USER MOD reduce.3.24.130724 H: found=0, std=0, add=934, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 932 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 117 MET CE :methyl -161:sc= -1.68! (180deg=-1.85!) USER MOD Set 1.2: A 119 SER OG : rot 88:sc= 0.14 USER MOD Set 2.1: A 88 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 91 ASN : amide:sc= -0.0893 K(o=-0.089,f=-1.4!) USER MOD Set 3.1: A 89 HIS : no HD1:sc= -2.12 X(o=-2.5,f=-2.6) USER MOD Set 3.2: A 90 GLN : amide:sc= -0.34 K(o=-2.5,f=-1.8) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= -0.0102 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= -0.224 USER MOD Single : A 13 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 HIS : no HD1:sc= -0.294 X(o=-0.29,f=0.057) USER MOD Single : A 33 LYS NZ :NH3+ -125:sc= 0 (180deg=-0.271) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= -1.58 K(o=-1.6,f=-10!) USER MOD Single : A 46 LYS NZ :NH3+ 142:sc= -0.323 (180deg=-0.716) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 MET CE :methyl 166:sc= -0.0445 (180deg=-0.293) USER MOD Single : A 52 SER OG : rot 30:sc= 0.0482 USER MOD Single : A 59 ASN : amide:sc= -4.26! C(o=-4.3!,f=-7.5!) USER MOD Single : A 70 MET CE :methyl 159:sc= -2.97! (180deg=-3.18!) USER MOD Single : A 80 ASN : amide:sc= -2.12 K(o=-2.1,f=-1.1) USER MOD Single : A 81 ASN : amide:sc= -0.703 K(o=-0.7,f=0.61) USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot -27:sc= 1.02 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 158:sc= -1.29 (180deg=-2.09!) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 ASN : amide:sc= -2.51 K(o=-2.5,f=-9.3!) USER MOD Single : A 115 ASN : amide:sc= -0.222 X(o=-0.22,f=0) USER MOD Single : A 116 GLN : amide:sc= 0 K(o=0,f=-0.8) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -6.120 -24.064 27.081 1.00 0.00 N ATOM 2 CA GLY A 1 -7.152 -23.241 26.477 1.00 0.00 C ATOM 3 C GLY A 1 -7.256 -23.447 24.979 1.00 0.00 C ATOM 4 O GLY A 1 -7.480 -24.564 24.513 1.00 0.00 O ATOM 0 H1 GLY A 1 -6.089 -23.886 28.105 1.00 0.00 H new ATOM 0 H2 GLY A 1 -6.332 -25.068 26.910 1.00 0.00 H new ATOM 0 H3 GLY A 1 -5.198 -23.829 26.661 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -8.112 -23.470 26.940 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -6.942 -22.191 26.682 1.00 0.00 H new ATOM 8 N SER A 2 -7.093 -22.366 24.222 1.00 0.00 N ATOM 9 CA SER A 2 -7.175 -22.433 22.768 1.00 0.00 C ATOM 10 C SER A 2 -6.180 -23.448 22.213 1.00 0.00 C ATOM 11 O SER A 2 -4.969 -23.231 22.251 1.00 0.00 O ATOM 12 CB SER A 2 -6.909 -21.055 22.157 1.00 0.00 C ATOM 13 OG SER A 2 -7.915 -20.129 22.530 1.00 0.00 O ATOM 0 H SER A 2 -6.904 -21.434 24.592 1.00 0.00 H new ATOM 0 HA SER A 2 -8.182 -22.754 22.500 1.00 0.00 H new ATOM 0 HB2 SER A 2 -5.935 -20.690 22.484 1.00 0.00 H new ATOM 0 HB3 SER A 2 -6.870 -21.137 21.071 1.00 0.00 H new ATOM 0 HG SER A 2 -7.721 -19.256 22.129 1.00 0.00 H new ATOM 19 N SER A 3 -6.701 -24.557 21.699 1.00 0.00 N ATOM 20 CA SER A 3 -5.859 -25.609 21.140 1.00 0.00 C ATOM 21 C SER A 3 -5.202 -25.147 19.843 1.00 0.00 C ATOM 22 O SER A 3 -5.883 -24.793 18.881 1.00 0.00 O ATOM 23 CB SER A 3 -6.685 -26.871 20.885 1.00 0.00 C ATOM 24 OG SER A 3 -5.853 -28.014 20.786 1.00 0.00 O ATOM 0 H SER A 3 -7.702 -24.751 21.658 1.00 0.00 H new ATOM 0 HA SER A 3 -5.076 -25.836 21.863 1.00 0.00 H new ATOM 0 HB2 SER A 3 -7.403 -27.009 21.693 1.00 0.00 H new ATOM 0 HB3 SER A 3 -7.259 -26.754 19.966 1.00 0.00 H new ATOM 0 HG SER A 3 -6.405 -28.807 20.625 1.00 0.00 H new ATOM 30 N GLY A 4 -3.873 -25.152 19.825 1.00 0.00 N ATOM 31 CA GLY A 4 -3.145 -24.732 18.642 1.00 0.00 C ATOM 32 C GLY A 4 -3.209 -23.233 18.424 1.00 0.00 C ATOM 33 O GLY A 4 -4.273 -22.627 18.544 1.00 0.00 O ATOM 0 H GLY A 4 -3.287 -25.440 20.609 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -2.103 -25.039 18.732 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -3.553 -25.241 17.768 1.00 0.00 H new ATOM 37 N SER A 5 -2.067 -22.634 18.104 1.00 0.00 N ATOM 38 CA SER A 5 -1.996 -21.196 17.874 1.00 0.00 C ATOM 39 C SER A 5 -2.664 -20.823 16.553 1.00 0.00 C ATOM 40 O SER A 5 -2.904 -21.681 15.703 1.00 0.00 O ATOM 41 CB SER A 5 -0.540 -20.729 17.871 1.00 0.00 C ATOM 42 OG SER A 5 -0.457 -19.314 17.877 1.00 0.00 O ATOM 0 H SER A 5 -1.178 -23.122 17.998 1.00 0.00 H new ATOM 0 HA SER A 5 -2.528 -20.698 18.684 1.00 0.00 H new ATOM 0 HB2 SER A 5 -0.025 -21.130 18.744 1.00 0.00 H new ATOM 0 HB3 SER A 5 -0.031 -21.122 16.991 1.00 0.00 H new ATOM 0 HG SER A 5 0.484 -19.042 17.877 1.00 0.00 H new ATOM 48 N SER A 6 -2.961 -19.538 16.389 1.00 0.00 N ATOM 49 CA SER A 6 -3.604 -19.051 15.174 1.00 0.00 C ATOM 50 C SER A 6 -2.566 -18.569 14.166 1.00 0.00 C ATOM 51 O SER A 6 -2.568 -18.987 13.008 1.00 0.00 O ATOM 52 CB SER A 6 -4.575 -17.916 15.506 1.00 0.00 C ATOM 53 OG SER A 6 -5.768 -18.418 16.083 1.00 0.00 O ATOM 0 H SER A 6 -2.767 -18.815 17.082 1.00 0.00 H new ATOM 0 HA SER A 6 -4.160 -19.877 14.730 1.00 0.00 H new ATOM 0 HB2 SER A 6 -4.100 -17.217 16.195 1.00 0.00 H new ATOM 0 HB3 SER A 6 -4.812 -17.359 14.599 1.00 0.00 H new ATOM 0 HG SER A 6 -6.371 -17.673 16.288 1.00 0.00 H new ATOM 59 N GLY A 7 -1.679 -17.686 14.615 1.00 0.00 N ATOM 60 CA GLY A 7 -0.647 -17.161 13.740 1.00 0.00 C ATOM 61 C GLY A 7 -0.430 -15.672 13.928 1.00 0.00 C ATOM 62 O GLY A 7 -1.114 -14.856 13.309 1.00 0.00 O ATOM 0 H GLY A 7 -1.657 -17.325 15.569 1.00 0.00 H new ATOM 0 HA2 GLY A 7 0.288 -17.688 13.929 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -0.920 -17.357 12.703 1.00 0.00 H new ATOM 66 N ASP A 8 0.521 -15.318 14.784 1.00 0.00 N ATOM 67 CA ASP A 8 0.826 -13.917 15.052 1.00 0.00 C ATOM 68 C ASP A 8 1.991 -13.440 14.191 1.00 0.00 C ATOM 69 O ASP A 8 2.836 -12.669 14.645 1.00 0.00 O ATOM 70 CB ASP A 8 1.155 -13.719 16.533 1.00 0.00 C ATOM 71 CG ASP A 8 0.260 -14.541 17.440 1.00 0.00 C ATOM 72 OD1 ASP A 8 -0.927 -14.723 17.096 1.00 0.00 O ATOM 73 OD2 ASP A 8 0.747 -15.002 18.493 1.00 0.00 O ATOM 0 H ASP A 8 1.095 -15.981 15.305 1.00 0.00 H new ATOM 0 HA ASP A 8 -0.054 -13.325 14.801 1.00 0.00 H new ATOM 0 HB2 ASP A 8 2.195 -13.991 16.711 1.00 0.00 H new ATOM 0 HB3 ASP A 8 1.054 -12.664 16.787 1.00 0.00 H new ATOM 78 N ALA A 9 2.029 -13.904 12.946 1.00 0.00 N ATOM 79 CA ALA A 9 3.089 -13.524 12.021 1.00 0.00 C ATOM 80 C ALA A 9 2.757 -12.215 11.313 1.00 0.00 C ATOM 81 O ALA A 9 3.562 -11.694 10.541 1.00 0.00 O ATOM 82 CB ALA A 9 3.325 -14.631 11.005 1.00 0.00 C ATOM 0 H ALA A 9 1.337 -14.544 12.555 1.00 0.00 H new ATOM 0 HA ALA A 9 4.002 -13.374 12.596 1.00 0.00 H new ATOM 0 HB1 ALA A 9 4.119 -14.333 10.321 1.00 0.00 H new ATOM 0 HB2 ALA A 9 3.616 -15.545 11.523 1.00 0.00 H new ATOM 0 HB3 ALA A 9 2.409 -14.809 10.442 1.00 0.00 H new ATOM 88 N PHE A 10 1.567 -11.688 11.581 1.00 0.00 N ATOM 89 CA PHE A 10 1.127 -10.440 10.968 1.00 0.00 C ATOM 90 C PHE A 10 1.189 -9.291 11.970 1.00 0.00 C ATOM 91 O PHE A 10 0.459 -8.306 11.849 1.00 0.00 O ATOM 92 CB PHE A 10 -0.297 -10.586 10.429 1.00 0.00 C ATOM 93 CG PHE A 10 -0.397 -11.494 9.237 1.00 0.00 C ATOM 94 CD1 PHE A 10 -0.419 -12.870 9.398 1.00 0.00 C ATOM 95 CD2 PHE A 10 -0.468 -10.972 7.955 1.00 0.00 C ATOM 96 CE1 PHE A 10 -0.511 -13.709 8.303 1.00 0.00 C ATOM 97 CE2 PHE A 10 -0.560 -11.806 6.857 1.00 0.00 C ATOM 98 CZ PHE A 10 -0.580 -13.176 7.031 1.00 0.00 C ATOM 0 H PHE A 10 0.890 -12.106 12.219 1.00 0.00 H new ATOM 0 HA PHE A 10 1.799 -10.214 10.140 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -0.940 -10.969 11.222 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -0.677 -9.601 10.158 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -0.364 -13.292 10.391 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -0.451 -9.902 7.813 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -0.529 -14.780 8.442 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -0.616 -11.387 5.863 1.00 0.00 H new ATOM 0 HZ PHE A 10 -0.649 -13.829 6.174 1.00 0.00 H new ATOM 108 N THR A 11 2.064 -9.424 12.961 1.00 0.00 N ATOM 109 CA THR A 11 2.221 -8.399 13.986 1.00 0.00 C ATOM 110 C THR A 11 3.223 -7.336 13.551 1.00 0.00 C ATOM 111 O THR A 11 4.253 -7.647 12.953 1.00 0.00 O ATOM 112 CB THR A 11 2.683 -9.007 15.323 1.00 0.00 C ATOM 113 OG1 THR A 11 3.993 -9.567 15.180 1.00 0.00 O ATOM 114 CG2 THR A 11 1.715 -10.083 15.791 1.00 0.00 C ATOM 0 H THR A 11 2.676 -10.232 13.076 1.00 0.00 H new ATOM 0 HA THR A 11 1.243 -7.938 14.124 1.00 0.00 H new ATOM 0 HB THR A 11 2.707 -8.213 16.069 1.00 0.00 H new ATOM 0 HG1 THR A 11 4.280 -9.950 16.035 1.00 0.00 H new ATOM 0 HG21 THR A 11 2.062 -10.498 16.737 1.00 0.00 H new ATOM 0 HG22 THR A 11 0.725 -9.648 15.927 1.00 0.00 H new ATOM 0 HG23 THR A 11 1.663 -10.876 15.044 1.00 0.00 H new ATOM 122 N ASP A 12 2.915 -6.080 13.855 1.00 0.00 N ATOM 123 CA ASP A 12 3.790 -4.970 13.497 1.00 0.00 C ATOM 124 C ASP A 12 5.255 -5.386 13.574 1.00 0.00 C ATOM 125 O ASP A 12 5.969 -5.365 12.572 1.00 0.00 O ATOM 126 CB ASP A 12 3.537 -3.775 14.418 1.00 0.00 C ATOM 127 CG ASP A 12 3.076 -4.197 15.800 1.00 0.00 C ATOM 128 OD1 ASP A 12 3.931 -4.614 16.608 1.00 0.00 O ATOM 129 OD2 ASP A 12 1.860 -4.111 16.072 1.00 0.00 O ATOM 0 H ASP A 12 2.066 -5.805 14.349 1.00 0.00 H new ATOM 0 HA ASP A 12 3.567 -4.681 12.470 1.00 0.00 H new ATOM 0 HB2 ASP A 12 4.451 -3.188 14.506 1.00 0.00 H new ATOM 0 HB3 ASP A 12 2.784 -3.127 13.969 1.00 0.00 H new ATOM 134 N GLN A 13 5.696 -5.763 14.770 1.00 0.00 N ATOM 135 CA GLN A 13 7.077 -6.183 14.978 1.00 0.00 C ATOM 136 C GLN A 13 7.533 -7.122 13.866 1.00 0.00 C ATOM 137 O GLN A 13 8.635 -6.982 13.334 1.00 0.00 O ATOM 138 CB GLN A 13 7.224 -6.872 16.335 1.00 0.00 C ATOM 139 CG GLN A 13 8.612 -7.442 16.581 1.00 0.00 C ATOM 140 CD GLN A 13 8.647 -8.410 17.747 1.00 0.00 C ATOM 141 OE1 GLN A 13 8.630 -8.001 18.909 1.00 0.00 O ATOM 142 NE2 GLN A 13 8.697 -9.701 17.443 1.00 0.00 N ATOM 0 H GLN A 13 5.117 -5.786 15.609 1.00 0.00 H new ATOM 0 HA GLN A 13 7.707 -5.294 14.960 1.00 0.00 H new ATOM 0 HB2 GLN A 13 6.989 -6.157 17.123 1.00 0.00 H new ATOM 0 HB3 GLN A 13 6.492 -7.677 16.406 1.00 0.00 H new ATOM 0 HG2 GLN A 13 8.956 -7.951 15.681 1.00 0.00 H new ATOM 0 HG3 GLN A 13 9.308 -6.625 16.771 1.00 0.00 H new ATOM 0 HE21 GLN A 13 8.709 -9.995 16.466 1.00 0.00 H new ATOM 0 HE22 GLN A 13 8.723 -10.399 18.186 1.00 0.00 H new ATOM 151 N LYS A 14 6.680 -8.079 13.519 1.00 0.00 N ATOM 152 CA LYS A 14 6.994 -9.042 12.470 1.00 0.00 C ATOM 153 C LYS A 14 6.976 -8.376 11.097 1.00 0.00 C ATOM 154 O LYS A 14 7.794 -8.692 10.233 1.00 0.00 O ATOM 155 CB LYS A 14 5.998 -10.202 12.498 1.00 0.00 C ATOM 156 CG LYS A 14 6.123 -11.081 13.731 1.00 0.00 C ATOM 157 CD LYS A 14 7.037 -12.269 13.478 1.00 0.00 C ATOM 158 CE LYS A 14 8.462 -11.980 13.924 1.00 0.00 C ATOM 159 NZ LYS A 14 9.435 -12.932 13.322 1.00 0.00 N ATOM 0 H LYS A 14 5.764 -8.209 13.949 1.00 0.00 H new ATOM 0 HA LYS A 14 7.996 -9.428 12.655 1.00 0.00 H new ATOM 0 HB2 LYS A 14 4.985 -9.802 12.448 1.00 0.00 H new ATOM 0 HB3 LYS A 14 6.142 -10.815 11.609 1.00 0.00 H new ATOM 0 HG2 LYS A 14 6.512 -10.492 14.561 1.00 0.00 H new ATOM 0 HG3 LYS A 14 5.136 -11.436 14.027 1.00 0.00 H new ATOM 0 HD2 LYS A 14 6.658 -13.141 14.010 1.00 0.00 H new ATOM 0 HD3 LYS A 14 7.030 -12.516 12.416 1.00 0.00 H new ATOM 0 HE2 LYS A 14 8.730 -10.961 13.645 1.00 0.00 H new ATOM 0 HE3 LYS A 14 8.521 -12.039 15.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 10.395 -12.702 13.650 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 9.194 -13.902 13.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 9.397 -12.858 12.285 1.00 0.00 H new ATOM 173 N ILE A 15 6.040 -7.452 10.906 1.00 0.00 N ATOM 174 CA ILE A 15 5.918 -6.741 9.639 1.00 0.00 C ATOM 175 C ILE A 15 7.174 -5.929 9.342 1.00 0.00 C ATOM 176 O ILE A 15 7.780 -6.070 8.279 1.00 0.00 O ATOM 177 CB ILE A 15 4.700 -5.799 9.638 1.00 0.00 C ATOM 178 CG1 ILE A 15 3.402 -6.608 9.692 1.00 0.00 C ATOM 179 CG2 ILE A 15 4.723 -4.905 8.407 1.00 0.00 C ATOM 180 CD1 ILE A 15 2.171 -5.761 9.928 1.00 0.00 C ATOM 0 H ILE A 15 5.356 -7.179 11.611 1.00 0.00 H new ATOM 0 HA ILE A 15 5.784 -7.496 8.864 1.00 0.00 H new ATOM 0 HB ILE A 15 4.748 -5.166 10.524 1.00 0.00 H new ATOM 0 HG12 ILE A 15 3.284 -7.153 8.755 1.00 0.00 H new ATOM 0 HG13 ILE A 15 3.479 -7.351 10.486 1.00 0.00 H new ATOM 0 HG21 ILE A 15 3.856 -4.245 8.421 1.00 0.00 H new ATOM 0 HG22 ILE A 15 5.634 -4.307 8.409 1.00 0.00 H new ATOM 0 HG23 ILE A 15 4.695 -5.522 7.509 1.00 0.00 H new ATOM 0 HD11 ILE A 15 1.289 -6.401 9.954 1.00 0.00 H new ATOM 0 HD12 ILE A 15 2.267 -5.236 10.878 1.00 0.00 H new ATOM 0 HD13 ILE A 15 2.069 -5.035 9.121 1.00 0.00 H new ATOM 192 N ARG A 16 7.562 -5.080 10.288 1.00 0.00 N ATOM 193 CA ARG A 16 8.746 -4.245 10.128 1.00 0.00 C ATOM 194 C ARG A 16 9.992 -5.103 9.928 1.00 0.00 C ATOM 195 O ARG A 16 10.848 -4.789 9.101 1.00 0.00 O ATOM 196 CB ARG A 16 8.928 -3.340 11.347 1.00 0.00 C ATOM 197 CG ARG A 16 9.103 -4.102 12.651 1.00 0.00 C ATOM 198 CD ARG A 16 9.104 -3.165 13.848 1.00 0.00 C ATOM 199 NE ARG A 16 9.748 -3.765 15.013 1.00 0.00 N ATOM 200 CZ ARG A 16 9.587 -3.319 16.254 1.00 0.00 C ATOM 201 NH1 ARG A 16 8.805 -2.274 16.490 1.00 0.00 N ATOM 202 NH2 ARG A 16 10.207 -3.919 17.262 1.00 0.00 N ATOM 0 H ARG A 16 7.073 -4.952 11.174 1.00 0.00 H new ATOM 0 HA ARG A 16 8.605 -3.625 9.243 1.00 0.00 H new ATOM 0 HB2 ARG A 16 9.798 -2.703 11.189 1.00 0.00 H new ATOM 0 HB3 ARG A 16 8.063 -2.683 11.433 1.00 0.00 H new ATOM 0 HG2 ARG A 16 8.299 -4.830 12.759 1.00 0.00 H new ATOM 0 HG3 ARG A 16 10.038 -4.661 12.624 1.00 0.00 H new ATOM 0 HD2 ARG A 16 9.619 -2.241 13.585 1.00 0.00 H new ATOM 0 HD3 ARG A 16 8.078 -2.897 14.099 1.00 0.00 H new ATOM 0 HE ARG A 16 10.355 -4.571 14.866 1.00 0.00 H new ATOM 0 HH11 ARG A 16 8.326 -1.811 15.718 1.00 0.00 H new ATOM 0 HH12 ARG A 16 8.683 -1.933 17.444 1.00 0.00 H new ATOM 0 HH21 ARG A 16 10.808 -4.724 17.085 1.00 0.00 H new ATOM 0 HH22 ARG A 16 10.083 -3.576 18.214 1.00 0.00 H new ATOM 216 N GLN A 17 10.087 -6.187 10.692 1.00 0.00 N ATOM 217 CA GLN A 17 11.229 -7.089 10.599 1.00 0.00 C ATOM 218 C GLN A 17 11.172 -7.910 9.315 1.00 0.00 C ATOM 219 O GLN A 17 12.205 -8.272 8.752 1.00 0.00 O ATOM 220 CB GLN A 17 11.270 -8.020 11.812 1.00 0.00 C ATOM 221 CG GLN A 17 12.072 -7.466 12.978 1.00 0.00 C ATOM 222 CD GLN A 17 12.659 -8.555 13.853 1.00 0.00 C ATOM 223 OE1 GLN A 17 12.091 -8.911 14.887 1.00 0.00 O ATOM 224 NE2 GLN A 17 13.802 -9.093 13.444 1.00 0.00 N ATOM 0 H GLN A 17 9.387 -6.462 11.382 1.00 0.00 H new ATOM 0 HA GLN A 17 12.136 -6.485 10.582 1.00 0.00 H new ATOM 0 HB2 GLN A 17 10.250 -8.216 12.144 1.00 0.00 H new ATOM 0 HB3 GLN A 17 11.696 -8.977 11.511 1.00 0.00 H new ATOM 0 HG2 GLN A 17 12.878 -6.840 12.595 1.00 0.00 H new ATOM 0 HG3 GLN A 17 11.431 -6.825 13.583 1.00 0.00 H new ATOM 0 HE21 GLN A 17 14.239 -8.768 12.581 1.00 0.00 H new ATOM 0 HE22 GLN A 17 14.243 -9.831 13.993 1.00 0.00 H new ATOM 233 N ARG A 18 9.958 -8.199 8.857 1.00 0.00 N ATOM 234 CA ARG A 18 9.767 -8.979 7.640 1.00 0.00 C ATOM 235 C ARG A 18 10.199 -8.183 6.412 1.00 0.00 C ATOM 236 O ARG A 18 10.807 -8.728 5.490 1.00 0.00 O ATOM 237 CB ARG A 18 8.301 -9.396 7.501 1.00 0.00 C ATOM 238 CG ARG A 18 7.968 -10.010 6.152 1.00 0.00 C ATOM 239 CD ARG A 18 6.729 -10.887 6.230 1.00 0.00 C ATOM 240 NE ARG A 18 6.940 -12.059 7.076 1.00 0.00 N ATOM 241 CZ ARG A 18 7.676 -13.104 6.715 1.00 0.00 C ATOM 242 NH1 ARG A 18 8.268 -13.123 5.529 1.00 0.00 N ATOM 243 NH2 ARG A 18 7.821 -14.132 7.541 1.00 0.00 N ATOM 0 H ARG A 18 9.093 -7.905 9.310 1.00 0.00 H new ATOM 0 HA ARG A 18 10.387 -9.873 7.709 1.00 0.00 H new ATOM 0 HB2 ARG A 18 8.060 -10.112 8.286 1.00 0.00 H new ATOM 0 HB3 ARG A 18 7.667 -8.524 7.660 1.00 0.00 H new ATOM 0 HG2 ARG A 18 7.809 -9.218 5.420 1.00 0.00 H new ATOM 0 HG3 ARG A 18 8.813 -10.603 5.802 1.00 0.00 H new ATOM 0 HD2 ARG A 18 5.896 -10.303 6.621 1.00 0.00 H new ATOM 0 HD3 ARG A 18 6.449 -11.210 5.227 1.00 0.00 H new ATOM 0 HE ARG A 18 6.498 -12.076 7.995 1.00 0.00 H new ATOM 0 HH11 ARG A 18 8.159 -12.334 4.892 1.00 0.00 H new ATOM 0 HH12 ARG A 18 8.833 -13.927 5.254 1.00 0.00 H new ATOM 0 HH21 ARG A 18 7.367 -14.120 8.454 1.00 0.00 H new ATOM 0 HH22 ARG A 18 8.386 -14.934 7.263 1.00 0.00 H new ATOM 257 N TYR A 19 9.881 -6.894 6.407 1.00 0.00 N ATOM 258 CA TYR A 19 10.234 -6.024 5.291 1.00 0.00 C ATOM 259 C TYR A 19 11.352 -5.063 5.681 1.00 0.00 C ATOM 260 O TYR A 19 11.618 -4.086 4.982 1.00 0.00 O ATOM 261 CB TYR A 19 9.008 -5.236 4.824 1.00 0.00 C ATOM 262 CG TYR A 19 7.890 -6.109 4.301 1.00 0.00 C ATOM 263 CD1 TYR A 19 8.007 -6.766 3.082 1.00 0.00 C ATOM 264 CD2 TYR A 19 6.717 -6.278 5.026 1.00 0.00 C ATOM 265 CE1 TYR A 19 6.987 -7.564 2.600 1.00 0.00 C ATOM 266 CE2 TYR A 19 5.693 -7.075 4.553 1.00 0.00 C ATOM 267 CZ TYR A 19 5.833 -7.715 3.339 1.00 0.00 C ATOM 268 OH TYR A 19 4.815 -8.510 2.863 1.00 0.00 O ATOM 0 H TYR A 19 9.379 -6.428 7.163 1.00 0.00 H new ATOM 0 HA TYR A 19 10.588 -6.651 4.473 1.00 0.00 H new ATOM 0 HB2 TYR A 19 8.633 -4.638 5.655 1.00 0.00 H new ATOM 0 HB3 TYR A 19 9.310 -4.540 4.042 1.00 0.00 H new ATOM 0 HD1 TYR A 19 8.910 -6.651 2.502 1.00 0.00 H new ATOM 0 HD2 TYR A 19 6.604 -5.777 5.976 1.00 0.00 H new ATOM 0 HE1 TYR A 19 7.093 -8.066 1.650 1.00 0.00 H new ATOM 0 HE2 TYR A 19 4.788 -7.196 5.130 1.00 0.00 H new ATOM 0 HH TYR A 19 4.074 -8.511 3.504 1.00 0.00 H new ATOM 278 N ALA A 20 12.004 -5.349 6.804 1.00 0.00 N ATOM 279 CA ALA A 20 13.095 -4.512 7.287 1.00 0.00 C ATOM 280 C ALA A 20 14.272 -4.531 6.318 1.00 0.00 C ATOM 281 O ALA A 20 15.136 -3.654 6.358 1.00 0.00 O ATOM 282 CB ALA A 20 13.540 -4.971 8.668 1.00 0.00 C ATOM 0 H ALA A 20 11.795 -6.153 7.395 1.00 0.00 H new ATOM 0 HA ALA A 20 12.731 -3.487 7.356 1.00 0.00 H new ATOM 0 HB1 ALA A 20 14.355 -4.337 9.017 1.00 0.00 H new ATOM 0 HB2 ALA A 20 12.703 -4.900 9.362 1.00 0.00 H new ATOM 0 HB3 ALA A 20 13.881 -6.005 8.615 1.00 0.00 H new ATOM 288 N ASP A 21 14.301 -5.535 5.448 1.00 0.00 N ATOM 289 CA ASP A 21 15.372 -5.667 4.468 1.00 0.00 C ATOM 290 C ASP A 21 15.220 -4.635 3.354 1.00 0.00 C ATOM 291 O ASP A 21 16.206 -4.200 2.758 1.00 0.00 O ATOM 292 CB ASP A 21 15.379 -7.077 3.875 1.00 0.00 C ATOM 293 CG ASP A 21 14.277 -7.282 2.854 1.00 0.00 C ATOM 294 OD1 ASP A 21 14.348 -6.663 1.772 1.00 0.00 O ATOM 295 OD2 ASP A 21 13.343 -8.061 3.138 1.00 0.00 O ATOM 0 H ASP A 21 13.595 -6.269 5.402 1.00 0.00 H new ATOM 0 HA ASP A 21 16.320 -5.490 4.977 1.00 0.00 H new ATOM 0 HB2 ASP A 21 16.345 -7.266 3.406 1.00 0.00 H new ATOM 0 HB3 ASP A 21 15.267 -7.806 4.678 1.00 0.00 H new ATOM 300 N LEU A 22 13.980 -4.248 3.079 1.00 0.00 N ATOM 301 CA LEU A 22 13.698 -3.267 2.036 1.00 0.00 C ATOM 302 C LEU A 22 14.535 -2.007 2.233 1.00 0.00 C ATOM 303 O LEU A 22 14.911 -1.651 3.350 1.00 0.00 O ATOM 304 CB LEU A 22 12.211 -2.910 2.033 1.00 0.00 C ATOM 305 CG LEU A 22 11.238 -4.086 1.940 1.00 0.00 C ATOM 306 CD1 LEU A 22 9.823 -3.590 1.688 1.00 0.00 C ATOM 307 CD2 LEU A 22 11.670 -5.050 0.844 1.00 0.00 C ATOM 0 H LEU A 22 13.153 -4.598 3.563 1.00 0.00 H new ATOM 0 HA LEU A 22 13.961 -3.709 1.075 1.00 0.00 H new ATOM 0 HB2 LEU A 22 11.990 -2.353 2.943 1.00 0.00 H new ATOM 0 HB3 LEU A 22 12.021 -2.240 1.195 1.00 0.00 H new ATOM 0 HG LEU A 22 11.250 -4.619 2.891 1.00 0.00 H new ATOM 0 HD11 LEU A 22 9.145 -4.441 1.625 1.00 0.00 H new ATOM 0 HD12 LEU A 22 9.514 -2.940 2.507 1.00 0.00 H new ATOM 0 HD13 LEU A 22 9.794 -3.033 0.752 1.00 0.00 H new ATOM 0 HD21 LEU A 22 10.966 -5.881 0.792 1.00 0.00 H new ATOM 0 HD22 LEU A 22 11.687 -4.529 -0.113 1.00 0.00 H new ATOM 0 HD23 LEU A 22 12.666 -5.432 1.067 1.00 0.00 H new ATOM 319 N PRO A 23 14.832 -1.314 1.124 1.00 0.00 N ATOM 320 CA PRO A 23 15.625 -0.082 1.149 1.00 0.00 C ATOM 321 C PRO A 23 14.872 1.079 1.790 1.00 0.00 C ATOM 322 O PRO A 23 15.398 1.765 2.666 1.00 0.00 O ATOM 323 CB PRO A 23 15.885 0.203 -0.332 1.00 0.00 C ATOM 324 CG PRO A 23 14.759 -0.460 -1.049 1.00 0.00 C ATOM 325 CD PRO A 23 14.416 -1.681 -0.240 1.00 0.00 C ATOM 0 HA PRO A 23 16.533 -0.194 1.742 1.00 0.00 H new ATOM 0 HB2 PRO A 23 15.905 1.274 -0.531 1.00 0.00 H new ATOM 0 HB3 PRO A 23 16.847 -0.198 -0.649 1.00 0.00 H new ATOM 0 HG2 PRO A 23 13.901 0.208 -1.131 1.00 0.00 H new ATOM 0 HG3 PRO A 23 15.049 -0.733 -2.064 1.00 0.00 H new ATOM 0 HD2 PRO A 23 13.351 -1.909 -0.288 1.00 0.00 H new ATOM 0 HD3 PRO A 23 14.947 -2.563 -0.599 1.00 0.00 H new ATOM 333 N GLY A 24 13.636 1.293 1.348 1.00 0.00 N ATOM 334 CA GLY A 24 12.831 2.372 1.891 1.00 0.00 C ATOM 335 C GLY A 24 12.475 2.153 3.348 1.00 0.00 C ATOM 336 O GLY A 24 12.901 1.172 3.957 1.00 0.00 O ATOM 0 H GLY A 24 13.178 0.739 0.624 1.00 0.00 H new ATOM 0 HA2 GLY A 24 13.373 3.312 1.790 1.00 0.00 H new ATOM 0 HA3 GLY A 24 11.916 2.468 1.307 1.00 0.00 H new ATOM 340 N GLU A 25 11.694 3.071 3.909 1.00 0.00 N ATOM 341 CA GLU A 25 11.284 2.974 5.305 1.00 0.00 C ATOM 342 C GLU A 25 9.807 2.605 5.414 1.00 0.00 C ATOM 343 O GLU A 25 8.943 3.281 4.854 1.00 0.00 O ATOM 344 CB GLU A 25 11.545 4.297 6.029 1.00 0.00 C ATOM 345 CG GLU A 25 11.757 4.140 7.526 1.00 0.00 C ATOM 346 CD GLU A 25 13.188 3.782 7.878 1.00 0.00 C ATOM 347 OE1 GLU A 25 14.108 4.288 7.202 1.00 0.00 O ATOM 348 OE2 GLU A 25 13.387 2.998 8.829 1.00 0.00 O ATOM 0 H GLU A 25 11.333 3.889 3.419 1.00 0.00 H new ATOM 0 HA GLU A 25 11.873 2.187 5.776 1.00 0.00 H new ATOM 0 HB2 GLU A 25 12.424 4.772 5.594 1.00 0.00 H new ATOM 0 HB3 GLU A 25 10.703 4.967 5.858 1.00 0.00 H new ATOM 0 HG2 GLU A 25 11.485 5.069 8.027 1.00 0.00 H new ATOM 0 HG3 GLU A 25 11.089 3.366 7.905 1.00 0.00 H new ATOM 355 N LEU A 26 9.525 1.527 6.138 1.00 0.00 N ATOM 356 CA LEU A 26 8.153 1.066 6.321 1.00 0.00 C ATOM 357 C LEU A 26 7.318 2.115 7.047 1.00 0.00 C ATOM 358 O LEU A 26 7.720 2.629 8.092 1.00 0.00 O ATOM 359 CB LEU A 26 8.136 -0.248 7.104 1.00 0.00 C ATOM 360 CG LEU A 26 6.919 -1.147 6.882 1.00 0.00 C ATOM 361 CD1 LEU A 26 7.027 -1.871 5.549 1.00 0.00 C ATOM 362 CD2 LEU A 26 6.777 -2.144 8.022 1.00 0.00 C ATOM 0 H LEU A 26 10.228 0.956 6.608 1.00 0.00 H new ATOM 0 HA LEU A 26 7.717 0.900 5.336 1.00 0.00 H new ATOM 0 HB2 LEU A 26 9.032 -0.813 6.846 1.00 0.00 H new ATOM 0 HB3 LEU A 26 8.201 -0.015 8.167 1.00 0.00 H new ATOM 0 HG LEU A 26 6.027 -0.520 6.861 1.00 0.00 H new ATOM 0 HD11 LEU A 26 6.152 -2.506 5.408 1.00 0.00 H new ATOM 0 HD12 LEU A 26 7.079 -1.141 4.741 1.00 0.00 H new ATOM 0 HD13 LEU A 26 7.927 -2.486 5.541 1.00 0.00 H new ATOM 0 HD21 LEU A 26 5.906 -2.775 7.847 1.00 0.00 H new ATOM 0 HD22 LEU A 26 7.671 -2.766 8.075 1.00 0.00 H new ATOM 0 HD23 LEU A 26 6.653 -1.606 8.962 1.00 0.00 H new ATOM 374 N HIS A 27 6.153 2.427 6.489 1.00 0.00 N ATOM 375 CA HIS A 27 5.259 3.413 7.086 1.00 0.00 C ATOM 376 C HIS A 27 3.836 2.872 7.176 1.00 0.00 C ATOM 377 O HIS A 27 3.102 2.862 6.188 1.00 0.00 O ATOM 378 CB HIS A 27 5.275 4.706 6.270 1.00 0.00 C ATOM 379 CG HIS A 27 6.343 5.668 6.691 1.00 0.00 C ATOM 380 ND1 HIS A 27 6.153 6.623 7.667 1.00 0.00 N ATOM 381 CD2 HIS A 27 7.619 5.817 6.265 1.00 0.00 C ATOM 382 CE1 HIS A 27 7.265 7.320 7.822 1.00 0.00 C ATOM 383 NE2 HIS A 27 8.170 6.850 6.982 1.00 0.00 N ATOM 0 H HIS A 27 5.806 2.012 5.625 1.00 0.00 H new ATOM 0 HA HIS A 27 5.613 3.624 8.095 1.00 0.00 H new ATOM 0 HB2 HIS A 27 5.414 4.460 5.217 1.00 0.00 H new ATOM 0 HB3 HIS A 27 4.304 5.193 6.358 1.00 0.00 H new ATOM 0 HD2 HIS A 27 8.112 5.232 5.503 1.00 0.00 H new ATOM 0 HE1 HIS A 27 7.409 8.134 8.516 1.00 0.00 H new ATOM 0 HE2 HIS A 27 9.124 7.198 6.882 1.00 0.00 H new ATOM 392 N ILE A 28 3.453 2.423 8.367 1.00 0.00 N ATOM 393 CA ILE A 28 2.118 1.881 8.586 1.00 0.00 C ATOM 394 C ILE A 28 1.161 2.960 9.081 1.00 0.00 C ATOM 395 O ILE A 28 1.384 3.568 10.128 1.00 0.00 O ATOM 396 CB ILE A 28 2.140 0.724 9.602 1.00 0.00 C ATOM 397 CG1 ILE A 28 3.155 -0.338 9.177 1.00 0.00 C ATOM 398 CG2 ILE A 28 0.753 0.115 9.740 1.00 0.00 C ATOM 399 CD1 ILE A 28 3.530 -1.295 10.287 1.00 0.00 C ATOM 0 H ILE A 28 4.049 2.424 9.195 1.00 0.00 H new ATOM 0 HA ILE A 28 1.769 1.503 7.625 1.00 0.00 H new ATOM 0 HB ILE A 28 2.441 1.118 10.573 1.00 0.00 H new ATOM 0 HG12 ILE A 28 2.746 -0.906 8.342 1.00 0.00 H new ATOM 0 HG13 ILE A 28 4.056 0.157 8.815 1.00 0.00 H new ATOM 0 HG21 ILE A 28 0.784 -0.701 10.461 1.00 0.00 H new ATOM 0 HG22 ILE A 28 0.054 0.877 10.084 1.00 0.00 H new ATOM 0 HG23 ILE A 28 0.426 -0.267 8.773 1.00 0.00 H new ATOM 0 HD11 ILE A 28 4.253 -2.020 9.913 1.00 0.00 H new ATOM 0 HD12 ILE A 28 3.969 -0.738 11.115 1.00 0.00 H new ATOM 0 HD13 ILE A 28 2.638 -1.817 10.634 1.00 0.00 H new ATOM 411 N ILE A 29 0.095 3.191 8.322 1.00 0.00 N ATOM 412 CA ILE A 29 -0.898 4.194 8.685 1.00 0.00 C ATOM 413 C ILE A 29 -2.313 3.645 8.539 1.00 0.00 C ATOM 414 O ILE A 29 -2.601 2.882 7.618 1.00 0.00 O ATOM 415 CB ILE A 29 -0.759 5.462 7.821 1.00 0.00 C ATOM 416 CG1 ILE A 29 -1.125 5.157 6.367 1.00 0.00 C ATOM 417 CG2 ILE A 29 0.656 6.013 7.913 1.00 0.00 C ATOM 418 CD1 ILE A 29 -1.282 6.395 5.512 1.00 0.00 C ATOM 0 H ILE A 29 -0.103 2.697 7.452 1.00 0.00 H new ATOM 0 HA ILE A 29 -0.718 4.453 9.728 1.00 0.00 H new ATOM 0 HB ILE A 29 -1.447 6.218 8.198 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -0.354 4.520 5.933 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -2.056 4.590 6.346 1.00 0.00 H new ATOM 0 HG21 ILE A 29 0.738 6.909 7.297 1.00 0.00 H new ATOM 0 HG22 ILE A 29 0.882 6.263 8.949 1.00 0.00 H new ATOM 0 HG23 ILE A 29 1.362 5.263 7.558 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -1.541 6.104 4.494 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -2.073 7.023 5.922 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -0.345 6.952 5.502 1.00 0.00 H new ATOM 430 N GLU A 30 -3.193 4.042 9.453 1.00 0.00 N ATOM 431 CA GLU A 30 -4.579 3.590 9.424 1.00 0.00 C ATOM 432 C GLU A 30 -5.478 4.631 8.763 1.00 0.00 C ATOM 433 O GLU A 30 -5.674 5.725 9.293 1.00 0.00 O ATOM 434 CB GLU A 30 -5.074 3.301 10.843 1.00 0.00 C ATOM 435 CG GLU A 30 -4.812 1.876 11.301 1.00 0.00 C ATOM 436 CD GLU A 30 -4.638 1.769 12.804 1.00 0.00 C ATOM 437 OE1 GLU A 30 -5.414 2.415 13.538 1.00 0.00 O ATOM 438 OE2 GLU A 30 -3.725 1.040 13.245 1.00 0.00 O ATOM 0 H GLU A 30 -2.971 4.675 10.222 1.00 0.00 H new ATOM 0 HA GLU A 30 -4.622 2.673 8.837 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -4.590 3.991 11.535 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -6.145 3.498 10.892 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -5.640 1.240 10.989 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -3.916 1.499 10.807 1.00 0.00 H new ATOM 445 N LEU A 31 -6.020 4.283 7.601 1.00 0.00 N ATOM 446 CA LEU A 31 -6.897 5.186 6.865 1.00 0.00 C ATOM 447 C LEU A 31 -8.319 4.636 6.805 1.00 0.00 C ATOM 448 O LEU A 31 -8.551 3.547 6.283 1.00 0.00 O ATOM 449 CB LEU A 31 -6.363 5.406 5.448 1.00 0.00 C ATOM 450 CG LEU A 31 -4.874 5.733 5.336 1.00 0.00 C ATOM 451 CD1 LEU A 31 -4.432 5.715 3.881 1.00 0.00 C ATOM 452 CD2 LEU A 31 -4.575 7.084 5.969 1.00 0.00 C ATOM 0 H LEU A 31 -5.867 3.382 7.148 1.00 0.00 H new ATOM 0 HA LEU A 31 -6.918 6.140 7.391 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -6.563 4.509 4.863 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -6.928 6.218 4.990 1.00 0.00 H new ATOM 0 HG LEU A 31 -4.313 4.970 5.875 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -3.369 5.950 3.821 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -4.609 4.726 3.459 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -5.000 6.456 3.319 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -3.510 7.300 5.880 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -5.147 7.859 5.459 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -4.854 7.062 7.023 1.00 0.00 H new ATOM 464 N GLU A 32 -9.266 5.399 7.342 1.00 0.00 N ATOM 465 CA GLU A 32 -10.665 4.988 7.347 1.00 0.00 C ATOM 466 C GLU A 32 -11.308 5.228 5.985 1.00 0.00 C ATOM 467 O GLU A 32 -11.283 6.341 5.460 1.00 0.00 O ATOM 468 CB GLU A 32 -11.438 5.746 8.429 1.00 0.00 C ATOM 469 CG GLU A 32 -12.611 4.966 8.998 1.00 0.00 C ATOM 470 CD GLU A 32 -13.433 5.781 9.977 1.00 0.00 C ATOM 471 OE1 GLU A 32 -12.898 6.142 11.046 1.00 0.00 O ATOM 472 OE2 GLU A 32 -14.613 6.058 9.674 1.00 0.00 O ATOM 0 H GLU A 32 -9.090 6.304 7.779 1.00 0.00 H new ATOM 0 HA GLU A 32 -10.703 3.920 7.564 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -10.755 6.002 9.239 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -11.804 6.684 8.012 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -13.251 4.632 8.181 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -12.240 4.071 9.498 1.00 0.00 H new ATOM 479 N LYS A 33 -11.884 4.174 5.415 1.00 0.00 N ATOM 480 CA LYS A 33 -12.536 4.268 4.114 1.00 0.00 C ATOM 481 C LYS A 33 -13.534 5.421 4.087 1.00 0.00 C ATOM 482 O LYS A 33 -14.556 5.385 4.772 1.00 0.00 O ATOM 483 CB LYS A 33 -13.248 2.954 3.782 1.00 0.00 C ATOM 484 CG LYS A 33 -12.300 1.821 3.429 1.00 0.00 C ATOM 485 CD LYS A 33 -12.970 0.793 2.532 1.00 0.00 C ATOM 486 CE LYS A 33 -13.827 -0.173 3.336 1.00 0.00 C ATOM 487 NZ LYS A 33 -15.210 0.342 3.529 1.00 0.00 N ATOM 0 H LYS A 33 -11.912 3.245 5.834 1.00 0.00 H new ATOM 0 HA LYS A 33 -11.769 4.458 3.364 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -13.857 2.655 4.635 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -13.929 3.120 2.947 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -11.420 2.224 2.928 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -11.953 1.338 4.342 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -13.589 1.302 1.793 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -12.210 0.237 1.983 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -13.866 -1.135 2.826 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -13.365 -0.346 4.308 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -15.435 0.361 4.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -15.279 1.304 3.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -15.884 -0.279 3.037 1.00 0.00 H new ATOM 501 N ASP A 34 -13.232 6.440 3.291 1.00 0.00 N ATOM 502 CA ASP A 34 -14.104 7.603 3.172 1.00 0.00 C ATOM 503 C ASP A 34 -15.379 7.250 2.412 1.00 0.00 C ATOM 504 O ASP A 34 -15.533 6.132 1.921 1.00 0.00 O ATOM 505 CB ASP A 34 -13.373 8.746 2.466 1.00 0.00 C ATOM 506 CG ASP A 34 -14.041 10.087 2.692 1.00 0.00 C ATOM 507 OD1 ASP A 34 -14.314 10.425 3.863 1.00 0.00 O ATOM 508 OD2 ASP A 34 -14.291 10.801 1.698 1.00 0.00 O ATOM 0 H ASP A 34 -12.389 6.485 2.718 1.00 0.00 H new ATOM 0 HA ASP A 34 -14.379 7.925 4.176 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -12.344 8.791 2.823 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -13.330 8.540 1.396 1.00 0.00 H new ATOM 513 N LYS A 35 -16.291 8.212 2.319 1.00 0.00 N ATOM 514 CA LYS A 35 -17.553 8.005 1.619 1.00 0.00 C ATOM 515 C LYS A 35 -17.365 7.078 0.422 1.00 0.00 C ATOM 516 O LYS A 35 -18.250 6.290 0.091 1.00 0.00 O ATOM 517 CB LYS A 35 -18.129 9.344 1.155 1.00 0.00 C ATOM 518 CG LYS A 35 -19.480 9.222 0.473 1.00 0.00 C ATOM 519 CD LYS A 35 -20.554 8.759 1.443 1.00 0.00 C ATOM 520 CE LYS A 35 -21.886 8.544 0.739 1.00 0.00 C ATOM 521 NZ LYS A 35 -21.952 7.214 0.073 1.00 0.00 N ATOM 0 H LYS A 35 -16.179 9.143 2.720 1.00 0.00 H new ATOM 0 HA LYS A 35 -18.252 7.537 2.313 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -18.224 10.006 2.015 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -17.426 9.814 0.467 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -19.763 10.185 0.048 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -19.408 8.517 -0.355 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -20.239 7.831 1.920 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -20.675 9.499 2.234 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -22.697 8.629 1.462 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -22.036 9.329 -0.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -22.874 7.106 -0.395 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -21.194 7.142 -0.635 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -21.834 6.464 0.783 1.00 0.00 H new ATOM 535 N ASN A 36 -16.207 7.178 -0.222 1.00 0.00 N ATOM 536 CA ASN A 36 -15.904 6.348 -1.382 1.00 0.00 C ATOM 537 C ASN A 36 -14.904 5.253 -1.021 1.00 0.00 C ATOM 538 O ASN A 36 -14.927 4.164 -1.593 1.00 0.00 O ATOM 539 CB ASN A 36 -15.346 7.208 -2.519 1.00 0.00 C ATOM 540 CG ASN A 36 -14.812 6.373 -3.666 1.00 0.00 C ATOM 541 OD1 ASN A 36 -13.658 6.519 -4.070 1.00 0.00 O ATOM 542 ND2 ASN A 36 -15.651 5.491 -4.198 1.00 0.00 N ATOM 0 H ASN A 36 -15.463 7.825 0.040 1.00 0.00 H new ATOM 0 HA ASN A 36 -16.830 5.877 -1.712 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -16.129 7.870 -2.889 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -14.548 7.843 -2.133 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -15.347 4.901 -4.973 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -16.599 5.404 -3.832 1.00 0.00 H new ATOM 549 N GLY A 37 -14.028 5.551 -0.067 1.00 0.00 N ATOM 550 CA GLY A 37 -13.033 4.582 0.355 1.00 0.00 C ATOM 551 C GLY A 37 -11.617 5.104 0.211 1.00 0.00 C ATOM 552 O GLY A 37 -11.393 6.315 0.191 1.00 0.00 O ATOM 0 H GLY A 37 -13.989 6.446 0.421 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -13.213 4.311 1.395 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -13.143 3.672 -0.235 1.00 0.00 H new ATOM 556 N LEU A 38 -10.659 4.190 0.112 1.00 0.00 N ATOM 557 CA LEU A 38 -9.256 4.564 -0.030 1.00 0.00 C ATOM 558 C LEU A 38 -8.912 4.846 -1.489 1.00 0.00 C ATOM 559 O LEU A 38 -8.613 3.931 -2.255 1.00 0.00 O ATOM 560 CB LEU A 38 -8.354 3.454 0.513 1.00 0.00 C ATOM 561 CG LEU A 38 -8.735 2.889 1.882 1.00 0.00 C ATOM 562 CD1 LEU A 38 -7.772 1.785 2.290 1.00 0.00 C ATOM 563 CD2 LEU A 38 -8.756 3.994 2.928 1.00 0.00 C ATOM 0 H LEU A 38 -10.828 3.184 0.127 1.00 0.00 H new ATOM 0 HA LEU A 38 -9.089 5.474 0.546 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -8.346 2.635 -0.206 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -7.335 3.837 0.571 1.00 0.00 H new ATOM 0 HG LEU A 38 -9.736 2.463 1.812 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -8.059 1.395 3.267 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -7.806 0.982 1.554 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -6.760 2.186 2.342 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -9.029 3.574 3.896 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -7.768 4.450 2.996 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -9.486 4.751 2.642 1.00 0.00 H new ATOM 575 N GLY A 39 -8.956 6.121 -1.866 1.00 0.00 N ATOM 576 CA GLY A 39 -8.645 6.501 -3.232 1.00 0.00 C ATOM 577 C GLY A 39 -7.152 6.581 -3.486 1.00 0.00 C ATOM 578 O GLY A 39 -6.487 7.515 -3.035 1.00 0.00 O ATOM 0 H GLY A 39 -9.201 6.896 -1.250 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -9.089 5.778 -3.917 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -9.100 7.467 -3.450 1.00 0.00 H new ATOM 582 N LEU A 40 -6.623 5.599 -4.207 1.00 0.00 N ATOM 583 CA LEU A 40 -5.199 5.561 -4.520 1.00 0.00 C ATOM 584 C LEU A 40 -4.959 4.939 -5.892 1.00 0.00 C ATOM 585 O LEU A 40 -5.550 3.915 -6.232 1.00 0.00 O ATOM 586 CB LEU A 40 -4.443 4.770 -3.450 1.00 0.00 C ATOM 587 CG LEU A 40 -4.437 5.377 -2.046 1.00 0.00 C ATOM 588 CD1 LEU A 40 -4.124 4.312 -1.006 1.00 0.00 C ATOM 589 CD2 LEU A 40 -3.434 6.518 -1.963 1.00 0.00 C ATOM 0 H LEU A 40 -7.159 4.818 -4.586 1.00 0.00 H new ATOM 0 HA LEU A 40 -4.828 6.586 -4.536 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -4.876 3.772 -3.391 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -3.410 4.650 -3.777 1.00 0.00 H new ATOM 0 HG LEU A 40 -5.430 5.777 -1.839 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -4.124 4.762 -0.013 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -4.880 3.528 -1.049 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -3.143 3.882 -1.209 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -3.443 6.938 -0.957 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -2.436 6.143 -2.190 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -3.703 7.292 -2.682 1.00 0.00 H new ATOM 601 N SER A 41 -4.086 5.566 -6.675 1.00 0.00 N ATOM 602 CA SER A 41 -3.768 5.075 -8.011 1.00 0.00 C ATOM 603 C SER A 41 -2.639 4.050 -7.959 1.00 0.00 C ATOM 604 O SER A 41 -1.565 4.320 -7.421 1.00 0.00 O ATOM 605 CB SER A 41 -3.375 6.238 -8.924 1.00 0.00 C ATOM 606 OG SER A 41 -4.505 7.022 -9.266 1.00 0.00 O ATOM 0 H SER A 41 -3.587 6.414 -6.407 1.00 0.00 H new ATOM 0 HA SER A 41 -4.657 4.590 -8.414 1.00 0.00 H new ATOM 0 HB2 SER A 41 -2.633 6.862 -8.425 1.00 0.00 H new ATOM 0 HB3 SER A 41 -2.909 5.852 -9.830 1.00 0.00 H new ATOM 0 HG SER A 41 -4.227 7.760 -9.848 1.00 0.00 H new ATOM 612 N LEU A 42 -2.891 2.874 -8.522 1.00 0.00 N ATOM 613 CA LEU A 42 -1.897 1.806 -8.541 1.00 0.00 C ATOM 614 C LEU A 42 -1.415 1.536 -9.963 1.00 0.00 C ATOM 615 O LEU A 42 -2.172 1.680 -10.923 1.00 0.00 O ATOM 616 CB LEU A 42 -2.480 0.528 -7.937 1.00 0.00 C ATOM 617 CG LEU A 42 -3.260 0.698 -6.632 1.00 0.00 C ATOM 618 CD1 LEU A 42 -3.844 -0.632 -6.183 1.00 0.00 C ATOM 619 CD2 LEU A 42 -2.366 1.283 -5.549 1.00 0.00 C ATOM 0 H LEU A 42 -3.775 2.635 -8.972 1.00 0.00 H new ATOM 0 HA LEU A 42 -1.044 2.127 -7.942 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -3.139 0.069 -8.674 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -1.663 -0.172 -7.760 1.00 0.00 H new ATOM 0 HG LEU A 42 -4.082 1.391 -6.810 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -4.395 -0.492 -5.253 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -4.518 -1.011 -6.951 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -3.038 -1.348 -6.022 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -2.937 1.397 -4.628 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -1.523 0.615 -5.373 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -1.996 2.257 -5.869 1.00 0.00 H new ATOM 631 N ALA A 43 -0.152 1.142 -10.090 1.00 0.00 N ATOM 632 CA ALA A 43 0.429 0.847 -11.394 1.00 0.00 C ATOM 633 C ALA A 43 1.544 -0.186 -11.277 1.00 0.00 C ATOM 634 O ALA A 43 2.407 -0.086 -10.405 1.00 0.00 O ATOM 635 CB ALA A 43 0.952 2.122 -12.039 1.00 0.00 C ATOM 0 H ALA A 43 0.488 1.020 -9.306 1.00 0.00 H new ATOM 0 HA ALA A 43 -0.353 0.428 -12.027 1.00 0.00 H new ATOM 0 HB1 ALA A 43 1.383 1.887 -13.012 1.00 0.00 H new ATOM 0 HB2 ALA A 43 0.132 2.828 -12.167 1.00 0.00 H new ATOM 0 HB3 ALA A 43 1.716 2.565 -11.401 1.00 0.00 H new ATOM 641 N GLY A 44 1.520 -1.179 -12.161 1.00 0.00 N ATOM 642 CA GLY A 44 2.535 -2.216 -12.138 1.00 0.00 C ATOM 643 C GLY A 44 3.925 -1.674 -12.406 1.00 0.00 C ATOM 644 O GLY A 44 4.080 -0.624 -13.028 1.00 0.00 O ATOM 0 H GLY A 44 0.816 -1.284 -12.892 1.00 0.00 H new ATOM 0 HA2 GLY A 44 2.522 -2.711 -11.167 1.00 0.00 H new ATOM 0 HA3 GLY A 44 2.294 -2.973 -12.884 1.00 0.00 H new ATOM 648 N ASN A 45 4.939 -2.391 -11.932 1.00 0.00 N ATOM 649 CA ASN A 45 6.324 -1.974 -12.122 1.00 0.00 C ATOM 650 C ASN A 45 6.687 -1.950 -13.603 1.00 0.00 C ATOM 651 O ASN A 45 6.256 -2.808 -14.374 1.00 0.00 O ATOM 652 CB ASN A 45 7.269 -2.913 -11.369 1.00 0.00 C ATOM 653 CG ASN A 45 8.718 -2.480 -11.473 1.00 0.00 C ATOM 654 OD1 ASN A 45 9.224 -2.224 -12.565 1.00 0.00 O ATOM 655 ND2 ASN A 45 9.394 -2.397 -10.333 1.00 0.00 N ATOM 0 H ASN A 45 4.828 -3.263 -11.414 1.00 0.00 H new ATOM 0 HA ASN A 45 6.431 -0.965 -11.724 1.00 0.00 H new ATOM 0 HB2 ASN A 45 6.978 -2.951 -10.319 1.00 0.00 H new ATOM 0 HB3 ASN A 45 7.165 -3.923 -11.765 1.00 0.00 H new ATOM 0 HD21 ASN A 45 10.373 -2.111 -10.340 1.00 0.00 H new ATOM 0 HD22 ASN A 45 8.934 -2.619 -9.450 1.00 0.00 H new ATOM 662 N LYS A 46 7.482 -0.960 -13.996 1.00 0.00 N ATOM 663 CA LYS A 46 7.906 -0.824 -15.384 1.00 0.00 C ATOM 664 C LYS A 46 8.090 -2.191 -16.034 1.00 0.00 C ATOM 665 O LYS A 46 7.549 -2.456 -17.108 1.00 0.00 O ATOM 666 CB LYS A 46 9.212 -0.029 -15.464 1.00 0.00 C ATOM 667 CG LYS A 46 9.042 1.451 -15.169 1.00 0.00 C ATOM 668 CD LYS A 46 10.346 2.081 -14.708 1.00 0.00 C ATOM 669 CE LYS A 46 10.309 3.596 -14.835 1.00 0.00 C ATOM 670 NZ LYS A 46 9.094 4.176 -14.199 1.00 0.00 N ATOM 0 H LYS A 46 7.846 -0.240 -13.372 1.00 0.00 H new ATOM 0 HA LYS A 46 7.127 -0.287 -15.925 1.00 0.00 H new ATOM 0 HB2 LYS A 46 9.928 -0.451 -14.759 1.00 0.00 H new ATOM 0 HB3 LYS A 46 9.638 -0.146 -16.460 1.00 0.00 H new ATOM 0 HG2 LYS A 46 8.686 1.963 -16.063 1.00 0.00 H new ATOM 0 HG3 LYS A 46 8.281 1.585 -14.401 1.00 0.00 H new ATOM 0 HD2 LYS A 46 10.537 1.806 -13.671 1.00 0.00 H new ATOM 0 HD3 LYS A 46 11.172 1.685 -15.300 1.00 0.00 H new ATOM 0 HE2 LYS A 46 11.199 4.021 -14.372 1.00 0.00 H new ATOM 0 HE3 LYS A 46 10.335 3.873 -15.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 9.341 5.071 -13.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 8.373 4.354 -14.927 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 8.718 3.509 -13.495 1.00 0.00 H new ATOM 684 N ASP A 47 8.855 -3.056 -15.376 1.00 0.00 N ATOM 685 CA ASP A 47 9.108 -4.397 -15.889 1.00 0.00 C ATOM 686 C ASP A 47 8.010 -5.362 -15.451 1.00 0.00 C ATOM 687 O ASP A 47 7.927 -5.733 -14.280 1.00 0.00 O ATOM 688 CB ASP A 47 10.469 -4.902 -15.409 1.00 0.00 C ATOM 689 CG ASP A 47 11.111 -5.860 -16.393 1.00 0.00 C ATOM 690 OD1 ASP A 47 10.421 -6.797 -16.844 1.00 0.00 O ATOM 691 OD2 ASP A 47 12.305 -5.674 -16.710 1.00 0.00 O ATOM 0 H ASP A 47 9.310 -2.852 -14.486 1.00 0.00 H new ATOM 0 HA ASP A 47 9.111 -4.348 -16.978 1.00 0.00 H new ATOM 0 HB2 ASP A 47 11.132 -4.052 -15.248 1.00 0.00 H new ATOM 0 HB3 ASP A 47 10.350 -5.400 -14.447 1.00 0.00 H new ATOM 696 N ARG A 48 7.170 -5.765 -16.399 1.00 0.00 N ATOM 697 CA ARG A 48 6.077 -6.685 -16.110 1.00 0.00 C ATOM 698 C ARG A 48 6.551 -7.832 -15.223 1.00 0.00 C ATOM 699 O ARG A 48 5.968 -8.101 -14.173 1.00 0.00 O ATOM 700 CB ARG A 48 5.491 -7.239 -17.410 1.00 0.00 C ATOM 701 CG ARG A 48 4.163 -7.953 -17.224 1.00 0.00 C ATOM 702 CD ARG A 48 3.750 -8.699 -18.483 1.00 0.00 C ATOM 703 NE ARG A 48 2.379 -9.195 -18.401 1.00 0.00 N ATOM 704 CZ ARG A 48 1.629 -9.463 -19.464 1.00 0.00 C ATOM 705 NH1 ARG A 48 2.116 -9.284 -20.685 1.00 0.00 N ATOM 706 NH2 ARG A 48 0.391 -9.912 -19.308 1.00 0.00 N ATOM 0 H ARG A 48 7.226 -5.469 -17.373 1.00 0.00 H new ATOM 0 HA ARG A 48 5.303 -6.133 -15.577 1.00 0.00 H new ATOM 0 HB2 ARG A 48 5.357 -6.420 -18.116 1.00 0.00 H new ATOM 0 HB3 ARG A 48 6.206 -7.930 -17.855 1.00 0.00 H new ATOM 0 HG2 ARG A 48 4.239 -8.654 -16.393 1.00 0.00 H new ATOM 0 HG3 ARG A 48 3.393 -7.228 -16.960 1.00 0.00 H new ATOM 0 HD2 ARG A 48 3.845 -8.037 -19.344 1.00 0.00 H new ATOM 0 HD3 ARG A 48 4.429 -9.536 -18.648 1.00 0.00 H new ATOM 0 HE ARG A 48 1.975 -9.344 -17.476 1.00 0.00 H new ATOM 0 HH11 ARG A 48 3.068 -8.940 -20.809 1.00 0.00 H new ATOM 0 HH12 ARG A 48 1.538 -9.490 -21.500 1.00 0.00 H new ATOM 0 HH21 ARG A 48 0.014 -10.052 -18.371 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -0.184 -10.117 -20.125 1.00 0.00 H new ATOM 720 N SER A 49 7.613 -8.506 -15.654 1.00 0.00 N ATOM 721 CA SER A 49 8.164 -9.627 -14.902 1.00 0.00 C ATOM 722 C SER A 49 8.151 -9.336 -13.405 1.00 0.00 C ATOM 723 O SER A 49 7.959 -10.236 -12.588 1.00 0.00 O ATOM 724 CB SER A 49 9.591 -9.926 -15.363 1.00 0.00 C ATOM 725 OG SER A 49 9.593 -10.681 -16.562 1.00 0.00 O ATOM 0 H SER A 49 8.109 -8.295 -16.520 1.00 0.00 H new ATOM 0 HA SER A 49 7.539 -10.500 -15.090 1.00 0.00 H new ATOM 0 HB2 SER A 49 10.130 -8.991 -15.518 1.00 0.00 H new ATOM 0 HB3 SER A 49 10.121 -10.474 -14.584 1.00 0.00 H new ATOM 0 HG SER A 49 10.517 -10.857 -16.836 1.00 0.00 H new ATOM 731 N ARG A 50 8.358 -8.071 -13.053 1.00 0.00 N ATOM 732 CA ARG A 50 8.372 -7.660 -11.654 1.00 0.00 C ATOM 733 C ARG A 50 6.972 -7.271 -11.188 1.00 0.00 C ATOM 734 O ARG A 50 6.482 -6.186 -11.499 1.00 0.00 O ATOM 735 CB ARG A 50 9.331 -6.485 -11.456 1.00 0.00 C ATOM 736 CG ARG A 50 10.757 -6.909 -11.145 1.00 0.00 C ATOM 737 CD ARG A 50 11.468 -5.881 -10.278 1.00 0.00 C ATOM 738 NE ARG A 50 11.291 -6.150 -8.854 1.00 0.00 N ATOM 739 CZ ARG A 50 12.022 -5.580 -7.902 1.00 0.00 C ATOM 740 NH1 ARG A 50 12.974 -4.715 -8.222 1.00 0.00 N ATOM 741 NH2 ARG A 50 11.801 -5.876 -6.628 1.00 0.00 N ATOM 0 H ARG A 50 8.518 -7.313 -13.717 1.00 0.00 H new ATOM 0 HA ARG A 50 8.714 -8.505 -11.056 1.00 0.00 H new ATOM 0 HB2 ARG A 50 9.332 -5.872 -12.357 1.00 0.00 H new ATOM 0 HB3 ARG A 50 8.962 -5.858 -10.644 1.00 0.00 H new ATOM 0 HG2 ARG A 50 10.748 -7.873 -10.635 1.00 0.00 H new ATOM 0 HG3 ARG A 50 11.308 -7.045 -12.075 1.00 0.00 H new ATOM 0 HD2 ARG A 50 12.531 -5.879 -10.517 1.00 0.00 H new ATOM 0 HD3 ARG A 50 11.087 -4.886 -10.509 1.00 0.00 H new ATOM 0 HE ARG A 50 10.567 -6.812 -8.575 1.00 0.00 H new ATOM 0 HH11 ARG A 50 13.147 -4.486 -9.201 1.00 0.00 H new ATOM 0 HH12 ARG A 50 13.534 -4.279 -7.489 1.00 0.00 H new ATOM 0 HH21 ARG A 50 11.069 -6.542 -6.379 1.00 0.00 H new ATOM 0 HH22 ARG A 50 12.363 -5.438 -5.898 1.00 0.00 H new ATOM 755 N MET A 51 6.333 -8.166 -10.440 1.00 0.00 N ATOM 756 CA MET A 51 4.990 -7.916 -9.931 1.00 0.00 C ATOM 757 C MET A 51 5.041 -7.108 -8.638 1.00 0.00 C ATOM 758 O MET A 51 5.364 -7.638 -7.576 1.00 0.00 O ATOM 759 CB MET A 51 4.258 -9.238 -9.691 1.00 0.00 C ATOM 760 CG MET A 51 2.827 -9.062 -9.210 1.00 0.00 C ATOM 761 SD MET A 51 1.829 -8.080 -10.345 1.00 0.00 S ATOM 762 CE MET A 51 1.799 -9.149 -11.782 1.00 0.00 C ATOM 0 H MET A 51 6.724 -9.070 -10.174 1.00 0.00 H new ATOM 0 HA MET A 51 4.446 -7.339 -10.679 1.00 0.00 H new ATOM 0 HB2 MET A 51 4.253 -9.814 -10.616 1.00 0.00 H new ATOM 0 HB3 MET A 51 4.811 -9.821 -8.955 1.00 0.00 H new ATOM 0 HG2 MET A 51 2.367 -10.042 -9.083 1.00 0.00 H new ATOM 0 HG3 MET A 51 2.833 -8.584 -8.231 1.00 0.00 H new ATOM 0 HE1 MET A 51 1.028 -8.808 -12.473 1.00 0.00 H new ATOM 0 HE2 MET A 51 2.769 -9.120 -12.278 1.00 0.00 H new ATOM 0 HE3 MET A 51 1.581 -10.171 -11.471 1.00 0.00 H new ATOM 772 N SER A 52 4.719 -5.822 -8.736 1.00 0.00 N ATOM 773 CA SER A 52 4.732 -4.940 -7.575 1.00 0.00 C ATOM 774 C SER A 52 3.652 -3.869 -7.694 1.00 0.00 C ATOM 775 O SER A 52 3.309 -3.438 -8.796 1.00 0.00 O ATOM 776 CB SER A 52 6.105 -4.281 -7.424 1.00 0.00 C ATOM 777 OG SER A 52 6.967 -5.075 -6.627 1.00 0.00 O ATOM 0 H SER A 52 4.446 -5.368 -9.608 1.00 0.00 H new ATOM 0 HA SER A 52 4.526 -5.542 -6.690 1.00 0.00 H new ATOM 0 HB2 SER A 52 6.550 -4.131 -8.408 1.00 0.00 H new ATOM 0 HB3 SER A 52 5.991 -3.296 -6.972 1.00 0.00 H new ATOM 0 HG SER A 52 6.731 -6.020 -6.731 1.00 0.00 H new ATOM 783 N ILE A 53 3.120 -3.445 -6.553 1.00 0.00 N ATOM 784 CA ILE A 53 2.080 -2.424 -6.528 1.00 0.00 C ATOM 785 C ILE A 53 2.602 -1.121 -5.931 1.00 0.00 C ATOM 786 O ILE A 53 3.058 -1.089 -4.788 1.00 0.00 O ATOM 787 CB ILE A 53 0.853 -2.890 -5.723 1.00 0.00 C ATOM 788 CG1 ILE A 53 0.455 -4.309 -6.132 1.00 0.00 C ATOM 789 CG2 ILE A 53 -0.309 -1.929 -5.925 1.00 0.00 C ATOM 790 CD1 ILE A 53 -0.384 -5.025 -5.097 1.00 0.00 C ATOM 0 H ILE A 53 3.392 -3.793 -5.633 1.00 0.00 H new ATOM 0 HA ILE A 53 1.782 -2.252 -7.562 1.00 0.00 H new ATOM 0 HB ILE A 53 1.113 -2.898 -4.665 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -0.099 -4.266 -7.070 1.00 0.00 H new ATOM 0 HG13 ILE A 53 1.358 -4.890 -6.321 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -1.169 -2.272 -5.350 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -0.021 -0.933 -5.588 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -0.571 -1.892 -6.982 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -0.629 -6.025 -5.455 1.00 0.00 H new ATOM 0 HD12 ILE A 53 0.175 -5.100 -4.164 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -1.304 -4.466 -4.925 1.00 0.00 H new ATOM 802 N PHE A 54 2.530 -0.048 -6.712 1.00 0.00 N ATOM 803 CA PHE A 54 2.994 1.258 -6.260 1.00 0.00 C ATOM 804 C PHE A 54 1.844 2.261 -6.224 1.00 0.00 C ATOM 805 O PHE A 54 0.733 1.965 -6.664 1.00 0.00 O ATOM 806 CB PHE A 54 4.106 1.773 -7.177 1.00 0.00 C ATOM 807 CG PHE A 54 5.341 0.918 -7.159 1.00 0.00 C ATOM 808 CD1 PHE A 54 6.170 0.898 -6.049 1.00 0.00 C ATOM 809 CD2 PHE A 54 5.673 0.135 -8.253 1.00 0.00 C ATOM 810 CE1 PHE A 54 7.307 0.113 -6.029 1.00 0.00 C ATOM 811 CE2 PHE A 54 6.809 -0.652 -8.239 1.00 0.00 C ATOM 812 CZ PHE A 54 7.627 -0.663 -7.126 1.00 0.00 C ATOM 0 H PHE A 54 2.155 -0.057 -7.660 1.00 0.00 H new ATOM 0 HA PHE A 54 3.388 1.147 -5.250 1.00 0.00 H new ATOM 0 HB2 PHE A 54 3.728 1.829 -8.198 1.00 0.00 H new ATOM 0 HB3 PHE A 54 4.371 2.787 -6.879 1.00 0.00 H new ATOM 0 HD1 PHE A 54 5.925 1.503 -5.189 1.00 0.00 H new ATOM 0 HD2 PHE A 54 5.037 0.140 -9.126 1.00 0.00 H new ATOM 0 HE1 PHE A 54 7.944 0.106 -5.157 1.00 0.00 H new ATOM 0 HE2 PHE A 54 7.057 -1.258 -9.098 1.00 0.00 H new ATOM 0 HZ PHE A 54 8.515 -1.277 -7.114 1.00 0.00 H new ATOM 822 N VAL A 55 2.120 3.449 -5.695 1.00 0.00 N ATOM 823 CA VAL A 55 1.110 4.497 -5.600 1.00 0.00 C ATOM 824 C VAL A 55 1.479 5.694 -6.469 1.00 0.00 C ATOM 825 O VAL A 55 2.105 6.645 -6.000 1.00 0.00 O ATOM 826 CB VAL A 55 0.925 4.968 -4.146 1.00 0.00 C ATOM 827 CG1 VAL A 55 -0.082 6.106 -4.077 1.00 0.00 C ATOM 828 CG2 VAL A 55 0.493 3.809 -3.261 1.00 0.00 C ATOM 0 H VAL A 55 3.034 3.710 -5.326 1.00 0.00 H new ATOM 0 HA VAL A 55 0.173 4.068 -5.956 1.00 0.00 H new ATOM 0 HB VAL A 55 1.882 5.339 -3.778 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -0.200 6.426 -3.042 1.00 0.00 H new ATOM 0 HG12 VAL A 55 0.274 6.944 -4.677 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -1.043 5.766 -4.463 1.00 0.00 H new ATOM 0 HG21 VAL A 55 0.367 4.160 -2.237 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -0.452 3.406 -3.625 1.00 0.00 H new ATOM 0 HG23 VAL A 55 1.254 3.029 -3.286 1.00 0.00 H new ATOM 838 N VAL A 56 1.085 5.642 -7.737 1.00 0.00 N ATOM 839 CA VAL A 56 1.372 6.724 -8.672 1.00 0.00 C ATOM 840 C VAL A 56 0.292 7.798 -8.617 1.00 0.00 C ATOM 841 O VAL A 56 0.090 8.540 -9.577 1.00 0.00 O ATOM 842 CB VAL A 56 1.488 6.201 -10.116 1.00 0.00 C ATOM 843 CG1 VAL A 56 2.324 4.932 -10.159 1.00 0.00 C ATOM 844 CG2 VAL A 56 0.107 5.961 -10.708 1.00 0.00 C ATOM 0 H VAL A 56 0.566 4.862 -8.141 1.00 0.00 H new ATOM 0 HA VAL A 56 2.326 7.157 -8.373 1.00 0.00 H new ATOM 0 HB VAL A 56 1.990 6.958 -10.719 1.00 0.00 H new ATOM 0 HG11 VAL A 56 2.395 4.578 -11.187 1.00 0.00 H new ATOM 0 HG12 VAL A 56 3.323 5.142 -9.778 1.00 0.00 H new ATOM 0 HG13 VAL A 56 1.854 4.166 -9.543 1.00 0.00 H new ATOM 0 HG21 VAL A 56 0.208 5.592 -11.729 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -0.424 5.223 -10.106 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -0.454 6.896 -10.714 1.00 0.00 H new ATOM 854 N GLY A 57 -0.401 7.877 -7.485 1.00 0.00 N ATOM 855 CA GLY A 57 -1.452 8.864 -7.325 1.00 0.00 C ATOM 856 C GLY A 57 -2.228 8.681 -6.036 1.00 0.00 C ATOM 857 O GLY A 57 -2.445 7.555 -5.589 1.00 0.00 O ATOM 0 H GLY A 57 -0.253 7.274 -6.676 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -1.015 9.862 -7.343 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -2.137 8.801 -8.170 1.00 0.00 H new ATOM 861 N ILE A 58 -2.646 9.791 -5.436 1.00 0.00 N ATOM 862 CA ILE A 58 -3.402 9.747 -4.191 1.00 0.00 C ATOM 863 C ILE A 58 -4.632 10.646 -4.262 1.00 0.00 C ATOM 864 O ILE A 58 -4.518 11.870 -4.284 1.00 0.00 O ATOM 865 CB ILE A 58 -2.536 10.176 -2.992 1.00 0.00 C ATOM 866 CG1 ILE A 58 -1.385 9.190 -2.787 1.00 0.00 C ATOM 867 CG2 ILE A 58 -3.386 10.276 -1.733 1.00 0.00 C ATOM 868 CD1 ILE A 58 -0.406 9.617 -1.716 1.00 0.00 C ATOM 0 H ILE A 58 -2.474 10.731 -5.792 1.00 0.00 H new ATOM 0 HA ILE A 58 -3.718 8.713 -4.050 1.00 0.00 H new ATOM 0 HB ILE A 58 -2.114 11.159 -3.201 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -1.795 8.215 -2.525 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -0.850 9.068 -3.729 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -2.760 10.580 -0.894 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -4.174 11.014 -1.884 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -3.834 9.306 -1.518 1.00 0.00 H new ATOM 0 HD11 ILE A 58 0.383 8.870 -1.626 1.00 0.00 H new ATOM 0 HD12 ILE A 58 0.033 10.578 -1.986 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -0.927 9.711 -0.763 1.00 0.00 H new ATOM 880 N ASN A 59 -5.808 10.028 -4.297 1.00 0.00 N ATOM 881 CA ASN A 59 -7.061 10.771 -4.365 1.00 0.00 C ATOM 882 C ASN A 59 -7.083 11.895 -3.333 1.00 0.00 C ATOM 883 O ASN A 59 -6.950 11.670 -2.130 1.00 0.00 O ATOM 884 CB ASN A 59 -8.248 9.833 -4.139 1.00 0.00 C ATOM 885 CG ASN A 59 -9.527 10.357 -4.764 1.00 0.00 C ATOM 886 OD1 ASN A 59 -10.572 10.410 -4.115 1.00 0.00 O ATOM 887 ND2 ASN A 59 -9.448 10.747 -6.031 1.00 0.00 N ATOM 0 H ASN A 59 -5.919 9.014 -4.279 1.00 0.00 H new ATOM 0 HA ASN A 59 -7.140 11.212 -5.359 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -8.018 8.853 -4.557 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -8.400 9.695 -3.068 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -10.275 11.109 -6.506 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -8.560 10.685 -6.529 1.00 0.00 H new ATOM 894 N PRO A 60 -7.256 13.136 -3.813 1.00 0.00 N ATOM 895 CA PRO A 60 -7.300 14.319 -2.949 1.00 0.00 C ATOM 896 C PRO A 60 -8.564 14.367 -2.097 1.00 0.00 C ATOM 897 O PRO A 60 -8.568 14.944 -1.010 1.00 0.00 O ATOM 898 CB PRO A 60 -7.281 15.484 -3.942 1.00 0.00 C ATOM 899 CG PRO A 60 -7.848 14.920 -5.199 1.00 0.00 C ATOM 900 CD PRO A 60 -7.421 13.478 -5.235 1.00 0.00 C ATOM 0 HA PRO A 60 -6.475 14.334 -2.236 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -7.877 16.322 -3.580 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -6.268 15.856 -4.097 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -8.935 15.006 -5.210 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -7.477 15.459 -6.071 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -8.170 12.849 -5.715 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -6.492 13.348 -5.790 1.00 0.00 H new ATOM 908 N GLU A 61 -9.634 13.758 -2.598 1.00 0.00 N ATOM 909 CA GLU A 61 -10.903 13.733 -1.881 1.00 0.00 C ATOM 910 C GLU A 61 -11.001 12.497 -0.991 1.00 0.00 C ATOM 911 O GLU A 61 -11.900 12.388 -0.158 1.00 0.00 O ATOM 912 CB GLU A 61 -12.073 13.758 -2.867 1.00 0.00 C ATOM 913 CG GLU A 61 -12.061 12.603 -3.854 1.00 0.00 C ATOM 914 CD GLU A 61 -13.144 12.725 -4.909 1.00 0.00 C ATOM 915 OE1 GLU A 61 -13.018 13.603 -5.788 1.00 0.00 O ATOM 916 OE2 GLU A 61 -14.116 11.944 -4.855 1.00 0.00 O ATOM 0 H GLU A 61 -9.647 13.276 -3.497 1.00 0.00 H new ATOM 0 HA GLU A 61 -10.951 14.620 -1.249 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -13.009 13.738 -2.308 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -12.052 14.697 -3.419 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -11.087 12.557 -4.342 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -12.191 11.666 -3.312 1.00 0.00 H new ATOM 923 N GLY A 62 -10.069 11.567 -1.175 1.00 0.00 N ATOM 924 CA GLY A 62 -10.067 10.351 -0.383 1.00 0.00 C ATOM 925 C GLY A 62 -9.435 10.547 0.981 1.00 0.00 C ATOM 926 O GLY A 62 -9.010 11.646 1.339 1.00 0.00 O ATOM 0 H GLY A 62 -9.315 11.634 -1.859 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -11.092 10.001 -0.258 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -9.527 9.572 -0.921 1.00 0.00 H new ATOM 930 N PRO A 63 -9.368 9.464 1.768 1.00 0.00 N ATOM 931 CA PRO A 63 -8.786 9.497 3.113 1.00 0.00 C ATOM 932 C PRO A 63 -7.274 9.692 3.086 1.00 0.00 C ATOM 933 O PRO A 63 -6.730 10.509 3.828 1.00 0.00 O ATOM 934 CB PRO A 63 -9.138 8.122 3.686 1.00 0.00 C ATOM 935 CG PRO A 63 -9.299 7.244 2.493 1.00 0.00 C ATOM 936 CD PRO A 63 -9.855 8.122 1.406 1.00 0.00 C ATOM 0 HA PRO A 63 -9.169 10.330 3.702 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -8.351 7.754 4.345 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -10.054 8.161 4.275 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -8.344 6.811 2.195 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -9.972 6.414 2.707 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -9.499 7.817 0.422 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -10.944 8.084 1.377 1.00 0.00 H new ATOM 944 N ALA A 64 -6.600 8.935 2.225 1.00 0.00 N ATOM 945 CA ALA A 64 -5.151 9.027 2.099 1.00 0.00 C ATOM 946 C ALA A 64 -4.695 10.481 2.045 1.00 0.00 C ATOM 947 O ALA A 64 -3.711 10.857 2.682 1.00 0.00 O ATOM 948 CB ALA A 64 -4.680 8.278 0.861 1.00 0.00 C ATOM 0 H ALA A 64 -7.035 8.252 1.605 1.00 0.00 H new ATOM 0 HA ALA A 64 -4.705 8.567 2.981 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -3.596 8.355 0.780 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -4.964 7.229 0.941 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -5.142 8.713 -0.025 1.00 0.00 H new ATOM 954 N ALA A 65 -5.417 11.295 1.281 1.00 0.00 N ATOM 955 CA ALA A 65 -5.087 12.708 1.145 1.00 0.00 C ATOM 956 C ALA A 65 -5.366 13.463 2.440 1.00 0.00 C ATOM 957 O ALA A 65 -4.510 14.191 2.942 1.00 0.00 O ATOM 958 CB ALA A 65 -5.868 13.324 -0.006 1.00 0.00 C ATOM 0 H ALA A 65 -6.234 11.000 0.747 1.00 0.00 H new ATOM 0 HA ALA A 65 -4.021 12.788 0.930 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -5.612 14.380 -0.096 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -5.616 12.809 -0.933 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -6.937 13.225 0.185 1.00 0.00 H new ATOM 964 N ALA A 66 -6.569 13.286 2.975 1.00 0.00 N ATOM 965 CA ALA A 66 -6.960 13.951 4.213 1.00 0.00 C ATOM 966 C ALA A 66 -5.914 13.743 5.302 1.00 0.00 C ATOM 967 O ALA A 66 -5.456 14.699 5.927 1.00 0.00 O ATOM 968 CB ALA A 66 -8.317 13.444 4.678 1.00 0.00 C ATOM 0 H ALA A 66 -7.290 12.688 2.571 1.00 0.00 H new ATOM 0 HA ALA A 66 -7.032 15.020 4.015 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -8.597 13.949 5.603 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -9.064 13.650 3.912 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -8.264 12.369 4.853 1.00 0.00 H new ATOM 974 N ASP A 67 -5.540 12.487 5.524 1.00 0.00 N ATOM 975 CA ASP A 67 -4.546 12.154 6.539 1.00 0.00 C ATOM 976 C ASP A 67 -3.231 12.878 6.270 1.00 0.00 C ATOM 977 O ASP A 67 -2.617 13.430 7.181 1.00 0.00 O ATOM 978 CB ASP A 67 -4.313 10.643 6.576 1.00 0.00 C ATOM 979 CG ASP A 67 -3.760 10.176 7.908 1.00 0.00 C ATOM 980 OD1 ASP A 67 -3.833 10.950 8.886 1.00 0.00 O ATOM 981 OD2 ASP A 67 -3.255 9.036 7.974 1.00 0.00 O ATOM 0 H ASP A 67 -5.910 11.684 5.016 1.00 0.00 H new ATOM 0 HA ASP A 67 -4.927 12.480 7.507 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -5.253 10.128 6.375 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -3.621 10.365 5.781 1.00 0.00 H new ATOM 986 N GLY A 68 -2.803 12.870 5.011 1.00 0.00 N ATOM 987 CA GLY A 68 -1.562 13.528 4.645 1.00 0.00 C ATOM 988 C GLY A 68 -0.340 12.727 5.049 1.00 0.00 C ATOM 989 O GLY A 68 0.635 13.283 5.554 1.00 0.00 O ATOM 0 H GLY A 68 -3.293 12.420 4.238 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -1.545 13.692 3.568 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -1.522 14.510 5.117 1.00 0.00 H new ATOM 993 N ARG A 69 -0.393 11.418 4.829 1.00 0.00 N ATOM 994 CA ARG A 69 0.717 10.539 5.176 1.00 0.00 C ATOM 995 C ARG A 69 1.225 9.792 3.946 1.00 0.00 C ATOM 996 O ARG A 69 2.424 9.775 3.670 1.00 0.00 O ATOM 997 CB ARG A 69 0.287 9.540 6.252 1.00 0.00 C ATOM 998 CG ARG A 69 -0.056 10.188 7.583 1.00 0.00 C ATOM 999 CD ARG A 69 1.186 10.397 8.436 1.00 0.00 C ATOM 1000 NE ARG A 69 1.871 11.645 8.108 1.00 0.00 N ATOM 1001 CZ ARG A 69 2.812 12.189 8.872 1.00 0.00 C ATOM 1002 NH1 ARG A 69 3.177 11.599 10.001 1.00 0.00 N ATOM 1003 NH2 ARG A 69 3.389 13.326 8.506 1.00 0.00 N ATOM 0 H ARG A 69 -1.193 10.942 4.412 1.00 0.00 H new ATOM 0 HA ARG A 69 1.528 11.155 5.565 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -0.580 8.984 5.894 1.00 0.00 H new ATOM 0 HB3 ARG A 69 1.088 8.817 6.405 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -0.544 11.147 7.407 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -0.768 9.562 8.121 1.00 0.00 H new ATOM 0 HD2 ARG A 69 0.906 10.403 9.489 1.00 0.00 H new ATOM 0 HD3 ARG A 69 1.869 9.560 8.293 1.00 0.00 H new ATOM 0 HE ARG A 69 1.613 12.125 7.246 1.00 0.00 H new ATOM 0 HH11 ARG A 69 2.735 10.725 10.286 1.00 0.00 H new ATOM 0 HH12 ARG A 69 3.900 12.019 10.585 1.00 0.00 H new ATOM 0 HH21 ARG A 69 3.110 13.783 7.638 1.00 0.00 H new ATOM 0 HH22 ARG A 69 4.111 13.743 9.093 1.00 0.00 H new ATOM 1017 N MET A 70 0.304 9.175 3.213 1.00 0.00 N ATOM 1018 CA MET A 70 0.658 8.427 2.012 1.00 0.00 C ATOM 1019 C MET A 70 1.170 9.362 0.921 1.00 0.00 C ATOM 1020 O MET A 70 0.611 10.436 0.698 1.00 0.00 O ATOM 1021 CB MET A 70 -0.549 7.639 1.501 1.00 0.00 C ATOM 1022 CG MET A 70 -0.654 6.240 2.085 1.00 0.00 C ATOM 1023 SD MET A 70 -1.665 5.140 1.077 1.00 0.00 S ATOM 1024 CE MET A 70 -0.462 4.582 -0.127 1.00 0.00 C ATOM 0 H MET A 70 -0.693 9.178 3.429 1.00 0.00 H new ATOM 0 HA MET A 70 1.454 7.729 2.270 1.00 0.00 H new ATOM 0 HB2 MET A 70 -1.459 8.191 1.736 1.00 0.00 H new ATOM 0 HB3 MET A 70 -0.492 7.567 0.415 1.00 0.00 H new ATOM 0 HG2 MET A 70 0.345 5.817 2.186 1.00 0.00 H new ATOM 0 HG3 MET A 70 -1.078 6.300 3.087 1.00 0.00 H new ATOM 0 HE1 MET A 70 -0.801 3.648 -0.574 1.00 0.00 H new ATOM 0 HE2 MET A 70 -0.349 5.337 -0.905 1.00 0.00 H new ATOM 0 HE3 MET A 70 0.497 4.421 0.365 1.00 0.00 H new ATOM 1034 N ARG A 71 2.235 8.946 0.243 1.00 0.00 N ATOM 1035 CA ARG A 71 2.822 9.747 -0.824 1.00 0.00 C ATOM 1036 C ARG A 71 2.980 8.923 -2.098 1.00 0.00 C ATOM 1037 O ARG A 71 2.754 7.713 -2.098 1.00 0.00 O ATOM 1038 CB ARG A 71 4.181 10.298 -0.388 1.00 0.00 C ATOM 1039 CG ARG A 71 4.099 11.275 0.773 1.00 0.00 C ATOM 1040 CD ARG A 71 3.946 12.708 0.286 1.00 0.00 C ATOM 1041 NE ARG A 71 2.574 13.007 -0.114 1.00 0.00 N ATOM 1042 CZ ARG A 71 2.140 14.230 -0.397 1.00 0.00 C ATOM 1043 NH1 ARG A 71 2.968 15.263 -0.324 1.00 0.00 N ATOM 1044 NH2 ARG A 71 0.877 14.422 -0.754 1.00 0.00 N ATOM 0 H ARG A 71 2.709 8.059 0.414 1.00 0.00 H new ATOM 0 HA ARG A 71 2.150 10.579 -1.032 1.00 0.00 H new ATOM 0 HB2 ARG A 71 4.827 9.466 -0.107 1.00 0.00 H new ATOM 0 HB3 ARG A 71 4.651 10.794 -1.237 1.00 0.00 H new ATOM 0 HG2 ARG A 71 3.254 11.014 1.410 1.00 0.00 H new ATOM 0 HG3 ARG A 71 4.997 11.191 1.384 1.00 0.00 H new ATOM 0 HD2 ARG A 71 4.251 13.394 1.077 1.00 0.00 H new ATOM 0 HD3 ARG A 71 4.615 12.877 -0.558 1.00 0.00 H new ATOM 0 HE ARG A 71 1.912 12.234 -0.180 1.00 0.00 H new ATOM 0 HH11 ARG A 71 3.940 15.119 -0.050 1.00 0.00 H new ATOM 0 HH12 ARG A 71 2.633 16.201 -0.542 1.00 0.00 H new ATOM 0 HH21 ARG A 71 0.237 13.630 -0.812 1.00 0.00 H new ATOM 0 HH22 ARG A 71 0.546 15.362 -0.971 1.00 0.00 H new ATOM 1058 N ILE A 72 3.369 9.587 -3.182 1.00 0.00 N ATOM 1059 CA ILE A 72 3.557 8.916 -4.462 1.00 0.00 C ATOM 1060 C ILE A 72 4.870 8.141 -4.488 1.00 0.00 C ATOM 1061 O ILE A 72 5.947 8.718 -4.346 1.00 0.00 O ATOM 1062 CB ILE A 72 3.543 9.918 -5.631 1.00 0.00 C ATOM 1063 CG1 ILE A 72 2.379 10.899 -5.475 1.00 0.00 C ATOM 1064 CG2 ILE A 72 3.449 9.182 -6.959 1.00 0.00 C ATOM 1065 CD1 ILE A 72 1.083 10.239 -5.060 1.00 0.00 C ATOM 0 H ILE A 72 3.560 10.589 -3.199 1.00 0.00 H new ATOM 0 HA ILE A 72 2.725 8.222 -4.579 1.00 0.00 H new ATOM 0 HB ILE A 72 4.475 10.483 -5.617 1.00 0.00 H new ATOM 0 HG12 ILE A 72 2.647 11.653 -4.734 1.00 0.00 H new ATOM 0 HG13 ILE A 72 2.225 11.421 -6.420 1.00 0.00 H new ATOM 0 HG21 ILE A 72 3.440 9.904 -7.775 1.00 0.00 H new ATOM 0 HG22 ILE A 72 4.308 8.520 -7.070 1.00 0.00 H new ATOM 0 HG23 ILE A 72 2.532 8.594 -6.985 1.00 0.00 H new ATOM 0 HD11 ILE A 72 0.303 10.995 -4.969 1.00 0.00 H new ATOM 0 HD12 ILE A 72 0.792 9.505 -5.811 1.00 0.00 H new ATOM 0 HD13 ILE A 72 1.219 9.741 -4.100 1.00 0.00 H new ATOM 1077 N GLY A 73 4.773 6.828 -4.672 1.00 0.00 N ATOM 1078 CA GLY A 73 5.960 5.994 -4.716 1.00 0.00 C ATOM 1079 C GLY A 73 5.889 4.833 -3.744 1.00 0.00 C ATOM 1080 O GLY A 73 6.617 3.850 -3.887 1.00 0.00 O ATOM 0 H GLY A 73 3.893 6.327 -4.791 1.00 0.00 H new ATOM 0 HA2 GLY A 73 6.093 5.610 -5.727 1.00 0.00 H new ATOM 0 HA3 GLY A 73 6.836 6.602 -4.488 1.00 0.00 H new ATOM 1084 N ASP A 74 5.012 4.946 -2.753 1.00 0.00 N ATOM 1085 CA ASP A 74 4.849 3.896 -1.753 1.00 0.00 C ATOM 1086 C ASP A 74 4.461 2.576 -2.410 1.00 0.00 C ATOM 1087 O ASP A 74 3.620 2.542 -3.308 1.00 0.00 O ATOM 1088 CB ASP A 74 3.790 4.301 -0.727 1.00 0.00 C ATOM 1089 CG ASP A 74 4.197 5.520 0.076 1.00 0.00 C ATOM 1090 OD1 ASP A 74 5.289 5.494 0.683 1.00 0.00 O ATOM 1091 OD2 ASP A 74 3.425 6.502 0.097 1.00 0.00 O ATOM 0 H ASP A 74 4.403 5.753 -2.620 1.00 0.00 H new ATOM 0 HA ASP A 74 5.803 3.760 -1.244 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.850 4.505 -1.241 1.00 0.00 H new ATOM 0 HB3 ASP A 74 3.608 3.467 -0.049 1.00 0.00 H new ATOM 1096 N GLU A 75 5.079 1.490 -1.956 1.00 0.00 N ATOM 1097 CA GLU A 75 4.799 0.167 -2.501 1.00 0.00 C ATOM 1098 C GLU A 75 4.018 -0.680 -1.501 1.00 0.00 C ATOM 1099 O GLU A 75 4.599 -1.306 -0.614 1.00 0.00 O ATOM 1100 CB GLU A 75 6.102 -0.541 -2.878 1.00 0.00 C ATOM 1101 CG GLU A 75 5.907 -1.981 -3.319 1.00 0.00 C ATOM 1102 CD GLU A 75 7.220 -2.696 -3.575 1.00 0.00 C ATOM 1103 OE1 GLU A 75 7.852 -2.420 -4.616 1.00 0.00 O ATOM 1104 OE2 GLU A 75 7.615 -3.531 -2.734 1.00 0.00 O ATOM 0 H GLU A 75 5.777 1.501 -1.212 1.00 0.00 H new ATOM 0 HA GLU A 75 4.191 0.293 -3.397 1.00 0.00 H new ATOM 0 HB2 GLU A 75 6.587 0.013 -3.681 1.00 0.00 H new ATOM 0 HB3 GLU A 75 6.777 -0.520 -2.023 1.00 0.00 H new ATOM 0 HG2 GLU A 75 5.348 -2.519 -2.553 1.00 0.00 H new ATOM 0 HG3 GLU A 75 5.304 -2.001 -4.227 1.00 0.00 H new ATOM 1111 N LEU A 76 2.698 -0.693 -1.649 1.00 0.00 N ATOM 1112 CA LEU A 76 1.836 -1.462 -0.759 1.00 0.00 C ATOM 1113 C LEU A 76 2.380 -2.873 -0.558 1.00 0.00 C ATOM 1114 O LEU A 76 2.876 -3.498 -1.496 1.00 0.00 O ATOM 1115 CB LEU A 76 0.415 -1.527 -1.323 1.00 0.00 C ATOM 1116 CG LEU A 76 -0.370 -0.215 -1.316 1.00 0.00 C ATOM 1117 CD1 LEU A 76 -1.624 -0.339 -2.168 1.00 0.00 C ATOM 1118 CD2 LEU A 76 -0.728 0.185 0.108 1.00 0.00 C ATOM 0 H LEU A 76 2.201 -0.180 -2.377 1.00 0.00 H new ATOM 0 HA LEU A 76 1.814 -0.960 0.208 1.00 0.00 H new ATOM 0 HB2 LEU A 76 0.469 -1.889 -2.350 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -0.147 -2.267 -0.753 1.00 0.00 H new ATOM 0 HG LEU A 76 0.260 0.565 -1.744 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -2.170 0.604 -2.151 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -1.345 -0.578 -3.194 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -2.257 -1.132 -1.770 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -1.286 1.121 0.094 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -1.339 -0.595 0.562 1.00 0.00 H new ATOM 0 HD23 LEU A 76 0.185 0.316 0.689 1.00 0.00 H new ATOM 1130 N LEU A 77 2.283 -3.370 0.670 1.00 0.00 N ATOM 1131 CA LEU A 77 2.763 -4.708 0.995 1.00 0.00 C ATOM 1132 C LEU A 77 1.649 -5.554 1.603 1.00 0.00 C ATOM 1133 O LEU A 77 1.507 -6.734 1.281 1.00 0.00 O ATOM 1134 CB LEU A 77 3.944 -4.627 1.964 1.00 0.00 C ATOM 1135 CG LEU A 77 5.117 -3.751 1.521 1.00 0.00 C ATOM 1136 CD1 LEU A 77 5.913 -3.276 2.726 1.00 0.00 C ATOM 1137 CD2 LEU A 77 6.013 -4.510 0.552 1.00 0.00 C ATOM 0 H LEU A 77 1.876 -2.866 1.458 1.00 0.00 H new ATOM 0 HA LEU A 77 3.092 -5.183 0.071 1.00 0.00 H new ATOM 0 HB2 LEU A 77 3.578 -4.253 2.920 1.00 0.00 H new ATOM 0 HB3 LEU A 77 4.316 -5.637 2.137 1.00 0.00 H new ATOM 0 HG LEU A 77 4.719 -2.876 1.007 1.00 0.00 H new ATOM 0 HD11 LEU A 77 6.743 -2.654 2.391 1.00 0.00 H new ATOM 0 HD12 LEU A 77 5.266 -2.695 3.383 1.00 0.00 H new ATOM 0 HD13 LEU A 77 6.301 -4.138 3.269 1.00 0.00 H new ATOM 0 HD21 LEU A 77 6.842 -3.872 0.247 1.00 0.00 H new ATOM 0 HD22 LEU A 77 6.403 -5.403 1.040 1.00 0.00 H new ATOM 0 HD23 LEU A 77 5.436 -4.799 -0.326 1.00 0.00 H new ATOM 1149 N GLU A 78 0.861 -4.943 2.481 1.00 0.00 N ATOM 1150 CA GLU A 78 -0.242 -5.640 3.132 1.00 0.00 C ATOM 1151 C GLU A 78 -1.435 -4.710 3.328 1.00 0.00 C ATOM 1152 O GLU A 78 -1.276 -3.493 3.435 1.00 0.00 O ATOM 1153 CB GLU A 78 0.208 -6.202 4.483 1.00 0.00 C ATOM 1154 CG GLU A 78 1.450 -7.072 4.397 1.00 0.00 C ATOM 1155 CD GLU A 78 1.617 -7.972 5.606 1.00 0.00 C ATOM 1156 OE1 GLU A 78 0.639 -8.135 6.365 1.00 0.00 O ATOM 1157 OE2 GLU A 78 2.728 -8.512 5.794 1.00 0.00 O ATOM 0 H GLU A 78 0.966 -3.967 2.758 1.00 0.00 H new ATOM 0 HA GLU A 78 -0.549 -6.463 2.487 1.00 0.00 H new ATOM 0 HB2 GLU A 78 0.401 -5.374 5.165 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -0.605 -6.786 4.913 1.00 0.00 H new ATOM 0 HG2 GLU A 78 1.398 -7.685 3.497 1.00 0.00 H new ATOM 0 HG3 GLU A 78 2.329 -6.435 4.299 1.00 0.00 H new ATOM 1164 N ILE A 79 -2.629 -5.290 3.373 1.00 0.00 N ATOM 1165 CA ILE A 79 -3.849 -4.513 3.556 1.00 0.00 C ATOM 1166 C ILE A 79 -4.944 -5.354 4.206 1.00 0.00 C ATOM 1167 O ILE A 79 -5.339 -6.392 3.677 1.00 0.00 O ATOM 1168 CB ILE A 79 -4.370 -3.959 2.217 1.00 0.00 C ATOM 1169 CG1 ILE A 79 -3.412 -2.897 1.673 1.00 0.00 C ATOM 1170 CG2 ILE A 79 -5.767 -3.381 2.390 1.00 0.00 C ATOM 1171 CD1 ILE A 79 -3.829 -2.338 0.331 1.00 0.00 C ATOM 0 H ILE A 79 -2.778 -6.295 3.285 1.00 0.00 H new ATOM 0 HA ILE A 79 -3.597 -3.679 4.211 1.00 0.00 H new ATOM 0 HB ILE A 79 -4.423 -4.777 1.498 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -3.342 -2.080 2.392 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -2.416 -3.330 1.584 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -6.121 -2.993 1.435 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -6.443 -4.162 2.738 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -5.739 -2.573 3.121 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -3.104 -1.591 0.007 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -3.872 -3.144 -0.402 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -4.812 -1.875 0.419 1.00 0.00 H new ATOM 1183 N ASN A 80 -5.431 -4.895 5.354 1.00 0.00 N ATOM 1184 CA ASN A 80 -6.481 -5.604 6.076 1.00 0.00 C ATOM 1185 C ASN A 80 -6.036 -7.018 6.435 1.00 0.00 C ATOM 1186 O ASN A 80 -6.845 -7.944 6.473 1.00 0.00 O ATOM 1187 CB ASN A 80 -7.759 -5.658 5.235 1.00 0.00 C ATOM 1188 CG ASN A 80 -8.949 -6.168 6.025 1.00 0.00 C ATOM 1189 OD1 ASN A 80 -9.504 -7.224 5.720 1.00 0.00 O ATOM 1190 ND2 ASN A 80 -9.347 -5.418 7.046 1.00 0.00 N ATOM 0 H ASN A 80 -5.116 -4.036 5.804 1.00 0.00 H new ATOM 0 HA ASN A 80 -6.683 -5.061 6.999 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -7.981 -4.662 4.851 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -7.596 -6.303 4.372 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -10.143 -5.710 7.614 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -8.857 -4.550 7.263 1.00 0.00 H new ATOM 1197 N ASN A 81 -4.742 -7.176 6.698 1.00 0.00 N ATOM 1198 CA ASN A 81 -4.188 -8.477 7.055 1.00 0.00 C ATOM 1199 C ASN A 81 -4.112 -9.389 5.834 1.00 0.00 C ATOM 1200 O ASN A 81 -4.387 -10.585 5.923 1.00 0.00 O ATOM 1201 CB ASN A 81 -5.038 -9.135 8.144 1.00 0.00 C ATOM 1202 CG ASN A 81 -4.293 -10.240 8.869 1.00 0.00 C ATOM 1203 OD1 ASN A 81 -4.113 -11.335 8.336 1.00 0.00 O ATOM 1204 ND2 ASN A 81 -3.857 -9.957 10.091 1.00 0.00 N ATOM 0 H ASN A 81 -4.058 -6.420 6.671 1.00 0.00 H new ATOM 0 HA ASN A 81 -3.178 -8.322 7.435 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -5.351 -8.379 8.864 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -5.944 -9.544 7.697 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -3.350 -10.661 10.627 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -4.029 -9.036 10.493 1.00 0.00 H new ATOM 1211 N GLN A 82 -3.736 -8.815 4.696 1.00 0.00 N ATOM 1212 CA GLN A 82 -3.624 -9.576 3.457 1.00 0.00 C ATOM 1213 C GLN A 82 -2.394 -9.146 2.664 1.00 0.00 C ATOM 1214 O GLN A 82 -2.314 -8.011 2.192 1.00 0.00 O ATOM 1215 CB GLN A 82 -4.883 -9.396 2.607 1.00 0.00 C ATOM 1216 CG GLN A 82 -6.033 -10.299 3.024 1.00 0.00 C ATOM 1217 CD GLN A 82 -6.006 -11.641 2.321 1.00 0.00 C ATOM 1218 OE1 GLN A 82 -5.519 -12.631 2.868 1.00 0.00 O ATOM 1219 NE2 GLN A 82 -6.530 -11.682 1.102 1.00 0.00 N ATOM 0 H GLN A 82 -3.504 -7.826 4.606 1.00 0.00 H new ATOM 0 HA GLN A 82 -3.517 -10.630 3.715 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -5.207 -8.357 2.668 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -4.638 -9.592 1.563 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -5.993 -10.457 4.102 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -6.978 -9.800 2.810 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -6.923 -10.837 0.687 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -6.540 -12.558 0.580 1.00 0.00 H new ATOM 1228 N ILE A 83 -1.440 -10.059 2.521 1.00 0.00 N ATOM 1229 CA ILE A 83 -0.215 -9.773 1.784 1.00 0.00 C ATOM 1230 C ILE A 83 -0.487 -9.662 0.288 1.00 0.00 C ATOM 1231 O ILE A 83 -1.071 -10.562 -0.317 1.00 0.00 O ATOM 1232 CB ILE A 83 0.851 -10.860 2.021 1.00 0.00 C ATOM 1233 CG1 ILE A 83 1.195 -10.951 3.509 1.00 0.00 C ATOM 1234 CG2 ILE A 83 2.098 -10.566 1.201 1.00 0.00 C ATOM 1235 CD1 ILE A 83 2.325 -11.911 3.810 1.00 0.00 C ATOM 0 H ILE A 83 -1.491 -11.002 2.905 1.00 0.00 H new ATOM 0 HA ILE A 83 0.161 -8.819 2.154 1.00 0.00 H new ATOM 0 HB ILE A 83 0.447 -11.821 1.701 1.00 0.00 H new ATOM 0 HG12 ILE A 83 1.465 -9.959 3.873 1.00 0.00 H new ATOM 0 HG13 ILE A 83 0.308 -11.262 4.060 1.00 0.00 H new ATOM 0 HG21 ILE A 83 2.842 -11.343 1.379 1.00 0.00 H new ATOM 0 HG22 ILE A 83 1.841 -10.546 0.142 1.00 0.00 H new ATOM 0 HG23 ILE A 83 2.506 -9.599 1.494 1.00 0.00 H new ATOM 0 HD11 ILE A 83 2.515 -11.925 4.883 1.00 0.00 H new ATOM 0 HD12 ILE A 83 2.050 -12.912 3.477 1.00 0.00 H new ATOM 0 HD13 ILE A 83 3.225 -11.589 3.287 1.00 0.00 H new ATOM 1247 N LEU A 84 -0.058 -8.553 -0.305 1.00 0.00 N ATOM 1248 CA LEU A 84 -0.253 -8.324 -1.733 1.00 0.00 C ATOM 1249 C LEU A 84 1.008 -8.672 -2.517 1.00 0.00 C ATOM 1250 O LEU A 84 0.944 -8.990 -3.705 1.00 0.00 O ATOM 1251 CB LEU A 84 -0.640 -6.866 -1.987 1.00 0.00 C ATOM 1252 CG LEU A 84 -1.632 -6.253 -0.998 1.00 0.00 C ATOM 1253 CD1 LEU A 84 -1.672 -4.741 -1.150 1.00 0.00 C ATOM 1254 CD2 LEU A 84 -3.019 -6.847 -1.196 1.00 0.00 C ATOM 0 H LEU A 84 0.427 -7.798 0.181 1.00 0.00 H new ATOM 0 HA LEU A 84 -1.060 -8.972 -2.074 1.00 0.00 H new ATOM 0 HB2 LEU A 84 0.268 -6.263 -1.980 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -1.064 -6.793 -2.989 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.299 -6.488 0.013 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -2.383 -4.322 -0.438 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -0.681 -4.330 -0.957 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -1.980 -4.485 -2.164 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -3.712 -6.399 -0.484 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -3.360 -6.644 -2.211 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -2.980 -7.924 -1.035 1.00 0.00 H new ATOM 1266 N TYR A 85 2.152 -8.611 -1.845 1.00 0.00 N ATOM 1267 CA TYR A 85 3.428 -8.919 -2.480 1.00 0.00 C ATOM 1268 C TYR A 85 3.313 -10.157 -3.363 1.00 0.00 C ATOM 1269 O TYR A 85 3.250 -11.282 -2.869 1.00 0.00 O ATOM 1270 CB TYR A 85 4.510 -9.134 -1.420 1.00 0.00 C ATOM 1271 CG TYR A 85 5.878 -9.415 -1.999 1.00 0.00 C ATOM 1272 CD1 TYR A 85 6.190 -10.665 -2.519 1.00 0.00 C ATOM 1273 CD2 TYR A 85 6.858 -8.431 -2.026 1.00 0.00 C ATOM 1274 CE1 TYR A 85 7.439 -10.927 -3.048 1.00 0.00 C ATOM 1275 CE2 TYR A 85 8.109 -8.683 -2.555 1.00 0.00 C ATOM 1276 CZ TYR A 85 8.395 -9.933 -3.064 1.00 0.00 C ATOM 1277 OH TYR A 85 9.640 -10.189 -3.591 1.00 0.00 O ATOM 0 H TYR A 85 2.222 -8.351 -0.861 1.00 0.00 H new ATOM 0 HA TYR A 85 3.706 -8.072 -3.108 1.00 0.00 H new ATOM 0 HB2 TYR A 85 4.568 -8.248 -0.787 1.00 0.00 H new ATOM 0 HB3 TYR A 85 4.218 -9.966 -0.779 1.00 0.00 H new ATOM 0 HD1 TYR A 85 5.443 -11.445 -2.510 1.00 0.00 H new ATOM 0 HD2 TYR A 85 6.638 -7.452 -1.627 1.00 0.00 H new ATOM 0 HE1 TYR A 85 7.666 -11.905 -3.447 1.00 0.00 H new ATOM 0 HE2 TYR A 85 8.859 -7.906 -2.570 1.00 0.00 H new ATOM 0 HH TYR A 85 10.194 -9.383 -3.527 1.00 0.00 H new ATOM 1287 N GLY A 86 3.285 -9.941 -4.675 1.00 0.00 N ATOM 1288 CA GLY A 86 3.178 -11.047 -5.607 1.00 0.00 C ATOM 1289 C GLY A 86 1.800 -11.148 -6.232 1.00 0.00 C ATOM 1290 O GLY A 86 1.388 -12.221 -6.673 1.00 0.00 O ATOM 0 H GLY A 86 3.335 -9.019 -5.108 1.00 0.00 H new ATOM 0 HA2 GLY A 86 3.923 -10.928 -6.394 1.00 0.00 H new ATOM 0 HA3 GLY A 86 3.408 -11.978 -5.089 1.00 0.00 H new ATOM 1294 N ARG A 87 1.085 -10.028 -6.267 1.00 0.00 N ATOM 1295 CA ARG A 87 -0.255 -9.995 -6.839 1.00 0.00 C ATOM 1296 C ARG A 87 -0.454 -8.744 -7.689 1.00 0.00 C ATOM 1297 O ARG A 87 0.361 -7.822 -7.653 1.00 0.00 O ATOM 1298 CB ARG A 87 -1.308 -10.043 -5.730 1.00 0.00 C ATOM 1299 CG ARG A 87 -1.479 -11.421 -5.112 1.00 0.00 C ATOM 1300 CD ARG A 87 -2.269 -11.355 -3.814 1.00 0.00 C ATOM 1301 NE ARG A 87 -2.681 -12.680 -3.356 1.00 0.00 N ATOM 1302 CZ ARG A 87 -1.859 -13.543 -2.770 1.00 0.00 C ATOM 1303 NH1 ARG A 87 -0.588 -13.224 -2.572 1.00 0.00 N ATOM 1304 NH2 ARG A 87 -2.309 -14.730 -2.382 1.00 0.00 N ATOM 0 H ARG A 87 1.412 -9.132 -5.906 1.00 0.00 H new ATOM 0 HA ARG A 87 -0.370 -10.870 -7.479 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -1.033 -9.335 -4.948 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -2.265 -9.714 -6.135 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -1.990 -12.076 -5.817 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -0.500 -11.860 -4.921 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -1.662 -10.878 -3.044 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -3.151 -10.731 -3.958 1.00 0.00 H new ATOM 0 HE ARG A 87 -3.653 -12.957 -3.494 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -0.238 -12.313 -2.870 1.00 0.00 H new ATOM 0 HH12 ARG A 87 0.041 -13.889 -2.122 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -3.286 -14.979 -2.534 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -1.677 -15.393 -1.932 1.00 0.00 H new ATOM 1318 N SER A 88 -1.541 -8.720 -8.454 1.00 0.00 N ATOM 1319 CA SER A 88 -1.844 -7.584 -9.316 1.00 0.00 C ATOM 1320 C SER A 88 -2.462 -6.443 -8.514 1.00 0.00 C ATOM 1321 O SER A 88 -3.176 -6.670 -7.538 1.00 0.00 O ATOM 1322 CB SER A 88 -2.794 -8.007 -10.438 1.00 0.00 C ATOM 1323 OG SER A 88 -4.065 -8.363 -9.922 1.00 0.00 O ATOM 0 H SER A 88 -2.226 -9.474 -8.494 1.00 0.00 H new ATOM 0 HA SER A 88 -0.910 -7.233 -9.754 1.00 0.00 H new ATOM 0 HB2 SER A 88 -2.904 -7.192 -11.153 1.00 0.00 H new ATOM 0 HB3 SER A 88 -2.368 -8.851 -10.980 1.00 0.00 H new ATOM 0 HG SER A 88 -4.655 -8.628 -10.659 1.00 0.00 H new ATOM 1329 N HIS A 89 -2.181 -5.213 -8.935 1.00 0.00 N ATOM 1330 CA HIS A 89 -2.710 -4.034 -8.257 1.00 0.00 C ATOM 1331 C HIS A 89 -4.234 -4.074 -8.206 1.00 0.00 C ATOM 1332 O HIS A 89 -4.845 -3.597 -7.250 1.00 0.00 O ATOM 1333 CB HIS A 89 -2.245 -2.762 -8.964 1.00 0.00 C ATOM 1334 CG HIS A 89 -2.639 -2.701 -10.408 1.00 0.00 C ATOM 1335 ND1 HIS A 89 -3.920 -2.409 -10.827 1.00 0.00 N ATOM 1336 CD2 HIS A 89 -1.912 -2.894 -11.533 1.00 0.00 C ATOM 1337 CE1 HIS A 89 -3.964 -2.428 -12.147 1.00 0.00 C ATOM 1338 NE2 HIS A 89 -2.758 -2.719 -12.600 1.00 0.00 N ATOM 0 H HIS A 89 -1.591 -5.007 -9.741 1.00 0.00 H new ATOM 0 HA HIS A 89 -2.330 -4.032 -7.235 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -2.658 -1.897 -8.446 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -1.160 -2.690 -8.889 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -0.862 -3.140 -11.582 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -4.838 -2.238 -12.753 1.00 0.00 H new ATOM 0 HE2 HIS A 89 -2.498 -2.800 -13.583 1.00 0.00 H new ATOM 1347 N GLN A 90 -4.841 -4.646 -9.241 1.00 0.00 N ATOM 1348 CA GLN A 90 -6.294 -4.747 -9.315 1.00 0.00 C ATOM 1349 C GLN A 90 -6.845 -5.544 -8.137 1.00 0.00 C ATOM 1350 O GLN A 90 -7.915 -5.237 -7.614 1.00 0.00 O ATOM 1351 CB GLN A 90 -6.715 -5.402 -10.631 1.00 0.00 C ATOM 1352 CG GLN A 90 -6.906 -4.413 -11.769 1.00 0.00 C ATOM 1353 CD GLN A 90 -6.870 -5.077 -13.132 1.00 0.00 C ATOM 1354 OE1 GLN A 90 -7.762 -5.850 -13.482 1.00 0.00 O ATOM 1355 NE2 GLN A 90 -5.836 -4.777 -13.910 1.00 0.00 N ATOM 0 H GLN A 90 -4.349 -5.047 -10.040 1.00 0.00 H new ATOM 0 HA GLN A 90 -6.705 -3.739 -9.272 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -5.961 -6.135 -10.920 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -7.646 -5.947 -10.474 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -7.860 -3.901 -11.644 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -6.127 -3.652 -11.719 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -5.119 -4.131 -13.579 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -5.759 -5.193 -14.838 1.00 0.00 H new ATOM 1364 N ASN A 91 -6.105 -6.569 -7.725 1.00 0.00 N ATOM 1365 CA ASN A 91 -6.520 -7.411 -6.609 1.00 0.00 C ATOM 1366 C ASN A 91 -6.531 -6.620 -5.305 1.00 0.00 C ATOM 1367 O ASN A 91 -7.488 -6.688 -4.534 1.00 0.00 O ATOM 1368 CB ASN A 91 -5.588 -8.617 -6.479 1.00 0.00 C ATOM 1369 CG ASN A 91 -5.959 -9.739 -7.430 1.00 0.00 C ATOM 1370 OD1 ASN A 91 -7.126 -9.908 -7.783 1.00 0.00 O ATOM 1371 ND2 ASN A 91 -4.964 -10.513 -7.848 1.00 0.00 N ATOM 0 H ASN A 91 -5.216 -6.836 -8.147 1.00 0.00 H new ATOM 0 HA ASN A 91 -7.532 -7.762 -6.808 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -4.563 -8.303 -6.674 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -5.618 -8.988 -5.454 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -5.152 -11.285 -8.488 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -4.011 -10.336 -7.529 1.00 0.00 H new ATOM 1378 N ALA A 92 -5.461 -5.870 -5.066 1.00 0.00 N ATOM 1379 CA ALA A 92 -5.348 -5.063 -3.857 1.00 0.00 C ATOM 1380 C ALA A 92 -6.645 -4.313 -3.574 1.00 0.00 C ATOM 1381 O ALA A 92 -7.265 -4.499 -2.527 1.00 0.00 O ATOM 1382 CB ALA A 92 -4.187 -4.087 -3.980 1.00 0.00 C ATOM 0 H ALA A 92 -4.660 -5.804 -5.694 1.00 0.00 H new ATOM 0 HA ALA A 92 -5.157 -5.734 -3.019 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -4.115 -3.491 -3.070 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -3.260 -4.641 -4.126 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -4.354 -3.429 -4.833 1.00 0.00 H new ATOM 1388 N SER A 93 -7.049 -3.465 -4.514 1.00 0.00 N ATOM 1389 CA SER A 93 -8.271 -2.683 -4.363 1.00 0.00 C ATOM 1390 C SER A 93 -9.429 -3.566 -3.910 1.00 0.00 C ATOM 1391 O SER A 93 -10.201 -3.192 -3.028 1.00 0.00 O ATOM 1392 CB SER A 93 -8.626 -1.994 -5.682 1.00 0.00 C ATOM 1393 OG SER A 93 -9.807 -1.221 -5.552 1.00 0.00 O ATOM 0 H SER A 93 -6.549 -3.302 -5.388 1.00 0.00 H new ATOM 0 HA SER A 93 -8.096 -1.925 -3.600 1.00 0.00 H new ATOM 0 HB2 SER A 93 -7.801 -1.354 -5.995 1.00 0.00 H new ATOM 0 HB3 SER A 93 -8.762 -2.743 -6.462 1.00 0.00 H new ATOM 0 HG SER A 93 -10.012 -0.790 -6.408 1.00 0.00 H new ATOM 1399 N ALA A 94 -9.542 -4.741 -4.520 1.00 0.00 N ATOM 1400 CA ALA A 94 -10.604 -5.680 -4.179 1.00 0.00 C ATOM 1401 C ALA A 94 -10.598 -5.997 -2.687 1.00 0.00 C ATOM 1402 O ALA A 94 -11.635 -5.937 -2.026 1.00 0.00 O ATOM 1403 CB ALA A 94 -10.461 -6.957 -4.993 1.00 0.00 C ATOM 0 H ALA A 94 -8.911 -5.066 -5.253 1.00 0.00 H new ATOM 0 HA ALA A 94 -11.559 -5.214 -4.421 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -11.261 -7.649 -4.728 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -10.523 -6.720 -6.055 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -9.497 -7.418 -4.780 1.00 0.00 H new ATOM 1409 N ILE A 95 -9.424 -6.336 -2.164 1.00 0.00 N ATOM 1410 CA ILE A 95 -9.284 -6.663 -0.750 1.00 0.00 C ATOM 1411 C ILE A 95 -9.818 -5.537 0.129 1.00 0.00 C ATOM 1412 O ILE A 95 -10.478 -5.785 1.139 1.00 0.00 O ATOM 1413 CB ILE A 95 -7.815 -6.937 -0.379 1.00 0.00 C ATOM 1414 CG1 ILE A 95 -7.256 -8.080 -1.228 1.00 0.00 C ATOM 1415 CG2 ILE A 95 -7.695 -7.262 1.103 1.00 0.00 C ATOM 1416 CD1 ILE A 95 -5.750 -8.207 -1.155 1.00 0.00 C ATOM 0 H ILE A 95 -8.557 -6.391 -2.698 1.00 0.00 H new ATOM 0 HA ILE A 95 -9.869 -7.566 -0.575 1.00 0.00 H new ATOM 0 HB ILE A 95 -7.231 -6.040 -0.583 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -7.708 -9.017 -0.903 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -7.550 -7.928 -2.267 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -6.651 -7.453 1.350 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -8.058 -6.419 1.691 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -8.290 -8.147 1.331 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -5.424 -9.038 -1.781 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -5.290 -7.284 -1.508 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -5.450 -8.391 -0.123 1.00 0.00 H new ATOM 1428 N ILE A 96 -9.530 -4.301 -0.262 1.00 0.00 N ATOM 1429 CA ILE A 96 -9.984 -3.137 0.489 1.00 0.00 C ATOM 1430 C ILE A 96 -11.506 -3.041 0.488 1.00 0.00 C ATOM 1431 O ILE A 96 -12.127 -2.837 1.531 1.00 0.00 O ATOM 1432 CB ILE A 96 -9.398 -1.833 -0.084 1.00 0.00 C ATOM 1433 CG1 ILE A 96 -7.882 -1.797 0.120 1.00 0.00 C ATOM 1434 CG2 ILE A 96 -10.054 -0.626 0.569 1.00 0.00 C ATOM 1435 CD1 ILE A 96 -7.168 -0.854 -0.823 1.00 0.00 C ATOM 0 H ILE A 96 -8.984 -4.079 -1.095 1.00 0.00 H new ATOM 0 HA ILE A 96 -9.631 -3.265 1.512 1.00 0.00 H new ATOM 0 HB ILE A 96 -9.603 -1.799 -1.154 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -7.669 -1.501 1.147 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -7.482 -2.802 -0.012 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -9.629 0.288 0.154 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -11.127 -0.647 0.378 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -9.876 -0.653 1.644 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -6.097 -0.880 -0.621 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -7.351 -1.161 -1.853 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -7.541 0.160 -0.675 1.00 0.00 H new ATOM 1447 N LYS A 97 -12.101 -3.192 -0.690 1.00 0.00 N ATOM 1448 CA LYS A 97 -13.551 -3.125 -0.829 1.00 0.00 C ATOM 1449 C LYS A 97 -14.237 -4.034 0.185 1.00 0.00 C ATOM 1450 O LYS A 97 -15.219 -3.646 0.820 1.00 0.00 O ATOM 1451 CB LYS A 97 -13.967 -3.522 -2.248 1.00 0.00 C ATOM 1452 CG LYS A 97 -15.256 -2.865 -2.710 1.00 0.00 C ATOM 1453 CD LYS A 97 -15.481 -3.065 -4.199 1.00 0.00 C ATOM 1454 CE LYS A 97 -14.579 -2.162 -5.026 1.00 0.00 C ATOM 1455 NZ LYS A 97 -14.560 -2.560 -6.461 1.00 0.00 N ATOM 0 H LYS A 97 -11.601 -3.362 -1.563 1.00 0.00 H new ATOM 0 HA LYS A 97 -13.862 -2.098 -0.639 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -13.167 -3.258 -2.939 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -14.084 -4.605 -2.294 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -16.097 -3.281 -2.155 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -15.223 -1.799 -2.486 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -15.292 -4.106 -4.460 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -16.524 -2.860 -4.441 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -14.921 -1.130 -4.940 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -13.566 -2.197 -4.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -13.934 -1.920 -6.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -14.210 -3.536 -6.546 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -15.523 -2.502 -6.850 1.00 0.00 H new ATOM 1469 N THR A 98 -13.714 -5.247 0.336 1.00 0.00 N ATOM 1470 CA THR A 98 -14.275 -6.211 1.274 1.00 0.00 C ATOM 1471 C THR A 98 -13.904 -5.861 2.710 1.00 0.00 C ATOM 1472 O THR A 98 -14.606 -6.232 3.650 1.00 0.00 O ATOM 1473 CB THR A 98 -13.794 -7.641 0.965 1.00 0.00 C ATOM 1474 OG1 THR A 98 -12.389 -7.752 1.223 1.00 0.00 O ATOM 1475 CG2 THR A 98 -14.079 -8.008 -0.484 1.00 0.00 C ATOM 0 H THR A 98 -12.902 -5.585 -0.180 1.00 0.00 H new ATOM 0 HA THR A 98 -15.358 -6.168 1.161 1.00 0.00 H new ATOM 0 HB THR A 98 -14.338 -8.330 1.611 1.00 0.00 H new ATOM 0 HG1 THR A 98 -11.966 -6.875 1.112 1.00 0.00 H new ATOM 0 HG21 THR A 98 -13.730 -9.022 -0.678 1.00 0.00 H new ATOM 0 HG22 THR A 98 -15.152 -7.951 -0.669 1.00 0.00 H new ATOM 0 HG23 THR A 98 -13.560 -7.313 -1.144 1.00 0.00 H new ATOM 1483 N ALA A 99 -12.797 -5.144 2.872 1.00 0.00 N ATOM 1484 CA ALA A 99 -12.334 -4.742 4.195 1.00 0.00 C ATOM 1485 C ALA A 99 -13.290 -3.737 4.828 1.00 0.00 C ATOM 1486 O ALA A 99 -13.974 -2.977 4.142 1.00 0.00 O ATOM 1487 CB ALA A 99 -10.932 -4.158 4.108 1.00 0.00 C ATOM 0 H ALA A 99 -12.204 -4.830 2.104 1.00 0.00 H new ATOM 0 HA ALA A 99 -12.308 -5.628 4.829 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -10.599 -3.862 5.103 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -10.250 -4.907 3.705 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -10.941 -3.286 3.454 1.00 0.00 H new ATOM 1493 N PRO A 100 -13.340 -3.730 6.169 1.00 0.00 N ATOM 1494 CA PRO A 100 -14.209 -2.822 6.924 1.00 0.00 C ATOM 1495 C PRO A 100 -13.748 -1.372 6.836 1.00 0.00 C ATOM 1496 O PRO A 100 -12.643 -1.088 6.374 1.00 0.00 O ATOM 1497 CB PRO A 100 -14.093 -3.335 8.362 1.00 0.00 C ATOM 1498 CG PRO A 100 -12.769 -4.016 8.415 1.00 0.00 C ATOM 1499 CD PRO A 100 -12.552 -4.608 7.050 1.00 0.00 C ATOM 0 HA PRO A 100 -15.229 -2.819 6.539 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -14.146 -2.517 9.080 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -14.903 -4.024 8.603 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -11.977 -3.310 8.664 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -12.759 -4.790 9.182 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -11.497 -4.610 6.776 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -12.896 -5.641 7.000 1.00 0.00 H new ATOM 1507 N SER A 101 -14.601 -0.456 7.284 1.00 0.00 N ATOM 1508 CA SER A 101 -14.282 0.966 7.253 1.00 0.00 C ATOM 1509 C SER A 101 -12.811 1.200 7.584 1.00 0.00 C ATOM 1510 O SER A 101 -12.051 1.711 6.761 1.00 0.00 O ATOM 1511 CB SER A 101 -15.167 1.731 8.240 1.00 0.00 C ATOM 1512 OG SER A 101 -16.461 1.947 7.704 1.00 0.00 O ATOM 0 H SER A 101 -15.518 -0.674 7.673 1.00 0.00 H new ATOM 0 HA SER A 101 -14.473 1.334 6.245 1.00 0.00 H new ATOM 0 HB2 SER A 101 -15.245 1.172 9.172 1.00 0.00 H new ATOM 0 HB3 SER A 101 -14.705 2.689 8.481 1.00 0.00 H new ATOM 0 HG SER A 101 -17.007 2.436 8.354 1.00 0.00 H new ATOM 1518 N LYS A 102 -12.417 0.823 8.795 1.00 0.00 N ATOM 1519 CA LYS A 102 -11.037 0.990 9.237 1.00 0.00 C ATOM 1520 C LYS A 102 -10.149 -0.116 8.676 1.00 0.00 C ATOM 1521 O LYS A 102 -10.352 -1.296 8.964 1.00 0.00 O ATOM 1522 CB LYS A 102 -10.967 0.988 10.766 1.00 0.00 C ATOM 1523 CG LYS A 102 -9.632 1.464 11.313 1.00 0.00 C ATOM 1524 CD LYS A 102 -9.784 2.085 12.692 1.00 0.00 C ATOM 1525 CE LYS A 102 -10.201 3.545 12.603 1.00 0.00 C ATOM 1526 NZ LYS A 102 -11.666 3.691 12.381 1.00 0.00 N ATOM 0 H LYS A 102 -13.034 0.400 9.489 1.00 0.00 H new ATOM 0 HA LYS A 102 -10.675 1.948 8.863 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -11.759 1.625 11.159 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -11.160 -0.021 11.129 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -8.939 0.624 11.365 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -9.197 2.194 10.630 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -10.526 1.528 13.263 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -8.841 2.007 13.233 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -9.920 4.060 13.522 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -9.660 4.028 11.789 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -11.971 4.636 12.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -11.877 3.572 11.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -12.174 2.967 12.929 1.00 0.00 H new ATOM 1540 N VAL A 103 -9.163 0.273 7.874 1.00 0.00 N ATOM 1541 CA VAL A 103 -8.242 -0.685 7.275 1.00 0.00 C ATOM 1542 C VAL A 103 -6.794 -0.323 7.586 1.00 0.00 C ATOM 1543 O VAL A 103 -6.425 0.851 7.604 1.00 0.00 O ATOM 1544 CB VAL A 103 -8.424 -0.758 5.747 1.00 0.00 C ATOM 1545 CG1 VAL A 103 -7.671 -1.950 5.176 1.00 0.00 C ATOM 1546 CG2 VAL A 103 -9.901 -0.829 5.390 1.00 0.00 C ATOM 0 H VAL A 103 -8.982 1.245 7.624 1.00 0.00 H new ATOM 0 HA VAL A 103 -8.472 -1.659 7.708 1.00 0.00 H new ATOM 0 HB VAL A 103 -8.010 0.148 5.305 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -7.811 -1.985 4.096 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -6.609 -1.851 5.401 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -8.052 -2.869 5.622 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -10.011 -0.880 4.307 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -10.342 -1.717 5.842 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -10.409 0.059 5.765 1.00 0.00 H new ATOM 1556 N LYS A 104 -5.975 -1.341 7.830 1.00 0.00 N ATOM 1557 CA LYS A 104 -4.566 -1.133 8.139 1.00 0.00 C ATOM 1558 C LYS A 104 -3.700 -1.347 6.902 1.00 0.00 C ATOM 1559 O LYS A 104 -3.545 -2.473 6.427 1.00 0.00 O ATOM 1560 CB LYS A 104 -4.122 -2.081 9.255 1.00 0.00 C ATOM 1561 CG LYS A 104 -2.735 -1.777 9.795 1.00 0.00 C ATOM 1562 CD LYS A 104 -2.322 -2.775 10.865 1.00 0.00 C ATOM 1563 CE LYS A 104 -1.019 -2.367 11.534 1.00 0.00 C ATOM 1564 NZ LYS A 104 -1.239 -1.367 12.615 1.00 0.00 N ATOM 0 H LYS A 104 -6.264 -2.319 7.820 1.00 0.00 H new ATOM 0 HA LYS A 104 -4.442 -0.103 8.474 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -4.841 -2.028 10.073 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -4.141 -3.104 8.880 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -2.013 -1.798 8.979 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -2.718 -0.769 10.210 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -3.109 -2.852 11.615 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -2.209 -3.763 10.419 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -0.532 -3.249 11.949 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -0.342 -1.952 10.787 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -0.327 -1.115 13.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -1.680 -0.514 12.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -1.864 -1.772 13.341 1.00 0.00 H new ATOM 1578 N LEU A 105 -3.137 -0.261 6.384 1.00 0.00 N ATOM 1579 CA LEU A 105 -2.284 -0.330 5.202 1.00 0.00 C ATOM 1580 C LEU A 105 -0.811 -0.361 5.594 1.00 0.00 C ATOM 1581 O LEU A 105 -0.383 0.355 6.499 1.00 0.00 O ATOM 1582 CB LEU A 105 -2.555 0.863 4.284 1.00 0.00 C ATOM 1583 CG LEU A 105 -4.022 1.132 3.947 1.00 0.00 C ATOM 1584 CD1 LEU A 105 -4.250 2.616 3.705 1.00 0.00 C ATOM 1585 CD2 LEU A 105 -4.448 0.320 2.733 1.00 0.00 C ATOM 0 H LEU A 105 -3.256 0.678 6.764 1.00 0.00 H new ATOM 0 HA LEU A 105 -2.517 -1.252 4.669 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -2.141 1.757 4.751 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -2.011 0.709 3.352 1.00 0.00 H new ATOM 0 HG LEU A 105 -4.632 0.825 4.796 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -5.299 2.789 3.466 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -3.985 3.176 4.602 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -3.629 2.949 2.873 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -5.495 0.524 2.508 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -3.832 0.595 1.877 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -4.323 -0.742 2.943 1.00 0.00 H new ATOM 1597 N VAL A 106 -0.037 -1.195 4.906 1.00 0.00 N ATOM 1598 CA VAL A 106 1.389 -1.317 5.179 1.00 0.00 C ATOM 1599 C VAL A 106 2.210 -1.147 3.906 1.00 0.00 C ATOM 1600 O VAL A 106 2.277 -2.052 3.073 1.00 0.00 O ATOM 1601 CB VAL A 106 1.724 -2.679 5.815 1.00 0.00 C ATOM 1602 CG1 VAL A 106 3.217 -2.791 6.083 1.00 0.00 C ATOM 1603 CG2 VAL A 106 0.928 -2.879 7.096 1.00 0.00 C ATOM 0 H VAL A 106 -0.375 -1.796 4.155 1.00 0.00 H new ATOM 0 HA VAL A 106 1.645 -0.523 5.881 1.00 0.00 H new ATOM 0 HB VAL A 106 1.445 -3.466 5.114 1.00 0.00 H new ATOM 0 HG11 VAL A 106 3.434 -3.760 6.532 1.00 0.00 H new ATOM 0 HG12 VAL A 106 3.763 -2.696 5.145 1.00 0.00 H new ATOM 0 HG13 VAL A 106 3.525 -1.998 6.764 1.00 0.00 H new ATOM 0 HG21 VAL A 106 1.177 -3.846 7.532 1.00 0.00 H new ATOM 0 HG22 VAL A 106 1.174 -2.088 7.804 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -0.138 -2.846 6.871 1.00 0.00 H new ATOM 1613 N PHE A 107 2.833 0.017 3.761 1.00 0.00 N ATOM 1614 CA PHE A 107 3.650 0.306 2.588 1.00 0.00 C ATOM 1615 C PHE A 107 5.021 0.835 2.997 1.00 0.00 C ATOM 1616 O PHE A 107 5.275 1.088 4.175 1.00 0.00 O ATOM 1617 CB PHE A 107 2.946 1.325 1.688 1.00 0.00 C ATOM 1618 CG PHE A 107 2.701 2.647 2.357 1.00 0.00 C ATOM 1619 CD1 PHE A 107 3.687 3.620 2.379 1.00 0.00 C ATOM 1620 CD2 PHE A 107 1.485 2.917 2.964 1.00 0.00 C ATOM 1621 CE1 PHE A 107 3.465 4.838 2.995 1.00 0.00 C ATOM 1622 CE2 PHE A 107 1.257 4.133 3.581 1.00 0.00 C ATOM 1623 CZ PHE A 107 2.248 5.095 3.595 1.00 0.00 C ATOM 0 H PHE A 107 2.788 0.776 4.441 1.00 0.00 H new ATOM 0 HA PHE A 107 3.788 -0.623 2.035 1.00 0.00 H new ATOM 0 HB2 PHE A 107 3.548 1.485 0.794 1.00 0.00 H new ATOM 0 HB3 PHE A 107 1.993 0.911 1.360 1.00 0.00 H new ATOM 0 HD1 PHE A 107 4.640 3.425 1.910 1.00 0.00 H new ATOM 0 HD2 PHE A 107 0.706 2.169 2.955 1.00 0.00 H new ATOM 0 HE1 PHE A 107 4.243 5.587 3.007 1.00 0.00 H new ATOM 0 HE2 PHE A 107 0.305 4.330 4.051 1.00 0.00 H new ATOM 0 HZ PHE A 107 2.071 6.047 4.074 1.00 0.00 H new ATOM 1633 N ILE A 108 5.902 0.999 2.016 1.00 0.00 N ATOM 1634 CA ILE A 108 7.248 1.497 2.273 1.00 0.00 C ATOM 1635 C ILE A 108 7.485 2.829 1.569 1.00 0.00 C ATOM 1636 O ILE A 108 6.992 3.054 0.463 1.00 0.00 O ATOM 1637 CB ILE A 108 8.319 0.490 1.815 1.00 0.00 C ATOM 1638 CG1 ILE A 108 9.710 0.960 2.244 1.00 0.00 C ATOM 1639 CG2 ILE A 108 8.259 0.302 0.307 1.00 0.00 C ATOM 1640 CD1 ILE A 108 10.707 -0.166 2.404 1.00 0.00 C ATOM 0 H ILE A 108 5.708 0.794 1.036 1.00 0.00 H new ATOM 0 HA ILE A 108 7.331 1.638 3.351 1.00 0.00 H new ATOM 0 HB ILE A 108 8.119 -0.471 2.289 1.00 0.00 H new ATOM 0 HG12 ILE A 108 10.089 1.667 1.506 1.00 0.00 H new ATOM 0 HG13 ILE A 108 9.627 1.498 3.188 1.00 0.00 H new ATOM 0 HG21 ILE A 108 9.022 -0.413 -0.001 1.00 0.00 H new ATOM 0 HG22 ILE A 108 7.275 -0.074 0.026 1.00 0.00 H new ATOM 0 HG23 ILE A 108 8.437 1.258 -0.186 1.00 0.00 H new ATOM 0 HD11 ILE A 108 11.671 0.242 2.709 1.00 0.00 H new ATOM 0 HD12 ILE A 108 10.351 -0.862 3.163 1.00 0.00 H new ATOM 0 HD13 ILE A 108 10.819 -0.690 1.455 1.00 0.00 H new ATOM 1652 N ARG A 109 8.243 3.708 2.216 1.00 0.00 N ATOM 1653 CA ARG A 109 8.547 5.017 1.651 1.00 0.00 C ATOM 1654 C ARG A 109 9.936 5.029 1.020 1.00 0.00 C ATOM 1655 O ARG A 109 10.908 5.453 1.644 1.00 0.00 O ATOM 1656 CB ARG A 109 8.456 6.096 2.732 1.00 0.00 C ATOM 1657 CG ARG A 109 8.557 7.512 2.189 1.00 0.00 C ATOM 1658 CD ARG A 109 8.205 8.542 3.252 1.00 0.00 C ATOM 1659 NE ARG A 109 6.777 8.843 3.270 1.00 0.00 N ATOM 1660 CZ ARG A 109 6.157 9.400 4.305 1.00 0.00 C ATOM 1661 NH1 ARG A 109 6.837 9.714 5.399 1.00 0.00 N ATOM 1662 NH2 ARG A 109 4.854 9.644 4.246 1.00 0.00 N ATOM 0 H ARG A 109 8.658 3.537 3.132 1.00 0.00 H new ATOM 0 HA ARG A 109 7.813 5.228 0.873 1.00 0.00 H new ATOM 0 HB2 ARG A 109 7.511 5.986 3.264 1.00 0.00 H new ATOM 0 HB3 ARG A 109 9.252 5.937 3.460 1.00 0.00 H new ATOM 0 HG2 ARG A 109 9.569 7.693 1.826 1.00 0.00 H new ATOM 0 HG3 ARG A 109 7.888 7.624 1.336 1.00 0.00 H new ATOM 0 HD2 ARG A 109 8.510 8.172 4.231 1.00 0.00 H new ATOM 0 HD3 ARG A 109 8.766 9.458 3.069 1.00 0.00 H new ATOM 0 HE ARG A 109 6.225 8.613 2.444 1.00 0.00 H new ATOM 0 HH11 ARG A 109 7.839 9.528 5.448 1.00 0.00 H new ATOM 0 HH12 ARG A 109 6.358 10.141 6.192 1.00 0.00 H new ATOM 0 HH21 ARG A 109 4.328 9.404 3.406 1.00 0.00 H new ATOM 0 HH22 ARG A 109 4.379 10.072 5.041 1.00 0.00 H new ATOM 1676 N ASN A 110 10.021 4.559 -0.220 1.00 0.00 N ATOM 1677 CA ASN A 110 11.292 4.515 -0.935 1.00 0.00 C ATOM 1678 C ASN A 110 11.359 5.609 -1.995 1.00 0.00 C ATOM 1679 O ASN A 110 10.687 5.532 -3.023 1.00 0.00 O ATOM 1680 CB ASN A 110 11.486 3.145 -1.587 1.00 0.00 C ATOM 1681 CG ASN A 110 12.746 3.078 -2.428 1.00 0.00 C ATOM 1682 OD1 ASN A 110 12.691 2.813 -3.629 1.00 0.00 O ATOM 1683 ND2 ASN A 110 13.891 3.319 -1.799 1.00 0.00 N ATOM 0 H ASN A 110 9.226 4.203 -0.751 1.00 0.00 H new ATOM 0 HA ASN A 110 12.092 4.684 -0.214 1.00 0.00 H new ATOM 0 HB2 ASN A 110 11.529 2.380 -0.812 1.00 0.00 H new ATOM 0 HB3 ASN A 110 10.623 2.918 -2.212 1.00 0.00 H new ATOM 0 HD21 ASN A 110 14.771 3.288 -2.313 1.00 0.00 H new ATOM 0 HD22 ASN A 110 13.890 3.535 -0.802 1.00 0.00 H new ATOM 1690 N GLU A 111 12.174 6.627 -1.737 1.00 0.00 N ATOM 1691 CA GLU A 111 12.327 7.738 -2.669 1.00 0.00 C ATOM 1692 C GLU A 111 12.818 7.244 -4.027 1.00 0.00 C ATOM 1693 O GLU A 111 12.723 7.953 -5.029 1.00 0.00 O ATOM 1694 CB GLU A 111 13.304 8.773 -2.108 1.00 0.00 C ATOM 1695 CG GLU A 111 13.376 10.050 -2.929 1.00 0.00 C ATOM 1696 CD GLU A 111 12.078 10.833 -2.905 1.00 0.00 C ATOM 1697 OE1 GLU A 111 11.847 11.571 -1.925 1.00 0.00 O ATOM 1698 OE2 GLU A 111 11.292 10.707 -3.868 1.00 0.00 O ATOM 0 H GLU A 111 12.738 6.705 -0.891 1.00 0.00 H new ATOM 0 HA GLU A 111 11.351 8.205 -2.801 1.00 0.00 H new ATOM 0 HB2 GLU A 111 13.010 9.023 -1.089 1.00 0.00 H new ATOM 0 HB3 GLU A 111 14.298 8.330 -2.053 1.00 0.00 H new ATOM 0 HG2 GLU A 111 14.182 10.678 -2.548 1.00 0.00 H new ATOM 0 HG3 GLU A 111 13.627 9.801 -3.960 1.00 0.00 H new ATOM 1705 N ASP A 112 13.344 6.024 -4.052 1.00 0.00 N ATOM 1706 CA ASP A 112 13.850 5.434 -5.285 1.00 0.00 C ATOM 1707 C ASP A 112 12.747 4.674 -6.016 1.00 0.00 C ATOM 1708 O ASP A 112 12.892 4.326 -7.188 1.00 0.00 O ATOM 1709 CB ASP A 112 15.020 4.496 -4.985 1.00 0.00 C ATOM 1710 CG ASP A 112 16.103 5.166 -4.162 1.00 0.00 C ATOM 1711 OD1 ASP A 112 16.741 6.108 -4.676 1.00 0.00 O ATOM 1712 OD2 ASP A 112 16.312 4.748 -3.004 1.00 0.00 O ATOM 0 H ASP A 112 13.431 5.424 -3.231 1.00 0.00 H new ATOM 0 HA ASP A 112 14.199 6.242 -5.929 1.00 0.00 H new ATOM 0 HB2 ASP A 112 14.652 3.620 -4.451 1.00 0.00 H new ATOM 0 HB3 ASP A 112 15.447 4.142 -5.923 1.00 0.00 H new ATOM 1717 N ALA A 113 11.647 4.420 -5.316 1.00 0.00 N ATOM 1718 CA ALA A 113 10.519 3.703 -5.899 1.00 0.00 C ATOM 1719 C ALA A 113 9.851 4.527 -6.994 1.00 0.00 C ATOM 1720 O ALA A 113 9.553 4.017 -8.074 1.00 0.00 O ATOM 1721 CB ALA A 113 9.511 3.339 -4.819 1.00 0.00 C ATOM 0 H ALA A 113 11.512 4.700 -4.344 1.00 0.00 H new ATOM 0 HA ALA A 113 10.897 2.786 -6.351 1.00 0.00 H new ATOM 0 HB1 ALA A 113 8.674 2.804 -5.268 1.00 0.00 H new ATOM 0 HB2 ALA A 113 9.990 2.704 -4.074 1.00 0.00 H new ATOM 0 HB3 ALA A 113 9.146 4.248 -4.341 1.00 0.00 H new ATOM 1727 N VAL A 114 9.617 5.804 -6.708 1.00 0.00 N ATOM 1728 CA VAL A 114 8.984 6.699 -7.670 1.00 0.00 C ATOM 1729 C VAL A 114 9.550 6.491 -9.070 1.00 0.00 C ATOM 1730 O VAL A 114 8.867 6.722 -10.067 1.00 0.00 O ATOM 1731 CB VAL A 114 9.167 8.174 -7.268 1.00 0.00 C ATOM 1732 CG1 VAL A 114 8.418 8.474 -5.978 1.00 0.00 C ATOM 1733 CG2 VAL A 114 10.645 8.508 -7.126 1.00 0.00 C ATOM 0 H VAL A 114 9.856 6.242 -5.818 1.00 0.00 H new ATOM 0 HA VAL A 114 7.921 6.460 -7.673 1.00 0.00 H new ATOM 0 HB VAL A 114 8.750 8.801 -8.056 1.00 0.00 H new ATOM 0 HG11 VAL A 114 8.559 9.521 -5.710 1.00 0.00 H new ATOM 0 HG12 VAL A 114 7.356 8.276 -6.120 1.00 0.00 H new ATOM 0 HG13 VAL A 114 8.802 7.840 -5.179 1.00 0.00 H new ATOM 0 HG21 VAL A 114 10.756 9.554 -6.842 1.00 0.00 H new ATOM 0 HG22 VAL A 114 11.089 7.874 -6.358 1.00 0.00 H new ATOM 0 HG23 VAL A 114 11.150 8.335 -8.076 1.00 0.00 H new ATOM 1743 N ASN A 115 10.803 6.052 -9.136 1.00 0.00 N ATOM 1744 CA ASN A 115 11.462 5.813 -10.415 1.00 0.00 C ATOM 1745 C ASN A 115 11.101 4.435 -10.963 1.00 0.00 C ATOM 1746 O ASN A 115 10.967 4.254 -12.173 1.00 0.00 O ATOM 1747 CB ASN A 115 12.979 5.931 -10.261 1.00 0.00 C ATOM 1748 CG ASN A 115 13.395 7.244 -9.625 1.00 0.00 C ATOM 1749 OD1 ASN A 115 13.273 8.307 -10.233 1.00 0.00 O ATOM 1750 ND2 ASN A 115 13.889 7.174 -8.394 1.00 0.00 N ATOM 0 H ASN A 115 11.382 5.855 -8.320 1.00 0.00 H new ATOM 0 HA ASN A 115 11.116 6.568 -11.121 1.00 0.00 H new ATOM 0 HB2 ASN A 115 13.345 5.104 -9.653 1.00 0.00 H new ATOM 0 HB3 ASN A 115 13.449 5.840 -11.240 1.00 0.00 H new ATOM 0 HD21 ASN A 115 14.186 8.024 -7.914 1.00 0.00 H new ATOM 0 HD22 ASN A 115 13.972 6.270 -7.928 1.00 0.00 H new ATOM 1757 N GLN A 116 10.946 3.469 -10.064 1.00 0.00 N ATOM 1758 CA GLN A 116 10.601 2.108 -10.458 1.00 0.00 C ATOM 1759 C GLN A 116 9.146 2.023 -10.907 1.00 0.00 C ATOM 1760 O GLN A 116 8.842 1.446 -11.950 1.00 0.00 O ATOM 1761 CB GLN A 116 10.846 1.141 -9.298 1.00 0.00 C ATOM 1762 CG GLN A 116 12.272 1.172 -8.771 1.00 0.00 C ATOM 1763 CD GLN A 116 12.536 0.094 -7.738 1.00 0.00 C ATOM 1764 OE1 GLN A 116 11.964 -0.994 -7.800 1.00 0.00 O ATOM 1765 NE2 GLN A 116 13.406 0.392 -6.780 1.00 0.00 N ATOM 0 H GLN A 116 11.054 3.603 -9.059 1.00 0.00 H new ATOM 0 HA GLN A 116 11.238 1.827 -11.297 1.00 0.00 H new ATOM 0 HB2 GLN A 116 10.162 1.382 -8.485 1.00 0.00 H new ATOM 0 HB3 GLN A 116 10.610 0.128 -9.624 1.00 0.00 H new ATOM 0 HG2 GLN A 116 12.966 1.050 -9.603 1.00 0.00 H new ATOM 0 HG3 GLN A 116 12.471 2.149 -8.330 1.00 0.00 H new ATOM 0 HE21 GLN A 116 13.857 1.307 -6.767 1.00 0.00 H new ATOM 0 HE22 GLN A 116 13.623 -0.294 -6.057 1.00 0.00 H new ATOM 1774 N MET A 117 8.252 2.602 -10.112 1.00 0.00 N ATOM 1775 CA MET A 117 6.829 2.592 -10.429 1.00 0.00 C ATOM 1776 C MET A 117 6.576 3.182 -11.814 1.00 0.00 C ATOM 1777 O MET A 117 6.905 4.338 -12.075 1.00 0.00 O ATOM 1778 CB MET A 117 6.045 3.378 -9.377 1.00 0.00 C ATOM 1779 CG MET A 117 6.621 4.756 -9.093 1.00 0.00 C ATOM 1780 SD MET A 117 5.883 6.042 -10.119 1.00 0.00 S ATOM 1781 CE MET A 117 5.199 7.124 -8.866 1.00 0.00 C ATOM 0 H MET A 117 8.488 3.084 -9.244 1.00 0.00 H new ATOM 0 HA MET A 117 6.489 1.556 -10.427 1.00 0.00 H new ATOM 0 HB2 MET A 117 5.013 3.486 -9.711 1.00 0.00 H new ATOM 0 HB3 MET A 117 6.022 2.805 -8.450 1.00 0.00 H new ATOM 0 HG2 MET A 117 6.466 5.001 -8.042 1.00 0.00 H new ATOM 0 HG3 MET A 117 7.698 4.737 -9.260 1.00 0.00 H new ATOM 0 HE1 MET A 117 4.439 7.765 -9.314 1.00 0.00 H new ATOM 0 HE2 MET A 117 4.748 6.525 -8.075 1.00 0.00 H new ATOM 0 HE3 MET A 117 5.993 7.742 -8.446 1.00 0.00 H new ATOM 1791 N ALA A 118 5.991 2.379 -12.696 1.00 0.00 N ATOM 1792 CA ALA A 118 5.693 2.822 -14.052 1.00 0.00 C ATOM 1793 C ALA A 118 5.202 4.266 -14.062 1.00 0.00 C ATOM 1794 O ALA A 118 5.633 5.072 -14.886 1.00 0.00 O ATOM 1795 CB ALA A 118 4.659 1.906 -14.692 1.00 0.00 C ATOM 0 H ALA A 118 5.714 1.418 -12.496 1.00 0.00 H new ATOM 0 HA ALA A 118 6.613 2.775 -14.634 1.00 0.00 H new ATOM 0 HB1 ALA A 118 4.446 2.249 -15.704 1.00 0.00 H new ATOM 0 HB2 ALA A 118 5.047 0.888 -14.728 1.00 0.00 H new ATOM 0 HB3 ALA A 118 3.742 1.924 -14.103 1.00 0.00 H new ATOM 1801 N SER A 119 4.296 4.585 -13.143 1.00 0.00 N ATOM 1802 CA SER A 119 3.743 5.931 -13.050 1.00 0.00 C ATOM 1803 C SER A 119 2.750 6.189 -14.178 1.00 0.00 C ATOM 1804 O SER A 119 2.632 7.310 -14.672 1.00 0.00 O ATOM 1805 CB SER A 119 4.865 6.970 -13.094 1.00 0.00 C ATOM 1806 OG SER A 119 4.516 8.129 -12.357 1.00 0.00 O ATOM 0 H SER A 119 3.930 3.930 -12.453 1.00 0.00 H new ATOM 0 HA SER A 119 3.216 6.016 -12.100 1.00 0.00 H new ATOM 0 HB2 SER A 119 5.780 6.539 -12.688 1.00 0.00 H new ATOM 0 HB3 SER A 119 5.073 7.242 -14.129 1.00 0.00 H new ATOM 0 HG SER A 119 4.777 8.012 -11.420 1.00 0.00 H new ATOM 1812 N GLY A 120 2.035 5.142 -14.581 1.00 0.00 N ATOM 1813 CA GLY A 120 1.061 5.276 -15.648 1.00 0.00 C ATOM 1814 C GLY A 120 -0.201 4.479 -15.384 1.00 0.00 C ATOM 1815 O GLY A 120 -0.314 3.312 -15.761 1.00 0.00 O ATOM 0 H GLY A 120 2.113 4.204 -14.187 1.00 0.00 H new ATOM 0 HA2 GLY A 120 0.804 6.328 -15.771 1.00 0.00 H new ATOM 0 HA3 GLY A 120 1.506 4.945 -16.586 1.00 0.00 H new ATOM 1819 N PRO A 121 -1.178 5.113 -14.720 1.00 0.00 N ATOM 1820 CA PRO A 121 -2.455 4.474 -14.390 1.00 0.00 C ATOM 1821 C PRO A 121 -3.318 4.231 -15.624 1.00 0.00 C ATOM 1822 O PRO A 121 -4.444 3.746 -15.519 1.00 0.00 O ATOM 1823 CB PRO A 121 -3.128 5.486 -13.458 1.00 0.00 C ATOM 1824 CG PRO A 121 -2.527 6.798 -13.828 1.00 0.00 C ATOM 1825 CD PRO A 121 -1.112 6.504 -14.241 1.00 0.00 C ATOM 0 HA PRO A 121 -2.314 3.490 -13.943 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -4.209 5.493 -13.595 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -2.941 5.246 -12.411 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -3.082 7.266 -14.641 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -2.552 7.490 -12.986 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -0.773 7.183 -15.023 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -0.420 6.609 -13.406 1.00 0.00 H new ATOM 1833 N SER A 122 -2.782 4.570 -16.791 1.00 0.00 N ATOM 1834 CA SER A 122 -3.504 4.392 -18.045 1.00 0.00 C ATOM 1835 C SER A 122 -4.245 3.058 -18.060 1.00 0.00 C ATOM 1836 O SER A 122 -3.707 2.032 -17.644 1.00 0.00 O ATOM 1837 CB SER A 122 -2.538 4.464 -19.230 1.00 0.00 C ATOM 1838 OG SER A 122 -1.708 3.317 -19.282 1.00 0.00 O ATOM 0 H SER A 122 -1.849 4.970 -16.895 1.00 0.00 H new ATOM 0 HA SER A 122 -4.235 5.196 -18.132 1.00 0.00 H new ATOM 0 HB2 SER A 122 -3.102 4.551 -20.158 1.00 0.00 H new ATOM 0 HB3 SER A 122 -1.922 5.359 -19.147 1.00 0.00 H new ATOM 0 HG SER A 122 -1.101 3.387 -20.049 1.00 0.00 H new ATOM 1844 N SER A 123 -5.484 3.082 -18.541 1.00 0.00 N ATOM 1845 CA SER A 123 -6.302 1.876 -18.607 1.00 0.00 C ATOM 1846 C SER A 123 -5.509 0.714 -19.197 1.00 0.00 C ATOM 1847 O SER A 123 -5.134 0.735 -20.369 1.00 0.00 O ATOM 1848 CB SER A 123 -7.556 2.131 -19.445 1.00 0.00 C ATOM 1849 OG SER A 123 -8.471 1.054 -19.333 1.00 0.00 O ATOM 0 H SER A 123 -5.943 3.923 -18.891 1.00 0.00 H new ATOM 0 HA SER A 123 -6.600 1.612 -17.592 1.00 0.00 H new ATOM 0 HB2 SER A 123 -8.034 3.054 -19.118 1.00 0.00 H new ATOM 0 HB3 SER A 123 -7.277 2.269 -20.490 1.00 0.00 H new ATOM 0 HG SER A 123 -9.265 1.241 -19.876 1.00 0.00 H new ATOM 1855 N GLY A 124 -5.258 -0.301 -18.376 1.00 0.00 N ATOM 1856 CA GLY A 124 -4.512 -1.459 -18.833 1.00 0.00 C ATOM 1857 C GLY A 124 -5.413 -2.616 -19.213 1.00 0.00 C ATOM 1858 O GLY A 124 -5.459 -3.021 -20.375 1.00 0.00 O ATOM 0 H GLY A 124 -5.558 -0.342 -17.402 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -3.903 -1.179 -19.693 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -3.827 -1.779 -18.048 1.00 0.00 H new TER 1862 GLY A 124