Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ww1_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 5.A N ASP 24.A O.A no hydrogen 2.951 N/A SER 5.A N ASP 24.A O.B no hydrogen 2.954 N/A GLN 6.A NE2 TYR 90.A O no hydrogen 2.967 N/A SER 7.A N ARG 22.A O no hydrogen 3.049 N/A ARG 9.A NH1 GLN 6.A O no hydrogen 2.925 N/A ARG 9.A NH1 GLY 106.A O no hydrogen 3.052 N/A ARG 9.A NH2 GLN 6.A O no hydrogen 3.409 N/A TYR 10.A OH GLU 154.A OE2 no hydrogen 2.678 N/A LYS 11.A N ARG 108.A O no hydrogen 2.944 N/A ALA 13.A N THR 110.A O no hydrogen 2.882 N/A LYS 14.A N GLN 17.A OE1.A no hydrogen 2.891 N/A LYS 14.A NZ ASP 114.A OD1 no hydrogen 3.399 N/A ARG 15.A N THR 112.A O no hydrogen 2.815 N/A ARG 15.A NH1 GLU 113.A OE1 no hydrogen 3.280 N/A ARG 15.A NH1 GLU 113.A OE2 no hydrogen 2.766 N/A GLY 16.A N THR 82.A O no hydrogen 2.754 N/A GLN 17.A N LYS 14.A O no hydrogen 2.928 N/A GLN 17.A NE2.A ASP 18.A O no hydrogen 3.174 N/A VAL 19.A N ILE 79.A O no hydrogen 2.924 N/A LEU 21.A N LEU 77.A O no hydrogen 2.835 N/A ARG 22.A N SER 7.A O no hydrogen 2.821 N/A ARG 22.A NE ASP 24.A OD2.A no hydrogen 2.795 N/A ARG 22.A NH2 ASP 24.A OD1.A no hydrogen 2.739 N/A ARG 22.A NH2 ASP 24.A OD2.A no hydrogen 3.554 N/A CYS 23.A N SER 75.A O no hydrogen 2.786 N/A CYS 23.A SG SER 5.A O no hydrogen 3.949 N/A ASP 24.A N.A SER 5.A O no hydrogen 2.814 N/A ASP 24.A N.B SER 5.A O no hydrogen 2.819 N/A ILE 26.A N SER 94.A OG no hydrogen 3.180 N/A SER 27.A N GLY 1.A O no hydrogen 3.017 N/A SER 27.A OG.A GLY 1.A O no hydrogen 3.387 N/A HIS 29.A N ILE 26.A O no hydrogen 2.979 N/A HIS 29.A ND1 SER 94.A OG no hydrogen 2.837 N/A SER 31.A N SER 95.A O no hydrogen 3.093 N/A LEU 32.A N PHE 49.A O no hydrogen 2.989 N/A PHE 33.A N ALA 93.A O no hydrogen 2.749 N/A TRP 34.A N THR 47.A O no hydrogen 2.931 N/A TRP 34.A NE1 SER 75.A OG no hydrogen 2.898 N/A TYR 35.A N LEU 91.A O no hydrogen 2.734 N/A TYR 35.A OH GLN 101.A OE1 no hydrogen 2.737 N/A GLN 36.A N GLU 44.A O no hydrogen 2.873 N/A GLN 36.A NE2 TYR 90.A OH no hydrogen 2.898 N/A GLN 37.A N VAL 89.A O no hydrogen 2.740 N/A GLN 37.A NE2 GLN 41.A O no hydrogen 2.841 N/A GLN 41.A N ALA 38.A O no hydrogen 3.092 N/A GLN 41.A NE2 LEU 39.A O no hydrogen 3.552 N/A GLU 44.A N GLN 36.A O no hydrogen 2.707 N/A LEU 46.A N TRP 34.A O no hydrogen 2.871 N/A THR 47.A N TRP 34.A O no hydrogen 3.379 N/A THR 47.A OG1 ASP 56.A O no hydrogen 3.143 N/A TYR 48.A N ASP 56.A O no hydrogen 2.942 N/A PHE 49.A N LEU 32.A O no hydrogen 2.809 N/A GLN 50.A N ALA 53.A O no hydrogen 2.866 N/A ASN 51.A N VAL 30.A O no hydrogen 2.870 N/A GLU 52.A N GLU 52.A OE2 no hydrogen 2.688 N/A ALA 53.A N GLN 50.A O no hydrogen 2.982 N/A GLN 54.A NE2 THR 47.A OG1 no hydrogen 2.717 N/A SER 58.A N ASP 56.A OD1 no hydrogen 2.972 N/A SER 58.A OG ASP 56.A OD1 no hydrogen 2.673 N/A GLY 59.A N LEU 46.A O no hydrogen 2.997 N/A LEU 60.A N LYS 57.A O no hydrogen 3.191 N/A ARG 64.A NH1 GLN 80.A O no hydrogen 2.960 N/A ARG 64.A NH1 ASP 86.A OD2 no hydrogen 2.852 N/A ARG 64.A NH2 ASP 86.A OD1 no hydrogen 2.923 N/A ARG 64.A NH2 ASP 86.A OD2 no hydrogen 3.402 N/A PHE 66.A N LYS 78.A O no hydrogen 2.973 N/A GLU 68.A N THR 76.A O no hydrogen 2.857 N/A ARG 69.A NE SER 73.A O no hydrogen 2.871 N/A ARG 69.A NH1 VAL 30.A O no hydrogen 2.807 N/A ARG 69.A NH1 ASN 51.A O no hydrogen 2.888 N/A ARG 69.A NH2 HIS 29.A O no hydrogen 2.912 N/A GLY 72.A N ARG 69.A O no hydrogen 3.067 N/A SER 75.A N CYS 23.A O no hydrogen 2.902 N/A SER 75.A OG GLU 68.A O no hydrogen 2.830 N/A THR 76.A N GLU 68.A O no hydrogen 2.888 N/A LEU 77.A N LEU 21.A O no hydrogen 2.797 N/A LYS 78.A N PHE 66.A O no hydrogen 2.782 N/A LYS 78.A NZ GLU 68.A OE1 no hydrogen 2.940 N/A ILE 79.A N VAL 19.A O no hydrogen 2.933 N/A GLN 80.A N ARG 64.A O no hydrogen 2.740 N/A ARG 81.A N ASP 18.A OD1 no hydrogen 2.867 N/A ARG 81.A NH1.A GLN 80.A OE1 no hydrogen 3.468 N/A ARG 81.A NH2.A GLN 80.A OE1 no hydrogen 3.530 N/A ARG 81.A NH2.B GLN 80.A OE1 no hydrogen 2.908 N/A THR 82.A N GLN 17.A O no hydrogen 2.915 N/A THR 82.A OG1.A GLN 17.A O no hydrogen 2.872 N/A THR 82.A OG1.B ASP 86.A OD2 no hydrogen 2.699 N/A GLN 83.A N ASP 86.A OD2 no hydrogen 2.908 N/A GLN 84.A NE2 VAL 111.A O no hydrogen 3.235 N/A GLU 85.A N GLU 85.A OE1 no hydrogen 3.395 N/A ASP 86.A N GLN 83.A O no hydrogen 2.928 N/A SER 87.A N GLN 84.A O no hydrogen 2.998 N/A SER 87.A OG GLN 84.A O no hydrogen 2.890 N/A ALA 88.A N LEU 109.A O no hydrogen 3.060 N/A VAL 89.A N GLN 37.A O no hydrogen 2.942 N/A TYR 90.A N THR 107.A O no hydrogen 2.836 N/A TYR 90.A OH ASP 86.A O no hydrogen 2.616 N/A LEU 91.A N TYR 35.A O no hydrogen 2.774 N/A CYS 92.A N GLN 6.A OE1 no hydrogen 3.107 N/A CYS 92.A SG.A PHE 33.A O no hydrogen 3.640 N/A CYS 92.A SG.A ALA 93.A O no hydrogen 3.999 N/A ALA 93.A N PHE 33.A O no hydrogen 2.916 N/A SER 94.A N TYR 102.A O no hydrogen 2.929 N/A SER 94.A OG HIS 29.A ND1 no hydrogen 2.837 N/A SER 95.A N SER 31.A O no hydrogen 3.037 N/A LEU 99.A N SER 96.A O no hydrogen 3.212 N/A GLU 100.A N ASP 98.A OD1 no hydrogen 3.154 N/A TYR 102.A N SER 94.A O no hydrogen 2.889 N/A GLY 104.A N CYS 92.A O no hydrogen 2.786 N/A GLY 106.A N GLN 6.A OE1 no hydrogen 2.915 N/A THR 107.A N TYR 90.A O no hydrogen 2.911 N/A THR 107.A OG1 PRO 8.A O no hydrogen 2.698 N/A ARG 108.A N ARG 9.A O no hydrogen 2.933 N/A ARG 108.A NH1 ASP 151.A OD2 no hydrogen 3.389 N/A LEU 109.A N ALA 88.A O no hydrogen 2.956 N/A THR 110.A N LYS 11.A O no hydrogen 2.920 N/A THR 110.A OG1 HIS 152.A NE2 no hydrogen 2.989 N/A VAL 111.A N SER 87.A OG no hydrogen 2.875 N/A THR 112.A N ALA 13.A O no hydrogen 2.895 N/A LYS 116.A N ASP 114.A OD2 no hydrogen 2.872 N/A LYS 116.A NZ.A GLN 223.A OE1 no hydrogen 3.201 N/A ASN 117.A N ASP 114.A O no hydrogen 3.066 N/A ASN 117.A ND2 THR 112.A OG1 no hydrogen 2.968 N/A VAL 118.A N LEU 115.A O no hydrogen 2.975 N/A PHE 119.A N TYR 149.A O no hydrogen 2.863 N/A GLU 122.A N THR 146.A O no hydrogen 2.867 N/A ALA 124.A N LEU 144.A O no hydrogen 2.996 N/A PHE 126.A N VAL 142.A O no hydrogen 2.799 N/A ALA 131.A N SER 129.A OG no hydrogen 3.084 N/A GLU 132.A N SER 129.A OG no hydrogen 3.275 N/A ILE 133.A N SER 129.A O no hydrogen 3.174 N/A SER 134.A N GLU 130.A O no hydrogen 2.944 N/A SER 134.A OG.A GLU 130.A O no hydrogen 3.353 N/A SER 134.A OG.A ALA 131.A O no hydrogen 3.223 N/A SER 134.A OG.B GLU 130.A O no hydrogen 3.279 N/A HIS 135.A N ALA 131.A O no hydrogen 2.890 N/A THR 136.A N GLU 132.A O no hydrogen 2.820 N/A THR 136.A OG1 GLU 132.A O no hydrogen 2.798 N/A GLN 137.A N ILE 133.A O no hydrogen 2.809 N/A LYS 138.A N THR 136.A OG1 no hydrogen 3.004 N/A ALA 139.A N VAL 194.A O no hydrogen 2.860 N/A THR 140.A N GLU 132.A OE1 no hydrogen 2.821 N/A THR 140.A OG1 GLU 132.A OE1 no hydrogen 3.479 N/A THR 140.A OG1 GLU 132.A OE2 no hydrogen 2.704 N/A LEU 141.A N LEU 192.A O no hydrogen 2.836 N/A VAL 142.A N PHE 126.A O no hydrogen 3.086 N/A CYS 143.A N SER 190.A O no hydrogen 2.842 N/A CYS 143.A SG ALA 124.A O no hydrogen 3.843 N/A LEU 144.A N ALA 124.A O no hydrogen 2.870 N/A ALA 145.A N LEU 188.A O no hydrogen 2.847 N/A THR 146.A N GLU 122.A O no hydrogen 2.833 N/A GLY 147.A N GLU 177.A OE1 no hydrogen 2.952 N/A PHE 148.A N TYR 186.A O no hydrogen 3.114 N/A TYR 149.A N PHE 119.A O no hydrogen 2.906 N/A HIS 152.A N PRO 150.A O no hydrogen 2.848 N/A GLU 154.A N GLN 211.A O no hydrogen 2.902 N/A SER 156.A N GLN 209.A O no hydrogen 2.826 N/A TRP 157.A NE1 SER 190.A OG no hydrogen 2.896 N/A TRP 158.A N ARG 207.A O no hydrogen 2.853 N/A TRP 158.A NE1 SER 156.A OG no hydrogen 2.810 N/A VAL 159.A N LYS 162.A O no hydrogen 2.793 N/A ASN 160.A N HIS 205.A O no hydrogen 2.835 N/A ASN 160.A ND2 ASN 204.A OD1 no hydrogen 2.908 N/A LYS 162.A N VAL 159.A O no hydrogen 2.897 N/A VAL 164.A N TRP 157.A O no hydrogen 2.895 N/A VAL 168.A N HIS 165.A O no hydrogen 3.256 N/A CYS 169.A N ARG 191.A O no hydrogen 3.004 N/A THR 170.A OG1 SER 190.A OG no hydrogen 2.695 N/A ASP 171.A N SER 189.A O no hydrogen 3.007 N/A LEU 175.A N ALA 187.A O no hydrogen 2.818 N/A LYS 176.A NZ LEU 181.A O no hydrogen 2.821 N/A GLU 177.A N ARG 185.A O no hydrogen 2.921 N/A GLN 178.A N SER 184.A OG no hydrogen 2.874 N/A LEU 181.A N GLN 178.A O no hydrogen 3.204 N/A SER 184.A OG GLN 178.A OE1.A no hydrogen 3.258 N/A SER 184.A OG ARG 185.A O no hydrogen 2.768 N/A ARG 185.A N GLN 178.A OE1.A no hydrogen 2.966 N/A ARG 185.A NE GLY 147.A O no hydrogen 2.772 N/A ARG 185.A NH2 GLY 147.A O no hydrogen 3.108 N/A TYR 186.A N PHE 148.A O no hydrogen 2.786 N/A ALA 187.A N LEU 175.A O no hydrogen 2.923 N/A LEU 188.A N ALA 145.A O no hydrogen 2.806 N/A SER 189.A N ASP 171.A OD2 no hydrogen 2.853 N/A SER 189.A OG ASP 171.A OD1 no hydrogen 3.147 N/A SER 189.A OG ASP 171.A OD2 no hydrogen 2.739 N/A SER 190.A N CYS 143.A O no hydrogen 2.881 N/A SER 190.A OG CYS 169.A O no hydrogen 3.298 N/A SER 190.A OG THR 170.A OG1 no hydrogen 2.695 N/A ARG 191.A N CYS 169.A O no hydrogen 2.953 N/A ARG 191.A NH1 CYS 169.A O no hydrogen 3.349 N/A ARG 191.A NH1 ASP 171.A OD1 no hydrogen 2.952 N/A ARG 191.A NH1 SER 189.A O no hydrogen 3.500 N/A ARG 191.A NH2 ASP 171.A OD1 no hydrogen 3.100 N/A LEU 192.A N LEU 141.A O no hydrogen 2.970 N/A ARG 193.A N GLY 167.A O no hydrogen 2.860 N/A ARG 193.A NH1 GLU 132.A OE2 no hydrogen 2.888 N/A VAL 194.A N ALA 139.A O no hydrogen 2.935 N/A SER 195.A OG THR 197.A OG1.A no hydrogen 3.151 N/A ALA 196.A N GLN 137.A O no hydrogen 2.850 N/A THR 197.A OG1.A SER 195.A OG no hydrogen 3.151 N/A PHE 198.A N SER 195.A O no hydrogen 3.131 N/A PHE 198.A N SER 195.A OG no hydrogen 3.182 N/A TRP 199.A N SER 195.A O no hydrogen 3.144 N/A GLN 200.A N ALA 196.A O no hydrogen 2.814 N/A ASN 201.A N PHE 198.A O no hydrogen 3.325 N/A ARG 203.A N ASN 201.A OD1 no hydrogen 3.036 N/A ASN 204.A N ASN 201.A O no hydrogen 3.074 N/A ASN 204.A ND2 PHE 198.A O no hydrogen 2.859 N/A HIS 205.A N ASN 160.A OD1 no hydrogen 2.896 N/A HIS 205.A NE2 GLU 236.A OE2 no hydrogen 2.627 N/A PHE 206.A N ALA 237.A O no hydrogen 2.815 N/A ARG 207.A N TRP 158.A O no hydrogen 2.816 N/A ARG 207.A NE GLU 236.A OE2 no hydrogen 3.327 N/A ARG 207.A NH2 GLU 236.A OE2 no hydrogen 2.761 N/A CYS 208.A N ALA 235.A O no hydrogen 2.876 N/A GLN 209.A N SER 156.A O no hydrogen 2.874 N/A VAL 210.A N VAL 233.A O no hydrogen 2.817 N/A GLN 211.A N GLU 154.A O no hydrogen 2.854 N/A PHE 212.A N GLN 231.A O no hydrogen 2.835 N/A TYR 213.A N HIS 152.A O no hydrogen 2.978 N/A TYR 213.A OH GLU 154.A OE1 no hydrogen 2.674 N/A GLY 214.A N THR 230.A OG1 no hydrogen 2.987 N/A LEU 215.A N PRO 228.A O no hydrogen 2.929 N/A SER 216.A N ASP 219.A OD1 no hydrogen 2.847 N/A SER 216.A OG ASP 219.A OD1 no hydrogen 3.346 N/A ASP 219.A N SER 216.A O no hydrogen 3.177 N/A TRP 221.A NE1 ARG 225.A O no hydrogen 2.811 N/A ARG 225.A NH1 VAL 118.A O no hydrogen 2.996 N/A ARG 225.A NH2 VAL 118.A O no hydrogen 2.912 N/A LYS 227.A NZ SER 216.A O no hydrogen 2.898 N/A LYS 227.A NZ GLU 217.A O no hydrogen 3.421 N/A LYS 227.A NZ ASP 219.A O no hydrogen 2.781 N/A VAL 229.A N LYS 227.A O no hydrogen 2.865 N/A THR 230.A N LEU 215.A O no hydrogen 3.379 N/A GLN 231.A N PHE 212.A O no hydrogen 2.927 N/A GLN 231.A NE2 VAL 229.A O no hydrogen 2.907 N/A VAL 233.A N VAL 210.A O no hydrogen 2.867 N/A ALA 235.A N CYS 208.A O no hydrogen 3.012 N/A ALA 237.A N PHE 206.A O no hydrogen 2.908 N/A GLY 239.A N ASN 204.A O no hydrogen 2.905 N/A ARG 240.A N TRP 199.A O no hydrogen 3.020 N/A