Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4k0w_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A N ILE 31.A O no hydrogen 3.320 N/A VAL 3.A N ILE 31.A O no hydrogen 3.117 N/A GLY 5.A N LEU 33.A O no hydrogen 2.961 N/A ASN 7.A ND2 GLN 4.A OE1 no hydrogen 2.891 N/A ASN 7.A ND2 GLY 35.A O no hydrogen 2.966 N/A HIS 11.A N ASN 7.A O no hydrogen 3.053 N/A TYR 13.A N VAL 9.A O no hydrogen 3.235 N/A PHE 14.A N ILE 10.A O no hydrogen 3.362 N/A ASP 15.A N HIS 11.A O no hydrogen 3.044 N/A GLU 16.A N GLN 12.A O no hydrogen 2.875 N/A LYS 17.A N PHE 14.A O no hydrogen 2.994 N/A LYS 17.A NZ GLU 222.A OE1 no hydrogen 3.502 N/A LYS 17.A NZ GLU 222.A OE2 no hydrogen 2.783 N/A ASN 18.A N ASP 15.A O no hydrogen 2.880 N/A THR 19.A OG1 GLU 210.A O no hydrogen 2.782 N/A SER 20.A N.C THR 19.A OG1 no hydrogen 2.915 N/A GLY 21.A N ASN 36.A OD1 no hydrogen 2.858 N/A VAL 22.A N ASN 208.A O no hydrogen 2.836 N/A LEU 23.A N TYR 34.A O no hydrogen 2.794 N/A VAL 24.A N ALA 206.A O no hydrogen 2.838 N/A ILE 25.A N ASN 32.A O no hydrogen 2.892 N/A GLN 26.A N ALA 204.A O no hydrogen 2.851 N/A GLN 26.A NE2 ASP 28.A O.A no hydrogen 3.557 N/A GLN 26.A NE2 ASP 28.A O.B no hydrogen 2.958 N/A GLN 26.A NE2 GLU 139.A OE1.B no hydrogen 3.218 N/A THR 27.A N.A LYS 30.A O no hydrogen 2.945 N/A THR 27.A N.B LYS 30.A O no hydrogen 2.883 N/A THR 27.A OG1.A ASP 28.A OD1.B no hydrogen 2.642 N/A LYS 30.A N THR 27.A O.B no hydrogen 3.084 N/A ASN 32.A N ILE 25.A O no hydrogen 2.857 N/A ASN 32.A ND2 VAL 3.A O no hydrogen 3.145 N/A LEU 33.A N VAL 3.A O no hydrogen 2.951 N/A TYR 34.A N LEU 23.A O no hydrogen 2.871 N/A GLY 35.A N ASN 7.A OD1 no hydrogen 2.792 N/A ASN 36.A N GLY 21.A O no hydrogen 3.069 N/A ASN 36.A ND2 ASP 15.A OD1 no hydrogen 2.871 N/A ASN 36.A ND2 THR 19.A O no hydrogen 2.906 N/A ALA 37.A N GLY 21.A O no hydrogen 3.065 N/A ARG 40.A N ALA 37.A O no hydrogen 2.978 N/A ARG 40.A NE ASN 208.A O no hydrogen 3.460 N/A ARG 40.A NE ASN 208.A OD1 no hydrogen 2.930 N/A ARG 40.A NH1 SER 20.A OG.C no hydrogen 3.305 N/A ARG 40.A NH2 ASN 208.A OD1 no hydrogen 2.851 N/A ALA 41.A N LEU 38.A O no hydrogen 3.039 N/A ASN 42.A N.B SER 39.A O.B no hydrogen 3.422 N/A THR 43.A N ARG 40.A O no hydrogen 3.049 N/A THR 43.A OG1 SER 39.A O.A no hydrogen 2.767 N/A THR 43.A OG1 SER 39.A O.B no hydrogen 2.747 N/A TYR 45.A N VAL 132.A O no hydrogen 2.939 N/A ALA 48.A N TRP 125.A O no hydrogen 2.748 N/A THR 50.A N PRO 47.A O no hydrogen 3.154 N/A THR 50.A OG1 PRO 47.A O no hydrogen 2.682 N/A THR 50.A OG1 GLU 137.A OE1 no hydrogen 2.637 N/A THR 50.A OG1 GLU 137.A OE2 no hydrogen 3.403 N/A PHE 51.A N ALA 48.A O no hydrogen 2.964 N/A LYS 52.A N.A SER 49.A O no hydrogen 2.995 N/A LYS 52.A N.B SER 49.A O no hydrogen 2.986 N/A LYS 52.A NZ.A ALA 82.A O no hydrogen 2.845 N/A LYS 52.A NZ.A MET 83.A O no hydrogen 2.942 N/A LYS 52.A NZ.B ALA 82.A O no hydrogen 2.991 N/A LYS 52.A NZ.B MET 83.A O no hydrogen 3.366 N/A MET 53.A N THR 50.A O no hydrogen 3.269 N/A ASN 55.A N PHE 51.A O no hydrogen 2.900 N/A ASN 55.A ND2 TYR 91.A O no hydrogen 3.112 N/A ALA 56.A N LYS 52.A O.A no hydrogen 2.932 N/A ALA 56.A N LYS 52.A O.B no hydrogen 2.926 N/A LEU 57.A N MET 53.A O no hydrogen 3.108 N/A ILE 58.A N LEU 54.A O no hydrogen 2.906 N/A GLY 59.A N ASN 55.A O no hydrogen 2.850 N/A LEU 60.A N ALA 56.A O no hydrogen 2.900 N/A GLU 61.A N LEU 57.A O no hydrogen 2.833 N/A ASN 62.A N ILE 58.A O no hydrogen 3.055 N/A ASN 62.A ND2 ILE 58.A O no hydrogen 2.913 N/A ASN 62.A ND2 GLU 106.A OE2 no hydrogen 2.938 N/A GLN 63.A N LEU 60.A O no hydrogen 3.069 N/A LYS 64.A N GLY 59.A O no hydrogen 2.862 N/A THR 65.A OG1 ASP 66.A O no hydrogen 3.405 N/A THR 65.A OG1 GLU 69.A OE2 no hydrogen 2.762 N/A ASN 68.A N ASP 66.A OD1 no hydrogen 2.785 N/A GLU 69.A N ASP 66.A O no hydrogen 3.306 N/A PHE 71.A N MET 77.A O.A no hydrogen 2.726 N/A PHE 71.A N MET 77.A O.B no hydrogen 2.796 N/A TRP 73.A N ASP 76.A OD1 no hydrogen 2.834 N/A MET 77.A N.A PHE 71.A O no hydrogen 3.043 N/A MET 77.A N.B PHE 71.A O no hydrogen 3.092 N/A THR 78.A N GLU 81.A OE1 no hydrogen 3.002 N/A GLU 81.A N THR 78.A OG1 no hydrogen 3.058 N/A ALA 82.A N THR 78.A O no hydrogen 2.893 N/A MET 83.A N GLY 80.A O no hydrogen 3.187 N/A LEU 85.A N ALA 82.A O no hydrogen 3.301 N/A TYR 91.A N ALA 87.A O no hydrogen 2.981 N/A TYR 91.A OH LEU 79.A O no hydrogen 2.833 N/A GLN 92.A N VAL 88.A O.A no hydrogen 2.501 N/A GLN 92.A N VAL 88.A O.B no hydrogen 2.492 N/A GLN 92.A NE2 ASP 122.A O no hydrogen 2.514 N/A GLU 93.A N.A PRO 89.A O no hydrogen 2.569 N/A GLU 93.A N.B PRO 89.A O no hydrogen 2.652 N/A LEU 94.A N VAL 90.A O no hydrogen 2.899 N/A ALA 95.A N TYR 91.A O no hydrogen 2.908 N/A ARG 96.A N.A GLN 92.A O no hydrogen 3.040 N/A ARG 96.A N.B GLN 92.A O no hydrogen 3.047 N/A ARG 96.A NE.B ASP 122.A OD2 no hydrogen 2.996 N/A ARG 96.A NH1.A GLN 92.A OE1 no hydrogen 3.487 N/A ARG 96.A NH2.B ASP 122.A OD2 no hydrogen 3.373 N/A ARG 97.A N GLU 93.A O.A no hydrogen 3.155 N/A ARG 97.A N GLU 93.A O.B no hydrogen 3.001 N/A ARG 97.A NE GLU 93.A OE1.B no hydrogen 2.987 N/A ARG 97.A NH1 LYS 64.A O no hydrogen 2.866 N/A ARG 97.A NH1 GLU 69.A OE1 no hydrogen 3.229 N/A ARG 97.A NH1 GLU 69.A OE2 no hydrogen 2.882 N/A ARG 97.A NH2 GLU 69.A OE1 no hydrogen 2.785 N/A ARG 97.A NH2 GLU 93.A OE2.A no hydrogen 3.034 N/A ILE 98.A N.A LEU 94.A O no hydrogen 3.032 N/A ILE 98.A N.B LEU 94.A O no hydrogen 2.997 N/A GLY 99.A N ALA 95.A O no hydrogen 2.872 N/A MET 103.A N GLY 99.A O no hydrogen 3.059 N/A GLN 104.A N LEU 100.A O no hydrogen 2.945 N/A GLN 104.A NE2 GLN 104.A O no hydrogen 2.982 N/A GLN 104.A NE2 ALA 115.A O no hydrogen 2.824 N/A LYS 105.A N ASP 101.A O no hydrogen 3.088 N/A GLU 106.A N LEU 102.A O no hydrogen 2.910 N/A VAL 107.A N MET 103.A O no hydrogen 2.870 N/A LYS 108.A N GLN 104.A O no hydrogen 2.963 N/A ARG 109.A N LYS 105.A O no hydrogen 2.902 N/A ARG 109.A NE GLU 106.A OE1 no hydrogen 3.277 N/A ARG 109.A NH1 PRO 150.A O no hydrogen 2.836 N/A ARG 109.A NH2 GLU 106.A OE1 no hydrogen 2.865 N/A ARG 109.A NH2 PRO 150.A O no hydrogen 2.992 N/A ILE 110.A N GLU 106.A O no hydrogen 2.921 N/A GLY 111.A N VAL 107.A O no hydrogen 2.865 N/A PHE 112.A N VAL 107.A O no hydrogen 3.323 N/A ASN 114.A N LYS 131.A O no hydrogen 2.816 N/A ASN 114.A ND2 PRO 129.A O no hydrogen 3.034 N/A ALA 115.A N PHE 112.A O no hydrogen 2.898 N/A GLU 116.A N.A ASN 114.A OD1 no hydrogen 3.065 N/A GLU 116.A N.B ASN 114.A OD1 no hydrogen 3.094 N/A ILE 117.A N GLN 104.A OE1 no hydrogen 3.131 N/A GLN 120.A NE2 ASP 122.A OD1 no hydrogen 2.826 N/A LEU 126.A N ASN 123.A O no hydrogen 2.933 N/A VAL 127.A N ASN 123.A O no hydrogen 3.268 N/A LYS 131.A N ASN 114.A OD1 no hydrogen 3.089 N/A VAL 132.A N TYR 45.A O no hydrogen 2.841 N/A THR 133.A N GLN 136.A OE1.A no hydrogen 2.940 N/A ILE 135.A N ALA 41.A O no hydrogen 3.130 N/A GLN 136.A N.A THR 133.A OG1 no hydrogen 2.942 N/A GLN 136.A N.B THR 133.A OG1 no hydrogen 2.923 N/A GLU 137.A N THR 133.A O no hydrogen 2.889 N/A VAL 138.A N PRO 134.A O no hydrogen 2.930 N/A GLU 139.A N.A ILE 135.A O no hydrogen 3.090 N/A GLU 139.A N.B ILE 135.A O no hydrogen 3.131 N/A PHE 140.A N GLN 136.A O.A no hydrogen 2.912 N/A PHE 140.A N GLN 136.A O.B no hydrogen 3.256 N/A VAL 141.A N GLU 137.A O no hydrogen 2.916 N/A SER 142.A N.A VAL 138.A O no hydrogen 2.945 N/A SER 142.A N.B VAL 138.A O no hydrogen 2.959 N/A SER 142.A OG.A VAL 138.A O no hydrogen 3.005 N/A GLN 143.A N GLU 139.A O.A no hydrogen 3.064 N/A GLN 143.A N GLU 139.A O.B no hydrogen 2.982 N/A GLN 143.A NE2 GLU 139.A O.A no hydrogen 3.576 N/A GLN 143.A NE2 GLU 139.A O.B no hydrogen 3.544 N/A LEU 144.A N PHE 140.A O no hydrogen 2.945 N/A ALA 145.A N VAL 141.A O no hydrogen 2.890 N/A HIS 146.A N SER 142.A O.A no hydrogen 3.014 N/A HIS 146.A N SER 142.A O.B no hydrogen 3.008 N/A HIS 146.A ND1 SER 142.A O.A no hydrogen 2.907 N/A HIS 146.A ND1 SER 142.A O.B no hydrogen 2.905 N/A THR 147.A N LEU 144.A O no hydrogen 2.941 N/A GLN 148.A N GLN 143.A O no hydrogen 2.844 N/A LEU 149.A N GLN 156.A OE1 no hydrogen 3.105 N/A PHE 151.A N LEU 149.A O no hydrogen 2.892 N/A SER 152.A N GLU 61.A OE1 no hydrogen 2.787 N/A LYS 154.A NZ.C ASN 158.A OD1 no hydrogen 2.907 N/A VAL 155.A N SER 152.A OG no hydrogen 3.035 N/A GLN 156.A N SER 152.A O no hydrogen 2.986 N/A GLN 156.A NE2 LEU 149.A O no hydrogen 2.997 N/A GLN 156.A NE2 PHE 151.A O no hydrogen 2.946 N/A GLN 156.A NE2 SER 152.A O no hydrogen 3.517 N/A ALA 157.A N GLU 153.A O no hydrogen 2.898 N/A ASN 158.A N LYS 154.A O.A no hydrogen 2.894 N/A ASN 158.A N LYS 154.A O.C no hydrogen 2.880 N/A VAL 159.A N VAL 155.A O no hydrogen 2.989 N/A LYS 160.A N GLN 156.A O no hydrogen 2.923 N/A LYS 160.A NZ.A GLU 196.A OE1.B no hydrogen 3.294 N/A LYS 160.A NZ.B LEU 144.A O no hydrogen 3.531 N/A LYS 160.A NZ.C GLU 196.A OE1.B no hydrogen 2.780 N/A LYS 160.A NZ.D ALA 145.A O no hydrogen 2.964 N/A ASN 161.A N ALA 157.A O no hydrogen 3.005 N/A MET 162.A N VAL 159.A O no hydrogen 2.965 N/A LEU 163.A N LYS 160.A O no hydrogen 2.964 N/A LEU 165.A N ILE 173.A O no hydrogen 2.719 N/A GLU 166.A N.A ILE 173.A O no hydrogen 3.361 N/A GLU 166.A N.B ILE 173.A O no hydrogen 3.343 N/A SER 168.A N TYR 171.A O no hydrogen 3.087 N/A TYR 171.A N SER 168.A O no hydrogen 2.947 N/A LYS 172.A N GLU 196.A O.A no hydrogen 2.970 N/A LYS 172.A N GLU 196.A O.B no hydrogen 2.974 N/A ILE 173.A N GLU 166.A O.A no hydrogen 2.936 N/A ILE 173.A N GLU 166.A O.B no hydrogen 2.922 N/A PHE 174.A N TRP 194.A O no hydrogen 2.850 N/A GLY 175.A N LEU 163.A O no hydrogen 2.830 N/A LYS 176.A N THR 192.A O no hydrogen 2.828 N/A LYS 176.A NZ THR 177.A O no hydrogen 2.892 N/A GLY 178.A N TRP 190.A O no hydrogen 2.968 N/A TRP 179.A NE1 GLN 187.A OE1 no hydrogen 2.827 N/A ALA 180.A N VAL 188.A O.A no hydrogen 2.847 N/A ALA 180.A N VAL 188.A O.B no hydrogen 2.838 N/A GLN 187.A NE2 SER 213.A OG no hydrogen 3.019 N/A VAL 188.A N.A ALA 180.A O no hydrogen 3.174 N/A VAL 188.A N.B ALA 180.A O no hydrogen 3.121 N/A GLY 189.A N MET 209.A O no hydrogen 2.826 N/A TRP 190.A N GLY 178.A O no hydrogen 2.807 N/A TRP 190.A NE1 VAL 46.A O no hydrogen 2.815 N/A LEU 191.A N LEU 207.A O no hydrogen 2.990 N/A THR 192.A N LYS 176.A O no hydrogen 3.042 N/A THR 192.A OG1 GLU 137.A OE2 no hydrogen 2.863 N/A GLY 193.A N PHE 205.A O no hydrogen 2.871 N/A TRP 194.A N PHE 174.A O no hydrogen 2.843 N/A TRP 194.A NE1 GLU 196.A OE1.B no hydrogen 2.994 N/A VAL 195.A N VAL 203.A O no hydrogen 2.772 N/A GLU 196.A N.A LYS 172.A O no hydrogen 2.844 N/A GLU 196.A N.B LYS 172.A O no hydrogen 2.843 N/A GLN 197.A N LYS 201.A O no hydrogen 2.843 N/A GLN 197.A NE2 ILE 233.A O no hydrogen 2.913 N/A GLY 200.A N GLN 197.A O no hydrogen 2.887 N/A LYS 201.A N ASP 199.A OD1 no hydrogen 3.097 N/A LYS 201.A NZ ASP 199.A OD2 no hydrogen 3.001 N/A VAL 203.A N VAL 195.A O no hydrogen 2.941 N/A ALA 204.A N GLN 26.A O no hydrogen 2.930 N/A PHE 205.A N GLY 193.A O no hydrogen 2.801 N/A ALA 206.A N VAL 24.A O no hydrogen 2.867 N/A LEU 207.A N LEU 191.A O no hydrogen 2.822 N/A ASN 208.A N VAL 22.A O no hydrogen 2.928 N/A MET 209.A N GLY 189.A O no hydrogen 2.880 N/A GLU 210.A N SER 20.A O.A no hydrogen 2.888 N/A GLU 210.A N SER 20.A O.B no hydrogen 2.877 N/A GLU 210.A N SER 20.A O.C no hydrogen 2.857 N/A MET 211.A N GLN 187.A O no hydrogen 3.202 N/A ARG 212.A NE GLU 214.A OE2.A no hydrogen 3.049 N/A ARG 212.A NH1 ASN 18.A O no hydrogen 3.003 N/A ARG 212.A NH2 LYS 17.A O no hydrogen 3.250 N/A ARG 212.A NH2 ASN 18.A O no hydrogen 3.099 N/A GLU 214.A N.A GLU 214.A OE1.A no hydrogen 2.898 N/A MET 215.A N ARG 212.A O no hydrogen 3.023 N/A ILE 219.A N PRO 216.A O no hydrogen 2.994 N/A ARG 220.A NE ALA 217.A O no hydrogen 3.018 N/A ARG 220.A NH1 ALA 217.A O no hydrogen 3.009 N/A ARG 220.A NH2 GLY 178.A O no hydrogen 2.885 N/A ASN 221.A ND2 GLU 166.A OE2.A no hydrogen 2.743 N/A GLU 222.A N SER 218.A O no hydrogen 2.873 N/A LEU 223.A N.A ILE 219.A O no hydrogen 3.035 N/A LEU 223.A N.B ILE 219.A O no hydrogen 3.037 N/A LEU 224.A N ARG 220.A O no hydrogen 2.870 N/A MET 225.A N ASN 221.A O no hydrogen 2.857 N/A LYS 226.A N.A GLU 222.A O no hydrogen 3.145 N/A LYS 226.A N.B GLU 222.A O no hydrogen 3.188 N/A SER 227.A N LEU 223.A O.A no hydrogen 3.063 N/A SER 227.A N LEU 223.A O.B no hydrogen 3.054 N/A SER 227.A OG LEU 223.A O.A no hydrogen 2.844 N/A SER 227.A OG LEU 223.A O.B no hydrogen 2.840 N/A LEU 228.A N LEU 224.A O no hydrogen 2.789 N/A LYS 229.A N MET 225.A O no hydrogen 2.983 N/A GLN 230.A N LYS 226.A O.A no hydrogen 3.060 N/A GLN 230.A N LYS 226.A O.B no hydrogen 3.042 N/A LEU 231.A N SER 227.A O no hydrogen 2.982 N/A ASN 232.A N LYS 229.A O no hydrogen 2.955 N/A ILE 233.A N LEU 228.A O no hydrogen 2.920 N/A ILE 234.A N LEU 228.A O no hydrogen 3.506 N/A