Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3w6z_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 12.A N PRO 9.A O no hydrogen 3.221 N/A SER 12.A OG PRO 9.A O no hydrogen 2.789 N/A HIS 13.A N ARG 10.A O no hydrogen 3.114 N/A MET 14.A N SER 12.A OG no hydrogen 2.978 N/A ARG 15.A N ASP 71.A OD2 no hydrogen 2.992 N/A ARG 15.A NE ASP 71.A OD2 no hydrogen 2.925 N/A ARG 15.A NH2 ASP 71.A OD1 no hydrogen 2.996 N/A VAL 16.A N PHE 37.A O no hydrogen 2.920 N/A GLY 17.A N VAL 72.A O no hydrogen 2.846 N/A PHE 18.A N ALA 40.A O no hydrogen 2.940 N/A ILE 19.A N ILE 74.A O no hydrogen 2.831 N/A GLY 20.A N TYR 42.A O no hydrogen 3.152 N/A LEU 21.A N ASN 43.A OD1 no hydrogen 2.923 N/A GLY 26.A N GLY 22.A O no hydrogen 2.995 N/A MET 28.A N MET 24.A O no hydrogen 3.060 N/A ALA 29.A N GLY 25.A O no hydrogen 2.881 N/A THR 30.A N GLY 26.A O no hydrogen 2.927 N/A THR 30.A OG1 GLY 26.A O no hydrogen 2.866 N/A HIS 31.A N PRO 27.A O no hydrogen 2.955 N/A HIS 31.A ND1 PRO 27.A O no hydrogen 3.102 N/A LEU 32.A N MET 28.A O no hydrogen 3.052 N/A LEU 33.A N ALA 29.A O no hydrogen 2.871 N/A LYS 34.A N THR 30.A O no hydrogen 2.902 N/A ALA 35.A N HIS 31.A O no hydrogen 3.091 N/A GLY 36.A N LEU 33.A O no hydrogen 3.063 N/A PHE 37.A N LEU 32.A O no hydrogen 2.962 N/A ALA 39.A N VAL 16.A O no hydrogen 2.836 N/A ALA 40.A N VAL 16.A O no hydrogen 3.297 N/A VAL 41.A N TYR 58.A O no hydrogen 2.906 N/A TYR 42.A N PHE 18.A O no hydrogen 2.938 N/A ASN 43.A ND2 THR 45.A O no hydrogen 2.907 N/A LYS 48.A N THR 45.A O no hydrogen 3.391 N/A THR 49.A N ARG 46.A O no hydrogen 2.891 N/A THR 49.A OG1 ARG 46.A O no hydrogen 2.700 N/A LYS 50.A N GLU 47.A O no hydrogen 3.118 N/A ALA 53.A N THR 49.A O no hydrogen 2.970 N/A GLU 54.A N LYS 50.A O no hydrogen 2.949 N/A ALA 55.A N PHE 52.A O no hydrogen 2.981 N/A GLY 56.A N ALA 53.A O no hydrogen 2.883 N/A VAL 57.A N PHE 52.A O no hydrogen 2.975 N/A TYR 58.A N ALA 39.A O no hydrogen 3.197 N/A TYR 58.A OH ASP 65.A OD2 no hydrogen 2.654 N/A ALA 60.A N VAL 41.A O no hydrogen 2.936 N/A GLU 61.A N ASP 65.A OD2 no hydrogen 2.937 N/A ALA 64.A N SER 91.A O no hydrogen 2.916 N/A ASP 65.A N SER 62.A OG no hydrogen 2.995 N/A LEU 66.A N SER 62.A O no hydrogen 3.050 N/A ALA 67.A N PRO 63.A O no hydrogen 2.885 N/A LYS 68.A N ALA 64.A O no hydrogen 3.182 N/A LYS 68.A NZ ASP 65.A OD1 no hydrogen 3.033 N/A ARG 69.A N LEU 66.A O no hydrogen 3.019 N/A ARG 69.A NE ASP 65.A O no hydrogen 3.199 N/A ARG 69.A NE ASP 65.A OD1 no hydrogen 3.124 N/A ARG 69.A NH2 ASP 65.A OD1 no hydrogen 2.989 N/A VAL 70.A N ALA 67.A O no hydrogen 3.473 N/A ASP 71.A N ARG 15.A O no hydrogen 2.849 N/A VAL 72.A N ARG 15.A O no hydrogen 3.090 N/A VAL 73.A N ILE 102.A O no hydrogen 2.778 N/A ILE 74.A N GLY 17.A O no hydrogen 2.874 N/A VAL 75.A N VAL 104.A O no hydrogen 2.932 N/A MET 76.A N ILE 19.A O no hydrogen 2.829 N/A ASP 79.A N ASP 82.A OD2 no hydrogen 2.885 N/A ALA 80.A N ASP 79.A OD1 no hydrogen 2.726 N/A VAL 83.A N ASP 79.A O no hydrogen 3.064 N/A GLU 84.A N ALA 80.A O no hydrogen 2.857 N/A GLN 85.A N PRO 81.A O no hydrogen 2.933 N/A VAL 86.A N ASP 82.A O no hydrogen 3.054 N/A LEU 87.A N VAL 83.A O no hydrogen 2.869 N/A PHE 88.A N GLU 84.A O no hydrogen 2.767 N/A GLY 89.A N GLN 85.A O no hydrogen 2.922 N/A GLY 92.A N GLY 89.A O no hydrogen 2.829 N/A VAL 93.A N VAL 86.A O no hydrogen 2.815 N/A VAL 94.A N LEU 87.A O no hydrogen 3.008 N/A GLU 95.A N GLY 92.A O no hydrogen 2.903 N/A GLY 96.A N VAL 93.A O no hydrogen 3.046 N/A ALA 97.A N VAL 93.A O no hydrogen 2.891 N/A ARG 98.A NH1 LYS 68.A O no hydrogen 2.578 N/A ARG 98.A NH2 LYS 68.A O no hydrogen 3.188 N/A GLY 100.A N GLY 125.A O no hydrogen 2.875 N/A LEU 101.A N ARG 98.A O no hydrogen 3.191 N/A ILE 102.A N ASP 71.A O no hydrogen 3.046 N/A VAL 103.A N GLU 127.A O no hydrogen 2.863 N/A VAL 104.A N VAL 73.A O no hydrogen 2.789 N/A ASP 105.A N LEU 129.A O no hydrogen 2.915 N/A MET 106.A N VAL 75.A O no hydrogen 2.860 N/A SER 107.A N ASP 105.A OD1 no hydrogen 3.003 N/A SER 107.A OG ASP 105.A OD1 no hydrogen 2.651 N/A ASN 109.A N GLN 180.A OE1 no hydrogen 2.864 N/A ASN 109.A ND2 ASP 105.A OD2 no hydrogen 2.885 N/A SER 110.A N ASN 109.A OD1 no hydrogen 2.838 N/A TRP 113.A N SER 110.A OG no hydrogen 3.164 N/A ALA 114.A N SER 110.A O no hydrogen 2.966 N/A ARG 115.A N PRO 111.A O no hydrogen 3.000 N/A LYS 116.A N ASP 112.A O no hydrogen 3.001 N/A LYS 116.A NZ GLU 119.A OE2 no hydrogen 2.479 N/A PHE 117.A N TRP 113.A O no hydrogen 2.841 N/A ALA 118.A N ALA 114.A O no hydrogen 2.916 N/A GLU 119.A N ARG 115.A O no hydrogen 2.883 N/A ARG 120.A N LYS 116.A O no hydrogen 2.986 N/A LEU 121.A N PHE 117.A O no hydrogen 2.867 N/A ALA 122.A N ALA 118.A O no hydrogen 2.898 N/A GLN 123.A N ARG 120.A O no hydrogen 3.314 N/A TYR 124.A N LEU 121.A O no hydrogen 2.956 N/A GLY 125.A N ALA 122.A O no hydrogen 3.070 N/A ILE 126.A N LEU 121.A O no hydrogen 3.203 N/A GLU 127.A N LEU 101.A O no hydrogen 2.913 N/A LEU 129.A N VAL 103.A O no hydrogen 2.920 N/A ASP 130.A N GLY 150.A O no hydrogen 3.064 N/A ALA 131.A N ASP 105.A O no hydrogen 2.818 N/A THR 134.A N THR 146.A O no hydrogen 2.820 N/A THR 134.A OG1 ASN 186.A OD1 no hydrogen 3.103 N/A LYS 138.A NZ GLU 142.A OE2 no hydrogen 3.545 N/A GLY 139.A N GLY 135.A O no hydrogen 2.959 N/A ALA 140.A N GLY 136.A O no hydrogen 2.988 N/A ILE 141.A N GLN 137.A O no hydrogen 2.904 N/A GLU 142.A N LYS 138.A O no hydrogen 2.876 N/A GLY 143.A N ALA 140.A O no hydrogen 3.285 N/A THR 144.A N GLY 139.A O no hydrogen 2.990 N/A THR 146.A N THR 134.A O no hydrogen 2.910 N/A ILE 147.A N ASP 169.A O no hydrogen 3.022 N/A MET 148.A N PRO 132.A O no hydrogen 3.015 N/A VAL 149.A N VAL 171.A O no hydrogen 2.919 N/A GLY 150.A N ASP 130.A O no hydrogen 2.729 N/A GLY 151.A N GLY 174.A O no hydrogen 2.926 N/A LYS 152.A NZ GLU 127.A OE1 no hydrogen 2.874 N/A LYS 152.A NZ GLU 127.A OE2 no hydrogen 3.377 N/A GLU 154.A N GLU 154.A OE1 no hydrogen 2.865 N/A LEU 155.A N LYS 152.A O no hydrogen 2.934 N/A PHE 156.A N LYS 152.A O no hydrogen 3.125 N/A HIS 157.A N GLU 153.A O no hydrogen 3.103 N/A ARG 158.A N GLU 154.A O no hydrogen 2.970 N/A LEU 159.A N LEU 155.A O no hydrogen 2.971 N/A LEU 160.A N HIS 157.A O no hydrogen 3.235 N/A PHE 163.A N LEU 159.A O no hydrogen 3.109 N/A LYS 164.A N LEU 160.A O no hydrogen 2.838 N/A ALA 165.A N PRO 161.A O no hydrogen 3.216 N/A ALA 165.A N ILE 162.A O no hydrogen 3.115 N/A MET 166.A N PHE 163.A O no hydrogen 3.038 N/A GLY 167.A N PHE 163.A O no hydrogen 2.903 N/A ARG 168.A N LEU 145.A O no hydrogen 2.830 N/A VAL 171.A N ILE 147.A O no hydrogen 2.803 N/A TYR 172.A OH GLY 151.A O no hydrogen 2.689 N/A MET 173.A N VAL 149.A O no hydrogen 2.764 N/A GLY 177.A N ASP 130.A OD1 no hydrogen 2.800 N/A TYR 178.A N PRO 175.A O no hydrogen 2.941 N/A GLN 180.A N ASP 130.A OD2 no hydrogen 2.808 N/A GLN 180.A NE2 SER 107.A O no hydrogen 2.893 N/A ALA 181.A N GLY 177.A O no hydrogen 2.867 N/A MET 182.A N TYR 178.A O no hydrogen 3.179 N/A MET 183.A N GLY 179.A O no hydrogen 2.967 N/A LEU 184.A N GLN 180.A O no hydrogen 2.906 N/A VAL 185.A N ALA 181.A O no hydrogen 3.221 N/A ASN 186.A N MET 182.A O no hydrogen 2.888 N/A GLN 187.A N MET 183.A O no hydrogen 2.804 N/A GLN 187.A NE2 ASP 252.A OD2 no hydrogen 2.903 N/A VAL 188.A N LEU 184.A O no hydrogen 3.096 N/A VAL 189.A N VAL 185.A O no hydrogen 3.316 N/A VAL 190.A N ASN 186.A O no hydrogen 2.891 N/A ALA 191.A N GLN 187.A O no hydrogen 2.833 N/A LEU 192.A N VAL 188.A O no hydrogen 3.135 N/A ASN 193.A N VAL 189.A O no hydrogen 2.850 N/A THR 194.A N VAL 190.A O no hydrogen 2.922 N/A THR 194.A OG1 VAL 190.A O no hydrogen 2.830 N/A VAL 195.A N ALA 191.A O no hydrogen 2.932 N/A ALA 196.A N LEU 192.A O no hydrogen 2.869 N/A MET 197.A N ASN 193.A O no hydrogen 3.167 N/A VAL 198.A N THR 194.A O no hydrogen 2.972 N/A GLU 199.A N VAL 195.A O no hydrogen 2.903 N/A GLY 200.A N ALA 196.A O no hydrogen 2.950 N/A LEU 201.A N MET 197.A O no hydrogen 2.886 N/A LYS 202.A N VAL 198.A O no hydrogen 2.900 N/A LEU 203.A N GLU 199.A O no hydrogen 2.953 N/A ALA 204.A N GLY 200.A O no hydrogen 2.874 N/A LYS 205.A N LEU 201.A O no hydrogen 2.849 N/A ALA 206.A N LYS 202.A O no hydrogen 3.056 N/A LEU 207.A N LEU 203.A O no hydrogen 2.874 N/A GLY 208.A N LYS 205.A O no hydrogen 3.120 N/A LEU 209.A N ALA 204.A O no hydrogen 3.150 N/A ASP 212.A N ASP 210.A OD1 no hydrogen 2.909 N/A VAL 214.A N ASP 210.A O no hydrogen 2.957 N/A ALA 215.A N MET 211.A O no hydrogen 2.889 N/A GLU 216.A N ASP 212.A O no hydrogen 3.092 N/A VAL 217.A N LYS 213.A O no hydrogen 2.938 N/A LEU 218.A N VAL 214.A O no hydrogen 2.944 N/A THR 219.A N ALA 215.A O no hydrogen 2.931 N/A THR 219.A OG1 ALA 215.A O no hydrogen 2.886 N/A THR 219.A OG1 GLU 216.A O no hydrogen 3.043 N/A ARG 220.A N VAL 217.A O no hydrogen 3.219 N/A ARG 220.A NH1 GLU 216.A O no hydrogen 2.994 N/A ARG 224.A N ARG 220.A O no hydrogen 3.084 N/A ILE 228.A N SER 225.A OG no hydrogen 3.071 N/A GLU 229.A N SER 225.A O no hydrogen 2.940 N/A LEU 230.A N GLY 226.A O no hydrogen 2.836 N/A TYR 231.A N ALA 227.A O no hydrogen 2.871 N/A LEU 232.A N ILE 228.A O no hydrogen 3.003 N/A LYS 234.A NZ SER 241.A O no hydrogen 2.865 N/A LEU 235.A N TYR 231.A O no hydrogen 2.993 N/A LEU 236.A N LEU 232.A O no hydrogen 2.912 N/A LYS 237.A N PRO 233.A O no hydrogen 3.187 N/A GLY 238.A N LEU 235.A O no hydrogen 2.957 N/A ASP 239.A N LYS 234.A O no hydrogen 2.923 N/A SER 241.A N ASP 239.A OD1 no hydrogen 3.002 N/A SER 241.A OG ASP 239.A OD1 no hydrogen 2.719 N/A GLY 243.A N GLN 137.A OE1 no hydrogen 2.924 N/A ALA 246.A N LEU 288.A O no hydrogen 2.861 N/A GLU 247.A N GLY 286.A O no hydrogen 2.878 N/A HIS 248.A N LYS 245.A O no hydrogen 2.949 N/A LEU 249.A N LYS 245.A O no hydrogen 3.201 N/A LYS 250.A N ALA 246.A O no hydrogen 2.886 N/A LYS 250.A NZ TYR 274.A OH no hydrogen 3.162 N/A LYS 251.A N GLU 247.A O no hydrogen 3.190 N/A LYS 251.A NZ SER 78.A O no hydrogen 3.292 N/A LYS 251.A NZ THR 108.A O no hydrogen 3.000 N/A LYS 251.A NZ ASP 252.A OD1 no hydrogen 2.578 N/A ASP 252.A N HIS 248.A O no hydrogen 2.979 N/A LEU 253.A N LEU 249.A O no hydrogen 2.859 N/A GLY 254.A N LYS 250.A O no hydrogen 2.909 N/A TYR 255.A N LYS 251.A O no hydrogen 3.191 N/A TYR 255.A OH ASP 79.A OD1 no hydrogen 2.655 N/A VAL 256.A N ASP 252.A O no hydrogen 2.931 N/A LEU 257.A N LEU 253.A O no hydrogen 2.887 N/A GLU 258.A N GLY 254.A O no hydrogen 3.041 N/A GLU 259.A N TYR 255.A O no hydrogen 3.038 N/A ALA 260.A N VAL 256.A O no hydrogen 2.870 N/A ARG 261.A N LEU 257.A O no hydrogen 2.910 N/A LYS 262.A N GLU 258.A O no hydrogen 2.973 N/A ARG 263.A N GLU 259.A O no hydrogen 2.972 N/A GLY 264.A N ARG 261.A O no hydrogen 3.249 N/A VAL 265.A N ALA 260.A O no hydrogen 2.957 N/A GLU 271.A N LEU 267.A O no hydrogen 2.956 N/A LEU 272.A N PRO 268.A O no hydrogen 2.985 N/A ALA 273.A N GLY 269.A O no hydrogen 2.898 N/A TYR 274.A N ALA 270.A O no hydrogen 2.866 N/A GLU 275.A N GLU 271.A O no hydrogen 2.957 N/A LEU 276.A N LEU 272.A O no hydrogen 2.894 N/A TYR 277.A N ALA 273.A O no hydrogen 2.922 N/A TYR 277.A OH ILE 290.A O no hydrogen 2.807 N/A ARG 278.A N TYR 274.A O no hydrogen 2.723 N/A LYS 279.A N GLU 275.A O no hydrogen 2.915 N/A LYS 279.A NZ ASP 283.A OD1 no hydrogen 3.423 N/A MET 280.A N LEU 276.A O no hydrogen 3.034 N/A VAL 281.A N TYR 277.A O no hydrogen 2.985 N/A GLU 282.A N ARG 278.A O no hydrogen 2.922 N/A ASP 283.A N LYS 279.A O no hydrogen 2.842 N/A GLY 284.A N VAL 281.A O no hydrogen 3.013 N/A ALA 285.A N MET 280.A O no hydrogen 2.976 N/A LEU 288.A N ALA 285.A O no hydrogen 2.996 N/A GLY 289.A N LEU 240.A O no hydrogen 2.861 N/A ILE 290.A N PHE 244.A O no hydrogen 2.835 N/A HIS 291.A NE2 ASP 239.A O no hydrogen 2.804 N/A ALA 292.A N GLY 289.A O no hydrogen 2.920 N/A LEU 293.A N ILE 290.A O no hydrogen 3.307 N/A PHE 295.A N ALA 292.A O no hydrogen 2.890 N/A TYR 296.A OH ASP 283.A OD2 no hydrogen 2.738 N/A