Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ubf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A N ASN 82.A O no hydrogen 2.874 N/A ARG 4.A NE ASP 81.A OD2 no hydrogen 3.074 N/A ARG 4.A NH1 GLU 33.A OE1 no hydrogen 3.364 N/A ARG 4.A NH2 GLU 33.A OE1 no hydrogen 2.970 N/A ARG 4.A NH2 GLU 33.A OE2 no hydrogen 2.599 N/A LYS 7.A N ARG 84.A O no hydrogen 2.865 N/A LYS 7.A NZ GLU 27.A OE1 no hydrogen 3.453 N/A LYS 7.A NZ GLU 27.A OE2 no hydrogen 2.949 N/A ILE 9.A N ILE 86.A O no hydrogen 3.143 N/A PHE 11.A N LEU 88.A O no hydrogen 2.979 N/A THR 12.A N ASP 15.A OD2 no hydrogen 2.748 N/A GLU 13.A N LYS 90.A O no hydrogen 2.762 N/A ASP 15.A N THR 12.A OG1 no hydrogen 3.064 N/A GLY 16.A N GLU 13.A O no hydrogen 3.050 N/A ASP 17.A N ALA 14.A O no hydrogen 3.053 N/A THR 18.A OG1 ASP 17.A OD1 no hydrogen 2.711 N/A GLY 20.A N VAL 54.A O no hydrogen 2.615 N/A LYS 21.A N THR 18.A O no hydrogen 3.175 N/A VAL 23.A N VAL 52.A O no hydrogen 2.860 N/A GLN 25.A NE2 LEU 26.A O no hydrogen 2.971 N/A GLN 25.A NE2 ASN 49.A O no hydrogen 2.663 N/A LEU 26.A N GLY 50.A O no hydrogen 2.841 N/A GLU 27.A N GLU 27.A OE1 no hydrogen 2.657 N/A LYS 28.A NZ ASP 31.A O no hydrogen 2.911 N/A LYS 28.A NZ ASP 31.A OD1 no hydrogen 3.529 N/A GLU 29.A N GLU 33.A OE1 no hydrogen 2.830 N/A LYS 32.A NZ ASP 31.A OD2 no hydrogen 3.010 N/A GLU 33.A N THR 30.A O no hydrogen 3.349 N/A THR 34.A N THR 76.A O no hydrogen 3.007 N/A PHE 35.A N THR 48.A O no hydrogen 2.718 N/A ARG 38.A N TRP 72.A O no hydrogen 2.954 N/A TRP 43.A N ASN 41.A OD1 no hydrogen 2.652 N/A VAL 44.A N ASN 41.A OD1 no hydrogen 3.110 N/A THR 45.A N ARG 53.A O no hydrogen 2.833 N/A GLU 47.A N ALA 51.A O no hydrogen 2.851 N/A GLY 50.A N GLU 47.A O no hydrogen 3.039 N/A ALA 51.A N ASN 49.A OD1 no hydrogen 2.807 N/A VAL 52.A N PHE 24.A O no hydrogen 2.765 N/A ARG 53.A N THR 45.A O no hydrogen 2.825 N/A ARG 53.A NE GLY 20.A O no hydrogen 2.685 N/A ARG 53.A NH1 GLU 47.A OE1 no hydrogen 3.331 N/A ARG 53.A NH2 GLY 20.A O no hydrogen 3.068 N/A VAL 54.A N LYS 21.A O no hydrogen 2.982 N/A LYS 55.A N TRP 43.A O no hydrogen 2.909 N/A LYS 55.A NZ ASN 41.A O no hydrogen 3.083 N/A LYS 56.A N PRO 42.A O no hydrogen 3.142 N/A TRP 58.A N GLY 16.A O no hydrogen 2.721 N/A TRP 58.A NE1 TRP 43.A O no hydrogen 3.023 N/A TYR 60.A N GLU 13.A OE2 no hydrogen 2.802 N/A GLU 61.A N GLU 61.A OE1 no hydrogen 2.552 N/A GLU 62.A N ASP 59.A O no hydrogen 2.894 N/A LEU 63.A N TYR 60.A O no hydrogen 3.138 N/A LYS 67.A N GLY 64.A O no hydrogen 2.815 N/A LYS 67.A NZ TYR 60.A O no hydrogen 2.832 N/A LYS 67.A NZ LEU 63.A O no hydrogen 3.058 N/A ILE 69.A N ILE 87.A O no hydrogen 2.919 N/A PHE 71.A N VAL 85.A O no hydrogen 2.894 N/A VAL 73.A N GLN 83.A O no hydrogen 2.800 N/A ILE 74.A N LYS 36.A O no hydrogen 2.659 N/A ILE 75.A N ASP 81.A O no hydrogen 2.983 N/A THR 76.A N THR 34.A O no hydrogen 3.030 N/A ASP 81.A N ILE 75.A O no hydrogen 2.843 N/A ASN 82.A N ALA 2.A O no hydrogen 2.753 N/A GLN 83.A N VAL 73.A O no hydrogen 3.088 N/A GLN 83.A NE2 PRO 5.A O no hydrogen 2.937 N/A ARG 84.A NE ASP 70.A OD1 no hydrogen 3.187 N/A ARG 84.A NH2 ASP 70.A OD2 no hydrogen 2.848 N/A VAL 85.A N PHE 71.A O no hydrogen 2.592 N/A ILE 86.A N LYS 7.A O no hydrogen 2.832 N/A ILE 87.A N ILE 69.A O no hydrogen 2.884 N/A LEU 88.A N ILE 9.A O no hydrogen 2.785 N/A VAL 89.A N LYS 67.A O no hydrogen 3.098 N/A LYS 90.A N PHE 11.A O no hydrogen 2.786 N/A ASP 94.A N ASP 91.A O no hydrogen 3.167 N/A GLU 95.A N ASN 93.A O no hydrogen 2.844 N/A TYR 98.A N ARG 126.A O no hydrogen 2.979 N/A ILE 100.A N GLN 124.A O no hydrogen 2.788 N/A ASN 101.A ND2 THR 122.A O no hydrogen 2.817 N/A ARG 102.A NH1 PHE 99.A O no hydrogen 3.192 N/A ARG 102.A NH1 ASN 101.A O no hydrogen 2.749 N/A ALA 108.A N SER 190.A O no hydrogen 2.869 N/A VAL 110.A N VAL 192.A O no hydrogen 2.946 N/A ALA 114.A N GLN 111.A O no hydrogen 3.203 N/A ASN 117.A N THR 158.A O no hydrogen 2.572 N/A THR 118.A N PRO 115.A O no hydrogen 3.248 N/A THR 118.A N THR 158.A OG1 no hydrogen 3.066 N/A THR 118.A OG1 PRO 115.A O no hydrogen 2.425 N/A VAL 120.A N VAL 156.A O no hydrogen 2.703 N/A LEU 123.A N GLY 154.A O no hydrogen 2.847 N/A GLN 124.A N ASN 101.A OD1 no hydrogen 2.781 N/A GLN 124.A NE2 THR 122.A O no hydrogen 3.245 N/A ALA 125.A N TYR 136.A OH no hydrogen 2.926 N/A ARG 126.A N TYR 98.A O no hydrogen 2.836 N/A ARG 126.A NH2 TYR 98.A OH no hydrogen 3.436 N/A ASP 129.A N ASP 127.A OD1 no hydrogen 2.730 N/A ASP 131.A N ASP 129.A OD1 no hydrogen 2.982 N/A HIS 132.A N ASP 129.A O no hydrogen 3.247 N/A HIS 132.A ND1 ASP 127.A OD2 no hydrogen 3.009 N/A HIS 132.A ND1 ASP 178.A OD2 no hydrogen 2.586 N/A ASN 133.A N ASN 180.A OD1 no hydrogen 3.171 N/A HIS 135.A N GLU 177.A O no hydrogen 2.766 N/A TYR 136.A N GLU 151.A O no hydrogen 3.110 N/A PHE 137.A N LYS 175.A O no hydrogen 2.930 N/A VAL 139.A N TYR 173.A O no hydrogen 2.813 N/A ARG 140.A N TYR 173.A O no hydrogen 3.436 N/A ARG 142.A N VAL 171.A O no hydrogen 2.802 N/A THR 143.A N ASP 141.A OD1 no hydrogen 2.750 N/A THR 143.A OG1 ASP 141.A OD1 no hydrogen 2.446 N/A THR 143.A OG1 ASP 141.A OD2 no hydrogen 3.525 N/A GLY 145.A N ASP 141.A OD2 no hydrogen 3.070 N/A ARG 146.A N THR 143.A OG1 no hydrogen 2.950 N/A ARG 146.A NE ARG 159.A O no hydrogen 2.989 N/A ARG 146.A NH1 ASP 162.A O no hydrogen 3.418 N/A ARG 146.A NH1 LEU 163.A O no hydrogen 3.358 N/A ARG 146.A NH2 ARG 159.A O no hydrogen 3.073 N/A ARG 146.A NH2 ASP 162.A O no hydrogen 2.782 N/A GLU 148.A N ARG 157.A O no hydrogen 3.014 N/A ASP 150.A N VAL 155.A O no hydrogen 2.808 N/A ARG 152.A N ASP 150.A OD1 no hydrogen 2.803 N/A SER 153.A N ASP 150.A OD1 no hydrogen 3.108 N/A GLY 154.A N ASP 150.A O no hydrogen 2.891 N/A VAL 155.A N SER 153.A OG no hydrogen 3.314 N/A VAL 156.A N PHE 121.A O no hydrogen 2.600 N/A ARG 157.A N GLU 148.A O no hydrogen 2.855 N/A ARG 157.A NH1 ASP 150.A OD2 no hydrogen 3.296 N/A THR 158.A N THR 118.A O no hydrogen 2.758 N/A THR 158.A OG1 PRO 115.A O no hydrogen 2.844 N/A ARG 159.A N ARG 146.A O no hydrogen 2.857 N/A ARG 159.A NH1 GLY 145.A O no hydrogen 2.955 N/A PHE 164.A N LEU 112.A O no hydrogen 2.870 N/A GLN 165.A N TYR 170.A OH no hydrogen 2.803 N/A ASP 167.A N GLY 193.A O no hydrogen 3.129 N/A MET 168.A N GLN 165.A O no hydrogen 3.159 N/A TYR 170.A N ILE 191.A O no hydrogen 2.596 N/A LEU 172.A N LEU 189.A O no hydrogen 2.891 N/A TYR 173.A N ARG 140.A O no hydrogen 2.746 N/A VAL 174.A N GLU 187.A O no hydrogen 2.804 N/A LYS 175.A N PHE 137.A O no hydrogen 3.021 N/A LYS 175.A NZ SER 183.A OG no hydrogen 3.351 N/A LYS 175.A NZ GLU 186.A OE2 no hydrogen 3.304 N/A ALA 176.A N THR 184.A OG1 no hydrogen 2.863 N/A GLU 177.A N HIS 135.A O no hydrogen 2.772 N/A ASP 178.A N GLN 182.A O no hydrogen 2.967 N/A GLN 179.A N ASN 133.A O no hydrogen 2.878 N/A GLN 179.A NE2 GLU 177.A O no hydrogen 3.469 N/A ASN 180.A N ASP 178.A OD1 no hydrogen 3.061 N/A GLY 181.A N ASP 178.A OD2 no hydrogen 3.143 N/A GLN 182.A NE2 ASP 94.A O no hydrogen 3.503 N/A GLN 182.A NE2 ASP 94.A OD1 no hydrogen 3.140 N/A SER 183.A OG THR 184.A O no hydrogen 3.320 N/A THR 184.A N ALA 176.A O no hydrogen 2.954 N/A THR 184.A OG1 ALA 176.A O no hydrogen 3.471 N/A THR 184.A OG1 PRO 185.A O no hydrogen 2.758 N/A GLU 187.A N VAL 174.A O no hydrogen 2.873 N/A ARG 188.A N GLU 187.A OE1 no hydrogen 3.378 N/A ARG 188.A NH1 GLU 169.A OE2 no hydrogen 3.440 N/A ARG 188.A NH2 GLU 169.A OE1 no hydrogen 3.012 N/A ARG 188.A NH2 GLU 169.A OE2 no hydrogen 3.424 N/A LEU 189.A N LEU 172.A O no hydrogen 2.690 N/A SER 190.A N MET 106.A O no hydrogen 2.991 N/A SER 190.A OG GLU 169.A OE2 no hydrogen 2.608 N/A ILE 191.A N TYR 170.A O no hydrogen 2.782 N/A VAL 192.A N ALA 108.A O no hydrogen 3.082 N/A GLY 193.A N MET 168.A O no hydrogen 2.824 N/A GLY 194.A N VAL 110.A O no hydrogen 2.701 N/A LYS 195.A N GLY 193.A O no hydrogen 2.878 N/A ARG 196.A NH1 SER 190.A OG no hydrogen 2.777 N/A ARG 196.A NH2 ALA 108.A O no hydrogen 2.812 N/A ARG 196.A NH2 SER 190.A O no hydrogen 2.796 N/A ARG 196.A NH2 SER 190.A OG no hydrogen 2.817 N/A GLN 199.A N LYS 225.A O no hydrogen 3.018 N/A GLN 199.A NE2 PRO 105.A O no hydrogen 2.877 N/A TYR 201.A N LYS 223.A O no hydrogen 2.865 N/A MET 202.A N TYR 205.A OH no hydrogen 3.044 N/A TYR 205.A N ASP 290.A O no hydrogen 2.838 N/A ALA 207.A N THR 292.A O no hydrogen 2.734 N/A ILE 209.A N ARG 294.A O no hydrogen 2.802 N/A GLU 211.A N THR 296.A O no hydrogen 2.930 N/A GLN 213.A N PRO 210.A O no hydrogen 3.128 N/A GLN 213.A NE2 SER 217.A OG no hydrogen 2.740 N/A ASP 216.A N LEU 257.A O no hydrogen 2.643 N/A SER 217.A N LYS 214.A O no hydrogen 3.042 N/A SER 217.A OG LYS 214.A O no hydrogen 2.657 N/A ILE 219.A N VAL 255.A O no hydrogen 2.780 N/A ILE 222.A N GLY 253.A O no hydrogen 2.769 N/A ALA 224.A N TYR 234.A OH no hydrogen 3.052 N/A LYS 225.A N GLN 199.A O no hydrogen 2.567 N/A SER 226.A OG ARG 230.A O no hydrogen 3.352 N/A SER 226.A OG GLU 280.A OE2 no hydrogen 2.512 N/A ASP 229.A N SER 226.A O no hydrogen 2.974 N/A ARG 230.A N SER 226.A OG no hydrogen 2.822 N/A ARG 233.A N THR 279.A O no hydrogen 2.680 N/A TYR 234.A N PRO 250.A O no hydrogen 2.885 N/A THR 235.A N THR 277.A O no hydrogen 2.774 N/A LYS 237.A N ILE 275.A O no hydrogen 2.925 N/A GLN 239.A N SER 273.A O no hydrogen 2.752 N/A GLN 241.A NE2 ARG 267.A O no hydrogen 2.632 N/A THR 245.A N GLY 242.A O no hydrogen 3.042 N/A THR 245.A OG1 GLY 242.A O no hydrogen 3.177 N/A ASN 247.A N LYS 256.A O no hydrogen 3.078 N/A GLY 249.A N ILE 254.A O no hydrogen 2.782 N/A GLY 253.A N GLY 249.A O no hydrogen 2.950 N/A ILE 254.A N SER 252.A OG no hydrogen 3.248 N/A VAL 255.A N ILE 220.A O no hydrogen 2.785 N/A LYS 256.A N ASN 247.A O no hydrogen 2.817 N/A LEU 257.A N SER 217.A O no hydrogen 3.184 N/A ALA 258.A N THR 245.A O no hydrogen 2.594 N/A LYS 259.A NZ ALA 243.A O no hydrogen 3.517 N/A ASP 262.A N GLN 268.A OE1 no hydrogen 2.672 N/A PHE 263.A N GLU 211.A OE2 no hydrogen 2.804 N/A GLU 264.A N ASP 262.A OD1 no hydrogen 3.301 N/A ARG 267.A N ASP 265.A OD1 no hydrogen 3.016 N/A GLN 268.A N ASP 265.A O no hydrogen 3.076 N/A GLN 268.A NE2 ASP 265.A OD2 no hydrogen 2.960 N/A HIS 270.A NE2 PHE 263.A O no hydrogen 2.843 N/A TYR 272.A N ILE 293.A O no hydrogen 2.699 N/A LEU 274.A N LEU 291.A O no hydrogen 2.652 N/A ILE 275.A N LYS 237.A O no hydrogen 2.827 N/A VAL 276.A N VAL 289.A O no hydrogen 3.026 N/A THR 277.A N THR 235.A O no hydrogen 2.727 N/A THR 277.A OG1 SER 288.A OG no hydrogen 2.794 N/A ALA 278.A N THR 287.A O no hydrogen 2.755 N/A THR 279.A N ARG 233.A O no hydrogen 2.693 N/A GLU 280.A N PHE 285.A O no hydrogen 2.960 N/A PHE 285.A N GLY 283.A O no hydrogen 2.814 N/A THR 287.A N ALA 278.A O no hydrogen 2.980 N/A THR 287.A OG1 PRO 198.A O no hydrogen 2.598 N/A SER 288.A OG THR 277.A OG1 no hydrogen 2.794 N/A VAL 289.A N VAL 276.A O no hydrogen 2.918 N/A LEU 291.A N LEU 274.A O no hydrogen 2.743 N/A THR 292.A N TYR 205.A O no hydrogen 2.868 N/A ILE 293.A N TYR 272.A O no hydrogen 2.858 N/A ARG 294.A N ALA 207.A O no hydrogen 2.865 N/A VAL 295.A N HIS 270.A O no hydrogen 2.711 N/A THR 296.A N ILE 209.A O no hydrogen 2.997 N/A VAL 298.A N ASP 297.A OD1 no hydrogen 2.792 N/A