Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3dbq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N TYR 11.A O no hydrogen 3.034 N/A VAL 6.A N ARG 9.A O no hydrogen 2.976 N/A LYS 7.A N GLU 78.A OE1 no hydrogen 2.504 N/A TYR 11.A N ILE 4.A O no hydrogen 2.794 N/A SER 12.A N LEU 29.A O no hydrogen 2.524 N/A SER 12.A OG ILE 13.A O no hydrogen 3.550 N/A LEU 14.A N GLN 27.A O no hydrogen 3.038 N/A ILE 17.A N VAL 25.A O no hydrogen 2.763 N/A SER 19.A OG SER 23.A O no hydrogen 3.187 N/A SER 23.A OG TYR 40.A O no hydrogen 3.049 N/A LYS 24.A N TYR 40.A O no hydrogen 2.759 N/A PHE 26.A N ILE 38.A O no hydrogen 3.041 N/A GLN 27.A N LYS 15.A O no hydrogen 3.107 N/A VAL 28.A N TYR 36.A O no hydrogen 2.826 N/A LEU 29.A N SER 12.A O no hydrogen 2.915 N/A ASN 30.A N GLN 34.A O no hydrogen 3.019 N/A ASN 30.A ND2 GLN 34.A OE1 no hydrogen 3.286 N/A LYS 33.A N ASN 30.A O no hydrogen 3.241 N/A LYS 33.A N GLU 31.A O no hydrogen 2.527 N/A TYR 36.A N VAL 28.A O no hydrogen 2.825 N/A ALA 37.A N MET 88.A O no hydrogen 2.888 N/A ILE 38.A N PHE 26.A O no hydrogen 2.889 N/A LYS 39.A N MET 86.A O no hydrogen 2.910 N/A LYS 39.A NZ GLN 156.A OE1 no hydrogen 3.269 N/A TYR 40.A N LYS 24.A O no hydrogen 2.547 N/A VAL 41.A N ILE 84.A O no hydrogen 3.126 N/A ASN 42.A ND2 GLN 82.A O no hydrogen 3.351 N/A LEU 43.A N GLN 82.A O no hydrogen 2.828 N/A ALA 46.A N LEU 43.A O no hydrogen 3.229 N/A THR 50.A OG1 ASP 47.A OD2 no hydrogen 2.988 N/A THR 50.A OG1 GLN 49.A OE1 no hydrogen 2.774 N/A LEU 51.A N ASP 47.A O no hydrogen 2.852 N/A ASP 52.A N ASN 48.A O no hydrogen 2.659 N/A SER 53.A N GLN 49.A O no hydrogen 2.700 N/A SER 53.A OG GLN 49.A O no hydrogen 3.422 N/A SER 53.A OG THR 50.A O no hydrogen 2.278 N/A TYR 54.A N THR 50.A O no hydrogen 3.067 N/A ARG 55.A N LEU 51.A O no hydrogen 2.988 N/A ARG 55.A NH1 ASP 52.A OD1 no hydrogen 3.089 N/A ASN 56.A N ASP 52.A O no hydrogen 2.755 N/A GLU 57.A N SER 53.A O no hydrogen 2.802 N/A ILE 58.A N TYR 54.A O no hydrogen 2.859 N/A ALA 59.A N ARG 55.A O no hydrogen 2.924 N/A TYR 60.A N ASN 56.A O no hydrogen 3.074 N/A LEU 61.A N GLU 57.A O no hydrogen 2.730 N/A ASN 62.A N ILE 58.A O no hydrogen 2.722 N/A LYS 63.A N ALA 59.A O no hydrogen 2.856 N/A LEU 64.A N TYR 60.A O no hydrogen 2.781 N/A GLN 65.A NE2 LEU 74.A O no hydrogen 2.735 N/A HIS 67.A N LEU 64.A O no hydrogen 3.077 N/A SER 68.A N GLN 65.A O no hydrogen 3.131 N/A SER 68.A OG GLU 119.A OE1 no hydrogen 3.273 N/A LYS 70.A N SER 68.A OG no hydrogen 3.002 N/A LYS 70.A NZ ASP 69.A OD1 no hydrogen 3.414 N/A LYS 70.A NZ ASP 69.A OD2 no hydrogen 3.146 N/A ILE 72.A N LEU 148.A O no hydrogen 2.923 N/A ARG 73.A NH1 SER 68.A O no hydrogen 3.362 N/A ARG 73.A NH2 GLN 65.A O no hydrogen 2.469 N/A ARG 73.A NH2 SER 68.A O no hydrogen 3.436 N/A LEU 74.A N GLN 65.A OE1 no hydrogen 2.869 N/A TYR 75.A N VAL 87.A O no hydrogen 2.884 N/A ASP 76.A N VAL 87.A O no hydrogen 3.442 N/A TYR 77.A N ASP 76.A OD1 no hydrogen 2.804 N/A GLU 78.A N TYR 85.A O no hydrogen 2.554 N/A THR 80.A N TYR 83.A O no hydrogen 2.856 N/A TYR 83.A OH GLU 78.A OE2 no hydrogen 2.612 N/A ILE 84.A N VAL 41.A O no hydrogen 3.052 N/A TYR 85.A N GLU 78.A O no hydrogen 2.773 N/A MET 86.A N LYS 39.A O no hydrogen 2.996 N/A VAL 87.A N ASP 76.A O no hydrogen 2.627 N/A MET 88.A N ALA 37.A O no hydrogen 2.689 N/A GLU 89.A N ARG 73.A O no hydrogen 3.128 N/A LEU 95.A N PHE 139.A O no hydrogen 2.890 N/A ASN 96.A N ASP 94.A OD2 no hydrogen 3.226 N/A SER 97.A N ASP 94.A OD2 no hydrogen 3.284 N/A SER 97.A OG ASP 94.A OD1 no hydrogen 2.629 N/A TRP 98.A N ASP 94.A O no hydrogen 3.105 N/A LEU 99.A N LEU 95.A O no hydrogen 3.236 N/A LYS 100.A N ASN 96.A O no hydrogen 3.215 N/A LYS 102.A NZ SER 104.A O no hydrogen 2.531 N/A LYS 103.A NZ TYR 189.A OH no hydrogen 3.058 N/A LYS 103.A NZ GLY 193.A O no hydrogen 3.144 N/A GLU 109.A N ASP 106.A O no hydrogen 2.624 N/A GLU 109.A N ASP 106.A OD1 no hydrogen 2.958 N/A ARG 110.A N ASP 106.A O no hydrogen 2.933 N/A ARG 110.A NH1 MET 190.A O no hydrogen 2.591 N/A ARG 110.A NH2 GLU 224.A OE2 no hydrogen 2.516 N/A LYS 111.A N PRO 107.A O no hydrogen 3.051 N/A SER 112.A N TRP 108.A O no hydrogen 2.950 N/A TYR 113.A N GLU 109.A O no hydrogen 2.737 N/A TRP 114.A N ARG 110.A O no hydrogen 2.875 N/A LYS 115.A N LYS 111.A O no hydrogen 2.996 N/A ASN 116.A N SER 112.A O no hydrogen 3.134 N/A MET 117.A N TYR 113.A O no hydrogen 2.977 N/A LEU 118.A N TRP 114.A O no hydrogen 3.054 N/A GLU 119.A N LYS 115.A O no hydrogen 3.010 N/A ALA 120.A N ASN 116.A O no hydrogen 3.105 N/A VAL 121.A N MET 117.A O no hydrogen 2.970 N/A HIS 122.A N LEU 118.A O no hydrogen 2.784 N/A THR 123.A N GLU 119.A O no hydrogen 2.940 N/A THR 123.A OG1 GLU 119.A O no hydrogen 2.779 N/A ILE 124.A N ALA 120.A O no hydrogen 3.116 N/A HIS 125.A N VAL 121.A O no hydrogen 2.925 N/A HIS 125.A NE2 ASP 179.A OD2 no hydrogen 2.691 N/A GLN 126.A N HIS 122.A O no hydrogen 2.973 N/A HIS 127.A N ILE 124.A O no hydrogen 3.097 N/A GLY 128.A N HIS 125.A O no hydrogen 2.742 N/A ILE 129.A N ILE 124.A O no hydrogen 2.895 N/A HIS 131.A N ASP 179.A OD2 no hydrogen 2.976 N/A HIS 131.A NE2 ASP 150.A OD2 no hydrogen 3.021 N/A SER 132.A N ASP 179.A OD1 no hydrogen 2.822 N/A SER 132.A OG HIS 131.A O no hydrogen 2.460 N/A ASP 133.A N HIS 131.A ND1 no hydrogen 3.179 N/A LYS 135.A NZ ASP 133.A OD2 no hydrogen 2.562 N/A ASN 138.A N LYS 135.A O no hydrogen 2.974 N/A ASN 138.A ND2 ASP 133.A O no hydrogen 3.098 N/A ASN 138.A ND2 LYS 135.A O no hydrogen 2.962 N/A PHE 139.A N PRO 136.A O no hydrogen 3.206 N/A LEU 140.A N LYS 147.A O no hydrogen 2.837 N/A ILE 141.A N ILE 93.A O no hydrogen 2.756 N/A VAL 142.A N MET 145.A O no hydrogen 2.714 N/A MET 145.A N VAL 142.A O no hydrogen 3.102 N/A LYS 147.A N LEU 140.A O no hydrogen 2.857 N/A LYS 147.A NZ ASP 69.A O no hydrogen 3.071 N/A LYS 147.A NZ GLU 89.A OE1 no hydrogen 3.429 N/A LYS 147.A NZ GLU 89.A OE2 no hydrogen 2.960 N/A LEU 148.A N LYS 70.A O no hydrogen 3.025 N/A ILE 149.A N ASN 138.A O no hydrogen 2.907 N/A PHE 151.A N GLU 57.A OE2 no hydrogen 2.767 N/A GLY 152.A N ASP 150.A OD2 no hydrogen 3.256 N/A ALA 154.A N GLU 57.A OE1 no hydrogen 2.641 N/A GLN 156.A N ALA 154.A O no hydrogen 2.603 N/A ASN 162.A ND2 PHE 197.A O no hydrogen 3.151 N/A MET 164.A N VAL 161.A O no hydrogen 3.403 N/A GLU 167.A N GLU 167.A OE1 no hydrogen 2.731 N/A ALA 168.A N PRO 165.A O no hydrogen 3.048 N/A LYS 170.A N PRO 166.A O no hydrogen 3.015 N/A ASP 171.A N GLU 167.A O no hydrogen 3.309 N/A MET 172.A N ILE 169.A O no hydrogen 2.865 N/A LYS 177.A N SER 175.A OG no hydrogen 2.887 N/A LYS 177.A NZ PRO 239.A O no hydrogen 2.723 N/A LYS 177.A NZ ARG 242.A O no hydrogen 2.864 N/A SER 178.A N SER 175.A O no hydrogen 2.865 N/A SER 178.A OG GLU 167.A OE2 no hydrogen 3.015 N/A ASP 179.A N PRO 176.A O no hydrogen 2.892 N/A VAL 180.A N PRO 176.A O no hydrogen 3.405 N/A TRP 181.A N LYS 177.A O no hydrogen 3.244 N/A SER 182.A N SER 178.A O no hydrogen 3.491 N/A SER 182.A OG TYR 163.A O no hydrogen 2.733 N/A SER 182.A OG SER 178.A O no hydrogen 3.533 N/A LEU 183.A N ASP 179.A O no hydrogen 2.932 N/A GLY 184.A N VAL 180.A O no hydrogen 2.806 N/A CYS 185.A N TRP 181.A O no hydrogen 2.828 N/A CYS 185.A SG ASN 162.A O no hydrogen 3.597 N/A CYS 185.A SG TRP 181.A O no hydrogen 3.405 N/A ILE 186.A N SER 182.A O no hydrogen 2.929 N/A LEU 187.A N LEU 183.A O no hydrogen 2.913 N/A TYR 188.A N GLY 184.A O no hydrogen 2.669 N/A TYR 188.A OH GLU 218.A O no hydrogen 2.772 N/A TYR 189.A N CYS 185.A O no hydrogen 3.166 N/A MET 190.A N ILE 186.A O no hydrogen 3.180 N/A MET 190.A N LEU 187.A O no hydrogen 2.778 N/A THR 191.A N TYR 188.A O no hydrogen 3.396 N/A THR 191.A OG1 LEU 187.A O no hydrogen 3.231 N/A TYR 192.A N TYR 188.A O no hydrogen 2.960 N/A TYR 192.A OH PRO 220.A O no hydrogen 2.699 N/A LYS 194.A NZ GLN 199.A OE1 no hydrogen 2.751 N/A THR 195.A N GLN 198.A OE1 no hydrogen 3.065 N/A GLN 198.A N THR 195.A O no hydrogen 2.923 N/A GLN 199.A N GLN 199.A OE1 no hydrogen 2.779 N/A ILE 200.A N PHE 197.A O no hydrogen 3.422 N/A GLN 203.A NE2 ILE 201.A O no hydrogen 2.661 N/A SER 205.A N ASN 202.A O no hydrogen 2.827 N/A SER 205.A OG ASN 202.A OD1 no hydrogen 3.015 N/A LYS 206.A N ASN 202.A O no hydrogen 3.251 N/A LYS 206.A NZ ASN 162.A OD1 no hydrogen 3.116 N/A LEU 207.A N GLN 203.A O no hydrogen 3.445 N/A HIS 208.A N SER 205.A O no hydrogen 2.812 N/A ALA 209.A N SER 205.A O no hydrogen 2.922 N/A ILE 210.A N LYS 206.A O no hydrogen 2.712 N/A ASP 212.A N HIS 208.A O no hydrogen 2.995 N/A ASN 214.A N ASP 212.A OD1 no hydrogen 2.790 N/A HIS 215.A N ASP 212.A O no hydrogen 2.759 N/A HIS 215.A ND1 HIS 215.A O no hydrogen 2.482 N/A ILE 222.A N GLN 228.A OE1 no hydrogen 3.365 N/A LYS 225.A NZ ILE 222.A O no hydrogen 2.829 N/A GLN 228.A N GLU 224.A O no hydrogen 3.302 N/A ASP 229.A N LYS 225.A O no hydrogen 3.181 N/A VAL 230.A N ASP 226.A O no hydrogen 3.057 N/A LEU 231.A N LEU 227.A O no hydrogen 3.129 N/A LYS 232.A N GLN 228.A O no hydrogen 3.134 N/A CYS 233.A N ASP 229.A O no hydrogen 2.877 N/A CYS 233.A SG ASP 229.A O no hydrogen 3.258 N/A CYS 233.A SG ASP 229.A OD1 no hydrogen 3.501 N/A CYS 233.A SG ASP 229.A OD2 no hydrogen 3.748 N/A CYS 234.A N VAL 230.A O no hydrogen 2.710 N/A CYS 234.A SG VAL 230.A O no hydrogen 3.455 N/A LEU 235.A N LEU 231.A O no hydrogen 3.013 N/A ARG 237.A NE ILE 210.A O no hydrogen 3.159 N/A ARG 237.A NH1 HIS 215.A O no hydrogen 2.995 N/A ARG 237.A NH2 HIS 215.A O no hydrogen 2.535 N/A LYS 240.A N ASP 238.A OD1 no hydrogen 3.073 N/A GLN 241.A N ASP 238.A O no hydrogen 2.688 N/A ARG 242.A N ASP 238.A O no hydrogen 2.782 N/A ARG 242.A NE LYS 236.A O no hydrogen 2.971 N/A ARG 242.A NH1 GLU 167.A OE1 no hydrogen 3.495 N/A ARG 242.A NH1 GLU 167.A OE2 no hydrogen 2.790 N/A ARG 242.A NH1 LYS 177.A O no hydrogen 2.914 N/A ARG 242.A NH2 GLU 167.A OE1 no hydrogen 2.865 N/A ARG 242.A NH2 LYS 236.A O no hydrogen 3.159 N/A ARG 242.A NH2 ARG 237.A O no hydrogen 3.415 N/A ILE 243.A N CYS 233.A O no hydrogen 3.325 N/A SER 244.A N GLU 247.A OE1 no hydrogen 2.552 N/A GLU 247.A N SER 244.A OG no hydrogen 3.172 N/A LEU 248.A N SER 244.A O no hydrogen 2.935 N/A LEU 249.A N ILE 245.A O no hydrogen 2.933 N/A ALA 250.A N GLU 247.A O no hydrogen 3.098 N/A HIS 251.A N LEU 248.A O no hydrogen 3.167 N/A HIS 251.A NE2 ASP 229.A OD2 no hydrogen 2.987 N/A TYR 253.A N HIS 251.A ND1 no hydrogen 2.819 N/A VAL 254.A N HIS 251.A O no hydrogen 2.792 N/A GLN 255.A N HIS 251.A O no hydrogen 2.845 N/A GLN 255.A NE2 LEU 249.A O no hydrogen 2.981 N/A ILE 256.A N PRO 252.A O no hydrogen 2.840 N/A HIS 259.A ND1 HIS 259.A O no hydrogen 2.605 N/A