Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3jqr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 4.A N ALA 108.A O no hydrogen 2.846 N/A TYR 6.A N GLY 107.A O no hydrogen 2.784 N/A TYR 6.A OH LEU 41.A O no hydrogen 2.626 N/A LEU 12.A N LEU 105.A O no hydrogen 2.799 N/A CYS 14.A N ILE 103.A O no hydrogen 2.753 N/A CYS 14.A SG LEU 12.A O no hydrogen 3.473 N/A LYS 15.A N ASN 37.A O no hydrogen 3.051 N/A LYS 15.A NZ ASN 100.A OD1 no hydrogen 2.410 N/A ILE 16.A N ASP 101.A O no hydrogen 3.123 N/A VAL 17.A N GLU 35.A O no hydrogen 2.743 N/A ASP 18.A N GLU 35.A O no hydrogen 3.373 N/A LYS 19.A NZ ILE 94.A O no hydrogen 2.754 N/A LYS 19.A NZ LYS 95.A O no hydrogen 3.054 N/A LYS 19.A NZ LEU 97.A O no hydrogen 2.968 N/A ILE 20.A N HIS 33.A O no hydrogen 2.984 N/A LEU 22.A N VAL 31.A O no hydrogen 2.888 N/A ARG 24.A N ASP 164.A O no hydrogen 3.029 N/A ARG 24.A NH1 ILE 166.A O no hydrogen 3.083 N/A ARG 24.A NH2 GLU 163.A O no hydrogen 3.051 N/A ARG 24.A NH2 ILE 166.A O no hydrogen 2.973 N/A ASN 26.A N ASP 164.A OD2 no hydrogen 3.027 N/A SER 27.A N ARG 24.A O no hydrogen 3.044 N/A SER 27.A OG SER 165.A OG no hydrogen 2.645 N/A ASN 29.A N SER 27.A OG no hydrogen 3.300 N/A TYR 32.A N ILE 77.A O no hydrogen 2.986 N/A TYR 32.A OH GLU 30.A OE1 no hydrogen 2.759 N/A HIS 33.A N ILE 20.A O no hydrogen 2.708 N/A HIS 33.A ND1 TYR 168.A OH no hydrogen 2.786 N/A HIS 33.A NE2 GLU 35.A OE2 no hydrogen 2.673 N/A LEU 34.A N VAL 75.A O no hydrogen 2.910 N/A GLU 35.A N ASP 18.A O no hydrogen 2.746 N/A ILE 36.A N LEU 73.A O no hydrogen 2.931 N/A ASN 37.A N LYS 15.A O no hydrogen 2.759 N/A ASN 39.A N ASN 37.A OD1 no hydrogen 2.964 N/A LEU 41.A N HIS 38.A O no hydrogen 2.768 N/A PHE 42.A N HIS 38.A ND1 no hydrogen 2.991 N/A LEU 45.A N HIS 48.A ND1 no hydrogen 2.929 N/A HIS 48.A N LEU 45.A O no hydrogen 3.135 N/A THR 49.A N HIS 109.A O no hydrogen 2.929 N/A THR 49.A OG1 HIS 109.A O no hydrogen 3.303 N/A CYS 50.A N TYR 62.A O no hydrogen 2.960 N/A CYS 50.A SG TYR 62.A O no hydrogen 3.890 N/A GLY 51.A N THR 106.A O no hydrogen 2.760 N/A ILE 52.A N ARG 60.A O no hydrogen 2.865 N/A ILE 53.A N TYR 104.A O no hydrogen 3.128 N/A ARG 60.A N ILE 52.A O no hydrogen 3.095 N/A ARG 60.A NH1 CYS 58.A O no hydrogen 3.436 N/A TYR 62.A N CYS 50.A O no hydrogen 2.881 N/A ILE 64.A N HIS 48.A O no hydrogen 3.100 N/A SER 65.A N SER 74.A O no hydrogen 2.984 N/A SER 65.A OG SER 74.A OG no hydrogen 2.693 N/A SER 65.A OG TYR 168.A OH no hydrogen 2.481 N/A SER 66.A OG TYR 44.A OH no hydrogen 2.890 N/A SER 67.A OG ASN 69.A OD1 no hydrogen 3.447 N/A ASN 68.A N GLU 46.A OE2 no hydrogen 2.735 N/A ASN 68.A ND2 TYR 44.A O no hydrogen 2.349 N/A MET 70.A N SER 67.A O no hydrogen 3.134 N/A LEU 73.A N ILE 36.A O no hydrogen 3.057 N/A SER 74.A N SER 66.A OG no hydrogen 2.884 N/A SER 74.A OG SER 65.A OG no hydrogen 2.693 N/A VAL 75.A N LEU 34.A O no hydrogen 3.335 N/A ILE 77.A N TYR 32.A O no hydrogen 2.895 N/A LYS 78.A NZ ASN 29.A OD1 no hydrogen 3.323 N/A ILE 79.A N GLU 30.A O no hydrogen 2.759 N/A HIS 80.A N SER 91.A OG no hydrogen 2.904 N/A GLY 88.A N HIS 80.A O no hydrogen 2.854 N/A CYS 90.A SG TYR 62.A OH no hydrogen 3.241 N/A GLY 92.A N GLY 88.A O no hydrogen 2.959 N/A ILE 94.A N CYS 90.A O no hydrogen 2.865 N/A LYS 95.A N SER 91.A O no hydrogen 2.726 N/A LYS 95.A NZ GLU 30.A OE1 no hydrogen 3.314 N/A ASN 96.A N GLY 92.A O no hydrogen 3.297 N/A LEU 97.A N ILE 94.A O no hydrogen 3.128 N/A LYS 98.A N ASP 101.A OD2 no hydrogen 2.631 N/A ASN 100.A N ILE 16.A O no hydrogen 2.419 N/A ASP 101.A N LYS 98.A O no hydrogen 3.213 N/A ILE 103.A N CYS 14.A O no hydrogen 2.919 N/A LEU 105.A N LEU 12.A O no hydrogen 2.936 N/A THR 106.A N GLY 51.A O no hydrogen 2.777 N/A THR 106.A OG1 HIS 109.A NE2 no hydrogen 2.739 N/A GLY 107.A N TYR 6.A O no hydrogen 2.673 N/A ALA 108.A N PHE 2.A O no hydrogen 3.029 N/A HIS 109.A N THR 49.A O no hydrogen 3.053 N/A HIS 109.A ND1 ASN 4.A OD1 no hydrogen 2.983 N/A HIS 109.A NE2 THR 106.A OG1 no hydrogen 2.739 N/A ASN 113.A N TYR 111.A O no hydrogen 2.873 N/A ALA 118.A N PRO 115.A O no hydrogen 2.973 N/A LYS 121.A N ASP 117.A O no hydrogen 2.937 N/A LYS 121.A NZ ASP 117.A OD2 no hydrogen 2.334 N/A THR 123.A N ALA 118.A O no hydrogen 3.311 N/A PHE 125.A N TYR 153.A O no hydrogen 2.858 N/A ILE 126.A N GLU 223.A O no hydrogen 3.025 N/A PHE 127.A N THR 155.A O no hydrogen 2.833 N/A ILE 128.A N TYR 225.A O no hydrogen 2.747 N/A ALA 129.A N TYR 157.A O no hydrogen 2.880 N/A THR 130.A N CYS 227.A O no hydrogen 3.010 N/A GLY 131.A N GLY 159.A O no hydrogen 3.211 N/A THR 132.A OG1 TYR 256.A OH no hydrogen 2.667 N/A GLY 133.A N THR 130.A O no hydrogen 2.904 N/A SER 135.A N THR 132.A O no hydrogen 3.222 N/A TYR 137.A N ILE 134.A O no hydrogen 2.799 N/A TYR 137.A OH ILE 128.A O no hydrogen 2.788 N/A ILE 138.A N ILE 134.A O no hydrogen 3.082 N/A SER 139.A N SER 135.A O no hydrogen 3.333 N/A SER 139.A OG PRO 136.A O no hydrogen 3.149 N/A PHE 140.A N PRO 136.A O no hydrogen 2.975 N/A LEU 141.A N TYR 137.A O no hydrogen 2.906 N/A LYS 142.A N ILE 138.A O no hydrogen 3.176 N/A LYS 142.A NZ SER 65.A O no hydrogen 3.080 N/A LYS 143.A N SER 139.A O no hydrogen 3.211 N/A LEU 144.A N PHE 140.A O no hydrogen 2.838 N/A PHE 145.A N LEU 141.A O no hydrogen 2.952 N/A ALA 146.A N LYS 143.A O no hydrogen 2.740 N/A TYR 147.A N LYS 142.A O no hydrogen 2.423 N/A TYR 150.A OH THR 123.A O no hydrogen 2.635 N/A THR 151.A N ASN 122.A OD1 no hydrogen 2.837 N/A ILE 154.A N ASN 182.A O no hydrogen 2.695 N/A THR 155.A N PHE 125.A O no hydrogen 2.886 N/A ILE 156.A N ASN 184.A O no hydrogen 2.796 N/A TYR 157.A N PHE 127.A O no hydrogen 2.888 N/A TYR 158.A N HIS 186.A O no hydrogen 3.072 N/A TYR 158.A OH GLY 131.A O no hydrogen 2.535 N/A GLY 159.A N ALA 129.A O no hydrogen 3.037 N/A VAL 160.A N VAL 188.A O no hydrogen 2.777 N/A ASN 162.A ND2 ASN 26.A O no hydrogen 3.081 N/A SER 165.A N ASN 162.A O no hydrogen 2.975 N/A SER 165.A OG SER 27.A OG no hydrogen 2.645 N/A SER 165.A OG ASN 162.A OD1 no hydrogen 2.797 N/A ILE 166.A N GLU 163.A O no hydrogen 3.204 N/A LEU 167.A N TYR 158.A OH no hydrogen 3.429 N/A TYR 168.A OH HIS 33.A ND1 no hydrogen 2.786 N/A GLU 171.A N GLU 171.A OE1 no hydrogen 2.641 N/A LEU 172.A N TYR 168.A O no hydrogen 3.040 N/A GLU 173.A N LEU 169.A O no hydrogen 2.885 N/A TYR 174.A N ASN 170.A O no hydrogen 2.901 N/A PHE 175.A N GLU 171.A O no hydrogen 2.932 N/A GLN 176.A N LEU 172.A O no hydrogen 3.033 N/A LYS 177.A N GLU 173.A O no hydrogen 3.015 N/A MET 178.A N TYR 174.A O no hydrogen 2.845 N/A TYR 179.A N PHE 175.A O no hydrogen 3.037 N/A ASN 182.A N TYR 179.A O no hydrogen 2.913 N/A ASN 182.A ND2 GLY 152.A O no hydrogen 2.791 N/A ILE 183.A N TYR 179.A O no hydrogen 3.042 N/A ASN 184.A N ILE 154.A O no hydrogen 2.936 N/A ILE 185.A N GLN 176.A OE1 no hydrogen 3.285 N/A HIS 186.A N ILE 156.A O no hydrogen 2.648 N/A VAL 188.A N TYR 158.A O no hydrogen 2.798 N/A SER 190.A N VAL 160.A O no hydrogen 2.978 N/A SER 190.A OG LYS 192.A O no hydrogen 3.238 N/A SER 190.A OG THR 198.A OG1 no hydrogen 2.966 N/A TYR 191.A N TYR 161.A O no hydrogen 2.729 N/A LYS 192.A N SER 190.A OG no hydrogen 3.198 N/A LYS 192.A NZ SER 190.A O no hydrogen 3.548 N/A LYS 192.A NZ TYR 201.A OH no hydrogen 3.013 N/A THR 198.A N ASN 194.A O no hydrogen 3.359 N/A THR 198.A OG1 SER 190.A OG no hydrogen 2.966 N/A THR 198.A OG1 LYS 192.A O no hydrogen 3.371 N/A THR 198.A OG1 ASN 194.A O no hydrogen 3.360 N/A SER 199.A N SER 195.A O no hydrogen 3.144 N/A SER 199.A OG ASP 196.A O no hydrogen 2.774 N/A SER 199.A OG SER 231.A O no hydrogen 2.988 N/A SER 199.A OG SER 231.A OG no hydrogen 3.159 N/A PHE 200.A N ALA 197.A O no hydrogen 2.970 N/A TYR 201.A N ALA 197.A O no hydrogen 3.243 N/A VAL 202.A N THR 198.A O no hydrogen 3.115 N/A GLN 203.A N SER 199.A O no hydrogen 3.051 N/A ASP 204.A N PHE 200.A O no hydrogen 2.837 N/A GLU 205.A N TYR 201.A O no hydrogen 3.139 N/A ILE 206.A N VAL 202.A O no hydrogen 3.058 N/A TYR 207.A N GLN 203.A O no hydrogen 2.863 N/A LYS 208.A N ASP 204.A O no hydrogen 2.880 N/A ARG 209.A N GLU 205.A O no hydrogen 3.093 N/A ARG 209.A N ILE 206.A O no hydrogen 3.061 N/A ARG 209.A NE GLU 205.A OE1 no hydrogen 2.694 N/A ARG 209.A NH2 GLU 205.A OE1 no hydrogen 3.076 N/A LYS 210.A N TYR 207.A O no hydrogen 2.995 N/A PHE 213.A N ARG 209.A O no hydrogen 2.972 N/A LEU 214.A N LYS 210.A O no hydrogen 2.894 N/A ASN 215.A N THR 211.A O no hydrogen 3.042 N/A LEU 216.A N GLU 212.A O no hydrogen 2.821 N/A PHE 217.A N PHE 213.A O no hydrogen 2.987 N/A ASN 218.A N LEU 214.A O no hydrogen 2.912 N/A ASN 218.A ND2 ASP 244.A OD2 no hydrogen 3.207 N/A ASN 219.A N ASN 215.A O no hydrogen 2.898 N/A ASN 219.A ND2 ASN 215.A OD1 no hydrogen 2.767 N/A TYR 220.A N ASN 215.A O no hydrogen 3.281 N/A TYR 220.A N LEU 216.A O no hydrogen 3.262 N/A CYS 222.A SG LEU 216.A O no hydrogen 3.273 N/A GLU 223.A N ASN 124.A O no hydrogen 2.989 N/A LEU 224.A N ARG 250.A O no hydrogen 2.621 N/A TYR 225.A N ILE 126.A O no hydrogen 2.895 N/A TYR 225.A OH ASN 113.A O no hydrogen 2.681 N/A ILE 226.A N HIS 252.A O no hydrogen 2.836 N/A CYS 227.A N ILE 128.A O no hydrogen 2.848 N/A CYS 227.A SG GLY 133.A O no hydrogen 3.567 N/A CYS 227.A SG GLU 254.A O no hydrogen 3.343 N/A SER 231.A OG SER 195.A O no hydrogen 3.144 N/A SER 231.A OG SER 199.A OG no hydrogen 3.159 N/A ILE 232.A N LEU 229.A O no hydrogen 3.348 N/A LYS 235.A NZ ASP 196.A OD1 no hydrogen 2.660 N/A LYS 235.A NZ SER 199.A OG no hydrogen 2.846 N/A LYS 235.A NZ SER 231.A O no hydrogen 3.167 N/A VAL 236.A N ILE 232.A O no hydrogen 3.233 N/A VAL 236.A N ARG 233.A O no hydrogen 3.101 N/A MET 237.A N ARG 233.A O no hydrogen 2.916 N/A ASP 238.A N TYR 234.A O no hydrogen 2.760 N/A ILE 239.A N VAL 236.A O no hydrogen 2.957 N/A LEU 240.A N VAL 236.A O no hydrogen 3.427 N/A LYS 241.A N MET 237.A O no hydrogen 2.879 N/A SER 242.A N ASP 238.A O no hydrogen 3.168 N/A SER 242.A OG ASP 238.A O no hydrogen 2.791 N/A HIS 243.A N LEU 240.A O no hydrogen 3.450 N/A ASP 244.A N LEU 240.A O no hydrogen 2.956 N/A ARG 250.A NH1 PHE 217.A O no hydrogen 3.182 N/A ARG 250.A NH1 CYS 222.A O no hydrogen 3.247 N/A HIS 252.A N LEU 224.A O no hydrogen 2.792 N/A HIS 252.A NE2 GLU 223.A OE1 no hydrogen 2.771 N/A GLU 254.A N ILE 226.A O no hydrogen 3.022 N/A TYR 256.A N GLY 228.A O no hydrogen 2.531 N/A TYR 256.A OH THR 132.A OG1 no hydrogen 2.667 N/A