Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3cle_L.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N SER 26.A OG no hydrogen 2.917 N/A THR 5.A N LYS 24.A O no hydrogen 2.700 N/A GLN 6.A NE2 TYR 86.A O no hydrogen 2.600 N/A GLN 6.A NE2 THR 102.A OG1 no hydrogen 3.267 N/A GLN 8.A NE2 PHE 10.A O no hydrogen 3.095 N/A MET 11.A N LYS 103.A O no hydrogen 2.788 N/A SER 12.A OG GLU 105.A OE1 no hydrogen 3.044 N/A THR 13.A N GLU 105.A O no hydrogen 3.100 N/A SER 14.A OG ASP 17.A OD1 no hydrogen 3.552 N/A GLY 16.A N VAL 78.A O no hydrogen 2.855 N/A ASP 17.A N SER 14.A O no hydrogen 2.873 N/A VAL 19.A N ILE 75.A O no hydrogen 2.813 N/A SER 20.A OG THR 74.A OG1 no hydrogen 3.099 N/A ILE 21.A N LEU 73.A O no hydrogen 2.635 N/A CYS 23.A N PHE 71.A O no hydrogen 3.038 N/A LYS 24.A N THR 5.A O no hydrogen 2.817 N/A LYS 24.A NZ ASP 70.A OD1 no hydrogen 3.262 N/A ALA 25.A N THR 69.A O no hydrogen 2.915 N/A SER 26.A N VAL 3.A O no hydrogen 2.907 N/A VAL 29.A N GLY 68.A O no hydrogen 2.730 N/A GLY 30.A N ASN 28.A OD1 no hydrogen 2.863 N/A ILE 32.A N VAL 29.A O no hydrogen 3.069 N/A ALA 34.A N GLN 89.A O no hydrogen 2.770 N/A TRP 35.A N ILE 48.A O no hydrogen 2.920 N/A TYR 36.A N PHE 87.A O no hydrogen 2.729 N/A GLN 37.A N LYS 45.A O no hydrogen 2.820 N/A GLN 38.A N GLU 85.A O no hydrogen 2.806 N/A GLN 38.A NE2 GLN 42.A O no hydrogen 2.973 N/A LYS 39.A NZ GLU 81.A O no hydrogen 3.059 N/A GLN 42.A N LYS 39.A O no hydrogen 2.945 N/A GLN 42.A NE2 PRO 40.A O no hydrogen 3.467 N/A LYS 45.A N GLN 37.A O no hydrogen 2.662 N/A LEU 47.A N TRP 35.A O no hydrogen 2.864 N/A ILE 48.A N TRP 35.A O no hydrogen 3.215 N/A TYR 49.A N TYR 53.A O no hydrogen 2.962 N/A LEU 50.A N TYR 91.A OH no hydrogen 3.093 N/A ALA 51.A N ILE 33.A O no hydrogen 2.908 N/A SER 52.A N LEU 50.A O no hydrogen 2.795 N/A TYR 53.A N TYR 49.A O no hydrogen 3.018 N/A ARG 54.A NE VAL 58.A O no hydrogen 3.165 N/A ARG 54.A NH2 VAL 58.A O no hydrogen 3.283 N/A TYR 55.A N LEU 47.A O no hydrogen 3.128 N/A VAL 58.A N TYR 55.A O no hydrogen 3.124 N/A ARG 61.A NE ASP 82.A OD1 no hydrogen 2.517 N/A ARG 61.A NE ASP 82.A OD2 no hydrogen 3.283 N/A ARG 61.A NH2 ASP 82.A OD2 no hydrogen 2.776 N/A PHE 62.A N PRO 59.A O no hydrogen 2.970 N/A THR 63.A N THR 74.A O no hydrogen 3.091 N/A SER 65.A N THR 72.A O no hydrogen 3.113 N/A GLY 68.A N GLY 30.A O no hydrogen 2.727 N/A THR 69.A OG1 ASP 70.A OD2 no hydrogen 3.055 N/A PHE 71.A N CYS 23.A O no hydrogen 2.918 N/A THR 72.A N SER 65.A O no hydrogen 3.136 N/A THR 72.A OG1 ILE 21.A O no hydrogen 3.496 N/A LEU 73.A N ILE 21.A O no hydrogen 2.785 N/A THR 74.A N THR 63.A O no hydrogen 2.971 N/A THR 74.A OG1 SER 20.A OG no hydrogen 3.099 N/A ILE 75.A N VAL 19.A O no hydrogen 2.646 N/A SER 76.A N ARG 61.A O no hydrogen 3.202 N/A SER 76.A OG ARG 61.A O no hydrogen 3.560 N/A VAL 78.A N ASP 17.A O no hydrogen 2.832 N/A GLN 79.A N ASP 82.A OD1 no hydrogen 2.815 N/A GLN 79.A NE2 ASN 77.A O no hydrogen 3.353 N/A ASP 82.A N GLN 79.A O no hydrogen 2.979 N/A LEU 83.A N SER 80.A O no hydrogen 3.160 N/A GLU 85.A N GLN 38.A O no hydrogen 2.923 N/A TYR 86.A N THR 102.A O no hydrogen 2.862 N/A TYR 86.A OH GLN 37.A OE1 no hydrogen 2.838 N/A TYR 86.A OH ASP 82.A O no hydrogen 2.521 N/A PHE 87.A N TYR 36.A O no hydrogen 2.810 N/A CYS 88.A N GLN 6.A OE1 no hydrogen 3.378 N/A CYS 88.A SG GLN 6.A OE1 no hydrogen 3.571 N/A GLN 89.A N ALA 34.A O no hydrogen 2.912 N/A GLN 90.A N THR 97.A O no hydrogen 3.079 N/A TYR 91.A N ILE 32.A O no hydrogen 3.192 N/A THR 97.A OG1 ILE 2.A O no hydrogen 2.716 N/A THR 97.A OG1 GLN 90.A OE1 no hydrogen 3.444 N/A GLY 99.A N CYS 88.A O no hydrogen 2.911 N/A GLY 101.A N GLN 6.A OE1 no hydrogen 3.050 N/A THR 102.A N TYR 86.A O no hydrogen 2.938 N/A THR 102.A OG1 GLN 8.A O no hydrogen 2.731 N/A LYS 103.A N LYS 9.A O no hydrogen 2.550 N/A LYS 103.A NZ GLU 85.A OE2 no hydrogen 3.567 N/A LEU 104.A N ALA 84.A O no hydrogen 2.954 N/A GLU 105.A N MET 11.A O no hydrogen 2.988 N/A LEU 106.A N GLN 166.A OE1 no hydrogen 2.868 N/A LYS 107.A N THR 13.A O no hydrogen 2.629 N/A ARG 108.A NE ASP 170.A O no hydrogen 3.057 N/A ARG 108.A NH1 ALA 109.A O no hydrogen 2.891 N/A ARG 108.A NH2 ASP 170.A O no hydrogen 2.716 N/A ALA 111.A N TYR 140.A O no hydrogen 2.965 N/A THR 114.A N ASN 137.A O no hydrogen 2.989 N/A SER 116.A N PHE 135.A O no hydrogen 3.024 N/A PHE 118.A N VAL 133.A O no hydrogen 2.756 N/A GLU 123.A N GLU 123.A OE2 no hydrogen 2.595 N/A GLN 124.A N SER 121.A OG no hydrogen 3.208 N/A GLN 124.A NE2 SER 131.A OG no hydrogen 2.899 N/A LEU 125.A N SER 121.A O no hydrogen 3.073 N/A THR 126.A N SER 122.A O no hydrogen 2.871 N/A THR 126.A OG1 SER 122.A O no hydrogen 3.022 N/A SER 127.A N GLN 124.A O no hydrogen 3.093 N/A GLY 128.A N LEU 125.A O no hydrogen 2.993 N/A GLY 129.A N GLN 124.A O no hydrogen 2.935 N/A ALA 130.A N LEU 181.A O no hydrogen 3.238 N/A SER 131.A N GLN 124.A OE1 no hydrogen 2.905 N/A SER 131.A OG THR 180.A OG1 no hydrogen 3.254 N/A VAL 132.A N LEU 179.A O no hydrogen 2.824 N/A VAL 133.A N PHE 118.A O no hydrogen 3.063 N/A CYS 134.A N SER 177.A O no hydrogen 2.842 N/A PHE 135.A N SER 116.A O no hydrogen 2.804 N/A LEU 136.A N MET 175.A O no hydrogen 2.883 N/A ASN 137.A N THR 114.A O no hydrogen 3.001 N/A ASN 138.A N SER 174.A OG no hydrogen 3.025 N/A PHE 139.A N TYR 173.A O no hydrogen 2.862 N/A TYR 140.A N ALA 111.A O no hydrogen 2.907 N/A TYR 140.A OH GLU 105.A OE1 no hydrogen 2.880 N/A LYS 142.A NZ GLU 105.A OE2 no hydrogen 3.550 N/A ASN 145.A N THR 197.A O no hydrogen 3.019 N/A LYS 147.A N GLU 195.A O no hydrogen 2.637 N/A TRP 148.A NE1 SER 177.A OG no hydrogen 2.954 N/A LYS 149.A N THR 193.A O no hydrogen 3.002 N/A LYS 149.A NZ GLU 195.A OE2 no hydrogen 2.649 N/A ILE 150.A N SER 153.A O no hydrogen 2.728 N/A ASP 151.A N SER 191.A O no hydrogen 2.650 N/A SER 153.A N ILE 150.A O no hydrogen 3.016 N/A ARG 155.A N TRP 148.A O no hydrogen 2.799 N/A ARG 155.A NE ASN 157.A O no hydrogen 2.854 N/A ARG 155.A NH1 GLU 185.A OE2 no hydrogen 2.905 N/A ARG 155.A NH2 GLU 185.A OE1 no hydrogen 3.402 N/A ARG 155.A NH2 GLU 185.A OE2 no hydrogen 3.545 N/A LEU 160.A N THR 178.A O no hydrogen 2.911 N/A SER 162.A N SER 176.A O no hydrogen 2.958 N/A THR 164.A N SER 174.A O no hydrogen 3.181 N/A THR 164.A OG1 ASP 165.A O no hydrogen 3.404 N/A THR 164.A OG1 SER 174.A O no hydrogen 3.233 N/A GLN 166.A NE2 LEU 106.A O no hydrogen 2.801 N/A GLN 166.A NE2 SER 171.A O no hydrogen 3.127 N/A ASP 167.A N THR 172.A O no hydrogen 2.927 N/A LYS 169.A N ASP 167.A OD1 no hydrogen 2.478 N/A ASP 170.A N ASP 167.A OD1 no hydrogen 2.808 N/A SER 171.A N ASP 167.A O no hydrogen 2.809 N/A THR 172.A N ASP 170.A OD2 no hydrogen 2.929 N/A THR 172.A OG1 ASP 170.A OD1 no hydrogen 3.131 N/A THR 172.A OG1 ASP 170.A OD2 no hydrogen 2.605 N/A TYR 173.A N PHE 139.A O no hydrogen 2.829 N/A TYR 173.A OH GLU 105.A OE2 no hydrogen 3.430 N/A SER 174.A N THR 164.A OG1 no hydrogen 3.189 N/A MET 175.A N LEU 136.A O no hydrogen 2.884 N/A SER 176.A N SER 162.A O no hydrogen 2.872 N/A SER 177.A N CYS 134.A O no hydrogen 2.859 N/A THR 178.A N LEU 160.A O no hydrogen 3.001 N/A LEU 179.A N VAL 132.A O no hydrogen 2.846 N/A THR 180.A N GLY 158.A O no hydrogen 2.769 N/A THR 180.A OG1 SER 131.A OG no hydrogen 3.254 N/A LEU 181.A N ALA 130.A O no hydrogen 2.803 N/A LYS 183.A N GLY 128.A O no hydrogen 3.193 N/A GLU 185.A N THR 182.A OG1 no hydrogen 3.083 N/A TYR 186.A N THR 182.A O no hydrogen 2.936 N/A GLU 187.A N LYS 183.A O no hydrogen 2.955 N/A ARG 188.A N GLU 185.A O no hydrogen 2.896 N/A HIS 189.A N TYR 186.A O no hydrogen 3.376 N/A ASN 190.A N ASP 151.A OD1 no hydrogen 3.169 N/A ASN 190.A N ASP 151.A OD2 no hydrogen 3.263 N/A SER 191.A N ASP 151.A OD2 no hydrogen 2.541 N/A TYR 192.A N PHE 209.A O no hydrogen 3.070 N/A TYR 192.A OH TYR 186.A O no hydrogen 2.647 N/A THR 193.A N LYS 149.A O no hydrogen 3.000 N/A CYS 194.A N LYS 207.A O no hydrogen 2.711 N/A GLU 195.A N LYS 147.A O no hydrogen 2.778 N/A ALA 196.A N ILE 205.A O no hydrogen 3.015 N/A THR 197.A N ASN 145.A O no hydrogen 2.827 N/A HIS 198.A ND1 ASP 143.A O no hydrogen 3.026 N/A HIS 198.A NE2 TYR 140.A O no hydrogen 3.182 N/A SER 201.A N HIS 198.A O no hydrogen 3.039 N/A SER 201.A OG SER 203.A O no hydrogen 2.463 N/A ILE 205.A N ALA 196.A O no hydrogen 2.805 N/A LYS 207.A N CYS 194.A O no hydrogen 3.055 N/A PHE 209.A N TYR 192.A O no hydrogen 3.074 N/A ARG 211.A N ASN 190.A O no hydrogen 2.964 N/A ARG 211.A NH1 HIS 189.A O no hydrogen 2.655 N/A