Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4cjb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N SER 33.A O no hydrogen 3.130 N/A ARG 2.A N ASP 89.A OD2 no hydrogen 3.206 N/A ARG 2.A NE ASP 89.A OD2 no hydrogen 2.549 N/A ARG 2.A NH1 ARG 86.A O no hydrogen 2.671 N/A ARG 2.A NH2 ASP 89.A OD1 no hydrogen 2.832 N/A ARG 2.A NH2 ASP 89.A OD2 no hydrogen 3.192 N/A ILE 3.A N ILE 35.A O no hydrogen 2.878 N/A GLY 4.A N TYR 90.A O no hydrogen 2.728 N/A ILE 5.A N GLU 37.A O no hydrogen 2.719 N/A LEU 6.A N PHE 92.A O no hydrogen 2.806 N/A TYR 7.A N TYR 39.A O no hydrogen 3.046 N/A TYR 7.A OH ALA 96.A O no hydrogen 2.561 N/A CYS 9.A N PHE 41.A O no hydrogen 2.919 N/A GLY 11.A N ASP 43.A OD1 no hydrogen 3.076 N/A GLY 11.A N ASP 43.A OD2 no hydrogen 3.270 N/A TYR 13.A N THR 10.A O no hydrogen 3.062 N/A ASP 14.A N ASP 14.A OD1 no hydrogen 2.537 N/A PHE 16.A N TYR 13.A O no hydrogen 3.221 N/A TRP 17.A N ASP 14.A O no hydrogen 3.249 N/A TRP 17.A NE1 TYR 48.A O no hydrogen 3.226 N/A PHE 20.A N PHE 16.A O no hydrogen 3.445 N/A TYR 21.A N TRP 17.A O no hydrogen 2.859 N/A TYR 21.A OH ASP 49.A OD2 no hydrogen 2.824 N/A LEU 22.A N LYS 18.A O no hydrogen 3.037 N/A SER 23.A N ASP 19.A O no hydrogen 3.116 N/A SER 23.A OG ASP 19.A O no hydrogen 2.863 N/A SER 23.A OG PHE 20.A O no hydrogen 2.578 N/A ALA 24.A N PHE 20.A O no hydrogen 2.951 N/A GLU 25.A N TYR 21.A O no hydrogen 2.811 N/A ARG 26.A N SER 23.A O no hydrogen 3.207 N/A TYR 27.A N SER 23.A O no hydrogen 2.846 N/A PHE 28.A N ALA 24.A O no hydrogen 3.313 N/A MET 29.A N ILE 104.A O no hydrogen 3.025 N/A SER 33.A N ASP 31.A OD2 no hydrogen 3.170 N/A SER 33.A OG ASP 31.A OD2 no hydrogen 2.363 N/A PHE 34.A N ASP 31.A O no hydrogen 3.027 N/A ILE 35.A N MET 1.A O no hydrogen 2.962 N/A GLU 37.A N ILE 3.A O no hydrogen 2.912 N/A TYR 38.A N HIS 55.A O no hydrogen 2.787 N/A TYR 38.A OH GLU 25.A OE2 no hydrogen 2.323 N/A TYR 39.A N ILE 5.A O no hydrogen 2.723 N/A TYR 39.A OH GLU 87.A OE1 no hydrogen 2.892 N/A VAL 40.A N HIS 57.A O no hydrogen 2.956 N/A PHE 41.A N TYR 7.A O no hydrogen 2.772 N/A THR 42.A N ILE 59.A O no hydrogen 3.033 N/A THR 42.A OG1 CYS 9.A O no hydrogen 2.821 N/A THR 42.A OG1 ASP 43.A OD1 no hydrogen 3.490 N/A SER 44.A N THR 42.A OG1 no hydrogen 2.958 N/A SER 44.A OG LYS 46.A O no hydrogen 2.800 N/A LYS 46.A NZ LEU 47.A O no hydrogen 2.899 N/A LYS 46.A NZ GLU 51.A OE1 no hydrogen 2.730 N/A LEU 47.A N GLU 50.A OE1 no hydrogen 2.773 N/A GLU 50.A N LEU 47.A O no hydrogen 3.260 N/A GLU 51.A N GLU 51.A OE1 no hydrogen 2.558 N/A ASN 52.A N ASP 49.A O no hydrogen 3.259 N/A ASN 52.A ND2 ASP 49.A OD1 no hydrogen 2.888 N/A ASN 53.A N ASP 49.A O no hydrogen 2.905 N/A ASN 53.A ND2 TYR 21.A OH no hydrogen 2.705 N/A HIS 55.A N ASN 53.A OD1 no hydrogen 3.057 N/A HIS 55.A ND1 GLU 37.A OE2 no hydrogen 2.666 N/A HIS 57.A N TYR 38.A O no hydrogen 2.762 N/A HIS 57.A NE2 GLU 37.A OE1 no hydrogen 2.345 N/A ILE 59.A N VAL 40.A O no hydrogen 2.840 N/A GLN 61.A N THR 42.A O no hydrogen 2.885 N/A GLN 61.A NE2 LYS 62.A O no hydrogen 2.736 N/A LEU 64.A N ASN 69.A OD1 no hydrogen 2.924 N/A GLY 65.A N ASN 63.A OD1 no hydrogen 2.647 N/A ASN 69.A N GLY 65.A O no hydrogen 3.027 N/A ASN 69.A ND2 ASN 63.A OD1 no hydrogen 2.587 N/A THR 70.A N PRO 67.A O no hydrogen 2.710 N/A THR 70.A OG1 PRO 67.A O no hydrogen 3.343 N/A LEU 71.A N PRO 67.A O no hydrogen 2.546 N/A LYS 72.A N ASP 68.A O no hydrogen 2.820 N/A LYS 72.A NZ ASP 68.A OD1 no hydrogen 2.959 N/A ILE 76.A N LYS 72.A O no hydrogen 3.184 N/A LEU 78.A N PHE 74.A O no hydrogen 3.264 N/A ARG 79.A NH1 LYS 60.A O no hydrogen 2.928 N/A ARG 79.A NH2 LYS 60.A O no hydrogen 3.379 N/A ILE 80.A N PHE 77.A O no hydrogen 3.353 N/A LYS 81.A N LEU 78.A O no hydrogen 3.420 N/A GLU 82.A N GLU 82.A OE1 no hydrogen 2.847 N/A GLN 83.A NE2 GLU 87.A OE1 no hydrogen 3.476 N/A LEU 84.A N ILE 80.A O no hydrogen 3.234 N/A GLU 85.A N LYS 81.A O no hydrogen 3.005 N/A GLU 85.A N GLU 82.A O no hydrogen 3.138 N/A ARG 86.A N GLU 82.A O no hydrogen 3.314 N/A GLU 87.A N GLN 83.A O no hydrogen 3.193 N/A THR 88.A N LEU 84.A O no hydrogen 3.114 N/A THR 88.A OG1 LEU 84.A O no hydrogen 2.611 N/A THR 88.A OG1 THR 163.A OG1 no hydrogen 2.848 N/A ASP 89.A N ARG 2.A O no hydrogen 2.850 N/A TYR 90.A N ARG 2.A O no hydrogen 3.110 N/A LEU 91.A N GLY 161.A O no hydrogen 2.838 N/A PHE 92.A N GLY 4.A O no hydrogen 2.878 N/A PHE 93.A N SER 159.A O no hydrogen 2.698 N/A PHE 94.A N LEU 6.A O no hydrogen 3.330 N/A ASN 95.A N GLY 157.A O no hydrogen 3.007 N/A ASN 97.A ND2 ARG 229.A O no hydrogen 3.055 N/A LEU 98.A N ASN 95.A O no hydrogen 3.241 N/A LEU 99.A N LEU 227.A O no hydrogen 2.835 N/A THR 101.A N ILE 225.A O no hydrogen 3.069 N/A THR 101.A OG1 PRO 224.A O no hydrogen 3.019 N/A THR 101.A OG1 ILE 225.A O no hydrogen 3.053 N/A SER 102.A OG PRO 103.A O no hydrogen 3.173 N/A ILE 104.A N TYR 27.A O no hydrogen 2.866 N/A GLY 105.A N GLU 107.A OE2 no hydrogen 2.752 N/A GLU 107.A N GLU 107.A OE1 no hydrogen 2.876 N/A LEU 109.A N LYS 106.A O no hydrogen 3.250 N/A ASP 113.A N ASP 113.A OD1 no hydrogen 2.484 N/A SER 114.A N PRO 111.A O no hydrogen 3.084 N/A SER 114.A OG PRO 111.A O no hydrogen 2.524 N/A ASN 115.A ND2 PRO 203.A O no hydrogen 2.570 N/A GLY 116.A N SER 114.A OG no hydrogen 3.172 N/A LEU 117.A N ASN 115.A OD1 no hydrogen 3.082 N/A LEU 118.A N GLY 160.A O no hydrogen 2.762 N/A GLY 119.A N ILE 206.A O no hydrogen 2.859 N/A THR 120.A OG1 LEU 158.A O no hydrogen 2.916 N/A MET 121.A N LEU 208.A O no hydrogen 2.814 N/A HIS 122.A N TYR 153.A O no hydrogen 2.998 N/A GLY 124.A N HIS 122.A ND1 no hydrogen 3.017 N/A PHE 125.A N HIS 122.A O no hydrogen 3.133 N/A LYS 128.A N PHE 125.A O no hydrogen 3.047 N/A LYS 128.A NZ GLY 124.A O no hydrogen 3.169 N/A LYS 128.A NZ ASN 127.A OD1 no hydrogen 2.418 N/A ASN 130.A ND2 GLU 149.A O no hydrogen 3.301 N/A GLU 132.A N PRO 129.A O no hydrogen 3.064 N/A PHE 133.A N ASN 130.A O no hydrogen 3.139 N/A THR 134.A OG1 TYR 153.A OH no hydrogen 3.016 N/A TYR 135.A OH TYR 152.A O no hydrogen 2.595 N/A ARG 137.A NH1 ILE 145.A O no hydrogen 2.838 N/A ARG 137.A NH2 PHE 133.A O no hydrogen 2.995 N/A ARG 138.A N GLU 136.A OE1 no hydrogen 3.198 N/A ARG 138.A NE GLU 136.A OE1 no hydrogen 3.046 N/A ARG 138.A NE GLU 136.A OE2 no hydrogen 3.400 N/A ARG 138.A NH2 GLU 136.A OE2 no hydrogen 2.689 N/A ARG 138.A NH2 ILE 186.A O no hydrogen 2.927 N/A SER 141.A N ARG 138.A O no hydrogen 2.875 N/A SER 141.A OG ASP 180.A OD2 no hydrogen 2.480 N/A THR 142.A N ASP 180.A OD1 no hydrogen 2.922 N/A THR 142.A N ASP 180.A OD2 no hydrogen 3.426 N/A THR 142.A OG1 TRP 176.A O no hydrogen 3.013 N/A THR 142.A OG1 ASP 180.A OD1 no hydrogen 3.152 N/A ALA 143.A N SER 141.A OG no hydrogen 3.122 N/A TYR 144.A N SER 141.A O no hydrogen 3.297 N/A ILE 145.A N GLU 136.A O no hydrogen 2.948 N/A GLU 149.A N PRO 146.A O no hydrogen 3.484 N/A TYR 153.A OH THR 134.A OG1 no hydrogen 3.016 N/A TYR 154.A N ASN 196.A OD1 no hydrogen 2.555 N/A TYR 154.A OH THR 207.A OG1 no hydrogen 2.873 N/A ALA 155.A N THR 120.A O no hydrogen 2.855 N/A SER 159.A N PHE 93.A O no hydrogen 3.415 N/A SER 159.A OG TYR 166.A OH no hydrogen 2.940 N/A GLY 160.A N LEU 118.A O no hydrogen 3.286 N/A GLY 161.A N LEU 91.A O no hydrogen 2.922 N/A CYS 162.A N GLY 116.A O no hydrogen 3.108 N/A CYS 162.A SG GLY 116.A O no hydrogen 3.977 N/A THR 163.A N ASP 89.A O no hydrogen 2.774 N/A THR 163.A OG1 THR 88.A OG1 no hydrogen 2.848 N/A TYR 166.A N CYS 162.A O no hydrogen 2.961 N/A TYR 166.A OH SER 159.A OG no hydrogen 2.940 N/A LEU 167.A N THR 163.A O no hydrogen 3.008 N/A LYS 168.A N LYS 164.A O no hydrogen 3.120 N/A LEU 169.A N ALA 165.A O no hydrogen 3.095 N/A CYS 170.A N TYR 166.A O no hydrogen 2.873 N/A CYS 170.A SG TYR 166.A O no hydrogen 3.322 N/A THR 171.A N LEU 167.A O no hydrogen 2.875 N/A THR 171.A OG1 LEU 167.A O no hydrogen 2.834 N/A THR 172.A N LYS 168.A O no hydrogen 3.102 N/A THR 172.A OG1 LYS 168.A O no hydrogen 2.787 N/A ILE 173.A N LEU 169.A O no hydrogen 3.046 N/A CYS 174.A N CYS 170.A O no hydrogen 3.164 N/A CYS 174.A SG HIS 75.A ND1 no hydrogen 3.502 N/A CYS 174.A SG CYS 170.A O no hydrogen 3.129 N/A SER 175.A N THR 171.A O no hydrogen 3.270 N/A SER 175.A OG THR 172.A O no hydrogen 2.343 N/A TRP 176.A N THR 172.A O no hydrogen 2.963 N/A VAL 177.A N ILE 173.A O no hydrogen 2.767 N/A ASP 178.A N CYS 174.A O no hydrogen 2.886 N/A ARG 179.A N SER 175.A O no hydrogen 2.841 N/A ASP 180.A N TRP 176.A O no hydrogen 3.191 N/A ALA 181.A N VAL 177.A O no hydrogen 3.168 N/A THR 182.A N ASP 178.A O no hydrogen 3.299 N/A THR 182.A OG1 ARG 179.A O no hydrogen 2.406 N/A ASN 183.A N ARG 179.A O no hydrogen 3.205 N/A HIS 184.A N ALA 181.A O no hydrogen 3.160 N/A ILE 185.A N ASP 180.A O no hydrogen 2.730 N/A ILE 188.A N GLU 136.A OE2 no hydrogen 3.190 N/A GLN 192.A N TRP 189.A O no hydrogen 3.266 N/A SER 193.A N TRP 189.A O no hydrogen 3.142 N/A ASN 196.A N GLN 192.A O no hydrogen 3.001 N/A ASN 196.A ND2 TYR 154.A O no hydrogen 2.731 N/A ASN 196.A ND2 GLN 192.A O no hydrogen 2.746 N/A LYS 197.A N SER 193.A O no hydrogen 3.111 N/A LYS 197.A NZ ASP 201.A OD1 no hydrogen 3.133 N/A LYS 197.A NZ ASP 201.A OD2 no hydrogen 2.892 N/A TYR 198.A N LEU 194.A O no hydrogen 2.954 N/A PHE 199.A N ILE 195.A O no hydrogen 2.943 N/A LEU 200.A N LYS 197.A O no hydrogen 3.121 N/A ASP 201.A N LYS 197.A O no hydrogen 3.260 N/A ASN 202.A N TYR 198.A O no hydrogen 2.770 N/A ASN 202.A ND2 TYR 198.A O no hydrogen 3.363 N/A ALA 205.A N ASN 115.A OD1 no hydrogen 3.187 N/A ILE 206.A N LEU 117.A O no hydrogen 3.172 N/A THR 207.A OG1 TYR 154.A OH no hydrogen 2.873 N/A LEU 208.A N GLY 119.A O no hydrogen 2.730 N/A ALA 211.A N SER 209.A OG no hydrogen 3.163 N/A TYR 212.A N SER 209.A O no hydrogen 3.023 N/A LEU 213.A N PRO 210.A O no hydrogen 3.085 N/A TYR 214.A N ILE 226.A O no hydrogen 2.993 N/A TYR 214.A OH TRP 218.A O no hydrogen 3.024 N/A GLU 216.A N ILE 228.A O no hydrogen 3.022 N/A TRP 218.A N PRO 215.A O no hydrogen 3.175 N/A LEU 220.A N TYR 214.A OH no hydrogen 2.649 N/A ILE 225.A N ALA 211.A O no hydrogen 2.895 N/A ILE 226.A N ALA 211.A O no hydrogen 3.110 N/A LEU 227.A N LEU 99.A O no hydrogen 2.796 N/A ILE 228.A N TYR 214.A O no hydrogen 2.625 N/A ARG 229.A N ASN 97.A O no hydrogen 3.070 N/A ARG 229.A NE ASN 97.A O no hydrogen 3.167 N/A ARG 229.A NH1 TYR 236.A OH no hydrogen 3.323 N/A ARG 229.A NH2 PHE 16.A O no hydrogen 2.823 N/A ARG 229.A NH2 ALA 96.A O no hydrogen 3.389 N/A ASP 230.A N GLU 216.A OE1 no hydrogen 2.892 N/A ASN 232.A N ASP 230.A OD1 no hydrogen 3.228 N/A LYS 233.A N ASP 230.A O no hydrogen 3.465 N/A LYS 233.A NZ GLU 216.A OE1 no hydrogen 2.694 N/A LYS 233.A NZ GLU 216.A OE2 no hydrogen 3.019 N/A TYR 236.A N LYS 233.A O no hydrogen 3.138 N/A