Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3rnl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NH1 PRO 4.A O no hydrogen 2.890 N/A ASN 5.A N VAL 79.A O no hydrogen 2.762 N/A ASN 5.A ND2 ARG 77.A O.A no hydrogen 2.856 N/A ASN 5.A ND2 ARG 77.A O.B no hydrogen 2.879 N/A PHE 6.A N VAL 79.A O no hydrogen 3.118 N/A PHE 7.A N LYS 103.A O no hydrogen 2.922 N/A ILE 8.A N GLU 81.A O no hydrogen 2.965 N/A VAL 9.A N LEU 105.A O no hydrogen 3.026 N/A LYS 13.A NZ HIS 119.A ND1 no hydrogen 3.112 N/A CYS 14.A N ALA 11.A O no hydrogen 3.382 N/A CYS 14.A SG ALA 12.A O no hydrogen 3.687 N/A CYS 14.A SG TYR 157.A OH no hydrogen 3.674 N/A SER 18.A N.A GLY 15.A O no hydrogen 3.254 N/A SER 18.A N.B GLY 15.A O no hydrogen 3.259 N/A SER 18.A OG.A GLY 15.A O no hydrogen 2.845 N/A LEU 19.A N GLY 15.A O no hydrogen 3.365 N/A ASP 20.A N THR 16.A O no hydrogen 2.830 N/A ARG 21.A N SER 17.A O no hydrogen 3.108 N/A TYR 22.A N SER 18.A O.A no hydrogen 2.957 N/A TYR 22.A N SER 18.A O.B no hydrogen 2.874 N/A LEU 23.A N LEU 19.A O no hydrogen 2.913 N/A SER 24.A N.A ASP 20.A O no hydrogen 2.964 N/A SER 24.A N.B ASP 20.A O no hydrogen 2.978 N/A SER 24.A OG.A ASP 20.A O no hydrogen 2.778 N/A SER 24.A OG.A ASP 20.A OD1 no hydrogen 3.026 N/A SER 24.A OG.B ASP 20.A O no hydrogen 3.405 N/A SER 24.A OG.B ARG 21.A O no hydrogen 2.842 N/A GLN 25.A N TYR 22.A O no hydrogen 3.249 N/A GLN 25.A NE2 ASP 205.A O no hydrogen 3.140 N/A HIS 26.A N LEU 23.A O no hydrogen 2.968 N/A HIS 26.A NE2 SER 199.A O no hydrogen 2.843 N/A ASP 28.A N HIS 26.A ND1 no hydrogen 2.909 N/A ILE 29.A N HIS 26.A O no hydrogen 3.186 N/A TYR 30.A N ALA 78.A O no hydrogen 2.831 N/A LYS 34.A NZ TYR 59.A O no hydrogen 2.612 N/A LYS 35.A NZ ASP 20.A OD1 no hydrogen 3.239 N/A LYS 35.A NZ ASP 20.A OD2 no hydrogen 2.761 N/A LYS 35.A NZ PRO 32.A O no hydrogen 2.872 N/A GLU 36.A N ALA 82.A O no hydrogen 3.016 N/A HIS 38.A N SER 83.A OG no hydrogen 2.880 N/A HIS 38.A ND1 GLU 36.A O no hydrogen 2.943 N/A SER 41.A N HIS 38.A O no hydrogen 2.962 N/A SER 41.A OG THR 92.A OG1 no hydrogen 2.757 N/A ILE 42.A N PHE 39.A O no hydrogen 3.487 N/A ASP 44.A N SER 41.A O no hydrogen 2.855 N/A PHE 45.A N ILE 42.A O no hydrogen 2.928 N/A PHE 49.A N ASN 57.A OD1 no hydrogen 2.854 N/A THR 50.A N HIS 144.A O no hydrogen 2.993 N/A THR 50.A OG1 GLN 143.A O no hydrogen 2.590 N/A GLY 51.A N ASP 54.A OD2 no hydrogen 2.829 N/A ASP 54.A N GLY 51.A O no hydrogen 3.128 N/A GLU 55.A N.B GLU 55.A OE2.B no hydrogen 2.769 N/A ASN 57.A ND2 PHE 49.A O no hydrogen 2.993 N/A LEU 58.A N GLU 55.A O.A no hydrogen 2.656 N/A LEU 58.A N GLU 55.A O.B no hydrogen 2.678 N/A TYR 59.A N GLY 56.A O no hydrogen 2.793 N/A THR 60.A OG1 ASN 57.A O no hydrogen 3.494 N/A ILE 61.A N ALA 37.A O no hydrogen 2.935 N/A ARG 62.A NH2 ASN 57.A O no hydrogen 3.300 N/A ARG 62.A NH2 THR 60.A OG1 no hydrogen 3.395 N/A ALA 66.A N ASP 63.A OD2 no hydrogen 2.871 N/A TYR 67.A N ASP 63.A O no hydrogen 2.893 N/A TYR 67.A OH GLU 81.A OE2 no hydrogen 2.636 N/A LEU 69.A N TYR 67.A O no hydrogen 3.021 N/A ASP 71.A N ARG 68.A O no hydrogen 3.160 N/A VAL 73.A N PHE 70.A O no hydrogen 3.057 N/A ARG 74.A N.A GLU 76.A OE1.A no hydrogen 2.848 N/A ARG 74.A N.A GLU 76.A OE1.B no hydrogen 2.692 N/A ARG 74.A N.B GLU 76.A OE1.A no hydrogen 2.877 N/A ARG 74.A N.B GLU 76.A OE1.B no hydrogen 2.717 N/A ARG 74.A NH2.A ASP 71.A O no hydrogen 2.952 N/A ARG 74.A NH2.A VAL 73.A O no hydrogen 2.959 N/A ARG 74.A NH2.B ASP 71.A O no hydrogen 2.837 N/A ARG 74.A NH2.B VAL 73.A O no hydrogen 3.039 N/A GLU 76.A N.A GLU 76.A OE1.A no hydrogen 2.773 N/A GLU 76.A N.B GLU 76.A OE1.B no hydrogen 2.965 N/A ARG 77.A N.A ASP 28.A OD1 no hydrogen 2.899 N/A ARG 77.A N.B ASP 28.A OD1 no hydrogen 3.025 N/A ALA 78.A N ASP 28.A O no hydrogen 3.081 N/A VAL 79.A N ASN 5.A OD1 no hydrogen 2.868 N/A GLY 80.A N TYR 30.A O no hydrogen 2.871 N/A GLU 81.A N PHE 6.A O no hydrogen 3.300 N/A SER 83.A N ILE 8.A O no hydrogen 3.210 N/A SER 83.A OG GLU 81.A OE1 no hydrogen 2.692 N/A VAL 84.A N GLU 36.A OE1 no hydrogen 2.833 N/A PHE 85.A N HIS 38.A NE2 no hydrogen 2.995 N/A TYR 86.A N SER 83.A O no hydrogen 3.212 N/A TYR 86.A OH GLU 81.A OE2 no hydrogen 2.622 N/A LEU 87.A N VAL 9.A O no hydrogen 2.819 N/A PHE 88.A N PHE 85.A O no hydrogen 3.054 N/A TYR 89.A N PHE 85.A O no hydrogen 3.081 N/A GLY 91.A N ASP 44.A OD2 no hydrogen 2.900 N/A THR 92.A N TYR 89.A O no hydrogen 3.231 N/A THR 92.A OG1 SER 41.A OG no hydrogen 2.757 N/A THR 92.A OG1 TYR 86.A O no hydrogen 3.510 N/A THR 92.A OG1 TYR 89.A O no hydrogen 2.802 N/A GLN 94.A NE2 GLN 94.A O no hydrogen 3.421 N/A GLN 94.A NE2 ASP 97.A OD1 no hydrogen 2.986 N/A ARG 95.A N GLY 91.A O no hydrogen 3.240 N/A ARG 95.A NH1 PHE 40.A O no hydrogen 2.999 N/A ARG 95.A NH1 ASP 44.A OD2 no hydrogen 2.875 N/A ARG 95.A NH2 ASP 44.A OD1 no hydrogen 2.857 N/A ASP 97.A N GLN 94.A O no hydrogen 2.906 N/A ALA 98.A N ARG 95.A O no hydrogen 3.210 N/A ALA 102.A N TYR 99.A O no hydrogen 3.056 N/A LYS 103.A N ASN 5.A O no hydrogen 2.972 N/A LYS 103.A NZ PHE 195.A O no hydrogen 2.993 N/A ILE 104.A N GLN 172.A O no hydrogen 2.778 N/A LEU 105.A N PHE 7.A O no hydrogen 2.883 N/A ILE 106.A N LYS 174.A O no hydrogen 2.995 N/A ARG 108.A NH1 LYS 13.A O no hydrogen 3.058 N/A ASN 109.A N GLU 179.A OE2 no hydrogen 3.147 N/A VAL 111.A N ASN 109.A OD1 no hydrogen 2.954 N/A ARG 113.A N ASN 109.A O no hydrogen 2.919 N/A ARG 113.A NH1 ALA 12.A O no hydrogen 3.158 N/A ARG 113.A NH2 TYR 151.A O no hydrogen 3.081 N/A ALA 114.A N PRO 110.A O no hydrogen 3.078 N/A PHE 115.A N VAL 111.A O no hydrogen 3.287 N/A SER 116.A N.A ASP 112.A O no hydrogen 2.913 N/A SER 116.A N.B ASP 112.A O no hydrogen 2.922 N/A SER 116.A OG.B ASP 112.A O no hydrogen 3.431 N/A ALA 117.A N ARG 113.A O no hydrogen 2.983 N/A TYR 118.A N ALA 114.A O no hydrogen 3.028 N/A TYR 118.A OH LEU 128.A O no hydrogen 2.608 N/A LEU 120.A N ALA 117.A O no hydrogen 2.979 N/A VAL 121.A N TYR 118.A O no hydrogen 2.885 N/A ASP 123.A N HIS 119.A O no hydrogen 3.100 N/A GLU 124.A N VAL 121.A O no hydrogen 2.959 N/A ARG 125.A N LEU 120.A O no hydrogen 2.933 N/A ARG 125.A NE PRO 52.A O no hydrogen 2.872 N/A ARG 125.A NH2 ASP 54.A OD1 no hydrogen 2.757 N/A ARG 125.A NH2 GLU 146.A OE1 no hydrogen 2.953 N/A GLU 126.A N LEU 120.A O no hydrogen 3.199 N/A LEU 128.A N GLU 126.A OE1 no hydrogen 2.893 N/A SER 129.A N GLU 132.A OE1.A no hydrogen 3.218 N/A SER 129.A OG GLU 132.A OE1.A no hydrogen 3.047 N/A ARG 131.A NH1 ASP 211.A OD2 no hydrogen 2.899 N/A ARG 131.A NH2 ASP 211.A OD1 no hydrogen 2.877 N/A ARG 131.A NH2 ASP 211.A OD2 no hydrogen 3.529 N/A GLU 132.A N.A SER 129.A OG no hydrogen 3.118 N/A GLU 132.A N.B SER 129.A OG no hydrogen 3.130 N/A SER 133.A N SER 129.A O no hydrogen 2.851 N/A SER 133.A OG GLU 126.A OE2 no hydrogen 2.606 N/A SER 133.A OG TYR 151.A OH no hydrogen 2.663 N/A LEU 134.A N PHE 130.A O no hydrogen 2.838 N/A ALA 135.A N ARG 131.A O no hydrogen 3.331 N/A LYS 136.A N GLU 132.A O.A no hydrogen 3.286 N/A LYS 136.A N SER 133.A O no hydrogen 3.214 N/A LYS 136.A NZ GLU 139.A OE2.A no hydrogen 2.720 N/A GLU 137.A N LEU 134.A O no hydrogen 3.188 N/A ARG 140.A N LYS 136.A O no hydrogen 3.009 N/A ARG 140.A NH1 GLU 126.A OE2 no hydrogen 3.223 N/A ARG 140.A NH1 SER 133.A OG no hydrogen 3.106 N/A ARG 140.A NH2 GLU 126.A OE2 no hydrogen 2.807 N/A ILE 141.A N GLU 137.A O no hydrogen 2.863 N/A ARG 142.A N GLU 138.A O.A no hydrogen 3.094 N/A ARG 142.A N GLU 138.A O.B no hydrogen 3.116 N/A ARG 142.A NE GLU 139.A OE2.B no hydrogen 3.172 N/A GLN 143.A N GLU 139.A O.A no hydrogen 2.997 N/A GLN 143.A N GLU 139.A O.B no hydrogen 2.822 N/A HIS 144.A N ILE 141.A O no hydrogen 3.155 N/A TYR 145.A N ARG 140.A O no hydrogen 2.988 N/A GLU 146.A N ASP 54.A OD2 no hydrogen 2.778 N/A LEU 148.A N GLU 146.A OE2 no hydrogen 3.178 N/A TRP 149.A N GLU 146.A O no hydrogen 3.116 N/A TRP 149.A NE1 ASP 54.A OD1 no hydrogen 2.944 N/A TYR 150.A N PRO 147.A O no hydrogen 2.815 N/A TYR 150.A OH TYR 145.A O no hydrogen 2.606 N/A TYR 151.A OH SER 133.A OG no hydrogen 2.663 N/A ARG 152.A N GLU 137.A OE1 no hydrogen 2.825 N/A ALA 153.A N GLU 137.A OE2 no hydrogen 2.889 N/A VAL 154.A N TYR 150.A O no hydrogen 3.218 N/A GLY 155.A N ARG 152.A O no hydrogen 3.036 N/A LEU 156.A N ALA 153.A O no hydrogen 3.320 N/A TYR 157.A OH ARG 108.A O no hydrogen 2.706 N/A ALA 158.A N ASP 223.A OD2 no hydrogen 2.956 N/A GLN 160.A NE2 VAL 154.A O no hydrogen 3.348 N/A GLN 160.A NE2 LEU 156.A O no hydrogen 2.949 N/A VAL 161.A N TYR 157.A O no hydrogen 2.820 N/A LYS 162.A N ALA 158.A O no hydrogen 2.894 N/A LYS 162.A NZ ASP 166.A OD2 no hydrogen 2.762 N/A ARG 163.A N ALA 159.A O no hydrogen 3.118 N/A ARG 163.A NH2 PRO 90.A O no hydrogen 3.002 N/A TYR 164.A OH TYR 86.A O no hydrogen 2.802 N/A LEU 165.A N VAL 161.A O no hydrogen 2.908 N/A ASP 166.A N LYS 162.A O no hydrogen 2.753 N/A VAL 167.A N ARG 163.A O no hydrogen 2.985 N/A PHE 168.A N TYR 164.A O no hydrogen 2.875 N/A GLY 169.A N LEU 165.A O no hydrogen 2.885 N/A ARG 170.A NH1.A LEU 230.A O.A no hydrogen 2.750 N/A ARG 170.A NH1.A LEU 230.A O.B no hydrogen 2.781 N/A ARG 170.A NH1.B VAL 173.A O no hydrogen 2.915 N/A ARG 170.A NH2.A LEU 230.A O.A no hydrogen 2.770 N/A ARG 170.A NH2.A LEU 230.A O.B no hydrogen 2.770 N/A GLN 172.A N GLY 169.A O no hydrogen 3.122 N/A GLN 172.A NE2 PRO 100.A O no hydrogen 2.942 N/A GLN 172.A NE2 ALA 102.A O no hydrogen 2.857 N/A VAL 173.A N ARG 170.A O.A no hydrogen 3.395 N/A VAL 173.A N ARG 170.A O.B no hydrogen 3.252 N/A LYS 174.A N ILE 104.A O no hydrogen 2.894 N/A ILE 176.A N ILE 106.A O no hydrogen 2.782 N/A PHE 178.A N LEU 107.A O no hydrogen 2.805 N/A GLU 180.A N.A LEU 177.A O no hydrogen 3.106 N/A PHE 181.A N LEU 177.A O no hydrogen 3.105 N/A ALA 182.A N PHE 178.A O no hydrogen 2.817 N/A ARG 183.A N GLU 179.A O no hydrogen 3.144 N/A ASP 184.A N GLU 180.A O.A no hydrogen 3.007 N/A ASP 184.A N GLU 180.A O.B no hydrogen 2.963 N/A GLN 187.A N ASP 184.A OD1 no hydrogen 3.078 N/A GLN 187.A NE2 GLN 187.A O no hydrogen 3.361 N/A GLN 187.A NE2 ASP 191.A OD1 no hydrogen 3.016 N/A VAL 188.A N ASP 184.A O no hydrogen 3.132 N/A VAL 189.A N PRO 185.A O no hydrogen 2.835 N/A ARG 190.A N VAL 186.A O no hydrogen 2.920 N/A ARG 190.A NE PHE 202.A O no hydrogen 2.979 N/A ASP 191.A N GLN 187.A O no hydrogen 2.888 N/A CYS 192.A N VAL 188.A O no hydrogen 2.977 N/A CYS 192.A SG VAL 188.A O no hydrogen 3.456 N/A CYS 193.A N VAL 189.A O no hydrogen 2.945 N/A CYS 193.A SG VAL 189.A O no hydrogen 3.333 N/A ALA 194.A N ARG 190.A O no hydrogen 3.057 N/A PHE 195.A N ASP 191.A O no hydrogen 2.982 N/A LEU 196.A N CYS 192.A O no hydrogen 2.858 N/A GLY 197.A N ALA 194.A O no hydrogen 3.107 N/A VAL 198.A N CYS 193.A O no hydrogen 2.971 N/A ASP 201.A N SER 199.A OG no hydrogen 3.044 N/A ASP 205.A N GLN 25.A OE1 no hydrogen 2.734 N/A SER 207.A N ASP 205.A OD1 no hydrogen 2.905 N/A SER 207.A OG ASP 205.A OD1 no hydrogen 2.962 N/A SER 207.A OG ASP 205.A OD2 no hydrogen 3.545 N/A ARG 213.A N.A GLU 209.A O no hydrogen 3.027 N/A ARG 213.A N.B GLU 209.A O no hydrogen 3.026 N/A ARG 213.A NH1.B GLU 208.A OE1 no hydrogen 3.198 N/A ARG 213.A NH2.A ASP 112.A OD1 no hydrogen 2.486 N/A ARG 213.A NH2.B GLU 208.A OE1 no hydrogen 3.428 N/A GLU 214.A N PRO 210.A O no hydrogen 3.037 N/A GLU 215.A N.A ASP 211.A O no hydrogen 2.916 N/A GLU 215.A N.B ASP 211.A O no hydrogen 2.899 N/A LEU 216.A N LEU 212.A O no hydrogen 2.817 N/A THR 217.A N ARG 213.A O.A no hydrogen 2.992 N/A THR 217.A N ARG 213.A O.B no hydrogen 3.084 N/A THR 217.A OG1 ARG 213.A O.A no hydrogen 2.718 N/A THR 217.A OG1 ARG 213.A O.B no hydrogen 2.668 N/A ALA 218.A N GLU 214.A O no hydrogen 3.116 N/A PHE 219.A N GLU 215.A O.A no hydrogen 2.946 N/A PHE 219.A N GLU 215.A O.B no hydrogen 2.957 N/A PHE 220.A N LEU 216.A O no hydrogen 3.061 N/A ALA 221.A N ALA 218.A O no hydrogen 3.264 N/A VAL 224.A N PHE 220.A O no hydrogen 2.849 N/A ALA 225.A N ALA 221.A O no hydrogen 2.972 N/A ARG 226.A N.A PRO 222.A O no hydrogen 3.136 N/A ARG 226.A N.B PRO 222.A O no hydrogen 3.143 N/A ARG 226.A NH2.A ASP 223.A OD1 no hydrogen 2.960 N/A LEU 227.A N ASP 223.A O no hydrogen 2.893 N/A GLU 228.A N VAL 224.A O no hydrogen 2.927 N/A LEU 230.A N.A ARG 226.A O.A no hydrogen 3.153 N/A LEU 230.A N.A ARG 226.A O.B no hydrogen 3.115 N/A LEU 230.A N.B ARG 226.A O.A no hydrogen 3.154 N/A LEU 230.A N.B ARG 226.A O.B no hydrogen 3.114 N/A LEU 230.A N.B LEU 227.A O no hydrogen 2.970 N/A ILE 231.A N LEU 227.A O no hydrogen 2.920 N/A ARG 233.A N GLU 228.A O no hydrogen 3.276 N/A ARG 233.A NH2 GLU 180.A OE2.B no hydrogen 2.574 N/A LEU 235.A N GLU 228.A OE2 no hydrogen 2.668 N/A SER 236.A N ASP 234.A OD2 no hydrogen 2.938 N/A SER 236.A OG ASP 234.A OD2 no hydrogen 2.590 N/A TRP 238.A N LEU 235.A O no hydrogen 2.759 N/A TRP 238.A NE1 GLU 179.A OE1 no hydrogen 3.234 N/A ARG 239.A N SER 236.A O no hydrogen 2.967 N/A ARG 239.A NH1 GLU 228.A OE2 no hydrogen 2.627 N/A ARG 239.A NH2 GLU 228.A OE2 no hydrogen 3.199 N/A