Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1jci_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 8.A N THR 275.A O no hydrogen 2.904 N/A SER 9.A N GLY 129.A O no hydrogen 2.847 N/A GLU 11.A N GLU 11.A OE2 no hydrogen 2.671 N/A ARG 14.A N GLU 11.A O no hydrogen 2.938 N/A ARG 14.A NH1 ASP 18.A OD2 no hydrogen 3.011 N/A SER 15.A N ASP 18.A OD1 no hydrogen 2.866 N/A SER 15.A OG GLU 17.A OE1 no hydrogen 3.334 N/A SER 15.A OG ASP 18.A OD1 no hydrogen 3.518 N/A TYR 16.A OH ILE 285.A O no hydrogen 2.954 N/A PHE 19.A N SER 15.A O no hydrogen 3.383 N/A GLN 20.A N TYR 16.A O no hydrogen 2.936 N/A LYS 21.A N GLU 17.A O no hydrogen 3.188 N/A VAL 22.A N ASP 18.A O no hydrogen 3.297 N/A TYR 23.A N PHE 19.A O no hydrogen 2.829 N/A TYR 23.A OH GLU 118.A OE1 no hydrogen 2.605 N/A ASN 24.A N GLN 20.A O no hydrogen 2.764 N/A ASN 24.A ND2 GLN 20.A OE1 no hydrogen 3.052 N/A ASN 24.A ND2 GLN 292.A OE1 no hydrogen 2.921 N/A ALA 25.A N LYS 21.A O no hydrogen 2.961 N/A ILE 26.A N VAL 22.A O no hydrogen 2.990 N/A ALA 27.A N TYR 23.A O no hydrogen 2.830 N/A LEU 28.A N ASN 24.A O no hydrogen 2.765 N/A LYS 29.A N ALA 25.A O no hydrogen 3.059 N/A LYS 29.A NZ ASP 33.A OD1 no hydrogen 2.848 N/A LEU 30.A N ILE 26.A O no hydrogen 2.916 N/A ARG 31.A N ALA 27.A O no hydrogen 3.094 N/A ARG 31.A NH1 LEU 294.A OXT no hydrogen 2.831 N/A ARG 31.A NH2 LEU 294.A O no hydrogen 2.977 N/A GLU 32.A N LEU 28.A O no hydrogen 2.993 N/A ASP 33.A N LYS 29.A O no hydrogen 2.908 N/A TYR 39.A N GLU 35.A O no hydrogen 2.988 N/A ILE 40.A N ASP 37.A O no hydrogen 3.140 N/A GLY 41.A N TYR 36.A O no hydrogen 2.992 N/A LEU 46.A N TYR 42.A O no hydrogen 3.079 N/A VAL 47.A N GLY 43.A O no hydrogen 3.125 N/A ARG 48.A N PRO 44.A O no hydrogen 2.989 N/A ARG 48.A NH1.B ALA 83.A O no hydrogen 2.904 N/A LEU 49.A N VAL 45.A O no hydrogen 2.880 N/A ALA 50.A N LEU 46.A O no hydrogen 3.027 N/A TRP 51.A N VAL 47.A O no hydrogen 3.051 N/A HIS 52.A N ARG 48.A O no hydrogen 2.835 N/A HIS 52.A ND1 ASN 82.A OD1 no hydrogen 2.690 N/A THR 53.A N LEU 49.A O no hydrogen 2.997 N/A THR 53.A OG1 LEU 49.A O no hydrogen 2.895 N/A THR 53.A OG1 ALA 50.A O no hydrogen 3.049 N/A SER 54.A N ALA 50.A O no hydrogen 3.249 N/A SER 54.A N TRP 51.A O no hydrogen 3.212 N/A SER 54.A OG ALA 50.A O no hydrogen 2.774 N/A GLY 55.A N TRP 51.A O no hydrogen 2.592 N/A TRP 57.A N SER 54.A O no hydrogen 3.240 N/A TRP 57.A NE1 ASN 62.A OD1 no hydrogen 2.756 N/A ASP 58.A N THR 63.A O no hydrogen 3.121 N/A LYS 59.A N ARG 160.A O no hydrogen 3.125 N/A LYS 59.A NZ GLN 159.A O no hydrogen 2.882 N/A HIS 60.A N ASP 58.A OD1 no hydrogen 2.838 N/A HIS 60.A ND1 ASP 58.A OD1 no hydrogen 2.768 N/A ASP 61.A N ASP 58.A O no hydrogen 3.337 N/A ASN 62.A N ASP 58.A O no hydrogen 2.835 N/A ASN 62.A ND2 LEU 4.A O no hydrogen 2.799 N/A ASN 62.A ND2 GLY 273.A O no hydrogen 3.433 N/A THR 63.A N ASP 61.A OD1 no hydrogen 3.046 N/A THR 63.A OG1 ASP 61.A OD1 no hydrogen 2.557 N/A THR 63.A OG1 ASP 61.A OD2 no hydrogen 3.486 N/A GLY 65.A N THR 56.A OG1 no hydrogen 2.979 N/A SER 66.A OG LEU 270.A O no hydrogen 2.758 N/A TYR 67.A OH VAL 7.A O no hydrogen 2.793 N/A THR 70.A OG1 GLU 76.A OE2 no hydrogen 2.566 N/A ARG 72.A N GLY 69.A O no hydrogen 3.458 N/A ARG 72.A NH1 GLY 68.A O no hydrogen 2.960 N/A ARG 72.A NH1 GLY 69.A O no hydrogen 2.826 N/A ARG 72.A NH2 THR 133.A O no hydrogen 2.937 N/A PHE 73.A N THR 70.A O no hydrogen 2.958 N/A LYS 74.A NZ GLU 135.A OE2 no hydrogen 3.442 N/A LYS 75.A NZ THR 138.A O no hydrogen 2.857 N/A LYS 75.A NZ ASP 140.A OD1 no hydrogen 2.723 N/A PHE 77.A N PHE 73.A O no hydrogen 2.907 N/A ASN 78.A N LYS 74.A O no hydrogen 2.766 N/A ASP 79.A N GLU 76.A O no hydrogen 3.123 N/A SER 81.A N ASP 79.A OD1 no hydrogen 2.868 N/A SER 81.A OG ASP 79.A OD1 no hydrogen 3.452 N/A ASN 82.A N ASP 79.A O no hydrogen 2.725 N/A ASN 82.A ND2 GLU 76.A O no hydrogen 2.845 N/A ALA 83.A N PRO 80.A O no hydrogen 3.174 N/A GLY 84.A N GLN 86.A OE1 no hydrogen 2.746 N/A LEU 85.A N ASN 82.A O no hydrogen 2.974 N/A GLN 86.A N GLN 86.A OE1 no hydrogen 2.705 N/A ASN 87.A N GLY 84.A O no hydrogen 3.191 N/A ASN 87.A ND2 GLY 84.A O no hydrogen 3.031 N/A GLY 88.A N LEU 85.A O no hydrogen 2.877 N/A PHE 89.A N LEU 85.A O no hydrogen 3.094 N/A LYS 90.A N GLN 86.A O no hydrogen 2.948 N/A PHE 91.A N ASN 87.A O no hydrogen 3.138 N/A LEU 92.A N GLY 88.A O no hydrogen 3.097 N/A GLU 93.A N LYS 90.A O no hydrogen 3.286 N/A HIS 96.A N LEU 92.A O no hydrogen 2.880 N/A HIS 96.A NE2 ILE 102.A O no hydrogen 2.698 N/A LYS 97.A N GLU 93.A O no hydrogen 2.986 N/A GLU 98.A N PRO 94.A O no hydrogen 3.123 N/A PHE 99.A N ILE 95.A O no hydrogen 3.005 N/A ILE 102.A N PHE 99.A O no hydrogen 3.273 N/A SER 103.A N GLU 11.A OE1 no hydrogen 3.295 N/A SER 103.A OG GLU 11.A OE1 no hydrogen 3.480 N/A SER 103.A OG ARG 130.A O no hydrogen 2.594 N/A SER 104.A N ASP 132.A OD1 no hydrogen 2.931 N/A ASP 106.A N SER 103.A OG no hydrogen 3.209 N/A LEU 107.A N SER 103.A O no hydrogen 2.991 N/A PHE 108.A N SER 104.A O no hydrogen 2.836 N/A SER 109.A N GLY 105.A O no hydrogen 3.073 N/A SER 109.A OG GLY 105.A O no hydrogen 2.882 N/A SER 109.A OG ASP 106.A O no hydrogen 3.084 N/A LEU 110.A N ASP 106.A O no hydrogen 2.820 N/A GLY 111.A N LEU 107.A O no hydrogen 2.861 N/A GLY 112.A N PHE 108.A O no hydrogen 3.418 N/A VAL 113.A N SER 109.A O no hydrogen 3.124 N/A THR 114.A N LEU 110.A O no hydrogen 2.839 N/A THR 114.A OG1 LEU 110.A O no hydrogen 2.786 N/A ALA 115.A N GLY 111.A O no hydrogen 3.112 N/A VAL 116.A N GLY 112.A O no hydrogen 3.122 N/A GLN 117.A N VAL 113.A O no hydrogen 3.129 N/A GLN 117.A NE2 TYR 23.A OH no hydrogen 3.229 N/A GLN 117.A NE2 PHE 286.A O no hydrogen 2.979 N/A GLU 118.A N THR 114.A O no hydrogen 2.867 N/A MET 119.A N ALA 115.A O no hydrogen 2.949 N/A MET 119.A N VAL 116.A O no hydrogen 3.222 N/A GLN 120.A N GLN 117.A O no hydrogen 3.149 N/A GLY 121.A N VAL 116.A O no hydrogen 2.842 N/A LYS 123.A NZ PHE 286.A O no hydrogen 3.019 N/A LYS 123.A NZ GLU 291.A OE1 no hydrogen 3.428 N/A LYS 123.A NZ GLU 291.A OE2 no hydrogen 2.819 N/A ILE 124.A N GLN 117.A OE1 no hydrogen 2.905 N/A TRP 126.A N PHE 284.A O no hydrogen 2.811 N/A TRP 126.A NE1 SER 109.A OG no hydrogen 2.981 N/A ARG 127.A NH2 PRO 281.A O no hydrogen 3.168 N/A GLY 129.A N ASP 106.A OD2 no hydrogen 2.995 N/A ARG 130.A N ASP 106.A OD1 no hydrogen 3.003 N/A ARG 130.A NE SER 66.A OG no hydrogen 2.931 N/A ARG 130.A NE LEU 270.A O no hydrogen 3.413 N/A ARG 130.A NH1 ASP 106.A OD1 no hydrogen 2.884 N/A ARG 130.A NH1 ARG 127.A O no hydrogen 2.804 N/A ARG 130.A NH2 LEU 270.A O no hydrogen 2.880 N/A THR 133.A N GLY 68.A O no hydrogen 3.237 N/A THR 133.A OG1 THR 137.A OG1 no hydrogen 2.762 N/A THR 137.A N PRO 134.A O no hydrogen 2.929 N/A THR 137.A OG1 THR 133.A OG1 no hydrogen 2.762 N/A THR 137.A OG1 PRO 134.A O no hydrogen 2.553 N/A THR 138.A N GLU 135.A O no hydrogen 3.224 N/A THR 138.A OG1 GLU 135.A O no hydrogen 2.813 N/A ARG 143.A NH1 THR 63.A OG1 no hydrogen 3.020 N/A ARG 143.A NH2 THR 56.A O no hydrogen 2.988 N/A ARG 143.A NH2 THR 63.A OG1 no hydrogen 2.781 N/A ASP 146.A N TYR 153.A OH no hydrogen 2.910 N/A LYS 149.A NZ ASP 146.A OD2 no hydrogen 3.207 N/A LYS 149.A NZ ASP 148.A OD1 no hydrogen 2.784 N/A TYR 153.A N ASP 150.A OD2 no hydrogen 3.127 N/A VAL 154.A N ASP 150.A O no hydrogen 3.090 N/A ARG 155.A N ALA 151.A O no hydrogen 2.871 N/A ARG 155.A NE ASP 165.A OD1 no hydrogen 2.866 N/A ARG 155.A NH1 ASP 241.A OD1 no hydrogen 3.053 N/A ARG 155.A NH2 ASP 165.A OD1 no hydrogen 3.494 N/A ARG 155.A NH2 ASP 165.A OD2 no hydrogen 3.058 N/A ARG 155.A NH2 ASP 241.A OD2 no hydrogen 2.957 N/A THR 156.A N ASP 152.A O no hydrogen 3.008 N/A THR 156.A OG1 ASP 152.A O no hydrogen 3.117 N/A PHE 157.A N TYR 153.A O no hydrogen 2.755 N/A PHE 158.A N VAL 154.A O no hydrogen 3.023 N/A GLN 159.A N THR 156.A O no hydrogen 3.144 N/A ARG 160.A N PHE 157.A O no hydrogen 3.208 N/A ARG 160.A NE TRP 57.A O no hydrogen 2.855 N/A ARG 160.A NH1 ARG 143.A O no hydrogen 2.914 N/A ARG 160.A NH2 TRP 57.A O no hydrogen 3.005 N/A ARG 160.A NH2 ARG 143.A O no hydrogen 3.085 N/A LEU 161.A N PHE 158.A O no hydrogen 3.032 N/A ASN 162.A N GLN 159.A O no hydrogen 2.974 N/A MET 163.A N PHE 158.A O no hydrogen 3.056 N/A ASN 164.A N GLU 167.A OE2 no hydrogen 2.757 N/A ARG 166.A NH1.A GLU 250.A OE1 no hydrogen 2.902 N/A ARG 166.A NH1.B GLU 250.A OE1 no hydrogen 3.349 N/A ARG 166.A NH1.B GLU 250.A OE2 no hydrogen 3.227 N/A ARG 166.A NH1.B TYR 251.A OH no hydrogen 3.292 N/A ARG 166.A NH1.B ASP 261.A OD2 no hydrogen 3.200 N/A ARG 166.A NH2.A GLU 250.A OE1 no hydrogen 3.393 N/A ARG 166.A NH2.A GLU 250.A OE2 no hydrogen 2.742 N/A ARG 166.A NH2.A ASP 261.A OD2 no hydrogen 3.052 N/A ARG 166.A NH2.B GLU 250.A OE1 no hydrogen 2.915 N/A GLU 167.A N ASN 164.A OD1 no hydrogen 2.872 N/A VAL 168.A N ASN 164.A O no hydrogen 2.917 N/A VAL 169.A N ASP 165.A O no hydrogen 3.003 N/A ALA 170.A N ARG 166.A O no hydrogen 3.010 N/A LEU 171.A N GLU 167.A O no hydrogen 2.938 N/A MET 172.A N VAL 168.A O no hydrogen 2.986 N/A GLY 173.A N ALA 170.A O no hydrogen 3.003 N/A ALA 174.A N LEU 171.A O no hydrogen 3.037 N/A HIS 175.A N MET 172.A O no hydrogen 2.975 N/A HIS 175.A ND1 ASP 235.A OD1 no hydrogen 2.800 N/A THR 176.A N GLY 173.A O no hydrogen 3.018 N/A THR 176.A OG1 ASP 199.A O no hydrogen 2.991 N/A THR 176.A OG1 ASP 199.A OD1 no hydrogen 2.861 N/A LEU 177.A N ALA 174.A O no hydrogen 2.901 N/A GLY 178.A N PRO 195.A O no hydrogen 2.896 N/A LYS 179.A NZ THR 180.A O no hydrogen 2.976 N/A LYS 179.A NZ GLU 188.A OE1 no hydrogen 2.888 N/A THR 180.A N GLY 189.A O no hydrogen 2.880 N/A THR 180.A OG1 GLY 189.A O no hydrogen 2.933 N/A HIS 181.A NE2 ASP 37.A OD2 no hydrogen 2.650 N/A LEU 182.A N GLU 188.A OE2 no hydrogen 2.954 N/A ASN 184.A N HIS 181.A O no hydrogen 2.810 N/A SER 185.A N HIS 181.A O no hydrogen 3.125 N/A GLY 186.A N LEU 182.A O no hydrogen 2.874 N/A GLY 189.A N THR 180.A O no hydrogen 3.206 N/A TRP 191.A NE1 ASP 235.A OD2 no hydrogen 2.771 N/A THR 192.A OG1 THR 176.A O no hydrogen 3.101 N/A THR 192.A OG1 ASN 194.A OD1 no hydrogen 3.340 N/A ASN 194.A ND2 ASP 199.A OD2 no hydrogen 2.827 N/A ASN 196.A ND2 TYR 39.A O no hydrogen 3.644 N/A ASN 196.A ND2 ILE 40.A O no hydrogen 3.222 N/A VAL 197.A N ASN 194.A O no hydrogen 3.054 N/A PHE 198.A N MET 119.A O no hydrogen 2.845 N/A SER 201.A N ASP 199.A OD1 no hydrogen 2.926 N/A SER 201.A OG ASP 199.A OD1 no hydrogen 2.939 N/A SER 201.A OG ASP 199.A OD2 no hydrogen 2.957 N/A TYR 203.A N ASN 200.A O no hydrogen 3.184 N/A TYR 203.A OH VAL 169.A O no hydrogen 2.573 N/A LEU 204.A N ASN 200.A O no hydrogen 3.330 N/A ASN 205.A N SER 201.A O no hydrogen 2.853 N/A ASN 205.A ND2 TRP 191.A O no hydrogen 2.904 N/A LEU 206.A N PHE 202.A O no hydrogen 3.130 N/A LEU 207.A N TYR 203.A O no hydrogen 3.126 N/A ASN 208.A N LEU 204.A O no hydrogen 2.790 N/A GLU 209.A N ASN 205.A O no hydrogen 2.965 N/A TRP 211.A NE1 ASN 205.A O no hydrogen 3.097 N/A TRP 211.A NE1 LEU 206.A O no hydrogen 3.135 N/A LYS 212.A N ASP 224.A O no hydrogen 2.862 N/A LYS 212.A NZ GLU 214.A OE1 no hydrogen 2.637 N/A GLU 214.A N GLN 222.A O no hydrogen 2.957 N/A ASN 216.A N ASN 220.A O no hydrogen 2.854 N/A ASN 216.A ND2 GLY 186.A O no hydrogen 2.935 N/A ALA 218.A N ASN 216.A OD1 no hydrogen 2.738 N/A ASN 219.A N ASN 216.A O no hydrogen 3.040 N/A ASN 220.A N ASN 216.A OD1 no hydrogen 3.151 N/A ASN 220.A ND2 GLY 186.A O no hydrogen 2.932 N/A GLN 222.A N GLU 214.A O no hydrogen 2.873 N/A TRP 223.A N MET 231.A O no hydrogen 2.926 N/A ASP 224.A N LYS 212.A O no hydrogen 2.844 N/A SER 225.A N TYR 229.A O no hydrogen 3.043 N/A SER 225.A OG GLU 209.A OE1 no hydrogen 3.462 N/A SER 227.A OG GLU 209.A OE1 no hydrogen 2.673 N/A GLY 228.A N SER 225.A O no hydrogen 2.910 N/A TYR 229.A N SER 225.A OG no hydrogen 3.218 N/A MET 230.A N PRO 190.A O no hydrogen 2.903 N/A MET 231.A N TRP 223.A O no hydrogen 2.837 N/A LEU 232.A N ASP 235.A OD2 no hydrogen 2.838 N/A THR 234.A N ALA 147.A O no hydrogen 3.304 N/A ASP 235.A N LEU 232.A O no hydrogen 2.933 N/A TYR 236.A N LEU 232.A O no hydrogen 2.980 N/A SER 237.A N PRO 233.A O no hydrogen 3.017 N/A SER 237.A OG THR 234.A O no hydrogen 2.746 N/A LEU 238.A N ASP 235.A O no hydrogen 3.046 N/A ILE 239.A N TYR 236.A O no hydrogen 3.061 N/A GLN 240.A N SER 237.A O no hydrogen 3.148 N/A ASP 241.A N SER 237.A O no hydrogen 3.065 N/A TYR 244.A N ASP 241.A OD2 no hydrogen 2.954 N/A LEU 245.A N ASP 241.A O no hydrogen 2.826 N/A SER 246.A N PRO 242.A O no hydrogen 3.342 N/A SER 246.A OG PRO 242.A O no hydrogen 3.211 N/A VAL 248.A N TYR 244.A O no hydrogen 2.945 N/A LYS 249.A N LEU 245.A O no hydrogen 2.989 N/A GLU 250.A N SER 246.A O no hydrogen 3.048 N/A TYR 251.A N ILE 247.A O no hydrogen 2.998 N/A TYR 251.A OH ASP 261.A OD2 no hydrogen 2.634 N/A ALA 252.A N VAL 248.A O no hydrogen 2.932 N/A ASN 253.A N LYS 249.A O no hydrogen 3.163 N/A ASN 253.A N GLU 250.A O no hydrogen 3.273 N/A ASN 253.A ND2 LYS 249.A O no hydrogen 2.803 N/A ASP 254.A N TYR 251.A O no hydrogen 3.324 N/A LYS 257.A N ASP 254.A OD1 no hydrogen 2.974 N/A LYS 257.A NZ GLU 250.A OE2 no hydrogen 3.385 N/A LYS 257.A NZ ASP 261.A OD1 no hydrogen 3.277 N/A LYS 257.A NZ ASP 261.A OD2 no hydrogen 2.686 N/A PHE 258.A N ASP 254.A O no hydrogen 3.128 N/A PHE 259.A N GLN 255.A O no hydrogen 3.002 N/A LYS 260.A N ASP 256.A O no hydrogen 2.929 N/A ASP 261.A N LYS 257.A O no hydrogen 2.929 N/A PHE 262.A N PHE 258.A O no hydrogen 2.769 N/A SER 263.A N PHE 259.A O no hydrogen 3.016 N/A SER 263.A OG LYS 123.A O no hydrogen 2.717 N/A LYS 264.A N LYS 260.A O no hydrogen 3.220 N/A LYS 264.A NZ ASP 261.A OD1 no hydrogen 3.566 N/A ALA 265.A N ASP 261.A O no hydrogen 3.026 N/A PHE 266.A N PHE 262.A O no hydrogen 2.757 N/A GLU 267.A N SER 263.A O no hydrogen 3.072 N/A LYS 268.A N LYS 264.A O no hydrogen 3.008 N/A LYS 268.A NZ ASN 162.A O no hydrogen 2.780 N/A LYS 268.A NZ GLU 167.A OE1 no hydrogen 2.825 N/A LYS 268.A NZ GLU 167.A OE2 no hydrogen 3.284 N/A LEU 269.A N ALA 265.A O no hydrogen 2.860 N/A LEU 270.A N PHE 266.A O no hydrogen 2.994 N/A GLU 271.A N LYS 268.A O no hydrogen 3.044 N/A ASN 272.A ND2 LEU 161.A O no hydrogen 3.199 N/A ILE 274.A N GLU 271.A O no hydrogen 3.063 N/A THR 275.A N HIS 6.A O no hydrogen 2.740 N/A ALA 280.A N PRO 277.A O no hydrogen 2.854 N/A PHE 284.A N TRP 126.A O no hydrogen 2.696 N/A THR 288.A N GLU 291.A OE2 no hydrogen 2.966 N/A LEU 289.A N GLU 118.A OE1 no hydrogen 3.087 N/A GLU 291.A N THR 288.A OG1 no hydrogen 3.045 N/A GLN 292.A N THR 288.A O no hydrogen 3.105 N/A GLN 292.A NE2 ASN 24.A OD1 no hydrogen 2.987 N/A GLY 293.A N GLU 290.A O no hydrogen 3.086 N/A LEU 294.A N LEU 289.A O no hydrogen 2.877 N/A