Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ocj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG TYR 56.A OH no hydrogen 2.299 N/A SER 4.A N SER 5.A O no hydrogen 2.945 N/A SER 5.A OG ASP 12.A OD1 no hydrogen 3.469 N/A SER 5.A OG ASP 12.A OD2 no hydrogen 2.462 N/A ARG 7.A N SER 5.A OG no hydrogen 3.223 N/A ALA 11.A N ALA 8.A O no hydrogen 2.930 N/A ASP 12.A N ALA 8.A O no hydrogen 3.273 N/A LEU 13.A N ALA 9.A O no hydrogen 2.784 N/A ALA 14.A N SER 10.A O no hydrogen 3.103 N/A GLY 15.A N ALA 11.A O no hydrogen 3.337 N/A ARG 17.A N.A ALA 14.A O no hydrogen 2.940 N/A ARG 17.A N.B ALA 14.A O no hydrogen 2.938 N/A GLN 18.A N GLY 15.A O no hydrogen 2.971 N/A ARG 20.A N VAL 16.A O no hydrogen 2.873 N/A GLN 21.A N ARG 17.A O.A no hydrogen 2.896 N/A GLN 21.A N ARG 17.A O.B no hydrogen 2.929 N/A ARG 22.A N GLN 18.A O no hydrogen 3.081 N/A ARG 22.A NE ARG 250.A O no hydrogen 2.779 N/A ARG 22.A NH2 ARG 250.A O no hydrogen 3.095 N/A ARG 22.A NH2 LEU 251.A O no hydrogen 2.953 N/A ILE 23.A N ALA 19.A O no hydrogen 3.102 N/A LEU 24.A N ARG 20.A O no hydrogen 2.951 N/A LEU 25.A N GLN 21.A O no hydrogen 2.876 N/A GLN 26.A N ARG 22.A O no hydrogen 3.205 N/A GLY 27.A N ILE 23.A O no hydrogen 2.882 N/A VAL 29.A N PHE 32.A O no hydrogen 3.000 N/A PHE 32.A N VAL 29.A O no hydrogen 3.001 N/A VAL 34.A N ASN 28.A OD1 no hydrogen 2.971 N/A ARG 36.A N ASP 33.A OD1 no hydrogen 2.938 N/A ARG 36.A NH1 GLU 39.A OE1 no hydrogen 3.074 N/A GLN 37.A N ASP 33.A O no hydrogen 2.924 N/A GLN 37.A NE2 GLY 27.A O no hydrogen 2.957 N/A GLN 37.A NE2 PHE 32.A O no hydrogen 2.999 N/A ILE 38.A N VAL 34.A O no hydrogen 2.929 N/A GLU 39.A N ALA 35.A O no hydrogen 2.990 N/A LEU 40.A N ARG 36.A O no hydrogen 2.896 N/A LEU 41.A N GLN 37.A O no hydrogen 2.897 N/A HIS 42.A N.A ILE 38.A O no hydrogen 2.932 N/A HIS 42.A N.B ILE 38.A O no hydrogen 2.938 N/A GLY 43.A N GLU 39.A O no hydrogen 2.966 N/A LEU 44.A N LEU 40.A O no hydrogen 3.000 N/A ALA 45.A N LEU 41.A O no hydrogen 2.952 N/A GLU 46.A N HIS 42.A O.A no hydrogen 2.923 N/A GLU 46.A N HIS 42.A O.B no hydrogen 2.951 N/A GLU 46.A N GLY 43.A O no hydrogen 3.320 N/A SER 47.A N LEU 44.A O no hydrogen 3.105 N/A SER 47.A OG GLU 81.A OE2 no hydrogen 2.694 N/A GLY 50.A N SER 47.A OG no hydrogen 3.015 N/A ARG 51.A N SER 47.A O no hydrogen 2.816 N/A ARG 51.A NH1 ALA 45.A O no hydrogen 2.920 N/A PHE 52.A N GLU 48.A O no hydrogen 3.094 N/A LEU 53.A N LEU 49.A O no hydrogen 2.914 N/A LEU 54.A N GLY 50.A O no hydrogen 2.910 N/A LEU 55.A N ARG 51.A O no hydrogen 2.986 N/A TYR 56.A N PHE 52.A O no hydrogen 2.835 N/A TYR 56.A OH SER 2.A OG no hydrogen 2.299 N/A ARG 57.A N LEU 53.A O no hydrogen 2.793 N/A ARG 57.A NH2 GLN 253.A O no hydrogen 2.896 N/A LEU 59.A N TYR 191.A OH no hydrogen 3.120 N/A TRP 63.A N ASN 60.A OD1 no hydrogen 2.938 N/A THR 64.A N ASN 60.A O no hydrogen 2.884 N/A THR 64.A OG1 ASN 60.A O no hydrogen 2.811 N/A HIS 65.A N ALA 61.A O no hydrogen 3.038 N/A HIS 65.A ND1 SER 123.A OG no hydrogen 2.721 N/A ARG 66.A N GLU 62.A O no hydrogen 2.929 N/A ARG 66.A NH1 GLU 62.A OE2 no hydrogen 2.833 N/A LEU 67.A N TRP 63.A O no hydrogen 2.855 N/A VAL 68.A N.A THR 64.A O no hydrogen 2.783 N/A VAL 68.A N.B THR 64.A O no hydrogen 2.793 N/A THR 69.A N HIS 65.A O no hydrogen 2.923 N/A THR 69.A OG1 HIS 65.A O no hydrogen 2.769 N/A HIS 70.A N LEU 67.A O no hydrogen 3.396 N/A HIS 70.A NE2 GLU 86.A OE2 no hydrogen 2.913 N/A GLY 73.A N GLU 86.A OE2 no hydrogen 2.765 N/A SER 74.A N GLN 71.A O no hydrogen 2.948 N/A SER 74.A OG GLN 71.A O no hydrogen 2.697 N/A ALA 78.A N GLU 81.A OE1 no hydrogen 2.940 N/A ARG 82.A N ALA 78.A O no hydrogen 2.858 N/A ARG 82.A NH1 SER 74.A O no hydrogen 2.868 N/A ARG 82.A NH1 GLU 86.A OE2 no hydrogen 2.933 N/A ARG 82.A NH2 SER 74.A O no hydrogen 2.993 N/A ARG 82.A NH2 GLY 75.A O no hydrogen 2.924 N/A VAL 83.A N PRO 79.A O no hydrogen 3.234 N/A PHE 84.A N LEU 80.A O no hydrogen 2.994 N/A TYR 85.A N GLU 81.A O no hydrogen 2.982 N/A GLU 86.A N VAL 83.A O no hydrogen 3.266 N/A ARG 87.A N VAL 83.A O no hydrogen 2.804 N/A ARG 87.A NE ASP 240.A OD2 no hydrogen 3.414 N/A ALA 90.A N GLN 244.A OE1 no hydrogen 2.801 N/A LEU 92.A N LEU 88.A O no hydrogen 3.042 N/A ALA 93.A N PRO 89.A O no hydrogen 2.936 N/A THR 94.A N ALA 90.A O no hydrogen 2.979 N/A ARG 95.A N VAL 91.A O no hydrogen 3.156 N/A ARG 95.A NE LEU 67.A O no hydrogen 2.892 N/A ARG 95.A NH1 TYR 85.A O no hydrogen 2.866 N/A ARG 95.A NH2 LEU 67.A O no hydrogen 2.888 N/A ARG 95.A NH2 TYR 85.A O no hydrogen 2.709 N/A GLU 96.A N LEU 92.A O no hydrogen 3.039 N/A ARG 97.A N ALA 93.A O no hydrogen 2.813 N/A ARG 97.A NE THR 94.A OG1 no hydrogen 3.034 N/A ARG 97.A NH2 THR 94.A OG1 no hydrogen 3.103 N/A HIS 98.A N THR 94.A O no hydrogen 2.887 N/A GLY 99.A N ARG 95.A O no hydrogen 3.136 N/A HIS 100.A N GLU 96.A O no hydrogen 2.973 N/A PHE 101.A N ARG 97.A O no hydrogen 2.832 N/A ARG 102.A N HIS 98.A O no hydrogen 3.016 N/A ARG 103.A N GLY 99.A O no hydrogen 2.976 N/A ARG 103.A NH1 HIS 100.A ND1 no hydrogen 2.871 N/A ARG 103.A NH1 GLU 280.A OE1 no hydrogen 3.174 N/A ALA 104.A N HIS 100.A O no hydrogen 2.873 N/A LEU 105.A N PHE 101.A O no hydrogen 2.836 N/A GLN 106.A N ARG 102.A O no hydrogen 2.902 N/A GLN 106.A NE2 ASP 129.A O no hydrogen 2.883 N/A ARG 107.A N ARG 103.A O no hydrogen 2.968 N/A HIS 108.A N ALA 104.A O no hydrogen 3.121 N/A HIS 108.A N LEU 105.A O no hydrogen 3.186 N/A LEU 109.A N LEU 105.A O no hydrogen 2.980 N/A ARG 110.A NH1 ARG 107.A O no hydrogen 2.917 N/A ARG 110.A NH1 LEU 109.A O no hydrogen 2.901 N/A GLY 112.A N PRO 134.A O no hydrogen 2.920 N/A CYS 113.A N ARG 110.A O no hydrogen 3.202 N/A CYS 113.A SG.A ARG 110.A O no hydrogen 3.202 N/A VAL 114.A N ASP 181.A OD2 no hydrogen 2.802 N/A VAL 115.A N GLN 137.A O no hydrogen 2.888 N/A ALA 116.A N LEU 182.A O no hydrogen 2.822 N/A SER 117.A N VAL 139.A O no hydrogen 2.887 N/A SER 117.A OG GLU 124.A OE2 no hydrogen 3.022 N/A VAL 118.A N THR 184.A O no hydrogen 2.907 N/A CYS 120.A N ILE 141.A O no hydrogen 2.853 N/A CYS 120.A SG GLY 121.A O no hydrogen 3.488 N/A GLY 121.A N ASP 142.A OD2 no hydrogen 2.916 N/A SER 123.A N GLU 124.A OE1 no hydrogen 3.387 N/A SER 123.A OG HIS 65.A ND1 no hydrogen 2.721 N/A GLU 124.A N GLU 124.A OE1 no hydrogen 2.531 N/A ALA 127.A N GLU 124.A O no hydrogen 3.267 N/A LEU 128.A N LEU 125.A O no hydrogen 3.464 N/A ASP 129.A N GLN 106.A OE1 no hydrogen 2.906 N/A TYR 130.A OH LEU 125.A O no hydrogen 2.598 N/A SER 131.A N ASP 129.A OD1 no hydrogen 2.977 N/A SER 131.A OG.A ASP 129.A OD1 no hydrogen 3.172 N/A SER 131.A OG.B ASP 129.A OD1 no hydrogen 2.834 N/A SER 131.A OG.B ASP 129.A OD2 no hydrogen 3.485 N/A CYS 133.A N TYR 130.A O no hydrogen 3.092 N/A GLN 137.A N CYS 113.A O no hydrogen 2.911 N/A LEU 138.A N GLN 163.A O no hydrogen 2.859 N/A VAL 139.A N VAL 115.A O no hydrogen 2.798 N/A GLY 140.A N THR 165.A O no hydrogen 2.863 N/A ILE 141.A N SER 117.A O no hydrogen 3.049 N/A ASP 142.A N HIS 167.A O no hydrogen 3.080 N/A ASP 144.A N ASP 142.A OD1 no hydrogen 2.922 N/A GLU 146.A N ASP 144.A OD1 no hydrogen 2.930 N/A ALA 147.A N ASP 144.A O no hydrogen 2.912 N/A LEU 148.A N ASP 144.A O no hydrogen 3.321 N/A ASP 149.A N PRO 145.A O no hydrogen 2.998 N/A GLY 150.A N GLU 146.A O no hydrogen 3.009 N/A ALA 151.A N ALA 147.A O no hydrogen 2.883 N/A THR 152.A N LEU 148.A O no hydrogen 3.017 N/A THR 152.A OG1 LEU 148.A O no hydrogen 3.324 N/A THR 152.A OG1 ASP 149.A O no hydrogen 2.390 N/A ARG 153.A N ASP 149.A O no hydrogen 3.001 N/A LEU 154.A N GLY 150.A O no hydrogen 2.883 N/A ALA 155.A N ALA 151.A O no hydrogen 2.942 N/A ALA 156.A N ARG 153.A O no hydrogen 3.413 N/A HIS 158.A N ALA 155.A O no hydrogen 2.827 N/A HIS 158.A NE2 LEU 126.A O no hydrogen 2.975 N/A LEU 160.A N HIS 158.A ND1 no hydrogen 2.929 N/A ALA 161.A N HIS 158.A O no hydrogen 3.174 N/A GLN 163.A N LEU 160.A O no hydrogen 2.775 N/A GLN 163.A NE2 VAL 136.A O no hydrogen 2.994 N/A THR 165.A N LEU 138.A O no hydrogen 2.926 N/A HIS 167.A N GLY 140.A O no hydrogen 2.875 N/A GLN 169.A N ASP 142.A O no hydrogen 3.112 N/A TRP 172.A N ASP 170.A OD1 no hydrogen 2.953 N/A LYS 173.A N ASP 170.A O no hydrogen 2.863 N/A LYS 173.A NZ ASP 170.A OD2 no hydrogen 2.792 N/A LEU 174.A N ALA 171.A O no hydrogen 3.210 N/A THR 176.A OG1 TYR 180.A OH no hydrogen 2.968 N/A ARG 177.A NE ASP 175.A O no hydrogen 2.841 N/A GLU 178.A N GLN 207.A O no hydrogen 2.922 N/A GLY 179.A N ALA 208.A O no hydrogen 2.847 N/A TYR 180.A N ALA 208.A O no hydrogen 3.107 N/A TYR 180.A OH THR 176.A OG1 no hydrogen 2.968 N/A ASP 181.A N VAL 114.A O no hydrogen 2.801 N/A LEU 182.A N VAL 114.A O no hydrogen 3.225 N/A LEU 183.A N ALA 214.A O no hydrogen 2.989 N/A THR 184.A N ALA 116.A O no hydrogen 2.849 N/A THR 184.A OG1 VAL 216.A O no hydrogen 3.333 N/A SER 185.A N VAL 216.A O no hydrogen 2.944 N/A SER 185.A OG VAL 118.A O no hydrogen 2.692 N/A ASN 186.A ND2 SER 218.A OG no hydrogen 2.614 N/A ASN 189.A ND2 TYR 202.A OH no hydrogen 2.851 N/A ASN 189.A ND2 SER 218.A O no hydrogen 2.786 N/A TYR 191.A N LEU 188.A O no hydrogen 3.001 N/A GLU 192.A N ASN 189.A O no hydrogen 3.060 N/A ASP 194.A N GLU 192.A OE2 no hydrogen 2.893 N/A ARG 197.A N ASP 194.A OD2 no hydrogen 2.906 N/A VAL 198.A N ASP 194.A O no hydrogen 3.277 N/A THR 199.A N ASP 195.A O no hydrogen 2.922 N/A THR 199.A OG1 ASP 195.A O no hydrogen 3.193 N/A GLU 200.A N ALA 196.A O no hydrogen 2.938 N/A LEU 201.A N ARG 197.A O no hydrogen 3.074 N/A TYR 202.A N VAL 198.A O no hydrogen 2.976 N/A ARG 203.A N THR 199.A O no hydrogen 2.903 N/A ARG 203.A NE GLU 200.A OE1.B no hydrogen 3.278 N/A ARG 203.A NE GLU 200.A OE2.B no hydrogen 3.309 N/A ARG 203.A NH1 GLU 271.A O no hydrogen 3.222 N/A ARG 203.A NH1 GLU 271.A OE2.A no hydrogen 3.532 N/A ARG 203.A NH2 GLU 200.A OE2.B no hydrogen 3.152 N/A ARG 203.A NH2 GLU 271.A OE2.A no hydrogen 3.019 N/A ARG 204.A N GLU 200.A O no hydrogen 3.002 N/A ARG 204.A NH1 LEU 174.A O no hydrogen 2.785 N/A PHE 205.A N LEU 201.A O no hydrogen 2.972 N/A TRP 206.A N TYR 202.A O no hydrogen 2.882 N/A TRP 206.A NE1 GLY 273.A O no hydrogen 2.917 N/A GLN 207.A N ARG 203.A O no hydrogen 2.881 N/A ALA 208.A N ARG 204.A O no hydrogen 2.974 N/A LEU 209.A N PHE 205.A O no hydrogen 3.156 N/A LEU 209.A N TRP 206.A O no hydrogen 3.160 N/A LYS 210.A N TYR 180.A O no hydrogen 2.783 N/A GLY 212.A N LYS 294.A O no hydrogen 2.840 N/A GLY 212.A N PRO 295.A O no hydrogen 3.150 N/A GLY 213.A N LYS 210.A O no hydrogen 2.859 N/A ALA 214.A N ASP 181.A O no hydrogen 3.087 N/A LEU 215.A N ALA 292.A O no hydrogen 2.849 N/A VAL 216.A N LEU 183.A O no hydrogen 2.824 N/A THR 217.A N VAL 290.A O no hydrogen 2.889 N/A THR 217.A OG1 SER 185.A O no hydrogen 2.672 N/A SER 218.A N THR 217.A OG1 no hydrogen 2.777 N/A PHE 219.A N PRO 288.A O no hydrogen 3.139 N/A THR 221.A N LEU 286.A O no hydrogen 3.155 N/A THR 221.A OG1 ARG 285.A O no hydrogen 2.680 N/A THR 221.A OG1 LEU 286.A O no hydrogen 3.315 N/A LEU 226.A N PRO 223.A O no hydrogen 3.011 N/A SER 227.A N PRO 223.A O no hydrogen 3.151 N/A ASP 229.A N SER 227.A OG no hydrogen 2.933 N/A SER 230.A N SER 227.A O no hydrogen 3.165 N/A SER 230.A OG PRO 222.A O no hydrogen 2.665 N/A TRP 232.A N SER 230.A OG no hydrogen 3.209 N/A TRP 232.A NE1 THR 221.A O no hydrogen 3.272 N/A TRP 232.A NE1 THR 221.A OG1 no hydrogen 2.938 N/A ASP 233.A N ALA 284.A O no hydrogen 2.994 N/A ALA 235.A N ASP 233.A O no hydrogen 2.924 N/A ASP 240.A N ASP 237.A OD2 no hydrogen 2.849 N/A LEU 241.A N ASP 237.A O no hydrogen 2.964 N/A GLN 242.A N PRO 238.A O no hydrogen 3.012 N/A LEU 243.A N HIS 239.A O no hydrogen 2.869 N/A GLN 244.A N ASP 240.A O no hydrogen 2.950 N/A GLN 245.A N LEU 241.A O no hydrogen 2.832 N/A LEU 246.A N GLN 242.A O no hydrogen 3.054 N/A VAL 247.A N LEU 243.A O no hydrogen 2.932 N/A PHE 248.A N GLN 244.A O no hydrogen 2.778 N/A THR 249.A N GLN 245.A O no hydrogen 2.881 N/A THR 249.A OG1 GLN 245.A O no hydrogen 2.527 N/A ARG 250.A N LEU 246.A O no hydrogen 3.010 N/A ARG 250.A NH1 GLY 27.A O no hydrogen 2.823 N/A ARG 250.A NH1 GLN 37.A OE1 no hydrogen 2.828 N/A LEU 251.A N VAL 247.A O no hydrogen 3.217 N/A ILE 252.A N VAL 247.A O no hydrogen 2.919 N/A GLN 253.A N PHE 248.A O no hydrogen 2.770 N/A GLN 253.A NE2 THR 249.A O no hydrogen 3.036 N/A ARG 255.A N ARG 57.A O no hydrogen 2.811 N/A ARG 255.A NE TYR 56.A O no hydrogen 2.853 N/A ALA 258.A N ILE 190.A O no hydrogen 2.965 N/A ARG 260.A N LEU 220.A O no hydrogen 2.934 N/A ARG 260.A NE ASP 195.A OD1 no hydrogen 2.881 N/A ARG 260.A NH1 ASN 189.A O no hydrogen 3.256 N/A ARG 260.A NH1 GLU 192.A O no hydrogen 3.328 N/A ARG 260.A NH2 GLU 192.A O no hydrogen 2.781 N/A ARG 260.A NH2 ASP 195.A OD1 no hydrogen 2.951 N/A THR 261.A N GLN 264.A OE1 no hydrogen 2.966 N/A HIS 262.A NE2 ASP 281.A OD1 no hydrogen 2.709 N/A GLN 264.A N THR 261.A OG1 no hydrogen 2.984 N/A THR 265.A N THR 261.A O no hydrogen 2.953 N/A THR 265.A OG1 THR 261.A O no hydrogen 3.163 N/A ARG 266.A N HIS 262.A O no hydrogen 2.794 N/A ARG 266.A NH1 GLU 270.A OE2 no hydrogen 2.909 N/A ALA 267.A N ALA 263.A O no hydrogen 2.963 N/A GLN 268.A N GLN 264.A O no hydrogen 3.031 N/A GLN 268.A NE2 ASP 195.A O no hydrogen 3.062 N/A LEU 269.A N THR 265.A O no hydrogen 2.908 N/A GLU 270.A N ARG 266.A O no hydrogen 2.862 N/A GLU 271.A N ALA 267.A O no hydrogen 3.001 N/A ALA 272.A N GLN 268.A O no hydrogen 3.015 N/A GLY 273.A N GLU 270.A O no hydrogen 2.987 N/A PHE 274.A N LEU 269.A O no hydrogen 2.966 N/A THR 275.A N ARG 293.A O no hydrogen 2.859 N/A THR 275.A OG1 ARG 293.A O no hydrogen 3.484 N/A ARG 278.A N ILE 291.A O no hydrogen 2.906 N/A ARG 278.A NE GLU 280.A OE2 no hydrogen 2.877 N/A ARG 278.A NH2 GLU 280.A OE2 no hydrogen 3.050 N/A GLU 280.A N THR 289.A O no hydrogen 2.765 N/A ARG 283.A N GLU 96.A OE1 no hydrogen 2.791 N/A ARG 285.A N ASP 282.A O no hydrogen 3.068 N/A ARG 285.A NH1 ASP 282.A O no hydrogen 3.156 N/A LEU 286.A N ASP 282.A OD2 no hydrogen 2.895 N/A PHE 287.A N ASP 282.A OD1 no hydrogen 2.836 N/A THR 289.A N GLU 280.A O no hydrogen 2.977 N/A VAL 290.A N THR 217.A O no hydrogen 2.801 N/A ILE 291.A N ARG 278.A O no hydrogen 2.797 N/A ALA 292.A N LEU 215.A O no hydrogen 2.859 N/A ARG 293.A N THR 275.A O no hydrogen 2.902 N/A ARG 293.A NH2 GLY 212.A O no hydrogen 2.812 N/A LYS 294.A N GLY 213.A O no hydrogen 2.883 N/A LYS 294.A NZ TRP 206.A O no hydrogen 2.843 N/A LYS 294.A NZ LEU 209.A O no hydrogen 2.731 N/A