Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pn1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A N THR 2.A OG1 no hydrogen 3.124 N/A THR 6.A N THR 2.A O no hydrogen 3.191 N/A THR 6.A OG1 THR 2.A O no hydrogen 3.339 N/A GLN 7.A N ASN 3.A O no hydrogen 2.878 N/A LEU 8.A N ILE 4.A O no hydrogen 2.889 N/A ASP 9.A N GLN 5.A O no hydrogen 2.906 N/A ASN 10.A N THR 6.A O no hydrogen 2.852 N/A LEU 11.A N GLN 7.A O no hydrogen 2.929 N/A ARG 12.A N LEU 8.A O no hydrogen 2.954 N/A ARG 12.A NE GLU 46.A OE2 no hydrogen 3.428 N/A ARG 12.A NE SER 57.A OG no hydrogen 3.273 N/A ARG 12.A NH2 GLU 46.A OE2 no hydrogen 2.855 N/A ARG 12.A NH2 PHE 52.A O no hydrogen 2.953 N/A LYS 13.A N ASP 9.A O no hydrogen 3.091 N/A THR 14.A N ASN 10.A O no hydrogen 2.856 N/A THR 14.A OG1 ASN 10.A O no hydrogen 2.889 N/A LEU 15.A N LEU 11.A O no hydrogen 2.896 N/A ARG 16.A N ARG 12.A O no hydrogen 2.924 N/A ARG 16.A NH2 ASP 56.A O no hydrogen 2.962 N/A GLN 17.A N LYS 13.A O no hydrogen 3.097 N/A GLN 17.A NE2 GLU 21.A OE2 no hydrogen 3.109 N/A TYR 18.A N THR 14.A O no hydrogen 2.850 N/A GLU 19.A N LEU 15.A O no hydrogen 2.874 N/A TYR 20.A N ARG 16.A O no hydrogen 2.895 N/A TYR 20.A OH LYS 248.A O no hydrogen 2.731 N/A GLU 21.A N GLN 17.A O no hydrogen 2.889 N/A TYR 22.A N TYR 18.A O no hydrogen 2.865 N/A HIS 23.A N GLU 19.A O no hydrogen 2.759 N/A VAL 24.A N TYR 20.A O no hydrogen 2.858 N/A LEU 25.A N TYR 20.A O no hydrogen 3.134 N/A ASN 27.A N GLU 21.A O no hydrogen 2.750 N/A SER 29.A N GLU 21.A OE1 no hydrogen 3.004 N/A SER 29.A OG GLU 21.A OE1 no hydrogen 2.713 N/A TYR 35.A N PRO 31.A O no hydrogen 3.211 N/A TYR 35.A OH GLU 19.A OE2 no hydrogen 2.444 N/A ASP 36.A N ASP 32.A O no hydrogen 2.866 N/A ARG 37.A N SER 33.A O no hydrogen 2.880 N/A ARG 37.A NE GLU 34.A OE1 no hydrogen 3.012 N/A ARG 37.A NH2 GLU 34.A OE1 no hydrogen 3.507 N/A ARG 37.A NH2 GLU 34.A OE2 no hydrogen 2.787 N/A LEU 38.A N GLU 34.A O no hydrogen 3.278 N/A PHE 39.A N TYR 35.A O no hydrogen 2.893 N/A HIS 40.A N ASP 36.A O no hydrogen 2.904 N/A GLN 41.A N ARG 37.A O no hydrogen 2.946 N/A LEU 42.A N LEU 38.A O no hydrogen 2.985 N/A LYS 43.A N PHE 39.A O no hydrogen 3.036 N/A ALA 44.A N HIS 40.A O no hydrogen 3.047 N/A LEU 45.A N GLN 41.A O no hydrogen 3.056 N/A GLU 46.A N LEU 42.A O no hydrogen 2.912 N/A LEU 47.A N LYS 43.A O no hydrogen 3.041 N/A GLU 48.A N ALA 44.A O no hydrogen 2.980 N/A HIS 49.A N GLU 46.A O no hydrogen 3.094 N/A GLU 51.A N GLU 51.A OE1 no hydrogen 2.760 N/A PHE 52.A N HIS 49.A O no hydrogen 2.962 N/A LEU 53.A N PRO 50.A O no hydrogen 3.027 N/A THR 54.A OG1 ASP 56.A OD1 no hydrogen 3.552 N/A SER 57.A N THR 54.A O no hydrogen 3.240 N/A SER 57.A OG GLU 46.A OE2 no hydrogen 2.537 N/A SER 57.A OG THR 59.A OG1 no hydrogen 3.312 N/A THR 59.A OG1 GLU 46.A OE1 no hydrogen 2.424 N/A THR 59.A OG1 GLU 46.A OE2 no hydrogen 3.540 N/A THR 59.A OG1 SER 57.A OG no hydrogen 3.312 N/A THR 59.A OG1 GLN 60.A OE1 no hydrogen 2.919 N/A GLN 60.A N SER 57.A O no hydrogen 2.888 N/A ARG 61.A NH1 VAL 156.A O no hydrogen 2.816 N/A ARG 61.A NH2 ARG 151.A O no hydrogen 2.975 N/A ARG 61.A NH2 VAL 156.A O no hydrogen 2.742 N/A LEU 67.A N LEU 211.A O no hydrogen 2.735 N/A ILE 73.A N GLY 143.A O no hydrogen 2.836 N/A HIS 75.A N THR 141.A O no hydrogen 2.790 N/A HIS 75.A NE2 ARG 137.A O no hydrogen 2.927 N/A MET 79.A N GLY 140.A O no hydrogen 2.968 N/A SER 81.A N LYS 306.A O no hydrogen 3.146 N/A ALA 85.A N ALA 313.A O no hydrogen 2.833 N/A PHE 86.A N GLU 90.A OE1 no hydrogen 2.918 N/A GLU 90.A N SER 87.A OG no hydrogen 2.890 N/A PHE 91.A N SER 87.A O no hydrogen 2.945 N/A ASN 92.A N ASP 88.A O no hydrogen 2.899 N/A ALA 93.A N ALA 89.A O no hydrogen 2.903 N/A PHE 94.A N GLU 90.A O no hydrogen 3.187 N/A VAL 95.A N PHE 91.A O no hydrogen 3.031 N/A LYS 96.A N ASN 92.A O no hydrogen 2.937 N/A ARG 97.A N ALA 93.A O no hydrogen 3.018 N/A ILE 98.A N PHE 94.A O no hydrogen 3.174 N/A GLU 99.A N VAL 95.A O no hydrogen 2.793 N/A ASP 100.A N LYS 96.A O no hydrogen 2.881 N/A ARG 101.A N ARG 97.A O no hydrogen 2.913 N/A LEU 102.A N ILE 98.A O no hydrogen 3.041 N/A ILE 103.A N GLU 300.A OE2 no hydrogen 2.672 N/A THR 110.A OG1 ASN 262.A OD1 no hydrogen 2.532 N/A PHE 111.A N CYS 261.A O no hydrogen 2.709 N/A CYS 112.A N LYS 291.A O no hydrogen 2.582 N/A CYS 112.A SG GLU 114.A OE2 no hydrogen 3.809 N/A CYS 113.A N ARG 259.A O no hydrogen 2.829 N/A CYS 113.A SG PHE 111.A O no hydrogen 3.866 N/A GLU 114.A N VAL 289.A O no hydrogen 2.940 N/A LYS 116.A N GLY 287.A O no hydrogen 2.941 N/A LYS 116.A NZ ASP 286.A OD2 no hydrogen 2.919 N/A GLY 119.A N GLU 174.A OE2 no hydrogen 2.760 N/A LEU 120.A N VAL 175.A O no hydrogen 2.797 N/A VAL 122.A N GLY 173.A O no hydrogen 2.927 N/A SER 123.A N ALA 135.A O no hydrogen 2.777 N/A SER 123.A OG GLU 170.A OE2 no hydrogen 2.795 N/A ILE 124.A N VAL 171.A O no hydrogen 2.800 N/A LEU 125.A N GLN 133.A O no hydrogen 2.751 N/A TYR 126.A N LEU 169.A O no hydrogen 2.725 N/A TYR 126.A OH PRO 157.A O no hydrogen 2.721 N/A VAL 127.A N GLU 130.A O no hydrogen 2.821 N/A ASN 128.A N ALA 167.A O no hydrogen 2.963 N/A GLU 130.A N VAL 127.A O no hydrogen 3.019 N/A LEU 131.A N LEU 158.A O no hydrogen 2.859 N/A THR 132.A N LEU 125.A O no hydrogen 2.860 N/A THR 132.A OG1 LEU 125.A O no hydrogen 3.515 N/A ALA 134.A N THR 147.A OG1 no hydrogen 2.991 N/A ALA 135.A N SER 123.A O no hydrogen 2.950 N/A THR 136.A N GLU 144.A O no hydrogen 3.033 N/A ARG 137.A N ALA 121.A O no hydrogen 2.957 N/A ARG 137.A NE MET 79.A O no hydrogen 3.053 N/A ARG 137.A NH2 MET 79.A O no hydrogen 2.768 N/A ASP 139.A N THR 142.A O no hydrogen 3.030 N/A GLY 140.A N ARG 137.A O no hydrogen 2.980 N/A THR 141.A N ASP 139.A OD1 no hydrogen 2.769 N/A THR 142.A N ASP 139.A OD1 no hydrogen 2.908 N/A GLY 143.A N ILE 73.A O no hydrogen 3.033 N/A GLU 144.A N THR 136.A OG1 no hydrogen 2.866 N/A ASP 145.A N SER 71.A O no hydrogen 2.839 N/A ILE 146.A N ALA 134.A O no hydrogen 2.830 N/A THR 147.A N ASP 145.A OD1 no hydrogen 2.950 N/A THR 147.A OG1 ALA 134.A O no hydrogen 3.533 N/A THR 147.A OG1 ASP 145.A OD1 no hydrogen 2.607 N/A ASN 149.A ND2 LEU 208.A O no hydrogen 2.910 N/A ASN 149.A ND2 GLN 210.A O no hydrogen 2.651 N/A ILE 150.A N ILE 146.A O no hydrogen 2.795 N/A ARG 151.A N THR 147.A O no hydrogen 2.869 N/A ARG 151.A NH2 SER 55.A O no hydrogen 2.818 N/A ARG 151.A NH2 GLN 60.A O no hydrogen 2.821 N/A THR 152.A N ASN 149.A O no hydrogen 3.089 N/A THR 152.A OG1 ASN 149.A O no hydrogen 2.803 N/A ILE 153.A N ILE 150.A O no hydrogen 3.089 N/A ARG 154.A NH1 THR 152.A O no hydrogen 3.148 N/A ARG 154.A NH1 SER 217.A O no hydrogen 2.863 N/A ARG 154.A NH2 SER 217.A O no hydrogen 3.191 N/A ASN 155.A ND2 LEU 223.A O no hydrogen 2.908 N/A VAL 156.A N ILE 153.A O no hydrogen 3.186 N/A LEU 160.A N GLY 129.A O no hydrogen 2.632 N/A LEU 161.A N ILE 250.A O no hydrogen 2.773 N/A ASN 164.A N THR 162.A OG1 no hydrogen 3.054 N/A ARG 168.A N GLU 232.A O no hydrogen 3.137 N/A ARG 168.A NH1 GLU 76.A OE2 no hydrogen 2.701 N/A ARG 168.A NH2 GLU 76.A OE1 no hydrogen 3.199 N/A ARG 168.A NH2 GLU 232.A OE1 no hydrogen 3.469 N/A ARG 168.A NH2 GLU 232.A OE2 no hydrogen 3.087 N/A LEU 169.A N TYR 126.A O no hydrogen 2.880 N/A GLU 170.A N ILE 230.A O no hydrogen 2.908 N/A VAL 171.A N ILE 124.A O no hydrogen 2.750 N/A ARG 172.A N GLY 227.A O no hydrogen 2.826 N/A ARG 172.A NE GLU 170.A OE2 no hydrogen 2.767 N/A ARG 172.A NH1 ILE 77.A O no hydrogen 2.730 N/A ARG 172.A NH1 GLU 170.A OE2 no hydrogen 2.631 N/A ARG 172.A NH2 PRO 78.A O no hydrogen 3.178 N/A GLY 173.A N VAL 122.A O no hydrogen 3.269 N/A GLU 174.A N ASN 224.A O no hydrogen 2.885 N/A VAL 175.A N LEU 120.A O no hydrogen 2.789 N/A PHE 176.A N VAL 222.A O no hydrogen 2.927 N/A HIS 179.A N GLY 282.A O no hydrogen 2.806 N/A HIS 179.A NE2 ASP 284.A OD1 no hydrogen 2.649 N/A PHE 182.A N PRO 178.A O no hydrogen 2.928 N/A GLU 183.A N HIS 179.A O no hydrogen 2.841 N/A ARG 184.A N ALA 180.A O no hydrogen 2.911 N/A LEU 185.A N GLY 181.A O no hydrogen 2.834 N/A ASN 186.A N PHE 182.A O no hydrogen 3.053 N/A ASN 186.A ND2 PHE 197.A O no hydrogen 3.034 N/A LYS 187.A N GLU 183.A O no hydrogen 3.218 N/A LYS 187.A NZ GLU 191.A OE2 no hydrogen 3.072 N/A TYR 188.A N ARG 184.A O no hydrogen 2.882 N/A ALA 189.A N LEU 185.A O no hydrogen 2.813 N/A LEU 190.A N ASN 186.A O no hydrogen 3.158 N/A GLU 191.A N LYS 187.A O no hydrogen 3.029 N/A HIS 192.A ND1 TYR 188.A O no hydrogen 2.770 N/A ASN 193.A N LEU 190.A O no hydrogen 3.112 N/A GLU 194.A N ALA 189.A O no hydrogen 2.668 N/A THR 196.A OG1 ASN 186.A OD1 no hydrogen 3.429 N/A PHE 197.A N ASN 186.A OD1 no hydrogen 2.699 N/A ARG 201.A NE ASP 118.A OD1 no hydrogen 3.456 N/A ARG 201.A NH2 ASN 202.A OD1 no hydrogen 2.879 N/A ASN 202.A N ASN 199.A OD1 no hydrogen 2.885 N/A ALA 203.A N ASN 199.A O no hydrogen 3.111 N/A ALA 204.A N PRO 200.A O no hydrogen 3.042 N/A ALA 205.A N ARG 201.A O no hydrogen 3.117 N/A GLY 206.A N ASN 202.A O no hydrogen 2.977 N/A SER 207.A N ALA 203.A O no hydrogen 2.823 N/A SER 207.A OG ALA 203.A O no hydrogen 2.689 N/A LEU 208.A N ALA 204.A O no hydrogen 3.000 N/A ARG 209.A N ALA 205.A O no hydrogen 3.132 N/A ARG 209.A N GLY 206.A O no hydrogen 3.309 N/A GLN 210.A N SER 207.A O no hydrogen 3.307 N/A GLN 210.A NE2 GLY 206.A O no hydrogen 3.278 N/A ASN 214.A N ASP 212.A OD1 no hydrogen 2.958 N/A ASN 214.A ND2 GLY 63.A O no hydrogen 2.906 N/A ASN 214.A ND2 ASP 212.A OD1 no hydrogen 2.769 N/A ILE 215.A N ASP 212.A O no hydrogen 2.800 N/A THR 216.A N ASP 212.A O no hydrogen 3.423 N/A THR 216.A OG1 ASN 149.A OD1 no hydrogen 2.736 N/A THR 216.A OG1 SER 207.A O no hydrogen 3.326 N/A SER 217.A N PRO 213.A O no hydrogen 2.791 N/A LYS 218.A N ILE 215.A O no hydrogen 2.770 N/A ARG 219.A N THR 216.A O no hydrogen 2.792 N/A ARG 219.A NH2 SER 207.A OG no hydrogen 3.105 N/A LEU 221.A N ARG 219.A O no hydrogen 2.739 N/A VAL 222.A N PHE 176.A O no hydrogen 2.902 N/A LEU 223.A N ASN 155.A OD1 no hydrogen 2.905 N/A ASN 224.A N GLU 174.A O no hydrogen 2.913 N/A ALA 225.A N PRO 253.A O no hydrogen 2.952 N/A TYR 226.A N ARG 172.A O no hydrogen 2.726 N/A TYR 226.A OH GLU 174.A OE1 no hydrogen 3.341 N/A GLY 227.A N ARG 172.A O no hydrogen 2.985 N/A GLY 229.A N GLU 170.A O no hydrogen 2.658 N/A ILE 230.A N GLU 170.A OE1 no hydrogen 3.052 N/A GLU 232.A N ARG 168.A O no hydrogen 2.847 N/A HIS 240.A N ASN 293.A O no hydrogen 2.846 N/A HIS 240.A NE2 GLU 114.A OE2 no hydrogen 2.813 N/A TYR 241.A N ASN 293.A OD1 no hydrogen 2.827 N/A ALA 242.A N THR 239.A OG1 no hydrogen 3.332 N/A ARG 243.A N THR 239.A O no hydrogen 3.001 N/A ARG 243.A NE PRO 237.A O no hydrogen 2.922 N/A LEU 244.A N HIS 240.A O no hydrogen 3.060 N/A GLN 245.A N TYR 241.A O no hydrogen 2.890 N/A TRP 246.A N ALA 242.A O no hydrogen 2.933 N/A LEU 247.A N ARG 243.A O no hydrogen 2.922 N/A LYS 248.A N LEU 244.A O no hydrogen 2.979 N/A SER 249.A N GLN 245.A O no hydrogen 2.892 N/A SER 249.A OG TRP 246.A O no hydrogen 2.926 N/A ILE 250.A N TRP 246.A O no hydrogen 2.970 N/A ILE 250.A N LEU 247.A O no hydrogen 3.018 N/A GLY 251.A N LYS 248.A O no hydrogen 3.205 N/A ILE 252.A N LEU 247.A O no hydrogen 3.104 N/A ASN 255.A ND2 TYR 283.A OH no hydrogen 2.888 N/A GLU 257.A N ASN 255.A OD1 no hydrogen 2.777 N/A ARG 259.A N CYS 113.A O no hydrogen 3.111 N/A ARG 259.A NH1 PRO 256.A O no hydrogen 2.899 N/A ARG 259.A NH1 ILE 258.A O no hydrogen 2.940 N/A CYS 261.A N PHE 111.A O no hydrogen 2.945 N/A CYS 261.A SG GLU 266.A O no hydrogen 4.037 N/A ASN 262.A N GLU 266.A OE1 no hydrogen 2.776 N/A GLY 263.A N LEU 109.A O no hydrogen 2.823 N/A VAL 267.A N GLY 263.A O no hydrogen 3.190 N/A LEU 268.A N ALA 264.A O no hydrogen 2.834 N/A GLY 269.A N ASP 265.A O no hydrogen 3.091 N/A PHE 270.A N GLU 266.A O no hydrogen 3.051 N/A TYR 271.A N VAL 267.A O no hydrogen 2.954 N/A TYR 271.A OH LYS 315.A O no hydrogen 2.710 N/A ARG 272.A N LEU 268.A O no hydrogen 2.861 N/A ARG 272.A NH1 ASP 88.A OD1 no hydrogen 2.393 N/A ARG 272.A NH1 ASP 88.A OD2 no hydrogen 2.856 N/A ARG 272.A NH2 ASP 88.A OD2 no hydrogen 2.800 N/A ASP 273.A N GLY 269.A O no hydrogen 2.855 N/A ILE 274.A N PHE 270.A O no hydrogen 2.887 N/A GLN 275.A N TYR 271.A O no hydrogen 2.845 N/A ASN 276.A N ARG 272.A O no hydrogen 2.920 N/A LYS 277.A N ASP 273.A O no hydrogen 3.003 N/A LYS 277.A NZ GLU 257.A OE1 no hydrogen 2.683 N/A ARG 278.A NH2 ILE 285.A O no hydrogen 2.969 N/A SER 279.A OG ASN 276.A O no hydrogen 3.423 N/A SER 280.A N LYS 277.A O no hydrogen 2.841 N/A SER 280.A OG LYS 277.A O no hydrogen 3.202 N/A LEU 281.A N ARG 278.A O no hydrogen 3.222 N/A ASP 286.A N LYS 116.A O no hydrogen 2.874 N/A THR 288.A N TYR 314.A O no hydrogen 2.875 N/A THR 288.A OG1 TYR 314.A O no hydrogen 3.329 N/A VAL 289.A N GLU 114.A O no hydrogen 2.775 N/A LEU 290.A N ILE 312.A O no hydrogen 2.880 N/A LYS 291.A N CYS 112.A O no hydrogen 2.928 N/A LYS 291.A NZ GLU 114.A OE1 no hydrogen 3.088 N/A LYS 291.A NZ GLU 114.A OE2 no hydrogen 2.922 N/A LYS 291.A NZ HIS 240.A NE2 no hydrogen 3.487 N/A ILE 292.A N TRP 310.A O no hydrogen 2.840 N/A ASN 293.A N THR 110.A O no hydrogen 3.066 N/A ILE 295.A N THR 238.A O no hydrogen 3.168 N/A LEU 297.A N ASP 294.A OD2 no hydrogen 2.905 N/A GLN 298.A N ASP 294.A O no hydrogen 2.954 N/A GLN 298.A NE2 ILE 292.A O no hydrogen 2.785 N/A ASN 299.A N ILE 295.A O no hydrogen 2.797 N/A GLU 300.A N ALA 296.A O no hydrogen 2.793 N/A LEU 301.A N LEU 297.A O no hydrogen 2.923 N/A GLY 302.A N GLN 298.A O no hydrogen 2.968 N/A GLY 302.A N ASN 299.A O no hydrogen 3.188 N/A ILE 304.A N ALA 307.A O no hydrogen 2.876 N/A LYS 306.A NZ SER 305.A O no hydrogen 3.191 N/A ALA 307.A N ILE 304.A O no hydrogen 2.982 N/A ARG 309.A N GLY 302.A O no hydrogen 2.912 N/A ARG 309.A NH2 LEU 301.A O no hydrogen 3.478 N/A ARG 309.A NH2 PHE 303.A O no hydrogen 3.051 N/A ILE 312.A N LEU 290.A O no hydrogen 2.979 N/A ALA 313.A N ASP 83.A O no hydrogen 2.896 N/A TYR 314.A OH ASP 88.A OD1 no hydrogen 2.394 N/A LYS 315.A N ALA 85.A O no hydrogen 2.883 N/A LYS 315.A NZ ASP 286.A OD1 no hydrogen 3.149 N/A PHE 316.A N ASP 286.A O no hydrogen 3.139 N/A