Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1gqg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 5.A N VAL 16.A O no hydrogen 2.950 N/A HIS 11.A ND1 ASP 10.A OD1 no hydrogen 2.700 N/A ARG 13.A NE PRO 14.A O no hydrogen 2.826 N/A ARG 13.A NH1 SER 2.A O no hydrogen 3.511 N/A ARG 13.A NH2 SER 2.A O no hydrogen 2.637 N/A ARG 13.A NH2 PRO 14.A O no hydrogen 3.052 N/A TYR 15.A N PHE 285.A O no hydrogen 3.211 N/A TYR 15.A OH TYR 36.A O no hydrogen 2.668 N/A TYR 15.A OH SER 41.A OG no hydrogen 2.855 N/A VAL 16.A N LEU 3.A O no hydrogen 2.863 N/A ILE 17.A N VAL 283.A O no hydrogen 2.908 N/A ARG 18.A NH1 GLU 277.A O no hydrogen 2.864 N/A ARG 18.A NH1 ASP 282.A OD2 no hydrogen 2.843 N/A HIS 19.A N ASP 282.A OD1 no hydrogen 2.801 N/A HIS 19.A NE2 GLU 120.A OE2 no hydrogen 2.636 N/A TYR 20.A N TYR 36.A OH no hydrogen 2.967 N/A TYR 20.A OH GLU 120.A OE1 no hydrogen 2.752 N/A SER 21.A N ARG 18.A O no hydrogen 3.041 N/A SER 21.A OG ARG 18.A O no hydrogen 2.649 N/A HIS 22.A ND1 ASP 7.A OD1 no hydrogen 2.759 N/A HIS 22.A NE2 ALA 141.A O no hydrogen 2.783 N/A ALA 23.A N GLU 6.A O no hydrogen 2.910 N/A ARG 24.A N ASP 7.A OD1 no hydrogen 2.807 N/A ARG 24.A NH1 TYR 135.A OH no hydrogen 3.117 N/A VAL 26.A N TYR 33.A O no hydrogen 3.143 N/A THR 27.A N THR 139.A O no hydrogen 2.869 N/A VAL 28.A N GLN 31.A O no hydrogen 2.903 N/A GLN 31.A N VAL 28.A O no hydrogen 2.968 N/A GLN 31.A NE2 GLY 60.A O no hydrogen 3.188 N/A LEU 32.A N ASN 52.A O no hydrogen 2.897 N/A TYR 33.A N VAL 26.A O no hydrogen 2.868 N/A TYR 33.A OH GLN 31.A OE1 no hydrogen 2.570 N/A ARG 34.A N GLY 50.A O no hydrogen 2.766 N/A ARG 34.A NE SER 21.A O no hydrogen 3.084 N/A ARG 34.A NH1 PRO 148.A O no hydrogen 2.932 N/A ARG 34.A NH2 THR 147.A O no hydrogen 2.837 N/A PHE 35.A N ALA 23.A O no hydrogen 2.871 N/A VAL 37.A N LEU 48.A O no hydrogen 3.039 N/A THR 38.A N SER 41.A OG no hydrogen 2.877 N/A GLY 39.A N GLU 131.A OE2 no hydrogen 2.699 N/A SER 41.A N THR 38.A OG1 no hydrogen 2.967 N/A SER 41.A OG TYR 15.A OH no hydrogen 2.855 N/A SER 41.A OG THR 38.A O no hydrogen 3.444 N/A SER 41.A OG THR 38.A OG1 no hydrogen 3.320 N/A SER 42.A N THR 38.A O no hydrogen 2.950 N/A SER 42.A N GLY 39.A O no hydrogen 3.176 N/A SER 42.A OG THR 38.A O no hydrogen 2.889 N/A SER 42.A OG PHE 46.A O no hydrogen 2.850 N/A GLY 43.A N PRO 40.A O no hydrogen 3.520 N/A TYR 44.A N GLY 39.A O no hydrogen 2.731 N/A ALA 45.A N SER 42.A O no hydrogen 3.252 N/A PHE 46.A N SER 42.A OG no hydrogen 3.137 N/A THR 47.A N ILE 125.A O no hydrogen 2.853 N/A THR 47.A OG1 GLU 131.A OE1 no hydrogen 2.603 N/A LEU 48.A N VAL 37.A O no hydrogen 2.954 N/A MET 49.A N GLY 123.A O no hydrogen 2.814 N/A GLY 50.A N ARG 34.A O no hydrogen 2.831 N/A THR 51.A N MET 121.A O no hydrogen 2.834 N/A ASN 52.A N LEU 32.A O no hydrogen 2.872 N/A ASN 52.A ND2 GLU 120.A OE1 no hydrogen 2.955 N/A ALA 53.A N THR 119.A O no hydrogen 3.151 N/A SER 56.A N ILE 114.A O no hydrogen 2.949 N/A SER 56.A OG ALA 58.A O no hydrogen 3.192 N/A ALA 58.A N SER 56.A OG no hydrogen 3.049 N/A GLY 60.A N PHE 112.A O no hydrogen 2.747 N/A HIS 64.A N HIS 110.A O no hydrogen 3.205 N/A HIS 64.A ND1 LEU 62.A O no hydrogen 2.831 N/A ILE 65.A N TYR 161.A O no hydrogen 2.865 N/A HIS 66.A ND1 ASP 159.A O no hydrogen 2.837 N/A GLN 67.A N ASP 159.A OD1 no hydrogen 2.847 N/A LYS 68.A N ASP 159.A OD2 no hydrogen 2.813 N/A HIS 69.A ND1 ASP 159.A OD2 no hydrogen 2.659 N/A TYR 70.A N VAL 126.A O no hydrogen 2.890 N/A TYR 70.A OH SER 103.A OG no hydrogen 2.809 N/A GLU 71.A N VAL 104.A O no hydrogen 2.924 N/A ASN 72.A N VAL 124.A O no hydrogen 2.867 N/A ASN 72.A ND2 VAL 124.A O no hydrogen 3.028 N/A ASN 72.A ND2 TYR 232.A OH no hydrogen 2.938 N/A PHE 73.A N GLY 102.A O no hydrogen 2.812 N/A TYR 74.A N THR 122.A O no hydrogen 2.901 N/A CYS 75.A N ASP 100.A O no hydrogen 3.015 N/A CYS 75.A SG LYS 77.A O no hydrogen 3.321 N/A CYS 75.A SG GLY 78.A O no hydrogen 3.420 N/A CYS 75.A SG LEU 96.A O no hydrogen 3.925 N/A ASN 76.A N GLU 120.A O no hydrogen 2.889 N/A ASN 76.A ND2.A GLN 262.A OE1 no hydrogen 2.746 N/A ASN 76.A ND2.B GLU 120.A O no hydrogen 3.392 N/A ASN 76.A ND2.B THR 122.A OG1 no hydrogen 2.117 N/A LYS 77.A NZ TYR 20.A OH no hydrogen 2.919 N/A LYS 77.A NZ ASP 118.A OD1 no hydrogen 3.202 N/A LYS 77.A NZ ASP 118.A OD2 no hydrogen 2.997 N/A SER 79.A N THR 119.A OG1 no hydrogen 3.070 N/A SER 79.A OG GLN 115.A OE1 no hydrogen 2.805 N/A SER 79.A OG ASP 116.A OD2 no hydrogen 2.752 N/A PHE 80.A N LEU 96.A O no hydrogen 3.002 N/A GLN 81.A N GLN 113.A O no hydrogen 2.812 N/A GLN 81.A NE2 THR 93.A OG1 no hydrogen 2.838 N/A GLN 81.A NE2 THR 172.A OG1 no hydrogen 2.999 N/A LEU 82.A N ARG 94.A O no hydrogen 2.869 N/A TRP 83.A N THR 111.A O no hydrogen 3.004 N/A TRP 83.A NE1 ARG 169.A O no hydrogen 3.019 N/A ALA 84.A N GLN 92.A O no hydrogen 2.886 N/A GLN 85.A N THR 109.A O no hydrogen 2.934 N/A GLN 85.A NE2 GLU 89.A O no hydrogen 2.551 N/A SER 86.A OG GLY 195.A O no hydrogen 3.370 N/A GLU 89.A N SER 86.A O no hydrogen 2.914 N/A GLN 91.A NE2 THR 167.A O no hydrogen 2.910 N/A GLN 92.A N ALA 84.A O no hydrogen 2.893 N/A THR 93.A N ALA 177.A O no hydrogen 2.991 N/A THR 93.A OG1 LEU 82.A O no hydrogen 2.887 N/A ARG 94.A N LEU 82.A O no hydrogen 3.077 N/A ARG 94.A NH1 GLN 92.A OE1 no hydrogen 2.904 N/A ARG 94.A NH1 THR 93.A O no hydrogen 2.975 N/A ARG 94.A NH2 GLN 92.A OE1 no hydrogen 3.005 N/A VAL 95.A N GLY 175.A O no hydrogen 2.842 N/A LEU 96.A N PHE 80.A O no hydrogen 2.798 N/A SER 97.A N ASP 100.A OD2 no hydrogen 2.960 N/A SER 97.A OG ASP 100.A OD2 no hydrogen 3.391 N/A GLY 99.A N CYS 75.A O no hydrogen 2.756 N/A ASP 100.A N SER 97.A O no hydrogen 2.883 N/A TYR 101.A N ILE 200.A O no hydrogen 2.946 N/A TYR 101.A OH ASN 72.A OD1 no hydrogen 2.513 N/A TYR 101.A OH SER 103.A OG no hydrogen 2.760 N/A GLY 102.A N PHE 73.A O no hydrogen 2.832 N/A SER 103.A N TYR 198.A O no hydrogen 2.783 N/A SER 103.A OG TYR 70.A OH no hydrogen 2.809 N/A SER 103.A OG TYR 101.A OH no hydrogen 2.760 N/A VAL 104.A N GLU 71.A O no hydrogen 2.902 N/A ARG 106.A NH1 ASP 229.A OD2 no hydrogen 2.919 N/A ARG 106.A NH2 ASP 229.A OD1 no hydrogen 2.733 N/A ARG 106.A NH2 ASP 229.A OD2 no hydrogen 3.454 N/A ASN 107.A N HIS 66.A O no hydrogen 2.896 N/A THR 109.A N GLN 85.A O no hydrogen 2.865 N/A HIS 110.A N HIS 64.A O no hydrogen 3.035 N/A HIS 110.A ND1 VAL 108.A O no hydrogen 2.904 N/A THR 111.A N TRP 83.A O no hydrogen 3.285 N/A THR 111.A OG1 VAL 61.A O no hydrogen 2.636 N/A GLN 113.A N GLN 81.A O no hydrogen 2.917 N/A GLN 113.A NE2 SER 56.A O no hydrogen 2.947 N/A GLN 115.A N SER 79.A O no hydrogen 2.846 N/A ASP 116.A N SER 79.A O no hydrogen 3.254 N/A THR 119.A OG1 SER 79.A O no hydrogen 3.152 N/A THR 119.A OG1 ASP 116.A O no hydrogen 2.646 N/A GLU 120.A N LYS 77.A O no hydrogen 2.917 N/A MET 121.A N THR 51.A O no hydrogen 2.836 N/A THR 122.A N TYR 74.A O no hydrogen 2.737 N/A THR 122.A OG1 GLN 260.A OE1 no hydrogen 2.999 N/A GLY 123.A N MET 49.A O no hydrogen 2.763 N/A VAL 124.A N ASN 72.A O no hydrogen 3.039 N/A ILE 125.A N THR 47.A O no hydrogen 2.879 N/A VAL 126.A N TYR 70.A O no hydrogen 2.976 N/A GLY 128.A N TYR 44.A O no hydrogen 2.945 N/A GLY 129.A N THR 47.A OG1 no hydrogen 3.137 N/A GLY 129.A N GLU 131.A OE1 no hydrogen 3.157 N/A GLU 131.A N GLU 131.A OE1 no hydrogen 2.697 N/A ASP 132.A N GLY 129.A O no hydrogen 3.301 N/A LEU 133.A N PHE 130.A O no hydrogen 3.130 N/A PHE 134.A N GLU 131.A O no hydrogen 2.879 N/A TYR 135.A N GLU 131.A O no hydrogen 3.039 N/A TYR 136.A N ASP 132.A O no hydrogen 2.861 N/A LEU 137.A N LEU 133.A O no hydrogen 2.962 N/A GLY 138.A N PHE 134.A O no hydrogen 2.812 N/A THR 139.A N THR 27.A O no hydrogen 2.936 N/A ALA 141.A N ALA 25.A O no hydrogen 3.012 N/A HIS 146.A N ASP 143.A O no hydrogen 2.964 N/A THR 147.A N ASP 143.A OD1 no hydrogen 3.107 N/A THR 147.A OG1 TYR 149.A O no hydrogen 3.478 N/A TYR 149.A OH PRO 117.A O no hydrogen 2.570 N/A GLN 156.A N GLN 156.A OE1 no hydrogen 2.796 N/A GLN 156.A NE2 SER 153.A O no hydrogen 3.621 N/A PHE 158.A N LEU 155.A O no hydrogen 2.886 N/A ASP 159.A N GLN 156.A O no hydrogen 2.812 N/A VAL 160.A N LEU 155.A O no hydrogen 3.262 N/A TYR 161.A N ILE 65.A O no hydrogen 2.932 N/A GLU 163.A N PRO 63.A O no hydrogen 3.087 N/A PHE 166.A N GLU 163.A O no hydrogen 3.072 N/A ARG 169.A N GLN 91.A OE1 no hydrogen 2.665 N/A ARG 169.A NE ASP 171.A OD1 no hydrogen 2.707 N/A ARG 169.A NH1 GLN 91.A O no hydrogen 2.974 N/A ARG 169.A NH2 ASP 171.A OD1 no hydrogen 3.511 N/A ARG 169.A NH2 ASP 171.A OD2 no hydrogen 2.717 N/A VAL 173.A N THR 176.A O no hydrogen 3.075 N/A THR 176.A N VAL 173.A O no hydrogen 3.092 N/A THR 176.A OG1 THR 93.A O no hydrogen 3.487 N/A THR 176.A OG1 THR 181.A OG1 no hydrogen 2.802 N/A ALA 177.A N THR 93.A O no hydrogen 3.115 N/A THR 181.A OG1 THR 176.A OG1 no hydrogen 2.802 N/A THR 181.A OG1 PRO 178.A O no hydrogen 2.635 N/A TRP 183.A NE1 VAL 95.A O no hydrogen 2.859 N/A HIS 184.A NE2 ASP 100.A OD2 no hydrogen 2.644 N/A ASN 188.A N TRP 204.A O no hydrogen 2.850 N/A ASN 188.A ND2 VAL 182.A O no hydrogen 2.963 N/A TYR 198.A N SER 103.A O no hydrogen 3.393 N/A TYR 198.A OH PHE 221.A O no hydrogen 2.641 N/A ILE 200.A N TYR 101.A O no hydrogen 2.920 N/A ALA 201.A N ASN 188.A OD1 no hydrogen 2.899 N/A ASN 202.A N ASP 100.A OD1 no hydrogen 2.874 N/A ASN 202.A ND2 SER 98.A O no hydrogen 3.380 N/A TRP 204.A N ALA 201.A O no hydrogen 2.909 N/A LYS 207.A NZ GLY 203.A O no hydrogen 2.954 N/A LYS 207.A NZ GLY 205.A O no hydrogen 2.847 N/A TYR 208.A N VAL 218.A O no hydrogen 2.893 N/A LEU 209.A N GLU 322.A O no hydrogen 2.838 N/A ASN 210.A N GLN 216.A O no hydrogen 2.752 N/A ASN 210.A ND2 GLN 212.A OE1 no hydrogen 2.831 N/A ASN 210.A ND2 LEU 317.A O no hydrogen 2.944 N/A GLN 212.A N ASN 210.A OD1 no hydrogen 2.912 N/A TYR 215.A N SER 240.A OG no hydrogen 2.885 N/A TYR 215.A OH ASP 332.A O no hydrogen 2.648 N/A GLN 216.A N ASN 210.A O no hydrogen 2.910 N/A GLN 216.A NE2 TYR 294.A OH no hydrogen 2.578 N/A ILE 217.A N SER 238.A O no hydrogen 2.885 N/A VAL 218.A N TYR 208.A O no hydrogen 2.934 N/A ALA 219.A N THR 236.A O no hydrogen 2.872 N/A PHE 221.A N LEU 234.A O no hydrogen 2.790 N/A VAL 222.A N LEU 234.A O no hydrogen 2.890 N/A THR 223.A N GLN 226.A OE1 no hydrogen 2.799 N/A THR 223.A OG1 GLN 226.A OE1 no hydrogen 2.672 N/A THR 225.A N THR 223.A OG1 no hydrogen 3.337 N/A GLN 226.A N THR 223.A O no hydrogen 3.058 N/A GLN 226.A NE2 ALA 191.A O no hydrogen 2.861 N/A ALA 227.A N THR 223.A O no hydrogen 2.832 N/A GLN 228.A N ALA 224.A O no hydrogen 2.929 N/A GLN 228.A NE2 ALA 224.A O no hydrogen 2.751 N/A GLN 228.A NE2 THR 225.A O no hydrogen 3.555 N/A THR 230.A N ALA 227.A O no hydrogen 2.935 N/A THR 230.A OG1 ALA 227.A O no hydrogen 2.629 N/A ASN 231.A N GLN 228.A O no hydrogen 2.949 N/A THR 233.A N SER 307.A O no hydrogen 2.861 N/A THR 233.A OG1 ASP 314.A OD1 no hydrogen 2.697 N/A THR 233.A OG1 ASP 314.A OD2 no hydrogen 3.295 N/A LEU 234.A N VAL 222.A O no hydrogen 3.158 N/A SER 235.A N PHE 305.A O no hydrogen 2.954 N/A SER 235.A OG ASP 314.A OD2 no hydrogen 2.959 N/A THR 236.A N ALA 219.A O no hydrogen 3.058 N/A ILE 237.A N VAL 303.A O no hydrogen 2.933 N/A SER 238.A N ILE 217.A O no hydrogen 2.850 N/A MET 239.A N SER 301.A O no hydrogen 2.761 N/A SER 240.A N TYR 215.A O no hydrogen 2.905 N/A SER 240.A OG TYR 215.A O no hydrogen 3.283 N/A SER 240.A OG THR 241.A O no hydrogen 2.709 N/A VAL 246.A N PRO 243.A O no hydrogen 2.898 N/A TRP 251.A N PHE 292.A O no hydrogen 2.760 N/A CYS 257.A N ILE 286.A O no hydrogen 3.038 N/A ALA 258.A N VAL 306.A O no hydrogen 2.919 N/A PHE 259.A N ALA 284.A O no hydrogen 3.021 N/A GLN 260.A N LEU 304.A O no hydrogen 2.912 N/A GLN 260.A NE2 GLY 281.A O no hydrogen 3.170 N/A VAL 261.A N ASP 282.A O no hydrogen 2.928 N/A GLN 262.A N LYS 302.A O no hydrogen 2.805 N/A GLN 262.A NE2 ASN 76.A OD1.B no hydrogen 3.595 N/A GLN 262.A NE2 GLN 260.A O no hydrogen 3.101 N/A GLN 262.A NE2 GLN 260.A OE1 no hydrogen 2.917 N/A GLU 263.A N LYS 302.A O no hydrogen 3.072 N/A ARG 265.A N SER 301.A OG no hydrogen 3.082 N/A ARG 265.A NH1 GLU 277.A OE2 no hydrogen 3.179 N/A VAL 266.A N LEU 278.A O no hydrogen 3.035 N/A VAL 267.A N TYR 295.A O no hydrogen 2.796 N/A VAL 268.A N THR 276.A O no hydrogen 2.822 N/A GLN 269.A N LYS 293.A O no hydrogen 2.805 N/A GLY 271.A N GLU 291.A O no hydrogen 2.839 N/A TYR 273.A N ILE 270.A O no hydrogen 2.937 N/A TYR 273.A OH SER 1.A O no hydrogen 3.429 N/A THR 276.A N VAL 268.A O no hydrogen 2.863 N/A THR 276.A OG1 ALA 274.A O no hydrogen 2.920 N/A LEU 278.A N VAL 266.A O no hydrogen 2.833 N/A GLY 279.A N ASP 282.A OD2 no hydrogen 2.791 N/A GLY 281.A N VAL 261.A O no hydrogen 2.819 N/A ASP 282.A N GLY 279.A O no hydrogen 2.998 N/A VAL 283.A N ILE 17.A O no hydrogen 2.967 N/A ALA 284.A N PHE 259.A O no hydrogen 2.913 N/A PHE 285.A N TYR 15.A O no hydrogen 2.878 N/A ILE 286.A N CYS 257.A O no hydrogen 2.915 N/A GLY 289.A N PHE 253.A O no hydrogen 2.732 N/A VAL 290.A N PRO 287.A O no hydrogen 3.228 N/A PHE 292.A N TRP 251.A O no hydrogen 2.866 N/A LYS 293.A N GLN 269.A O no hydrogen 2.986 N/A TYR 295.A N VAL 267.A O no hydrogen 2.972 N/A SER 296.A OG ALA 298.A O no hydrogen 2.673 N/A SER 296.A OG SER 301.A OG no hydrogen 2.628 N/A GLU 297.A N ARG 265.A O no hydrogen 2.829 N/A ALA 298.A N ARG 265.A O no hydrogen 3.313 N/A SER 301.A N MET 239.A O no hydrogen 3.033 N/A SER 301.A OG ARG 265.A O no hydrogen 3.425 N/A SER 301.A OG SER 296.A OG no hydrogen 2.628 N/A LYS 302.A N GLU 263.A O no hydrogen 2.870 N/A LYS 302.A NZ TYR 74.A OH no hydrogen 3.498 N/A LYS 302.A NZ ASN 202.A OD1 no hydrogen 3.493 N/A VAL 303.A N ILE 237.A O no hydrogen 2.866 N/A LEU 304.A N GLN 260.A O no hydrogen 2.903 N/A PHE 305.A N SER 235.A O no hydrogen 2.739 N/A VAL 306.A N ALA 258.A O no hydrogen 2.914 N/A SER 307.A N THR 233.A O no hydrogen 3.032 N/A SER 307.A OG SER 308.A O no hydrogen 3.308 N/A SER 308.A N ALA 256.A O no hydrogen 2.845 N/A GLY 309.A N ASN 231.A O no hydrogen 2.839 N/A SER 310.A OG ASP 311.A OD1 no hydrogen 2.950 N/A GLN 315.A N ASP 314.A OD1 no hydrogen 2.923 N/A ASN 316.A N GLY 312.A O no hydrogen 2.904 N/A LEU 317.A N LEU 313.A O no hydrogen 2.945 N/A VAL 318.A N ASP 314.A O no hydrogen 2.908 N/A ASN 319.A N GLN 315.A O no hydrogen 2.840 N/A ASN 319.A ND2 GLN 315.A OE1 no hydrogen 3.012 N/A GLY 320.A N ASN 316.A O no hydrogen 3.046 N/A GLY 321.A N VAL 318.A O no hydrogen 2.981 N/A GLU 322.A N LEU 209.A O no hydrogen 2.966 N/A TRP 324.A N LYS 207.A O no hydrogen 2.956 N/A TRP 324.A NE1 SER 328.A O no hydrogen 2.901 N/A SER 326.A OG SER 328.A O no hydrogen 3.424 N/A SER 328.A N SER 326.A OG no hydrogen 2.999 N/A