Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wgq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A N ASP 25.A O no hydrogen 3.166 N/A ILE 2.A N ASP 25.A O no hydrogen 3.005 N/A ARG 3.A N ASP 61.A OD2 no hydrogen 2.750 N/A ARG 3.A NE ASP 61.A OD2 no hydrogen 3.191 N/A ARG 3.A NH2 ASP 61.A OD1 no hydrogen 2.962 N/A ILE 4.A N GLU 27.A O no hydrogen 2.780 N/A GLY 5.A N VAL 62.A O no hydrogen 2.930 N/A ILE 6.A N ALA 30.A O no hydrogen 2.966 N/A VAL 7.A N ILE 64.A O no hydrogen 2.943 N/A GLY 8.A N PHE 32.A O no hydrogen 2.807 N/A TYR 9.A OH GLU 17.A OE1 no hydrogen 2.514 N/A LYS 14.A N GLY 10.A O no hydrogen 3.004 N/A LYS 14.A NZ TYR 9.A O no hydrogen 2.827 N/A GLY 15.A N ASN 11.A O no hydrogen 2.930 N/A VAL 16.A N ILE 12.A O no hydrogen 2.801 N/A GLU 17.A N GLY 13.A O no hydrogen 3.054 N/A LYS 18.A N LYS 14.A O no hydrogen 3.232 N/A LYS 18.A NZ GLU 275.A OE2 no hydrogen 2.600 N/A ALA 19.A N GLY 15.A O no hydrogen 2.884 N/A ILE 20.A N VAL 16.A O no hydrogen 2.907 N/A LYS 21.A N LYS 18.A O no hydrogen 2.953 N/A GLN 22.A N ALA 19.A O no hydrogen 2.846 N/A ASN 23.A N ILE 20.A O no hydrogen 2.991 N/A ASN 23.A ND2 ALA 19.A O no hydrogen 2.721 N/A MET 26.A N ASN 23.A O no hydrogen 3.177 N/A GLU 27.A N ILE 2.A O no hydrogen 2.889 N/A GLU 29.A N ILE 4.A O no hydrogen 2.789 N/A ILE 31.A N LYS 46.A O no hydrogen 2.942 N/A PHE 32.A N ILE 6.A O no hydrogen 2.669 N/A THR 33.A N VAL 48.A O no hydrogen 2.919 N/A ARG 35.A NE ASP 41.A OD1 no hydrogen 3.078 N/A ARG 35.A NH1 ASP 36.A OD2 no hydrogen 3.546 N/A LYS 39.A N ASN 38.A OD1 no hydrogen 2.538 N/A LYS 39.A NZ ASN 43.A OD1 no hydrogen 2.865 N/A SER 42.A N VAL 40.A O no hydrogen 2.674 N/A LYS 46.A NZ LEU 28.A O no hydrogen 3.374 N/A LEU 47.A N ASN 44.A O no hydrogen 3.120 N/A VAL 48.A N ILE 31.A O no hydrogen 2.715 N/A HIS 49.A ND1 SER 51.A OG no hydrogen 2.633 N/A ILE 50.A N THR 33.A O no hydrogen 2.858 N/A SER 51.A N HIS 49.A ND1 no hydrogen 3.039 N/A SER 51.A OG HIS 49.A ND1 no hydrogen 2.633 N/A ARG 52.A N HIS 49.A O no hydrogen 2.968 N/A LEU 53.A N ILE 50.A O no hydrogen 3.167 N/A LEU 55.A N ARG 52.A O no hydrogen 2.843 N/A TYR 56.A N LEU 53.A O no hydrogen 3.035 N/A LYS 57.A N GLU 54.A O no hydrogen 3.218 N/A LYS 57.A NZ GLN 83.A O no hydrogen 3.547 N/A THR 59.A N TYR 56.A O no hydrogen 3.038 N/A ASP 61.A N ARG 3.A O no hydrogen 2.704 N/A VAL 62.A N ARG 3.A O no hydrogen 3.203 N/A MET 63.A N ASN 85.A O no hydrogen 2.933 N/A ILE 64.A N GLY 5.A O no hydrogen 2.823 N/A LEU 65.A N VAL 87.A O no hydrogen 2.832 N/A CYS 66.A N VAL 7.A O no hydrogen 2.716 N/A CYS 66.A SG ILE 64.A O no hydrogen 3.552 N/A ASP 72.A N SER 69.A OG no hydrogen 3.181 N/A VAL 74.A N ALA 70.A O no hydrogen 2.948 N/A GLU 75.A N ASP 72.A O no hydrogen 3.117 N/A GLN 76.A N ASP 72.A O no hydrogen 2.879 N/A GLY 77.A N LEU 73.A O no hydrogen 2.787 N/A MET 79.A N GLU 75.A O no hydrogen 3.367 N/A ILE 80.A N GLN 76.A O no hydrogen 3.060 N/A ALA 81.A N GLY 77.A O no hydrogen 2.905 N/A SER 82.A N PRO 78.A O no hydrogen 3.146 N/A SER 82.A OG MET 79.A O no hydrogen 2.786 N/A GLN 83.A N ILE 80.A O no hydrogen 2.795 N/A GLN 83.A NE2 MET 79.A O no hydrogen 3.015 N/A PHE 84.A N ILE 80.A O no hydrogen 2.815 N/A ASN 85.A ND2 ILE 113.A O no hydrogen 3.605 N/A THR 86.A N ILE 113.A O no hydrogen 3.018 N/A THR 86.A OG1 SER 114.A OG no hydrogen 2.823 N/A VAL 87.A N MET 63.A O no hydrogen 3.106 N/A ASP 88.A N LEU 115.A O no hydrogen 2.963 N/A PHE 90.A N ASP 88.A OD1 no hydrogen 2.835 N/A ARG 95.A N ASN 92.A O no hydrogen 2.997 N/A ARG 95.A N ASN 92.A OD1 no hydrogen 3.082 N/A ILE 96.A N HIS 93.A O no hydrogen 3.189 N/A GLN 98.A N GLN 98.A OE1 no hydrogen 2.361 N/A GLN 98.A NE2 GLY 94.A O no hydrogen 3.694 N/A HIS 99.A N ARG 95.A O no hydrogen 3.086 N/A HIS 99.A NE2 ASP 88.A OD2 no hydrogen 2.929 N/A PHE 100.A N ILE 96.A O no hydrogen 2.783 N/A GLU 101.A N PRO 97.A O no hydrogen 3.094 N/A ARG 102.A N GLN 98.A O no hydrogen 2.992 N/A ARG 102.A NE VAL 74.A O no hydrogen 2.616 N/A MET 103.A N HIS 99.A O no hydrogen 2.909 N/A ASP 104.A N PHE 100.A O no hydrogen 2.769 N/A GLU 105.A N GLU 101.A O no hydrogen 3.050 N/A ILE 106.A N ARG 102.A O no hydrogen 3.144 N/A SER 107.A N MET 103.A O no hydrogen 2.850 N/A SER 107.A OG MET 103.A O no hydrogen 2.842 N/A SER 107.A OG ASP 104.A O no hydrogen 3.233 N/A LYS 108.A N ASP 104.A O no hydrogen 2.899 N/A LYS 109.A N GLU 105.A O no hydrogen 3.116 N/A ALA 110.A N ILE 106.A O no hydrogen 3.037 N/A GLY 111.A N LYS 108.A O no hydrogen 2.948 N/A ASN 112.A N SER 107.A O no hydrogen 2.692 N/A ASN 112.A ND2 ALA 81.A O no hydrogen 2.984 N/A SER 114.A N GLY 298.A O no hydrogen 2.977 N/A SER 114.A OG THR 86.A OG1 no hydrogen 2.823 N/A LEU 115.A N THR 86.A O no hydrogen 2.832 N/A ILE 116.A N VAL 300.A O no hydrogen 2.962 N/A SER 117.A N ASP 88.A OD1 no hydrogen 2.885 N/A SER 117.A OG PHE 90.A O no hydrogen 2.800 N/A THR 118.A N ASP 88.A O no hydrogen 3.056 N/A TRP 120.A NE1 SER 273.A OG no hydrogen 3.119 N/A GLY 123.A N SER 126.A OG no hydrogen 2.836 N/A LEU 124.A N GLY 119.A O no hydrogen 2.917 N/A PHE 125.A N TRP 120.A O no hydrogen 2.715 N/A LEU 127.A N GLY 123.A O no hydrogen 3.028 N/A ASN 128.A N LEU 124.A O no hydrogen 3.143 N/A ARG 129.A N PHE 125.A O no hydrogen 2.966 N/A ARG 129.A NE THR 143.A OG1 no hydrogen 2.894 N/A ARG 129.A NH1 ASP 121.A OD1 no hydrogen 3.317 N/A ARG 129.A NH2 ASP 121.A OD1 no hydrogen 2.946 N/A ARG 129.A NH2 ASP 121.A OD2 no hydrogen 2.259 N/A LEU 130.A N SER 126.A O no hydrogen 3.116 N/A LEU 131.A N LEU 127.A O no hydrogen 2.877 N/A GLY 132.A N ASN 128.A O no hydrogen 2.862 N/A GLU 133.A N ARG 129.A O no hydrogen 2.997 N/A SER 134.A N LEU 130.A O no hydrogen 2.925 N/A SER 134.A OG LEU 130.A O no hydrogen 3.075 N/A ILE 135.A N LEU 131.A O no hydrogen 2.969 N/A LEU 136.A N GLY 132.A O no hydrogen 2.991 N/A LYS 140.A N SER 253.A O no hydrogen 2.818 N/A LYS 140.A NZ ASP 187.A OD1 no hydrogen 3.204 N/A HIS 142.A N ILE 251.A O no hydrogen 2.693 N/A PHE 144.A N PHE 249.A O no hydrogen 2.691 N/A TRP 145.A NE1 ASP 121.A OD2 no hydrogen 2.894 N/A GLY 148.A N ILE 170.A O no hydrogen 3.283 N/A HIS 153.A N SER 150.A O no hydrogen 2.657 N/A SER 154.A N LEU 151.A O no hydrogen 2.739 N/A ASP 155.A N LEU 151.A O no hydrogen 3.088 N/A ALA 156.A N GLY 152.A O no hydrogen 2.768 N/A ILE 157.A N HIS 153.A O no hydrogen 3.152 N/A ARG 158.A N SER 154.A O no hydrogen 3.119 N/A ARG 158.A NE ASN 165.A OD1 no hydrogen 3.275 N/A ARG 159.A N ALA 156.A O no hydrogen 3.138 N/A ARG 159.A NH1 TYR 221.A OH no hydrogen 3.568 N/A VAL 160.A N ILE 157.A O no hydrogen 2.893 N/A VAL 163.A N VAL 160.A O no hydrogen 3.222 N/A LYS 164.A N VAL 201.A O no hydrogen 3.164 N/A ASN 165.A N VAL 201.A O no hydrogen 3.352 N/A ILE 167.A N TYR 199.A O no hydrogen 2.854 N/A TYR 169.A N VAL 197.A O no hydrogen 2.739 N/A TYR 169.A OH HIS 241.A ND1 no hydrogen 2.926 N/A ILE 170.A N GLY 148.A O no hydrogen 2.940 N/A ILE 171.A N GLU 195.A O no hydrogen 2.989 N/A ILE 173.A N LYS 193.A O no hydrogen 2.681 N/A LYS 174.A NZ ASP 178.A OD1 no hydrogen 2.797 N/A LYS 174.A NZ ASP 178.A OD2 no hydrogen 2.933 N/A LEU 177.A N ILE 173.A O no hydrogen 3.139 N/A ASP 178.A N LYS 174.A O no hydrogen 2.849 N/A LYS 179.A N GLY 175.A O no hydrogen 3.070 N/A ALA 180.A N ALA 176.A O no hydrogen 2.820 N/A ARG 181.A N LEU 177.A O no hydrogen 2.994 N/A ARG 181.A NE GLU 265.A OE1 no hydrogen 2.947 N/A ARG 181.A NH2 GLU 265.A OE2 no hydrogen 3.217 N/A SER 182.A N ASP 178.A O no hydrogen 2.969 N/A SER 182.A N LYS 179.A O no hydrogen 2.901 N/A SER 182.A OG ASP 178.A O no hydrogen 2.663 N/A GLY 183.A N ALA 180.A O no hydrogen 3.492 N/A THR 189.A N GLU 192.A OE1 no hydrogen 2.905 N/A THR 189.A OG1 GLU 192.A OE1 no hydrogen 3.522 N/A ARG 191.A NH1 ASN 226.A OD1 no hydrogen 2.976 N/A ARG 191.A NH2 ALA 223.A O no hydrogen 2.547 N/A GLU 192.A N THR 189.A O no hydrogen 2.822 N/A GLU 192.A N THR 189.A OG1 no hydrogen 3.074 N/A LYS 193.A N THR 190.A O no hydrogen 3.301 N/A LYS 193.A NZ THR 143.A O no hydrogen 2.987 N/A HIS 194.A N THR 190.A O no hydrogen 3.443 N/A GLU 195.A N ILE 171.A O no hydrogen 2.945 N/A MET 196.A N ASN 226.A O no hydrogen 3.028 N/A VAL 197.A N TYR 169.A O no hydrogen 3.012 N/A CYS 198.A N THR 228.A O no hydrogen 2.673 N/A TYR 199.A N ILE 167.A O no hydrogen 2.772 N/A VAL 200.A N HIS 230.A O no hydrogen 2.693 N/A VAL 201.A N ASN 165.A O no hydrogen 2.754 N/A GLU 203.A N GLY 162.A O no hydrogen 2.691 N/A GLU 212.A N LEU 208.A O no hydrogen 3.245 N/A GLU 212.A N LYS 209.A O no hydrogen 2.888 N/A GLN 213.A N LYS 210.A O no hydrogen 3.174 N/A THR 217.A OG1 ASP 214.A O no hydrogen 3.413 N/A MET 218.A N ILE 215.A O no hydrogen 3.003 N/A PHE 222.A N MET 218.A O no hydrogen 3.226 N/A THR 227.A OG1 TYR 225.A O no hydrogen 3.121 N/A THR 228.A N MET 196.A O no hydrogen 2.741 N/A HIS 230.A N CYS 198.A O no hydrogen 2.775 N/A ILE 232.A N VAL 200.A O no hydrogen 2.888 N/A THR 233.A N GLU 236.A OE1 no hydrogen 2.565 N/A THR 233.A OG1 GLU 235.A OE2 no hydrogen 3.421 N/A LEU 237.A N THR 233.A O no hydrogen 3.059 N/A LYS 238.A N GLU 234.A O no hydrogen 3.068 N/A LEU 239.A N GLU 235.A O no hydrogen 3.260 N/A ASN 240.A N GLU 236.A O no hydrogen 2.808 N/A HIS 241.A N LEU 237.A O no hydrogen 2.826 N/A HIS 241.A ND1 TYR 169.A OH no hydrogen 2.926 N/A LEU 244.A N ALA 242.A O no hydrogen 2.411 N/A ASN 246.A N LEU 270.A O no hydrogen 2.873 N/A ASN 246.A ND2 VAL 149.A O no hydrogen 3.150 N/A GLY 247.A N ASN 246.A OD1 no hydrogen 2.856 N/A GLY 248.A N LEU 268.A O no hydrogen 3.007 N/A PHE 249.A N PHE 144.A O no hydrogen 2.686 N/A VAL 250.A N PHE 266.A O no hydrogen 2.809 N/A ILE 251.A N HIS 142.A O no hydrogen 2.735 N/A ARG 252.A N MET 264.A O no hydrogen 2.859 N/A ARG 252.A NE LEU 136.A O no hydrogen 3.002 N/A ARG 252.A NH1 THR 141.A OG1 no hydrogen 2.814 N/A ARG 252.A NH2 LEU 136.A O no hydrogen 2.646 N/A SER 253.A N LYS 140.A O no hydrogen 2.883 N/A GLY 254.A N GLN 262.A O no hydrogen 2.960 N/A ASN 255.A N LYS 138.A O no hydrogen 3.113 N/A THR 256.A N ALA 260.A O no hydrogen 3.308 N/A GLY 259.A N THR 256.A O no hydrogen 3.011 N/A LYS 261.A NZ GLY 259.A O no hydrogen 3.328 N/A GLN 262.A N GLY 254.A O no hydrogen 3.006 N/A GLN 262.A NE2 THR 256.A OG1 no hydrogen 3.430 N/A MET 264.A N ARG 252.A O no hydrogen 2.891 N/A PHE 266.A N VAL 250.A O no hydrogen 3.076 N/A ASN 267.A ND2 GLU 265.A OE2 no hydrogen 2.844 N/A LEU 268.A N GLY 248.A O no hydrogen 2.944 N/A LEU 270.A N ASN 246.A O no hydrogen 2.774 N/A SER 273.A N LEU 244.A O no hydrogen 2.843 N/A PHE 276.A N SER 272.A O no hydrogen 3.050 N/A THR 277.A N SER 273.A O no hydrogen 2.952 N/A THR 277.A OG1 SER 273.A O no hydrogen 3.328 N/A SER 278.A N ALA 274.A O no hydrogen 2.890 N/A SER 278.A OG ILE 12.A O no hydrogen 2.823 N/A SER 278.A OG ALA 274.A O no hydrogen 2.927 N/A SER 279.A N GLU 275.A O no hydrogen 3.015 N/A SER 279.A OG GLU 275.A O no hydrogen 2.918 N/A VAL 280.A N PHE 276.A O no hydrogen 2.935 N/A LEU 281.A N THR 277.A O no hydrogen 2.907 N/A VAL 282.A N SER 278.A O no hydrogen 3.091 N/A ALA 283.A N SER 279.A O no hydrogen 3.034 N/A TYR 284.A N VAL 280.A O no hydrogen 3.029 N/A SER 285.A N LEU 281.A O no hydrogen 3.016 N/A SER 285.A N VAL 282.A O no hydrogen 3.041 N/A SER 285.A OG LEU 281.A O no hydrogen 2.824 N/A ARG 286.A N VAL 282.A O no hydrogen 3.330 N/A ARG 286.A N ALA 283.A O no hydrogen 3.061 N/A ARG 286.A NE LEU 310.A O no hydrogen 3.060 N/A ARG 286.A NH1 ASN 23.A OD1 no hydrogen 3.007 N/A ARG 286.A NH1 ASP 25.A OD2 no hydrogen 3.174 N/A ARG 286.A NH2 ASN 23.A OD1 no hydrogen 3.006 N/A ARG 286.A NH2 LEU 310.A O no hydrogen 3.382 N/A ALA 287.A N ALA 283.A O no hydrogen 3.457 N/A ILE 288.A N TYR 284.A O no hydrogen 2.901 N/A TYR 289.A N SER 285.A O no hydrogen 2.859 N/A LYS 290.A N ARG 286.A O no hydrogen 3.086 N/A LYS 290.A NZ TYR 309.A O no hydrogen 2.898 N/A LYS 290.A NZ SER 311.A O no hydrogen 2.564 N/A LEU 291.A N ALA 287.A O no hydrogen 2.909 N/A SER 292.A N ILE 288.A O no hydrogen 2.861 N/A SER 292.A OG ASN 85.A OD1 no hydrogen 3.091 N/A LYS 293.A N TYR 289.A O no hydrogen 3.151 N/A GLU 294.A N LYS 290.A O no hydrogen 3.170 N/A GLU 294.A N LEU 291.A O no hydrogen 2.958 N/A GLY 295.A N SER 292.A O no hydrogen 2.833 N/A LYS 296.A N LEU 291.A O no hydrogen 3.113 N/A LYS 297.A NZ GLY 111.A O no hydrogen 3.126 N/A GLY 298.A N ASN 112.A O no hydrogen 2.904 N/A ALA 299.A N ASP 104.A OD1 no hydrogen 2.796 N/A VAL 300.A N SER 114.A O no hydrogen 2.930 N/A THR 301.A N ASP 304.A OD2 no hydrogen 3.057 N/A THR 301.A OG1 ASP 304.A OD2 no hydrogen 3.568 N/A LEU 303.A N THR 301.A OG1 no hydrogen 3.200 N/A ASP 304.A N THR 301.A O no hydrogen 2.979 N/A ILE 305.A N VAL 302.A O no hydrogen 3.271 N/A TYR 309.A N PRO 306.A O no hydrogen 3.049 N/A TYR 309.A OH GLU 294.A OE1 no hydrogen 3.024 N/A TYR 309.A OH GLU 294.A OE2 no hydrogen 2.911 N/A LEU 310.A N PHE 307.A O no hydrogen 3.033 N/A SER 311.A N SER 308.A O no hydrogen 3.244 N/A LYS 313.A N SER 311.A OG no hydrogen 3.040 N/A LYS 313.A NZ GLU 321.A OE1 no hydrogen 3.081 N/A THR 314.A N GLU 317.A OE1 no hydrogen 2.829 N/A GLU 317.A N THR 314.A OG1 no hydrogen 3.152 N/A LEU 318.A N THR 314.A O no hydrogen 3.046 N/A ARG 319.A N PRO 315.A O no hydrogen 3.104 N/A LYS 320.A N GLU 316.A O no hydrogen 2.996 N/A GLU 321.A N GLU 317.A O no hydrogen 2.870 N/A LEU 322.A N LEU 318.A O no hydrogen 2.739 N/A LEU 323.A N LEU 318.A O no hydrogen 3.294 N/A