Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3mwx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N GLU 20.A OE1 no hydrogen 3.506 N/A ALA 1.A N GLU 20.A OE2 no hydrogen 3.158 N/A ASN 2.A ND2 THR 115.A O no hydrogen 2.989 N/A PHE 3.A N GLY 18.A O no hydrogen 2.995 N/A GLU 5.A N LYS 16.A O no hydrogen 2.772 N/A ILE 7.A N ALA 14.A O no hydrogen 2.953 N/A TYR 9.A N THR 12.A O no hydrogen 2.774 N/A TYR 9.A OH GLU 48.A OE2 no hydrogen 2.699 N/A THR 12.A N TYR 9.A O no hydrogen 2.894 N/A ALA 14.A N ILE 7.A O no hydrogen 2.914 N/A ILE 15.A N VAL 25.A O no hydrogen 2.931 N/A LYS 16.A N GLU 5.A O no hydrogen 2.822 N/A GLY 18.A N PHE 3.A O no hydrogen 3.036 N/A ASN 19.A N LEU 22.A O no hydrogen 2.957 N/A ASN 19.A ND2 GLU 150.A O no hydrogen 2.914 N/A GLU 20.A N GLU 20.A OE1 no hydrogen 2.837 N/A HIS 21.A N ASN 19.A OD1 no hydrogen 2.832 N/A LEU 22.A N ASN 19.A OD1 no hydrogen 2.880 N/A GLU 23.A N VAL 37.A O no hydrogen 3.067 N/A VAL 25.A N ILE 15.A O no hydrogen 2.911 N/A VAL 26.A N ASN 32.A O no hydrogen 2.884 N/A TRP 29.A N VAL 26.A O no hydrogen 3.040 N/A GLY 30.A N GLU 105.A O no hydrogen 2.885 N/A SER 31.A N PRO 27.A O no hydrogen 3.174 N/A SER 31.A OG THR 123.A OG1 no hydrogen 2.700 N/A SER 31.A OG TYR 146.A OH no hydrogen 3.073 N/A ASN 32.A N TRP 29.A O no hydrogen 3.198 N/A ASN 32.A ND2 TYR 62.A O no hydrogen 2.971 N/A ILE 34.A N ILE 24.A O no hydrogen 2.925 N/A LEU 36.A N GLN 44.A OE1 no hydrogen 2.984 N/A VAL 37.A N GLU 23.A O no hydrogen 2.852 N/A ASP 38.A N VAL 43.A O no hydrogen 2.964 N/A LYS 39.A N HIS 21.A O no hydrogen 2.844 N/A THR 40.A OG1.B ASP 38.A OD1 no hydrogen 3.197 N/A THR 40.A OG1.B ASP 38.A OD2 no hydrogen 3.388 N/A THR 41.A OG1 ASP 38.A OD2 no hydrogen 2.505 N/A VAL 43.A N ASP 38.A O no hydrogen 3.238 N/A GLN 44.A NE2 SER 35.A OG no hydrogen 2.867 N/A LEU 45.A N LEU 36.A O no hydrogen 2.859 N/A LEU 46.A N GLN 44.A OE1 no hydrogen 2.962 N/A ARG 47.A N THR 175.A O no hydrogen 2.871 N/A ARG 47.A NH1 LEU 61.A O no hydrogen 2.902 N/A THR 51.A N SER 54.A OG.B no hydrogen 3.258 N/A THR 51.A OG1 SER 54.A OG.A no hydrogen 2.825 N/A SER 54.A N THR 51.A OG1 no hydrogen 2.929 N/A SER 54.A OG.A THR 51.A OG1 no hydrogen 2.825 N/A SER 54.A OG.B THR 51.A O no hydrogen 2.588 N/A SER 54.A OG.B THR 51.A OG1 no hydrogen 3.368 N/A SER 54.A OG.C TYR 62.A OH no hydrogen 2.775 N/A PHE 55.A N THR 51.A O no hydrogen 3.296 N/A HIS 56.A N ALA 52.A O no hydrogen 3.001 N/A HIS 56.A ND1 HIS 104.A NE2.A no hydrogen 2.621 N/A HIS 56.A ND1 HIS 104.A NE2.B no hydrogen 2.909 N/A ASP 57.A N GLU 53.A O no hydrogen 2.950 N/A THR 58.A N SER 54.A O no hydrogen 3.207 N/A THR 58.A OG1 THR 58.A O no hydrogen 2.639 N/A LEU 61.A N THR 58.A O no hydrogen 3.109 N/A TYR 62.A OH SER 54.A OG.C no hydrogen 2.775 N/A GLY 63.A N ARG 47.A O no hydrogen 2.965 N/A ILE 64.A N ASN 32.A OD1 no hydrogen 2.943 N/A LEU 67.A N GLY 171.A O no hydrogen 2.871 N/A ASN 71.A N HIS 99.A ND1 no hydrogen 2.971 N/A ASN 71.A ND2 TYR 279.A OH no hydrogen 2.929 N/A ARG 72.A N ASN 71.A OD1 no hydrogen 2.772 N/A ARG 72.A NE GLU 91.A OE1 no hydrogen 2.851 N/A ARG 72.A NE GLU 91.A OE2 no hydrogen 3.444 N/A ARG 72.A NH1 ASN 71.A OD1 no hydrogen 3.032 N/A ARG 72.A NH2 GLU 91.A OE2 no hydrogen 2.876 N/A ILE 73.A N HIS 97.A O no hydrogen 2.881 N/A SER 74.A N ASN 284.A OD1 no hydrogen 2.957 N/A SER 74.A OG.A ASN 284.A OD1 no hydrogen 3.341 N/A ASP 75.A N HIS 95.A O no hydrogen 2.920 N/A GLY 76.A N ILE 73.A O no hydrogen 2.971 N/A THR 77.A N SER 74.A O no hydrogen 2.954 N/A THR 77.A OG1.A ASP 75.A O no hydrogen 2.920 N/A THR 77.A OG1.A HIS 86.A ND1 no hydrogen 3.108 N/A THR 77.A OG1.B SER 74.A O no hydrogen 3.495 N/A PHE 78.A N TYR 85.A O no hydrogen 3.263 N/A SER 79.A OG.A THR 84.A OG1 no hydrogen 3.398 N/A PHE 80.A N ARG 83.A O no hydrogen 2.860 N/A ARG 81.A NH1 GLU 301.A OE2 no hydrogen 3.153 N/A ARG 81.A NH2 GLU 301.A OE2 no hydrogen 3.061 N/A ARG 83.A N PHE 80.A O no hydrogen 2.968 N/A THR 84.A OG1 SER 79.A OG.A no hydrogen 3.398 N/A TYR 85.A N PHE 78.A O no hydrogen 2.820 N/A TYR 85.A OH HIS 139.A NE2 no hydrogen 2.604 N/A HIS 86.A ND1 THR 77.A OG1.A no hydrogen 3.108 N/A PHE 87.A N GLY 76.A O no hydrogen 2.705 N/A ASP 88.A N GLN 136.A OE1 no hydrogen 2.810 N/A ASN 90.A ND2 LEU 98.A O no hydrogen 3.004 N/A GLU 91.A N ASN 96.A O no hydrogen 2.885 N/A HIS 95.A N LYS 92.A O no hydrogen 3.143 N/A HIS 95.A ND1 ASP 75.A OD1 no hydrogen 2.678 N/A ASN 96.A N GLU 91.A O no hydrogen 3.031 N/A ASN 96.A ND2 GLU 91.A OE1 no hydrogen 3.036 N/A ASN 96.A ND2 ARG 198.A O no hydrogen 3.202 N/A HIS 97.A N ILE 73.A O no hydrogen 3.015 N/A HIS 97.A ND1 ASP 88.A O no hydrogen 2.963 N/A LEU 98.A N ASN 90.A OD1 no hydrogen 2.787 N/A HIS 99.A N ASN 71.A O no hydrogen 2.926 N/A GLY 100.A N HIS 97.A NE2 no hydrogen 2.995 N/A PHE 101.A N PHE 68.A O no hydrogen 2.924 N/A HIS 104.A NE2.A HIS 56.A ND1 no hydrogen 2.621 N/A HIS 104.A NE2.B HIS 56.A ND1 no hydrogen 2.909 N/A TRP 107.A N PRO 27.A O no hydrogen 2.980 N/A TRP 107.A NE1 LEU 102.A O no hydrogen 3.107 N/A ASN 108.A N GLU 124.A O no hydrogen 2.811 N/A VAL 110.A N GLU 122.A O no hydrogen 2.836 N/A THR 111.A N GLU 122.A O no hydrogen 3.344 N/A THR 111.A OG1 GLU 122.A OE1 no hydrogen 2.622 N/A LYS 113.A N ILE 120.A O no hydrogen 2.941 N/A GLN 114.A NE2 ASN 2.A OD1 no hydrogen 2.755 N/A THR 115.A N GLY 118.A O no hydrogen 3.027 N/A GLU 117.A N THR 115.A OG1 no hydrogen 2.827 N/A GLY 118.A N THR 115.A OG1 no hydrogen 3.158 N/A VAL 119.A N ILE 148.A O no hydrogen 2.962 N/A ILE 120.A N LYS 113.A O no hydrogen 2.745 N/A VAL 121.A N TYR 146.A O no hydrogen 2.925 N/A GLU 122.A N THR 111.A O no hydrogen 2.941 N/A THR 123.A OG1 SER 31.A OG no hydrogen 2.700 N/A GLU 124.A N ASN 108.A O no hydrogen 2.816 N/A ILE 125.A N VAL 143.A O no hydrogen 2.937 N/A LEU 127.A N ALA 141.A O no hydrogen 2.889 N/A SER 128.A N ASP 126.A OD1 no hydrogen 2.866 N/A SER 128.A OG ASP 126.A OD1 no hydrogen 2.629 N/A GLU 129.A N ASP 126.A O no hydrogen 2.990 N/A LEU 130.A N LEU 127.A O no hydrogen 3.188 N/A HIS 132.A NE2 ASP 88.A OD2 no hydrogen 2.626 N/A GLN 134.A N LEU 130.A O no hydrogen 2.994 N/A GLN 134.A NE2 LEU 127.A O no hydrogen 2.992 N/A GLN 134.A NE2 HIS 139.A O no hydrogen 2.881 N/A LYS 135.A N PRO 131.A O no hydrogen 3.117 N/A LYS 135.A NZ HIS 132.A ND1 no hydrogen 3.248 N/A GLN 136.A N VAL 133.A O no hydrogen 2.966 N/A GLN 136.A NE2 HIS 132.A O no hydrogen 3.001 N/A PHE 137.A N VAL 133.A O no hydrogen 2.783 N/A HIS 139.A N PHE 137.A O no hydrogen 2.825 N/A HIS 139.A ND1 GLU 164.A OE2 no hydrogen 2.900 N/A HIS 139.A NE2 TYR 85.A OH no hydrogen 2.604 N/A HIS 140.A NE2 ASP 126.A OD2 no hydrogen 2.751 N/A VAL 143.A N ILE 125.A O no hydrogen 2.992 N/A ARG 144.A N THR 158.A O no hydrogen 2.834 N/A ARG 144.A NE GLU 124.A OE2 no hydrogen 2.727 N/A ARG 144.A NH1 GLU 122.A OE1 no hydrogen 2.967 N/A ARG 144.A NH2 GLU 124.A OE2 no hydrogen 2.915 N/A THR 145.A OG1 GLU 122.A OE2 no hydrogen 2.623 N/A TYR 146.A N VAL 121.A O no hydrogen 2.840 N/A TYR 146.A OH SER 31.A OG no hydrogen 3.073 N/A THR 147.A N PHE 154.A O no hydrogen 2.937 N/A ILE 148.A N VAL 119.A O no hydrogen 2.847 N/A LYS 149.A N THR 152.A O no hydrogen 3.049 N/A ASN 151.A ND2 ILE 314.A O no hydrogen 2.830 N/A THR 152.A N LYS 149.A O no hydrogen 3.061 N/A THR 152.A OG1 THR 313.A OG1 no hydrogen 2.734 N/A LEU 153.A N ILE 312.A O no hydrogen 2.824 N/A PHE 154.A N THR 147.A O no hydrogen 2.784 N/A LYS 155.A N SER 310.A O no hydrogen 2.886 N/A LYS 155.A NZ TYR 253.A OH no hydrogen 2.723 N/A LYS 155.A NZ SER 310.A OG no hydrogen 2.963 N/A HIS 156.A N THR 145.A O no hydrogen 2.909 N/A ALA 157.A N ALA 308.A O no hydrogen 2.919 N/A THR 158.A N ARG 144.A O no hydrogen 2.771 N/A THR 158.A OG1 THR 307.A OG1 no hydrogen 2.724 N/A VAL 159.A N THR 306.A O no hydrogen 2.868 N/A ASN 160.A ND2 GLU 164.A O no hydrogen 2.866 N/A ASN 160.A ND2 LEU 300.A O no hydrogen 2.916 N/A LYS 161.A N HIS 140.A O no hydrogen 2.864 N/A GLY 162.A N ASN 160.A OD1 no hydrogen 2.915 N/A PHE 166.A N LEU 300.A O no hydrogen 3.151 N/A TRP 168.A N GLN 298.A O no hydrogen 2.916 N/A ILE 170.A N THR 280.A OG1 no hydrogen 2.930 N/A GLY 171.A N LEU 67.A O no hydrogen 2.873 N/A TYR 172.A N PRO 278.A O no hydrogen 3.275 N/A HIS 173.A N PRO 65.A O no hydrogen 2.940 N/A HIS 173.A ND1 HIS 173.A O no hydrogen 2.820 N/A THR 174.A OG1 TYR 253.A OH no hydrogen 2.726 N/A THR 175.A N GLY 63.A O no hydrogen 2.890 N/A THR 175.A OG1 HIS 173.A O no hydrogen 2.772 N/A PHE 176.A N LEU 274.A O no hydrogen 2.959 N/A ILE 177.A N LEU 45.A O no hydrogen 2.968 N/A PHE 178.A N GLY 272.A O no hydrogen 2.887 N/A GLU 181.A N GLU 181.A OE1 no hydrogen 2.772 N/A SER 182.A N.A PRO 179.A O no hydrogen 3.047 N/A SER 182.A N.B PRO 179.A O no hydrogen 3.046 N/A SER 183.A N PRO 179.A O no hydrogen 2.892 N/A SER 183.A OG HIS 244.A ND1 no hydrogen 2.703 N/A LEU 184.A N TYR 243.A O no hydrogen 2.882 N/A SER 186.A N VAL 241.A O no hydrogen 2.876 N/A LEU 187.A N LEU 213.A O no hydrogen 2.986 N/A THR 188.A N GLN 239.A O no hydrogen 3.094 N/A THR 188.A OG1 GLN 239.A O no hydrogen 3.346 N/A ALA 189.A N LEU 187.A O no hydrogen 3.013 N/A GLN 192.A NE2 ASP 225.A OD2 no hydrogen 2.943 N/A TRP 193.A N VAL 226.A O no hydrogen 2.871 N/A TRP 193.A NE1 HIS 261.A ND1 no hydrogen 3.067 N/A GLU 194.A N LYS 204.A O no hydrogen 2.980 N/A ASP 196.A N LEU 200.A O no hydrogen 2.878 N/A ARG 198.A N ASP 196.A OD1 no hydrogen 2.824 N/A ARG 198.A NE LYS 94.A O no hydrogen 3.025 N/A ARG 198.A NH2 ASP 75.A OD1 no hydrogen 2.997 N/A ARG 198.A NH2 LYS 94.A O no hydrogen 3.088 N/A ARG 198.A NH2 HIS 95.A O no hydrogen 2.927 N/A LEU 199.A N ASP 196.A O no hydrogen 2.980 N/A LEU 200.A N ASP 196.A OD1 no hydrogen 3.048 N/A THR 202.A N GLU 194.A O no hydrogen 2.975 N/A THR 202.A OG1 GLU 194.A O no hydrogen 3.556 N/A THR 202.A OG1 GLU 194.A OE1 no hydrogen 2.694 N/A LYS 204.A N THR 202.A OG1 no hydrogen 3.205 N/A VAL 207.A N ASP 190.A O no hydrogen 3.064 N/A LYS 210.A N VAL 207.A O no hydrogen 3.013 N/A LYS 210.A NZ ASP 206.A OD1 no hydrogen 2.854 N/A LEU 213.A N TYR 209.A O no hydrogen 2.960 N/A HIS 214.A N LYS 210.A O no hydrogen 2.931 N/A HIS 214.A NE2 ALA 189.A O no hydrogen 2.810 N/A GLU 215.A N GLU 211.A O no hydrogen 3.040 N/A GLY 216.A N ALA 212.A O no hydrogen 2.963 N/A ARG 219.A N ASP 217.A OD1 no hydrogen 2.890 N/A ARG 219.A NE ASP 217.A OD1 no hydrogen 3.126 N/A ARG 219.A NE ASP 217.A OD2 no hydrogen 3.258 N/A ARG 219.A NH2 ASP 217.A OD2 no hydrogen 2.995 N/A LYS 221.A N LEU 218.A O no hydrogen 3.017 N/A GLN 222.A NE2.B ASP 268.A O no hydrogen 3.186 N/A LEU 223.A N ASN 266.A OD1 no hydrogen 2.765 N/A ASP 224.A N ASP 225.A OD1 no hydrogen 2.826 N/A ASP 225.A N VAL 264.A O no hydrogen 3.124 N/A PHE 227.A N TRP 262.A O no hydrogen 2.740 N/A LEU 228.A N GLN 191.A O no hydrogen 2.984 N/A SER 229.A N LYS 260.A O no hydrogen 2.863 N/A SER 229.A OG.A ASN 238.A OD1 no hydrogen 2.643 N/A SER 229.A OG.B ASN 238.A OD1 no hydrogen 3.200 N/A SER 229.A OG.B PHE 259.A O no hydrogen 3.004 N/A SER 230.A N THR 188.A O no hydrogen 3.057 N/A TYR 231.A N SER 229.A OG.A no hydrogen 3.189 N/A GLN 232.A NE2 SER 293.A O no hydrogen 2.913 N/A LYS 233.A N SER 230.A O no hydrogen 3.101 N/A ARG 234.A N SER 230.A O no hydrogen 2.828 N/A GLY 235.A N TYR 231.A O no hydrogen 2.713 N/A ASN 238.A ND2 ALA 255.A O no hydrogen 3.077 N/A ASN 238.A ND2 ASP 256.A O no hydrogen 2.985 N/A ASN 238.A ND2 PHE 259.A O no hydrogen 2.934 N/A GLN 239.A N THR 188.A OG1 no hydrogen 2.929 N/A ALA 240.A N TYR 253.A O no hydrogen 2.919 N/A VAL 241.A N SER 186.A O no hydrogen 2.873 N/A ILE 242.A N ILE 251.A O no hydrogen 2.969 N/A TYR 243.A N LEU 184.A O no hydrogen 2.853 N/A HIS 244.A N ILE 249.A O no hydrogen 2.818 N/A HIS 244.A ND1 SER 183.A OG no hydrogen 2.703 N/A GLN 245.A N SER 182.A O.A no hydrogen 3.122 N/A GLN 245.A NE2 SER 182.A O.B no hydrogen 2.571 N/A ILE 249.A N HIS 244.A O no hydrogen 3.263 N/A SER 250.A N GLU 315.A O no hydrogen 2.836 N/A ILE 251.A N ILE 242.A O no hydrogen 2.803 N/A ILE 252.A N THR 313.A O no hydrogen 2.807 N/A TYR 253.A N ALA 240.A O no hydrogen 2.816 N/A TYR 253.A OH THR 174.A OG1 no hydrogen 2.726 N/A LYS 254.A N SER 311.A O no hydrogen 2.865 N/A LYS 254.A NZ.A GLN 239.A OE1 no hydrogen 2.595 N/A ALA 255.A N ASN 238.A O no hydrogen 2.982 N/A ASP 256.A N LYS 309.A O no hydrogen 2.872 N/A GLU 257.A N GLU 257.A OE1 no hydrogen 2.825 N/A GLN 258.A N ASP 256.A OD1 no hydrogen 2.905 N/A GLN 258.A NE2 THR 306.A OG1.A no hydrogen 3.360 N/A PHE 259.A N ASP 256.A O no hydrogen 2.989 N/A LYS 260.A NZ GLU 257.A O no hydrogen 2.890 N/A HIS 261.A N TYR 279.A O no hydrogen 3.276 N/A TRP 262.A N PHE 227.A O no hydrogen 2.898 N/A TRP 262.A NE1 ASN 238.A OD1 no hydrogen 2.945 N/A VAL 263.A N GLU 277.A O no hydrogen 2.864 N/A VAL 264.A N ASP 225.A O no hydrogen 3.016 N/A TYR 265.A N CYS 275.A O no hydrogen 2.978 N/A ASN 266.A N LEU 223.A O no hydrogen 3.112 N/A ASN 266.A ND2 LYS 221.A O no hydrogen 2.940 N/A GLY 269.A N ASN 266.A O no hydrogen 2.840 N/A LYS 270.A N ASP 268.A OD1 no hydrogen 3.009 N/A GLN 271.A NE2 ASP 268.A OD1 no hydrogen 2.773 N/A GLN 271.A NE2 ASP 268.A OD2 no hydrogen 3.276 N/A LEU 274.A N PHE 176.A O no hydrogen 2.937 N/A CYS 275.A N TYR 265.A O no hydrogen 2.872 N/A CYS 275.A SG HIS 173.A ND1 no hydrogen 3.678 N/A CYS 275.A SG THR 175.A OG1 no hydrogen 3.469 N/A GLU 277.A N VAL 263.A O no hydrogen 2.712 N/A TYR 279.A N HIS 261.A O no hydrogen 2.850 N/A TYR 279.A OH GLU 277.A OE1 no hydrogen 2.690 N/A THR 280.A N ILE 170.A O no hydrogen 2.852 N/A THR 280.A OG1 ILE 170.A O no hydrogen 3.414 N/A VAL 282.A N THR 295.A O no hydrogen 2.872 N/A ASN 284.A ND2 SER 74.A OG.A no hydrogen 3.270 N/A ASN 287.A N ASN 284.A O no hydrogen 2.844 N/A ASN 287.A ND2 THR 77.A O no hydrogen 2.935 N/A ASN 287.A ND2 ASN 284.A OD1 no hydrogen 2.950 N/A LEU 288.A N ALA 285.A O no hydrogen 3.177 N/A LEU 294.A N PRO 291.A O no hydrogen 2.992 N/A THR 295.A N PRO 291.A O no hydrogen 3.001 N/A GLY 296.A N SER 292.A O no hydrogen 2.851 N/A LEU 297.A N THR 295.A OG1 no hydrogen 3.170 N/A GLN 298.A NE2 GLN 258.A OE1 no hydrogen 2.841 N/A LEU 300.A N PHE 166.A O no hydrogen 2.905 N/A GLU 301.A N GLU 304.A OE1 no hydrogen 2.840 N/A GLY 303.A N ASN 160.A O no hydrogen 2.833 N/A GLU 304.A N GLU 301.A O no hydrogen 3.005 N/A THR 306.A N VAL 159.A O no hydrogen 2.981 N/A THR 307.A OG1 THR 158.A OG1 no hydrogen 2.724 N/A ALA 308.A N ALA 157.A O no hydrogen 2.790 N/A LYS 309.A N ASP 256.A OD2 no hydrogen 2.799 N/A LYS 309.A NZ ASP 256.A OD2 no hydrogen 2.821 N/A SER 310.A N LYS 155.A O no hydrogen 3.149 N/A SER 310.A OG LYS 155.A O no hydrogen 2.999 N/A SER 311.A N LYS 254.A O no hydrogen 2.863 N/A ILE 312.A N LEU 153.A O no hydrogen 2.785 N/A THR 313.A N ILE 252.A O no hydrogen 2.876 N/A THR 313.A OG1 THR 152.A OG1 no hydrogen 2.734 N/A ILE 314.A N ASN 151.A O no hydrogen 2.966 N/A GLU 315.A N SER 250.A O no hydrogen 2.862 N/A ASN 317.A N HIS 248.A O no hydrogen 2.710 N/A