Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3vnt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 2.A N LYS 156.A O no hydrogen 3.139 N/A HIS 5.A N LEU 2.A O no hydrogen 3.456 N/A CYS 6.A SG ASP 3.A O no hydrogen 3.290 N/A CYS 6.A SG SER 73.A O no hydrogen 4.022 N/A GLU 7.A N GLU 7.A OE1 no hydrogen 2.797 N/A LEU 9.A N CYS 6.A O no hydrogen 3.089 N/A TYR 11.A OH GLU 17.A OE1 no hydrogen 2.582 N/A SER 14.A OG ASP 12.A OD1 no hydrogen 2.680 N/A LYS 15.A N ASP 12.A O no hydrogen 3.074 N/A TRP 16.A N ASP 12.A O no hydrogen 3.081 N/A GLU 17.A N ALA 13.A O no hydrogen 2.953 N/A PHE 18.A N ALA 93.A O no hydrogen 2.802 N/A ARG 20.A NH1 PRO 100.A O no hydrogen 2.878 N/A ARG 20.A NH2 LYS 96.A O no hydrogen 2.823 N/A ARG 20.A NH2 PRO 100.A O no hydrogen 2.924 N/A ARG 22.A N PRO 19.A O no hydrogen 3.002 N/A LEU 23.A N ARG 20.A O no hydrogen 3.114 N/A LYS 24.A N ASP 41.A O no hydrogen 2.849 N/A GLY 26.A N GLU 39.A O no hydrogen 2.685 N/A LEU 29.A N VAL 37.A O no hydrogen 2.678 N/A GLY 30.A N VAL 37.A O no hydrogen 3.281 N/A ARG 31.A NE GLN 36.A OE1 no hydrogen 3.043 N/A ARG 31.A NH1 GLN 36.A OE1 no hydrogen 3.414 N/A GLY 32.A N GLY 35.A O no hydrogen 2.795 N/A GLN 36.A N MET 58.A O no hydrogen 2.888 N/A GLN 36.A NE2 LEU 59.A O no hydrogen 3.097 N/A VAL 37.A N GLY 30.A O no hydrogen 2.864 N/A ILE 38.A N VAL 56.A O no hydrogen 2.784 N/A GLU 39.A N LYS 27.A O no hydrogen 2.906 N/A ALA 40.A N VAL 54.A O no hydrogen 2.913 N/A ASP 41.A N LYS 24.A O no hydrogen 2.856 N/A ALA 42.A N ARG 52.A O no hydrogen 2.828 N/A PHE 43.A N ARG 22.A O no hydrogen 2.839 N/A GLY 44.A N THR 50.A O no hydrogen 2.823 N/A THR 50.A N LYS 47.A O no hydrogen 3.170 N/A THR 50.A OG1 THR 48.A O no hydrogen 3.004 N/A ARG 52.A N ALA 42.A O no hydrogen 2.943 N/A VAL 54.A N ALA 40.A O no hydrogen 2.862 N/A ALA 55.A N VAL 105.A O no hydrogen 2.933 N/A VAL 56.A N ILE 38.A O no hydrogen 2.810 N/A LYS 57.A N VAL 103.A O no hydrogen 2.907 N/A LYS 57.A NZ GLU 74.A OE1 no hydrogen 3.168 N/A LYS 57.A NZ GLU 74.A OE2 no hydrogen 2.746 N/A LYS 57.A NZ ASP 179.A O no hydrogen 2.880 N/A LYS 57.A NZ PHE 180.A O no hydrogen 3.220 N/A MET 58.A N GLN 36.A O no hydrogen 2.990 N/A LYS 60.A N PHE 34.A O no hydrogen 2.923 N/A LYS 60.A NZ GLY 32.A O no hydrogen 3.543 N/A LYS 60.A NZ ALA 33.A O no hydrogen 2.986 N/A LYS 60.A NZ GLU 61.A O no hydrogen 3.021 N/A ALA 63.A N LYS 60.A O no hydrogen 3.025 N/A THR 64.A N GLU 67.A OE1 no hydrogen 2.747 N/A THR 64.A OG1 GLU 67.A OE1 no hydrogen 2.722 N/A SER 66.A N THR 64.A OG1 no hydrogen 3.230 N/A HIS 68.A N THR 64.A O no hydrogen 3.185 N/A ARG 69.A N HIS 65.A O no hydrogen 2.926 N/A ALA 70.A N SER 66.A O no hydrogen 3.055 N/A LEU 71.A N GLU 67.A O no hydrogen 2.899 N/A MET 72.A N HIS 68.A O no hydrogen 3.041 N/A SER 73.A N ARG 69.A O no hydrogen 2.951 N/A SER 73.A OG ARG 69.A O no hydrogen 3.486 N/A GLU 74.A N ALA 70.A O no hydrogen 2.940 N/A LEU 75.A N LEU 71.A O no hydrogen 2.999 N/A LYS 76.A N MET 72.A O no hydrogen 2.996 N/A ILE 77.A N SER 73.A O no hydrogen 2.963 N/A LEU 78.A N GLU 74.A O no hydrogen 2.951 N/A ILE 79.A N LEU 75.A O no hydrogen 3.084 N/A HIS 80.A N LYS 76.A O no hydrogen 3.046 N/A HIS 80.A NE2 ARG 155.A O no hydrogen 3.175 N/A ILE 81.A N ILE 77.A O no hydrogen 2.856 N/A GLY 82.A N LEU 78.A O no hydrogen 3.323 N/A HIS 84.A N ASN 89.A OD1 no hydrogen 3.122 N/A ASN 86.A N HIS 84.A ND1 no hydrogen 2.892 N/A ASN 86.A ND2 GLN 144.A OE1 no hydrogen 2.920 N/A ASN 86.A ND2 VAL 175.A O no hydrogen 2.943 N/A VAL 87.A N HIS 84.A O no hydrogen 3.296 N/A VAL 88.A N ILE 177.A O no hydrogen 2.960 N/A ASN 89.A N GLU 106.A OE1.A no hydrogen 2.839 N/A ASN 89.A ND2 HIS 84.A O no hydrogen 2.913 N/A ASN 89.A ND2 GLU 106.A OE1.A no hydrogen 3.178 N/A ASN 89.A ND2 GLU 106.A OE1.B no hydrogen 2.844 N/A ASN 89.A ND2 GLU 106.A OE2.A no hydrogen 3.386 N/A LEU 91.A N ILE 104.A O no hydrogen 2.778 N/A GLY 92.A N ILE 104.A O no hydrogen 3.225 N/A ALA 93.A N TRP 16.A O no hydrogen 2.941 N/A CYS 94.A N MET 102.A O no hydrogen 2.888 N/A CYS 94.A SG PHE 18.A O no hydrogen 3.335 N/A THR 95.A N GLU 17.A OE2 no hydrogen 2.737 N/A THR 95.A OG1 GLU 17.A OE1 no hydrogen 2.607 N/A THR 95.A OG1 GLU 17.A OE2 no hydrogen 3.472 N/A LYS 96.A N GLU 17.A OE2 no hydrogen 3.269 N/A MET 102.A N CYS 94.A O no hydrogen 2.945 N/A VAL 103.A N LYS 57.A O no hydrogen 2.997 N/A ILE 104.A N GLY 92.A O no hydrogen 2.866 N/A VAL 105.A N ALA 55.A O no hydrogen 2.903 N/A GLU 106.A N ASN 89.A O no hydrogen 3.011 N/A CYS 108.A SG SER 170.A OG.A no hydrogen 3.180 N/A PHE 110.A N LEU 169.A O no hydrogen 2.865 N/A GLY 111.A N CYS 108.A O no hydrogen 3.165 N/A ASN 112.A ND2 THR 115.A OG1 no hydrogen 2.742 N/A LEU 113.A N ILE 167.A O no hydrogen 2.765 N/A SER 114.A OG GLY 235.A O no hydrogen 3.568 N/A THR 115.A N ASN 112.A OD1 no hydrogen 2.953 N/A TYR 116.A N ASN 112.A O no hydrogen 3.105 N/A LEU 117.A N LEU 113.A O no hydrogen 2.826 N/A ARG 118.A N SER 114.A O no hydrogen 3.038 N/A ARG 118.A NE GLY 235.A O no hydrogen 2.952 N/A ARG 118.A NH1 SER 114.A OG no hydrogen 2.741 N/A SER 119.A N THR 115.A O no hydrogen 3.142 N/A SER 119.A N TYR 116.A O no hydrogen 2.969 N/A SER 119.A OG TYR 116.A O no hydrogen 2.652 N/A LYS 120.A N LEU 117.A O no hydrogen 2.999 N/A LYS 120.A NZ GLU 123.A OE1 no hydrogen 2.818 N/A LYS 120.A NZ ASP 131.A O no hydrogen 2.777 N/A ARG 121.A NE LEU 234.A O no hydrogen 2.927 N/A ARG 121.A NH1 LEU 234.A O no hydrogen 3.141 N/A GLU 123.A N LYS 120.A O no hydrogen 2.830 N/A VAL 125.A N LEU 133.A O no hydrogen 2.985 N/A LYS 128.A NZ LYS 130.A O no hydrogen 3.376 N/A LYS 128.A NZ PHE 132.A O no hydrogen 3.545 N/A PHE 132.A N TYR 129.A O no hydrogen 3.083 N/A LEU 133.A N GLU 123.A O no hydrogen 2.845 N/A THR 134.A N HIS 137.A ND1 no hydrogen 3.171 N/A THR 134.A OG1 HIS 137.A ND1 no hydrogen 2.846 N/A LEU 135.A N PRO 126.A O no hydrogen 2.964 N/A HIS 137.A ND1 THR 134.A OG1 no hydrogen 2.846 N/A LEU 138.A N THR 134.A O no hydrogen 3.204 N/A ILE 139.A N LEU 135.A O no hydrogen 2.924 N/A CYS 140.A N GLU 136.A O no hydrogen 2.855 N/A TYR 141.A N HIS 137.A O no hydrogen 2.852 N/A SER 142.A N LEU 138.A O no hydrogen 3.129 N/A SER 142.A OG LEU 138.A O no hydrogen 2.845 N/A PHE 143.A N ILE 139.A O no hydrogen 2.874 N/A GLN 144.A N CYS 140.A O no hydrogen 2.931 N/A GLN 144.A NE2 CYS 140.A O no hydrogen 3.674 N/A GLN 144.A NE2 ASN 173.A O no hydrogen 2.796 N/A VAL 145.A N TYR 141.A O no hydrogen 2.978 N/A ALA 146.A N SER 142.A O no hydrogen 2.970 N/A LYS 147.A N PHE 143.A O no hydrogen 2.894 N/A GLY 148.A N GLN 144.A O no hydrogen 2.910 N/A MET 149.A N VAL 145.A O no hydrogen 2.866 N/A GLU 150.A N ALA 146.A O no hydrogen 2.841 N/A PHE 151.A N LYS 147.A O no hydrogen 2.994 N/A LEU 152.A N GLY 148.A O no hydrogen 2.899 N/A ALA 153.A N MET 149.A O no hydrogen 2.893 N/A SER 154.A N GLU 150.A O no hydrogen 3.024 N/A SER 154.A OG PHE 151.A O no hydrogen 2.612 N/A ARG 155.A N PHE 151.A O no hydrogen 3.220 N/A ARG 155.A N LEU 152.A O no hydrogen 2.933 N/A ARG 155.A NE ILE 81.A O no hydrogen 3.015 N/A ARG 155.A NH1 HIS 80.A O no hydrogen 2.789 N/A LYS 156.A N ALA 153.A O no hydrogen 2.994 N/A CYS 157.A N.A LEU 152.A O no hydrogen 3.181 N/A CYS 157.A N.B LEU 152.A O no hydrogen 3.153 N/A CYS 157.A SG.A ARG 155.A O no hydrogen 3.664 N/A CYS 157.A SG.B ASP 3.A OD2 no hydrogen 3.754 N/A CYS 157.A SG.B ILE 158.A O no hydrogen 3.655 N/A ILE 158.A N ASP 3.A OD2 no hydrogen 2.927 N/A HIS 159.A N ASP 220.A OD2 no hydrogen 2.776 N/A HIS 159.A NE2 CYS 178.A O no hydrogen 2.732 N/A ARG 160.A N ASP 220.A OD1 no hydrogen 3.083 N/A ARG 160.A NH1 ASP 3.A OD2 no hydrogen 3.117 N/A ARG 160.A NH2 ASP 3.A OD1 no hydrogen 3.346 N/A ASP 161.A N HIS 159.A ND1 no hydrogen 3.016 N/A ALA 164.A N GLU 230.A OE1 no hydrogen 2.889 N/A ARG 165.A NE TYR 192.A OH no hydrogen 2.881 N/A ARG 165.A NH1 ASP 161.A OD1 no hydrogen 2.913 N/A ARG 165.A NH1 TYR 192.A OH no hydrogen 3.485 N/A ASN 166.A N ALA 163.A O no hydrogen 2.859 N/A ASN 166.A ND2 ASP 161.A O no hydrogen 2.795 N/A ILE 167.A N ALA 164.A O no hydrogen 3.083 N/A LEU 168.A N LYS 176.A O no hydrogen 2.802 N/A LEU 169.A N GLY 111.A O no hydrogen 2.871 N/A SER 170.A N VAL 174.A O no hydrogen 2.774 N/A VAL 174.A N GLU 171.A O no hydrogen 3.301 N/A VAL 175.A N GLN 144.A OE1 no hydrogen 2.934 N/A LYS 176.A N LEU 168.A O no hydrogen 2.787 N/A LYS 176.A NZ LEU 85.A O no hydrogen 2.748 N/A LYS 176.A NZ GLU 106.A OE1.A no hydrogen 2.976 N/A LYS 176.A NZ GLU 106.A OE1.B no hydrogen 2.705 N/A LYS 176.A NZ GLU 106.A OE2.B no hydrogen 3.386 N/A ILE 177.A N ASN 86.A O no hydrogen 2.827 N/A CYS 178.A N ASN 166.A O no hydrogen 2.834 N/A CYS 178.A SG ASN 166.A O no hydrogen 3.537 N/A CYS 178.A SG ASN 166.A OD1 no hydrogen 4.038 N/A PHE 180.A N ASN 166.A OD1 no hydrogen 3.342 N/A ALA 183.A N PHE 180.A O no hydrogen 3.047 N/A ARG 184.A N GLY 181.A O no hydrogen 3.153 N/A ARG 184.A NH1 ASN 166.A OD1 no hydrogen 3.242 N/A ARG 184.A NH2 ASN 166.A OD1 no hydrogen 2.924 N/A LYS 188.A N ASP 185.A OD1 no hydrogen 3.368 N/A ASP 189.A N ASP 185.A O no hydrogen 2.935 N/A ASP 191.A N ASP 189.A OD1 no hydrogen 2.982 N/A TYR 192.A N ASP 189.A O no hydrogen 3.127 N/A TYR 192.A OH ASP 161.A OD1 no hydrogen 3.333 N/A TYR 192.A OH ASP 161.A OD2 no hydrogen 2.559 N/A VAL 193.A N LEU 200.A O no hydrogen 2.821 N/A ARG 194.A NE GLY 196.A O no hydrogen 3.242 N/A LYS 195.A N ALA 198.A O no hydrogen 2.830 N/A ALA 198.A N LYS 195.A O no hydrogen 3.357 N/A LEU 200.A N VAL 193.A O no hydrogen 2.921 N/A LEU 202.A N LEU 200.A O no hydrogen 2.850 N/A LYS 203.A NZ SER 237.A OG no hydrogen 2.867 N/A LYS 203.A NZ PRO 238.A O no hydrogen 3.050 N/A TRP 204.A N PRO 201.A O no hydrogen 2.920 N/A TRP 204.A NE1 GLU 230.A OE1 no hydrogen 2.819 N/A MET 205.A N LEU 202.A O no hydrogen 3.131 N/A GLU 208.A N GLU 208.A OE1 no hydrogen 2.798 N/A THR 209.A N ALA 206.A O no hydrogen 2.911 N/A THR 209.A OG1 VAL 214.A O no hydrogen 2.798 N/A ILE 210.A N ALA 206.A O no hydrogen 3.015 N/A PHE 211.A N PRO 207.A O no hydrogen 2.849 N/A ASP 212.A N GLU 208.A O no hydrogen 2.918 N/A ARG 213.A N THR 209.A O no hydrogen 2.985 N/A VAL 214.A N GLU 208.A O no hydrogen 3.247 N/A THR 216.A N SER 219.A OG no hydrogen 2.854 N/A GLN 218.A N.A THR 216.A OG1 no hydrogen 3.067 N/A GLN 218.A NE2.A PRO 280.A O no hydrogen 3.501 N/A GLN 218.A NE2.A PRO 284.A O no hydrogen 3.002 N/A SER 219.A N THR 216.A OG1 no hydrogen 3.198 N/A SER 219.A OG THR 216.A O no hydrogen 2.774 N/A ASP 220.A N THR 216.A O no hydrogen 3.136 N/A VAL 221.A N ILE 217.A O no hydrogen 3.041 N/A TRP 222.A N GLN 218.A O.A no hydrogen 3.396 N/A TRP 222.A N GLN 218.A O.B no hydrogen 3.243 N/A SER 223.A N SER 219.A O no hydrogen 3.109 N/A SER 223.A OG TRP 204.A O no hydrogen 2.665 N/A SER 223.A OG SER 219.A O no hydrogen 3.403 N/A PHE 224.A N ASP 220.A O no hydrogen 2.782 N/A GLY 225.A N VAL 221.A O no hydrogen 2.977 N/A VAL 226.A N TRP 222.A O no hydrogen 3.201 N/A LEU 227.A N SER 223.A O no hydrogen 2.860 N/A LEU 228.A N PHE 224.A O no hydrogen 2.846 N/A TRP 229.A N GLY 225.A O no hydrogen 3.138 N/A TRP 229.A NE1 ARG 259.A O no hydrogen 2.987 N/A GLU 230.A N VAL 226.A O no hydrogen 2.940 N/A ILE 231.A N LEU 227.A O no hydrogen 2.823 N/A PHE 232.A N LEU 228.A O no hydrogen 2.915 N/A SER 233.A N GLU 230.A O no hydrogen 3.425 N/A SER 233.A OG TRP 229.A O no hydrogen 2.979 N/A SER 233.A OG GLU 230.A O no hydrogen 2.997 N/A LEU 234.A N ILE 231.A O no hydrogen 2.991 N/A GLY 235.A N GLU 230.A O no hydrogen 2.764 N/A ALA 236.A N SER 233.A OG no hydrogen 3.031 N/A VAL 242.A N TYR 239.A O no hydrogen 3.090 N/A ASP 245.A N LYS 243.A O no hydrogen 3.178 N/A PHE 248.A N ASP 245.A OD1 no hydrogen 2.964 N/A CYS 249.A N ASP 245.A O no hydrogen 3.192 N/A CYS 249.A SG ASP 245.A O no hydrogen 3.408 N/A ARG 250.A N GLU 246.A O no hydrogen 2.997 N/A ARG 250.A NE GLU 254.A OE2 no hydrogen 2.904 N/A ARG 251.A N GLU 247.A O no hydrogen 3.025 N/A ARG 251.A NH1 GLU 247.A OE1 no hydrogen 2.916 N/A LEU 252.A N PHE 248.A O no hydrogen 3.052 N/A LYS 253.A N CYS 249.A O no hydrogen 3.032 N/A GLU 254.A N ARG 250.A O no hydrogen 2.804 N/A GLY 255.A N ARG 251.A O no hydrogen 2.992 N/A GLY 255.A N LEU 252.A O no hydrogen 3.055 N/A THR 256.A N ARG 251.A O no hydrogen 2.931 N/A THR 256.A OG1 ARG 251.A O no hydrogen 3.270 N/A ARG 257.A NE TRP 276.A O no hydrogen 2.928 N/A ARG 257.A NH1 LEU 252.A O no hydrogen 2.886 N/A ARG 257.A NH1 THR 256.A O no hydrogen 3.001 N/A ARG 257.A NH2 TRP 276.A O no hydrogen 2.771 N/A TYR 263.A N PHE 232.A O no hydrogen 2.934 N/A THR 264.A N PRO 261.A O no hydrogen 3.379 N/A THR 264.A OG1 THR 265.A O no hydrogen 2.859 N/A MET 268.A N.A THR 265.A OG1 no hydrogen 3.155 N/A MET 268.A N.B THR 265.A OG1 no hydrogen 3.142 N/A TYR 269.A N THR 265.A O no hydrogen 3.071 N/A TYR 269.A OH MET 258.A O no hydrogen 2.618 N/A GLN 270.A N PRO 266.A O no hydrogen 3.043 N/A GLN 270.A NE2 ASP 274.A OD1 no hydrogen 2.929 N/A THR 271.A N GLU 267.A O no hydrogen 2.971 N/A THR 271.A OG1 GLU 267.A O no hydrogen 2.969 N/A MET 272.A N MET 268.A O.A no hydrogen 3.030 N/A MET 272.A N MET 268.A O.B no hydrogen 3.041 N/A LEU 273.A N TYR 269.A O no hydrogen 3.032 N/A ASP 274.A N GLN 270.A O no hydrogen 2.889 N/A CYS 275.A N THR 271.A O no hydrogen 3.008 N/A CYS 275.A SG THR 271.A O no hydrogen 3.421 N/A TRP 276.A N MET 272.A O no hydrogen 3.027 N/A TRP 276.A N LEU 273.A O no hydrogen 3.112 N/A HIS 277.A N ASP 274.A O no hydrogen 3.313 N/A GLU 279.A N HIS 277.A ND1 no hydrogen 3.032 N/A GLN 282.A N GLU 279.A O no hydrogen 2.913 N/A ARG 283.A N PRO 280.A O no hydrogen 3.146 N/A ARG 283.A NE HIS 277.A O no hydrogen 2.777 N/A ARG 283.A NH1 GLU 208.A OE2 no hydrogen 2.800 N/A ARG 283.A NH1 GLN 218.A O.A no hydrogen 2.777 N/A ARG 283.A NH1 GLN 218.A O.B no hydrogen 3.130 N/A ARG 283.A NH2 GLU 208.A OE1 no hydrogen 2.981 N/A ARG 283.A NH2 HIS 277.A O no hydrogen 3.124 N/A THR 285.A N GLU 288.A OE1 no hydrogen 3.006 N/A SER 287.A OG GLU 150.A OE2 no hydrogen 2.693 N/A GLU 288.A N THR 285.A OG1 no hydrogen 3.113 N/A LEU 289.A N THR 285.A O no hydrogen 2.921 N/A VAL 290.A N PHE 286.A O no hydrogen 2.849 N/A GLU 291.A N SER 287.A O no hydrogen 3.182 N/A HIS 292.A N GLU 288.A O no hydrogen 2.945 N/A LEU 293.A N LEU 289.A O no hydrogen 2.795 N/A GLY 294.A N VAL 290.A O no hydrogen 2.928 N/A ASN 295.A N GLU 291.A O no hydrogen 3.056 N/A LEU 296.A N HIS 292.A O no hydrogen 2.941 N/A LEU 297.A N LEU 293.A O no hydrogen 2.874 N/A GLN 298.A N GLY 294.A O no hydrogen 3.119 N/A ALA 299.A N ASN 295.A O no hydrogen 2.853 N/A ASN 300.A N LEU 296.A O no hydrogen 2.903 N/A ALA 301.A N LEU 297.A O no hydrogen 3.277 N/A