Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3vgk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 1.A N GLU 19.A OE2 no hydrogen 3.308 N/A THR 2.A N VAL 17.A O no hydrogen 3.159 N/A THR 2.A OG1 ALA 57.A O no hydrogen 2.919 N/A THR 2.A OG1 ALA 305.A O no hydrogen 3.206 N/A ILE 3.A N ALA 57.A O no hydrogen 3.225 N/A GLY 4.A N GLY 15.A O no hydrogen 2.862 N/A VAL 5.A N GLY 59.A O no hydrogen 2.935 N/A ASP 6.A N ALA 13.A O no hydrogen 2.992 N/A GLY 8.A N LYS 11.A O no hydrogen 2.999 N/A ILE 12.A N VAL 29.A O no hydrogen 2.834 N/A ALA 13.A N ASP 6.A O no hydrogen 3.004 N/A ALA 14.A N PHE 27.A O no hydrogen 2.842 N/A GLY 15.A N GLY 4.A O no hydrogen 2.964 N/A VAL 16.A N SER 25.A O no hydrogen 3.109 N/A VAL 17.A N THR 2.A O no hydrogen 2.695 N/A ASP 18.A N ARG 22.A O no hydrogen 3.403 N/A GLU 20.A N ASP 18.A OD1 no hydrogen 3.160 N/A GLY 21.A N ASP 18.A O no hydrogen 2.796 N/A ARG 22.A N ASP 18.A OD1 no hydrogen 2.880 N/A ARG 22.A NE ASP 18.A OD2 no hydrogen 3.528 N/A LEU 24.A N VAL 16.A O no hydrogen 2.878 N/A SER 25.A OG ALA 49.A O no hydrogen 3.233 N/A PHE 27.A N ALA 14.A O no hydrogen 2.749 N/A VAL 29.A N ILE 12.A O no hydrogen 3.199 N/A THR 31.A N THR 10.A O no hydrogen 3.175 N/A THR 31.A OG1 GLY 8.A O no hydrogen 2.696 N/A THR 31.A OG1 GLY 9.A O no hydrogen 3.389 N/A ALA 41.A N GLY 37.A O no hydrogen 2.978 N/A ILE 42.A N ILE 38.A O no hydrogen 2.848 N/A CYS 43.A N VAL 39.A O no hydrogen 3.478 N/A CYS 43.A SG VAL 39.A O no hydrogen 3.525 N/A ALA 44.A N ASP 40.A O no hydrogen 2.698 N/A ALA 45.A N ALA 41.A O no hydrogen 2.929 N/A VAL 46.A N ILE 42.A O no hydrogen 2.859 N/A ALA 47.A N CYS 43.A O no hydrogen 2.856 N/A GLY 48.A N ALA 44.A O no hydrogen 3.290 N/A ALA 49.A N ALA 45.A O no hydrogen 3.017 N/A SER 50.A N VAL 46.A O no hydrogen 3.261 N/A SER 50.A N ALA 47.A O no hydrogen 3.090 N/A GLU 56.A N LEU 1.A O no hydrogen 3.023 N/A VAL 58.A N PRO 97.A O no hydrogen 2.947 N/A GLY 59.A N ILE 3.A O no hydrogen 3.162 N/A ILE 60.A N VAL 99.A O no hydrogen 2.933 N/A GLY 61.A N VAL 5.A O no hydrogen 3.001 N/A ALA 62.A N GLU 101.A O no hydrogen 2.844 N/A TYR 65.A N PHE 75.A O no hydrogen 2.793 N/A ASP 67.A N THR 72.A O no hydrogen 3.435 N/A ARG 70.A NE GLU 101.A OE2 no hydrogen 2.591 N/A ARG 70.A NH2 LEU 307.A O no hydrogen 2.669 N/A ALA 71.A N ASP 67.A OD1 no hydrogen 2.881 N/A VAL 73.A N GLU 84.A O no hydrogen 3.046 N/A LEU 74.A N TYR 65.A O no hydrogen 2.718 N/A TRP 81.A N ILE 79.A O no hydrogen 2.731 N/A ARG 82.A NH1 ILE 79.A O no hydrogen 3.546 N/A ARG 82.A NH1 TRP 81.A O no hydrogen 3.209 N/A HIS 83.A N LEU 74.A O no hydrogen 3.362 N/A GLU 84.A N VAL 73.A O no hydrogen 3.258 N/A LEU 86.A N GLU 84.A O no hydrogen 2.774 N/A LYS 87.A N ALA 71.A O no hydrogen 3.079 N/A LYS 87.A NZ GLU 91.A OE1 no hydrogen 3.275 N/A LYS 87.A NZ GLU 91.A OE2 no hydrogen 3.343 N/A LYS 89.A N PRO 85.A O no hydrogen 3.057 N/A LYS 89.A NZ GLU 36.A OE2 no hydrogen 2.802 N/A LYS 89.A NZ GLU 84.A OE2 no hydrogen 2.506 N/A VAL 90.A N LEU 86.A O no hydrogen 3.093 N/A GLU 91.A N LYS 87.A O no hydrogen 2.735 N/A GLN 92.A N ASP 88.A O no hydrogen 3.081 N/A ARG 93.A N VAL 90.A O no hydrogen 2.940 N/A ARG 93.A NH1 ASP 40.A OD1 no hydrogen 3.458 N/A ARG 93.A NH2 ASP 40.A OD1 no hydrogen 2.751 N/A VAL 94.A N VAL 90.A O no hydrogen 2.878 N/A GLY 95.A N GLU 91.A O no hydrogen 3.346 N/A VAL 98.A N GLU 91.A OE2 no hydrogen 3.325 N/A VAL 99.A N VAL 58.A O no hydrogen 3.109 N/A VAL 100.A N ARG 70.A O no hydrogen 2.979 N/A GLU 101.A N ILE 60.A O no hydrogen 2.884 N/A ASN 102.A ND2 GLY 64.A O no hydrogen 2.998 N/A ASN 102.A ND2 GLU 152.A OE2 no hydrogen 3.565 N/A ASP 103.A N ALA 62.A O no hydrogen 2.691 N/A ASN 105.A N ASN 102.A OD1 no hydrogen 3.285 N/A ALA 106.A N ASN 102.A O no hydrogen 3.069 N/A ALA 107.A N ASP 103.A O no hydrogen 3.433 N/A ALA 108.A N ALA 104.A O no hydrogen 2.904 N/A TRP 109.A N ASN 105.A O no hydrogen 2.882 N/A TRP 109.A NE1 ASP 306.A OD2 no hydrogen 3.120 N/A GLY 110.A N ALA 106.A O no hydrogen 2.633 N/A GLU 111.A N ALA 107.A O no hydrogen 3.072 N/A TYR 112.A N ALA 108.A O no hydrogen 2.863 N/A TYR 112.A OH HIS 120.A O no hydrogen 3.126 N/A ARG 113.A N TRP 109.A O no hydrogen 2.847 N/A ARG 113.A NH1 ARG 113.A O no hydrogen 2.872 N/A PHE 114.A N GLY 110.A O no hydrogen 3.120 N/A GLY 115.A N GLU 111.A O no hydrogen 2.852 N/A ALA 116.A N GLU 111.A OE1 no hydrogen 3.076 N/A GLY 117.A N GLU 111.A O no hydrogen 3.203 N/A HIS 120.A N GLY 117.A O no hydrogen 2.890 N/A VAL 123.A N ILE 137.A O no hydrogen 2.746 N/A ILE 124.A N ALA 253.A O no hydrogen 3.329 N/A CYS 125.A N GLY 135.A O no hydrogen 3.116 N/A CYS 125.A SG ALA 108.A O no hydrogen 3.459 N/A ILE 126.A N ILE 255.A O no hydrogen 3.101 N/A THR 127.A N GLY 133.A O no hydrogen 2.794 N/A THR 127.A OG1 GLY 133.A O no hydrogen 3.491 N/A LEU 128.A N GLY 257.A O no hydrogen 2.977 N/A GLY 129.A N GLY 131.A O no hydrogen 2.798 N/A GLY 133.A N THR 127.A O no hydrogen 3.298 N/A GLY 135.A N CYS 125.A O no hydrogen 3.231 N/A ILE 137.A N VAL 123.A O no hydrogen 2.758 N/A ASN 140.A N ASP 121.A O no hydrogen 3.067 N/A ARG 143.A N ILE 136.A O no hydrogen 2.801 N/A ARG 143.A NE ILE 138.A O no hydrogen 3.152 N/A ARG 143.A NH2 ILE 138.A O no hydrogen 2.986 N/A ARG 144.A NE GLU 101.A OE1 no hydrogen 2.750 N/A ARG 144.A NE GLU 101.A OE2 no hydrogen 2.796 N/A ARG 144.A NH2 GLU 101.A OE2 no hydrogen 2.863 N/A ARG 146.A NH1 ASP 68.A OD2 no hydrogen 3.194 N/A ARG 146.A NH1 ARG 146.A O no hydrogen 2.576 N/A ALA 150.A N ARG 144.A O no hydrogen 2.754 N/A HIS 155.A N GLU 152.A O no hydrogen 3.112 N/A ILE 156.A N PHE 153.A O no hydrogen 3.043 N/A VAL 158.A N GLY 171.A O no hydrogen 2.814 N/A VAL 159.A N GLY 171.A O no hydrogen 3.339 N/A LEU 163.A N TYR 176.A OH no hydrogen 3.075 N/A CYS 165.A N SER 169.A O no hydrogen 3.022 N/A CYS 165.A SG HIS 155.A ND1 no hydrogen 3.578 N/A CYS 165.A SG GLU 174.A OE1 no hydrogen 3.857 N/A CYS 167.A SG HIS 155.A ND1 no hydrogen 2.953 N/A GLY 168.A N CYS 165.A O no hydrogen 2.755 N/A GLY 171.A N LEU 163.A O no hydrogen 2.714 N/A CYS 172.A SG HIS 155.A ND1 no hydrogen 3.385 N/A CYS 172.A SG SER 169.A O no hydrogen 3.752 N/A TRP 173.A NE1 TRP 237.A O no hydrogen 3.104 N/A GLU 174.A N GLY 154.A O no hydrogen 2.748 N/A TYR 176.A N TRP 173.A O no hydrogen 2.994 N/A ALA 177.A N TRP 173.A O no hydrogen 2.910 N/A SER 178.A OG THR 130.A O no hydrogen 3.231 N/A SER 178.A OG GLU 174.A O no hydrogen 2.532 N/A GLY 179.A N GLY 129.A O no hydrogen 2.557 N/A ALA 181.A N SER 178.A OG no hydrogen 3.166 N/A LEU 182.A N SER 178.A O no hydrogen 2.707 N/A VAL 183.A N GLY 179.A O no hydrogen 2.927 N/A ARG 184.A N ARG 180.A O no hydrogen 3.203 N/A ARG 184.A NH1 GLN 175.A O no hydrogen 2.995 N/A ARG 184.A NH2 GLN 175.A O no hydrogen 2.865 N/A TYR 185.A N ALA 181.A O no hydrogen 3.039 N/A TYR 185.A OH TYR 176.A O no hydrogen 2.588 N/A ALA 186.A N LEU 182.A O no hydrogen 3.097 N/A LYS 187.A N VAL 183.A O no hydrogen 2.874 N/A GLN 188.A N ARG 184.A O no hydrogen 3.006 N/A ARG 189.A N TYR 185.A O no hydrogen 2.995 N/A ARG 189.A NE GLU 233.A OE2 no hydrogen 3.470 N/A ARG 189.A NH2 GLU 233.A OE2 no hydrogen 2.972 N/A ALA 190.A N ALA 186.A O no hydrogen 2.685 N/A ASN 191.A N LYS 187.A O no hydrogen 3.229 N/A ALA 192.A N GLN 188.A O no hydrogen 2.932 N/A THR 193.A N ARG 189.A O no hydrogen 2.929 N/A THR 193.A OG1 THR 193.A O no hydrogen 2.251 N/A THR 193.A OG1 ASN 196.A OD1 no hydrogen 3.177 N/A ASN 196.A N THR 193.A O no hydrogen 3.255 N/A ALA 197.A N PRO 194.A O no hydrogen 2.997 N/A VAL 199.A N ASP 224.A OD1 no hydrogen 3.282 N/A LEU 201.A N ALA 197.A O no hydrogen 3.281 N/A LEU 203.A N VAL 199.A O no hydrogen 3.281 N/A GLY 206.A N LEU 201.A O no hydrogen 2.981 N/A SER 207.A OG ASP 205.A OD1 no hydrogen 2.273 N/A SER 207.A OG ASP 205.A OD2 no hydrogen 2.900 N/A GLY 210.A N SER 207.A OG no hydrogen 3.015 N/A ILE 216.A N GLY 213.A O no hydrogen 2.823 N/A SER 217.A N GLY 213.A O no hydrogen 3.487 N/A SER 217.A OG LYS 214.A O no hydrogen 3.046 N/A GLU 218.A N LYS 214.A O no hydrogen 3.017 N/A ALA 219.A N HIS 215.A O no hydrogen 3.050 N/A ALA 220.A N ILE 216.A O no hydrogen 2.683 N/A ARG 221.A N SER 217.A O no hydrogen 3.435 N/A ARG 221.A NE GLU 263.A OE2 no hydrogen 2.942 N/A ARG 221.A NH2 GLU 263.A OE1 no hydrogen 2.535 N/A ARG 221.A NH2 GLU 263.A OE2 no hydrogen 3.433 N/A GLN 222.A N GLU 218.A O no hydrogen 3.290 N/A GLY 223.A N ALA 220.A O no hydrogen 2.660 N/A ASP 224.A N ALA 219.A O no hydrogen 3.007 N/A ALA 227.A N ASP 224.A OD2 no hydrogen 3.412 N/A VAL 228.A N ASP 224.A O no hydrogen 2.955 N/A ASP 229.A N PRO 225.A O no hydrogen 3.266 N/A SER 230.A N VAL 226.A O no hydrogen 2.816 N/A SER 230.A OG VAL 226.A O no hydrogen 3.009 N/A PHE 231.A N ALA 227.A O no hydrogen 3.412 N/A ARG 232.A N VAL 228.A O no hydrogen 3.302 N/A GLU 233.A N ASP 229.A O no hydrogen 3.249 N/A LEU 234.A N SER 230.A O no hydrogen 2.854 N/A ALA 235.A N PHE 231.A O no hydrogen 2.825 N/A ARG 236.A N ARG 232.A O no hydrogen 3.146 N/A ALA 238.A N LEU 234.A O no hydrogen 2.946 N/A GLY 239.A N ALA 235.A O no hydrogen 2.685 N/A ALA 240.A N ARG 236.A O no hydrogen 2.941 N/A GLY 241.A N TRP 237.A O no hydrogen 3.159 N/A LEU 242.A N ALA 238.A O no hydrogen 3.166 N/A ALA 243.A N GLY 239.A O no hydrogen 2.889 N/A ASP 244.A N GLY 241.A O no hydrogen 2.976 N/A LEU 245.A N GLY 241.A O no hydrogen 2.936 N/A ALA 246.A N LEU 242.A O no hydrogen 2.609 N/A SER 247.A N ASP 244.A O no hydrogen 3.002 N/A SER 247.A OG ALA 243.A O no hydrogen 3.452 N/A LEU 248.A N ASP 244.A O no hydrogen 3.069 N/A PHE 249.A N LEU 245.A O no hydrogen 2.922 N/A ASP 250.A N LEU 245.A O no hydrogen 3.442 N/A SER 252.A N ASP 122.A O no hydrogen 3.168 N/A SER 252.A OG HIS 120.A ND1 no hydrogen 2.694 N/A SER 252.A OG ASP 122.A O no hydrogen 3.340 N/A PHE 254.A N GLN 289.A O no hydrogen 2.863 N/A ILE 255.A N ILE 124.A O no hydrogen 3.261 N/A VAL 256.A N LEU 291.A O no hydrogen 3.024 N/A GLY 257.A N ILE 126.A O no hydrogen 3.221 N/A VAL 260.A N LEU 128.A O no hydrogen 3.284 N/A SER 261.A N GLY 258.A O no hydrogen 2.928 N/A SER 261.A OG GLY 257.A O no hydrogen 3.072 N/A ASP 262.A N GLY 258.A O no hydrogen 3.254 N/A ASP 262.A N GLY 259.A O no hydrogen 3.256 N/A GLY 264.A N SER 261.A O no hydrogen 2.704 N/A VAL 267.A N GLY 264.A O no hydrogen 3.058 N/A LEU 268.A N GLY 264.A O no hydrogen 3.161 N/A ASP 269.A N GLU 265.A O no hydrogen 2.917 N/A ARG 272.A N LEU 268.A O no hydrogen 2.831 N/A ARG 272.A NE VAL 290.A O no hydrogen 2.908 N/A ARG 272.A NH1 GLU 265.A OE1 no hydrogen 3.523 N/A ARG 272.A NH2 GLU 265.A OE1 no hydrogen 3.203 N/A ARG 272.A NH2 VAL 290.A O no hydrogen 3.051 N/A LYS 273.A N ASP 269.A O no hydrogen 2.764 N/A LYS 273.A NZ ASP 269.A OD2 no hydrogen 3.553 N/A SER 274.A N PRO 270.A O no hydrogen 2.865 N/A SER 274.A OG ALA 235.A O no hydrogen 3.256 N/A SER 274.A OG ARG 236.A O no hydrogen 3.502 N/A PHE 275.A N ILE 271.A O no hydrogen 2.726 N/A ARG 276.A N ARG 272.A O no hydrogen 3.220 N/A ARG 276.A NH1 HIS 287.A ND1 no hydrogen 3.374 N/A ARG 277.A N LYS 273.A O no hydrogen 3.208 N/A TRP 278.A N SER 274.A O no hydrogen 2.949 N/A GLU 283.A N GLU 283.A OE1 no hydrogen 2.556 N/A ARG 285.A NE PRO 286.A O no hydrogen 3.318 N/A ARG 285.A NH1 ILE 280.A O no hydrogen 2.981 N/A GLN 289.A N SER 252.A O no hydrogen 3.139 N/A LEU 291.A N PHE 254.A O no hydrogen 2.969 N/A GLN 294.A N GLU 111.A OE1 no hydrogen 3.232 N/A LEU 295.A N GLU 111.A OE2 no hydrogen 2.765 N/A VAL 302.A N LYS 298.A O no hydrogen 2.873 N/A GLY 303.A N ALA 299.A O no hydrogen 2.820 N/A ALA 304.A N GLY 300.A O no hydrogen 3.066 N/A ALA 305.A N LEU 301.A O no hydrogen 3.179 N/A ASP 306.A N VAL 302.A O no hydrogen 3.104 N/A LEU 307.A N GLY 303.A O no hydrogen 2.895 N/A ALA 308.A N ALA 304.A O no hydrogen 3.149 N/A ARG 309.A N ASP 306.A O no hydrogen 2.621 N/A GLN 310.A NE2 ASP 306.A O no hydrogen 2.614 N/A