Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1vll_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N ILE 317.A O no hydrogen 2.683 N/A THR 3.A OG1 PRO 95.A O no hydrogen 2.881 N/A LEU 4.A N LEU 96.A O no hydrogen 2.847 N/A ILE 5.A N SER 315.A O no hydrogen 2.728 N/A LEU 6.A N VAL 98.A O no hydrogen 3.339 N/A THR 7.A N GLU 10.A OE1 no hydrogen 2.636 N/A GLN 8.A NE2 GLU 12.A OE2 no hydrogen 3.521 N/A VAL 11.A N THR 7.A O no hydrogen 2.933 N/A GLU 12.A N GLN 8.A O no hydrogen 2.871 N/A SER 13.A N GLU 10.A O no hydrogen 3.073 N/A SER 13.A OG GLU 10.A O no hydrogen 2.768 N/A LEU 14.A N VAL 11.A O no hydrogen 2.875 N/A SER 16.A N GLU 19.A OE1 no hydrogen 2.634 N/A SER 16.A OG GLU 19.A OE1 no hydrogen 2.856 N/A GLU 19.A N SER 16.A OG no hydrogen 3.233 N/A ALA 20.A N SER 16.A O no hydrogen 3.005 N/A MET 21.A N MET 17.A O no hydrogen 2.789 N/A ASN 22.A N ASP 18.A O no hydrogen 3.038 N/A ASN 22.A ND2 ASP 18.A O no hydrogen 3.317 N/A ALA 23.A N GLU 19.A O no hydrogen 2.835 N/A VAL 24.A N ALA 20.A O no hydrogen 2.816 N/A GLU 25.A N MET 21.A O no hydrogen 2.814 N/A GLU 26.A N ASN 22.A O no hydrogen 2.986 N/A ALA 27.A N ALA 23.A O no hydrogen 2.836 N/A PHE 28.A N VAL 24.A O no hydrogen 2.826 N/A ARG 29.A N GLU 25.A O no hydrogen 3.033 N/A LEU 30.A N GLU 26.A O no hydrogen 2.828 N/A TYR 31.A N ALA 27.A O no hydrogen 3.084 N/A ALA 32.A N PHE 28.A O no hydrogen 2.999 N/A LEU 33.A N ARG 29.A O no hydrogen 3.025 N/A LEU 33.A N LEU 30.A O no hydrogen 3.169 N/A GLY 34.A N TYR 31.A O no hydrogen 3.213 N/A LYS 35.A N LEU 30.A O no hydrogen 2.827 N/A GLN 37.A N HIS 57.A O no hydrogen 2.653 N/A GLN 37.A NE2 HIS 57.A ND1 no hydrogen 2.929 N/A VAL 42.A N ALA 53.A O no hydrogen 2.971 N/A LEU 44.A N LEU 51.A O no hydrogen 2.877 N/A PHE 46.A N GLY 49.A O no hydrogen 2.908 N/A GLY 49.A N PHE 46.A O no hydrogen 3.478 N/A ASP 50.A N SER 69.A O no hydrogen 3.088 N/A LEU 51.A N LEU 44.A O no hydrogen 2.973 N/A ARG 52.A N VAL 67.A O no hydrogen 2.833 N/A ALA 53.A N VAL 42.A O no hydrogen 2.657 N/A MET 54.A N LYS 65.A O no hydrogen 2.768 N/A ALA 56.A N GLY 63.A O no hydrogen 3.000 N/A HIS 57.A N GLN 37.A O no hydrogen 2.736 N/A LEU 58.A N TYR 61.A O no hydrogen 3.021 N/A TYR 61.A N LEU 58.A O no hydrogen 2.912 N/A TYR 61.A OH GLU 306.A OE2 no hydrogen 2.729 N/A ALA 62.A N ASN 88.A O no hydrogen 3.031 N/A GLY 63.A N ALA 56.A O no hydrogen 2.998 N/A LEU 64.A N ILE 86.A O no hydrogen 2.858 N/A LYS 65.A N MET 54.A O no hydrogen 2.936 N/A LYS 65.A NZ THR 105.A OG1 no hydrogen 2.806 N/A LYS 65.A NZ ASP 297.A OD2 no hydrogen 3.447 N/A TRP 66.A N LEU 84.A O no hydrogen 2.871 N/A VAL 67.A N ARG 52.A O no hydrogen 3.173 N/A ASN 68.A N MET 82.A O no hydrogen 2.973 N/A ASN 68.A ND2 HIS 70.A ND1 no hydrogen 2.975 N/A ASN 68.A ND2 THR 80.A O no hydrogen 3.457 N/A SER 69.A N ASP 50.A O no hydrogen 2.927 N/A HIS 70.A N THR 80.A O no hydrogen 2.964 N/A ASN 73.A N HIS 70.A O no hydrogen 3.126 N/A ASN 73.A ND2 PRO 79.A O no hydrogen 2.763 N/A LYS 76.A N ASN 73.A O no hydrogen 2.681 N/A GLY 77.A N PRO 74.A O no hydrogen 2.767 N/A LEU 78.A N ASN 73.A O no hydrogen 3.026 N/A MET 82.A N ASN 68.A OD1 no hydrogen 2.539 N/A LEU 84.A N TRP 66.A O no hydrogen 2.941 N/A MET 85.A N MET 99.A O no hydrogen 2.910 N/A ILE 86.A N LEU 64.A O no hydrogen 2.832 N/A LEU 87.A N ALA 97.A O no hydrogen 2.839 N/A ASN 88.A N ALA 62.A O no hydrogen 2.602 N/A ASN 88.A ND2 GLY 93.A O no hydrogen 3.054 N/A SER 89.A N PHE 94.A O no hydrogen 2.998 N/A SER 89.A OG THR 92.A OG1 no hydrogen 3.303 N/A GLU 91.A N SER 89.A OG no hydrogen 3.312 N/A THR 92.A OG1 SER 89.A OG no hydrogen 3.303 N/A GLY 93.A N SER 89.A O no hydrogen 2.821 N/A PHE 94.A N THR 92.A OG1 no hydrogen 2.969 N/A ALA 97.A N LEU 87.A O no hydrogen 3.188 N/A VAL 98.A N LEU 4.A O no hydrogen 2.912 N/A MET 99.A N MET 85.A O no hydrogen 2.976 N/A ASP 100.A N LEU 6.A O no hydrogen 3.130 N/A ALA 101.A N ALA 83.A O no hydrogen 2.791 N/A THR 102.A N ASP 100.A OD1 no hydrogen 2.859 N/A THR 102.A OG1 ASP 100.A OD1 no hydrogen 2.595 N/A TYR 103.A N ASP 100.A OD2 no hydrogen 3.184 N/A THR 104.A OG1 ALA 101.A O no hydrogen 3.253 N/A THR 105.A N ALA 101.A O no hydrogen 2.933 N/A THR 105.A OG1 ALA 101.A O no hydrogen 2.407 N/A SER 106.A N THR 102.A O no hydrogen 3.482 N/A LEU 107.A N TYR 103.A O no hydrogen 2.891 N/A ARG 108.A N THR 104.A O no hydrogen 2.826 N/A ARG 108.A NE ASP 297.A OD1 no hydrogen 2.884 N/A ARG 108.A NH2 ASP 297.A OD1 no hydrogen 3.469 N/A ARG 108.A NH2 ASP 297.A OD2 no hydrogen 2.818 N/A THR 109.A N THR 105.A O no hydrogen 3.070 N/A THR 109.A OG1 THR 105.A O no hydrogen 2.875 N/A GLY 110.A N SER 106.A O no hydrogen 3.229 N/A ALA 111.A N LEU 107.A O no hydrogen 2.937 N/A ALA 112.A N ARG 108.A O no hydrogen 3.078 N/A GLY 113.A N THR 109.A O no hydrogen 3.086 N/A GLY 114.A N GLY 110.A O no hydrogen 2.919 N/A ILE 115.A N ALA 111.A O no hydrogen 2.860 N/A ALA 116.A N ALA 112.A O no hydrogen 2.931 N/A ALA 117.A N GLY 113.A O no hydrogen 2.891 N/A LYS 118.A N GLY 114.A O no hydrogen 2.736 N/A LYS 118.A NZ GLU 25.A OE2 no hydrogen 3.145 N/A TYR 119.A N ILE 115.A O no hydrogen 3.016 N/A TYR 119.A N ALA 116.A O no hydrogen 3.233 N/A TYR 119.A OH GLU 25.A OE2 no hydrogen 2.554 N/A LEU 120.A N ALA 117.A O no hydrogen 3.266 N/A ALA 121.A N ALA 117.A O no hydrogen 2.982 N/A ARG 122.A NE GLY 210.A O no hydrogen 2.959 N/A ARG 122.A NH1 ASN 124.A OD1 no hydrogen 3.232 N/A SER 125.A N ARG 122.A O no hydrogen 3.100 N/A SER 125.A OG ARG 122.A O no hydrogen 2.659 N/A SER 126.A N ASP 189.A OD2 no hydrogen 2.511 N/A VAL 127.A N ASP 189.A OD2 no hydrogen 2.977 N/A PHE 128.A N GLU 152.A O no hydrogen 2.906 N/A GLY 129.A N VAL 190.A O no hydrogen 2.736 N/A PHE 130.A N LYS 154.A O no hydrogen 2.735 N/A ILE 131.A N VAL 192.A O no hydrogen 2.832 N/A GLY 132.A N TYR 156.A O no hydrogen 2.913 N/A CYS 133.A N ASP 157.A OD2 no hydrogen 3.014 N/A CYS 133.A SG TYR 156.A O no hydrogen 3.469 N/A GLN 136.A NE2 SER 106.A O no hydrogen 3.266 N/A ALA 137.A N GLY 134.A O no hydrogen 2.874 N/A TYR 138.A N THR 135.A O no hydrogen 3.144 N/A PHE 139.A N THR 135.A O no hydrogen 3.401 N/A GLN 140.A N GLN 136.A O no hydrogen 2.803 N/A LEU 141.A N ALA 137.A O no hydrogen 2.940 N/A GLU 142.A N TYR 138.A O no hydrogen 2.756 N/A ALA 143.A N PHE 139.A O no hydrogen 2.869 N/A LEU 144.A N GLN 140.A O no hydrogen 2.781 N/A ARG 145.A N LEU 141.A O no hydrogen 2.812 N/A ARG 145.A NE GLU 142.A OE2 no hydrogen 2.564 N/A ARG 145.A NH2 GLU 142.A OE2 no hydrogen 2.770 N/A ARG 146.A N ALA 143.A O no hydrogen 2.946 N/A ARG 146.A NE ASP 18.A OD1 no hydrogen 2.588 N/A ARG 146.A NH2 ASP 18.A OD2 no hydrogen 2.828 N/A VAL 147.A N LEU 144.A O no hydrogen 3.036 N/A PHE 148.A N LEU 144.A O no hydrogen 3.141 N/A GLU 152.A N SER 126.A O no hydrogen 3.225 N/A VAL 153.A N SER 176.A O no hydrogen 2.984 N/A LYS 154.A N PHE 128.A O no hydrogen 2.716 N/A LYS 154.A NZ GLU 184.A O no hydrogen 2.748 N/A LYS 154.A NZ GLU 184.A OE2 no hydrogen 2.555 N/A LYS 154.A NZ ARG 187.A O no hydrogen 2.522 N/A ALA 155.A N SER 178.A O no hydrogen 3.160 N/A TYR 156.A N PHE 130.A O no hydrogen 2.932 N/A ARG 159.A N ASP 157.A OD1 no hydrogen 2.625 N/A ALA 163.A N ARG 159.A O no hydrogen 3.345 N/A LYS 164.A N GLU 160.A O no hydrogen 3.107 N/A LYS 165.A N LYS 161.A O no hydrogen 2.793 N/A PHE 166.A N ALA 162.A O no hydrogen 3.032 N/A VAL 167.A N ALA 163.A O no hydrogen 2.935 N/A SER 168.A N LYS 164.A O no hydrogen 2.856 N/A TYR 169.A N LYS 165.A O no hydrogen 3.066 N/A TYR 169.A OH GLU 142.A OE1 no hydrogen 2.462 N/A CYS 170.A N PHE 166.A O no hydrogen 3.060 N/A CYS 170.A SG PHE 166.A O no hydrogen 3.635 N/A GLU 171.A N VAL 167.A O no hydrogen 2.902 N/A ASP 172.A N SER 168.A O no hydrogen 2.974 N/A ARG 173.A N CYS 170.A O no hydrogen 2.998 N/A ARG 173.A NH1 TYR 169.A O no hydrogen 3.005 N/A GLY 174.A N GLU 171.A O no hydrogen 3.281 N/A SER 178.A N VAL 153.A O no hydrogen 3.163 N/A SER 178.A OG VAL 153.A O no hydrogen 3.471 N/A GLN 180.A N ALA 155.A O no hydrogen 3.070 N/A GLN 180.A NE2 SER 178.A OG no hydrogen 3.042 N/A ALA 185.A N PRO 181.A O no hydrogen 2.957 N/A SER 186.A N ALA 182.A O no hydrogen 2.997 N/A SER 186.A OG ALA 182.A O no hydrogen 2.907 N/A ARG 187.A N GLU 184.A O no hydrogen 3.113 N/A CYS 188.A SG ALA 185.A O no hydrogen 3.665 N/A CYS 188.A SG SER 186.A O no hydrogen 3.811 N/A CYS 188.A SG VAL 190.A O no hydrogen 3.158 N/A ASP 189.A N VAL 127.A O no hydrogen 2.971 N/A VAL 190.A N VAL 127.A O no hydrogen 3.307 N/A LEU 191.A N HIS 212.A O no hydrogen 2.704 N/A VAL 192.A N GLY 129.A O no hydrogen 2.579 N/A THR 193.A N ASN 214.A O no hydrogen 3.094 N/A THR 193.A OG1 GLU 225.A OE1 no hydrogen 3.005 N/A THR 194.A N ILE 131.A O no hydrogen 2.996 N/A THR 195.A OG1 GLU 225.A OE2 no hydrogen 2.837 N/A SER 197.A OG LYS 199.A O no hydrogen 2.440 N/A VAL 202.A N GLU 225.A O no hydrogen 2.915 N/A ALA 204.A N ASP 227.A OD2 no hydrogen 3.162 N/A TRP 206.A N LYS 203.A O no hydrogen 3.096 N/A VAL 207.A N ALA 204.A O no hydrogen 3.352 N/A THR 211.A N GLU 208.A O no hydrogen 3.414 N/A THR 211.A OG1 CYS 188.A O no hydrogen 3.019 N/A THR 211.A OG1 GLU 208.A O no hydrogen 2.692 N/A HIS 212.A N ASP 189.A O no hydrogen 2.838 N/A HIS 212.A ND1 THR 286.A OG1 no hydrogen 2.655 N/A HIS 212.A NE2 ASN 214.A OD1 no hydrogen 2.413 N/A ILE 213.A N THR 286.A O no hydrogen 2.716 N/A ASN 214.A N LEU 191.A O no hydrogen 2.832 N/A ASN 214.A ND2 GLY 113.A O no hydrogen 3.051 N/A ASN 214.A ND2 GLN 140.A OE1 no hydrogen 3.437 N/A ALA 215.A N PHE 288.A O no hydrogen 2.879 N/A ILE 216.A N THR 193.A O no hydrogen 2.899 N/A GLY 217.A N THR 193.A O no hydrogen 3.095 N/A GLY 220.A N GLY 247.A O no hydrogen 2.960 N/A GLY 222.A N ASN 251.A OD1 no hydrogen 2.881 N/A LYS 223.A N GLY 220.A O no hydrogen 3.152 N/A GLN 224.A N SER 197.A O no hydrogen 3.143 N/A GLU 225.A N GLU 249.A OE2 no hydrogen 2.627 N/A LEU 226.A N GLU 249.A OE2 no hydrogen 2.649 N/A ASP 227.A N VAL 202.A O no hydrogen 3.109 N/A GLU 229.A N ASP 227.A OD1 no hydrogen 2.831 N/A ILE 230.A N ASP 227.A O no hydrogen 2.681 N/A LYS 232.A N VAL 228.A O no hydrogen 3.204 N/A LYS 233.A N ILE 230.A O no hydrogen 2.965 N/A LYS 235.A N ILE 285.A O no hydrogen 3.016 N/A LYS 235.A NZ GLY 278.A O no hydrogen 3.122 N/A LYS 235.A NZ GLU 284.A OE1 no hydrogen 3.172 N/A LYS 235.A NZ GLU 284.A OE2 no hydrogen 2.933 N/A VAL 237.A N ILE 287.A O no hydrogen 2.891 N/A VAL 238.A N ALA 266.A O no hydrogen 2.962 N/A ASP 239.A N ASP 289.A O no hydrogen 2.986 N/A GLN 243.A N ASP 240.A OD1 no hydrogen 3.015 N/A GLN 243.A NE2 THR 291.A OG1 no hydrogen 2.821 N/A GLN 243.A NE2 GLY 292.A O no hydrogen 2.799 N/A ALA 244.A N ASP 240.A O no hydrogen 3.070 N/A LYS 245.A N LEU 241.A O no hydrogen 2.927 N/A HIS 246.A N GLU 242.A O no hydrogen 2.949 N/A GLY 247.A N GLN 243.A O no hydrogen 2.841 N/A GLY 248.A N GLN 243.A O no hydrogen 3.219 N/A GLU 249.A N ASP 289.A OD1 no hydrogen 2.638 N/A ILE 250.A N ASP 289.A OD2 no hydrogen 2.965 N/A ASN 251.A N GLY 248.A O no hydrogen 3.045 N/A ASN 251.A ND2 LYS 223.A O no hydrogen 2.784 N/A ASN 251.A ND2 GLY 248.A O no hydrogen 2.875 N/A VAL 254.A N ILE 250.A O no hydrogen 2.887 N/A SER 255.A N ASN 251.A O no hydrogen 3.161 N/A LYS 256.A N VAL 252.A O no hydrogen 2.864 N/A GLY 257.A N VAL 254.A O no hydrogen 3.052 N/A VAL 258.A N ALA 253.A O no hydrogen 2.646 N/A ILE 259.A N ALA 253.A O no hydrogen 3.274 N/A GLY 260.A N ASP 263.A OD2 no hydrogen 2.749 N/A GLU 262.A N GLU 262.A OE1 no hydrogen 2.761 N/A ASP 263.A N GLY 260.A O no hydrogen 3.124 N/A VAL 264.A N VAL 261.A O no hydrogen 2.966 N/A HIS 265.A N ILE 236.A O no hydrogen 2.701 N/A HIS 265.A NE2 ASP 277.A O no hydrogen 2.777 N/A THR 267.A N GLU 270.A OE1 no hydrogen 2.752 N/A THR 267.A OG1 GLU 270.A OE1 no hydrogen 3.172 N/A ILE 268.A N VAL 238.A O no hydrogen 2.905 N/A GLU 270.A N THR 267.A OG1 no hydrogen 3.218 N/A VAL 271.A N THR 267.A O no hydrogen 3.111 N/A ILE 272.A N ILE 268.A O no hydrogen 2.754 N/A ALA 273.A N GLY 269.A O no hydrogen 2.809 N/A GLY 274.A N VAL 271.A O no hydrogen 3.173 N/A LEU 275.A N GLU 270.A O no hydrogen 2.903 N/A ARG 279.A NE LEU 120.A O no hydrogen 2.720 N/A ARG 279.A NH1 SER 281.A O no hydrogen 2.955 N/A ARG 279.A NH1 GLU 284.A O no hydrogen 2.671 N/A ARG 279.A NH2 GLU 284.A O no hydrogen 3.029 N/A ARG 279.A NH2 THR 286.A OG1 no hydrogen 3.128 N/A GLU 280.A N GLU 284.A OE2 no hydrogen 2.728 N/A GLU 283.A N GLU 283.A OE1 no hydrogen 2.912 N/A THR 286.A N THR 211.A O no hydrogen 3.225 N/A THR 286.A OG1 LEU 120.A O no hydrogen 3.471 N/A THR 286.A OG1 HIS 212.A ND1 no hydrogen 2.655 N/A ILE 287.A N LYS 235.A O no hydrogen 3.083 N/A PHE 288.A N ILE 213.A O no hydrogen 2.753 N/A ASP 289.A N VAL 237.A O no hydrogen 2.797 N/A SER 290.A N ALA 215.A O no hydrogen 3.228 N/A SER 290.A OG ASP 239.A OD1 no hydrogen 3.505 N/A THR 291.A OG1 ASP 239.A OD2 no hydrogen 2.820 N/A GLY 292.A N ASP 239.A OD2 no hydrogen 2.487 N/A LEU 293.A N GLN 296.A OE1 no hydrogen 2.550 N/A GLN 296.A N LEU 293.A O no hydrogen 2.951 N/A VAL 298.A N ALA 294.A O no hydrogen 2.809 N/A ALA 299.A N ILE 295.A O no hydrogen 2.809 N/A VAL 300.A N GLN 296.A O no hydrogen 3.084 N/A ALA 301.A N ASP 297.A O no hydrogen 2.971 N/A LYS 302.A N VAL 298.A O no hydrogen 3.009 N/A LYS 302.A NZ MET 59.A O no hydrogen 3.268 N/A VAL 304.A N VAL 300.A O no hydrogen 2.914 N/A TYR 305.A N ALA 301.A O no hydrogen 2.700 N/A GLU 306.A N LYS 302.A O no hydrogen 2.997 N/A ASN 307.A N VAL 303.A O no hydrogen 3.079 N/A ASN 307.A ND2 LEU 14.A O no hydrogen 2.974 N/A ASN 307.A ND2 GLU 19.A OE2 no hydrogen 2.936 N/A ALA 308.A N VAL 304.A O no hydrogen 2.802 N/A LEU 309.A N TYR 305.A O no hydrogen 2.979 N/A SER 310.A N GLU 306.A O no hydrogen 3.042 N/A LYS 311.A N ASN 307.A O no hydrogen 2.770 N/A ASN 312.A N LEU 309.A O no hydrogen 3.426 N/A VAL 313.A N ALA 308.A O no hydrogen 2.961 N/A SER 315.A N ILE 5.A O no hydrogen 2.976 N/A ILE 317.A N THR 3.A O no hydrogen 2.772 N/A