Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1vci_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 1.A N GLU 146.A OE1 no hydrogen 2.621 N/A VAL 7.A N ILE 29.A O no hydrogen 2.964 N/A LYS 8.A N TYR 64.A O no hydrogen 3.029 N/A LEU 9.A N LEU 27.A O no hydrogen 2.683 N/A GLU 10.A N ARG 62.A O no hydrogen 2.873 N/A LEU 12.A N LEU 25.A O no hydrogen 2.893 N/A THR 13.A N GLU 60.A O no hydrogen 2.933 N/A LYS 14.A N VAL 22.A O no hydrogen 2.898 N/A LYS 14.A NZ GLU 57.A O no hydrogen 2.691 N/A ARG 15.A N THR 59.A OG1 no hydrogen 3.160 N/A PHE 19.A N PHE 16.A O no hydrogen 3.226 N/A ALA 21.A N LYS 14.A O no hydrogen 2.748 N/A VAL 22.A N LYS 14.A O no hydrogen 3.104 N/A ASN 23.A N GLY 205.A O no hydrogen 2.963 N/A LYS 24.A N THR 13.A OG1 no hydrogen 3.062 N/A LEU 25.A N LEU 12.A O no hydrogen 2.669 N/A LEU 27.A N LEU 9.A O no hydrogen 2.939 N/A ILE 29.A N VAL 7.A O no hydrogen 2.705 N/A LYS 30.A N GLU 33.A OE1 no hydrogen 2.928 N/A GLY 32.A N THR 181.A OG1 no hydrogen 2.745 N/A GLU 33.A N LYS 30.A O no hydrogen 2.903 N/A PHE 34.A N ASP 197.A OD2 no hydrogen 2.660 N/A LEU 35.A N THR 182.A O no hydrogen 2.864 N/A VAL 36.A N ARG 198.A O no hydrogen 3.118 N/A LEU 37.A N TYR 184.A O no hydrogen 2.672 N/A LEU 38.A N ALA 200.A O no hydrogen 3.063 N/A CYS 43.A N PRO 40.A O no hydrogen 3.247 N/A CYS 43.A SG PRO 40.A O no hydrogen 3.198 N/A LYS 45.A NZ GLY 39.A O no hydrogen 3.057 N/A LYS 45.A NZ PRO 40.A O no hydrogen 3.237 N/A THR 46.A OG1 ASP 153.A OD2 no hydrogen 3.409 N/A THR 48.A N GLY 44.A O no hydrogen 2.976 N/A THR 48.A OG1 GLY 44.A O no hydrogen 2.786 N/A LEU 49.A N LYS 45.A O no hydrogen 3.115 N/A ARG 50.A N THR 46.A O no hydrogen 2.987 N/A ARG 50.A NE GLU 56.A OE2 no hydrogen 3.210 N/A MET 51.A N THR 47.A O no hydrogen 3.182 N/A ILE 52.A N THR 48.A O no hydrogen 3.229 N/A ALA 53.A N LEU 49.A O no hydrogen 3.004 N/A GLY 54.A N ARG 50.A O no hydrogen 2.896 N/A GLY 54.A N MET 51.A O no hydrogen 3.225 N/A LEU 55.A N ARG 50.A O no hydrogen 3.129 N/A THR 59.A N THR 13.A O no hydrogen 2.793 N/A GLU 60.A N THR 13.A O no hydrogen 3.202 N/A ARG 62.A N GLU 10.A O no hydrogen 3.060 N/A ARG 62.A NH1 ASP 69.A OD2 no hydrogen 2.573 N/A ILE 63.A N THR 71.A OG1 no hydrogen 2.691 N/A TYR 64.A N LYS 8.A O no hydrogen 2.864 N/A PHE 65.A N ARG 68.A O no hydrogen 2.913 N/A GLY 66.A N GLU 6.A O no hydrogen 2.773 N/A ARG 68.A N PHE 65.A O no hydrogen 3.039 N/A ARG 68.A NH1 ASP 77.A O no hydrogen 3.263 N/A VAL 70.A N ILE 63.A O no hydrogen 2.939 N/A THR 71.A N ASP 69.A OD1 no hydrogen 2.998 N/A THR 71.A OG1 ILE 63.A O no hydrogen 3.486 N/A THR 71.A OG1 ASP 69.A OD1 no hydrogen 2.619 N/A LEU 73.A N VAL 70.A O no hydrogen 3.085 N/A ASP 77.A N PRO 74.A O no hydrogen 2.767 N/A ARG 78.A N PRO 75.A O no hydrogen 3.473 N/A ARG 78.A NE LEU 73.A O no hydrogen 3.079 N/A ARG 78.A NH1 MET 51.A O no hydrogen 2.890 N/A ARG 78.A NH1 ILE 52.A O no hydrogen 2.928 N/A ARG 78.A NH2 LEU 73.A O no hydrogen 3.259 N/A SER 81.A OG ALA 142.A O no hydrogen 3.050 N/A THR 88.A OG1 LEU 122.A O no hydrogen 3.052 N/A THR 88.A OG1 ARG 124.A O no hydrogen 2.755 N/A VAL 89.A N ARG 124.A O no hydrogen 2.928 N/A TYR 90.A N LEU 122.A O no hydrogen 2.951 N/A TYR 90.A OH ASP 106.A OD1 no hydrogen 2.806 N/A ASN 92.A N THR 88.A O no hydrogen 2.592 N/A ILE 93.A N VAL 89.A O no hydrogen 2.859 N/A ALA 94.A N TYR 90.A O no hydrogen 2.901 N/A ALA 94.A N GLU 91.A O no hydrogen 3.171 N/A PHE 95.A N GLU 91.A O no hydrogen 2.784 N/A LEU 97.A N ALA 94.A O no hydrogen 2.579 N/A GLU 104.A N PRO 101.A O no hydrogen 2.951 N/A ILE 105.A N PRO 101.A O no hydrogen 2.808 N/A ASP 106.A N LYS 102.A O no hydrogen 2.912 N/A ARG 108.A N GLU 104.A O no hydrogen 3.052 N/A ARG 108.A NE VAL 144.A O no hydrogen 3.160 N/A ARG 108.A NH2 VAL 144.A O no hydrogen 3.562 N/A ARG 108.A NH2 VAL 145.A O no hydrogen 3.130 N/A VAL 109.A N ILE 105.A O no hydrogen 2.805 N/A ARG 110.A N ASP 106.A O no hydrogen 3.035 N/A ARG 110.A NE ASP 106.A OD1 no hydrogen 3.484 N/A ARG 110.A NE ASP 106.A OD2 no hydrogen 2.847 N/A TRP 111.A N LYS 107.A O no hydrogen 2.983 N/A ALA 112.A N ARG 108.A O no hydrogen 2.758 N/A ALA 113.A N VAL 109.A O no hydrogen 2.833 N/A GLU 114.A N ARG 110.A O no hydrogen 3.043 N/A LEU 115.A N TRP 111.A O no hydrogen 3.103 N/A LEU 116.A N ALA 112.A O no hydrogen 2.984 N/A GLN 117.A N GLU 114.A O no hydrogen 3.133 N/A ILE 118.A N ALA 113.A O no hydrogen 2.726 N/A GLU 119.A N GLU 119.A OE1 no hydrogen 2.462 N/A LEU 121.A N ILE 118.A O no hydrogen 2.934 N/A LEU 122.A N GLU 119.A O no hydrogen 3.393 N/A ARG 124.A N LEU 121.A O no hydrogen 3.099 N/A GLN 128.A N TYR 125.A O no hydrogen 2.859 N/A LEU 129.A N PRO 126.A O no hydrogen 2.532 N/A SER 130.A N GLN 128.A O no hydrogen 2.533 N/A ARG 136.A NE LEU 116.A O no hydrogen 2.976 N/A ARG 136.A NH1 GLN 133.A OE1 no hydrogen 2.831 N/A ARG 136.A NH2 LEU 116.A O no hydrogen 3.244 N/A VAL 137.A N GLN 133.A O no hydrogen 3.426 N/A ALA 138.A N ARG 134.A O no hydrogen 3.237 N/A VAL 139.A N GLN 135.A O no hydrogen 3.240 N/A ALA 140.A N ARG 136.A O no hydrogen 3.096 N/A ARG 141.A N VAL 137.A O no hydrogen 3.030 N/A ALA 142.A N ALA 138.A O no hydrogen 3.188 N/A ILE 143.A N VAL 139.A O no hydrogen 2.943 N/A VAL 144.A N ALA 140.A O no hydrogen 2.862 N/A GLU 146.A N ILE 143.A O no hydrogen 2.762 N/A ASP 148.A N ASN 79.A O no hydrogen 2.751 N/A LEU 150.A N THR 181.A O no hydrogen 2.769 N/A LEU 151.A N SER 81.A O no hydrogen 3.068 N/A MET 152.A N ILE 183.A O no hydrogen 3.110 N/A ASP 153.A N VAL 83.A O no hydrogen 2.833 N/A GLU 154.A N VAL 185.A O no hydrogen 2.869 N/A SER 157.A OG GLN 85.A O no hydrogen 2.745 N/A LEU 163.A N ASP 160.A OD2 no hydrogen 3.334 N/A ARG 164.A N ASP 160.A O no hydrogen 3.136 N/A ARG 164.A NE GLU 191.A OE1 no hydrogen 2.806 N/A ARG 164.A NH2 GLU 191.A OE1 no hydrogen 3.153 N/A VAL 165.A N ALA 161.A O no hydrogen 2.983 N/A ALA 166.A N LYS 162.A O no hydrogen 3.296 N/A MET 167.A N LEU 163.A O no hydrogen 3.005 N/A ARG 168.A N ARG 164.A O no hydrogen 2.950 N/A ARG 168.A NE GLU 191.A OE1 no hydrogen 2.894 N/A ARG 168.A NH2 GLU 191.A OE1 no hydrogen 3.380 N/A ALA 169.A N VAL 165.A O no hydrogen 3.186 N/A GLU 170.A N ALA 166.A O no hydrogen 2.819 N/A ILE 171.A N MET 167.A O no hydrogen 2.724 N/A LYS 172.A N ARG 168.A O no hydrogen 2.971 N/A LYS 172.A NZ MET 195.A O no hydrogen 2.661 N/A LYS 172.A NZ ASP 197.A OD1 no hydrogen 3.507 N/A LYS 173.A N ALA 169.A O no hydrogen 3.060 N/A LEU 174.A N GLU 170.A O no hydrogen 3.159 N/A GLN 175.A N ILE 171.A O no hydrogen 2.987 N/A GLN 176.A N LYS 172.A O no hydrogen 2.785 N/A LYS 177.A N LYS 173.A O no hydrogen 2.877 N/A LYS 177.A N LEU 174.A O no hydrogen 3.076 N/A LEU 178.A N LEU 174.A O no hydrogen 2.773 N/A LYS 179.A N GLN 175.A O no hydrogen 2.627 N/A LYS 179.A NZ GLY 32.A O no hydrogen 2.628 N/A THR 181.A OG1 VAL 5.A O no hydrogen 2.558 N/A THR 182.A N GLU 33.A O no hydrogen 2.975 N/A THR 182.A OG1 VAL 180.A O no hydrogen 2.821 N/A ILE 183.A N LEU 150.A O no hydrogen 2.939 N/A TYR 184.A N LEU 35.A O no hydrogen 2.801 N/A TYR 184.A OH GLU 191.A OE2 no hydrogen 2.850 N/A VAL 185.A N MET 152.A O no hydrogen 2.754 N/A THR 186.A N LEU 37.A O no hydrogen 3.281 N/A THR 186.A OG1 GLU 154.A OE1 no hydrogen 2.532 N/A THR 186.A OG1 GLU 154.A OE2 no hydrogen 3.472 N/A HIS 187.A N GLU 154.A OE2 no hydrogen 3.069 N/A ASP 188.A N THR 186.A OG1 no hydrogen 3.053 N/A VAL 190.A N ASP 188.A OD1 no hydrogen 3.074 N/A GLU 191.A N ASP 188.A OD1 no hydrogen 3.139 N/A ALA 192.A N ASP 188.A O no hydrogen 3.061 N/A MET 193.A N GLN 189.A O no hydrogen 3.140 N/A THR 194.A N VAL 190.A O no hydrogen 3.071 N/A THR 194.A OG1 VAL 190.A O no hydrogen 2.987 N/A MET 195.A N GLU 191.A O no hydrogen 3.127 N/A MET 195.A N ALA 192.A O no hydrogen 3.258 N/A GLY 196.A N ALA 192.A O no hydrogen 3.007 N/A ASP 197.A N PHE 34.A O no hydrogen 2.639 N/A ARG 198.A NE GLU 33.A OE1 no hydrogen 3.355 N/A ARG 198.A NE GLU 33.A OE2 no hydrogen 2.940 N/A ARG 198.A NH1 THR 28.A O no hydrogen 2.919 N/A ARG 198.A NH1 GLU 33.A OE1 no hydrogen 2.774 N/A ILE 199.A N GLY 211.A O no hydrogen 2.629 N/A ALA 200.A N VAL 36.A O no hydrogen 2.635 N/A VAL 201.A N GLN 209.A O no hydrogen 2.902 N/A MET 202.A N LEU 38.A O no hydrogen 2.866 N/A ASN 203.A N GLN 206.A O no hydrogen 3.045 N/A GLY 205.A N CYS 43.A O no hydrogen 2.769 N/A GLN 206.A N ASN 203.A O no hydrogen 2.987 N/A LEU 208.A N VAL 201.A O no hydrogen 2.962 N/A GLN 209.A NE2 ARG 219.A O no hydrogen 3.248 N/A GLY 211.A N ILE 199.A O no hydrogen 3.119 N/A GLU 215.A N SER 212.A OG no hydrogen 3.208 N/A VAL 216.A N SER 212.A O no hydrogen 3.020 N/A TYR 217.A N PRO 213.A O no hydrogen 3.087 N/A TYR 217.A OH GLU 276.A OE2 no hydrogen 2.701 N/A LEU 218.A N THR 214.A O no hydrogen 2.862 N/A ARG 219.A N GLU 215.A O no hydrogen 2.685 N/A ASN 221.A N GLN 209.A OE1 no hydrogen 2.722 N/A ASN 221.A ND2 LEU 208.A O no hydrogen 3.417 N/A SER 222.A OG ASN 221.A OD1 no hydrogen 3.320 N/A VAL 223.A N GLU 349.A O no hydrogen 3.030 N/A ALA 226.A N SER 222.A O no hydrogen 2.962 N/A THR 227.A N VAL 223.A O no hydrogen 2.922 N/A THR 227.A N PHE 224.A O no hydrogen 3.084 N/A THR 227.A OG1 VAL 223.A O no hydrogen 2.860 N/A THR 227.A OG1 PHE 224.A O no hydrogen 2.839 N/A PHE 228.A N VAL 225.A O no hydrogen 3.075 N/A GLY 230.A N GLN 189.A OE1 no hydrogen 2.696 N/A ASN 235.A N ILE 273.A O no hydrogen 3.056 N/A LEU 237.A N PHE 271.A O no hydrogen 2.897 N/A VAL 239.A N VAL 269.A O no hydrogen 2.966 N/A SER 240.A N GLU 247.A O no hydrogen 3.099 N/A SER 240.A OG GLU 247.A OE2 no hydrogen 3.539 N/A VAL 241.A N LYS 267.A O no hydrogen 3.038 N/A GLY 242.A N TYR 245.A O no hydrogen 3.112 N/A TYR 245.A OH ASP 243.A OD1 no hydrogen 3.250 N/A LEU 246.A N ILE 253.A O no hydrogen 2.960 N/A GLU 247.A N SER 240.A O no hydrogen 3.123 N/A GLY 248.A N PHE 251.A O no hydrogen 2.639 N/A ARG 249.A NH2 GLU 238.A OE2 no hydrogen 2.839 N/A GLY 250.A N GLY 248.A O no hydrogen 2.554 N/A PHE 251.A N GLY 248.A O no hydrogen 3.339 N/A ILE 253.A N LEU 246.A O no hydrogen 2.844 N/A LEU 255.A N GLY 244.A O no hydrogen 2.530 N/A LYS 262.A NZ ASP 259.A O no hydrogen 3.359 N/A TYR 264.A N LEU 261.A O no hydrogen 2.479 N/A TYR 264.A OH ASP 345.A OD2 no hydrogen 3.150 N/A GLY 266.A N VAL 241.A O no hydrogen 2.587 N/A LYS 267.A N TYR 264.A O no hydrogen 2.873 N/A VAL 269.A N VAL 239.A O no hydrogen 2.823 N/A LEU 270.A N PHE 344.A O no hydrogen 2.795 N/A PHE 271.A N LEU 237.A O no hydrogen 2.698 N/A GLY 272.A N HIS 342.A O no hydrogen 2.719 N/A ILE 273.A N ASN 235.A O no hydrogen 3.139 N/A ARG 274.A NH1 ILE 229.A O no hydrogen 3.035 N/A ARG 274.A NH2 TYR 217.A O no hydrogen 3.331 N/A ARG 274.A NH2 ILE 229.A O no hydrogen 3.173 N/A GLU 276.A N GLU 276.A OE1 no hydrogen 2.691 N/A HIS 277.A N ARG 274.A O no hydrogen 2.692 N/A VAL 280.A N THR 279.A OG1 no hydrogen 2.591 N/A GLU 281.A N LYS 333.A O no hydrogen 3.041 N/A ARG 287.A NE ASP 339.A OD2 no hydrogen 3.064 N/A ARG 287.A NH2 ASP 339.A OD2 no hydrogen 2.448 N/A ALA 289.A N MET 336.A O no hydrogen 2.976 N/A LEU 291.A N VAL 334.A O no hydrogen 3.252 N/A GLY 293.A N VAL 332.A O no hydrogen 2.957 N/A VAL 295.A N ARG 330.A O no hydrogen 2.880 N/A ASP 296.A N HIS 308.A O no hydrogen 2.653 N/A GLU 299.A N ILE 306.A O no hydrogen 2.820 N/A LEU 301.A N ASP 304.A O no hydrogen 2.891 N/A THR 303.A N LEU 301.A O no hydrogen 2.834 N/A THR 305.A N LEU 320.A O no hydrogen 2.663 N/A THR 305.A OG1 GLY 322.A O no hydrogen 2.930 N/A ILE 306.A N GLU 299.A O no hydrogen 2.979 N/A LEU 307.A N VAL 318.A O no hydrogen 2.731 N/A HIS 308.A N PHE 297.A O no hydrogen 2.869 N/A HIS 308.A NE2 GLU 299.A OE2 no hydrogen 2.619 N/A VAL 309.A N VAL 316.A O no hydrogen 2.827 N/A LYS 310.A N LYS 294.A O no hydrogen 3.242 N/A LYS 310.A NZ ASP 296.A OD1 no hydrogen 3.507 N/A ASP 313.A N ARG 249.A O no hydrogen 2.826 N/A VAL 316.A N VAL 309.A O no hydrogen 2.773 N/A VAL 318.A N LEU 307.A O no hydrogen 2.766 N/A LYS 319.A N PRO 275.A O no hydrogen 2.767 N/A LEU 320.A N THR 305.A O no hydrogen 3.041 N/A GLY 322.A N THR 303.A O no hydrogen 3.142 N/A ILE 324.A N THR 305.A OG1 no hydrogen 2.556 N/A ILE 326.A N ILE 324.A O no hydrogen 2.603 N/A GLY 329.A N VAL 295.A O no hydrogen 2.817 N/A ARG 330.A N GLU 327.A O no hydrogen 3.423 N/A VAL 332.A N GLY 293.A O no hydrogen 2.695 N/A VAL 334.A N LEU 291.A O no hydrogen 2.877 N/A ILE 335.A N THR 279.A O no hydrogen 2.939 N/A MET 336.A N ALA 289.A O no hydrogen 2.737 N/A ASP 337.A N HIS 277.A O no hydrogen 3.106 N/A ASP 339.A N ASP 337.A OD1 no hydrogen 3.146 N/A MET 340.A N ASP 337.A O no hydrogen 2.841 N/A HIS 342.A N GLY 272.A O no hydrogen 2.757 N/A PHE 344.A N LEU 270.A O no hydrogen 2.897 N/A ASP 345.A N LYS 350.A O no hydrogen 2.882 N/A LYS 346.A NZ GLU 238.A OE1 no hydrogen 2.702 N/A ASP 347.A N ASP 345.A OD1 no hydrogen 2.634 N/A THR 348.A N ASP 345.A OD1 no hydrogen 3.127 N/A LYS 350.A N THR 348.A OG1 no hydrogen 3.419 N/A ALA 351.A N ASN 221.A O no hydrogen 2.946 N/A ILE 352.A N VAL 343.A O no hydrogen 2.572 N/A VAL 353.A N VAL 343.A O no hydrogen 2.752 N/A