Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3vad_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A N MET 7.A O no hydrogen 2.854 N/A MET 8.A N TYR 26.A OH no hydrogen 3.358 N/A LEU 9.A N ARG 2.A O no hydrogen 2.515 N/A SER 14.A OG ARG 13.A O no hydrogen 2.795 N/A SER 14.A OG SER 18.A OG no hydrogen 3.111 N/A SER 18.A OG SER 14.A OG no hydrogen 3.111 N/A SER 18.A OG ASP 16.A OD2 no hydrogen 3.514 N/A SER 23.A N HIS 19.A O no hydrogen 3.159 N/A SER 23.A OG HIS 140.A ND1 no hydrogen 2.611 N/A GLY 24.A N LEU 20.A O no hydrogen 2.891 N/A ARG 25.A N LEU 21.A O no hydrogen 2.950 N/A ARG 25.A NE ILE 75.A O no hydrogen 3.256 N/A TYR 26.A N LYS 22.A O no hydrogen 3.041 N/A LEU 27.A N SER 23.A O no hydrogen 2.986 N/A GLN 28.A N GLY 24.A O no hydrogen 2.944 N/A GLN 28.A NE2 PRO 73.A O no hydrogen 2.965 N/A GLN 29.A N ARG 25.A O no hydrogen 2.875 N/A GLU 30.A N TYR 26.A O no hydrogen 2.786 N/A GLU 30.A N LEU 27.A O no hydrogen 3.017 N/A LEU 31.A N LEU 27.A O no hydrogen 2.785 N/A ARG 34.A N GLU 30.A O no hydrogen 3.347 N/A ILE 35.A N LEU 31.A O no hydrogen 2.889 N/A ALA 36.A N PRO 32.A O no hydrogen 2.958 N/A HIS 37.A N VAL 33.A O no hydrogen 2.967 N/A ARG 38.A N ARG 34.A O no hydrogen 3.071 N/A ILE 39.A N ILE 35.A O no hydrogen 2.856 N/A LYS 40.A N ALA 36.A O no hydrogen 3.155 N/A GLY 41.A N HIS 37.A O no hydrogen 3.435 N/A PHE 42.A N ARG 38.A O no hydrogen 3.141 N/A ARG 43.A N ILE 39.A O no hydrogen 2.935 N/A SER 44.A N LYS 40.A O no hydrogen 2.865 N/A SER 44.A N GLY 41.A O no hydrogen 3.395 N/A SER 44.A OG LYS 40.A O no hydrogen 3.347 N/A LEU 45.A N PHE 42.A O no hydrogen 3.425 N/A GLY 50.A N PRO 46.A O no hydrogen 2.848 N/A CYS 51.A SG PHE 47.A O no hydrogen 3.518 N/A ASN 52.A N ILE 49.A O no hydrogen 3.043 N/A THR 54.A OG1 GLU 104.A OE1 no hydrogen 3.549 N/A ILE 55.A N ASN 52.A OD1 no hydrogen 2.681 N/A LEU 56.A N ASN 52.A O no hydrogen 2.806 N/A HIS 57.A N PRO 53.A O no hydrogen 2.773 N/A VAL 58.A N THR 54.A O no hydrogen 3.057 N/A HIS 59.A N ILE 55.A O no hydrogen 2.951 N/A GLU 60.A N LEU 56.A O no hydrogen 2.756 N/A LEU 61.A N HIS 57.A O no hydrogen 2.937 N/A TYR 62.A N VAL 58.A O no hydrogen 2.977 N/A ILE 63.A N HIS 59.A O no hydrogen 3.172 N/A ARG 64.A N GLU 60.A O no hydrogen 2.770 N/A ALA 65.A N LEU 61.A O no hydrogen 2.923 N/A PHE 66.A N TYR 62.A O no hydrogen 2.966 N/A GLN 67.A N ILE 63.A O no hydrogen 2.744 N/A LYS 68.A N ARG 64.A O no hydrogen 2.897 N/A LEU 69.A N ALA 65.A O no hydrogen 2.964 N/A THR 70.A N PHE 66.A O no hydrogen 2.947 N/A THR 70.A OG1 PHE 66.A O no hydrogen 3.326 N/A THR 70.A OG1 GLN 67.A O no hydrogen 3.359 N/A ASP 71.A N GLN 67.A O no hydrogen 2.949 N/A PHE 72.A N LEU 69.A O no hydrogen 3.323 N/A ILE 75.A N GLN 28.A OE1 no hydrogen 3.107 N/A LYS 76.A N ASP 80.A OD2 no hydrogen 2.841 N/A ASP 80.A N ASP 77.A OD1 no hydrogen 2.995 N/A GLU 81.A N ASP 77.A O no hydrogen 3.214 N/A ALA 82.A N GLN 78.A O no hydrogen 2.751 N/A GLN 83.A N ASP 80.A O no hydrogen 2.807 N/A TYR 84.A N ASP 80.A O no hydrogen 2.919 N/A CYS 85.A N GLU 81.A O no hydrogen 2.973 N/A CYS 85.A SG GLU 81.A O no hydrogen 3.510 N/A CYS 85.A SG GLU 81.A OE2 no hydrogen 2.924 N/A CYS 85.A SG HIS 140.A NE2 no hydrogen 3.775 N/A CYS 85.A SG HIS 144.A NE2 no hydrogen 3.047 N/A GLN 86.A N GLN 83.A O no hydrogen 3.070 N/A VAL 88.A N TYR 84.A O no hydrogen 2.908 N/A ARG 89.A N CYS 85.A O no hydrogen 3.063 N/A GLN 90.A N GLN 86.A O no hydrogen 3.082 N/A LEU 91.A N LEU 87.A O no hydrogen 2.882 N/A LEU 92.A N VAL 88.A O no hydrogen 2.937 N/A ASP 93.A N ARG 89.A O no hydrogen 3.012 N/A ASP 94.A N GLN 90.A O no hydrogen 2.800 N/A HIS 95.A N LEU 91.A O no hydrogen 2.889 N/A LYS 96.A N ASP 93.A O no hydrogen 3.285 N/A LYS 96.A NZ ASP 93.A O no hydrogen 3.448 N/A LYS 96.A NZ ASP 93.A OD2 no hydrogen 2.760 N/A VAL 98.A N HIS 95.A O no hydrogen 3.333 N/A THR 100.A N ASP 97.A O no hydrogen 2.973 N/A LEU 101.A N ASP 97.A O no hydrogen 2.904 N/A LEU 102.A N VAL 98.A O no hydrogen 2.881 N/A ALA 103.A N VAL 99.A O no hydrogen 2.927 N/A GLU 104.A N THR 100.A O no hydrogen 2.914 N/A GLY 105.A N LEU 101.A O no hydrogen 2.726 N/A LEU 106.A N LEU 102.A O no hydrogen 2.951 N/A SER 109.A OG GLY 105.A O no hydrogen 3.132 N/A ARG 110.A N LEU 106.A O no hydrogen 3.099 N/A ARG 110.A NH1 HIS 265.A ND1 no hydrogen 3.210 N/A LYS 111.A N GLU 108.A O no hydrogen 3.121 N/A LYS 111.A NZ GLU 108.A OE2 no hydrogen 3.156 N/A ARG 120.A NH2 ASP 263.A OD1 no hydrogen 2.646 N/A TYR 121.A N LYS 117.A O no hydrogen 3.100 N/A PHE 122.A N LEU 118.A O no hydrogen 2.992 N/A LEU 123.A N VAL 119.A O no hydrogen 2.788 N/A ASP 124.A N ARG 120.A O no hydrogen 2.850 N/A LYS 125.A N TYR 121.A O no hydrogen 3.350 N/A THR 126.A N PHE 122.A O no hydrogen 2.847 N/A THR 126.A OG1 PHE 122.A O no hydrogen 2.813 N/A LEU 127.A N LEU 123.A O no hydrogen 2.782 N/A THR 128.A N ASP 124.A O no hydrogen 2.975 N/A THR 128.A OG1 ASP 124.A O no hydrogen 2.623 N/A THR 128.A OG1 LYS 125.A O no hydrogen 3.529 N/A SER 129.A N LYS 125.A O no hydrogen 3.214 N/A SER 129.A OG LYS 125.A O no hydrogen 3.057 N/A ARG 130.A N THR 126.A O no hydrogen 2.952 N/A ARG 130.A NH2 HIS 95.A O no hydrogen 2.740 N/A LEU 131.A N LEU 127.A O no hydrogen 3.025 N/A GLY 132.A N THR 128.A O no hydrogen 3.085 N/A PHE 133.A N SER 129.A O no hydrogen 2.763 N/A ARG 134.A N ARG 130.A O no hydrogen 2.867 N/A ARG 134.A NH2.B LEU 92.A O no hydrogen 2.368 N/A MET 135.A N LEU 131.A O no hydrogen 2.790 N/A LEU 136.A N GLY 132.A O no hydrogen 3.128 N/A ALA 137.A N PHE 133.A O no hydrogen 2.861 N/A THR 138.A N ARG 134.A O no hydrogen 2.876 N/A THR 138.A OG1 ARG 134.A O no hydrogen 3.025 N/A HIS 139.A N MET 135.A O no hydrogen 2.837 N/A HIS 139.A NE2 TYR 10.A O.A no hydrogen 3.153 N/A HIS 139.A NE2 TYR 10.A O.B no hydrogen 3.218 N/A HIS 140.A N LEU 136.A O no hydrogen 3.165 N/A HIS 140.A ND1 SER 23.A OG no hydrogen 2.611 N/A HIS 140.A NE2 GLU 81.A OE2 no hydrogen 2.677 N/A LEU 141.A N ALA 137.A O no hydrogen 3.167 N/A ALA 142.A N THR 138.A O no hydrogen 2.900 N/A LEU 143.A N HIS 139.A O no hydrogen 2.881 N/A HIS 144.A N LEU 141.A O no hydrogen 3.205 N/A HIS 144.A NE2 GLU 81.A OE2 no hydrogen 2.862 N/A VAL 151.A N ILE 154.A O no hydrogen 2.902 N/A ILE 153.A N HIS 139.A ND1 no hydrogen 3.218 N/A ILE 154.A N VAL 151.A O no hydrogen 3.184 N/A CYS 155.A N PHE 197.A O no hydrogen 2.956 N/A CYS 155.A SG ASP 149.A O no hydrogen 3.530 N/A THR 156.A N ASP 149.A O no hydrogen 2.732 N/A ARG 157.A NH1 ASP 149.A OD1 no hydrogen 3.286 N/A LEU 158.A N PHE 195.A O no hydrogen 2.634 N/A LYS 161.A NZ GLU 165.A OE2 no hydrogen 2.714 N/A LYS 162.A N SER 159.A OG no hydrogen 3.065 N/A ILE 163.A N SER 159.A O no hydrogen 2.889 N/A ILE 164.A N PRO 160.A O no hydrogen 2.878 N/A GLU 165.A N LYS 161.A O no hydrogen 2.823 N/A LYS 166.A N LYS 162.A O no hydrogen 2.952 N/A LYS 166.A NZ ASP 203.A OD1 no hydrogen 3.094 N/A TRP 167.A N ILE 163.A O no hydrogen 3.199 N/A TRP 167.A NE1 ASP 203.A OD1 no hydrogen 2.589 N/A VAL 168.A N ILE 164.A O no hydrogen 2.753 N/A ASP 169.A N GLU 165.A O no hydrogen 3.115 N/A PHE 170.A N LYS 166.A O no hydrogen 3.325 N/A ALA 171.A N TRP 167.A O no hydrogen 2.911 N/A ARG 172.A N VAL 168.A O no hydrogen 2.760 N/A ARG 172.A NE PRO 183.A O no hydrogen 2.813 N/A ARG 172.A NH2 ALA 182.A O no hydrogen 2.909 N/A ARG 173.A N ASP 169.A O no hydrogen 3.041 N/A LEU 174.A N PHE 170.A O no hydrogen 3.239 N/A CYS 175.A N ALA 171.A O no hydrogen 2.962 N/A CYS 175.A SG ASN 181.A O no hydrogen 3.605 N/A GLU 176.A N ARG 172.A O no hydrogen 2.739 N/A HIS 177.A N ARG 173.A O no hydrogen 2.919 N/A LYS 178.A N LEU 174.A O no hydrogen 3.210 N/A LYS 178.A N CYS 175.A O no hydrogen 3.047 N/A TYR 179.A N CYS 175.A O no hydrogen 2.846 N/A GLY 180.A N GLU 176.A O no hydrogen 2.824 N/A ASN 181.A ND2 PRO 225.A O no hydrogen 2.819 N/A ARG 186.A N VAL 231.A O no hydrogen 3.080 N/A ARG 186.A NH1 ASP 230.A OD2 no hydrogen 2.784 N/A ASN 188.A N ILE 233.A O no hydrogen 2.850 N/A HIS 190.A N ILE 235.A O no hydrogen 2.914 N/A VAL 191.A N GLY 189.A O no hydrogen 2.784 N/A ALA 193.A N HIS 190.A O no hydrogen 3.363 N/A ARG 194.A NE ARG 157.A O no hydrogen 3.277 N/A ARG 194.A NH2 ARG 157.A O no hydrogen 3.406 N/A PHE 195.A N LEU 158.A O no hydrogen 3.139 N/A PHE 197.A N CYS 155.A O no hydrogen 2.840 N/A ASP 203.A N PRO 199.A O no hydrogen 2.960 N/A ASP 203.A N MET 200.A O no hydrogen 2.864 N/A TYR 204.A N MET 200.A O no hydrogen 3.230 N/A TYR 204.A N PRO 201.A O no hydrogen 3.076 N/A ILE 205.A N PRO 201.A O no hydrogen 2.959 N/A LEU 206.A N LEU 202.A O no hydrogen 2.908 N/A LEU 209.A N ILE 205.A O no hydrogen 3.063 N/A LEU 210.A N LEU 206.A O no hydrogen 2.915 N/A LYS 211.A N PRO 207.A O no hydrogen 2.814 N/A LYS 211.A NZ GLU 208.A OE1 no hydrogen 3.364 N/A ASN 212.A N GLU 208.A O no hydrogen 3.093 N/A ALA 213.A N LEU 209.A O no hydrogen 2.966 N/A MET 214.A N LEU 210.A O no hydrogen 2.974 N/A ARG 215.A N LYS 211.A O no hydrogen 2.993 N/A ARG 215.A NE GLU 219.A OE2 no hydrogen 3.280 N/A ARG 215.A NH2 THR 268.A OG1 no hydrogen 2.917 N/A ALA 216.A N ASN 212.A O no hydrogen 3.127 N/A THR 217.A N ALA 213.A O no hydrogen 3.208 N/A THR 217.A OG1 ALA 213.A O no hydrogen 2.693 N/A MET 218.A N MET 214.A O no hydrogen 2.997 N/A GLU 219.A N ARG 215.A O no hydrogen 2.728 N/A SER 220.A N THR 217.A O no hydrogen 3.311 N/A SER 220.A OG ALA 216.A O no hydrogen 2.671 N/A SER 220.A OG THR 217.A O no hydrogen 3.172 N/A SER 220.A OG HIS 221.A ND1 no hydrogen 3.365 N/A HIS 221.A N MET 218.A O no hydrogen 3.009 N/A HIS 221.A ND1 THR 217.A O no hydrogen 3.089 N/A THR 224.A N HIS 221.A O no hydrogen 2.919 N/A THR 224.A OG1 ASN 227.A O no hydrogen 3.211 N/A ASN 227.A N THR 224.A O no hydrogen 2.742 N/A VAL 231.A N ARG 184.A O no hydrogen 3.128 N/A VAL 232.A N SER 247.A O no hydrogen 3.003 N/A ILE 233.A N ARG 186.A O no hydrogen 2.826 N/A THR 234.A N ARG 245.A O no hydrogen 2.798 N/A THR 234.A OG1 ASN 188.A OD1 no hydrogen 2.558 N/A ILE 235.A N ASN 188.A O no hydrogen 3.070 N/A ALA 236.A N ILE 243.A O no hydrogen 2.894 N/A ASN 237.A N HIS 190.A ND1 no hydrogen 2.750 N/A ASN 238.A N ASP 241.A O no hydrogen 3.296 N/A ASN 238.A ND2 ASP 241.A OD2 no hydrogen 2.994 N/A VAL 240.A N ASN 238.A OD1 no hydrogen 2.770 N/A ASP 241.A N ASN 238.A OD1 no hydrogen 2.838 N/A LEU 242.A N LEU 306.A O no hydrogen 2.789 N/A ILE 243.A N ALA 236.A O no hydrogen 2.966 N/A ILE 244.A N LEU 304.A O no hydrogen 2.848 N/A ARG 245.A N THR 234.A O no hydrogen 2.796 N/A ARG 245.A NH2 THR 234.A OG1 no hydrogen 3.022 N/A ILE 246.A N VAL 302.A O no hydrogen 2.802 N/A SER 247.A N VAL 232.A O no hydrogen 2.953 N/A ASP 248.A N THR 300.A O no hydrogen 2.776 N/A GLY 250.A N ASP 248.A OD2 no hydrogen 2.810 N/A GLY 251.A N ILE 298.A O no hydrogen 2.790 N/A ILE 253.A N SER 294.A OG no hydrogen 2.639 N/A ASP 257.A N ALA 254.A O no hydrogen 2.985 N/A LEU 258.A N HIS 255.A O no hydrogen 3.408 N/A ARG 260.A N ASP 257.A O no hydrogen 2.884 N/A VAL 261.A N ASP 257.A O no hydrogen 3.105 N/A ASP 263.A N ARG 260.A O no hydrogen 2.840 N/A TYR 264.A OH ASP 124.A OD1 no hydrogen 2.583 N/A HIS 265.A N GLY 273.A O no hydrogen 3.284 N/A HIS 265.A NE2 ALA 103.A O no hydrogen 2.751 N/A PHE 266.A N ASP 263.A O no hydrogen 3.313 N/A ALA 269.A N THR 267.A OG1 no hydrogen 3.143 N/A THR 278.A N PHE 274.A O no hydrogen 3.017 N/A THR 278.A OG1 PHE 274.A O no hydrogen 2.707 N/A SER 279.A N GLY 275.A O no hydrogen 3.056 N/A SER 279.A OG GLY 275.A O no hydrogen 2.887 N/A ARG 280.A N LEU 276.A O no hydrogen 2.980 N/A ALA 281.A N PRO 277.A O no hydrogen 3.137 N/A TYR 282.A N THR 278.A O no hydrogen 2.897 N/A ALA 283.A N SER 279.A O no hydrogen 2.979 N/A GLU 284.A N ARG 280.A O no hydrogen 2.915 N/A TYR 285.A N ALA 281.A O no hydrogen 2.907 N/A LEU 286.A N TYR 282.A O no hydrogen 3.085 N/A GLY 287.A N GLU 284.A O no hydrogen 2.937 N/A GLY 288.A N ALA 283.A O no hydrogen 2.792 N/A SER 289.A N ARG 305.A O no hydrogen 2.952 N/A GLN 291.A N TYR 303.A O no hydrogen 2.973 N/A GLN 293.A N ASP 301.A O no hydrogen 2.904 N/A SER 294.A OG ILE 253.A O no hydrogen 2.635 N/A LEU 295.A N GLY 299.A O no hydrogen 2.708 N/A GLN 296.A N GLN 296.A OE1 no hydrogen 2.808 N/A GLN 296.A NE2 ILE 253.A O no hydrogen 2.997 N/A GLY 297.A N GLY 251.A O no hydrogen 2.869 N/A ILE 298.A N LEU 295.A O no hydrogen 2.719 N/A GLY 299.A N LEU 295.A O no hydrogen 2.977 N/A THR 300.A N ASP 248.A O no hydrogen 3.234 N/A THR 300.A N ASP 248.A OD2 no hydrogen 3.164 N/A ASP 301.A N GLN 293.A O no hydrogen 2.982 N/A VAL 302.A N ILE 246.A O no hydrogen 2.755 N/A TYR 303.A N GLN 291.A O no hydrogen 2.839 N/A LEU 304.A N ILE 244.A O no hydrogen 3.044 N/A ARG 305.A N SER 289.A O no hydrogen 2.873 N/A LEU 306.A N LEU 242.A O no hydrogen 2.864 N/A HIS 308.A N VAL 240.A O no hydrogen 3.131 N/A HIS 308.A NE2 ASN 237.A OD1 no hydrogen 2.686 N/A