Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3vui_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 2.A N ASP 1.A OD2 no hydrogen 2.786 N/A TYR 5.A N VAL 16.A O no hydrogen 3.105 N/A TYR 5.A OH TYR 20.A O no hydrogen 2.834 N/A SER 6.A OG TYR 5.A O no hydrogen 2.886 N/A SER 6.A OG THR 15.A OG1 no hydrogen 3.327 N/A VAL 7.A N PHE 14.A O no hydrogen 3.015 N/A ILE 9.A N SER 12.A O no hydrogen 2.627 N/A SER 12.A N ILE 9.A O no hydrogen 2.812 N/A THR 13.A OG1 GLU 8.A OE1 no hydrogen 2.598 N/A THR 13.A OG1 GLU 8.A OE2 no hydrogen 3.062 N/A PHE 14.A N VAL 7.A O no hydrogen 2.919 N/A THR 15.A N TYR 99.A OH no hydrogen 2.681 N/A THR 15.A OG1 SER 6.A OG no hydrogen 3.327 N/A VAL 16.A N TYR 5.A O no hydrogen 3.293 N/A LYS 18.A N ASN 3.A O no hydrogen 3.165 N/A LYS 18.A NZ ASN 2.A O no hydrogen 3.212 N/A ARG 19.A NE ASP 39.A OD1 no hydrogen 2.879 N/A ARG 19.A NH2 ASP 39.A OD1 no hydrogen 2.874 N/A TYR 20.A N LEU 17.A O no hydrogen 3.089 N/A TYR 20.A OH ASN 84.A OD1 no hydrogen 2.700 N/A GLN 21.A N TYR 38.A O no hydrogen 2.857 N/A LYS 24.A N ALA 36.A O no hydrogen 3.087 N/A ILE 26.A N VAL 34.A O no hydrogen 3.026 N/A SER 28.A OG GLY 27.A O no hydrogen 2.992 N/A SER 28.A OG GLY 32.A O no hydrogen 3.207 N/A GLY 29.A N GLY 32.A O no hydrogen 3.061 N/A ALA 30.A N ASP 163.A OD2 no hydrogen 2.941 N/A GLN 31.A N GLN 31.A OE1 no hydrogen 2.548 N/A GLN 31.A NE2 GLU 67.A OE1 no hydrogen 2.673 N/A VAL 34.A N GLY 27.A O no hydrogen 3.278 N/A CYS 35.A N ILE 48.A O no hydrogen 2.756 N/A ALA 36.A N LYS 24.A O no hydrogen 2.944 N/A ALA 37.A N VAL 46.A O no hydrogen 2.990 N/A TYR 38.A N GLN 21.A O no hydrogen 2.833 N/A ASP 39.A N ARG 44.A O no hydrogen 3.080 N/A ALA 40.A N ARG 19.A O no hydrogen 2.748 N/A LEU 42.A N ASP 39.A OD1 no hydrogen 3.348 N/A VAL 46.A N ALA 37.A O no hydrogen 2.703 N/A ALA 47.A N MET 102.A O no hydrogen 2.799 N/A ILE 48.A N CYS 35.A O no hydrogen 2.666 N/A LYS 49.A N ILE 100.A O no hydrogen 2.834 N/A LYS 49.A NZ GLN 31.A OE1 no hydrogen 3.252 N/A LYS 49.A NZ GLU 67.A OE1 no hydrogen 2.751 N/A LYS 49.A NZ ASP 163.A OD2 no hydrogen 3.439 N/A LYS 50.A N ILE 33.A O no hydrogen 3.030 N/A LYS 50.A NZ THR 13.A O no hydrogen 2.541 N/A LEU 51.A N VAL 98.A O no hydrogen 2.770 N/A ARG 53.A N ASP 97.A OD1 no hydrogen 3.335 N/A GLN 56.A N ARG 53.A O no hydrogen 2.903 N/A GLN 56.A NE2 SER 52.A O no hydrogen 3.230 N/A ALA 61.A N ASN 57.A O no hydrogen 3.073 N/A LYS 62.A N GLN 58.A O no hydrogen 2.860 N/A ARG 63.A N THR 59.A O no hydrogen 2.863 N/A ALA 64.A N HIS 60.A O no hydrogen 2.912 N/A TYR 65.A N ALA 61.A O no hydrogen 2.854 N/A ARG 66.A N LYS 62.A O no hydrogen 3.176 N/A ARG 66.A NH1 GLY 165.A O no hydrogen 3.147 N/A ARG 66.A NH2 ASP 334.A O no hydrogen 3.504 N/A GLU 67.A N ARG 63.A O no hydrogen 2.851 N/A LEU 68.A N ALA 64.A O no hydrogen 2.795 N/A VAL 69.A N TYR 65.A O no hydrogen 2.633 N/A LEU 70.A N ARG 66.A O no hydrogen 2.642 N/A MET 71.A N GLU 67.A O no hydrogen 3.026 N/A LYS 72.A N LEU 68.A O no hydrogen 3.318 N/A LYS 72.A N VAL 69.A O no hydrogen 2.903 N/A VAL 73.A N VAL 69.A O no hydrogen 3.104 N/A VAL 73.A N LEU 70.A O no hydrogen 3.263 N/A VAL 74.A N LEU 70.A O no hydrogen 2.967 N/A ASN 75.A N HIS 135.A NE2 no hydrogen 3.241 N/A HIS 76.A NE2 ASN 78.A OD1 no hydrogen 2.825 N/A LYS 77.A NZ GLU 320.A OE2 no hydrogen 2.795 N/A ASN 78.A ND2 LEU 159.A O no hydrogen 3.046 N/A ILE 79.A N HIS 76.A O no hydrogen 3.280 N/A ILE 80.A N ILE 161.A O no hydrogen 2.999 N/A ASN 84.A N VAL 101.A O no hydrogen 3.277 N/A PHE 86.A N TYR 99.A O no hydrogen 3.152 N/A THR 87.A N GLU 355.A OE1 no hydrogen 3.425 N/A THR 87.A OG1 GLN 89.A OE1 no hydrogen 3.201 N/A THR 87.A OG1 ASP 97.A O no hydrogen 3.140 N/A GLN 89.A N THR 87.A OG1 no hydrogen 3.067 N/A LYS 90.A NZ GLU 94.A OE2 no hydrogen 3.480 N/A GLU 94.A N SER 91.A OG no hydrogen 3.258 N/A PHE 95.A N SER 91.A O no hydrogen 2.788 N/A GLN 96.A N GLN 89.A OE1 no hydrogen 2.779 N/A ASP 97.A N GLN 89.A OE1 no hydrogen 2.734 N/A VAL 98.A N LEU 51.A O no hydrogen 2.988 N/A TYR 99.A N PHE 86.A O no hydrogen 2.971 N/A ILE 100.A N LYS 49.A O no hydrogen 3.154 N/A VAL 101.A N ASN 84.A O no hydrogen 2.876 N/A MET 102.A N ALA 47.A O no hydrogen 2.771 N/A GLU 103.A N GLY 81.A O no hydrogen 3.153 N/A ASP 106.A N VAL 153.A O no hydrogen 2.812 N/A ALA 107.A N VAL 153.A O no hydrogen 3.257 N/A LEU 109.A N PRO 148.A O no hydrogen 3.090 N/A LEU 109.A N ILE 151.A O no hydrogen 2.867 N/A GLN 111.A NE2 SER 110.A OG no hydrogen 3.032 N/A VAL 112.A N LEU 109.A O no hydrogen 2.786 N/A ILE 113.A N LEU 109.A O no hydrogen 3.134 N/A GLN 114.A NE2 GLY 212.A O no hydrogen 3.439 N/A HIS 119.A ND1 TYR 311.A OH no hydrogen 2.813 N/A ARG 121.A N ASP 118.A OD2 no hydrogen 2.885 N/A ARG 121.A NE ASP 118.A OD1 no hydrogen 2.892 N/A ARG 121.A NH2 ASP 118.A OD1 no hydrogen 3.323 N/A MET 122.A N ASP 118.A O no hydrogen 3.046 N/A SER 123.A N HIS 119.A O no hydrogen 2.782 N/A SER 123.A OG TYR 311.A O no hydrogen 2.640 N/A TYR 124.A N GLU 120.A O no hydrogen 2.810 N/A LEU 125.A N ARG 121.A O no hydrogen 2.908 N/A LEU 126.A N MET 122.A O no hydrogen 3.263 N/A TYR 127.A N SER 123.A O no hydrogen 2.885 N/A TYR 127.A OH GLU 320.A OE1 no hydrogen 2.709 N/A GLN 128.A N TYR 124.A O no hydrogen 2.929 N/A GLN 128.A NE2 ALA 157.A O no hydrogen 2.962 N/A MET 129.A N LEU 125.A O no hydrogen 2.726 N/A LEU 130.A N LEU 126.A O no hydrogen 2.757 N/A CYS 131.A N TYR 127.A O no hydrogen 3.003 N/A CYS 131.A SG TYR 127.A O no hydrogen 3.257 N/A GLY 132.A N GLN 128.A O no hydrogen 3.277 N/A ILE 133.A N MET 129.A O no hydrogen 2.957 N/A LYS 134.A N LEU 130.A O no hydrogen 2.656 N/A LYS 134.A NZ ASP 304.A OD1 no hydrogen 3.323 N/A LYS 134.A NZ ALA 321.A O no hydrogen 2.971 N/A HIS 135.A N CYS 131.A O no hydrogen 2.832 N/A LEU 136.A N GLY 132.A O no hydrogen 3.230 N/A HIS 137.A N ILE 133.A O no hydrogen 2.921 N/A HIS 137.A NE2 ASP 198.A OD2 no hydrogen 2.696 N/A SER 138.A N LYS 134.A O no hydrogen 2.819 N/A ALA 139.A N LEU 136.A O no hydrogen 3.022 N/A GLY 140.A N HIS 137.A O no hydrogen 2.461 N/A ILE 141.A N LEU 136.A O no hydrogen 2.973 N/A ILE 142.A N ARG 168.A O no hydrogen 2.788 N/A HIS 143.A N ASP 198.A OD2 no hydrogen 2.968 N/A ARG 144.A N ASP 198.A OD1 no hydrogen 2.808 N/A ARG 144.A NE LEU 166.A O no hydrogen 3.095 N/A ARG 144.A NH2 LEU 166.A O no hydrogen 3.217 N/A ASP 145.A N HIS 143.A O no hydrogen 2.762 N/A LYS 147.A NZ ASP 145.A OD2 no hydrogen 3.470 N/A LYS 147.A NZ THR 179.A OG1 no hydrogen 2.627 N/A ASN 150.A N LYS 147.A O no hydrogen 2.757 N/A ASN 150.A ND2 HIS 143.A NE2 no hydrogen 3.641 N/A ASN 150.A ND2 ASP 145.A O no hydrogen 2.669 N/A ASN 150.A ND2 ASP 145.A OD2 no hydrogen 3.391 N/A ILE 151.A N PRO 148.A O no hydrogen 3.313 N/A VAL 152.A N LYS 160.A O no hydrogen 2.699 N/A VAL 153.A N ALA 107.A O no hydrogen 2.703 N/A LYS 154.A N THR 158.A O no hydrogen 3.129 N/A SER 155.A N ASP 106.A OD2 no hydrogen 3.097 N/A SER 155.A OG ASP 106.A OD2 no hydrogen 3.077 N/A ALA 157.A N LYS 154.A O no hydrogen 2.836 N/A THR 158.A N ASP 156.A OD1 no hydrogen 3.188 N/A THR 158.A OG1 ASP 156.A OD1 no hydrogen 2.647 N/A LEU 159.A N GLN 128.A OE1 no hydrogen 2.761 N/A LYS 160.A N VAL 152.A O no hydrogen 2.877 N/A LYS 160.A NZ LYS 77.A O no hydrogen 2.964 N/A ILE 161.A N ASN 78.A O no hydrogen 2.838 N/A GLY 165.A N ASP 163.A OD1 no hydrogen 3.107 N/A ALA 167.A N PHE 164.A O no hydrogen 2.851 N/A ARG 168.A N ILE 142.A O no hydrogen 3.239 N/A ARG 168.A NE ASP 334.A O no hydrogen 3.313 N/A THR 169.A N ASP 334.A OD2 no hydrogen 2.925 N/A THR 169.A OG1 ASP 334.A OD2 no hydrogen 2.488 N/A GLY 171.A N TYR 193.A O no hydrogen 2.657 N/A THR 179.A N ASP 145.A OD1 no hydrogen 3.127 N/A THR 179.A OG1 ASP 145.A OD1 no hydrogen 3.023 N/A ARG 180.A NE GLY 218.A O no hydrogen 3.016 N/A ARG 180.A NH2 GLY 218.A O no hydrogen 2.964 N/A TYR 182.A N THR 179.A O no hydrogen 3.190 N/A TYR 182.A OH GLU 208.A OE1 no hydrogen 2.632 N/A TYR 182.A OH GLU 208.A OE2 no hydrogen 2.961 N/A ARG 183.A N ARG 180.A O no hydrogen 3.287 N/A ARG 183.A NH1 VAL 178.A O no hydrogen 2.384 N/A GLU 186.A N GLU 186.A OE1 no hydrogen 2.835 N/A VAL 187.A N ALA 184.A O no hydrogen 2.762 N/A ILE 188.A N ALA 184.A O no hydrogen 2.799 N/A LEU 189.A N PRO 185.A O no hydrogen 2.831 N/A GLY 190.A N VAL 187.A O no hydrogen 3.364 N/A MET 191.A N GLU 186.A O no hydrogen 3.114 N/A GLU 195.A N GLU 195.A OE1 no hydrogen 3.108 N/A ASN 196.A ND2 ALA 297.A O no hydrogen 2.706 N/A ASN 196.A ND2 ARG 300.A O no hydrogen 3.461 N/A VAL 197.A N LYS 194.A O no hydrogen 2.978 N/A ASP 198.A N GLU 195.A O no hydrogen 3.126 N/A ILE 199.A N ASN 196.A O no hydrogen 2.939 N/A TRP 200.A N ASN 196.A O no hydrogen 3.341 N/A TRP 200.A N VAL 197.A O no hydrogen 3.039 N/A SER 201.A N VAL 197.A O no hydrogen 3.340 N/A SER 201.A OG TYR 182.A O no hydrogen 3.390 N/A VAL 202.A N ASP 198.A O no hydrogen 2.963 N/A GLY 203.A N ILE 199.A O no hydrogen 2.877 N/A CYS 204.A N TRP 200.A O no hydrogen 2.996 N/A CYS 204.A SG TYR 181.A O no hydrogen 4.036 N/A CYS 204.A SG TRP 200.A O no hydrogen 3.366 N/A ILE 205.A N SER 201.A O no hydrogen 2.963 N/A MET 206.A N VAL 202.A O no hydrogen 2.690 N/A GLY 207.A N GLY 203.A O no hydrogen 2.890 N/A GLU 208.A N CYS 204.A O no hydrogen 2.822 N/A MET 209.A N ILE 205.A O no hydrogen 2.918 N/A ILE 210.A N MET 206.A O no hydrogen 3.191 N/A LYS 211.A N GLY 207.A O no hydrogen 2.641 N/A GLY 212.A N GLU 208.A O no hydrogen 2.769 N/A THR 219.A N ASP 223.A OD2 no hydrogen 2.818 N/A THR 219.A OG1 ASP 220.A OD2 no hydrogen 3.476 N/A ILE 222.A N ASP 220.A OD1 no hydrogen 2.668 N/A ASP 223.A N ASP 220.A OD1 no hydrogen 2.474 N/A GLN 224.A N ASP 220.A O no hydrogen 2.886 N/A GLN 224.A NE2 PHE 216.A O no hydrogen 3.697 N/A GLN 224.A NE2 PRO 217.A O no hydrogen 2.721 N/A TRP 225.A N ILE 222.A O no hydrogen 2.837 N/A ASN 226.A ND2 ASP 223.A OD1 no hydrogen 2.851 N/A LYS 227.A N ASP 223.A O no hydrogen 3.049 N/A LYS 227.A NZ ASP 223.A OD2 no hydrogen 3.229 N/A VAL 228.A N GLN 224.A O no hydrogen 3.173 N/A ILE 229.A N TRP 225.A O no hydrogen 2.950 N/A GLU 230.A N ASN 226.A O no hydrogen 2.647 N/A GLN 231.A N VAL 228.A O no hydrogen 3.277 N/A GLN 231.A NE2 LEU 215.A O no hydrogen 3.355 N/A LEU 232.A N VAL 228.A O no hydrogen 3.007 N/A GLY 233.A N ILE 229.A O no hydrogen 2.799 N/A THR 234.A N TYR 257.A O no hydrogen 2.935 N/A PHE 239.A N SER 236.A O no hydrogen 2.986 N/A PHE 239.A N SER 236.A OG no hydrogen 2.966 N/A MET 240.A N SER 236.A O no hydrogen 3.020 N/A LYS 241.A N PRO 237.A O no hydrogen 2.913 N/A LYS 242.A N PHE 239.A O no hydrogen 2.839 N/A LEU 243.A N MET 240.A O no hydrogen 2.865 N/A ARG 248.A N GLN 244.A O no hydrogen 2.462 N/A ARG 248.A NH1 GLU 252.A OE2 no hydrogen 3.273 N/A THR 249.A N PRO 245.A O no hydrogen 2.835 N/A THR 249.A OG1 PRO 245.A O no hydrogen 2.866 N/A VAL 251.A N VAL 247.A O no hydrogen 3.135 N/A GLU 252.A N ARG 248.A O no hydrogen 3.077 N/A ASN 253.A N THR 249.A O no hydrogen 2.988 N/A ARG 254.A N VAL 251.A O no hydrogen 2.802 N/A ARG 254.A NE ASN 226.A OD1 no hydrogen 3.265 N/A ARG 254.A NH2 ASN 226.A OD1 no hydrogen 2.626 N/A LYS 256.A NZ GLU 252.A O no hydrogen 3.347 N/A TYR 257.A N THR 234.A OG1 no hydrogen 2.846 N/A TYR 260.A N GLN 231.A O no hydrogen 3.012 N/A LYS 264.A N SER 261.A OG no hydrogen 3.041 N/A LEU 265.A N SER 261.A O no hydrogen 2.616 N/A PHE 266.A N PHE 262.A O no hydrogen 2.749 N/A LEU 270.A N PRO 267.A O no hydrogen 3.182 N/A PHE 271.A N ASP 268.A O no hydrogen 2.688 N/A SER 275.A N LEU 280.A O no hydrogen 3.459 N/A SER 275.A OG HIS 277.A O no hydrogen 3.418 N/A SER 275.A OG LEU 280.A O no hydrogen 3.480 N/A LYS 279.A NZ ASN 313.A OD1 no hydrogen 3.164 N/A LYS 281.A N LYS 279.A O no hydrogen 2.729 N/A ALA 282.A N ASP 274.A OD1 no hydrogen 3.146 N/A ALA 285.A N LYS 281.A O no hydrogen 3.049 N/A ARG 286.A N ALA 282.A O no hydrogen 3.080 N/A ARG 286.A NE PHE 266.A O no hydrogen 2.771 N/A ARG 286.A NH2 PHE 266.A O no hydrogen 3.406 N/A ARG 286.A NH2 ASP 268.A OD2 no hydrogen 3.023 N/A ASP 287.A N SER 283.A O no hydrogen 2.931 N/A LEU 288.A N GLN 284.A O no hydrogen 3.095 N/A LEU 289.A N ALA 285.A O no hydrogen 2.746 N/A SER 290.A N ARG 286.A O no hydrogen 2.838 N/A SER 290.A OG ASP 287.A O no hydrogen 2.736 N/A LYS 291.A N ASP 287.A O no hydrogen 3.142 N/A LYS 291.A N LEU 288.A O no hydrogen 2.877 N/A MET 292.A N LEU 288.A O no hydrogen 3.077 N/A MET 292.A N LEU 289.A O no hydrogen 3.248 N/A LEU 293.A N LEU 289.A O no hydrogen 2.998 N/A VAL 294.A N MET 292.A O no hydrogen 2.945 N/A SER 298.A OG ASP 296.A OD1 no hydrogen 2.980 N/A SER 298.A OG ASP 296.A OD2 no hydrogen 2.939 N/A LYS 299.A N ASP 296.A O no hydrogen 2.705 N/A LYS 299.A NZ GLU 238.A OE2 no hydrogen 3.003 N/A ARG 300.A N ALA 297.A O no hydrogen 3.104 N/A ARG 300.A NE VAL 294.A O no hydrogen 2.946 N/A ARG 300.A NH1 GLU 186.A OE1 no hydrogen 3.499 N/A ARG 300.A NH1 GLU 186.A OE2 no hydrogen 2.949 N/A ARG 300.A NH1 ASN 196.A O no hydrogen 3.051 N/A ARG 300.A NH2 GLU 186.A OE1 no hydrogen 2.723 N/A ARG 300.A NH2 VAL 294.A O no hydrogen 3.202 N/A ARG 300.A NH2 ILE 295.A O no hydrogen 3.184 N/A ILE 301.A N LYS 291.A O no hydrogen 3.147 N/A SER 302.A N GLU 305.A OE1 no hydrogen 2.638 N/A GLU 305.A N SER 302.A OG no hydrogen 3.124 N/A ALA 306.A N SER 302.A O no hydrogen 2.743 N/A LEU 307.A N VAL 303.A O no hydrogen 2.776 N/A GLN 308.A N ASP 304.A O no hydrogen 3.135 N/A HIS 309.A N ALA 306.A O no hydrogen 3.215 N/A HIS 309.A NE2 GLN 284.A O no hydrogen 3.100 N/A TYR 311.A OH HIS 119.A ND1 no hydrogen 2.813 N/A ILE 312.A N HIS 309.A O no hydrogen 2.921 N/A ASN 313.A N HIS 309.A O no hydrogen 2.973 N/A TRP 315.A NE1 SER 123.A OG no hydrogen 2.971 N/A TYR 316.A N ASN 313.A O no hydrogen 2.526 N/A TYR 316.A OH GLU 322.A OE1 no hydrogen 2.425 N/A ASP 317.A N TYR 127.A OH no hydrogen 3.081 N/A SER 319.A N ASP 317.A OD1 no hydrogen 2.809 N/A SER 319.A OG ASP 317.A OD1 no hydrogen 2.696 N/A SER 319.A OG ASP 317.A OD2 no hydrogen 3.447 N/A GLU 320.A N ASP 317.A O no hydrogen 3.008 N/A ALA 321.A N ASP 317.A O no hydrogen 2.990 N/A GLU 322.A N PRO 318.A O no hydrogen 2.817 N/A LYS 327.A NZ ILE 328.A O no hydrogen 3.223 N/A GLU 335.A N LEU 333.A O no hydrogen 2.622 N/A ARG 336.A N LEU 333.A O no hydrogen 3.408 N/A ARG 336.A NH1 LEU 333.A O no hydrogen 2.627 N/A TRP 343.A N THR 339.A O no hydrogen 2.855 N/A LYS 344.A NZ GLU 93.A O no hydrogen 3.270 N/A LYS 344.A NZ PHE 95.A O no hydrogen 3.016 N/A GLU 345.A N GLU 341.A O no hydrogen 3.133 N/A LEU 346.A N GLU 342.A O no hydrogen 3.008 N/A ILE 347.A N TRP 343.A O no hydrogen 3.095 N/A TYR 348.A N LYS 344.A O no hydrogen 3.360 N/A LYS 349.A N GLU 345.A O no hydrogen 2.931 N/A GLU 350.A N LEU 346.A O no hydrogen 2.864 N/A VAL 351.A N ILE 347.A O no hydrogen 2.550 N/A MET 352.A N TYR 348.A O no hydrogen 2.679 N/A ASP 353.A N LYS 349.A O no hydrogen 2.837 N/A LEU 354.A N GLU 350.A O no hydrogen 3.262 N/A GLU 355.A N VAL 351.A O no hydrogen 2.737 N/A