Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3vuc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 4.A N LEU 153.A O no hydrogen 2.974 N/A THR 6.A N VAL 152.A O no hydrogen 2.749 N/A THR 7.A OG1 GLY 179.A O no hydrogen 3.453 N/A SER 8.A N LEU 178.A O no hydrogen 3.133 N/A VAL 10.A N ILE 176.A O no hydrogen 2.863 N/A LEU 12.A N GLY 174.A O no hydrogen 2.722 N/A THR 13.A N TYR 21.A O no hydrogen 2.753 N/A TYR 15.A N GLN 19.A O no hydrogen 2.846 N/A THR 18.A N TYR 15.A O no hydrogen 2.848 N/A THR 18.A OG1 TYR 15.A O no hydrogen 3.321 N/A GLN 19.A N TYR 15.A O no hydrogen 3.182 N/A GLN 19.A NE2 LEU 121.A O no hydrogen 3.057 N/A TYR 20.A OH ASN 14.A OD1 no hydrogen 3.183 N/A TYR 20.A OH ASN 163.A O no hydrogen 2.829 N/A TYR 21.A N THR 13.A O no hydrogen 2.955 N/A GLY 22.A N VAL 35.A O no hydrogen 2.792 N/A ILE 24.A N PHE 33.A O no hydrogen 2.994 N/A GLY 25.A N THR 98.A O no hydrogen 3.173 N/A ILE 26.A N GLN 31.A O no hydrogen 2.632 N/A GLY 27.A N ILE 96.A O no hydrogen 3.002 N/A THR 28.A N SER 69.A OG no hydrogen 3.052 N/A THR 28.A OG1 SER 71.A OG no hydrogen 2.660 N/A GLN 31.A N ILE 26.A O no hydrogen 2.793 N/A GLN 31.A NE2 ASP 65.A O no hydrogen 2.980 N/A PHE 33.A N ILE 24.A O no hydrogen 2.796 N/A LYS 34.A N ASP 125.A OD2 no hydrogen 2.724 N/A VAL 35.A N GLY 22.A O no hydrogen 2.712 N/A VAL 36.A N GLY 126.A O no hydrogen 3.165 N/A ASP 38.A N VAL 128.A O no hydrogen 2.924 N/A THR 39.A N THR 227.A OG1 no hydrogen 2.828 N/A THR 39.A OG1 VAL 225.A O no hydrogen 2.706 N/A THR 39.A OG1 THR 227.A OG1 no hydrogen 3.362 N/A GLY 40.A N ASP 38.A OD1 no hydrogen 3.115 N/A SER 41.A N ASP 38.A O no hydrogen 3.287 N/A SER 41.A OG ASP 38.A OD2 no hydrogen 2.577 N/A SER 42.A OG PHE 132.A O no hydrogen 2.563 N/A ASN 43.A ND2 ILE 137.A O no hydrogen 3.017 N/A TRP 45.A N VAL 127.A O no hydrogen 2.958 N/A TRP 45.A NE1 TYR 83.A OH no hydrogen 2.836 N/A VAL 46.A N GLY 109.A O no hydrogen 3.093 N/A SER 48.A N VAL 111.A O no hydrogen 2.924 N/A SER 48.A OG GLU 110.A OE2 no hydrogen 2.899 N/A SER 49.A N PHE 64.A O no hydrogen 2.664 N/A SER 49.A OG PHE 64.A O no hydrogen 3.238 N/A LYS 50.A N SER 48.A OG no hydrogen 2.669 N/A CYS 51.A N SER 48.A O no hydrogen 3.076 N/A CYS 51.A SG SER 52.A O no hydrogen 3.713 N/A CYS 51.A SG THR 112.A O no hydrogen 3.567 N/A ARG 53.A NH2 SER 49.A O no hydrogen 2.958 N/A ARG 53.A NH2 CYS 51.A O no hydrogen 2.631 N/A LEU 54.A N SER 52.A OG no hydrogen 3.169 N/A TYR 55.A N SER 52.A O no hydrogen 2.921 N/A TYR 55.A OH GLU 113.A OE2 no hydrogen 3.343 N/A CYS 58.A N TYR 55.A O no hydrogen 2.768 N/A VAL 59.A N TYR 55.A O no hydrogen 3.286 N/A TYR 60.A N THR 56.A O no hydrogen 3.104 N/A HIS 61.A ND1 ALA 57.A O no hydrogen 2.711 N/A HIS 61.A NE2 ALA 122.A O no hydrogen 2.860 N/A LYS 62.A N ASP 125.A OD1 no hydrogen 2.874 N/A LYS 62.A NZ THR 32.A O no hydrogen 2.946 N/A LYS 62.A NZ THR 32.A OG1 no hydrogen 3.360 N/A PHE 64.A N PRO 47.A O no hydrogen 2.869 N/A ASP 65.A N GLN 31.A OE1 no hydrogen 2.970 N/A SER 67.A N ASP 65.A OD1 no hydrogen 3.166 N/A ASP 68.A N ASP 65.A O no hydrogen 3.048 N/A SER 69.A N ALA 66.A O no hydrogen 2.884 N/A SER 69.A OG ASP 95.A OD1 no hydrogen 3.423 N/A SER 69.A OG ASP 95.A OD2 no hydrogen 2.691 N/A SER 70.A N THR 28.A O no hydrogen 2.834 N/A SER 71.A OG THR 28.A OG1 no hydrogen 2.660 N/A SER 71.A OG SER 69.A OG no hydrogen 3.402 N/A SER 71.A OG ASP 95.A OD1 no hydrogen 2.870 N/A LYS 73.A N GLN 94.A O no hydrogen 2.881 N/A GLY 76.A N LEU 92.A O no hydrogen 2.814 N/A THR 77.A N ASN 75.A OD1 no hydrogen 3.171 N/A THR 77.A OG1 ASN 75.A OD1 no hydrogen 2.824 N/A LEU 79.A N GLY 90.A O no hydrogen 2.738 N/A THR 80.A OG1 GLU 78.A OE2 no hydrogen 2.334 N/A THR 80.A OG1 SER 89.A OG no hydrogen 3.102 N/A LEU 81.A N VAL 88.A O no hydrogen 2.926 N/A GLY 86.A N TYR 83.A O no hydrogen 3.405 N/A VAL 88.A N LEU 81.A O no hydrogen 2.831 N/A SER 89.A N GLU 113.A O no hydrogen 3.179 N/A SER 89.A OG LEU 79.A O no hydrogen 3.383 N/A SER 89.A OG THR 80.A OG1 no hydrogen 3.102 N/A SER 89.A OG GLU 113.A OE1 no hydrogen 3.380 N/A GLY 90.A N LEU 79.A O no hydrogen 2.839 N/A PHE 91.A N GLU 110.A O no hydrogen 3.065 N/A LEU 92.A N THR 77.A O no hydrogen 2.942 N/A SER 93.A N PHE 108.A O no hydrogen 2.786 N/A SER 93.A OG GLU 110.A OE1 no hydrogen 2.708 N/A GLN 94.A N LYS 73.A O no hydrogen 3.123 N/A ASP 95.A N GLN 106.A O no hydrogen 3.069 N/A ILE 96.A N ASP 95.A OD1 no hydrogen 2.811 N/A ILE 97.A N VAL 104.A O no hydrogen 2.673 N/A THR 98.A N GLY 25.A O no hydrogen 2.888 N/A VAL 99.A N ILE 102.A O no hydrogen 2.905 N/A ILE 102.A N VAL 99.A O no hydrogen 2.934 N/A VAL 104.A N ILE 97.A O no hydrogen 2.950 N/A GLN 106.A N ASP 95.A O no hydrogen 2.891 N/A GLN 106.A NE2 MET 107.A O no hydrogen 3.109 N/A GLN 106.A NE2 THR 141.A O no hydrogen 2.708 N/A PHE 108.A N SER 93.A O no hydrogen 2.642 N/A GLY 109.A N VAL 44.A O no hydrogen 2.861 N/A GLU 110.A N PHE 91.A O no hydrogen 2.795 N/A VAL 111.A N VAL 46.A O no hydrogen 2.927 N/A THR 112.A N SER 89.A O no hydrogen 2.733 N/A GLU 113.A N SER 89.A O no hydrogen 2.993 N/A PHE 119.A N PRO 115.A O no hydrogen 3.002 N/A MET 120.A N ALA 116.A O no hydrogen 2.686 N/A LEU 121.A N PRO 118.A O no hydrogen 2.774 N/A ALA 122.A N PHE 119.A O no hydrogen 2.914 N/A GLU 123.A N GLN 19.A OE1 no hydrogen 2.787 N/A ASP 125.A N LYS 34.A O no hydrogen 2.673 N/A GLY 126.A N LYS 34.A O no hydrogen 2.961 N/A VAL 127.A N TRP 45.A O no hydrogen 2.983 N/A VAL 128.A N VAL 36.A O no hydrogen 2.683 N/A GLY 129.A N ASN 43.A O no hydrogen 2.822 N/A MET 130.A N ASP 38.A O no hydrogen 2.929 N/A GLY 131.A N SER 41.A O no hydrogen 2.696 N/A GLU 134.A N GLU 134.A OE1 no hydrogen 2.531 N/A GLN 135.A N PHE 132.A O no hydrogen 3.045 N/A ALA 136.A N ILE 133.A O no hydrogen 2.956 N/A ILE 137.A N ASN 43.A OD1 no hydrogen 2.800 N/A ASN 146.A N PRO 142.A O no hydrogen 3.167 N/A ASN 146.A ND2 GLN 106.A OE1 no hydrogen 2.774 N/A ILE 147.A N ILE 143.A O no hydrogen 3.088 N/A ILE 148.A N PHE 144.A O no hydrogen 2.851 N/A SER 149.A N ASP 145.A O no hydrogen 3.043 N/A SER 149.A OG ASP 145.A O no hydrogen 3.480 N/A GLN 150.A N ILE 147.A O no hydrogen 2.974 N/A GLY 151.A N ILE 148.A O no hydrogen 2.907 N/A LYS 154.A N THR 6.A O no hydrogen 2.917 N/A PHE 158.A N PHE 327.A O no hydrogen 3.036 N/A SER 159.A N VAL 177.A O no hydrogen 2.918 N/A SER 159.A OG GLY 180.A O no hydrogen 2.678 N/A PHE 160.A N THR 325.A O no hydrogen 2.803 N/A TYR 161.A N GLN 175.A O no hydrogen 2.731 N/A TYR 162.A OH THR 227.A O no hydrogen 2.602 N/A ASN 163.A N GLY 173.A O no hydrogen 2.957 N/A ASN 163.A ND2 LEU 172.A O no hydrogen 2.647 N/A ASP 165.A N ASP 17.A OD2 no hydrogen 2.991 N/A ASN 168.A ND2 ASN 168.A O no hydrogen 3.301 N/A SER 171.A N ASN 168.A O no hydrogen 2.969 N/A GLY 174.A N LEU 12.A O no hydrogen 3.102 N/A GLN 175.A N TYR 161.A O no hydrogen 2.851 N/A GLN 175.A NE2 ASP 182.A OD2 no hydrogen 2.946 N/A ILE 176.A N VAL 10.A O no hydrogen 3.062 N/A VAL 177.A N SER 159.A O no hydrogen 2.879 N/A LEU 178.A N SER 8.A O no hydrogen 2.782 N/A GLY 179.A N VAL 157.A O no hydrogen 2.619 N/A ASP 182.A N TYR 324.A OH no hydrogen 2.699 N/A GLN 184.A N ASP 182.A OD1 no hydrogen 3.068 N/A HIS 185.A N ASP 182.A O no hydrogen 2.811 N/A GLU 187.A N LEU 338.A O no hydrogen 2.861 N/A HIS 191.A N PHE 336.A O no hydrogen 2.838 N/A ILE 193.A N ILE 334.A O no hydrogen 3.031 N/A LEU 195.A N ASN 332.A O no hydrogen 3.012 N/A ILE 196.A N GLN 202.A O no hydrogen 3.252 N/A THR 198.A OG1 ASN 332.A OD1 no hydrogen 2.885 N/A TRP 201.A NE1 MET 130.A O no hydrogen 3.034 N/A GLN 202.A N VAL 200.A O no hydrogen 2.904 N/A GLN 202.A NE2 THR 309.A O no hydrogen 2.892 N/A GLN 202.A NE2 THR 312.A OG1 no hydrogen 2.740 N/A ILE 203.A N ALA 223.A O no hydrogen 2.802 N/A MET 205.A N CYS 221.A O no hydrogen 2.716 N/A LYS 206.A N HIS 271.A O no hydrogen 2.911 N/A LYS 206.A NZ GLY 273.A O no hydrogen 3.200 N/A VAL 208.A N LEU 216.A O no hydrogen 3.158 N/A SER 209.A N SER 269.A O no hydrogen 2.981 N/A VAL 210.A N THR 214.A O no hydrogen 3.219 N/A GLY 211.A N ASP 267.A O no hydrogen 2.775 N/A LEU 216.A N VAL 208.A O no hydrogen 2.871 N/A CYS 217.A SG MET 205.A O no hydrogen 3.261 N/A GLY 220.A N CYS 217.A O no hydrogen 3.221 N/A CYS 221.A N MET 205.A O no hydrogen 2.897 N/A CYS 221.A SG MET 205.A O no hydrogen 3.695 N/A ALA 223.A N ILE 203.A O no hydrogen 2.853 N/A LEU 224.A N TRP 313.A O no hydrogen 2.877 N/A VAL 225.A N TRP 201.A O no hydrogen 2.858 N/A ASP 226.A N LEU 315.A O no hydrogen 2.919 N/A THR 227.A N THR 39.A OG1 no hydrogen 2.959 N/A THR 227.A OG1 PHE 37.A O no hydrogen 2.592 N/A THR 227.A OG1 THR 39.A OG1 no hydrogen 3.362 N/A GLY 228.A N ASP 226.A OD1 no hydrogen 2.934 N/A ALA 229.A N ASP 226.A O no hydrogen 3.141 N/A SER 230.A OG THR 18.A O no hydrogen 2.626 N/A ILE 232.A N ALA 299.A O no hydrogen 3.149 N/A SER 233.A N ALA 314.A O no hydrogen 2.767 N/A GLY 234.A N HIS 301.A O no hydrogen 3.236 N/A SER 235.A OG SER 238.A OG no hydrogen 3.037 N/A THR 236.A N ASP 304.A OD1 no hydrogen 2.770 N/A THR 236.A OG1 ASP 304.A OD1 no hydrogen 3.127 N/A THR 236.A OG1 ASP 304.A OD2 no hydrogen 2.361 N/A SER 238.A N SER 235.A OG no hydrogen 3.007 N/A SER 238.A OG SER 235.A OG no hydrogen 3.037 N/A ILE 239.A N SER 235.A O no hydrogen 2.947 N/A GLU 240.A N THR 236.A O no hydrogen 2.841 N/A LYS 241.A N SER 238.A O no hydrogen 3.002 N/A LEU 242.A N SER 238.A O no hydrogen 2.939 N/A MET 243.A N ILE 239.A O no hydrogen 2.727 N/A GLU 244.A N GLU 240.A O no hydrogen 3.075 N/A ALA 245.A N LYS 241.A O no hydrogen 3.189 N/A LEU 246.A N LEU 242.A O no hydrogen 3.276 N/A LEU 246.A N MET 243.A O no hydrogen 3.170 N/A GLY 247.A N GLU 244.A O no hydrogen 3.011 N/A ALA 248.A N MET 243.A O no hydrogen 3.023 N/A LYS 249.A N VAL 256.A O no hydrogen 3.096 N/A LYS 250.A NZ ARG 251.A O no hydrogen 3.481 N/A ARG 251.A N ASP 254.A O no hydrogen 2.852 N/A ARG 251.A NE ASP 254.A OD1 no hydrogen 3.075 N/A ARG 251.A NH2 ASP 254.A OD1 no hydrogen 3.399 N/A ARG 251.A NH2 ASP 254.A OD2 no hydrogen 3.166 N/A VAL 256.A N LYS 249.A O no hydrogen 3.169 N/A VAL 257.A N CYS 296.A O no hydrogen 3.188 N/A LYS 258.A N GLU 261.A OE1 no hydrogen 3.393 N/A CYS 259.A N LYS 294.A O no hydrogen 2.856 N/A CYS 259.A SG LYS 294.A O no hydrogen 3.542 N/A ASN 260.A N SER 291.A O no hydrogen 3.228 N/A GLU 261.A N LYS 258.A O no hydrogen 2.932 N/A GLY 262.A N CYS 259.A O no hydrogen 3.137 N/A THR 264.A N GLU 261.A O no hydrogen 3.214 N/A THR 264.A OG1 GLU 261.A O no hydrogen 2.916 N/A LEU 265.A N GLY 262.A O no hydrogen 3.157 N/A ILE 268.A N LEU 279.A O no hydrogen 2.787 N/A SER 269.A N SER 209.A O no hydrogen 2.676 N/A SER 269.A OG THR 278.A OG1 no hydrogen 2.635 N/A PHE 270.A N TYR 277.A O no hydrogen 2.835 N/A HIS 271.A N GLY 207.A O no hydrogen 2.933 N/A LEU 272.A N LYS 275.A O no hydrogen 3.120 N/A LYS 275.A N LEU 272.A O no hydrogen 3.038 N/A TYR 277.A N PHE 270.A O no hydrogen 2.639 N/A THR 278.A OG1 SER 269.A OG no hydrogen 2.635 N/A LEU 279.A N ILE 268.A O no hydrogen 2.773 N/A THR 280.A N ASP 283.A OD2 no hydrogen 2.898 N/A THR 280.A OG1 ASP 283.A OD2 no hydrogen 3.119 N/A SER 281.A OG GLY 262.A O no hydrogen 3.208 N/A ASP 283.A N THR 280.A O no hydrogen 2.948 N/A TYR 284.A N SER 281.A O no hydrogen 2.949 N/A TYR 284.A OH PRO 266.A O no hydrogen 2.754 N/A VAL 285.A N SER 281.A O no hydrogen 2.674 N/A PHE 286.A N THR 297.A O no hydrogen 2.976 N/A GLN 287.A NE2 CYS 259.A O no hydrogen 2.851 N/A GLN 287.A NE2 SER 289.A O no hydrogen 2.801 N/A GLU 288.A N PHE 286.A O no hydrogen 2.896 N/A SER 291.A N SER 289.A OG no hydrogen 2.961 N/A LYS 293.A N SER 291.A OG no hydrogen 2.757 N/A CYS 296.A N VAL 257.A O no hydrogen 2.939 N/A CYS 296.A SG PHE 286.A O no hydrogen 3.236 N/A CYS 296.A SG SER 289.A O no hydrogen 3.906 N/A THR 297.A OG1 ASP 254.A OD2 no hydrogen 2.845 N/A THR 297.A OG1 TYR 255.A O no hydrogen 3.322 N/A THR 297.A OG1 LEU 298.A O no hydrogen 3.445 N/A LEU 298.A N TYR 255.A O no hydrogen 3.139 N/A ALA 299.A N TYR 284.A O no hydrogen 2.754 N/A HIS 301.A N ILE 232.A O no hydrogen 2.982 N/A MET 303.A N GLY 234.A O no hydrogen 2.672 N/A THR 309.A OG1 GLN 135.A OE1 no hydrogen 3.090 N/A GLY 310.A N PRO 306.A O no hydrogen 2.556 N/A THR 312.A OG1 TRP 313.A O no hydrogen 2.943 N/A TRP 313.A N LEU 222.A O no hydrogen 2.955 N/A ALA 314.A N SER 233.A O no hydrogen 2.702 N/A LEU 315.A N LEU 224.A O no hydrogen 2.688 N/A ALA 317.A N ALA 229.A O no hydrogen 2.788 N/A THR 318.A OG1 SER 230.A O no hydrogen 3.519 N/A THR 318.A OG1 ALA 299.A O no hydrogen 2.770 N/A ILE 320.A N GLY 316.A O no hydrogen 3.009 N/A ARG 321.A N ALA 317.A O no hydrogen 3.040 N/A ARG 321.A NH1 ASP 17.A O no hydrogen 2.927 N/A ARG 321.A NH1 TYR 20.A OH no hydrogen 3.287 N/A LYS 322.A N PHE 319.A O no hydrogen 3.013 N/A LYS 322.A NZ THR 278.A O no hydrogen 3.178 N/A PHE 323.A N PHE 319.A O no hydrogen 3.013 N/A THR 325.A N PHE 160.A O no hydrogen 3.077 N/A THR 325.A OG1 PHE 323.A O no hydrogen 2.854 N/A GLU 326.A N GLY 335.A O no hydrogen 2.799 N/A PHE 327.A N PHE 158.A O no hydrogen 2.669 N/A ASP 328.A N ARG 333.A O no hydrogen 2.937 N/A ARG 329.A N ASP 156.A O no hydrogen 2.914 N/A ARG 329.A NH2 ASP 145.A OD2 no hydrogen 2.717 N/A ASN 331.A N ASP 328.A OD1 no hydrogen 3.118 N/A ARG 333.A N ASP 328.A O no hydrogen 3.134 N/A ARG 333.A NH1 ASP 328.A OD2 no hydrogen 2.598 N/A ILE 334.A N ILE 193.A O no hydrogen 3.054 N/A GLY 335.A N GLU 326.A O no hydrogen 2.843 N/A PHE 336.A N HIS 191.A O no hydrogen 2.856 N/A ALA 337.A N TYR 324.A O no hydrogen 3.105 N/A ALA 339.A N LYS 322.A O no hydrogen 3.007 N/A ARG 340.A N HIS 185.A O no hydrogen 3.022 N/A ARG 340.A NE TYR 186.A O no hydrogen 3.247 N/A ARG 340.A NH2 TYR 186.A O no hydrogen 3.533 N/A