Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3v6s_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 5.A N VAL 16.A O no hydrogen 2.995 N/A TYR 5.A OH TYR 20.A O no hydrogen 2.706 N/A SER 6.A OG THR 15.A OG1 no hydrogen 3.053 N/A VAL 7.A N PHE 14.A O no hydrogen 2.986 N/A VAL 9.A N SER 12.A O no hydrogen 2.726 N/A SER 12.A N VAL 9.A O no hydrogen 3.083 N/A THR 13.A OG1 GLU 8.A OE2 no hydrogen 2.909 N/A PHE 14.A N VAL 7.A O no hydrogen 2.794 N/A THR 15.A N TYR 99.A OH no hydrogen 2.854 N/A THR 15.A OG1 SER 6.A OG no hydrogen 3.053 N/A VAL 16.A N TYR 5.A O no hydrogen 3.053 N/A LYS 18.A N GLN 3.A O no hydrogen 2.758 N/A LYS 18.A NZ ASN 2.A O no hydrogen 3.376 N/A ARG 19.A NE ASP 39.A OD1 no hydrogen 2.983 N/A ARG 19.A NH2 ASP 39.A OD1 no hydrogen 3.178 N/A ARG 19.A NH2 ASP 39.A OD2 no hydrogen 2.874 N/A TYR 20.A N LEU 17.A O no hydrogen 3.023 N/A GLN 21.A N TYR 38.A O no hydrogen 2.917 N/A GLN 21.A NE2 LYS 18.A O no hydrogen 3.438 N/A LYS 24.A N ALA 36.A O no hydrogen 2.707 N/A ILE 26.A N VAL 34.A O no hydrogen 3.457 N/A SER 28.A OG GLY 27.A O no hydrogen 2.888 N/A GLN 31.A N GLY 29.A O no hydrogen 2.648 N/A CYS 35.A N ILE 48.A O no hydrogen 3.065 N/A CYS 35.A SG ALA 36.A O no hydrogen 3.959 N/A ALA 36.A N LYS 24.A O no hydrogen 2.636 N/A ALA 37.A N VAL 46.A O no hydrogen 2.954 N/A TYR 38.A N GLN 21.A O no hydrogen 2.827 N/A TYR 38.A OH ASP 43.A OD1 no hydrogen 2.637 N/A ASP 39.A N ARG 44.A O no hydrogen 2.769 N/A ALA 40.A N ARG 19.A O no hydrogen 2.790 N/A LEU 42.A N ASP 39.A OD1 no hydrogen 3.204 N/A ARG 44.A N ASP 39.A O no hydrogen 3.300 N/A VAL 46.A N ALA 37.A O no hydrogen 2.765 N/A ALA 47.A N MET 102.A O no hydrogen 2.752 N/A ILE 48.A N CYS 35.A O no hydrogen 2.884 N/A LYS 49.A N LEU 100.A O no hydrogen 2.856 N/A LYS 49.A NZ GLU 67.A OE1 no hydrogen 2.959 N/A LYS 49.A NZ GLU 67.A OE2 no hydrogen 3.390 N/A LYS 50.A N ILE 33.A O no hydrogen 2.811 N/A LYS 50.A NZ THR 13.A O no hydrogen 2.778 N/A LEU 51.A N VAL 98.A O no hydrogen 3.034 N/A GLN 56.A N ARG 53.A O no hydrogen 3.368 N/A THR 59.A OG1 ASN 57.A OD1 no hydrogen 2.694 N/A HIS 60.A N ASN 57.A OD1 no hydrogen 3.009 N/A HIS 60.A ND1 ARG 53.A O no hydrogen 2.791 N/A ALA 61.A N ASN 57.A O no hydrogen 3.207 N/A LYS 62.A N GLN 58.A O no hydrogen 2.833 N/A ARG 63.A N THR 59.A O no hydrogen 2.970 N/A ARG 63.A NH2 ASP 163.A OD1 no hydrogen 2.813 N/A ALA 64.A N HIS 60.A O no hydrogen 2.922 N/A TYR 65.A N ALA 61.A O no hydrogen 2.936 N/A ARG 66.A N LYS 62.A O no hydrogen 2.981 N/A GLU 67.A N ARG 63.A O no hydrogen 3.020 N/A LEU 68.A N ALA 64.A O no hydrogen 3.060 N/A VAL 69.A N TYR 65.A O no hydrogen 2.963 N/A LEU 70.A N ARG 66.A O no hydrogen 2.914 N/A MET 71.A N GLU 67.A O no hydrogen 2.909 N/A LYS 72.A N LEU 68.A O no hydrogen 3.348 N/A CYS 73.A N VAL 69.A O no hydrogen 3.025 N/A CYS 73.A SG VAL 69.A O no hydrogen 3.415 N/A VAL 74.A N LEU 70.A O no hydrogen 2.893 N/A HIS 76.A NE2 GLU 318.A O no hydrogen 3.193 N/A LYS 77.A NZ GLU 318.A OE1 no hydrogen 2.800 N/A ASN 78.A N HIS 76.A ND1 no hydrogen 2.941 N/A ASN 78.A ND2 GLN 128.A OE1 no hydrogen 3.231 N/A ASN 78.A ND2 LEU 159.A O no hydrogen 2.983 N/A ILE 79.A N HIS 76.A O no hydrogen 3.137 N/A ILE 80.A N ILE 161.A O no hydrogen 3.042 N/A LEU 83.A N VAL 101.A O no hydrogen 2.747 N/A ASN 84.A N VAL 101.A O no hydrogen 3.115 N/A ASN 84.A ND2 TYR 20.A OH no hydrogen 2.872 N/A PHE 86.A N TYR 99.A O no hydrogen 3.226 N/A THR 87.A OG1 ASP 97.A O no hydrogen 2.716 N/A GLN 89.A NE2 ASP 97.A OD2 no hydrogen 3.373 N/A PHE 95.A N THR 91.A O no hydrogen 2.853 N/A GLN 96.A N GLN 89.A OE1 no hydrogen 2.789 N/A GLN 96.A NE2 ASP 97.A OD2 no hydrogen 3.569 N/A ASP 97.A N GLN 89.A OE1 no hydrogen 2.854 N/A TYR 99.A N PHE 86.A O no hydrogen 3.044 N/A LEU 100.A N LYS 49.A O no hydrogen 2.852 N/A VAL 101.A N ASN 84.A O no hydrogen 2.778 N/A MET 102.A N ALA 47.A O no hydrogen 2.894 N/A ALA 107.A N VAL 153.A O no hydrogen 3.045 N/A ASN 108.A N GLN 111.A OE1 no hydrogen 3.071 N/A ASN 108.A ND2 SER 149.A O no hydrogen 2.828 N/A LEU 109.A N ILE 151.A O no hydrogen 2.771 N/A CYS 110.A N ASN 108.A OD1 no hydrogen 3.007 N/A GLN 111.A N ASN 108.A O no hydrogen 3.062 N/A VAL 112.A N ASN 108.A O no hydrogen 3.352 N/A ILE 113.A N LEU 109.A O no hydrogen 2.733 N/A GLN 114.A N GLN 111.A O no hydrogen 3.208 N/A MET 115.A N VAL 112.A O no hydrogen 2.944 N/A HIS 119.A ND1 TYR 309.A OH no hydrogen 2.757 N/A ARG 121.A N ASP 118.A OD2 no hydrogen 3.034 N/A ARG 121.A NH1 ASP 118.A OD1 no hydrogen 2.852 N/A ARG 121.A NH1 ASP 118.A OD2 no hydrogen 3.192 N/A MET 122.A N ASP 118.A O no hydrogen 3.052 N/A SER 123.A N HIS 119.A O no hydrogen 2.880 N/A SER 123.A OG HIS 119.A O no hydrogen 2.994 N/A SER 123.A OG GLU 120.A O no hydrogen 3.203 N/A TYR 124.A N GLU 120.A O no hydrogen 3.164 N/A LEU 125.A N ARG 121.A O no hydrogen 2.972 N/A LEU 126.A N MET 122.A O no hydrogen 3.100 N/A TYR 127.A N SER 123.A O no hydrogen 2.883 N/A TYR 127.A OH GLU 318.A OE2 no hydrogen 2.748 N/A GLN 128.A N TYR 124.A O no hydrogen 3.094 N/A GLN 128.A NE2 TYR 124.A O no hydrogen 3.315 N/A GLN 128.A NE2 CYS 157.A O no hydrogen 2.894 N/A MET 129.A N LEU 125.A O no hydrogen 3.062 N/A LEU 130.A N LEU 126.A O no hydrogen 2.904 N/A CYS 131.A N TYR 127.A O no hydrogen 2.940 N/A CYS 131.A SG TYR 127.A O no hydrogen 3.356 N/A GLY 132.A N GLN 128.A O no hydrogen 2.961 N/A ILE 133.A N MET 129.A O no hydrogen 2.834 N/A LYS 134.A N LEU 130.A O no hydrogen 2.933 N/A HIS 135.A N CYS 131.A O no hydrogen 3.107 N/A LEU 136.A N GLY 132.A O no hydrogen 3.008 N/A HIS 137.A N ILE 133.A O no hydrogen 2.975 N/A HIS 137.A NE2 ASP 196.A OD2 no hydrogen 2.787 N/A SER 138.A N LYS 134.A O no hydrogen 3.003 N/A SER 138.A OG LYS 134.A O no hydrogen 3.499 N/A ALA 139.A N LEU 136.A O no hydrogen 3.125 N/A GLY 140.A N HIS 137.A O no hydrogen 2.852 N/A ILE 141.A N LEU 136.A O no hydrogen 2.900 N/A ILE 142.A N ALA 167.A O no hydrogen 3.155 N/A HIS 143.A N ASP 196.A OD2 no hydrogen 3.076 N/A ARG 144.A N ASP 196.A OD1 no hydrogen 2.804 N/A ARG 144.A NH2 ILE 142.A O no hydrogen 3.546 N/A ASP 145.A N HIS 143.A ND1 no hydrogen 3.122 N/A LYS 147.A NZ ASP 145.A OD2 no hydrogen 3.166 N/A ASN 150.A N LYS 147.A O no hydrogen 2.948 N/A ILE 151.A N PRO 148.A O no hydrogen 3.153 N/A VAL 152.A N LYS 160.A O no hydrogen 2.999 N/A VAL 153.A N ALA 107.A O no hydrogen 2.692 N/A LYS 154.A N THR 158.A O no hydrogen 2.831 N/A SER 155.A N ASP 106.A OD2 no hydrogen 2.647 N/A SER 155.A OG ASP 106.A OD2 no hydrogen 3.533 N/A CYS 157.A N LYS 154.A O no hydrogen 2.949 N/A CYS 157.A SG ARG 121.A O no hydrogen 3.952 N/A CYS 157.A SG CYS 157.A O no hydrogen 2.764 N/A THR 158.A N ASP 156.A OD1 no hydrogen 3.192 N/A THR 158.A OG1 ASP 156.A OD1 no hydrogen 2.563 N/A THR 158.A OG1 ASP 156.A OD2 no hydrogen 3.559 N/A LEU 159.A N GLN 128.A OE1 no hydrogen 2.855 N/A LYS 160.A N VAL 152.A O no hydrogen 2.938 N/A LYS 160.A NZ LYS 77.A O no hydrogen 2.776 N/A ILE 161.A N ASN 78.A O no hydrogen 2.855 N/A LEU 162.A N ASN 150.A O no hydrogen 2.769 N/A LEU 166.A N HIS 143.A O no hydrogen 2.951 N/A ALA 167.A N PHE 164.A O no hydrogen 3.198 N/A THR 169.A N LEU 166.A O no hydrogen 3.239 N/A THR 169.A OG1 LEU 166.A O no hydrogen 2.617 N/A THR 172.A OG1 THR 172.A O no hydrogen 2.402 N/A THR 172.A OG1 VAL 185.A O no hydrogen 3.314 N/A ARG 178.A NH2 GLY 216.A O no hydrogen 3.544 N/A TYR 180.A OH GLU 206.A OE1 no hydrogen 2.503 N/A ARG 181.A N ARG 178.A O no hydrogen 3.184 N/A ARG 181.A NE ASP 145.A OD1 no hydrogen 3.100 N/A ARG 181.A NH1 TYR 219.A OH no hydrogen 2.813 N/A ARG 181.A NH2 ASP 145.A OD2 no hydrogen 3.420 N/A GLU 184.A N GLU 184.A OE1 no hydrogen 2.852 N/A VAL 185.A N ALA 182.A O no hydrogen 2.925 N/A ILE 186.A N ALA 182.A O no hydrogen 3.115 N/A LEU 187.A N PRO 183.A O no hydrogen 2.834 N/A GLY 188.A N VAL 185.A O no hydrogen 3.226 N/A MET 189.A N GLU 184.A O no hydrogen 2.802 N/A ASN 194.A ND2 PRO 295.A O no hydrogen 2.639 N/A ASN 194.A ND2 ARG 298.A O no hydrogen 3.155 N/A VAL 195.A N LYS 192.A O no hydrogen 3.240 N/A ASP 196.A N GLU 193.A O no hydrogen 3.460 N/A ILE 197.A N ASN 194.A O no hydrogen 3.087 N/A SER 199.A OG TYR 180.A O no hydrogen 2.803 N/A VAL 200.A N ASP 196.A O no hydrogen 3.248 N/A GLY 201.A N ILE 197.A O no hydrogen 2.884 N/A CYS 202.A N TRP 198.A O no hydrogen 2.899 N/A CYS 202.A SG TYR 179.A O no hydrogen 3.843 N/A CYS 202.A SG TRP 198.A O no hydrogen 3.409 N/A ILE 203.A N SER 199.A O no hydrogen 2.998 N/A MET 204.A N VAL 200.A O no hydrogen 2.873 N/A GLY 205.A N GLY 201.A O no hydrogen 2.944 N/A GLU 206.A N CYS 202.A O no hydrogen 3.032 N/A MET 207.A N ILE 203.A O no hydrogen 2.977 N/A VAL 208.A N MET 204.A O no hydrogen 3.120 N/A ARG 209.A N GLY 205.A O no hydrogen 2.764 N/A HIS 210.A N GLU 206.A O no hydrogen 2.736 N/A HIS 210.A NE2 MET 115.A O no hydrogen 2.865 N/A ARG 217.A N ASP 221.A OD2 no hydrogen 3.231 N/A ASP 221.A N ASP 218.A OD1 no hydrogen 2.937 N/A GLN 222.A N ASP 218.A O no hydrogen 2.931 N/A GLN 222.A NE2 ARG 178.A O no hydrogen 2.865 N/A TRP 223.A N TYR 219.A O no hydrogen 2.749 N/A ASN 224.A N ILE 220.A O no hydrogen 3.379 N/A LYS 225.A N ASP 221.A O no hydrogen 3.362 N/A LYS 225.A NZ ASP 221.A OD1 no hydrogen 2.776 N/A VAL 226.A N GLN 222.A O no hydrogen 3.180 N/A VAL 226.A N TRP 223.A O no hydrogen 3.130 N/A ILE 227.A N TRP 223.A O no hydrogen 2.994 N/A GLU 228.A N ASN 224.A O no hydrogen 2.831 N/A GLN 229.A NE2 LEU 213.A O no hydrogen 2.933 N/A GLN 229.A NE2 LYS 225.A O no hydrogen 2.786 N/A LEU 230.A N VAL 226.A O no hydrogen 2.874 N/A GLY 231.A N ILE 227.A O no hydrogen 2.901 N/A THR 232.A N TYR 255.A O no hydrogen 2.873 N/A THR 232.A OG1 TYR 255.A O no hydrogen 3.313 N/A CYS 234.A SG ASP 294.A OD2 no hydrogen 3.797 N/A MET 238.A N CYS 234.A O no hydrogen 3.190 N/A LYS 239.A N PRO 235.A O no hydrogen 2.807 N/A LYS 240.A N GLU 236.A O no hydrogen 3.346 N/A LEU 241.A N MET 238.A O no hydrogen 3.436 N/A ARG 246.A N GLN 242.A O no hydrogen 3.015 N/A ASN 247.A N PRO 243.A O no hydrogen 3.169 N/A VAL 249.A N VAL 245.A O no hydrogen 2.969 N/A GLU 250.A N ARG 246.A O no hydrogen 2.828 N/A ASN 251.A N ASN 247.A O no hydrogen 3.119 N/A ASN 251.A N TYR 248.A O no hydrogen 3.190 N/A ASN 251.A ND2 ASN 247.A OD1 no hydrogen 3.319 N/A ARG 252.A N VAL 249.A O no hydrogen 3.308 N/A LYS 254.A NZ GLU 250.A O no hydrogen 2.847 N/A LYS 254.A NZ ARG 252.A O no hydrogen 3.381 N/A TYR 255.A N THR 232.A OG1 no hydrogen 2.735 N/A LYS 262.A N THR 259.A O no hydrogen 3.077 N/A LEU 263.A N THR 259.A O no hydrogen 2.833 N/A PHE 264.A N PHE 260.A O no hydrogen 2.711 N/A LEU 268.A N PRO 265.A O no hydrogen 2.980 N/A PHE 269.A N ASP 266.A O no hydrogen 3.045 N/A ASN 276.A ND2 ALA 271.A O no hydrogen 3.242 N/A LEU 278.A N GLU 274.A O no hydrogen 3.073 N/A LYS 279.A N HIS 275.A O no hydrogen 2.984 N/A ALA 280.A N ASN 276.A O no hydrogen 2.974 N/A ALA 280.A N LYS 277.A O no hydrogen 3.321 N/A SER 281.A N LYS 277.A O no hydrogen 3.510 N/A GLN 282.A N LEU 278.A O no hydrogen 3.251 N/A ALA 283.A N LYS 279.A O no hydrogen 3.154 N/A ARG 284.A N ALA 280.A O no hydrogen 3.095 N/A ARG 284.A NE PHE 264.A O no hydrogen 2.819 N/A ARG 284.A NH2 PHE 264.A O no hydrogen 3.031 N/A ARG 284.A NH2 ASP 266.A OD1 no hydrogen 3.195 N/A ASP 285.A N SER 281.A O no hydrogen 3.099 N/A LEU 286.A N GLN 282.A O no hydrogen 3.104 N/A LEU 287.A N ALA 283.A O no hydrogen 2.995 N/A SER 288.A N ARG 284.A O no hydrogen 2.912 N/A SER 288.A OG ASP 285.A O no hydrogen 2.800 N/A LYS 289.A N LEU 286.A O no hydrogen 3.183 N/A LYS 289.A NZ ASP 285.A OD2 no hydrogen 2.944 N/A MET 290.A N LEU 286.A O no hydrogen 3.010 N/A MET 290.A N LEU 287.A O no hydrogen 3.200 N/A LEU 291.A N LEU 287.A O no hydrogen 2.801 N/A ALA 296.A N ASP 294.A OD1 no hydrogen 3.212 N/A LYS 297.A N ASP 294.A O no hydrogen 3.159 N/A LYS 297.A NZ ASP 294.A OD2 no hydrogen 3.340 N/A ARG 298.A NE VAL 292.A O no hydrogen 2.933 N/A ARG 298.A NH1 GLU 184.A OE1 no hydrogen 3.535 N/A ARG 298.A NH1 GLU 184.A OE2 no hydrogen 2.750 N/A ARG 298.A NH1 ASN 194.A O no hydrogen 2.916 N/A ARG 298.A NH2 GLU 184.A OE1 no hydrogen 2.764 N/A ARG 298.A NH2 GLU 184.A OE2 no hydrogen 3.459 N/A ARG 298.A NH2 VAL 292.A O no hydrogen 3.159 N/A ARG 298.A NH2 ILE 293.A O no hydrogen 2.947 N/A ILE 299.A N LYS 289.A O no hydrogen 3.026 N/A ASP 303.A N SER 300.A OG no hydrogen 3.251 N/A ALA 304.A N SER 300.A O no hydrogen 3.085 N/A LEU 305.A N VAL 301.A O no hydrogen 2.938 N/A GLN 306.A N ASP 303.A O no hydrogen 3.110 N/A HIS 307.A N ALA 304.A O no hydrogen 3.134 N/A HIS 307.A NE2 ASP 285.A OD2 no hydrogen 2.734 N/A TYR 309.A N HIS 307.A ND1 no hydrogen 3.060 N/A TYR 309.A OH HIS 119.A ND1 no hydrogen 2.757 N/A ILE 310.A N HIS 307.A O no hydrogen 2.954 N/A ASN 311.A N HIS 307.A O no hydrogen 2.724 N/A ASN 311.A ND2 LEU 305.A O no hydrogen 3.126 N/A TRP 313.A N ILE 310.A O no hydrogen 2.983 N/A TRP 313.A NE1 SER 123.A OG no hydrogen 2.717 N/A TYR 314.A N ASN 311.A O no hydrogen 3.031 N/A TYR 314.A OH GLU 320.A OE2 no hydrogen 2.669 N/A ASP 315.A N TYR 127.A OH no hydrogen 3.084 N/A ALA 317.A N ASP 315.A OD1 no hydrogen 3.294 N/A GLU 318.A N ASP 315.A O no hydrogen 2.810 N/A VAL 319.A N ASP 315.A O no hydrogen 3.009 N/A GLU 320.A N PRO 316.A O no hydrogen 2.824 N/A GLN 325.A NE2 PRO 323.A O no hydrogen 2.937 N/A GLU 337.A N THR 334.A OG1 no hydrogen 3.231 N/A TRP 338.A N THR 334.A O no hydrogen 2.916 N/A LYS 339.A N ILE 335.A O no hydrogen 2.903 N/A LYS 339.A NZ LEU 92.A O no hydrogen 3.523 N/A GLU 340.A N GLU 336.A O no hydrogen 3.198 N/A LEU 341.A N GLU 337.A O no hydrogen 3.158 N/A ILE 342.A N TRP 338.A O no hydrogen 2.656 N/A TYR 343.A N LYS 339.A O no hydrogen 2.754 N/A LYS 344.A N GLU 340.A O no hydrogen 3.055 N/A LYS 344.A NZ GLU 340.A OE2 no hydrogen 3.221 N/A GLU 345.A N LEU 341.A O no hydrogen 3.373 N/A VAL 346.A N ILE 342.A O no hydrogen 3.140 N/A MET 347.A N TYR 343.A O no hydrogen 3.002 N/A ASN 348.A N LYS 344.A O no hydrogen 2.794 N/A SER 349.A OG VAL 346.A O no hydrogen 3.272 N/A