Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ixb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 6.A N PRO 2.A O no hydrogen 2.914 N/A ASN 6.A ND2 ASP 7.A OD1 no hydrogen 3.249 N/A ASP 7.A N GLN 3.A O no hydrogen 2.785 N/A ILE 8.A N GLN 4.A O no hydrogen 3.069 N/A VAL 9.A N ILE 5.A O no hydrogen 2.976 N/A HIS 10.A N ASN 6.A O no hydrogen 2.908 N/A ARG 11.A N ASP 7.A O no hydrogen 2.930 N/A THR 12.A N ILE 8.A O no hydrogen 3.105 N/A THR 12.A N VAL 9.A O no hydrogen 3.236 N/A THR 12.A OG1 ILE 8.A O no hydrogen 2.770 N/A ILE 13.A N VAL 9.A O no hydrogen 2.869 N/A THR 14.A N HIS 10.A O no hydrogen 3.064 N/A THR 14.A OG1 HIS 10.A O no hydrogen 2.828 N/A LEU 16.A N THR 12.A O no hydrogen 3.470 N/A ILE 17.A N ILE 13.A O no hydrogen 2.916 N/A GLU 18.A N THR 14.A O no hydrogen 3.149 N/A GLN 19.A N PRO 15.A O no hydrogen 2.798 N/A GLN 20.A N LEU 16.A O no hydrogen 2.881 N/A ILE 22.A N ILE 17.A O no hydrogen 3.194 N/A MET 25.A N TRP 40.A O no hydrogen 2.984 N/A ALA 26.A N LEU 330.A O no hydrogen 2.867 N/A VAL 27.A N PHE 38.A O no hydrogen 2.802 N/A ALA 28.A N VAL 328.A O no hydrogen 2.948 N/A VAL 29.A N TYR 36.A O no hydrogen 2.903 N/A ILE 30.A N GLY 326.A O no hydrogen 2.850 N/A TYR 31.A N LYS 34.A O no hydrogen 2.885 N/A LYS 34.A N TYR 31.A O no hydrogen 2.991 N/A TYR 36.A N VAL 29.A O no hydrogen 2.822 N/A PHE 38.A N VAL 27.A O no hydrogen 2.913 N/A TRP 40.A N MET 25.A O no hydrogen 2.885 N/A TYR 42.A N PRO 23.A O no hydrogen 2.781 N/A ALA 43.A N GLN 49.A O no hydrogen 2.822 N/A ASP 44.A N GLN 49.A O no hydrogen 3.328 N/A ILE 45.A N TYR 200.A OH no hydrogen 2.793 N/A LYS 47.A N ASP 44.A OD1 no hydrogen 2.924 N/A LYS 48.A N ILE 45.A O no hydrogen 3.140 N/A GLN 49.A N ASP 44.A O no hydrogen 2.977 N/A GLN 49.A NE2 LYS 47.A O no hydrogen 3.023 N/A VAL 51.A N GLY 41.A O no hydrogen 2.893 N/A THR 52.A N THR 55.A OG1 no hydrogen 2.817 N/A GLN 53.A NE2 GLU 225.A OE2 no hydrogen 2.833 N/A GLN 54.A N THR 52.A OG1 no hydrogen 3.013 N/A THR 55.A N THR 52.A O no hydrogen 3.094 N/A THR 55.A OG1 THR 52.A O no hydrogen 3.374 N/A LEU 56.A N ASN 195.A O no hydrogen 2.735 N/A PHE 57.A N SER 222.A O no hydrogen 2.924 N/A LEU 59.A N VAL 220.A O no hydrogen 2.939 N/A SER 61.A OG TYR 147.A OH no hydrogen 2.935 N/A VAL 62.A N LEU 59.A O no hydrogen 3.094 N/A SER 63.A N GLY 60.A O no hydrogen 2.843 N/A SER 63.A OG GLY 60.A O no hydrogen 2.678 N/A LYS 64.A N SER 61.A O no hydrogen 2.901 N/A LYS 64.A NZ SER 61.A OG no hydrogen 2.695 N/A LYS 64.A NZ TYR 147.A OH no hydrogen 3.521 N/A LYS 64.A NZ ASN 149.A OD1 no hydrogen 2.753 N/A LYS 64.A NZ ALA 217.A O no hydrogen 2.875 N/A THR 65.A N VAL 62.A O no hydrogen 2.990 N/A THR 65.A OG1 VAL 62.A O no hydrogen 2.795 N/A THR 67.A N SER 63.A O no hydrogen 3.112 N/A THR 67.A OG1 SER 63.A O no hydrogen 3.472 N/A THR 67.A OG1 LYS 216.A O no hydrogen 2.538 N/A GLY 68.A N LYS 64.A O no hydrogen 2.873 N/A VAL 69.A N THR 65.A O no hydrogen 3.026 N/A LEU 70.A N PHE 66.A O no hydrogen 2.832 N/A GLY 71.A N THR 67.A O no hydrogen 2.878 N/A GLY 72.A N GLY 68.A O no hydrogen 2.877 N/A ASP 73.A N VAL 69.A O no hydrogen 2.811 N/A ALA 74.A N LEU 70.A O no hydrogen 3.014 N/A ILE 75.A N GLY 71.A O no hydrogen 2.943 N/A ALA 76.A N GLY 72.A O no hydrogen 2.961 N/A ARG 77.A N ASP 73.A O no hydrogen 2.911 N/A ARG 77.A NE ASP 73.A OD2 no hydrogen 2.748 N/A GLY 78.A N ILE 75.A O no hydrogen 2.847 N/A GLU 79.A N ALA 74.A O no hydrogen 2.994 N/A LYS 81.A N TYR 89.A OH no hydrogen 3.178 N/A ASP 84.A N LYS 81.A O no hydrogen 3.082 N/A THR 86.A N ILE 101.A O no hydrogen 2.928 N/A THR 86.A OG1 ILE 101.A O no hydrogen 2.890 N/A LYS 88.A N PRO 85.A O no hydrogen 2.978 N/A TYR 89.A N THR 86.A O no hydrogen 3.049 N/A TYR 89.A OH ASP 84.A OD2 no hydrogen 2.326 N/A TRP 90.A N THR 86.A O no hydrogen 3.199 N/A GLU 92.A N GLU 92.A OE2 no hydrogen 2.827 N/A LEU 93.A N TRP 90.A O no hydrogen 2.954 N/A ALA 95.A N GLN 133.A OE1 no hydrogen 2.838 N/A GLN 97.A N GLN 97.A OE1 no hydrogen 2.709 N/A GLN 97.A NE2 GLN 133.A O no hydrogen 2.832 N/A GLN 97.A NE2 TRP 135.A O no hydrogen 2.767 N/A TRP 98.A N ALA 95.A O no hydrogen 3.139 N/A TRP 98.A NE1 TYR 132.A O no hydrogen 2.927 N/A ASN 99.A N LYS 96.A O no hydrogen 3.157 N/A ILE 101.A N TRP 98.A O no hydrogen 2.986 N/A THR 102.A N HIS 105.A ND1 no hydrogen 2.960 N/A THR 102.A OG1 LEU 82.A O no hydrogen 3.462 N/A THR 102.A OG1 HIS 105.A ND1 no hydrogen 3.167 N/A LEU 103.A N ASP 84.A O no hydrogen 3.032 N/A LEU 104.A N LEU 82.A O no hydrogen 2.959 N/A HIS 105.A N THR 102.A OG1 no hydrogen 3.384 N/A LEU 106.A N THR 102.A O no hydrogen 3.216 N/A ALA 107.A N LEU 103.A O no hydrogen 2.881 N/A THR 108.A N LEU 104.A O no hydrogen 3.075 N/A THR 108.A N HIS 105.A O no hydrogen 3.383 N/A THR 108.A OG1 LEU 104.A O no hydrogen 2.697 N/A THR 108.A OG1 THR 110.A OG1 no hydrogen 2.960 N/A THR 110.A N HIS 105.A O no hydrogen 2.969 N/A THR 110.A OG1 THR 108.A OG1 no hydrogen 2.960 N/A VAL 122.A N PRO 119.A O no hydrogen 2.944 N/A LYS 123.A N ASP 127.A OD2 no hydrogen 2.992 N/A SER 124.A N ASP 127.A OD2 no hydrogen 3.013 N/A SER 124.A OG SER 126.A OG no hydrogen 3.140 N/A SER 126.A OG SER 124.A OG no hydrogen 3.140 N/A ASP 127.A N SER 124.A OG no hydrogen 3.023 N/A LEU 128.A N SER 124.A O no hydrogen 2.925 N/A LEU 129.A N SER 125.A O no hydrogen 3.027 N/A ARG 130.A N SER 126.A O no hydrogen 3.102 N/A PHE 131.A N ASP 127.A O no hydrogen 2.966 N/A TYR 132.A N LEU 128.A O no hydrogen 3.121 N/A TYR 132.A OH SER 150.A O no hydrogen 2.612 N/A GLN 133.A N LEU 129.A O no hydrogen 2.855 N/A GLN 133.A NE2 THR 94.A OG1 no hydrogen 3.138 N/A ASN 134.A N ARG 130.A O no hydrogen 2.979 N/A TRP 135.A N PHE 131.A O no hydrogen 3.081 N/A TRP 135.A NE1 GLY 113.A O no hydrogen 3.244 N/A GLN 136.A NE2 ASN 134.A O no hydrogen 3.415 N/A GLN 136.A NE2 TRP 135.A O no hydrogen 3.323 N/A ALA 138.A N GLY 112.A O no hydrogen 3.228 N/A TRP 139.A N GLY 112.A O no hydrogen 3.467 N/A GLY 142.A N THR 110.A O no hydrogen 2.814 N/A THR 143.A OG1 ALA 140.A O no hydrogen 2.812 N/A ARG 145.A N ARG 287.A O no hydrogen 2.728 N/A ARG 145.A NE GLN 264.A OE1 no hydrogen 2.838 N/A ARG 145.A NH2 GLN 264.A OE1 no hydrogen 2.910 N/A LEU 146.A N TYR 109.A O no hydrogen 3.005 N/A ASN 149.A N LEU 116.A O no hydrogen 2.892 N/A SER 150.A OG PRO 115.A O no hydrogen 2.598 N/A SER 151.A N ALA 148.A O no hydrogen 3.284 N/A SER 151.A OG LEU 106.A O no hydrogen 2.690 N/A ILE 152.A N ALA 148.A O no hydrogen 3.311 N/A GLY 153.A N ASN 149.A O no hydrogen 2.816 N/A PHE 155.A N SER 151.A O no hydrogen 3.070 N/A GLY 156.A N ILE 152.A O no hydrogen 2.897 N/A ALA 157.A N GLY 153.A O no hydrogen 3.054 N/A LEU 158.A N LEU 154.A O no hydrogen 2.886 N/A ALA 159.A N PHE 155.A O no hydrogen 2.857 N/A LYS 161.A N LEU 158.A O no hydrogen 3.065 N/A LYS 161.A NZ TYR 89.A O no hydrogen 2.733 N/A SER 163.A N VAL 160.A O no hydrogen 3.165 N/A SER 163.A OG VAL 160.A O no hydrogen 2.648 N/A GLY 164.A N LYS 161.A O no hydrogen 3.246 N/A LEU 165.A N SER 163.A OG no hydrogen 3.050 N/A GLN 169.A N SER 166.A OG no hydrogen 2.995 N/A ALA 170.A N SER 166.A O no hydrogen 2.864 N/A MET 171.A N PHE 167.A O no hydrogen 2.898 N/A GLN 172.A N GLU 168.A O no hydrogen 2.873 N/A THR 173.A N GLN 169.A O no hydrogen 2.885 N/A ARG 174.A N ALA 170.A O no hydrogen 2.895 N/A ARG 174.A NH1 GLU 79.A OE1 no hydrogen 2.709 N/A ARG 174.A NH2 GLU 79.A OE2 no hydrogen 2.897 N/A VAL 175.A N MET 171.A O no hydrogen 3.045 N/A PHE 176.A N MET 171.A O no hydrogen 2.923 N/A GLN 177.A N GLN 172.A O no hydrogen 2.888 N/A LEU 179.A N VAL 175.A O no hydrogen 3.339 N/A LYS 180.A N GLN 177.A O no hydrogen 3.023 N/A LEU 181.A N PHE 176.A O no hydrogen 2.907 N/A HIS 183.A N ASP 226.A OD2 no hydrogen 2.745 N/A THR 184.A OG1 SER 222.A OG no hydrogen 2.755 N/A THR 184.A OG1 ASP 226.A OD2 no hydrogen 2.678 N/A TRP 185.A N LYS 221.A O no hydrogen 2.830 N/A ASN 187.A ND2 GLU 168.A OE2 no hydrogen 3.042 N/A GLU 192.A N PRO 189.A O no hydrogen 2.808 N/A GLU 193.A N PRO 190.A O no hydrogen 3.292 N/A LYS 194.A NZ ALA 191.A O no hydrogen 2.882 N/A ASN 195.A N GLU 192.A O no hydrogen 2.882 N/A TYR 196.A N GLU 193.A O no hydrogen 3.043 N/A TYR 196.A OH GLU 58.A OE2 no hydrogen 2.540 N/A ALA 197.A N LEU 56.A O no hydrogen 2.989 N/A TRP 198.A N ALA 43.A O no hydrogen 2.831 N/A GLY 199.A N VAL 206.A O no hydrogen 2.869 N/A TYR 200.A N GLY 312.A O no hydrogen 3.194 N/A TYR 200.A N ASN 332.A O no hydrogen 3.020 N/A ARG 201.A N LYS 204.A O no hydrogen 3.002 N/A LYS 204.A N ARG 201.A O no hydrogen 3.092 N/A VAL 206.A N GLY 199.A O no hydrogen 2.733 N/A HIS 207.A NE2 ALA 197.A O no hydrogen 2.856 N/A VAL 208.A N GLU 58.A OE2 no hydrogen 2.838 N/A GLY 211.A N ASP 214.A OD2 no hydrogen 3.035 N/A ASP 214.A N GLY 211.A O no hydrogen 3.063 N/A LYS 216.A N LEU 213.A O.A no hydrogen 2.789 N/A LYS 216.A N LEU 213.A O.B no hydrogen 3.116 N/A ALA 217.A N LEU 213.A O.A no hydrogen 2.978 N/A ALA 217.A N LEU 213.A O.B no hydrogen 3.008 N/A TYR 218.A N ASP 214.A O no hydrogen 2.932 N/A VAL 220.A N SER 63.A OG no hydrogen 2.914 N/A LYS 221.A N TRP 185.A O no hydrogen 2.758 N/A LYS 221.A NZ ILE 186.A O no hydrogen 2.906 N/A LYS 221.A NZ GLY 219.A O no hydrogen 2.983 N/A SER 222.A N PHE 57.A O no hydrogen 3.029 N/A SER 222.A OG THR 184.A OG1 no hydrogen 2.755 N/A SER 222.A OG THR 223.A O no hydrogen 3.503 N/A ASP 226.A N THR 223.A OG1 no hydrogen 2.994 N/A MET 227.A N THR 223.A O no hydrogen 2.964 N/A ALA 228.A N ILE 224.A O no hydrogen 2.994 N/A ARG 229.A N GLU 225.A O no hydrogen 3.085 N/A TRP 230.A N ASP 226.A O no hydrogen 2.824 N/A TRP 230.A NE1 THR 65.A OG1 no hydrogen 3.004 N/A VAL 231.A N MET 227.A O no hydrogen 2.956 N/A GLN 232.A N ALA 228.A O no hydrogen 2.919 N/A SER 233.A N ARG 229.A O no hydrogen 2.909 N/A SER 233.A OG ARG 229.A O no hydrogen 2.930 N/A ASN 234.A N TRP 230.A O no hydrogen 3.036 N/A ASN 234.A ND2 TRP 230.A O no hydrogen 2.855 N/A LEU 235.A N VAL 231.A O no hydrogen 2.856 N/A LYS 236.A N GLN 232.A O no hydrogen 3.043 N/A ASP 239.A N LYS 236.A O no hydrogen 3.169 N/A ILE 240.A N PRO 237.A O no hydrogen 3.000 N/A GLU 242.A N GLU 242.A OE1 no hydrogen 2.748 N/A THR 244.A OG1 ASP 73.A OD1 no hydrogen 2.797 N/A GLN 246.A N GLU 242.A O no hydrogen 2.995 N/A GLN 246.A NE2 ILE 240.A O no hydrogen 3.131 N/A GLN 247.A N LYS 243.A O no hydrogen 3.120 N/A GLY 248.A N THR 244.A O no hydrogen 2.795 N/A ILE 249.A N LEU 245.A O no hydrogen 2.884 N/A GLN 250.A N GLN 246.A O no hydrogen 3.184 N/A LEU 251.A N GLN 247.A O no hydrogen 2.843 N/A ALA 252.A N GLY 248.A O no hydrogen 3.003 N/A GLN 253.A N ILE 249.A O no hydrogen 3.324 N/A GLN 253.A N GLN 250.A O no hydrogen 3.232 N/A GLN 253.A NE2 ASN 234.A O no hydrogen 2.972 N/A GLN 253.A NE2 ASN 234.A OD1 no hydrogen 3.473 N/A SER 254.A N LEU 251.A O no hydrogen 3.226 N/A SER 254.A OG GLN 250.A O no hydrogen 3.382 N/A ARG 255.A N THR 296.A O no hydrogen 2.838 N/A ARG 255.A NH1 ASP 272.A OD1 no hydrogen 2.924 N/A ARG 255.A NH2 ASP 272.A OD1 no hydrogen 2.838 N/A ARG 255.A NH2 SER 302.A OG no hydrogen 2.877 N/A TYR 256.A N GLN 264.A O no hydrogen 2.971 N/A TYR 256.A OH LEU 251.A O no hydrogen 2.849 N/A TRP 257.A NE1 THR 108.A OG1 no hydrogen 2.918 N/A GLN 258.A N LYS 290.A O no hydrogen 2.836 N/A GLN 258.A NE2 GLY 260.A O no hydrogen 2.949 N/A THR 259.A N MET 262.A O no hydrogen 2.905 N/A THR 259.A OG1 PRO 288.A O no hydrogen 3.199 N/A MET 262.A N THR 259.A O no hydrogen 3.001 N/A TYR 263.A N MET 270.A O no hydrogen 2.731 N/A TYR 263.A OH ASP 272.A OD2 no hydrogen 3.251 N/A GLN 264.A N TRP 257.A O no hydrogen 2.953 N/A GLN 264.A NE2 GLY 265.A O no hydrogen 3.041 N/A GLY 265.A N TRP 268.A O no hydrogen 2.866 N/A LEU 266.A N ALA 252.A O no hydrogen 2.879 N/A TRP 268.A NE1 ASN 234.A OD1 no hydrogen 2.989 N/A GLU 269.A N HIS 305.A O no hydrogen 3.143 N/A MET 270.A N TYR 263.A O no hydrogen 2.856 N/A LEU 271.A N TRP 303.A O no hydrogen 2.878 N/A TRP 273.A N ALA 301.A O no hydrogen 2.892 N/A ASP 278.A N ASN 276.A OD1 no hydrogen 3.350 N/A SER 279.A N ASN 276.A O no hydrogen 2.845 N/A SER 279.A OG ASP 261.A OD1 no hydrogen 2.712 N/A ILE 280.A N ASN 276.A O no hydrogen 3.253 N/A ARG 287.A N ARG 145.A O no hydrogen 3.052 N/A VAL 289.A N THR 143.A O no hydrogen 3.105 N/A LYS 290.A N GLN 258.A O no hydrogen 2.942 N/A ILE 292.A N TYR 256.A O no hydrogen 3.014 N/A THR 296.A N ARG 255.A O no hydrogen 3.200 N/A SER 302.A N ARG 300.A O no hydrogen 2.913 N/A SER 302.A OG VAL 299.A O no hydrogen 2.663 N/A TRP 303.A N LEU 271.A O no hydrogen 2.779 N/A TRP 303.A NE1 TYR 316.A OH no hydrogen 3.189 N/A VAL 304.A N PHE 319.A O no hydrogen 2.882 N/A HIS 305.A N GLU 269.A O no hydrogen 2.889 N/A HIS 305.A ND1 TYR 316.A OH no hydrogen 2.689 N/A LYS 306.A N VAL 317.A O no hydrogen 2.964 N/A LYS 306.A NZ TYR 147.A OH no hydrogen 2.874 N/A LYS 306.A NZ THR 307.A O no hydrogen 2.866 N/A GLY 308.A N SER 315.A O no hydrogen 2.852 N/A THR 310.A N PHE 313.A O no hydrogen 2.957 N/A THR 310.A OG1 GLU 58.A OE1 no hydrogen 2.725 N/A PHE 313.A N THR 310.A O no hydrogen 3.421 N/A GLY 314.A N ALA 331.A O no hydrogen 3.026 N/A SER 315.A N GLY 308.A O no hydrogen 2.766 N/A SER 315.A OG LEU 59.A O no hydrogen 2.808 N/A TYR 316.A N MET 329.A O no hydrogen 2.902 N/A TYR 316.A OH HIS 305.A ND1 no hydrogen 2.689 N/A VAL 317.A N LYS 306.A O no hydrogen 3.125 N/A ALA 318.A N ILE 327.A O no hydrogen 3.042 N/A PHE 319.A N VAL 304.A O no hydrogen 2.796 N/A ILE 320.A N LEU 325.A O no hydrogen 2.836 N/A GLU 322.A N ARG 300.A O no hydrogen 2.942 N/A LYS 323.A N ILE 320.A O no hydrogen 3.039 N/A GLU 324.A N PRO 321.A O no hydrogen 3.139 N/A LEU 325.A N ILE 320.A O no hydrogen 3.465 N/A GLY 326.A N ILE 30.A O no hydrogen 2.945 N/A ILE 327.A N ALA 318.A O no hydrogen 2.809 N/A VAL 328.A N ALA 28.A O no hydrogen 2.914 N/A MET 329.A N TYR 316.A O no hydrogen 2.820 N/A LEU 330.A N ALA 26.A O no hydrogen 2.861 N/A ALA 331.A N GLY 314.A O no hydrogen 2.971 N/A ASN 332.A N GLY 24.A O no hydrogen 3.221 N/A ASN 332.A ND2 TYR 42.A O no hydrogen 2.876 N/A ASN 332.A ND2 ALA 43.A O no hydrogen 3.576 N/A ASN 332.A ND2 TRP 198.A O no hydrogen 3.058 N/A LYS 333.A NZ GLN 20.A O no hydrogen 2.761 N/A ALA 339.A N PRO 336.A O no hydrogen 3.101 N/A ARG 340.A N PRO 336.A O no hydrogen 3.410 N/A ARG 340.A NE TYR 335.A O no hydrogen 3.111 N/A ARG 340.A NH1 GLY 308.A O no hydrogen 2.701 N/A ARG 340.A NH1 SER 315.A O no hydrogen 2.774 N/A ARG 340.A NH2 TYR 335.A O no hydrogen 2.849 N/A VAL 341.A N ASN 337.A O no hydrogen 3.040 N/A ASP 342.A N PRO 338.A O no hydrogen 2.944 N/A ALA 343.A N ALA 339.A O no hydrogen 3.179 N/A ALA 344.A N ARG 340.A O no hydrogen 2.957 N/A TRP 345.A N VAL 341.A O no hydrogen 2.835 N/A GLN 346.A N ASP 342.A O no hydrogen 3.007 N/A ILE 347.A N ALA 343.A O no hydrogen 3.079 N/A LEU 348.A N ALA 344.A O no hydrogen 2.930 N/A ASN 349.A N TRP 345.A O no hydrogen 2.759 N/A ALA 350.A N GLN 346.A O no hydrogen 3.287 N/A LEU 351.A N LEU 348.A O no hydrogen 3.136 N/A GLN 352.A N ASN 349.A O no hydrogen 3.354 N/A GLN 352.A NE2 ASN 349.A OD1 no hydrogen 3.318 N/A