Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3tux_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N PRO 30.A O no hydrogen 3.202 N/A LEU 5.A N THR 32.A O no hydrogen 2.709 N/A GLY 7.A N THR 34.A O no hydrogen 2.730 N/A ALA 8.A N ASP 6.A OD1 no hydrogen 3.035 N/A GLN 9.A N ASP 6.A O no hydrogen 2.967 N/A GLY 12.A N GLN 9.A O no hydrogen 2.968 N/A GLN 15.A NE2 GLN 15.A O no hydrogen 3.115 N/A GLN 15.A NE2 SER 19.A OG no hydrogen 2.895 N/A GLN 15.A NE2 GLN 101.A OE1 no hydrogen 3.199 N/A GLN 15.A NE2 ASN 310.A OD1 no hydrogen 3.541 N/A ARG 18.A N GLY 14.A O no hydrogen 3.087 N/A ARG 18.A NE GLN 101.A OE1 no hydrogen 2.921 N/A ARG 18.A NH1 GLN 48.A OE1 no hydrogen 3.188 N/A ARG 18.A NH2 GLN 15.A OE1 no hydrogen 2.993 N/A SER 19.A N GLN 15.A O no hydrogen 2.964 N/A SER 19.A OG GLN 15.A O no hydrogen 3.321 N/A SER 19.A OG ASN 310.A OD1 no hydrogen 2.554 N/A ALA 20.A N ILE 16.A O no hydrogen 2.913 N/A LEU 21.A N LEU 17.A O no hydrogen 2.928 N/A SER 22.A N ARG 18.A O no hydrogen 3.188 N/A SER 22.A OG ARG 18.A O no hydrogen 3.070 N/A SER 22.A OG THR 102.A O no hydrogen 2.647 N/A LEU 23.A N SER 19.A O no hydrogen 3.075 N/A SER 24.A N ALA 20.A O no hydrogen 2.777 N/A SER 24.A OG GLN 29.A O no hydrogen 2.688 N/A MET 25.A N LEU 21.A O no hydrogen 2.943 N/A ILE 26.A N SER 22.A O no hydrogen 2.980 N/A THR 27.A N LEU 23.A O no hydrogen 2.904 N/A THR 27.A OG1 LEU 23.A O no hydrogen 2.764 N/A THR 27.A OG1 GLN 29.A OE1 no hydrogen 3.233 N/A GLY 28.A N SER 24.A O no hydrogen 2.772 N/A GLN 29.A N THR 27.A OG1 no hydrogen 3.175 N/A PHE 31.A N PHE 76.A O no hydrogen 3.054 N/A THR 32.A N ILE 3.A O no hydrogen 2.755 N/A ILE 33.A N LEU 74.A O no hydrogen 2.873 N/A THR 34.A N LEU 5.A O no hydrogen 3.249 N/A ILE 36.A N GLN 72.A O no hydrogen 2.959 N/A ARG 37.A NH1 LYS 42.A O no hydrogen 2.576 N/A ARG 37.A NH1 GLY 44.A O no hydrogen 2.856 N/A ARG 37.A NH2 LYS 42.A O no hydrogen 3.448 N/A ARG 40.A N ARG 37.A O no hydrogen 3.254 N/A ARG 40.A NH1 GLU 11.A O no hydrogen 2.851 N/A ARG 40.A NH2 GLU 11.A O no hydrogen 2.950 N/A GLY 44.A N ILE 36.A O no hydrogen 3.153 N/A LEU 45.A N SER 71.A O no hydrogen 3.007 N/A LEU 46.A N HIS 49.A ND1 no hydrogen 2.994 N/A LEU 50.A N LEU 46.A O no hydrogen 2.920 N/A THR 51.A N ARG 47.A O no hydrogen 2.948 N/A THR 51.A OG1 ARG 47.A O no hydrogen 2.765 N/A ALA 52.A N GLN 48.A O no hydrogen 2.958 N/A VAL 53.A N HIS 49.A O no hydrogen 2.931 N/A LYS 54.A N LEU 50.A O no hydrogen 2.765 N/A ALA 55.A N THR 51.A O no hydrogen 2.862 N/A ALA 56.A N ALA 52.A O no hydrogen 2.953 N/A THR 57.A N VAL 53.A O no hydrogen 2.906 N/A THR 57.A OG1 VAL 53.A O no hydrogen 2.671 N/A GLU 58.A N LYS 54.A O no hydrogen 2.907 N/A ILE 59.A N ALA 55.A O no hydrogen 2.944 N/A CYS 60.A N ALA 56.A O no hydrogen 3.150 N/A CYS 60.A SG ALA 56.A O no hydrogen 3.283 N/A ALA 62.A N THR 57.A O no hydrogen 3.055 N/A THR 63.A N ARG 77.A O no hydrogen 2.820 N/A GLU 65.A N LEU 75.A O no hydrogen 2.871 N/A GLY 70.A N LEU 45.A O no hydrogen 2.868 N/A SER 71.A N GLU 68.A O no hydrogen 3.008 N/A SER 71.A OG GLY 66.A O no hydrogen 2.838 N/A SER 71.A OG ARG 73.A O no hydrogen 2.993 N/A ARG 73.A N SER 71.A OG no hydrogen 3.330 N/A ARG 73.A NH1 GLU 65.A OE1 no hydrogen 2.996 N/A ARG 73.A NH2 GLU 65.A OE1 no hydrogen 3.511 N/A LEU 74.A N ILE 33.A O no hydrogen 2.967 N/A LEU 75.A N GLU 65.A O no hydrogen 3.015 N/A PHE 76.A N PHE 31.A O no hydrogen 2.926 N/A ARG 77.A N THR 63.A O no hydrogen 2.789 N/A ARG 82.A N ILE 59.A O no hydrogen 2.930 N/A GLY 84.A N SER 114.A OG no hydrogen 3.108 N/A TYR 86.A N ARG 115.A O no hydrogen 2.824 N/A TYR 86.A OH ARG 82.A O no hydrogen 2.690 N/A PHE 88.A N GLU 117.A O no hydrogen 2.822 N/A ILE 90.A N SER 119.A O no hydrogen 2.975 N/A GLY 94.A N SER 92.A OG no hydrogen 3.086 N/A CYS 96.A N GLY 121.A O no hydrogen 3.034 N/A CYS 96.A SG VAL 118.A O no hydrogen 3.413 N/A CYS 96.A SG GLY 121.A O no hydrogen 3.384 N/A THR 97.A OG1 SER 95.A OG no hydrogen 2.981 N/A THR 97.A OG1 PRO 128.A O no hydrogen 2.646 N/A LEU 98.A N SER 95.A OG no hydrogen 3.144 N/A VAL 99.A N SER 95.A O no hydrogen 3.447 N/A LEU 100.A N CYS 96.A O no hydrogen 3.030 N/A GLN 101.A N THR 97.A O no hydrogen 2.723 N/A THR 102.A N LEU 98.A O no hydrogen 3.254 N/A THR 102.A N VAL 99.A O no hydrogen 3.058 N/A THR 102.A OG1 LEU 98.A O no hydrogen 2.816 N/A VAL 103.A N LEU 100.A O no hydrogen 3.124 N/A LEU 104.A N LEU 100.A O no hydrogen 2.987 N/A LEU 107.A N VAL 103.A O no hydrogen 3.404 N/A TRP 108.A N LEU 104.A O no hydrogen 3.220 N/A TRP 108.A N PRO 105.A O no hydrogen 3.213 N/A TRP 108.A NE1 GLN 148.A OE1 no hydrogen 2.972 N/A PHE 109.A N ALA 106.A O no hydrogen 3.132 N/A ALA 110.A N LEU 107.A O no hydrogen 3.377 N/A SER 114.A N VAL 169.A O no hydrogen 2.942 N/A ARG 115.A N GLY 84.A O no hydrogen 3.002 N/A ARG 115.A NH1 GLU 117.A OE1 no hydrogen 2.977 N/A ARG 115.A NH2 GLU 117.A OE1 no hydrogen 3.270 N/A VAL 116.A N THR 167.A O no hydrogen 2.970 N/A GLU 117.A N TYR 86.A O no hydrogen 2.908 N/A VAL 118.A N VAL 165.A O no hydrogen 2.935 N/A SER 119.A N PHE 88.A O no hydrogen 2.864 N/A GLY 120.A N GLY 163.A O no hydrogen 2.928 N/A GLY 121.A N GLY 94.A O no hydrogen 2.677 N/A THR 122.A N GLY 156.A O no hydrogen 3.039 N/A THR 122.A OG1 ASP 123.A OD1 no hydrogen 2.621 N/A THR 122.A OG1 GLY 156.A O no hydrogen 3.368 N/A ASN 124.A ND2 ALA 93.A O no hydrogen 2.722 N/A ILE 133.A N PRO 129.A O no hydrogen 3.097 N/A ARG 134.A N ALA 130.A O no hydrogen 2.852 N/A ARG 134.A NH2 ASP 131.A OD1 no hydrogen 2.565 N/A ARG 135.A N ASP 131.A O no hydrogen 2.829 N/A ARG 135.A NE GLU 237.A OE1 no hydrogen 2.805 N/A ARG 135.A NH2 GLU 237.A OE2 no hydrogen 2.888 N/A VAL 136.A N PHE 132.A O no hydrogen 2.876 N/A LEU 137.A N PHE 132.A O no hydrogen 3.194 N/A GLU 138.A N ILE 133.A O no hydrogen 2.796 N/A LEU 140.A N LEU 137.A O no hydrogen 2.921 N/A LEU 141.A N LEU 137.A O no hydrogen 2.870 N/A ALA 142.A N GLU 138.A O no hydrogen 2.912 N/A LYS 143.A N PRO 139.A O no hydrogen 3.355 N/A ILE 144.A N LEU 140.A O no hydrogen 3.163 N/A ILE 144.A N LEU 141.A O no hydrogen 2.971 N/A GLY 145.A N ALA 142.A O no hydrogen 3.052 N/A ILE 146.A N LEU 141.A O no hydrogen 2.918 N/A GLN 148.A NE2 GLU 138.A OE2 no hydrogen 2.809 N/A GLN 149.A N GLU 168.A O no hydrogen 2.788 N/A THR 150.A N GLU 138.A OE1 no hydrogen 2.872 N/A THR 150.A OG1 GLU 138.A OE2 no hydrogen 2.620 N/A THR 150.A OG1 THR 167.A OG1 no hydrogen 2.613 N/A THR 151.A N ALA 166.A O no hydrogen 2.877 N/A LEU 153.A N VAL 164.A O no hydrogen 2.732 N/A ARG 154.A N VAL 164.A O no hydrogen 3.224 N/A HIS 155.A ND1 ASP 123.A OD1 no hydrogen 2.984 N/A GLY 156.A N THR 122.A OG1 no hydrogen 2.837 N/A PHE 157.A N GLN 228.A O no hydrogen 3.383 N/A GLY 161.A N PHE 157.A O no hydrogen 2.810 N/A GLY 163.A N GLY 120.A O no hydrogen 2.796 N/A VAL 164.A N ARG 154.A O no hydrogen 2.891 N/A VAL 165.A N VAL 118.A O no hydrogen 3.028 N/A ALA 166.A N THR 151.A O no hydrogen 2.995 N/A THR 167.A N VAL 116.A O no hydrogen 2.852 N/A THR 167.A OG1 THR 150.A OG1 no hydrogen 2.613 N/A GLU 168.A N GLN 149.A O no hydrogen 2.901 N/A VAL 169.A N SER 114.A O no hydrogen 2.987 N/A SER 170.A N HIS 147.A O no hydrogen 3.047 N/A VAL 172.A N TRP 108.A O no hydrogen 2.870 N/A ASN 176.A N ILE 144.A O no hydrogen 2.786 N/A GLN 179.A NE2 GLU 297.A OE1 no hydrogen 3.076 N/A LEU 180.A N GLU 297.A O no hydrogen 2.954 N/A ARG 183.A N THR 275.A O no hydrogen 2.903 N/A ARG 183.A NH1 SER 274.A O no hydrogen 2.472 N/A ARG 183.A NH1 ALA 276.A O no hydrogen 3.384 N/A ARG 183.A NH2 LEU 272.A O no hydrogen 3.028 N/A ARG 183.A NH2 SER 274.A O no hydrogen 2.949 N/A ASN 185.A ND2 GLU 241.A OE2 no hydrogen 3.189 N/A VAL 187.A N GLU 239.A O no hydrogen 2.685 N/A GLN 188.A N GLU 239.A O no hydrogen 3.120 N/A ARG 190.A N GLU 237.A O no hydrogen 2.899 N/A ARG 190.A NE GLU 237.A OE2 no hydrogen 3.320 N/A ARG 190.A NH1 GLN 188.A OE1 no hydrogen 2.934 N/A ARG 190.A NH1 GLU 239.A OE1 no hydrogen 3.033 N/A ARG 190.A NH2 GLU 237.A OE2 no hydrogen 2.516 N/A GLY 191.A N GLU 218.A O no hydrogen 3.064 N/A GLU 192.A N SER 235.A O no hydrogen 2.869 N/A VAL 193.A N ASN 220.A O no hydrogen 2.849 N/A LEU 194.A N THR 233.A O no hydrogen 2.913 N/A LEU 195.A N HIS 222.A O no hydrogen 2.894 N/A ALA 196.A N GLY 231.A O no hydrogen 2.881 N/A VAL 202.A N PRO 199.A O no hydrogen 3.026 N/A ALA 203.A N ARG 200.A O no hydrogen 3.198 N/A ARG 205.A N HIS 201.A O no hydrogen 3.135 N/A ARG 205.A NH1 GLU 258.A OE1 no hydrogen 2.874 N/A GLU 206.A N VAL 202.A O no hydrogen 3.095 N/A ILE 207.A N ALA 203.A O no hydrogen 3.021 N/A ALA 208.A N GLU 204.A O no hydrogen 2.988 N/A THR 209.A N ARG 205.A O no hydrogen 3.319 N/A THR 209.A OG1 ARG 205.A O no hydrogen 3.120 N/A LEU 210.A N GLU 206.A O no hydrogen 3.270 N/A ALA 211.A N ILE 207.A O no hydrogen 2.872 N/A GLY 212.A N ALA 208.A O no hydrogen 3.006 N/A SER 213.A N LEU 210.A O no hydrogen 3.224 N/A PHE 214.A N LEU 210.A O no hydrogen 2.867 N/A HIS 217.A N MET 189.A O no hydrogen 2.784 N/A ASN 220.A N GLY 191.A O no hydrogen 2.966 N/A ASN 220.A ND2 GLU 218.A OE1 no hydrogen 3.127 N/A HIS 222.A N VAL 193.A O no hydrogen 2.803 N/A LEU 224.A N LEU 195.A O no hydrogen 2.871 N/A ARG 226.A NH1 ASN 223.A OD1 no hydrogen 2.815 N/A ARG 226.A NH2 ASN 223.A OD1 no hydrogen 3.468 N/A GLN 228.A N PRO 225.A O no hydrogen 3.067 N/A GLY 229.A N ARG 226.A O no hydrogen 3.140 N/A GLY 231.A N ALA 196.A O no hydrogen 2.779 N/A ASN 232.A ND2 GLU 206.A OE2 no hydrogen 2.744 N/A THR 233.A N LEU 194.A O no hydrogen 3.121 N/A VAL 234.A N VAL 249.A O no hydrogen 2.934 N/A SER 235.A N GLU 192.A O no hydrogen 2.791 N/A LEU 236.A N PHE 247.A O no hydrogen 2.846 N/A GLU 237.A N ARG 190.A O no hydrogen 2.812 N/A VAL 238.A N GLU 245.A O no hydrogen 2.785 N/A GLU 239.A N GLN 188.A O no hydrogen 2.737 N/A SER 240.A N ILE 243.A O no hydrogen 2.688 N/A GLU 241.A N ASN 185.A O no hydrogen 2.710 N/A ASN 242.A N ARG 183.A O no hydrogen 3.372 N/A ASN 242.A ND2 GLU 182.A O no hydrogen 2.761 N/A GLU 245.A N VAL 238.A O no hydrogen 2.870 N/A ARG 246.A N GLU 245.A OE2 no hydrogen 2.923 N/A ARG 246.A NH1 GLU 237.A OE1 no hydrogen 2.642 N/A ARG 246.A NH2 GLU 192.A OE2 no hydrogen 3.011 N/A PHE 247.A N LEU 236.A O no hydrogen 2.811 N/A VAL 249.A N VAL 234.A O no hydrogen 2.844 N/A GLY 251.A N ASN 232.A O no hydrogen 2.945 N/A VAL 255.A N GLU 252.A O no hydrogen 3.288 N/A VAL 260.A N SER 256.A O no hydrogen 3.192 N/A ALA 261.A N ALA 257.A O no hydrogen 3.125 N/A ALA 262.A N VAL 259.A O no hydrogen 3.005 N/A GLN 263.A N VAL 259.A O no hydrogen 3.026 N/A VAL 265.A N ALA 261.A O no hydrogen 3.043 N/A LYS 266.A N ALA 262.A O no hydrogen 2.993 N/A GLU 267.A N GLN 263.A O no hydrogen 3.111 N/A VAL 268.A N LEU 264.A O no hydrogen 2.874 N/A LYS 269.A N VAL 265.A O no hydrogen 2.946 N/A ARG 270.A N LYS 266.A O no hydrogen 2.992 N/A TYR 271.A N GLU 267.A O no hydrogen 3.187 N/A TYR 271.A OH ALA 277.A O no hydrogen 2.728 N/A LEU 272.A N VAL 268.A O no hydrogen 2.976 N/A ALA 273.A N LYS 269.A O no hydrogen 2.824 N/A SER 274.A N TYR 271.A O no hydrogen 3.352 N/A ALA 276.A N SER 274.A OG no hydrogen 3.040 N/A ALA 277.A N THR 299.A OG1 no hydrogen 3.018 N/A VAL 278.A N THR 299.A O no hydrogen 3.144 N/A GLY 279.A N GLU 245.A OE1 no hydrogen 2.797 N/A ALA 283.A N GLY 279.A O no hydrogen 3.190 N/A GLN 285.A N TYR 281.A O no hydrogen 3.354 N/A GLN 285.A N LEU 282.A O no hydrogen 2.902 N/A GLN 285.A NE2 TYR 281.A O no hydrogen 3.262 N/A LEU 286.A N ALA 283.A O no hydrogen 3.276 N/A MET 290.A N LEU 286.A O no hydrogen 3.067 N/A ALA 291.A N VAL 287.A O no hydrogen 2.967 N/A LEU 292.A N LEU 288.A O no hydrogen 2.881 N/A ALA 293.A N PRO 289.A O no hydrogen 3.029 N/A GLY 294.A N MET 290.A O no hydrogen 2.979 N/A GLY 294.A N ALA 291.A O no hydrogen 3.136 N/A GLU 297.A N LEU 178.A O no hydrogen 3.158 N/A PHE 298.A N VAL 333.A O no hydrogen 2.975 N/A THR 299.A OG1 GLY 181.A O no hydrogen 2.685 N/A VAL 300.A N THR 331.A O no hydrogen 2.913 N/A LEU 307.A N SER 304.A OG no hydrogen 3.028 N/A LEU 308.A N SER 304.A O no hydrogen 3.024 N/A THR 309.A N SER 305.A O no hydrogen 2.747 N/A THR 309.A OG1 SER 305.A O no hydrogen 3.105 N/A ASN 310.A N ASN 306.A O no hydrogen 2.890 N/A ASN 310.A ND2 ASP 284.A O no hydrogen 2.806 N/A ILE 311.A N LEU 307.A O no hydrogen 2.976 N/A ALA 312.A N LEU 308.A O no hydrogen 2.958 N/A VAL 313.A N THR 309.A O no hydrogen 2.869 N/A VAL 314.A N ASN 310.A O no hydrogen 2.929 N/A GLU 315.A N ILE 311.A O no hydrogen 2.958 N/A ARG 316.A N ALA 312.A O no hydrogen 3.152 N/A ARG 316.A N VAL 313.A O no hydrogen 3.111 N/A ARG 316.A NH1 ALA 4.A O no hydrogen 3.449 N/A PHE 317.A N VAL 313.A O no hydrogen 3.197 N/A PHE 317.A N VAL 314.A O no hydrogen 3.124 N/A LEU 318.A N VAL 314.A O no hydrogen 2.800 N/A ARG 321.A NH1 LEU 318.A O no hydrogen 3.020 N/A ARG 321.A NH1 VAL 320.A O no hydrogen 2.651 N/A PHE 322.A N GLU 315.A OE2 no hydrogen 2.927 N/A SER 323.A N SER 334.A O no hydrogen 2.803 N/A SER 323.A OG.A SER 334.A O no hydrogen 3.455 N/A ILE 325.A N ARG 332.A O no hydrogen 3.052 N/A THR 327.A N VAL 330.A O no hydrogen 2.790 N/A GLY 329.A N GLU 326.A OE2 no hydrogen 3.117 N/A VAL 330.A N THR 327.A O no hydrogen 3.228 N/A THR 331.A N VAL 300.A O no hydrogen 2.854 N/A ARG 332.A N ILE 325.A O no hydrogen 2.796 N/A ARG 332.A NE GLU 297.A OE2 no hydrogen 2.797 N/A ARG 332.A NH2 GLU 297.A OE1 no hydrogen 2.815 N/A ARG 332.A NH2 GLU 297.A OE2 no hydrogen 3.496 N/A VAL 333.A N PHE 298.A O no hydrogen 2.813 N/A SER 334.A N SER 323.A O no hydrogen 2.939 N/A SER 334.A OG SER 323.A OG.A no hydrogen 2.525 N/A ILE 335.A N GLY 296.A O no hydrogen 3.000 N/A GLU 336.A N ARG 321.A O no hydrogen 2.842 N/A