Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2igt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 9.A NH1 GLU 239.A OE2 no hydrogen 2.993 N/A ARG 9.A NH2 ASP 235.A OD1.A no hydrogen 2.665 N/A ARG 9.A NH2 GLU 239.A OE2 no hydrogen 2.646 N/A ALA 15.A N GLY 272.A O no hydrogen 3.127 N/A HIS 17.A N VAL 274.A O no hydrogen 2.902 N/A VAL 20.A N SER 276.A O no hydrogen 2.755 N/A LEU 22.A N GLU 278.A O no hydrogen 2.926 N/A SER 24.A N VAL 280.A O no hydrogen 2.943 N/A SER 25.A OG.B ARG 282.A O no hydrogen 3.489 N/A PHE 30.A N ALA 27.A O no hydrogen 3.124 N/A HIS 31.A N GLN 43.A O no hydrogen 3.186 N/A ILE 33.A N LEU 41.A O no hydrogen 2.821 N/A ASP 34.A N LEU 41.A O no hydrogen 3.329 N/A SER 35.A OG GLU 283.A OE2 no hydrogen 2.574 N/A GLY 36.A N LEU 39.A O no hydrogen 2.887 N/A ASN 37.A N TRP 58.A O no hydrogen 2.782 N/A GLY 38.A N ALA 56.A O no hydrogen 2.856 N/A LEU 39.A N GLY 36.A O no hydrogen 3.013 N/A LYS 40.A N ARG 51.A O no hydrogen 2.785 N/A LYS 40.A NZ GLU 53.A OE1 no hydrogen 2.683 N/A LEU 41.A N ASP 34.A O no hydrogen 2.836 N/A GLU 42.A N VAL 49.A O no hydrogen 2.819 N/A GLN 43.A N HIS 31.A O no hydrogen 2.880 N/A GLN 43.A NE2 GLY 45.A O no hydrogen 3.009 N/A TYR 44.A N TYR 47.A O no hydrogen 2.924 N/A TYR 44.A OH GLU 42.A OE2 no hydrogen 2.857 N/A GLY 45.A N ASP 29.A O no hydrogen 2.668 N/A TYR 47.A N TYR 44.A O no hydrogen 3.066 N/A ARG 48.A N ASP 71.A OD2 no hydrogen 2.851 N/A ARG 48.A NE GLN 43.A OE1 no hydrogen 2.580 N/A ARG 48.A NH2 GLN 43.A OE1 no hydrogen 3.192 N/A VAL 49.A N GLU 42.A O no hydrogen 2.812 N/A VAL 50.A N ALA 72.A O no hydrogen 2.895 N/A ARG 51.A N LYS 40.A O no hydrogen 3.025 N/A ARG 51.A NE GLU 42.A OE1 no hydrogen 2.793 N/A ARG 51.A NH1 ARG 110.A O.A no hydrogen 2.767 N/A ARG 51.A NH1 ARG 110.A O.B no hydrogen 2.908 N/A ARG 51.A NH2 GLU 42.A OE1 no hydrogen 3.248 N/A ARG 51.A NH2 GLU 42.A OE2 no hydrogen 2.993 N/A GLU 53.A N GLY 38.A O no hydrogen 2.800 N/A ALA 56.A N GLU 53.A O no hydrogen 3.018 N/A LEU 57.A N GLN 55.A O no hydrogen 2.694 N/A TRP 58.A NE1 SER 35.A OG no hydrogen 2.820 N/A LEU 61.A N ASP 34.A OD1 no hydrogen 2.848 N/A VAL 62.A N ASP 34.A OD2 no hydrogen 2.942 N/A VAL 66.A N PRO 63.A O no hydrogen 3.054 N/A TRP 67.A NE1 ASP 34.A OD2 no hydrogen 2.791 N/A GLN 68.A N.A ASP 64.A O.A no hydrogen 2.845 N/A GLN 68.A N.A ASP 64.A O.B no hydrogen 2.754 N/A GLN 68.A N.B ASP 64.A O.A no hydrogen 2.831 N/A GLN 68.A N.B ASP 64.A O.B no hydrogen 2.738 N/A GLN 68.A NE2.B ASP 64.A OD1.B no hydrogen 3.055 N/A ASN 69.A N VAL 66.A O no hydrogen 3.305 N/A ALA 70.A N TRP 67.A O no hydrogen 3.219 N/A ASP 71.A N ARG 48.A O no hydrogen 2.713 N/A ALA 72.A N ARG 48.A O no hydrogen 3.326 N/A ILE 73.A N ARG 83.A O no hydrogen 2.832 N/A PHE 74.A N VAL 50.A O no hydrogen 2.903 N/A THR 75.A N ARG 81.A O no hydrogen 2.975 N/A THR 75.A OG1 ARG 81.A O no hydrogen 2.751 N/A ARG 81.A N THR 75.A O no hydrogen 2.921 N/A ARG 83.A N ILE 73.A O no hydrogen 2.802 N/A LYS 86.A NZ ASN 69.A O no hydrogen 2.844 N/A LYS 86.A NZ ASN 69.A OD1 no hydrogen 3.393 N/A LYS 86.A NZ ASP 71.A OD1 no hydrogen 3.091 N/A TRP 93.A N GLY 104.A O no hydrogen 3.071 N/A TRP 93.A NE1 TYR 44.A O no hydrogen 2.953 N/A LEU 95.A N PHE 102.A O no hydrogen 2.791 N/A SER 96.A N.A ASP 29.A OD2 no hydrogen 2.828 N/A SER 96.A N.B ASP 29.A OD2 no hydrogen 2.826 N/A SER 96.A OG.B VAL 100.A O no hydrogen 3.369 N/A SER 96.A OG.B GLU 101.A OE2.A no hydrogen 3.062 N/A LEU 97.A N VAL 100.A O no hydrogen 3.067 N/A VAL 100.A N LEU 97.A O no hydrogen 2.968 N/A PHE 102.A N LEU 95.A O no hydrogen 2.893 N/A LEU 103.A N ASN 175.A OD1 no hydrogen 2.893 N/A GLY 104.A N TRP 93.A O no hydrogen 2.807 N/A ARG 105.A N VAL 112.A O no hydrogen 2.890 N/A ARG 105.A NH1 GLU 91.A OE2 no hydrogen 2.862 N/A ARG 105.A NH2 GLU 174.A OE1 no hydrogen 3.117 N/A PHE 106.A N GLU 91.A O no hydrogen 2.813 N/A PHE 109.A N THR 107.A OG1 no hydrogen 3.135 N/A ARG 110.A NE.B PRO 52.A O no hydrogen 3.168 N/A ARG 110.A NH1.B PRO 52.A O no hydrogen 2.763 N/A GLU 117.A N GLU 117.A OE1 no hydrogen 2.730 N/A GLN 118.A N PHE 115.A O no hydrogen 2.945 N/A GLN 118.A NE2 TYR 253.A OH.A no hydrogen 3.043 N/A GLN 118.A NE2 TYR 253.A OH.B no hydrogen 3.011 N/A ILE 119.A N PRO 116.A O no hydrogen 3.055 N/A VAL 120.A N GLU 117.A O no hydrogen 3.307 N/A TRP 122.A N GLN 118.A O no hydrogen 2.904 N/A GLU 123.A N.A ILE 119.A O no hydrogen 2.818 N/A GLU 123.A N.B ILE 119.A O no hydrogen 2.828 N/A TRP 124.A N VAL 120.A O no hydrogen 3.197 N/A TRP 124.A NE1 GLU 304.A OE2 no hydrogen 2.787 N/A LEU 125.A N HIS 121.A O no hydrogen 2.896 N/A LYS 126.A N TRP 122.A O no hydrogen 2.732 N/A LYS 126.A NZ GLU 130.A OE1.A no hydrogen 2.875 N/A LYS 126.A NZ GLU 130.A OE1.B no hydrogen 3.069 N/A ASN 127.A N GLU 123.A O.A no hydrogen 2.982 N/A ASN 127.A N GLU 123.A O.B no hydrogen 2.958 N/A ALA 128.A N TRP 124.A O no hydrogen 2.953 N/A VAL 129.A N LEU 125.A O no hydrogen 2.937 N/A GLU 130.A N.A LYS 126.A O no hydrogen 2.831 N/A GLU 130.A N.B LYS 126.A O no hydrogen 2.838 N/A THR 131.A N ASN 127.A O no hydrogen 2.978 N/A THR 131.A OG1 ASN 127.A O no hydrogen 2.682 N/A ALA 132.A N VAL 129.A O no hydrogen 3.321 N/A ARG 134.A NH1 ASP 207.A OD1 no hydrogen 2.779 N/A ARG 134.A NH1 LYS 244.A O no hydrogen 3.077 N/A LYS 137.A N ASP 207.A OD2 no hydrogen 2.788 N/A LYS 137.A NZ THR 205.A O no hydrogen 3.043 N/A VAL 138.A N GLU 158.A O no hydrogen 2.876 N/A LEU 139.A N ILE 208.A O no hydrogen 2.830 N/A ASN 140.A N THR 160.A O no hydrogen 2.873 N/A ASN 140.A ND2 SER 149.A OG no hydrogen 2.813 N/A LEU 141.A N LEU 210.A O no hydrogen 2.790 N/A GLY 143.A N VAL 162.A O no hydrogen 3.030 N/A TYR 144.A N ASP 163.A OD2 no hydrogen 2.818 N/A THR 145.A OG1 GLY 113.A O no hydrogen 2.614 N/A GLY 146.A N GLY 143.A O no hydrogen 2.936 N/A LEU 150.A N GLY 146.A O no hydrogen 2.959 N/A VAL 151.A N VAL 147.A O no hydrogen 2.898 N/A ALA 152.A N ALA 148.A O no hydrogen 2.995 N/A ALA 153.A N SER 149.A O no hydrogen 2.993 N/A ALA 154.A N LEU 150.A O no hydrogen 2.808 N/A ALA 155.A N VAL 151.A O no hydrogen 3.157 N/A GLY 156.A N ALA 153.A O no hydrogen 3.074 N/A ALA 157.A N ALA 152.A O no hydrogen 2.999 N/A GLU 158.A N LEU 136.A O no hydrogen 2.909 N/A VAL 159.A N PRO 185.A O no hydrogen 2.848 N/A THR 160.A N VAL 138.A O no hydrogen 2.877 N/A HIS 161.A N ARG 187.A O.A no hydrogen 2.822 N/A HIS 161.A N ARG 187.A O.B no hydrogen 2.801 N/A VAL 162.A N ASN 140.A O no hydrogen 2.913 N/A ASP 163.A N ILE 189.A O no hydrogen 3.043 N/A SER 165.A N ASP 163.A OD1 no hydrogen 2.898 N/A ALA 168.A N SER 165.A OG no hydrogen 3.041 N/A ILE 169.A N SER 165.A O no hydrogen 2.960 N/A GLY 170.A N LYS 166.A O no hydrogen 2.892 N/A TRP 171.A N LYS 167.A O no hydrogen 3.029 N/A ALA 172.A N ALA 168.A O no hydrogen 2.939 N/A LYS 173.A N ILE 169.A O no hydrogen 2.931 N/A GLU 174.A N GLY 170.A O no hydrogen 2.993 N/A ASN 175.A N TRP 171.A O no hydrogen 3.032 N/A ASN 175.A ND2 THR 145.A O no hydrogen 3.036 N/A GLN 176.A N ALA 172.A O no hydrogen 2.805 N/A GLN 176.A NE2 LEU 181.A O no hydrogen 2.901 N/A VAL 177.A N LYS 173.A O no hydrogen 2.966 N/A LEU 178.A N GLU 174.A O no hydrogen 3.060 N/A ALA 179.A N ASN 175.A O no hydrogen 2.812 N/A GLY 180.A N VAL 177.A O no hydrogen 3.038 N/A LEU 181.A N GLN 176.A O no hydrogen 2.921 N/A ALA 184.A N LEU 181.A O no hydrogen 2.998 N/A ILE 186.A N ALA 184.A O no hydrogen 2.827 N/A ARG 187.A N.A VAL 159.A O no hydrogen 2.755 N/A ARG 187.A N.B VAL 159.A O no hydrogen 2.739 N/A ARG 187.A NE.A THR 160.A OG1 no hydrogen 3.062 N/A ARG 187.A NH2.A THR 160.A OG1 no hydrogen 3.046 N/A TRP 188.A NE1 GLN 176.A OE1 no hydrogen 3.064 N/A ILE 189.A N HIS 161.A O no hydrogen 2.752 N/A CYS 190.A SG ASP 163.A O no hydrogen 3.803 N/A CYS 190.A SG ALA 164.A O no hydrogen 3.538 N/A LYS 194.A NZ GLU 223.A OE2 no hydrogen 2.627 N/A PHE 195.A N ASP 192.A O no hydrogen 3.011 N/A ILE 196.A N ALA 193.A O no hydrogen 3.055 N/A ARG 198.A N LYS 194.A O no hydrogen 2.986 N/A GLU 199.A N PHE 195.A O no hydrogen 2.824 N/A GLU 200.A N ILE 196.A O no hydrogen 2.848 N/A ARG 201.A N.A GLN 197.A O no hydrogen 2.938 N/A ARG 201.A N.B GLN 197.A O no hydrogen 2.967 N/A ARG 202.A N ARG 198.A O no hydrogen 2.933 N/A ARG 202.A NE GLU 199.A OE2 no hydrogen 2.887 N/A ARG 202.A NH1 GLU 199.A OE2 no hydrogen 2.858 N/A GLY 203.A N GLU 200.A O no hydrogen 3.046 N/A SER 204.A N GLU 199.A O no hydrogen 2.975 N/A SER 204.A OG GLU 199.A OE1 no hydrogen 3.531 N/A TYR 206.A N ILE 240.A O no hydrogen 2.804 N/A TYR 206.A OH GLU 199.A OE1 no hydrogen 2.552 N/A ASP 207.A N LYS 137.A O no hydrogen 2.773 N/A ILE 208.A N LYS 137.A O no hydrogen 3.096 N/A ILE 209.A N GLY 247.A O no hydrogen 3.063 N/A LEU 210.A N LEU 139.A O no hydrogen 2.791 N/A THR 211.A N VAL 249.A O no hydrogen 2.851 N/A ASP 212.A N LEU 141.A O no hydrogen 3.202 N/A GLY 217.A N TRP 225.A O no hydrogen 2.877 N/A ARG 218.A NE GLY 222.A O no hydrogen 3.515 N/A GLY 219.A N GLU 223.A O no hydrogen 2.786 N/A THR 220.A OG1 ALA 164.A O no hydrogen 3.066 N/A HIS 221.A N GLU 223.A OE1 no hydrogen 2.831 N/A GLY 222.A N GLY 219.A O no hydrogen 3.042 N/A GLU 223.A N GLU 223.A OE1 no hydrogen 2.883 N/A TRP 225.A N GLY 217.A O no hydrogen 2.850 N/A TRP 225.A NE1 PRO 214.A O no hydrogen 2.902 N/A GLN 226.A N.A HIS 230.A ND1 no hydrogen 3.022 N/A GLN 226.A N.B HIS 230.A ND1 no hydrogen 3.009 N/A LEU 227.A N LYS 215.A O no hydrogen 2.912 N/A ASP 229.A N GLN 226.A O.A no hydrogen 2.862 N/A ASP 229.A N GLN 226.A O.B no hydrogen 3.095 N/A HIS 230.A N GLN 226.A O.A no hydrogen 2.921 N/A HIS 230.A N GLN 226.A O.B no hydrogen 2.916 N/A HIS 230.A N LEU 227.A O no hydrogen 3.312 N/A LEU 231.A N LEU 227.A O no hydrogen 2.894 N/A ASP 235.A N.A PRO 232.A O no hydrogen 3.119 N/A ASP 235.A N.B PRO 232.A O no hydrogen 3.111 N/A ILE 236.A N LEU 233.A O no hydrogen 2.926 N/A ARG 238.A N LEU 234.A O no hydrogen 2.868 N/A ARG 238.A NH1 THR 267.A O no hydrogen 2.767 N/A ARG 238.A NH1 ARG 268.A O no hydrogen 2.769 N/A ARG 238.A NH2 ARG 268.A O no hydrogen 3.180 N/A GLU 239.A N ASP 235.A O.A no hydrogen 3.129 N/A GLU 239.A N ASP 235.A O.B no hydrogen 3.113 N/A ILE 240.A N ILE 236.A O no hydrogen 3.035 N/A ILE 240.A N CYS 237.A O no hydrogen 3.058 N/A LEU 241.A N ARG 238.A O no hydrogen 3.136 N/A SER 242.A N TYR 206.A O no hydrogen 2.814 N/A SER 242.A OG TYR 206.A O no hydrogen 3.495 N/A SER 242.A OG ASP 207.A OD1 no hydrogen 2.710 N/A ALA 245.A N SER 242.A O no hydrogen 3.057 N/A LEU 246.A N ASP 207.A O no hydrogen 2.762 N/A GLY 247.A N ASP 207.A O no hydrogen 3.398 N/A LEU 248.A N TRP 303.A O no hydrogen 2.968 N/A VAL 249.A N ILE 209.A O no hydrogen 2.771 N/A LEU 250.A N SER 301.A O no hydrogen 2.850 N/A THR 251.A N THR 211.A O no hydrogen 2.919 N/A THR 251.A OG1 THR 211.A O no hydrogen 3.467 N/A THR 251.A OG1 ASP 212.A OD1 no hydrogen 2.735 N/A ALA 252.A N LEU 299.A O no hydrogen 3.010 N/A TYR 253.A OH.A GLU 117.A OE2 no hydrogen 2.919 N/A TYR 253.A OH.B GLU 117.A OE2 no hydrogen 2.459 N/A SER 254.A OG.A TYR 253.A O.B no hydrogen 3.061 N/A SER 254.A OG.B TYR 253.A O.B no hydrogen 2.791 N/A ILE 255.A N.A TYR 253.A O.A no hydrogen 2.721 N/A ALA 257.A N.A SER 254.A O.A no hydrogen 3.218 N/A TYR 260.A N SER 258.A OG no hydrogen 2.949 N/A SER 261.A N.A SER 258.A O no hydrogen 2.995 N/A SER 261.A N.B SER 258.A O no hydrogen 3.001 N/A HIS 262.A ND1 SER 276.A OG no hydrogen 2.704 N/A HIS 262.A NE2 GLU 16.A OE1 no hydrogen 2.692 N/A GLU 263.A N TYR 260.A O no hydrogen 2.876 N/A LEU 264.A N SER 261.A O.A no hydrogen 3.222 N/A LEU 264.A N SER 261.A O.B no hydrogen 3.023 N/A ARG 265.A NH2 PRO 14.A O no hydrogen 2.517 N/A GLU 266.A N GLU 263.A O no hydrogen 2.977 N/A THR 267.A N LEU 264.A O no hydrogen 2.874 N/A THR 267.A OG1 LEU 264.A O no hydrogen 2.727 N/A ARG 268.A NE GLU 266.A OE2 no hydrogen 2.958 N/A ARG 268.A NH1 GLY 11.A O no hydrogen 2.808 N/A ARG 268.A NH2 GLU 266.A OE1 no hydrogen 3.012 N/A GLY 269.A N GLU 12.A O no hydrogen 2.698 N/A VAL 273.A N GLU 304.A O no hydrogen 2.784 N/A VAL 274.A N ALA 15.A O no hydrogen 2.883 N/A ALA 275.A N ARG 302.A O no hydrogen 2.890 N/A SER 276.A N HIS 17.A O no hydrogen 3.139 N/A SER 276.A OG HIS 262.A ND1 no hydrogen 2.704 N/A SER 276.A OG SER 301.A OG no hydrogen 2.770 N/A GLY 277.A N PHE 300.A O no hydrogen 3.037 N/A LEU 279.A N SER 298.A O no hydrogen 2.968 N/A VAL 280.A N LEU 22.A O no hydrogen 2.798 N/A ILE 281.A N LEU 295.A O no hydrogen 2.869 N/A ARG 282.A N SER 24.A O no hydrogen 2.970 N/A ARG 282.A NE GLU 23.A OE1 no hydrogen 3.359 N/A ARG 282.A NE GLU 23.A OE2 no hydrogen 2.637 N/A ARG 282.A NH1 GLY 292.A O no hydrogen 2.864 N/A ARG 282.A NH2 GLU 23.A OE1 no hydrogen 3.050 N/A GLU 283.A N ARG 293.A O no hydrogen 2.994 N/A ALA 284.A N LEU 32.A O no hydrogen 2.627 N/A LYS 289.A NZ.A SER 25.A O.A no hydrogen 2.667 N/A LYS 289.A NZ.A SER 25.A O.B no hydrogen 2.537 N/A LYS 289.A NZ.A GLY 26.A O no hydrogen 2.517 N/A THR 290.A N.A ALA 284.A O no hydrogen 3.040 N/A THR 290.A N.B ALA 284.A O no hydrogen 3.084 N/A THR 290.A OG1.A ASP 287.A OD2.B no hydrogen 2.556 N/A THR 290.A OG1.A GLY 288.A O.A no hydrogen 2.980 N/A GLY 292.A N GLU 283.A O no hydrogen 3.268 N/A ARG 293.A N GLU 283.A OE1 no hydrogen 2.965 N/A ARG 293.A NE GLU 283.A OE1 no hydrogen 2.754 N/A ARG 293.A NH1 ARG 59.A O.A no hydrogen 2.757 N/A ARG 293.A NH1 ARG 59.A O.B no hydrogen 2.813 N/A ARG 293.A NH2 ARG 59.A O.A no hydrogen 2.859 N/A ARG 293.A NH2 ARG 59.A O.B no hydrogen 3.057 N/A ARG 293.A NH2 GLU 283.A OE1 no hydrogen 3.511 N/A ARG 293.A NH2 GLU 283.A OE2 no hydrogen 3.071 N/A LEU 295.A N ILE 281.A O no hydrogen 2.766 N/A SER 296.A OG GLU 278.A OE1 no hydrogen 2.676 N/A THR 297.A N LEU 279.A O no hydrogen 2.931 N/A THR 297.A OG1 GLU 117.A OE2 no hydrogen 3.417 N/A THR 297.A OG1 LEU 279.A O no hydrogen 2.971 N/A THR 297.A OG1 SER 298.A OG no hydrogen 2.885 N/A SER 298.A OG THR 297.A OG1 no hydrogen 2.885 N/A LEU 299.A N ALA 252.A O no hydrogen 2.810 N/A PHE 300.A N GLY 277.A O no hydrogen 3.015 N/A SER 301.A N LEU 250.A O no hydrogen 2.931 N/A SER 301.A OG SER 276.A OG no hydrogen 2.770 N/A ARG 302.A N ALA 275.A O no hydrogen 2.800 N/A TRP 303.A N LEU 248.A O no hydrogen 2.908 N/A TRP 303.A NE1 GLY 271.A O no hydrogen 2.881 N/A GLU 304.A N VAL 273.A O no hydrogen 2.920 N/A