Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ixs_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 6.A N GLU 10.A OE2 no hydrogen 3.007 N/A LEU 8.A N GLU 58.A OE2 no hydrogen 3.190 N/A GLU 10.A N THR 7.A OG1 no hydrogen 2.768 N/A TYR 11.A N LEU 8.A O no hydrogen 2.995 N/A TYR 11.A OH GLY 47.A O no hydrogen 2.870 N/A GLN 14.A NE2 GLU 163.A O no hydrogen 2.875 N/A ARG 16.A NH1 HIS 161.A O no hydrogen 3.094 N/A ARG 16.A NH2 HIS 161.A O no hydrogen 3.009 N/A LYS 18.A N GLN 14.A O no hydrogen 2.823 N/A LYS 18.A NZ TYR 11.A O no hydrogen 2.860 N/A GLN 19.A N GLU 15.A O no hydrogen 3.132 N/A LEU 21.A N LEU 17.A O no hydrogen 2.858 N/A ARG 22.A N LYS 18.A O no hydrogen 2.841 N/A VAL 23.A N GLN 19.A O no hydrogen 3.082 N/A VAL 23.A N LYS 20.A O no hydrogen 3.189 N/A TYR 24.A N LYS 20.A O no hydrogen 3.123 N/A LEU 25.A N LEU 21.A O no hydrogen 2.558 N/A GLU 26.A N ARG 22.A O no hydrogen 3.118 N/A ALA 27.A N VAL 23.A O no hydrogen 3.092 N/A ALA 28.A N TYR 24.A O no hydrogen 3.430 N/A LYS 29.A N LEU 25.A O no hydrogen 2.861 N/A LYS 29.A NZ GLU 26.A OE2 no hydrogen 3.300 N/A LYS 29.A NZ GLU 58.A O no hydrogen 3.494 N/A ALA 30.A N ALA 27.A O no hydrogen 2.620 N/A ARG 31.A N ALA 27.A O no hydrogen 2.683 N/A HIS 37.A NE2 MET 111.A O no hydrogen 2.991 N/A LEU 38.A N LEU 138.A O no hydrogen 2.932 N/A LEU 39.A N ILE 158.A O no hydrogen 3.383 N/A LEU 40.A N GLY 140.A O no hydrogen 2.798 N/A PHE 41.A N GLU 160.A O no hydrogen 2.791 N/A LYS 48.A NZ LEU 40.A O no hydrogen 2.986 N/A LYS 48.A NZ GLY 42.A O no hydrogen 3.248 N/A LEU 51.A N GLY 47.A O no hydrogen 3.338 N/A ALA 52.A N LYS 48.A O no hydrogen 3.061 N/A HIS 53.A N THR 49.A O no hydrogen 3.155 N/A VAL 54.A N THR 50.A O no hydrogen 2.878 N/A ILE 55.A N LEU 51.A O no hydrogen 2.877 N/A ALA 56.A N ALA 52.A O no hydrogen 3.056 N/A HIS 57.A N HIS 53.A O no hydrogen 2.836 N/A GLU 58.A N VAL 54.A O no hydrogen 2.903 N/A LEU 59.A N ILE 55.A O no hydrogen 3.102 N/A LEU 59.A N ALA 56.A O no hydrogen 3.291 N/A GLY 60.A N ALA 56.A O no hydrogen 2.963 N/A GLY 60.A N HIS 57.A O no hydrogen 2.735 N/A VAL 61.A N ALA 56.A O no hydrogen 3.002 N/A ASN 62.A N ASP 89.A OD1 no hydrogen 2.455 N/A ASN 62.A ND2 ASP 89.A OD1 no hydrogen 2.948 N/A ARG 64.A N ILE 90.A O no hydrogen 2.919 N/A ARG 64.A NH1 SER 84.A O no hydrogen 3.375 N/A THR 66.A N PHE 92.A O no hydrogen 2.919 N/A THR 66.A OG1 SER 67.A O no hydrogen 3.440 N/A GLY 68.A N ASP 94.A O no hydrogen 2.861 N/A ALA 70.A N SER 67.A OG no hydrogen 3.071 N/A LYS 73.A NZ ASP 76.A OD1 no hydrogen 3.171 N/A ALA 78.A N PRO 74.A O no hydrogen 2.744 N/A ALA 79.A N GLY 75.A O no hydrogen 2.680 N/A ILE 80.A N ASP 76.A O no hydrogen 3.451 N/A LEU 81.A N LEU 77.A O no hydrogen 2.758 N/A ALA 82.A N ALA 78.A O no hydrogen 2.815 N/A ASN 83.A N ALA 79.A O no hydrogen 3.055 N/A GLU 86.A N ASP 89.A OD2 no hydrogen 2.862 N/A GLY 88.A N ARG 135.A O no hydrogen 2.983 N/A ASP 89.A N GLU 86.A O no hydrogen 2.852 N/A ILE 90.A N ASN 62.A O no hydrogen 3.150 N/A LEU 91.A N THR 137.A O no hydrogen 3.291 N/A PHE 92.A N ARG 64.A O no hydrogen 2.937 N/A ILE 93.A N ILE 139.A O no hydrogen 2.984 N/A ASP 94.A N THR 66.A O no hydrogen 2.843 N/A GLU 95.A N ASP 94.A OD2 no hydrogen 2.852 N/A ILE 96.A N ALA 141.A O no hydrogen 3.026 N/A ARG 98.A N GLU 95.A O no hydrogen 2.842 N/A ARG 98.A NH1 GLU 95.A OE2 no hydrogen 3.254 N/A SER 100.A OG GLN 102.A OE1 no hydrogen 3.094 N/A GLN 102.A N GLN 102.A OE1 no hydrogen 2.595 N/A GLU 104.A N SER 100.A O no hydrogen 2.780 N/A GLU 105.A N ARG 101.A O no hydrogen 2.864 N/A HIS 106.A N GLN 102.A O no hydrogen 2.915 N/A LEU 107.A N ALA 103.A O no hydrogen 3.061 N/A LEU 107.A N GLU 104.A O no hydrogen 2.885 N/A TYR 108.A N GLU 104.A O no hydrogen 3.368 N/A TYR 108.A OH GLU 104.A OE1 no hydrogen 2.526 N/A MET 111.A N LEU 107.A O no hydrogen 2.978 N/A GLU 112.A N TYR 108.A O no hydrogen 2.937 N/A ASP 113.A N PRO 109.A O no hydrogen 3.176 N/A MET 116.A N LEU 131.A O no hydrogen 3.147 N/A ILE 118.A N ILE 129.A O no hydrogen 2.768 N/A ILE 120.A N ARG 127.A O no hydrogen 2.766 N/A ILE 129.A N ILE 118.A O no hydrogen 2.689 N/A ARG 130.A NE ASP 117.A OD1 no hydrogen 3.228 N/A LEU 131.A N MET 116.A O no hydrogen 2.753 N/A LEU 133.A N PHE 114.A O no hydrogen 3.173 N/A ARG 135.A N GLU 87.A OE2 no hydrogen 2.686 N/A THR 137.A N ASP 89.A O no hydrogen 3.203 N/A LEU 138.A N HIS 37.A ND1 no hydrogen 2.976 N/A ILE 139.A N LEU 91.A O no hydrogen 2.939 N/A GLY 140.A N LEU 38.A O no hydrogen 2.841 N/A ALA 141.A N ILE 93.A O no hydrogen 2.995 N/A THR 142.A N LEU 40.A O no hydrogen 3.089 N/A SER 154.A N PRO 151.A O no hydrogen 2.862 N/A SER 154.A OG PRO 151.A O no hydrogen 2.787 N/A ARG 155.A N LEU 152.A O no hydrogen 3.092 N/A ARG 155.A NH1 GLU 112.A OE2 no hydrogen 2.659 N/A PHE 156.A N LEU 153.A O no hydrogen 3.232 N/A ILE 158.A N HIS 37.A O no hydrogen 3.043 N/A GLU 160.A N LEU 39.A O no hydrogen 3.210 N/A LEU 162.A N PHE 41.A O no hydrogen 3.121 N/A GLU 163.A N GLN 14.A OE1 no hydrogen 3.133 N/A TYR 165.A N GLY 199.A O no hydrogen 2.672 N/A TYR 165.A OH LEU 46.A O no hydrogen 2.593 N/A THR 166.A N GLU 169.A OE1 no hydrogen 2.862 N/A THR 166.A OG1 GLU 168.A OE2 no hydrogen 3.543 N/A THR 166.A OG1 GLU 169.A OE1 no hydrogen 3.389 N/A GLU 168.A N GLU 168.A OE2 no hydrogen 2.391 N/A GLU 169.A N THR 166.A OG1 no hydrogen 3.382 N/A LEU 170.A N THR 166.A O no hydrogen 3.033 N/A ALA 171.A N PRO 167.A O no hydrogen 2.791 N/A GLN 172.A N GLU 168.A O no hydrogen 2.665 N/A GLY 173.A N GLU 169.A O no hydrogen 3.056 N/A GLY 173.A N LEU 170.A O no hydrogen 2.964 N/A VAL 174.A N LEU 170.A O no hydrogen 3.224 N/A MET 175.A N ALA 171.A O no hydrogen 2.792 N/A ARG 176.A N GLN 172.A O no hydrogen 3.035 N/A ASP 177.A N MET 175.A O no hydrogen 2.556 N/A ALA 178.A N MET 175.A O no hydrogen 2.724 N/A ARG 179.A N MET 175.A O no hydrogen 3.396 N/A GLY 182.A N ARG 179.A O no hydrogen 3.285 N/A VAL 183.A N LEU 181.A O no hydrogen 2.625 N/A THR 186.A N ILE 223.A O no hydrogen 2.958 N/A THR 186.A OG1 ILE 223.A O no hydrogen 3.125 N/A ALA 190.A N THR 186.A O no hydrogen 3.201 N/A LEU 191.A N GLU 187.A O no hydrogen 2.859 N/A GLU 192.A N GLU 188.A O no hydrogen 2.553 N/A GLU 192.A N ALA 189.A O no hydrogen 2.726 N/A ILE 193.A N ALA 189.A O no hydrogen 3.153 N/A ILE 193.A N ALA 190.A O no hydrogen 2.700 N/A GLY 194.A N ALA 190.A O no hydrogen 2.883 N/A ARG 195.A N LEU 191.A O no hydrogen 3.241 N/A SER 197.A N ILE 193.A O no hydrogen 2.680 N/A SER 197.A OG ILE 193.A O no hydrogen 3.054 N/A GLY 199.A N SER 197.A O no hydrogen 2.520 N/A THR 200.A OG1 GLY 45.A O no hydrogen 3.101 N/A ARG 202.A N GLY 45.A O no hydrogen 3.235 N/A ARG 202.A N THR 200.A OG1 no hydrogen 3.132 N/A LYS 205.A N MET 201.A O no hydrogen 3.381 N/A LYS 205.A NZ ASP 177.A OD2 no hydrogen 2.818 N/A ARG 206.A N ARG 202.A O no hydrogen 3.191 N/A LEU 207.A N VAL 203.A O no hydrogen 2.634 N/A PHE 208.A N ALA 204.A O no hydrogen 2.788 N/A ARG 209.A N LYS 205.A O no hydrogen 3.032 N/A ARG 210.A N ARG 206.A O no hydrogen 3.073 N/A VAL 211.A N LEU 207.A O no hydrogen 2.721 N/A ARG 212.A N PHE 208.A O no hydrogen 2.810 N/A ASP 213.A N ARG 209.A O no hydrogen 2.778 N/A ASP 213.A N ARG 210.A O no hydrogen 3.165 N/A PHE 214.A N ARG 210.A O no hydrogen 3.016 N/A ALA 215.A N VAL 211.A O no hydrogen 2.977 N/A ILE 223.A N ARG 184.A O no hydrogen 3.174 N/A ARG 225.A NH1 GLU 192.A OE2 no hydrogen 3.090 N/A ALA 228.A N THR 224.A O no hydrogen 2.797 N/A LEU 229.A N ARG 225.A O no hydrogen 2.780 N/A GLU 230.A N GLU 226.A O no hydrogen 2.905 N/A ALA 231.A N ARG 227.A O no hydrogen 3.020 N/A LEU 232.A N ALA 228.A O no hydrogen 2.970 N/A ALA 233.A N LEU 229.A O no hydrogen 2.848 N/A ALA 234.A N GLU 230.A O no hydrogen 2.874 N/A LEU 235.A N ALA 231.A O no hydrogen 3.128 N/A GLY 236.A N ALA 233.A O no hydrogen 3.033 N/A LEU 237.A N LEU 232.A O no hydrogen 3.269 N/A GLY 241.A N ASP 238.A O no hydrogen 2.952 N/A LEU 242.A N ASP 238.A OD1 no hydrogen 3.322 N/A GLU 243.A N ASP 246.A OD2 no hydrogen 2.542 N/A ARG 245.A NH1 GLU 273.A OE1 no hydrogen 2.703 N/A ASP 246.A N GLU 243.A O no hydrogen 2.925 N/A ARG 247.A N GLU 243.A O no hydrogen 3.282 N/A ARG 247.A NH1 GLY 236.A O no hydrogen 3.345 N/A ARG 247.A NH1 ASP 238.A OD2 no hydrogen 3.288 N/A ARG 247.A NH2 GLY 236.A O no hydrogen 2.583 N/A GLU 248.A N LYS 244.A O no hydrogen 3.465 N/A ILE 249.A N ARG 245.A O no hydrogen 2.950 N/A ILE 249.A N ASP 246.A O no hydrogen 3.316 N/A LEU 250.A N ASP 246.A O no hydrogen 3.368 N/A VAL 252.A N GLU 248.A O no hydrogen 3.257 N/A ARG 256.A NH1 ARG 256.A O no hydrogen 3.405 N/A GLY 260.A N GLY 258.A O no hydrogen 2.402 N/A VAL 262.A N ARG 299.A O no hydrogen 2.895 N/A THR 266.A OG1 VAL 262.A O no hydrogen 2.403 N/A THR 266.A OG1 GLY 263.A O no hydrogen 2.455 N/A LEU 267.A N LEU 264.A O no hydrogen 2.718 N/A ALA 268.A N LEU 264.A O no hydrogen 2.841 N/A THR 269.A OG1 ALA 265.A O no hydrogen 3.363 N/A LEU 271.A N LEU 267.A O no hydrogen 3.081 N/A LEU 271.A N ALA 268.A O no hydrogen 3.222 N/A SER 272.A N THR 269.A O no hydrogen 3.191 N/A SER 272.A OG LEU 271.A O no hydrogen 2.538 N/A THR 277.A N ASP 274.A OD1 no hydrogen 2.767 N/A LEU 278.A N ASP 274.A O no hydrogen 2.802 N/A GLU 280.A N GLY 276.A O no hydrogen 2.593 N/A GLU 280.A N THR 277.A O no hydrogen 3.121 N/A TYR 285.A OH LEU 240.A O no hydrogen 2.590 N/A ILE 287.A N GLU 283.A O no hydrogen 2.774 N/A ILE 287.A N PRO 284.A O no hydrogen 3.098 N/A ARG 288.A N PRO 284.A O no hydrogen 2.850 N/A ARG 288.A NH1 ARG 198.A O no hydrogen 3.480 N/A ARG 288.A NH2 ARG 198.A O no hydrogen 3.506 N/A GLN 289.A N TYR 285.A O no hydrogen 2.839 N/A GLY 290.A N ILE 287.A O no hydrogen 2.646 N/A LEU 291.A N LEU 286.A O no hydrogen 3.083 N/A LYS 293.A N VAL 300.A O no hydrogen 2.912 N/A ARG 294.A NH1 GLU 279.A OE1 no hydrogen 2.877 N/A THR 295.A N GLY 298.A O no hydrogen 3.483 N/A ARG 297.A N THR 295.A O no hydrogen 2.569 N/A ARG 299.A NH1 GLY 298.A O no hydrogen 3.549 N/A ARG 299.A NH2 GLU 283.A OE2 no hydrogen 3.219 N/A VAL 300.A N LYS 293.A O no hydrogen 3.176 N/A THR 302.A OG1 GLU 303.A OE1 no hydrogen 3.383 N/A TYR 306.A N THR 302.A O no hydrogen 3.346 N/A HIS 308.A N LEU 304.A O no hydrogen 2.947 N/A LEU 309.A N TYR 306.A O no hydrogen 2.860 N/A GLY 310.A N ARG 307.A O no hydrogen 2.731 N/A TYR 311.A N TYR 306.A O no hydrogen 3.287 N/A