Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3itj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 3.A N THR 110.A O no hydrogen 2.789 N/A THR 6.A N ALA 113.A O no hydrogen 3.032 N/A THR 6.A OG1 THR 111.A OG1 no hydrogen 2.746 N/A ILE 7.A N ILE 29.A O no hydrogen 2.786 N/A ILE 8.A N ILE 115.A O no hydrogen 2.762 N/A GLY 9.A N TYR 31.A O no hydrogen 3.090 N/A SER 10.A OG GLU 32.A O no hydrogen 3.178 N/A HIS 15.A N GLY 11.A O no hydrogen 3.117 N/A HIS 15.A ND1 SER 74.A OG no hydrogen 2.867 N/A THR 16.A N PRO 12.A O no hydrogen 3.250 N/A THR 16.A OG1 PRO 12.A O no hydrogen 2.393 N/A ALA 17.A N ALA 13.A O no hydrogen 3.036 N/A ALA 18.A N ALA 14.A O no hydrogen 2.767 N/A ILE 19.A N HIS 15.A O no hydrogen 2.758 N/A TYR 20.A N THR 16.A O no hydrogen 3.338 N/A LEU 21.A N ALA 17.A O no hydrogen 2.996 N/A ALA 22.A N ALA 18.A O no hydrogen 2.867 N/A ARG 23.A N ILE 19.A O no hydrogen 2.970 N/A ALA 24.A N TYR 20.A O no hydrogen 3.014 N/A GLU 25.A N ALA 22.A O no hydrogen 2.754 N/A ILE 26.A N LEU 21.A O no hydrogen 2.757 N/A ILE 29.A N VAL 5.A O no hydrogen 3.113 N/A LEU 30.A N GLU 80.A O no hydrogen 2.878 N/A TYR 31.A N ILE 7.A O no hydrogen 2.838 N/A GLU 32.A N ILE 82.A O no hydrogen 3.105 N/A GLY 38.A N MET 35.A O no hydrogen 3.222 N/A ILE 39.A N ALA 36.A O no hydrogen 3.180 N/A GLY 42.A N SER 10.A OG no hydrogen 2.985 N/A GLY 43.A N ALA 40.A O no hydrogen 3.170 N/A THR 46.A N GLY 43.A O no hydrogen 2.913 N/A THR 46.A OG1 GLY 43.A O no hydrogen 2.840 N/A THR 47.A N GLN 44.A O no hydrogen 3.083 N/A THR 47.A OG1 GLN 44.A O no hydrogen 2.732 N/A THR 48.A N LEU 45.A O no hydrogen 3.224 N/A THR 48.A OG1 GLN 135.A OE1 no hydrogen 3.212 N/A THR 49.A N GLN 135.A OE1 no hydrogen 3.113 N/A THR 49.A OG1 GLN 135.A OE1 no hydrogen 2.950 N/A ILE 51.A N LEU 61.A O no hydrogen 2.598 N/A PHE 57.A N PHE 54.A O no hydrogen 3.259 N/A GLY 60.A N PHE 57.A O no hydrogen 2.717 N/A LEU 61.A N ILE 51.A O no hydrogen 3.278 N/A THR 62.A N GLU 65.A OE1 no hydrogen 3.087 N/A THR 62.A OG1 GLU 65.A OE1 no hydrogen 3.149 N/A GLY 63.A N THR 49.A O no hydrogen 3.130 N/A LEU 66.A N THR 62.A O no hydrogen 2.954 N/A LEU 66.A N GLY 63.A O no hydrogen 3.181 N/A MET 67.A N GLY 63.A O no hydrogen 3.137 N/A ASP 68.A N SER 64.A O no hydrogen 2.814 N/A ARG 69.A N GLU 65.A O no hydrogen 3.066 N/A MET 70.A N LEU 66.A O no hydrogen 2.830 N/A ARG 71.A N MET 67.A O no hydrogen 2.836 N/A GLU 72.A N ASP 68.A O no hydrogen 2.883 N/A GLN 73.A N ARG 69.A O no hydrogen 2.963 N/A SER 74.A N MET 70.A O no hydrogen 2.909 N/A SER 74.A OG HIS 15.A ND1 no hydrogen 2.867 N/A SER 74.A OG HIS 15.A O no hydrogen 3.348 N/A SER 74.A OG MET 70.A O no hydrogen 3.133 N/A THR 75.A N ARG 71.A O no hydrogen 3.081 N/A THR 75.A OG1 ARG 71.A O no hydrogen 2.488 N/A LYS 76.A N GLU 72.A O no hydrogen 2.881 N/A GLY 78.A N THR 75.A O no hydrogen 2.838 N/A THR 79.A N SER 74.A O no hydrogen 3.035 N/A THR 79.A OG1 SER 74.A O no hydrogen 2.880 N/A GLU 80.A N PRO 28.A O no hydrogen 2.977 N/A ILE 82.A N LEU 30.A O no hydrogen 2.776 N/A THR 83.A OG1 GLU 32.A OE2 no hydrogen 2.508 N/A GLU 84.A N ILE 82.A O no hydrogen 2.943 N/A THR 85.A OG1 MET 34.A O no hydrogen 3.462 N/A SER 87.A N TRP 99.A O no hydrogen 3.067 N/A SER 87.A OG GLU 104.A OE1 no hydrogen 2.564 N/A ASP 90.A N LYS 97.A O no hydrogen 2.497 N/A LEU 91.A N GLN 259.A OE1 no hydrogen 2.860 N/A SER 92.A N ASP 90.A OD1 no hydrogen 3.110 N/A SER 92.A OG ASP 90.A OD1 no hydrogen 2.808 N/A SER 92.A OG ASP 90.A OD2 no hydrogen 3.414 N/A PHE 96.A N THR 111.A O no hydrogen 2.665 N/A LYS 97.A N ASP 90.A O no hydrogen 3.029 N/A LEU 98.A N VAL 109.A O no hydrogen 3.022 N/A TRP 99.A N LYS 88.A O no hydrogen 2.785 N/A THR 100.A OG1 GLU 84.A OE1 no hydrogen 3.029 N/A THR 100.A OG1 ASN 103.A OD1 no hydrogen 2.778 N/A GLU 101.A N THR 85.A O no hydrogen 2.793 N/A ASN 103.A N THR 100.A O no hydrogen 2.774 N/A VAL 109.A N LEU 98.A O no hydrogen 2.954 N/A THR 110.A N VAL 1.A O no hydrogen 2.641 N/A THR 111.A N PHE 96.A O no hydrogen 2.878 N/A THR 111.A OG1 ASN 3.A O no hydrogen 3.013 N/A THR 111.A OG1 THR 6.A OG1 no hydrogen 2.746 N/A THR 111.A OG1 ALA 113.A O no hydrogen 2.992 N/A ASP 112.A N ASN 3.A O no hydrogen 2.932 N/A ILE 114.A N GLY 281.A O no hydrogen 2.868 N/A ILE 115.A N THR 6.A O no hydrogen 2.703 N/A LEU 116.A N PHE 283.A O no hydrogen 2.682 N/A ALA 117.A N ILE 8.A O no hydrogen 2.614 N/A THR 118.A OG1 ALA 252.A O no hydrogen 2.857 N/A ALA 122.A N GLN 44.A OE1 no hydrogen 2.741 N/A LYS 123.A N GLY 248.A O no hydrogen 2.622 N/A ARG 124.A NH1 GLU 130.A OE2 no hydrogen 2.352 N/A LEU 127.A N GLU 130.A OE1 no hydrogen 3.439 N/A GLY 129.A N GLU 131.A OE1 no hydrogen 3.370 N/A GLU 130.A N LEU 127.A O no hydrogen 2.734 N/A THR 132.A N GLY 129.A O no hydrogen 2.838 N/A TYR 133.A N GLY 129.A O no hydrogen 2.877 N/A TRP 134.A N GLU 130.A O no hydrogen 2.774 N/A TRP 134.A NE1 THR 47.A O no hydrogen 2.883 N/A GLN 135.A N ILE 138.A O no hydrogen 2.762 N/A LYS 136.A N TYR 133.A O no hydrogen 2.657 N/A ILE 138.A N TYR 133.A O no hydrogen 3.081 N/A SER 139.A N LEU 243.A O no hydrogen 2.862 N/A SER 139.A OG CYS 141.A O no hydrogen 3.517 N/A CYS 141.A N SER 139.A OG no hydrogen 3.201 N/A ALA 142.A N GLU 168.A OE1 no hydrogen 3.468 N/A CYS 144.A N CYS 141.A O no hydrogen 2.880 N/A ASP 145.A N CYS 141.A O no hydrogen 2.986 N/A GLY 146.A N ALA 142.A O no hydrogen 2.785 N/A VAL 148.A N ASP 145.A O no hydrogen 2.825 N/A PHE 151.A N VAL 148.A O no hydrogen 3.353 N/A ARG 152.A N PRO 149.A O no hydrogen 2.743 N/A ARG 152.A NH2 ALA 147.A O no hydrogen 2.320 N/A ASN 153.A N TYR 175.A O no hydrogen 2.564 N/A LYS 154.A N PHE 151.A O no hydrogen 3.339 N/A LEU 156.A N LYS 178.A O no hydrogen 2.795 N/A ALA 157.A N GLY 242.A O no hydrogen 2.923 N/A VAL 158.A N PHE 180.A O no hydrogen 2.710 N/A ILE 159.A N PHE 244.A O no hydrogen 2.948 N/A GLY 160.A N LEU 182.A O no hydrogen 3.312 N/A CYS 166.A N GLY 162.A O no hydrogen 3.375 N/A CYS 166.A SG GLY 162.A O no hydrogen 3.617 N/A CYS 166.A SG MET 194.A O no hydrogen 3.709 N/A GLU 167.A N ASP 163.A O no hydrogen 2.865 N/A GLU 168.A N SER 164.A O no hydrogen 2.715 N/A ALA 169.A N ALA 165.A O no hydrogen 2.831 N/A GLN 170.A N CYS 166.A O no hydrogen 2.689 N/A PHE 171.A N GLU 167.A O no hydrogen 2.886 N/A LEU 172.A N GLU 168.A O no hydrogen 2.779 N/A THR 173.A N ALA 169.A O no hydrogen 3.191 N/A THR 173.A N GLN 170.A O no hydrogen 3.147 N/A THR 173.A OG1 ALA 169.A O no hydrogen 3.478 N/A THR 173.A OG1 GLN 170.A O no hydrogen 2.137 N/A LYS 174.A N PHE 171.A O no hydrogen 3.008 N/A TYR 175.A N LEU 172.A O no hydrogen 2.925 N/A GLY 176.A N LEU 172.A O no hydrogen 2.726 N/A SER 177.A N LYS 154.A O no hydrogen 3.065 N/A VAL 179.A N LYS 203.A O no hydrogen 2.632 N/A PHE 180.A N LEU 156.A O no hydrogen 2.726 N/A MET 181.A N GLU 205.A O no hydrogen 2.929 N/A LEU 182.A N VAL 158.A O no hydrogen 2.761 N/A VAL 183.A N MET 181.A O no hydrogen 3.115 N/A VAL 183.A N LEU 207.A O no hydrogen 2.836 N/A HIS 187.A ND1 ASP 186.A OD2 no hydrogen 2.543 N/A ARG 189.A N GLY 161.A O no hydrogen 2.523 N/A SER 191.A N ASP 163.A OD1 no hydrogen 2.855 N/A MET 194.A N SER 191.A OG no hydrogen 3.292 N/A GLN 195.A N SER 191.A O no hydrogen 3.150 N/A GLN 195.A NE2 ALA 190.A O no hydrogen 2.630 N/A LYS 196.A N THR 192.A O no hydrogen 3.293 N/A ARG 197.A N ILE 193.A O no hydrogen 3.003 N/A ALA 198.A N MET 194.A O no hydrogen 2.979 N/A GLU 199.A N GLN 195.A O no hydrogen 2.875 N/A LYS 200.A N LYS 196.A O no hydrogen 2.725 N/A ASN 201.A N ALA 198.A O no hydrogen 3.166 N/A ASN 201.A ND2 GLN 170.A OE1 no hydrogen 2.964 N/A ASN 201.A ND2 THR 173.A OG1 no hydrogen 3.290 N/A LYS 203.A N ASN 201.A OD1 no hydrogen 2.647 N/A ILE 204.A N ASN 201.A O no hydrogen 3.050 N/A GLU 205.A N VAL 179.A O no hydrogen 2.781 N/A LEU 207.A N MET 181.A O no hydrogen 2.873 N/A ASN 209.A N LYS 185.A O no hydrogen 2.668 N/A THR 210.A N VAL 183.A O no hydrogen 2.973 N/A THR 210.A OG1 LEU 207.A O no hydrogen 3.345 N/A VAL 211.A N LYS 228.A O no hydrogen 2.794 N/A LEU 213.A N ARG 226.A O no hydrogen 2.726 N/A GLU 214.A N ARG 226.A O no hydrogen 3.455 N/A ALA 215.A N PRO 128.A O no hydrogen 2.684 N/A LYS 216.A N ALA 224.A O no hydrogen 2.955 N/A LYS 216.A NZ ASP 237.A OD2 no hydrogen 2.595 N/A ASP 218.A N LEU 221.A O no hydrogen 3.220 N/A GLY 219.A N TYR 133.A OH no hydrogen 2.680 N/A LYS 220.A N ASP 218.A OD1 no hydrogen 2.624 N/A LEU 221.A N ASP 218.A OD1 no hydrogen 2.668 N/A LEU 222.A N LYS 136.A O no hydrogen 2.906 N/A ASN 223.A N LYS 216.A O no hydrogen 2.848 N/A ALA 224.A N LYS 216.A O no hydrogen 3.170 N/A LEU 225.A N LEU 238.A O no hydrogen 2.909 N/A ARG 226.A N GLU 214.A O no hydrogen 2.976 N/A ARG 226.A NE GLU 235.A OE1 no hydrogen 2.591 N/A ARG 226.A NH2 GLU 235.A OE1 no hydrogen 3.468 N/A ILE 227.A N THR 236.A O no hydrogen 2.821 N/A LYS 228.A N VAL 211.A O no hydrogen 2.698 N/A ASN 229.A N GLU 234.A O no hydrogen 2.854 N/A THR 230.A N ASN 209.A O no hydrogen 2.682 N/A THR 230.A OG1 ASN 209.A O no hydrogen 3.454 N/A LYS 231.A N ASN 229.A OD1 no hydrogen 2.812 N/A LYS 232.A N ASN 229.A OD1 no hydrogen 2.663 N/A GLU 234.A N ASN 229.A O no hydrogen 3.164 N/A THR 236.A N ILE 227.A O no hydrogen 2.843 N/A LEU 238.A N LEU 225.A O no hydrogen 2.774 N/A VAL 240.A N ASN 223.A O no hydrogen 3.056 N/A SER 241.A N PRO 155.A O no hydrogen 2.734 N/A LEU 243.A N GLY 137.A O no hydrogen 2.692 N/A PHE 244.A N ALA 157.A O no hydrogen 2.871 N/A TYR 245.A N SER 139.A O no hydrogen 2.988 N/A TYR 245.A OH GLU 130.A OE1 no hydrogen 2.380 N/A ALA 246.A N ILE 159.A O no hydrogen 3.135 N/A THR 250.A N SER 121.A O no hydrogen 2.790 N/A ALA 252.A N GLY 119.A O no hydrogen 2.888 N/A THR 253.A N PRO 251.A O no hydrogen 2.838 N/A THR 253.A OG1 GLY 266.A O no hydrogen 2.573 N/A VAL 256.A N THR 253.A O no hydrogen 2.986 N/A ALA 257.A N LYS 254.A O no hydrogen 3.160 N/A GLN 259.A N VAL 256.A O no hydrogen 2.895 N/A GLN 259.A NE2 VAL 89.A O no hydrogen 2.941 N/A ASP 261.A N SER 278.A OG no hydrogen 2.905 N/A ASP 263.A N TYR 267.A O no hydrogen 2.773 N/A GLY 266.A N ASP 263.A O no hydrogen 2.768 N/A TYR 267.A N ASP 263.A OD1 no hydrogen 2.923 N/A ILE 268.A N VAL 288.A O no hydrogen 2.963 N/A LYS 269.A N ASP 261.A O no hydrogen 3.030 N/A VAL 271.A N LEU 276.A O no hydrogen 2.862 N/A SER 274.A OG VAL 271.A O no hydrogen 2.682 N/A SER 275.A N ASP 309.A OD2 no hydrogen 2.905 N/A SER 275.A OG ASP 309.A OD2 no hydrogen 2.461 N/A LEU 276.A N SER 274.A OG no hydrogen 3.023 N/A THR 277.A OG1 VAL 279.A O no hydrogen 3.359 N/A THR 277.A OG1 PHE 282.A O no hydrogen 2.885 N/A VAL 279.A N THR 277.A OG1 no hydrogen 3.083 N/A PHE 282.A N VAL 279.A O no hydrogen 2.913 N/A PHE 283.A N ILE 114.A O no hydrogen 2.861 N/A ALA 284.A N SER 275.A O no hydrogen 3.116 N/A ALA 285.A N LEU 116.A O no hydrogen 2.756 N/A GLY 286.A N SER 302.A OG no hydrogen 2.732 N/A GLN 289.A N GLY 286.A O no hydrogen 3.090 N/A GLN 289.A NE2 THR 270.A OG1 no hydrogen 2.534 N/A ASP 290.A N ASP 287.A O no hydrogen 3.339 N/A LYS 292.A N ASP 290.A OD1 no hydrogen 2.806 N/A LYS 292.A NZ TYR 293.A OH no hydrogen 3.167 N/A TYR 293.A N ASP 290.A OD1 no hydrogen 2.929 N/A TYR 293.A N ASP 290.A OD2 no hydrogen 3.130 N/A ARG 294.A N ASP 290.A OD2 no hydrogen 2.768 N/A ARG 294.A NH2 TYR 267.A OH no hydrogen 3.546 N/A GLN 295.A N THR 298.A OG1 no hydrogen 3.011 N/A GLN 295.A NE2 ARG 294.A O no hydrogen 2.589 N/A THR 298.A OG1 GLN 295.A O no hydrogen 2.966 N/A SER 299.A N GLN 295.A O no hydrogen 2.936 N/A SER 299.A OG GLN 295.A O no hydrogen 2.682 N/A ALA 300.A N ALA 296.A O no hydrogen 2.758 N/A GLY 301.A N ILE 297.A O no hydrogen 2.965 N/A SER 302.A N THR 298.A O no hydrogen 2.740 N/A SER 302.A OG GLN 289.A OE1 no hydrogen 3.109 N/A GLY 303.A N SER 299.A O no hydrogen 2.830 N/A CYS 304.A N ALA 300.A O no hydrogen 2.926 N/A MET 305.A N GLY 301.A O no hydrogen 2.909 N/A ALA 306.A N SER 302.A O no hydrogen 2.943 N/A ALA 307.A N GLY 303.A O no hydrogen 2.957 N/A LEU 308.A N CYS 304.A O no hydrogen 2.918 N/A ASP 309.A N MET 305.A O no hydrogen 2.647 N/A ALA 310.A N ALA 306.A O no hydrogen 2.964 N/A GLU 311.A N ALA 307.A O no hydrogen 2.771 N/A LYS 312.A N LEU 308.A O no hydrogen 3.029 N/A TYR 313.A N ASP 309.A O no hydrogen 2.869 N/A LEU 314.A N ALA 310.A O no hydrogen 2.800 N/A THR 315.A N GLU 311.A O no hydrogen 3.039 N/A THR 315.A OG1 GLU 311.A O no hydrogen 3.443 N/A SER 316.A N TYR 313.A O no hydrogen 2.979 N/A SER 316.A OG TYR 313.A O no hydrogen 2.488 N/A LEU 317.A N LEU 314.A O no hydrogen 3.067 N/A