Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3r6k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ GLU 235.A OE1 no hydrogen 2.687 N/A THR 4.A OG1 HIS 231.A NE2 no hydrogen 2.801 N/A THR 9.A N GLU 12.A OE1 no hydrogen 2.849 N/A GLU 12.A N THR 9.A O no hydrogen 2.842 N/A LEU 13.A N ILE 10.A O no hydrogen 3.450 N/A THR 14.A N GLU 227.A OE1 no hydrogen 2.709 N/A THR 14.A OG1 GLU 227.A OE2 no hydrogen 2.617 N/A ASN 15.A N VAL 20.A O no hydrogen 2.814 N/A ASN 15.A ND2 SER 207.A OG no hydrogen 2.918 N/A ASN 15.A ND2 ILE 220.A O no hydrogen 3.004 N/A SER 16.A OG LEU 224.A O no hydrogen 2.653 N/A ARG 17.A N ASN 15.A OD1 no hydrogen 2.840 N/A ARG 17.A NE ASP 103.A OD1 no hydrogen 3.214 N/A ARG 17.A NE ASP 103.A OD2 no hydrogen 3.058 N/A ARG 17.A NH1 GLN 173.A OE1 no hydrogen 2.877 N/A ARG 17.A NH1 ASP 221.A O no hydrogen 2.779 N/A ARG 17.A NH2 ASP 103.A OD1 no hydrogen 2.897 N/A ARG 17.A NH2 GLN 173.A O no hydrogen 2.793 N/A VAL 20.A N PHE 18.A O no hydrogen 2.740 N/A ILE 22.A N LEU 13.A O no hydrogen 2.919 N/A ASP 23.A N ARG 206.A O no hydrogen 2.790 N/A GLU 24.A N ARG 206.A O no hydrogen 3.182 N/A TYR 26.A N PHE 204.A O no hydrogen 2.961 N/A THR 27.A N ARG 276.A O no hydrogen 3.239 N/A THR 27.A OG1 GLN 201.A OE1 no hydrogen 3.015 N/A THR 27.A OG1 ILE 202.A O no hydrogen 2.769 N/A SER 28.A OG PRO 29.A O no hydrogen 3.455 N/A LEU 33.A N ASN 30.A O no hydrogen 3.225 N/A GLN 36.A NE2 ALA 190.A O no hydrogen 3.020 N/A GLN 38.A N ASP 103.A OD2 no hydrogen 2.853 N/A GLN 38.A NE2 GLN 36.A O no hydrogen 2.843 N/A GLN 38.A NE2 ALA 190.A O no hydrogen 3.137 N/A ASN 39.A N ASP 103.A OD2 no hydrogen 3.023 N/A ASN 39.A ND2 THR 101.A O no hydrogen 2.826 N/A ARG 41.A N THR 52.A OG1 no hydrogen 2.843 N/A ARG 41.A NH1 PRO 37.A O no hydrogen 2.764 N/A ARG 41.A NH1 PRO 191.A O no hydrogen 3.065 N/A ARG 41.A NH2 PRO 191.A O no hydrogen 2.806 N/A CYS 42.A SG ALA 43.A O no hydrogen 3.346 N/A ALA 43.A N GLU 47.A O no hydrogen 2.937 N/A LEU 44.A N ARG 264.A O no hydrogen 2.860 N/A GLY 46.A N ALA 43.A O no hydrogen 2.887 N/A GLU 47.A N ASP 45.A OD1 no hydrogen 3.200 N/A GLN 49.A N ARG 41.A O no hydrogen 2.982 N/A GLN 49.A NE2 GLU 47.A OE1 no hydrogen 2.968 N/A THR 51.A N GLN 38.A O no hydrogen 2.948 N/A THR 51.A OG1 ASN 39.A OD1 no hydrogen 2.795 N/A THR 52.A N GLN 49.A O no hydrogen 2.989 N/A THR 52.A OG1 GLN 38.A O no hydrogen 2.982 N/A THR 52.A OG1 ARG 41.A O no hydrogen 3.324 N/A THR 52.A OG1 GLN 49.A O no hydrogen 3.012 N/A GLN 53.A NE2 LEU 55.A O no hydrogen 2.836 N/A LEU 55.A N GLN 53.A OE1 no hydrogen 2.947 N/A ALA 58.A N LEU 55.A O no hydrogen 3.233 N/A ILE 59.A N PRO 56.A O no hydrogen 3.283 N/A CYS 60.A N GLY 100.A O no hydrogen 2.857 N/A CYS 60.A SG ARG 17.A O no hydrogen 3.596 N/A SER 61.A N ALA 58.A O no hydrogen 3.001 N/A SER 61.A OG ALA 58.A O no hydrogen 2.678 N/A PHE 62.A N PHE 160.A O no hydrogen 3.322 N/A ARG 63.A NH1 ILE 84.A O no hydrogen 2.825 N/A GLY 64.A N THR 158.A O no hydrogen 2.885 N/A ARG 65.A N GLN 80.A O no hydrogen 3.129 N/A ARG 65.A NH1 ASN 155.A OD1 no hydrogen 2.661 N/A ASN 67.A N ASN 78.A O no hydrogen 3.146 N/A VAL 70.A N VAL 76.A O no hydrogen 3.136 N/A GLU 73.A N VAL 70.A O no hydrogen 3.025 N/A TRP 77.A N ILE 144.A O no hydrogen 2.612 N/A TRP 77.A NE1 THR 146.A OG1 no hydrogen 2.956 N/A ASN 78.A N GLN 68.A O no hydrogen 2.978 N/A MET 79.A N ILE 142.A O no hydrogen 2.842 N/A GLN 80.A N ARG 65.A O no hydrogen 2.820 N/A VAL 81.A N GLY 140.A O no hydrogen 2.999 N/A THR 82.A N ARG 63.A O no hydrogen 2.720 N/A THR 82.A OG1 ASN 83.A O no hydrogen 3.040 N/A ASN 83.A N THR 87.A O no hydrogen 2.780 N/A ASN 83.A ND2 THR 87.A OG1 no hydrogen 3.256 N/A GLY 86.A N ASN 83.A O no hydrogen 2.931 N/A THR 87.A N ASN 85.A OD1 no hydrogen 2.927 N/A THR 87.A OG1 ASN 85.A OD1 no hydrogen 2.716 N/A THR 92.A N ASP 90.A OD1 no hydrogen 3.026 N/A THR 92.A OG1 ASP 90.A OD1 no hydrogen 2.944 N/A THR 92.A OG1 ASP 90.A OD2 no hydrogen 2.602 N/A GLU 93.A N ASP 90.A O no hydrogen 2.817 N/A VAL 95.A N GLU 93.A O no hydrogen 2.730 N/A GLY 100.A N THR 51.A O no hydrogen 2.820 N/A THR 101.A N PRO 98.A O no hydrogen 3.089 N/A THR 101.A OG1 PRO 98.A O no hydrogen 2.549 N/A SER 105.A N ASN 172.A O no hydrogen 3.323 N/A SER 105.A OG THR 175.A O no hydrogen 2.702 N/A GLY 106.A N THR 130.A OG1 no hydrogen 2.856 N/A LYS 107.A NZ GLU 167.A OE2 no hydrogen 3.269 N/A LEU 108.A N ILE 128.A O no hydrogen 2.874 N/A PHE 109.A N GLY 164.A O no hydrogen 2.694 N/A GLY 110.A N ALA 126.A O no hydrogen 2.956 N/A VAL 111.A N THR 161.A O no hydrogen 2.922 N/A LEU 112.A N HIS 124.A O no hydrogen 2.795 N/A SER 113.A N LYS 159.A O no hydrogen 2.864 N/A GLN 114.A N ARG 122.A O no hydrogen 2.938 N/A GLN 114.A NE2 HIS 153.A O no hydrogen 2.886 N/A GLN 114.A NE2 THR 158.A OG1 no hydrogen 2.837 N/A ARG 115.A N PRO 157.A O no hydrogen 3.272 N/A ARG 115.A NH1 ASN 119.A OD1 no hydrogen 2.713 N/A ASP 116.A N ALA 120.A O no hydrogen 2.822 N/A HIS 117.A N GLN 156.A OE1 no hydrogen 3.040 N/A ASN 119.A N ASP 116.A O no hydrogen 2.679 N/A ALA 120.A N ASP 118.A OD1 no hydrogen 3.137 N/A CYS 121.A SG GLN 114.A O no hydrogen 3.696 N/A CYS 121.A SG ASN 119.A O no hydrogen 3.531 N/A ARG 122.A N GLN 114.A O no hydrogen 3.274 N/A ARG 122.A NH1 GLN 114.A OE1 no hydrogen 2.848 N/A ARG 122.A NH1 ASP 116.A OD1 no hydrogen 2.751 N/A ARG 122.A NH2 ASP 116.A OD2 no hydrogen 2.731 N/A HIS 124.A N LEU 112.A O no hydrogen 2.846 N/A HIS 124.A NE2 ASP 151.A OD2 no hydrogen 2.639 N/A ALA 126.A N GLY 110.A O no hydrogen 2.876 N/A VAL 127.A N GLY 145.A O no hydrogen 2.865 N/A ILE 128.A N LEU 108.A O no hydrogen 2.875 N/A THR 130.A N GLY 106.A O no hydrogen 2.852 N/A THR 130.A OG1 PHE 104.A O no hydrogen 2.655 N/A THR 130.A OG1 GLY 106.A O no hydrogen 3.121 N/A SER 132.A N ALA 129.A O no hydrogen 3.303 N/A LYS 134.A N SER 132.A OG no hydrogen 3.206 N/A PHE 135.A N SER 132.A O no hydrogen 3.068 N/A THR 136.A N ALA 141.A O no hydrogen 2.976 N/A THR 136.A OG1 ALA 141.A O no hydrogen 2.734 N/A LYS 138.A N TYR 179.A O no hydrogen 2.921 N/A LYS 138.A NZ PRO 91.A O no hydrogen 2.818 N/A LYS 138.A NZ VAL 95.A O no hydrogen 2.681 N/A LEU 139.A N THR 136.A O no hydrogen 2.786 N/A GLY 140.A N PRO 137.A O no hydrogen 2.878 N/A ALA 141.A N THR 136.A O no hydrogen 3.288 N/A ILE 142.A N MET 79.A O no hydrogen 2.969 N/A ILE 144.A N TRP 77.A O no hydrogen 2.813 N/A GLY 145.A N VAL 127.A O no hydrogen 2.914 N/A THR 146.A N HIS 75.A O no hydrogen 2.594 N/A THR 146.A OG1 GLU 148.A O no hydrogen 2.840 N/A ASP 151.A N GLU 148.A OE2 no hydrogen 2.752 N/A VAL 152.A N ASP 150.A O no hydrogen 3.174 N/A HIS 153.A N GLN 114.A OE1 no hydrogen 2.988 N/A HIS 153.A ND1 ASP 116.A OD2 no hydrogen 2.797 N/A ASN 155.A N ILE 66.A O no hydrogen 2.890 N/A THR 158.A N GLY 64.A O no hydrogen 2.720 N/A THR 158.A OG1 GLN 156.A O no hydrogen 2.688 N/A LYS 159.A N SER 113.A O no hydrogen 2.851 N/A PHE 160.A N PHE 62.A O no hydrogen 2.836 N/A THR 161.A N VAL 111.A O no hydrogen 2.908 N/A VAL 163.A N PHE 109.A O no hydrogen 2.876 N/A GLY 164.A N PHE 109.A O no hydrogen 3.068 N/A LEU 165.A N PRO 210.A O no hydrogen 2.876 N/A PHE 166.A N LYS 107.A O no hydrogen 2.802 N/A PHE 171.A N ASP 168.A O no hydrogen 3.001 N/A ASN 172.A N SER 105.A O no hydrogen 3.099 N/A GLN 173.A NE2 ASP 221.A OD2 no hydrogen 2.836 N/A TRP 174.A N ASN 172.A OD1 no hydrogen 3.002 N/A THR 175.A N ASN 172.A O no hydrogen 3.321 N/A ASN 178.A ND2 GLY 181.A O no hydrogen 3.013 N/A TYR 179.A N ASN 186.A OD1 no hydrogen 2.951 N/A GLY 181.A N ASN 178.A O no hydrogen 2.920 N/A THR 184.A OG1 ALA 182.A O no hydrogen 3.178 N/A ASN 186.A ND2 PRO 177.A O no hydrogen 2.944 N/A ALA 190.A N GLN 38.A OE1 no hydrogen 2.823 N/A VAL 193.A N VAL 35.A O no hydrogen 2.860 N/A GLU 200.A N PHE 197.A O no hydrogen 3.149 N/A GLN 201.A N VAL 270.A O no hydrogen 2.840 N/A LEU 203.A N ILE 268.A O no hydrogen 2.942 N/A PHE 204.A N TYR 26.A O no hydrogen 2.667 N/A PHE 205.A N CYS 222.A O no hydrogen 3.008 N/A ARG 206.A N GLU 24.A O no hydrogen 2.784 N/A ARG 206.A NE ASP 221.A OD1 no hydrogen 2.781 N/A ARG 206.A NH2 ASP 221.A OD2 no hydrogen 2.913 N/A SER 207.A N ILE 220.A O no hydrogen 2.992 N/A SER 207.A OG PRO 21.A O no hydrogen 2.707 N/A HIS 208.A N ASP 23.A OD2 no hydrogen 2.660 N/A HIS 208.A ND1 ASP 217.A OD1 no hydrogen 2.700 N/A HIS 208.A NE2 GLU 24.A OE2 no hydrogen 2.683 N/A ILE 209.A N PRO 218.A O no hydrogen 2.994 N/A LYS 212.A N LEU 165.A O no hydrogen 2.804 N/A ILE 220.A N SER 207.A O no hydrogen 2.891 N/A ASP 221.A N GLN 173.A OE1 no hydrogen 2.784 N/A CYS 222.A N PHE 205.A O no hydrogen 2.943 N/A CYS 222.A SG ASN 15.A OD1 no hydrogen 3.601 N/A CYS 222.A SG PHE 205.A O no hydrogen 3.510 N/A CYS 222.A SG LEU 224.A O no hydrogen 3.431 N/A GLN 226.A N THR 14.A O no hydrogen 2.889 N/A GLN 226.A NE2 GLN 53.A O no hydrogen 2.923 N/A GLN 226.A NE2 LEU 54.A O no hydrogen 2.926 N/A GLU 227.A N GLU 227.A OE1 no hydrogen 2.752 N/A TRP 228.A N PRO 225.A O no hydrogen 3.013 N/A ILE 229.A N PRO 225.A O no hydrogen 3.283 N/A GLN 230.A N GLN 226.A O no hydrogen 2.894 N/A GLN 230.A NE2 LEU 54.A O no hydrogen 2.950 N/A HIS 231.A N GLU 227.A O no hydrogen 2.903 N/A HIS 231.A NE2 THR 4.A OG1 no hydrogen 2.801 N/A LEU 232.A N TRP 228.A O no hydrogen 2.800 N/A TYR 233.A N ILE 229.A O no hydrogen 2.926 N/A GLN 234.A N GLN 230.A O no hydrogen 3.128 N/A GLU 235.A N HIS 231.A O no hydrogen 2.871 N/A SER 236.A N LEU 232.A O no hydrogen 2.856 N/A SER 236.A OG TYR 233.A O no hydrogen 3.109 N/A SER 241.A OG VAL 292.A O no hydrogen 2.647 N/A VAL 243.A N SER 241.A OG no hydrogen 3.393 N/A ALA 244.A N LEU 262.A O no hydrogen 2.747 N/A LEU 245.A N SER 290.A O no hydrogen 2.728 N/A ILE 246.A N ALA 260.A O no hydrogen 2.984 N/A ARG 247.A N ARG 287.A O no hydrogen 2.903 N/A PHE 248.A N PHE 258.A O no hydrogen 2.895 N/A THR 249.A N TYR 285.A O no hydrogen 2.901 N/A THR 249.A OG1 ARG 247.A O no hydrogen 3.130 N/A ASN 250.A N ARG 255.A O no hydrogen 2.793 N/A ASP 252.A N ASN 250.A OD1 no hydrogen 2.894 N/A THR 253.A N ASN 250.A OD1 no hydrogen 3.309 N/A GLY 254.A N ASN 250.A O no hydrogen 2.728 N/A ARG 255.A N THR 253.A OG1 no hydrogen 3.209 N/A LEU 257.A N PHE 248.A O no hydrogen 2.829 N/A ALA 260.A N ILE 246.A O no hydrogen 2.874 N/A LYS 261.A N THR 269.A O no hydrogen 2.917 N/A LYS 261.A NZ GLU 200.A OE2 no hydrogen 2.654 N/A LYS 261.A NZ GLN 294.A O no hydrogen 3.003 N/A LYS 261.A NZ TYR 296.A O no hydrogen 2.691 N/A LEU 262.A N ALA 244.A O no hydrogen 2.722 N/A HIS 263.A N TYR 267.A O no hydrogen 2.765 N/A HIS 263.A NE2 THR 269.A OG1 no hydrogen 2.756 N/A ARG 264.A N ASP 242.A O no hydrogen 2.888 N/A GLY 266.A N HIS 263.A O no hydrogen 2.839 N/A TYR 267.A OH ALA 194.A O no hydrogen 3.335 N/A THR 269.A N LYS 261.A O no hydrogen 2.902 N/A THR 269.A OG1 GLU 200.A OE1 no hydrogen 2.617 N/A THR 269.A OG1 HIS 263.A NE2 no hydrogen 2.756 N/A VAL 270.A N GLN 201.A O no hydrogen 2.803 N/A ASN 272.A N GLY 199.A O no hydrogen 3.099 N/A GLY 274.A N ASN 272.A OD1 no hydrogen 3.164 N/A ILE 278.A N LEU 25.A O no hydrogen 3.255 N/A ASN 283.A ND2 ASN 250.A OD1 no hydrogen 2.809 N/A ASN 283.A ND2 ASP 252.A OD2 no hydrogen 2.745 N/A GLY 284.A N PRO 281.A O no hydrogen 3.137 N/A TYR 285.A N THR 249.A O no hydrogen 3.119 N/A ARG 287.A N ARG 247.A O no hydrogen 2.935 N/A ASP 289.A N LEU 245.A O no hydrogen 2.806 N/A SER 290.A N LEU 245.A O no hydrogen 3.382 N/A SER 290.A OG ASP 289.A OD1 no hydrogen 2.770 N/A VAL 292.A N VAL 243.A O no hydrogen 2.946 N/A PHE 295.A N ASN 293.A OD1 no hydrogen 3.014 N/A TYR 296.A N ASN 293.A O no hydrogen 3.053 N/A ALA 299.A N GLU 259.A OE2 no hydrogen 2.892 N/A MET 301.A N ALA 271.A O no hydrogen 2.907 N/A