Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1kw1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 3.A N HIS 184.A O no hydrogen 2.979 N/A LEU 4.A N ASP 28.A OD2 no hydrogen 2.785 N/A GLN 5.A N PHE 186.A O no hydrogen 2.847 N/A GLN 5.A NE2 GLU 31.A OE1 no hydrogen 3.032 N/A VAL 6.A N ILE 29.A O no hydrogen 2.967 N/A ALA 7.A N ALA 188.A O no hydrogen 3.113 N/A LEU 8.A N GLU 31.A O no hydrogen 2.982 N/A THR 12.A OG1 ASP 14.A OD1 no hydrogen 2.783 N/A MET 13.A N GLU 40.A OE2 no hydrogen 2.736 N/A SER 15.A N THR 12.A O no hydrogen 3.219 N/A SER 15.A OG ASN 10.A OD1 no hydrogen 3.094 N/A ALA 16.A N THR 12.A O no hydrogen 3.217 N/A TYR 17.A N MET 13.A O no hydrogen 2.921 N/A GLU 18.A N SER 15.A O no hydrogen 3.140 N/A THR 19.A N ALA 16.A O no hydrogen 2.953 N/A THR 20.A N ALA 16.A O no hydrogen 3.113 N/A THR 20.A OG1 TYR 52.A OH no hydrogen 2.875 N/A ARG 21.A N TYR 17.A O no hydrogen 2.950 N/A LEU 22.A N THR 19.A O no hydrogen 3.052 N/A ILE 23.A N THR 19.A O no hydrogen 3.015 N/A ALA 24.A N THR 20.A O no hydrogen 2.913 N/A GLU 26.A N ILE 23.A O no hydrogen 2.820 N/A ASP 28.A N LEU 4.A O no hydrogen 2.947 N/A ILE 29.A N LEU 4.A O no hydrogen 3.207 N/A ILE 30.A N ILE 56.A O no hydrogen 2.846 N/A GLU 31.A N VAL 6.A O no hydrogen 2.990 N/A VAL 32.A N LEU 58.A O no hydrogen 2.684 N/A GLY 33.A N LEU 8.A O no hydrogen 2.893 N/A THR 34.A OG1 ASP 60.A O no hydrogen 2.847 N/A CYS 37.A N GLY 33.A O no hydrogen 2.937 N/A CYS 37.A SG VAL 32.A O no hydrogen 3.719 N/A CYS 37.A SG GLY 33.A O no hydrogen 3.426 N/A CYS 37.A SG ASP 60.A O no hydrogen 4.014 N/A VAL 38.A N THR 34.A O no hydrogen 2.940 N/A GLY 39.A N ILE 35.A O no hydrogen 2.986 N/A GLU 40.A N LEU 36.A O no hydrogen 2.930 N/A GLY 41.A N CYS 37.A O no hydrogen 2.722 N/A ARG 43.A NE ASP 47.A OD2 no hydrogen 3.289 N/A ARG 43.A NH2 ASP 47.A OD2 no hydrogen 2.874 N/A ALA 44.A N GLY 41.A O no hydrogen 3.149 N/A VAL 45.A N VAL 42.A O no hydrogen 3.012 N/A ARG 46.A N VAL 42.A O no hydrogen 3.353 N/A ASP 47.A N ARG 43.A O no hydrogen 2.833 N/A LEU 48.A N ALA 44.A O no hydrogen 2.982 N/A LYS 49.A N VAL 45.A O no hydrogen 3.059 N/A LYS 49.A NZ PRO 53.A O no hydrogen 3.246 N/A LYS 49.A NZ LYS 55.A O no hydrogen 2.788 N/A LYS 49.A NZ ASP 80.A OD1 no hydrogen 3.563 N/A LYS 49.A NZ ASP 80.A OD2 no hydrogen 2.766 N/A ALA 50.A N ARG 46.A O no hydrogen 3.231 N/A LEU 51.A N ASP 47.A O no hydrogen 3.122 N/A TYR 52.A N LEU 48.A O no hydrogen 2.807 N/A TYR 52.A OH THR 20.A OG1 no hydrogen 2.875 N/A HIS 54.A N HIS 54.A ND1 no hydrogen 2.795 N/A HIS 54.A NE2 GLU 25.A OE1 no hydrogen 3.254 N/A HIS 54.A NE2 GLU 25.A OE2 no hydrogen 2.969 N/A LYS 55.A N TYR 52.A O no hydrogen 3.132 N/A LYS 55.A NZ VAL 27.A O no hydrogen 2.797 N/A ILE 56.A N ASP 28.A O no hydrogen 3.341 N/A VAL 57.A N ASP 80.A OD2 no hydrogen 2.754 N/A LEU 58.A N ILE 30.A O no hydrogen 3.085 N/A ALA 59.A N TRP 81.A O no hydrogen 2.844 N/A ASP 60.A N VAL 32.A O no hydrogen 3.043 N/A ALA 61.A N ALA 59.A O no hydrogen 2.783 N/A LYS 62.A N THR 83.A OG1 no hydrogen 2.863 N/A LYS 62.A NZ THR 34.A OG1 no hydrogen 2.993 N/A LYS 62.A NZ ASP 60.A OD1 no hydrogen 3.135 N/A ILE 63.A N THR 83.A O no hydrogen 2.968 N/A LEU 70.A N ALA 66.A O no hydrogen 3.003 N/A SER 71.A N GLY 67.A O no hydrogen 3.119 N/A SER 71.A OG GLY 67.A O no hydrogen 2.712 N/A SER 71.A OG LYS 68.A O no hydrogen 3.565 N/A ARG 72.A N LYS 68.A O no hydrogen 3.289 N/A ARG 72.A NH1 GLU 102.A OE1 no hydrogen 3.466 N/A ARG 72.A NH2 GLU 102.A OE1 no hydrogen 3.487 N/A ARG 72.A NH2 GLU 102.A OE2 no hydrogen 3.496 N/A MET 73.A N ILE 69.A O no hydrogen 3.306 N/A CYS 74.A N LEU 70.A O no hydrogen 3.286 N/A CYS 74.A SG LEU 70.A O no hydrogen 3.615 N/A PHE 75.A N SER 71.A O no hydrogen 2.884 N/A GLU 76.A N ARG 72.A O no hydrogen 2.806 N/A ALA 77.A N CYS 74.A O no hydrogen 3.045 N/A ASN 78.A N PHE 75.A O no hydrogen 2.957 N/A ALA 79.A N CYS 74.A O no hydrogen 2.996 N/A ASP 80.A N VAL 57.A O no hydrogen 2.853 N/A TRP 81.A N VAL 57.A O no hydrogen 3.331 N/A VAL 82.A N ASP 106.A O no hydrogen 3.271 N/A THR 83.A N ALA 59.A O no hydrogen 3.210 N/A THR 83.A OG1 ASP 60.A OD1 no hydrogen 2.590 N/A VAL 84.A N GLN 108.A O no hydrogen 2.821 N/A ILE 85.A N ILE 63.A O no hydrogen 2.957 N/A CYS 86.A N GLU 110.A O no hydrogen 2.988 N/A CYS 86.A SG GLU 110.A O no hydrogen 3.332 N/A CYS 86.A SG THR 112.A O no hydrogen 3.643 N/A CYS 86.A SG TYR 114.A O no hydrogen 3.642 N/A ALA 88.A N ILE 85.A O no hydrogen 3.067 N/A ASN 91.A N ASP 89.A OD2 no hydrogen 2.887 N/A ASN 91.A ND2 ASP 89.A OD2 no hydrogen 2.736 N/A THR 92.A N ASP 89.A O no hydrogen 2.905 N/A THR 92.A OG1 ASP 65.A OD1 no hydrogen 3.536 N/A ALA 93.A N ASP 89.A O no hydrogen 3.316 N/A LYS 94.A N ILE 90.A O no hydrogen 2.993 N/A GLY 95.A N ASN 91.A O no hydrogen 3.008 N/A ALA 96.A N THR 92.A O no hydrogen 3.162 N/A LEU 97.A N ALA 93.A O no hydrogen 3.191 N/A ASP 98.A N LYS 94.A O no hydrogen 3.009 N/A VAL 99.A N GLY 95.A O no hydrogen 3.092 N/A ALA 100.A N ALA 96.A O no hydrogen 2.827 N/A LYS 101.A N LEU 97.A O no hydrogen 2.963 N/A GLU 102.A N VAL 99.A O no hydrogen 2.867 N/A PHE 103.A N ALA 100.A O no hydrogen 3.060 N/A ASN 104.A N LYS 101.A O no hydrogen 3.239 N/A GLY 105.A N ALA 100.A O no hydrogen 2.761 N/A ASP 106.A N ASP 80.A O no hydrogen 3.075 N/A VAL 107.A N ASP 106.A OD1 no hydrogen 2.732 N/A GLN 108.A N VAL 82.A O no hydrogen 2.994 N/A ILE 109.A N GLN 130.A O no hydrogen 3.024 N/A GLU 110.A N VAL 84.A O no hydrogen 2.826 N/A LEU 111.A N VAL 132.A O no hydrogen 2.873 N/A THR 112.A OG1 GLU 110.A OE1 no hydrogen 2.442 N/A THR 112.A OG1 HIS 134.A ND1 no hydrogen 2.683 N/A THR 116.A N GLN 119.A OE1 no hydrogen 3.127 N/A THR 116.A OG1 GLU 118.A OE1 no hydrogen 3.263 N/A GLN 119.A N THR 116.A OG1 no hydrogen 3.300 N/A ALA 120.A N THR 116.A O no hydrogen 3.150 N/A GLN 121.A N TRP 117.A O no hydrogen 2.979 N/A GLN 121.A NE2 ASP 125.A OD1 no hydrogen 3.133 N/A GLN 122.A N GLU 118.A O no hydrogen 3.047 N/A TRP 123.A N GLN 119.A O no hydrogen 2.932 N/A ARG 124.A N ALA 120.A O no hydrogen 3.362 N/A ARG 124.A NH1 ILE 128.A O no hydrogen 3.277 N/A ASP 125.A N GLN 121.A O no hydrogen 3.082 N/A ALA 126.A N GLN 122.A O no hydrogen 2.909 N/A GLY 127.A N ARG 124.A O no hydrogen 2.774 N/A ILE 128.A N TRP 123.A O no hydrogen 2.847 N/A GLN 130.A NE2 ASP 106.A OD2 no hydrogen 2.754 N/A VAL 131.A N LYS 163.A O no hydrogen 3.294 N/A VAL 132.A N ILE 109.A O no hydrogen 2.750 N/A TYR 133.A N THR 165.A O no hydrogen 2.801 N/A TYR 133.A OH ASP 150.A OD1 no hydrogen 2.609 N/A HIS 134.A ND1 THR 112.A OG1 no hydrogen 2.683 N/A ARG 135.A N THR 167.A O no hydrogen 3.059 N/A ARG 135.A NE GLY 168.A O no hydrogen 3.147 N/A ARG 135.A NH2 GLY 168.A O no hydrogen 2.781 N/A ALA 139.A N SER 136.A OG no hydrogen 3.230 N/A GLN 140.A N SER 136.A O no hydrogen 2.781 N/A ALA 141.A N ARG 137.A O no hydrogen 3.033 N/A ALA 142.A N ALA 139.A O no hydrogen 2.911 N/A GLY 143.A N GLN 140.A O no hydrogen 2.907 N/A VAL 144.A N ALA 139.A O no hydrogen 3.136 N/A GLY 147.A N ASP 150.A OD2 no hydrogen 2.737 N/A ILE 151.A N GLY 147.A O no hydrogen 3.134 N/A THR 152.A N GLU 148.A O no hydrogen 2.772 N/A THR 152.A OG1 GLU 148.A O no hydrogen 3.140 N/A ALA 153.A N ALA 149.A O no hydrogen 3.039 N/A ILE 154.A N ASP 150.A O no hydrogen 2.871 N/A LYS 155.A N ILE 151.A O no hydrogen 2.937 N/A ARG 156.A N THR 152.A O no hydrogen 2.919 N/A LEU 157.A N ALA 153.A O no hydrogen 2.850 N/A SER 158.A N ILE 154.A O no hydrogen 3.064 N/A ASP 159.A N LYS 155.A O no hydrogen 2.852 N/A MET 160.A N ARG 156.A O no hydrogen 3.034 N/A MET 160.A N LEU 157.A O no hydrogen 3.122 N/A GLY 161.A N SER 158.A O no hydrogen 2.903 N/A PHE 162.A N LEU 157.A O no hydrogen 3.392 N/A LYS 163.A N GLY 129.A O no hydrogen 2.902 N/A THR 165.A N VAL 131.A O no hydrogen 3.083 N/A VAL 166.A N VAL 185.A O no hydrogen 2.972 N/A THR 167.A N TYR 133.A O no hydrogen 3.111 N/A ALA 171.A N ASP 174.A OD2 no hydrogen 2.828 N/A ASP 174.A N ALA 171.A O no hydrogen 2.675 N/A LEU 177.A N ASP 174.A O no hydrogen 3.249 N/A PHE 178.A N LEU 175.A O no hydrogen 2.995 N/A LYS 179.A N PRO 176.A O no hydrogen 3.068 N/A ILE 181.A N PHE 178.A O no hydrogen 3.376 N/A ILE 183.A N ILE 181.A O no hydrogen 2.813 N/A HIS 184.A N VAL 164.A O no hydrogen 2.794 N/A VAL 185.A N VAL 164.A O no hydrogen 3.412 N/A PHE 186.A N MET 3.A O no hydrogen 2.871 N/A ILE 187.A N VAL 166.A O no hydrogen 3.127 N/A ALA 188.A N GLN 5.A O no hydrogen 2.868 N/A ARG 190.A NH1 GLN 140.A OE1 no hydrogen 2.646 N/A ARG 190.A NH2 GLN 140.A OE1 no hydrogen 3.154 N/A SER 191.A OG LEU 170.A O no hydrogen 3.070 N/A ILE 192.A N GLY 189.A O no hydrogen 3.131 N/A ARG 193.A N GLY 189.A O no hydrogen 2.834 N/A ARG 193.A NH1 ALA 7.A O no hydrogen 2.812 N/A ASP 194.A N ARG 190.A O no hydrogen 2.901 N/A ALA 195.A N ILE 192.A O no hydrogen 3.372 N/A GLU 200.A N SER 197.A OG no hydrogen 3.380 N/A ALA 201.A N SER 197.A O no hydrogen 2.897 N/A ALA 202.A N PRO 198.A O no hydrogen 2.896 N/A ARG 203.A N VAL 199.A O no hydrogen 2.975 N/A ARG 203.A NE GLU 26.A OE1 no hydrogen 3.101 N/A ARG 203.A NH2 GLU 26.A OE2 no hydrogen 3.259 N/A GLN 204.A N GLU 200.A O no hydrogen 2.968 N/A PHE 205.A N ALA 201.A O no hydrogen 3.277 N/A LYS 206.A N ALA 202.A O no hydrogen 3.096 N/A LYS 206.A NZ ASP 28.A OD1 no hydrogen 3.165 N/A LYS 206.A NZ ASP 28.A OD2 no hydrogen 2.995 N/A ARG 207.A N ARG 203.A O no hydrogen 2.778 N/A SER 208.A N GLN 204.A O no hydrogen 2.817 N/A ILE 209.A N PHE 205.A O no hydrogen 2.806 N/A ALA 210.A N LYS 206.A O no hydrogen 2.924 N/A GLU 211.A N ARG 207.A O no hydrogen 3.028 N/A LEU 212.A N SER 208.A O no hydrogen 2.937 N/A TRP 213.A N ILE 209.A O no hydrogen 2.849 N/A TRP 213.A NE1 ILE 181.A O no hydrogen 2.919 N/A