Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1knd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N GLN 74.A OE1 no hydrogen 3.387 N/A ARG 3.A N GLU 65.A O no hydrogen 2.751 N/A GLY 6.A N GLY 63.A O no hydrogen 2.769 N/A TYR 7.A N GLY 63.A O no hydrogen 3.275 N/A TYR 7.A OH GLU 114.A OE1 no hydrogen 2.741 N/A MET 8.A N ARG 48.A O no hydrogen 2.963 N/A GLY 9.A N PHE 61.A O no hydrogen 2.859 N/A PHE 10.A N ALA 50.A O no hydrogen 2.871 N/A ALA 11.A N ASP 58.A O no hydrogen 3.019 N/A VAL 12.A N GLN 52.A O no hydrogen 2.789 N/A SER 13.A N ASP 57.A OD1 no hydrogen 2.958 N/A SER 13.A OG ASP 57.A OD1 no hydrogen 3.346 N/A SER 13.A OG ASP 57.A OD2 no hydrogen 2.782 N/A ALA 17.A N ASP 14.A OD1 no hydrogen 3.078 N/A TRP 18.A N ASP 14.A O no hydrogen 3.185 N/A TRP 18.A NE1 SER 254.A OG no hydrogen 2.747 N/A ARG 19.A N VAL 15.A O no hydrogen 2.924 N/A ARG 19.A NE ASP 38.A OD2 no hydrogen 2.776 N/A ARG 19.A NH2 ASP 38.A OD1 no hydrogen 3.497 N/A ARG 19.A NH2 ASP 38.A OD2 no hydrogen 2.655 N/A SER 20.A N ALA 16.A O no hydrogen 3.087 N/A SER 20.A OG GLN 24.A OE1 no hydrogen 2.944 N/A PHE 21.A N ALA 17.A O no hydrogen 2.929 N/A LEU 22.A N TRP 18.A O no hydrogen 2.872 N/A THR 23.A N ARG 19.A O no hydrogen 3.123 N/A THR 23.A OG1 ARG 19.A O no hydrogen 2.824 N/A GLN 24.A N SER 20.A O no hydrogen 2.897 N/A LYS 25.A N PHE 21.A O no hydrogen 3.046 N/A LYS 25.A NZ ASP 230.A OD2 no hydrogen 2.716 N/A LEU 26.A N PHE 21.A O no hydrogen 3.188 N/A LEU 28.A N LEU 22.A O no hydrogen 2.900 N/A MET 29.A N ARG 41.A O no hydrogen 2.969 N/A ALA 31.A N LEU 39.A O no hydrogen 2.714 N/A THR 33.A OG1 ASP 38.A OD1 no hydrogen 2.982 N/A THR 34.A N GLY 37.A O no hydrogen 2.883 N/A ASN 36.A N THR 34.A OG1 no hydrogen 2.973 N/A GLY 37.A N THR 34.A O no hydrogen 2.881 N/A ASP 38.A N VAL 51.A O no hydrogen 2.964 N/A LEU 39.A N GLY 32.A O no hydrogen 2.771 N/A PHE 40.A N ILE 49.A O no hydrogen 2.890 N/A ARG 41.A N MET 29.A O no hydrogen 2.770 N/A ARG 41.A NE ASP 43.A O no hydrogen 3.263 N/A ARG 41.A NE ARG 45.A O no hydrogen 3.077 N/A ARG 41.A NH1 LYS 125.A O no hydrogen 2.717 N/A ARG 41.A NH2 ASP 43.A O no hydrogen 2.976 N/A ARG 41.A NH2 LYS 125.A O no hydrogen 2.902 N/A SER 44.A OG GLU 121.A OE1 no hydrogen 2.774 N/A ARG 45.A N ASP 43.A OD1 no hydrogen 3.184 N/A ARG 45.A NH1 GLU 65.A OE2 no hydrogen 2.705 N/A ARG 45.A NH2 GLU 65.A OE1 no hydrogen 3.264 N/A ARG 45.A NH2 GLU 65.A OE2 no hydrogen 3.415 N/A ALA 46.A N SER 120.A O no hydrogen 2.832 N/A TRP 47.A NE1 ARG 97.A O no hydrogen 2.822 N/A ARG 48.A N PHE 40.A O no hydrogen 2.875 N/A ARG 48.A NE ASP 43.A OD1 no hydrogen 3.281 N/A ARG 48.A NE ASP 43.A OD2 no hydrogen 3.336 N/A ARG 48.A NH1 GLY 6.A O no hydrogen 2.866 N/A ARG 48.A NH2 ASP 43.A OD2 no hydrogen 2.847 N/A ILE 49.A N PHE 40.A O no hydrogen 3.311 N/A ALA 50.A N MET 8.A O no hydrogen 2.985 N/A VAL 51.A N ASP 38.A O no hydrogen 2.861 N/A GLN 52.A N PHE 10.A O no hydrogen 2.816 N/A GLN 52.A NE2 ASN 36.A O no hydrogen 3.106 N/A GLN 53.A NE2 VAL 12.A O no hydrogen 3.447 N/A GLY 54.A N VAL 12.A O no hydrogen 2.756 N/A ASP 58.A N ALA 11.A O no hydrogen 3.174 N/A LEU 59.A N ASP 58.A OD1 no hydrogen 2.729 N/A ALA 60.A N GLY 9.A O no hydrogen 2.665 N/A PHE 61.A N GLY 9.A O no hydrogen 3.330 N/A ALA 62.A N PRO 112.A O no hydrogen 3.375 N/A GLY 63.A N TYR 7.A O no hydrogen 2.820 N/A TYR 64.A N GLU 114.A O no hydrogen 2.746 N/A GLU 65.A N SER 4.A O no hydrogen 2.825 N/A VAL 66.A N TYR 116.A O no hydrogen 2.908 N/A GLY 71.A N ASP 68.A OD1 no hydrogen 2.803 N/A LEU 72.A N ASP 68.A O no hydrogen 3.051 N/A ALA 73.A N ALA 69.A O no hydrogen 3.015 N/A GLN 74.A N ALA 70.A O no hydrogen 2.921 N/A MET 75.A N GLY 71.A O no hydrogen 3.083 N/A ALA 76.A N LEU 72.A O no hydrogen 2.965 N/A ASP 77.A N ALA 73.A O no hydrogen 2.981 N/A LYS 78.A N GLN 74.A O no hydrogen 2.902 N/A LEU 79.A N MET 75.A O no hydrogen 2.902 N/A LYS 80.A N ALA 76.A O no hydrogen 2.979 N/A GLN 81.A N ASP 77.A O no hydrogen 2.856 N/A ALA 82.A N LEU 79.A O no hydrogen 3.021 N/A GLY 83.A N LYS 80.A O no hydrogen 2.759 N/A ILE 84.A N LEU 79.A O no hydrogen 2.960 N/A THR 87.A N THR 104.A O no hydrogen 2.864 N/A GLY 89.A N LEU 102.A O no hydrogen 2.777 N/A SER 92.A N ASP 90.A OD2 no hydrogen 2.930 N/A LEU 93.A N ASP 90.A OD1 no hydrogen 3.117 N/A ALA 94.A N ASP 90.A O no hydrogen 2.979 N/A ARG 95.A N ALA 91.A O no hydrogen 2.828 N/A ARG 96.A N SER 92.A O no hydrogen 3.010 N/A ARG 97.A N LEU 93.A O no hydrogen 2.913 N/A ARG 97.A NE GLU 114.A OE1 no hydrogen 2.863 N/A ARG 97.A NE GLU 114.A OE2 no hydrogen 3.330 N/A ARG 97.A NH1 ASN 36.A OD1 no hydrogen 2.736 N/A ARG 97.A NH2 GLU 114.A OE2 no hydrogen 2.682 N/A GLY 98.A N ARG 95.A O no hydrogen 3.219 N/A VAL 99.A N ALA 94.A O no hydrogen 2.982 N/A THR 100.A N TYR 117.A O no hydrogen 2.997 N/A THR 100.A OG1 GLY 118.A O no hydrogen 2.858 N/A GLY 101.A N TYR 117.A O no hydrogen 3.355 N/A ILE 103.A N ILE 115.A O no hydrogen 2.910 N/A THR 104.A N THR 87.A O no hydrogen 2.748 N/A THR 104.A OG1 THR 87.A O no hydrogen 3.391 N/A PHE 105.A N LEU 113.A O no hydrogen 3.049 N/A ASP 107.A N LEU 111.A O no hydrogen 2.846 N/A PHE 109.A N ASP 107.A OD1 no hydrogen 2.994 N/A GLY 110.A N ASP 107.A O no hydrogen 2.991 N/A LEU 111.A N ASP 107.A OD1 no hydrogen 2.947 N/A LEU 113.A N PHE 105.A O no hydrogen 2.753 N/A GLU 114.A N ALA 62.A O no hydrogen 2.920 N/A ILE 115.A N ILE 103.A O no hydrogen 3.001 N/A TYR 116.A N TYR 64.A O no hydrogen 2.932 N/A TYR 116.A OH GLU 65.A OE2 no hydrogen 2.595 N/A TYR 117.A N GLY 101.A O no hydrogen 3.025 N/A SER 120.A OG GLY 98.A O no hydrogen 2.797 N/A VAL 122.A N SER 44.A O no hydrogen 2.753 N/A GLU 124.A N GLU 124.A OE1 no hydrogen 2.673 N/A LYS 125.A N VAL 122.A O no hydrogen 3.016 N/A GLY 130.A N GLY 27.A O no hydrogen 3.162 N/A GLY 130.A N LEU 28.A O no hydrogen 3.202 N/A SER 134.A N ASP 219.A OD1 no hydrogen 2.806 N/A SER 134.A OG ASP 219.A OD1 no hydrogen 3.512 N/A SER 134.A OG ASP 219.A OD2 no hydrogen 2.588 N/A LEU 137.A N GLU 213.A O no hydrogen 2.785 N/A THR 138.A OG1 ASP 43.A OD2 no hydrogen 2.738 N/A GLN 141.A N THR 138.A O no hydrogen 2.984 N/A GLY 142.A N GLY 139.A O no hydrogen 2.982 N/A LEU 143.A N LEU 5.A O no hydrogen 2.899 N/A HIS 145.A NE2 GLU 259.A OE2 no hydrogen 3.234 N/A PHE 146.A N THR 195.A O no hydrogen 3.399 N/A VAL 147.A N HIS 209.A O no hydrogen 3.003 N/A ARG 148.A N ALA 197.A O no hydrogen 2.853 N/A ARG 148.A NE ASP 107.A OD2 no hydrogen 2.734 N/A ARG 148.A NH1 ARG 206.A O no hydrogen 3.151 N/A ARG 148.A NH2 ASP 107.A OD1 no hydrogen 2.900 N/A ARG 148.A NH2 ASP 107.A OD2 no hydrogen 3.104 N/A ARG 148.A NH2 PHE 109.A O no hydrogen 3.409 N/A CYS 149.A N ARG 206.A O no hydrogen 2.928 N/A VAL 150.A N ALA 199.A O no hydrogen 2.994 N/A LYS 155.A N ASP 152.A OD1 no hydrogen 3.301 N/A ALA 156.A N ASP 152.A O no hydrogen 3.199 N/A LEU 157.A N SER 153.A O no hydrogen 2.743 N/A ALA 158.A N ASP 154.A O no hydrogen 3.018 N/A PHE 159.A N LYS 155.A O no hydrogen 3.180 N/A TYR 160.A N ALA 156.A O no hydrogen 2.966 N/A TYR 160.A OH ASP 107.A OD2 no hydrogen 2.891 N/A THR 161.A N LEU 157.A O no hydrogen 2.899 N/A THR 161.A OG1 LEU 157.A O no hydrogen 2.795 N/A THR 161.A OG1 ASP 162.A OD1 no hydrogen 3.413 N/A ASP 162.A N ALA 158.A O no hydrogen 2.860 N/A VAL 163.A N PHE 159.A O no hydrogen 2.984 N/A LEU 164.A N PHE 159.A O no hydrogen 3.021 N/A GLY 165.A N THR 161.A O no hydrogen 3.061 N/A PHE 166.A N TYR 160.A O no hydrogen 2.978 N/A GLN 167.A N HIS 188.A O no hydrogen 2.886 N/A GLN 167.A NE2 GLY 165.A O no hydrogen 3.004 N/A SER 169.A N PHE 186.A O no hydrogen 2.675 N/A SER 169.A OG HIS 188.A ND1 no hydrogen 2.668 N/A SER 169.A OG HIS 193.A O no hydrogen 2.625 N/A ASP 170.A N PHE 186.A O no hydrogen 3.469 N/A VAL 171.A N VAL 274.A O no hydrogen 3.179 N/A ILE 172.A N ALA 184.A O no hydrogen 3.005 N/A ASP 173.A N HIS 276.A O no hydrogen 3.010 N/A MET 174.A N VAL 182.A O no hydrogen 2.774 N/A MET 176.A N VAL 180.A O no hydrogen 2.776 N/A VAL 180.A N GLY 177.A O no hydrogen 3.294 N/A VAL 182.A N MET 174.A O no hydrogen 2.808 N/A ALA 184.A N ILE 172.A O no hydrogen 2.814 N/A TYR 185.A N ILE 198.A O no hydrogen 2.803 N/A PHE 186.A N ASP 170.A O no hydrogen 3.002 N/A LEU 187.A N LEU 196.A O no hydrogen 2.766 N/A HIS 188.A N GLN 167.A O no hydrogen 2.806 N/A HIS 188.A ND1 SER 169.A OG no hydrogen 2.668 N/A CYS 189.A SG ARG 3.A O no hydrogen 3.934 N/A CYS 189.A SG THR 195.A OG1 no hydrogen 3.618 N/A ASN 190.A ND2 ARG 3.A O no hydrogen 2.707 N/A ARG 192.A N ASN 190.A OD1 no hydrogen 2.916 N/A ARG 192.A NE GLN 141.A O no hydrogen 2.860 N/A ARG 192.A NH1 GLU 213.A OE1 no hydrogen 2.781 N/A ARG 192.A NH2 LEU 137.A O no hydrogen 3.000 N/A ARG 192.A NH2 GLY 142.A O no hydrogen 2.957 N/A HIS 193.A ND1 HIS 194.A ND1 no hydrogen 2.927 N/A HIS 193.A NE2 ASP 170.A OD2 no hydrogen 2.666 N/A HIS 194.A ND1 HIS 193.A ND1 no hydrogen 2.927 N/A THR 195.A N LEU 187.A O no hydrogen 2.816 N/A LEU 196.A N LEU 187.A O no hydrogen 3.287 N/A ALA 197.A N PHE 146.A O no hydrogen 3.128 N/A ILE 198.A N TYR 185.A O no hydrogen 2.724 N/A ALA 199.A N ARG 148.A O no hydrogen 3.214 N/A LEU 203.A N PHE 201.A O no hydrogen 2.928 N/A LYS 205.A NZ VAL 56.A O no hydrogen 3.122 N/A LYS 205.A NZ ASP 57.A O no hydrogen 2.708 N/A ARG 206.A N ASP 58.A OD2 no hydrogen 2.790 N/A ARG 206.A NH1 LEU 59.A O no hydrogen 2.703 N/A HIS 208.A N VAL 147.A O no hydrogen 2.843 N/A HIS 208.A ND1 HIS 209.A ND1 no hydrogen 2.794 N/A HIS 209.A ND1 HIS 208.A ND1 no hydrogen 2.794 N/A PHE 210.A N GLU 257.A O no hydrogen 3.271 N/A MET 211.A N HIS 145.A O no hydrogen 2.718 N/A LEU 212.A N GLU 259.A O no hydrogen 3.025 N/A VAL 214.A N GLY 261.A O no hydrogen 2.836 N/A ALA 215.A N GLY 135.A O no hydrogen 2.802 N/A SER 216.A N ASP 219.A OD2 no hydrogen 3.037 N/A ASP 219.A N SER 216.A O no hydrogen 3.122 N/A ASP 219.A N SER 216.A OG no hydrogen 3.359 N/A GLY 221.A N LEU 217.A O no hydrogen 2.919 N/A PHE 222.A N ASP 218.A O no hydrogen 2.851 N/A ALA 223.A N ASP 219.A O no hydrogen 3.145 N/A PHE 224.A N VAL 220.A O no hydrogen 2.892 N/A ASP 225.A N GLY 221.A O no hydrogen 3.339 N/A ARG 226.A N PHE 222.A O no hydrogen 3.098 N/A ARG 226.A NE LYS 25.A O no hydrogen 2.894 N/A ARG 226.A NH2 LYS 25.A O no hydrogen 2.900 N/A VAL 227.A N ALA 223.A O no hydrogen 2.957 N/A ASP 228.A N PHE 224.A O no hydrogen 2.774 N/A ALA 229.A N ASP 225.A O no hydrogen 3.033 N/A ASP 230.A N VAL 227.A O no hydrogen 3.111 N/A GLY 231.A N ASP 228.A O no hydrogen 2.820 N/A LEU 232.A N VAL 227.A O no hydrogen 3.256 N/A THR 234.A N TYR 249.A O no hydrogen 2.901 N/A THR 234.A OG1 GLU 257.A OE1 no hydrogen 2.601 N/A SER 235.A N TYR 249.A O no hydrogen 3.426 N/A THR 236.A N LYS 285.A O no hydrogen 3.001 N/A GLY 238.A N SER 247.A O no hydrogen 3.062 N/A ARG 239.A N TRP 282.A O no hydrogen 2.920 N/A ARG 239.A NH1 HIS 244.A O no hydrogen 2.683 N/A HIS 240.A N MET 245.A O no hydrogen 2.961 N/A HIS 240.A ND1 PRO 279.A O no hydrogen 2.860 N/A HIS 240.A NE2 GLU 259.A OE1 no hydrogen 2.990 N/A THR 241.A N PRO 279.A O no hydrogen 3.139 N/A THR 241.A OG1 SER 278.A O no hydrogen 2.727 N/A ASN 242.A ND2 ASP 170.A OD1 no hydrogen 2.973 N/A ASP 243.A N ASN 242.A OD1 no hydrogen 2.861 N/A MET 245.A N ASP 243.A OD1 no hydrogen 3.017 N/A VAL 246.A N TRP 262.A O no hydrogen 2.981 N/A SER 247.A N GLY 238.A O no hydrogen 2.896 N/A SER 247.A OG GLU 259.A OE1 no hydrogen 2.757 N/A SER 247.A OG HIS 284.A NE2 no hydrogen 3.035 N/A PHE 248.A N TYR 260.A O no hydrogen 3.327 N/A TYR 249.A N SER 235.A O no hydrogen 3.357 N/A TYR 249.A OH HIS 240.A NE2 no hydrogen 2.731 N/A ALA 250.A N VAL 258.A O no hydrogen 2.926 N/A SER 251.A N LEU 232.A O no hydrogen 2.869 N/A SER 251.A OG THR 252.A O no hydrogen 3.445 N/A THR 252.A N VAL 256.A O no hydrogen 2.951 N/A THR 252.A OG1 VAL 256.A O no hydrogen 2.668 N/A SER 254.A N THR 252.A OG1 no hydrogen 3.252 N/A SER 254.A OG ASP 57.A OD1 no hydrogen 2.819 N/A GLY 255.A N THR 252.A O no hydrogen 3.072 N/A GLU 257.A N HIS 208.A O no hydrogen 3.302 N/A VAL 258.A N ALA 250.A O no hydrogen 2.844 N/A GLU 259.A N PHE 210.A O no hydrogen 2.842 N/A TYR 260.A N PHE 248.A O no hydrogen 3.102 N/A TYR 260.A OH LEU 26.A O no hydrogen 2.728 N/A GLY 261.A N LEU 212.A O no hydrogen 3.075 N/A TRP 262.A N VAL 246.A O no hydrogen 2.862 N/A ALA 264.A N GLU 213.A OE2 no hydrogen 3.362 N/A ARG 265.A N ASP 243.A O no hydrogen 2.751 N/A ARG 265.A NE ASN 242.A O no hydrogen 2.892 N/A ARG 265.A NH2 ASN 242.A O no hydrogen 2.934 N/A VAL 267.A N GLU 191.A O no hydrogen 2.804 N/A SER 270.A N ASP 268.A OD2 no hydrogen 2.923 N/A SER 270.A OG ASP 268.A OD1 no hydrogen 2.866 N/A SER 270.A OG ASP 268.A OD2 no hydrogen 2.641 N/A TRP 271.A N ASP 268.A O no hydrogen 3.235 N/A TRP 271.A NE1 SER 169.A O no hydrogen 2.781 N/A ARG 275.A NH1 ASP 277.A OD2 no hydrogen 2.838 N/A ARG 275.A NH2 ASP 173.A OD2 no hydrogen 2.690 N/A ARG 275.A NH2 ASP 277.A OD1 no hydrogen 2.671 N/A ARG 275.A NH2 ASP 277.A OD2 no hydrogen 3.283 N/A HIS 276.A N VAL 171.A O no hydrogen 2.918 N/A SER 280.A OG HIS 284.A ND1 no hydrogen 2.710 N/A MET 281.A N ARG 239.A O no hydrogen 2.794 N/A HIS 284.A N LEU 237.A O no hydrogen 2.993 N/A HIS 284.A ND1 SER 280.A OG no hydrogen 2.710 N/A HIS 284.A NE2 SER 247.A OG no hydrogen 3.035 N/A LYS 285.A N THR 236.A OG1 no hydrogen 2.865 N/A VAL 287.A N THR 234.A O no hydrogen 2.846 N/A ARG 288.A NE GLU 257.A OE2 no hydrogen 2.967 N/A ARG 288.A NH1 SER 286.A OG no hydrogen 2.969 N/A ARG 288.A NH2 GLU 257.A OE1 no hydrogen 2.873 N/A ARG 288.A NH2 GLU 257.A OE2 no hydrogen 3.478 N/A