Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1kfj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N ASP 124.A O no hydrogen 3.142 N/A MET 1.A N ASN 147.A O no hydrogen 3.326 N/A ARG 3.A NE PRO 93.A O no hydrogen 2.875 N/A ARG 3.A NH1 ASP 124.A OD1 no hydrogen 2.625 N/A ARG 3.A NH2 PRO 93.A O no hydrogen 3.456 N/A TYR 4.A OH SER 125.A OG no hydrogen 2.744 N/A GLU 5.A N MET 1.A O no hydrogen 3.363 N/A ASN 6.A N GLU 2.A O no hydrogen 2.848 N/A LEU 7.A N ARG 3.A O no hydrogen 2.873 N/A PHE 8.A N TYR 4.A O no hydrogen 2.849 N/A ALA 9.A N GLU 5.A O no hydrogen 3.053 N/A GLN 10.A N ASN 6.A O no hydrogen 3.023 N/A LEU 11.A N LEU 7.A O no hydrogen 2.846 N/A ASN 12.A N PHE 8.A O no hydrogen 2.891 N/A ASP 13.A N ALA 9.A O no hydrogen 3.221 N/A ARG 14.A N LEU 11.A O no hydrogen 2.927 N/A ARG 15.A N ASN 12.A O no hydrogen 2.971 N/A GLU 16.A N LEU 11.A O no hydrogen 2.879 N/A GLY 17.A N SER 252.A O no hydrogen 2.822 N/A ALA 18.A N ALA 215.A O no hydrogen 2.880 N/A PHE 19.A N ASP 46.A OD2 no hydrogen 2.721 N/A VAL 20.A N ALA 217.A O no hydrogen 2.836 N/A PHE 22.A N SER 219.A O no hydrogen 3.157 N/A VAL 23.A N GLU 49.A O no hydrogen 3.044 N/A LEU 25.A N GLY 51.A O no hydrogen 2.903 N/A GLY 26.A N SER 33.A OG no hydrogen 2.938 N/A ASP 27.A N THR 24.A O no hydrogen 3.167 N/A GLN 32.A NE2 PRO 234.A O no hydrogen 3.567 N/A SER 33.A N GLY 29.A O no hydrogen 2.957 N/A LEU 34.A N ILE 30.A O no hydrogen 2.897 N/A LYS 35.A N GLU 31.A O no hydrogen 3.252 N/A ILE 36.A N GLN 32.A O no hydrogen 2.927 N/A ILE 37.A N SER 33.A O no hydrogen 2.868 N/A ASP 38.A N LEU 34.A O no hydrogen 2.968 N/A THR 39.A N LYS 35.A O no hydrogen 3.034 N/A THR 39.A OG1 LYS 35.A O no hydrogen 2.944 N/A LEU 40.A N ILE 36.A O no hydrogen 2.886 N/A ILE 41.A N ILE 37.A O no hydrogen 2.959 N/A ASP 42.A N ASP 38.A O no hydrogen 2.766 N/A ALA 43.A N THR 39.A O no hydrogen 2.937 N/A GLY 44.A N ILE 41.A O no hydrogen 2.956 N/A ALA 45.A N LEU 40.A O no hydrogen 3.085 N/A ASP 46.A N PHE 19.A O no hydrogen 2.956 N/A LEU 48.A N PRO 96.A O no hydrogen 3.062 N/A GLU 49.A N PRO 21.A O no hydrogen 3.120 N/A LEU 50.A N GLY 98.A O no hydrogen 2.903 N/A GLY 51.A N VAL 23.A O no hydrogen 2.844 N/A VAL 52.A N LEU 100.A O no hydrogen 3.325 N/A SER 55.A OG ASP 56.A OD2 no hydrogen 2.431 N/A LEU 58.A N ASP 56.A O no hydrogen 2.762 N/A ALA 59.A N TYR 102.A OH no hydrogen 2.767 N/A ASP 60.A N PRO 57.A O no hydrogen 2.837 N/A GLN 65.A N GLY 61.A O no hydrogen 2.979 N/A GLN 65.A NE2 ASP 60.A O no hydrogen 2.760 N/A ASN 66.A N PRO 62.A O no hydrogen 2.907 N/A ALA 67.A N THR 63.A O no hydrogen 2.997 N/A ASN 68.A N ILE 64.A O no hydrogen 2.979 N/A LEU 69.A N GLN 65.A O no hydrogen 3.278 N/A ARG 70.A N ASN 66.A O no hydrogen 2.878 N/A ARG 70.A NE ASP 27.A OD1 no hydrogen 2.495 N/A ARG 70.A NH1 GLU 228.A OE1 no hydrogen 2.832 N/A ARG 70.A NH2 ASP 27.A OD2 no hydrogen 2.566 N/A ARG 70.A NH2 GLU 228.A OE1 no hydrogen 3.260 N/A ALA 71.A N ALA 67.A O no hydrogen 2.872 N/A PHE 72.A N ASN 68.A O no hydrogen 2.782 N/A ALA 73.A N LEU 69.A O no hydrogen 2.831 N/A ALA 74.A N ARG 70.A O no hydrogen 3.049 N/A ALA 74.A N ALA 71.A O no hydrogen 3.033 N/A GLY 75.A N PHE 72.A O no hydrogen 2.843 N/A VAL 76.A N ALA 71.A O no hydrogen 3.162 N/A GLN 80.A N THR 77.A OG1 no hydrogen 3.072 N/A CYS 81.A N THR 77.A O no hydrogen 2.932 N/A CYS 81.A SG THR 77.A O no hydrogen 3.488 N/A PHE 82.A N PRO 78.A O no hydrogen 3.036 N/A PHE 82.A N ALA 79.A O no hydrogen 3.246 N/A GLU 83.A N ALA 79.A O no hydrogen 3.194 N/A MET 84.A N GLN 80.A O no hydrogen 2.996 N/A LEU 85.A N CYS 81.A O no hydrogen 2.904 N/A ALA 86.A N PHE 82.A O no hydrogen 3.103 N/A LEU 87.A N GLU 83.A O no hydrogen 3.173 N/A ILE 88.A N MET 84.A O no hydrogen 2.941 N/A ARG 89.A N LEU 85.A O no hydrogen 2.963 N/A ARG 89.A NE GLY 122.A O no hydrogen 2.988 N/A ARG 89.A NH1 HIS 92.A O no hydrogen 2.758 N/A ARG 89.A NH1 ILE 95.A O no hydrogen 2.776 N/A ARG 89.A NH2 ILE 95.A O no hydrogen 2.943 N/A ARG 89.A NH2 GLY 122.A O no hydrogen 2.899 N/A GLU 90.A N ALA 86.A O no hydrogen 3.103 N/A GLU 90.A N LEU 87.A O no hydrogen 3.153 N/A LYS 91.A N LEU 87.A O no hydrogen 3.107 N/A LYS 91.A NZ ASP 38.A OD1 no hydrogen 3.250 N/A LYS 91.A NZ ASP 38.A OD2 no hydrogen 2.446 N/A HIS 92.A N ILE 88.A O no hydrogen 3.013 N/A HIS 92.A N ARG 89.A O no hydrogen 3.354 N/A HIS 92.A NE2 ASP 38.A OD1 no hydrogen 2.890 N/A ILE 97.A N ASP 124.A OD2 no hydrogen 2.730 N/A GLY 98.A N LEU 48.A O no hydrogen 2.751 N/A LEU 99.A N SER 125.A O no hydrogen 2.841 N/A LEU 100.A N LEU 50.A O no hydrogen 2.886 N/A MET 101.A N LEU 127.A O no hydrogen 2.877 N/A TYR 102.A OH ASP 60.A OD2 no hydrogen 2.708 N/A ALA 103.A N ASP 130.A OD1 no hydrogen 2.726 N/A LEU 105.A N TYR 102.A O no hydrogen 3.142 N/A PHE 107.A N ALA 103.A O no hydrogen 2.912 N/A ASN 108.A N ASN 104.A O no hydrogen 2.925 N/A GLY 110.A N PHE 107.A O no hydrogen 3.008 N/A PHE 114.A N GLY 110.A O no hydrogen 3.026 N/A TYR 115.A N ILE 111.A O no hydrogen 3.193 N/A ALA 116.A N ASP 112.A O no hydrogen 2.843 N/A ARG 117.A N ALA 113.A O no hydrogen 2.992 N/A ARG 117.A NH1 GLN 120.A OE1 no hydrogen 2.926 N/A CYS 118.A N PHE 114.A O no hydrogen 3.032 N/A CYS 118.A SG PHE 114.A O no hydrogen 3.473 N/A GLU 119.A N TYR 115.A O no hydrogen 3.051 N/A GLN 120.A N ALA 116.A O no hydrogen 3.023 N/A VAL 121.A N ARG 117.A O no hydrogen 3.167 N/A GLY 122.A N CYS 118.A O no hydrogen 2.984 N/A GLY 122.A N GLU 119.A O no hydrogen 3.127 N/A VAL 123.A N CYS 118.A O no hydrogen 3.009 N/A ASP 124.A N ILE 97.A O no hydrogen 2.790 N/A SER 125.A N ILE 97.A O no hydrogen 3.377 N/A SER 125.A OG TYR 4.A OH no hydrogen 2.744 N/A VAL 126.A N ALA 149.A O no hydrogen 2.877 N/A LEU 127.A N LEU 99.A O no hydrogen 2.805 N/A ALA 129.A N MET 101.A O no hydrogen 2.695 N/A VAL 131.A N VAL 128.A O no hydrogen 3.327 N/A GLU 134.A N GLU 134.A OE1 no hydrogen 2.731 N/A GLU 135.A N PRO 132.A O no hydrogen 2.822 N/A SER 136.A N VAL 133.A O no hydrogen 3.107 N/A SER 136.A OG VAL 133.A O no hydrogen 2.731 N/A PHE 139.A N SER 136.A O no hydrogen 3.039 N/A ARG 140.A N SER 136.A O no hydrogen 2.857 N/A ARG 140.A NE SER 136.A OG no hydrogen 2.794 N/A GLN 141.A N ALA 137.A O no hydrogen 2.917 N/A ALA 142.A N PRO 138.A O no hydrogen 3.060 N/A ALA 143.A N PHE 139.A O no hydrogen 2.867 N/A LEU 144.A N ARG 140.A O no hydrogen 2.954 N/A ARG 145.A N GLN 141.A O no hydrogen 3.045 N/A ARG 145.A NE ASP 112.A OD1 no hydrogen 3.356 N/A ARG 145.A NH2 ASP 112.A OD1 no hydrogen 2.740 N/A HIS 146.A N ALA 143.A O no hydrogen 2.873 N/A HIS 146.A ND1 ALA 142.A O no hydrogen 2.809 N/A ASN 147.A N LEU 144.A O no hydrogen 3.172 N/A ASN 147.A ND2 GLU 119.A OE2 no hydrogen 2.964 N/A ILE 148.A N ALA 143.A O no hydrogen 2.904 N/A ALA 149.A N ASP 124.A O no hydrogen 2.841 N/A ILE 151.A N VAL 126.A O no hydrogen 3.161 N/A CYS 154.A N TYR 175.A O no hydrogen 2.830 N/A ALA 158.A N PRO 155.A O no hydrogen 3.197 N/A ASP 161.A N ASP 159.A OD2 no hydrogen 3.286 N/A LEU 163.A N ASP 159.A O no hydrogen 2.951 N/A ARG 164.A N ASP 160.A O no hydrogen 2.912 N/A ARG 164.A NE ASP 160.A OD2 no hydrogen 2.822 N/A GLN 165.A N ASP 161.A O no hydrogen 3.091 N/A VAL 166.A N LEU 162.A O no hydrogen 2.761 N/A ALA 167.A N LEU 163.A O no hydrogen 2.949 N/A SER 168.A N ARG 164.A O no hydrogen 3.031 N/A TYR 169.A N GLN 165.A O no hydrogen 2.968 N/A GLY 170.A N VAL 166.A O no hydrogen 3.065 N/A ARG 171.A N PRO 150.A O no hydrogen 3.032 N/A ARG 171.A NH1 SER 168.A O no hydrogen 2.870 N/A ARG 171.A NH1 GLY 170.A O no hydrogen 3.099 N/A THR 174.A N PRO 193.A O no hydrogen 2.857 N/A THR 174.A OG1 ALA 192.A O no hydrogen 2.766 N/A TYR 175.A N PHE 152.A O no hydrogen 2.992 N/A LEU 176.A N LEU 195.A O no hydrogen 2.790 N/A LEU 177.A N CYS 154.A O no hydrogen 2.872 N/A HIS 181.A N PRO 178.A O no hydrogen 2.252 N/A LEU 182.A N PRO 178.A O no hydrogen 3.068 N/A ILE 183.A N LEU 179.A O no hydrogen 3.149 N/A GLU 184.A N HIS 180.A O no hydrogen 3.219 N/A LYS 185.A N HIS 181.A O no hydrogen 2.807 N/A LYS 185.A NZ GLU 188.A OE1 no hydrogen 3.449 N/A LEU 186.A N LEU 182.A O no hydrogen 2.724 N/A LYS 187.A N ILE 183.A O no hydrogen 2.982 N/A LYS 187.A NZ GLY 213.A O no hydrogen 3.421 N/A GLU 188.A N GLU 184.A O no hydrogen 2.792 N/A TYR 189.A N LYS 185.A O no hydrogen 2.714 N/A TYR 189.A OH ASP 160.A OD1 no hydrogen 2.373 N/A HIS 190.A N LYS 187.A O no hydrogen 3.052 N/A ALA 191.A N LEU 186.A O no hydrogen 2.934 N/A LEU 195.A N THR 174.A O no hydrogen 2.956 N/A GLN 196.A N GLY 216.A O no hydrogen 2.882 N/A GLN 196.A NE2 LEU 177.A O no hydrogen 3.231 N/A GLN 196.A NE2 GLY 197.A O no hydrogen 2.594 N/A GLY 197.A N LEU 176.A O no hydrogen 2.781 N/A SER 201.A N GLN 205.A OE1 no hydrogen 2.747 N/A SER 202.A OG GLN 205.A OE1 no hydrogen 2.587 N/A GLN 205.A N SER 202.A O no hydrogen 3.102 N/A GLN 205.A NE2 GLY 199.A O no hydrogen 3.116 N/A SER 207.A N PRO 203.A O no hydrogen 3.112 N/A SER 207.A OG GLU 204.A O no hydrogen 2.949 N/A ALA 208.A N GLU 204.A O no hydrogen 2.956 N/A ALA 209.A N GLN 205.A O no hydrogen 2.976 N/A VAL 210.A N VAL 206.A O no hydrogen 3.114 N/A ARG 211.A N SER 207.A O no hydrogen 3.032 N/A ALA 212.A N ALA 208.A O no hydrogen 2.941 N/A GLY 213.A N VAL 210.A O no hydrogen 3.043 N/A ALA 214.A N ALA 209.A O no hydrogen 2.994 N/A ALA 215.A N ALA 194.A O no hydrogen 2.676 N/A ALA 217.A N ALA 18.A O no hydrogen 2.935 N/A ILE 218.A N GLN 196.A O no hydrogen 2.745 N/A SER 219.A N VAL 20.A O no hydrogen 2.908 N/A SER 219.A OG ILE 200.A O no hydrogen 2.915 N/A LYS 225.A N SER 221.A O no hydrogen 2.948 N/A ILE 226.A N ALA 222.A O no hydrogen 3.208 N/A ILE 227.A N ILE 223.A O no hydrogen 3.122 N/A GLU 228.A N VAL 224.A O no hydrogen 3.028 N/A LYS 229.A N LYS 225.A O no hydrogen 2.760 N/A ASN 230.A N ILE 227.A O no hydrogen 2.891 N/A ASN 230.A ND2 ILE 226.A O no hydrogen 2.673 N/A ASN 230.A ND2 GLU 240.A OE2 no hydrogen 3.106 N/A SER 233.A N ASN 230.A O no hydrogen 3.043 N/A GLN 236.A N SER 233.A OG no hydrogen 3.148 N/A MET 237.A N SER 233.A O no hydrogen 2.809 N/A LEU 238.A N PRO 234.A O no hydrogen 3.094 N/A ALA 239.A N LYS 235.A O no hydrogen 3.138 N/A GLU 240.A N GLN 236.A O no hydrogen 3.028 N/A LEU 241.A N MET 237.A O no hydrogen 2.948 N/A ARG 242.A N LEU 238.A O no hydrogen 2.967 N/A ARG 242.A NH1 ASP 42.A OD2 no hydrogen 2.732 N/A ARG 242.A NH2 ASP 42.A OD2 no hydrogen 3.066 N/A SER 243.A N ALA 239.A O no hydrogen 2.935 N/A PHE 244.A N GLU 240.A O no hydrogen 2.793 N/A VAL 245.A N LEU 241.A O no hydrogen 2.818 N/A SER 246.A N ARG 242.A O no hydrogen 2.824 N/A SER 246.A OG ARG 242.A O no hydrogen 2.682 N/A ALA 247.A N SER 243.A O no hydrogen 3.101 N/A MET 248.A N PHE 244.A O no hydrogen 2.896 N/A LYS 249.A N VAL 245.A O no hydrogen 2.851 N/A LYS 249.A NZ GLY 17.A O no hydrogen 2.618 N/A LYS 249.A NZ ASP 46.A OD1 no hydrogen 3.373 N/A LYS 249.A NZ ASP 46.A OD2 no hydrogen 2.737 N/A LYS 249.A NZ SER 252.A OG no hydrogen 3.076 N/A ALA 250.A N SER 246.A O no hydrogen 2.860 N/A ALA 251.A N ALA 247.A O no hydrogen 3.147 N/A SER 252.A N LYS 249.A O no hydrogen 2.783 N/A SER 252.A OG GLY 17.A O no hydrogen 3.250 N/A SER 252.A OG LYS 249.A O no hydrogen 2.473 N/A ARG 253.A N ALA 250.A O no hydrogen 3.101 N/A