Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4kr5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 6.A N TYR 10.A OH no hydrogen 2.801 N/A LYS 6.A NZ GLU 202.A OE1 no hydrogen 3.493 N/A LYS 7.A NZ ASP 69.A OD1 no hydrogen 2.691 N/A TYR 10.A N LYS 48.A O no hydrogen 2.944 N/A TYR 10.A OH GLU 202.A OE2 no hydrogen 2.591 N/A THR 11.A N ASP 69.A OD2 no hydrogen 2.866 N/A THR 11.A OG1.A ASP 69.A OD2 no hydrogen 3.184 N/A ILE 12.A N LYS 50.A O no hydrogen 2.817 N/A ALA 13.A N GLY 70.A O no hydrogen 2.859 N/A SER 14.A N ASN 52.A O no hydrogen 3.053 N/A SER 14.A OG MET 72.A O no hydrogen 2.747 N/A ASP 15.A N SER 73.A OG no hydrogen 2.966 N/A SER 17.A N ASP 15.A OD2 no hydrogen 2.898 N/A PHE 18.A N GLU 22.A O no hydrogen 2.808 N/A PHE 21.A N PHE 18.A O no hydrogen 2.900 N/A GLU 22.A N PHE 18.A O no hydrogen 3.141 N/A PHE 23.A N THR 31.A O no hydrogen 2.972 N/A GLN 24.A NE2 LYS 28.A O no hydrogen 3.085 N/A ASN 25.A N GLN 29.A O no hydrogen 2.980 N/A ASN 25.A ND2 GLN 29.A OE1 no hydrogen 3.009 N/A ASP 27.A N ASN 25.A OD1 no hydrogen 2.902 N/A LYS 28.A N ASN 25.A O no hydrogen 2.753 N/A GLN 29.A N ASN 25.A OD1 no hydrogen 3.043 N/A THR 31.A N PHE 23.A O no hydrogen 2.786 N/A THR 31.A OG1 TYR 227.A OH no hydrogen 2.886 N/A GLY 32.A N THR 31.A OG1 no hydrogen 2.740 N/A GLY 32.A N TYR 227.A OH no hydrogen 2.976 N/A ILE 33.A N PRO 20.A O no hydrogen 2.871 N/A ASP 34.A N PHE 21.A O no hydrogen 2.923 N/A ASP 36.A N GLY 32.A O no hydrogen 2.919 N/A LEU 37.A N ILE 33.A O no hydrogen 2.845 N/A LEU 38.A N ASP 34.A O no hydrogen 2.977 N/A ASN 39.A N VAL 35.A O no hydrogen 3.008 N/A ALA 40.A N ASP 36.A O no hydrogen 3.041 N/A ILE 41.A N LEU 37.A O no hydrogen 2.905 N/A ALA 42.A N LEU 38.A O no hydrogen 2.837 N/A LYS 43.A N ASN 39.A O no hydrogen 2.878 N/A ASN 44.A N ALA 40.A O no hydrogen 2.892 N/A GLN 45.A N ILE 41.A O no hydrogen 3.164 N/A GLN 45.A N ALA 42.A O no hydrogen 3.087 N/A GLN 45.A NE2 ASN 44.A OD1 no hydrogen 3.003 N/A GLY 46.A N LYS 43.A O no hydrogen 3.246 N/A PHE 47.A N ALA 42.A O no hydrogen 2.930 N/A LYS 50.A N TYR 10.A O no hydrogen 2.847 N/A TRP 51.A NE1 ASN 39.A OD1 no hydrogen 2.920 N/A ASN 52.A N ILE 12.A O no hydrogen 2.809 N/A GLY 55.A N SER 14.A O no hydrogen 3.024 N/A PHE 56.A N ASP 15.A OD1 no hydrogen 2.756 N/A ALA 59.A N GLY 55.A O no hydrogen 2.771 N/A VAL 60.A N PHE 56.A O no hydrogen 2.957 N/A ASP 61.A N GLN 57.A O no hydrogen 3.051 N/A SER 62.A N ALA 58.A O no hydrogen 2.836 N/A VAL 63.A N ALA 59.A O no hydrogen 3.034 N/A GLN 64.A N VAL 60.A O no hydrogen 2.973 N/A GLN 64.A NE2 VAL 84.A O no hydrogen 2.829 N/A SER 65.A N ASP 61.A O no hydrogen 3.069 N/A SER 65.A N SER 62.A O no hydrogen 3.288 N/A SER 65.A OG ASP 61.A O no hydrogen 2.929 N/A SER 65.A OG SER 62.A O no hydrogen 3.186 N/A SER 65.A OG HIS 67.A ND1 no hydrogen 3.140 N/A GLY 66.A N VAL 63.A O no hydrogen 3.123 N/A HIS 67.A N SER 62.A O no hydrogen 2.877 N/A HIS 67.A ND1 SER 65.A OG no hydrogen 3.140 N/A ASP 69.A N THR 11.A O no hydrogen 2.741 N/A ASP 69.A N THR 11.A OG1.A no hydrogen 3.045 N/A GLY 70.A N THR 11.A O no hydrogen 3.060 N/A MET 71.A N ALA 194.A O no hydrogen 2.781 N/A MET 72.A N ALA 13.A O no hydrogen 3.287 N/A GLY 74.A N ASP 34.A OD2 no hydrogen 2.792 N/A ILE 77.A N GLN 190.A O no hydrogen 3.038 N/A ARG 81.A N THR 78.A OG1 no hydrogen 3.048 N/A ARG 81.A NH1 SER 76.A O no hydrogen 2.955 N/A LYS 82.A N THR 78.A O no hydrogen 2.975 N/A GLN 83.A N ALA 80.A O no hydrogen 3.223 N/A GLN 83.A NE2 ASP 79.A O no hydrogen 3.093 N/A VAL 84.A N ARG 81.A O no hydrogen 3.075 N/A PHE 85.A N ARG 81.A O no hydrogen 2.892 N/A ASP 86.A N VAL 195.A O no hydrogen 2.845 N/A GLY 88.A N PHE 193.A O no hydrogen 2.921 N/A SER 89.A N ASN 208.A OD1 no hydrogen 2.750 N/A TYR 91.A N TYR 191.A O no hydrogen 3.064 N/A TYR 91.A OH ASP 34.A OD1 no hydrogen 2.576 N/A SER 94.A N GLY 189.A O no hydrogen 3.001 N/A SER 94.A OG ASP 188.A O no hydrogen 3.066 N/A SER 94.A OG GLY 189.A O no hydrogen 3.247 N/A ASN 95.A ND2 GLU 166.A OE1 no hydrogen 3.027 N/A LEU 96.A N ILE 186.A O no hydrogen 2.787 N/A THR 97.A N ASP 164.A O no hydrogen 2.948 N/A ALA 99.A N LEU 162.A O no hydrogen 2.895 N/A THR 100.A N ALA 180.A O no hydrogen 2.982 N/A THR 100.A OG1 SER 101.A O no hydrogen 3.478 N/A SER 101.A OG THR 103.A OG1 no hydrogen 2.999 N/A SER 102.A N LYS 178.A O no hydrogen 3.001 N/A THR 103.A N SER 101.A OG no hydrogen 3.309 N/A THR 103.A OG1 SER 101.A OG no hydrogen 2.999 N/A ASP 104.A N SER 101.A O no hydrogen 3.075 N/A SER 106.A N ASP 104.A OD1 no hydrogen 2.901 N/A SER 106.A OG ASP 104.A OD1 no hydrogen 2.529 N/A SER 106.A OG ASP 104.A OD2 no hydrogen 3.372 N/A LYS 108.A N ASP 112.A OD2 no hydrogen 2.963 N/A SER 109.A OG ASP 112.A OD2 no hydrogen 3.102 N/A LYS 111.A NZ ASP 112.A OD1 no hydrogen 2.865 N/A ASP 112.A N SER 109.A O no hydrogen 3.150 N/A LEU 113.A N TRP 110.A O no hydrogen 2.958 N/A LYS 114.A N LYS 111.A O no hydrogen 3.499 N/A GLY 115.A N GLY 138.A O no hydrogen 2.881 N/A LYS 116.A N LEU 113.A O no hydrogen 2.902 N/A LYS 116.A NZ SER 106.A OG no hydrogen 3.088 N/A THR 117.A N ASN 160.A OD1 no hydrogen 2.826 N/A THR 117.A OG1 THR 140.A OG1.A no hydrogen 3.332 N/A LEU 118.A N THR 140.A O no hydrogen 2.950 N/A GLY 119.A N ALA 161.A O no hydrogen 2.829 N/A ALA 120.A N LYS 142.A O no hydrogen 3.151 N/A ASN 122.A N PHE 144.A O no hydrogen 2.794 N/A THR 124.A N LYS 121.A O no hydrogen 3.308 N/A THR 124.A OG1 LYS 121.A O no hydrogen 2.755 N/A PHE 127.A N THR 124.A OG1 no hydrogen 3.101 N/A ASP 128.A N THR 124.A O no hydrogen 2.914 N/A TYR 129.A N ALA 125.A O no hydrogen 2.864 N/A LEU 130.A N SER 126.A O no hydrogen 2.797 N/A ASN 131.A N PHE 127.A O no hydrogen 2.953 N/A ALA 132.A N ASP 128.A O no hydrogen 3.012 N/A HIS 133.A N LEU 130.A O no hydrogen 3.200 N/A HIS 133.A ND1 TYR 129.A O no hydrogen 2.977 N/A ALA 134.A N ASN 131.A O no hydrogen 3.461 N/A TYR 137.A N HIS 133.A O no hydrogen 3.230 N/A GLY 138.A N ALA 134.A O no hydrogen 2.823 N/A TYR 139.A N ALA 134.A O no hydrogen 3.310 N/A TYR 139.A OH LEU 130.A O no hydrogen 2.709 N/A THR 140.A N LYS 116.A O no hydrogen 3.084 N/A LYS 142.A N LEU 118.A O no hydrogen 2.801 N/A PHE 144.A N ALA 120.A O no hydrogen 2.926 N/A THR 149.A N ASP 146.A OD1.A no hydrogen 2.931 N/A THR 149.A OG1.A ASP 146.A OD1.A no hydrogen 3.105 N/A THR 149.A OG1.A ASP 146.A OD1.B no hydrogen 2.914 N/A THR 149.A OG1.A ASP 146.A OD2.A no hydrogen 3.502 N/A THR 149.A OG1.A ASP 146.A OD2.B no hydrogen 3.494 N/A THR 149.A OG1.B ASP 146.A O no hydrogen 2.877 N/A THR 149.A OG1.B ASP 146.A OD1.A no hydrogen 3.083 N/A THR 149.A OG1.B ASP 146.A OD1.B no hydrogen 2.213 N/A MET 150.A N ASP 146.A O no hydrogen 3.359 N/A TYR 151.A N ALA 147.A O no hydrogen 2.879 N/A TYR 151.A OH ASP 164.A OD2 no hydrogen 2.651 N/A SER 152.A N THR 148.A O no hydrogen 2.899 N/A SER 152.A OG THR 148.A O no hydrogen 2.749 N/A SER 153.A N.A THR 149.A O no hydrogen 2.894 N/A SER 153.A N.B THR 149.A O no hydrogen 2.878 N/A SER 153.A N.B MET 150.A O no hydrogen 3.155 N/A SER 153.A OG.A THR 149.A O no hydrogen 2.987 N/A SER 153.A OG.A SER 158.A OG no hydrogen 3.385 N/A SER 153.A OG.B SER 158.A OG no hydrogen 2.509 N/A LEU 154.A N MET 150.A O no hydrogen 3.137 N/A ASN 155.A N TYR 151.A O no hydrogen 3.026 N/A ASN 155.A ND2 GLN 177.A OE1 no hydrogen 3.361 N/A ASN 156.A N SER 152.A O no hydrogen 2.826 N/A GLY 157.A N SER 153.A O.A no hydrogen 3.067 N/A GLY 157.A N LEU 154.A O no hydrogen 3.360 N/A SER 158.A N SER 153.A O.A no hydrogen 3.055 N/A SER 158.A N SER 153.A O.B no hydrogen 3.046 N/A SER 158.A N ASN 156.A OD1 no hydrogen 2.967 N/A SER 158.A OG SER 153.A O.A no hydrogen 3.492 N/A SER 158.A OG SER 153.A O.B no hydrogen 3.418 N/A SER 158.A OG SER 153.A OG.B no hydrogen 2.509 N/A SER 158.A OG ASN 156.A OD1 no hydrogen 2.890 N/A ILE 159.A N SER 153.A O.A no hydrogen 3.333 N/A ILE 159.A N SER 153.A O.B no hydrogen 3.318 N/A ASN 160.A N THR 117.A O no hydrogen 2.840 N/A LEU 162.A N ALA 99.A O no hydrogen 3.012 N/A MET 163.A N GLY 119.A O no hydrogen 3.004 N/A ASP 164.A N THR 97.A O no hydrogen 3.125 N/A ASP 165.A N ASP 164.A OD1 no hydrogen 2.791 N/A GLU 166.A N ASN 95.A O no hydrogen 2.919 N/A ILE 169.A N ASP 165.A O no hydrogen 3.203 N/A LYS 170.A N GLU 166.A O no hydrogen 2.729 N/A LYS 170.A NZ.B THR 181.A OG1 no hydrogen 2.762 N/A TYR 171.A N PRO 167.A O no hydrogen 2.804 N/A ALA 172.A N VAL 168.A O no hydrogen 2.973 N/A ILE 173.A N ILE 169.A O no hydrogen 3.021 N/A LYS 174.A N LYS 170.A O no hydrogen 2.887 N/A LYS 174.A NZ ASP 225.A O no hydrogen 3.001 N/A GLN 175.A N TYR 171.A O no hydrogen 2.874 N/A GLY 176.A N ILE 173.A O no hydrogen 2.806 N/A GLN 177.A N ALA 172.A O no hydrogen 2.937 N/A LYS 178.A NZ GLY 176.A O no hydrogen 3.234 N/A ALA 180.A N THR 100.A O no hydrogen 2.852 N/A ILE 186.A N LEU 96.A O no hydrogen 2.773 N/A ASP 188.A N SER 94.A O no hydrogen 2.907 N/A TYR 191.A N TYR 92.A O no hydrogen 2.873 N/A GLY 192.A N MET 75.A O no hydrogen 2.976 N/A ALA 194.A N MET 71.A O no hydrogen 3.060 N/A VAL 195.A N ASP 86.A O no hydrogen 2.939 N/A LYS 196.A NZ GLN 64.A O no hydrogen 2.825 N/A LYS 197.A N VAL 84.A O no hydrogen 2.948 N/A LYS 197.A NZ ASP 86.A OD1 no hydrogen 2.720 N/A GLY 198.A N ASP 86.A OD2 no hydrogen 2.980 N/A SER 199.A N LYS 196.A O no hydrogen 2.848 N/A ASN 200.A ND2 ASP 69.A O no hydrogen 3.378 N/A ASN 200.A ND2 ASP 69.A OD1 no hydrogen 3.549 N/A GLU 202.A N GLU 202.A OE1 no hydrogen 2.657 N/A LEU 203.A N ASN 200.A O no hydrogen 2.906 N/A GLU 205.A N PRO 201.A O no hydrogen 3.071 N/A MET 206.A N GLU 202.A O no hydrogen 3.011 N/A PHE 207.A N LEU 203.A O no hydrogen 3.041 N/A ASN 208.A N ILE 204.A O no hydrogen 2.929 N/A ASN 209.A N GLU 205.A O no hydrogen 2.882 N/A ASN 209.A ND2 GLY 1.A O no hydrogen 2.707 N/A GLY 210.A N MET 206.A O no hydrogen 2.866 N/A LEU 211.A N PHE 207.A O no hydrogen 2.803 N/A ALA 212.A N ASN 208.A O no hydrogen 3.040 N/A ASN 213.A N ASN 209.A O no hydrogen 3.006 N/A ASN 213.A ND2 ASN 44.A OD1 no hydrogen 3.050 N/A LEU 214.A N GLY 210.A O no hydrogen 2.863 N/A ARG 215.A N LEU 211.A O no hydrogen 2.909 N/A ARG 215.A NH2 PRO 90.A O no hydrogen 3.164 N/A ALA 216.A N ALA 212.A O no hydrogen 3.115 N/A ASN 217.A N ASN 213.A O no hydrogen 2.869 N/A GLU 219.A N ASN 217.A OD1 no hydrogen 2.971 N/A TYR 220.A N LEU 214.A O no hydrogen 3.016 N/A TYR 220.A OH TYR 91.A O no hydrogen 2.632 N/A LYS 222.A N GLY 218.A O no hydrogen 3.121 N/A ILE 223.A N GLU 219.A O no hydrogen 2.979 N/A ILE 224.A N TYR 220.A O no hydrogen 3.127 N/A ASP 225.A N ASP 221.A O no hydrogen 2.925 N/A LYS 226.A N LYS 222.A O no hydrogen 3.018 N/A LYS 226.A NZ ASP 36.A OD2 no hydrogen 2.969 N/A TYR 227.A N ILE 224.A O no hydrogen 3.023 N/A TYR 227.A OH THR 31.A OG1 no hydrogen 2.886 N/A TYR 227.A OH ASP 36.A OD2 no hydrogen 2.701 N/A LEU 228.A N ILE 224.A O no hydrogen 3.009 N/A GLU 229.A N ASP 225.A O no hydrogen 3.015 N/A