Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2gk4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N GLU 42.A O no hydrogen 2.950 N/A LEU 4.A N VAL 83.A O no hydrogen 2.813 N/A VAL 5.A N CYS 44.A O no hydrogen 2.861 N/A THR 6.A N ILE 85.A O no hydrogen 2.916 N/A SER 7.A N ILE 46.A O.A no hydrogen 2.908 N/A SER 7.A N ILE 46.A O.B no hydrogen 3.054 N/A SER 7.A OG THR 47.A OG1 no hydrogen 2.962 N/A GLY 9.A N THR 48.A OG1 no hydrogen 3.150 N/A THR 10.A N ALA 88.A O no hydrogen 3.121 N/A THR 10.A OG1 SER 90.A OG no hydrogen 2.564 N/A SER 11.A N.A THR 66.A O no hydrogen 2.852 N/A SER 11.A N.B THR 66.A O no hydrogen 2.874 N/A SER 11.A OG.A THR 21.A OG1 no hydrogen 2.767 N/A SER 11.A OG.B THR 21.A OG1 no hydrogen 2.752 N/A GLU 12.A N ILE 20.A O no hydrogen 2.821 N/A ILE 14.A N ARG 18.A O no hydrogen 2.816 N/A ASP 15.A N ARG 18.A O no hydrogen 3.253 N/A VAL 17.A N ASP 15.A OD1 no hydrogen 2.682 N/A ARG 18.A N ASP 15.A OD1 no hydrogen 2.733 N/A ARG 18.A NE ASP 15.A OD2 no hydrogen 2.946 N/A ARG 18.A NH2 ASP 15.A OD2 no hydrogen 3.328 N/A ILE 20.A N GLU 12.A O no hydrogen 2.869 N/A THR 21.A OG1 SER 11.A OG.A no hydrogen 2.767 N/A THR 21.A OG1 SER 11.A OG.B no hydrogen 2.752 N/A ASN 22.A N THR 10.A O no hydrogen 2.848 N/A GLY 26.A N SER 24.A OG no hydrogen 3.134 N/A LYS 30.A N GLY 26.A O no hydrogen 3.023 N/A LYS 30.A NZ GLU 34.A OE2 no hydrogen 2.595 N/A ILE 31.A N HIS 27.A O no hydrogen 3.113 N/A ILE 32.A N LEU 28.A O no hydrogen 2.905 N/A THR 33.A N GLY 29.A O no hydrogen 2.969 N/A THR 33.A OG1 GLY 29.A O no hydrogen 2.869 N/A GLU 34.A N LYS 30.A O no hydrogen 2.910 N/A THR 35.A N ILE 31.A O no hydrogen 2.891 N/A THR 35.A OG1 ILE 31.A O no hydrogen 2.834 N/A LEU 36.A N ILE 32.A O no hydrogen 2.938 N/A LEU 37.A N THR 33.A O no hydrogen 2.894 N/A SER 38.A N.A GLU 34.A O no hydrogen 2.960 N/A SER 38.A N.B GLU 34.A O no hydrogen 2.923 N/A SER 38.A OG.A GLU 34.A O no hydrogen 3.132 N/A ALA 39.A N THR 35.A O no hydrogen 3.175 N/A ALA 39.A N LEU 36.A O no hydrogen 3.121 N/A GLY 40.A N LEU 37.A O no hydrogen 2.917 N/A TYR 41.A N LEU 36.A O no hydrogen 3.103 N/A TYR 41.A OH HIS 225.A NE2 no hydrogen 2.547 N/A VAL 43.A N ASN 59.A O no hydrogen 2.927 N/A CYS 44.A N ILE 3.A O no hydrogen 2.904 N/A LEU 45.A N SER 61.A O no hydrogen 2.764 N/A ILE 46.A N.A VAL 5.A O no hydrogen 2.756 N/A ILE 46.A N.B VAL 5.A O no hydrogen 2.768 N/A THR 47.A N ARG 63.A O no hydrogen 2.922 N/A THR 47.A OG1 SER 7.A O no hydrogen 3.394 N/A THR 47.A OG1 SER 7.A OG no hydrogen 2.962 N/A THR 48.A N THR 47.A OG1 no hydrogen 2.861 N/A THR 48.A OG1 GLY 9.A O no hydrogen 3.334 N/A ARG 50.A NH2 HIS 23.A O no hydrogen 3.089 N/A ALA 51.A N THR 48.A O no hydrogen 3.257 N/A LEU 52.A N THR 25.A O no hydrogen 2.802 N/A LYS 53.A NZ THR 48.A O no hydrogen 2.759 N/A LYS 53.A NZ LYS 49.A O no hydrogen 3.208 N/A LYS 53.A NZ ALA 51.A O no hydrogen 2.770 N/A ASN 59.A N HIS 57.A ND1 no hydrogen 2.969 N/A LEU 60.A N HIS 57.A O no hydrogen 2.961 N/A SER 61.A N VAL 43.A O no hydrogen 3.057 N/A ARG 63.A N LEU 45.A O no hydrogen 2.877 N/A ILE 65.A N THR 47.A O no hydrogen 2.818 N/A THR 66.A N ASP 70.A OD2 no hydrogen 2.858 N/A ASN 67.A N ASP 70.A OD2 no hydrogen 3.185 N/A THR 68.A N.A GLU 12.A OE2 no hydrogen 2.805 N/A THR 68.A N.B GLU 12.A OE2 no hydrogen 2.802 N/A THR 68.A OG1.A GLU 12.A OE2 no hydrogen 3.494 N/A THR 68.A OG1.B GLU 12.A OE2 no hydrogen 2.768 N/A ASP 70.A N ASN 67.A OD1 no hydrogen 2.933 N/A LEU 71.A N ASN 67.A O no hydrogen 3.089 N/A LEU 72.A N.A THR 68.A O.A no hydrogen 2.829 N/A LEU 72.A N.A THR 68.A O.B no hydrogen 2.904 N/A LEU 72.A N.B THR 68.A O.A no hydrogen 2.830 N/A LEU 72.A N.B THR 68.A O.B no hydrogen 2.904 N/A ILE 73.A N LYS 69.A O no hydrogen 3.104 N/A GLU 74.A N ASP 70.A O no hydrogen 3.003 N/A GLU 76.A N.A ILE 73.A O no hydrogen 2.992 N/A GLU 76.A N.B ILE 73.A O no hydrogen 2.996 N/A ARG 77.A N GLU 74.A O no hydrogen 2.824 N/A ARG 77.A NE GLU 74.A OE2 no hydrogen 2.632 N/A ARG 77.A NH1 GLU 74.A OE2 no hydrogen 2.825 N/A GLN 79.A NE2.A GLU 76.A O.A no hydrogen 3.069 N/A GLN 79.A NE2.A GLU 76.A O.B no hydrogen 2.846 N/A GLN 79.A NE2.B TRP 145.A O no hydrogen 3.242 N/A ASP 80.A N ARG 77.A O no hydrogen 2.800 N/A TYR 81.A N VAL 78.A O no hydrogen 3.317 N/A GLN 82.A N LYS 2.A O no hydrogen 2.927 N/A GLN 82.A NE2 ASP 80.A O no hydrogen 3.619 N/A LEU 84.A N HIS 150.A O no hydrogen 2.883 N/A ILE 85.A N LEU 4.A O no hydrogen 2.829 N/A HIS 86.A N ILE 152.A O no hydrogen 2.792 N/A SER 87.A N THR 6.A O no hydrogen 3.073 N/A SER 87.A OG THR 6.A O no hydrogen 2.603 N/A ALA 88.A N GLY 8.A O no hydrogen 2.819 N/A SER 90.A N THR 10.A OG1 no hydrogen 2.764 N/A SER 90.A OG THR 10.A OG1 no hydrogen 2.564 N/A THR 93.A N LYS 133.A O no hydrogen 2.873 N/A THR 93.A OG1 GLU 12.A OE1 no hydrogen 2.764 N/A VAL 95.A N PHE 131.A O no hydrogen 2.823 N/A TYR 96.A N PHE 131.A O no hydrogen 3.372 N/A TYR 96.A OH GLU 101.A OE1 no hydrogen 2.852 N/A TYR 96.A OH GLU 101.A OE2 no hydrogen 2.895 N/A THR 97.A OG1 GLU 101.A OE1 no hydrogen 2.236 N/A THR 97.A OG1 LYS 120.A O no hydrogen 3.341 N/A GLY 98.A N LYS 120.A O no hydrogen 3.234 N/A LEU 99.A N VAL 127.A O no hydrogen 3.056 N/A VAL 102.A N GLY 98.A O no hydrogen 3.464 N/A GLN 103.A N LEU 99.A O no hydrogen 2.800 N/A ALA 104.A N GLU 100.A O.A no hydrogen 3.041 N/A ALA 104.A N GLU 100.A O.B no hydrogen 3.070 N/A ALA 104.A N GLU 100.A O.C no hydrogen 3.021 N/A SER 105.A N VAL 102.A O no hydrogen 3.143 N/A SER 105.A OG GLU 110.A OE2 no hydrogen 2.578 N/A ASN 107.A N SER 105.A OG no hydrogen 3.081 N/A LYS 109.A N ASN 107.A OD1 no hydrogen 3.285 N/A GLU 110.A N ASN 107.A O no hydrogen 3.022 N/A PHE 111.A N LEU 108.A O no hydrogen 3.068 N/A LEU 112.A N LYS 109.A O no hydrogen 3.065 N/A SER 113.A N GLU 110.A O no hydrogen 3.291 N/A SER 113.A OG GLU 110.A O no hydrogen 3.072 N/A LYS 114.A N PHE 111.A O no hydrogen 3.436 N/A LYS 114.A NZ GLU 110.A OE1 no hydrogen 3.037 N/A GLN 115.A N GLN 118.A OE1 no hydrogen 2.922 N/A ASN 116.A ND2 ILE 14.A O no hydrogen 3.541 N/A GLN 118.A N GLN 115.A O no hydrogen 2.910 N/A ALA 119.A N ASN 116.A O no hydrogen 2.981 N/A LYS 120.A N GLU 101.A OE1 no hydrogen 3.376 N/A SER 122.A N.A ASP 125.A OD1 no hydrogen 2.870 N/A SER 122.A N.B ASP 125.A OD1 no hydrogen 2.887 N/A SER 122.A OG.B THR 124.A OG1 no hydrogen 2.344 N/A THR 124.A N SER 122.A OG.B no hydrogen 3.084 N/A THR 124.A OG1 SER 122.A OG.B no hydrogen 2.344 N/A ASP 125.A N SER 122.A O.A no hydrogen 3.010 N/A ASP 125.A N SER 122.A O.B no hydrogen 2.981 N/A GLN 128.A NE2.A SER 122.A O.A no hydrogen 3.276 N/A GLN 128.A NE2.A SER 122.A O.B no hydrogen 3.317 N/A GLN 128.A NE2.A ASP 125.A OD1 no hydrogen 3.398 N/A VAL 129.A N THR 97.A O no hydrogen 2.777 N/A PHE 131.A N TYR 96.A O no hydrogen 2.856 N/A LYS 133.A N THR 93.A O no hydrogen 2.964 N/A THR 135.A N ASP 91.A O no hydrogen 3.038 N/A THR 135.A OG1 SER 90.A O no hydrogen 2.695 N/A LEU 141.A N ILE 138.A O no hydrogen 2.828 N/A VAL 142.A N ILE 139.A O no hydrogen 2.991 N/A LYS 143.A NZ.A PRO 147.A O no hydrogen 2.962 N/A LYS 143.A NZ.A ILE 149.A O no hydrogen 2.822 N/A LYS 143.A NZ.B ILE 149.A O no hydrogen 3.190 N/A LYS 143.A NZ.B GLN 177.A O no hydrogen 2.771 N/A GLU 144.A N.A LEU 141.A O no hydrogen 2.957 N/A TRP 145.A N LEU 141.A O no hydrogen 2.985 N/A ASN 146.A N VAL 142.A O no hydrogen 2.839 N/A ASN 146.A ND2 VAL 78.A O no hydrogen 2.929 N/A THR 148.A N ASN 146.A OD1 no hydrogen 3.251 N/A THR 148.A OG1 ASN 146.A OD1 no hydrogen 3.156 N/A ILE 149.A N ASN 146.A O no hydrogen 3.227 N/A HIS 150.A N GLN 82.A O no hydrogen 2.948 N/A LEU 151.A N ASP 179.A OD1.A no hydrogen 2.931 N/A ILE 152.A N LEU 84.A O no hydrogen 2.783 N/A GLY 153.A N LEU 180.A O no hydrogen 2.933 N/A LYS 155.A N ILE 182.A O no hydrogen 2.965 N/A LEU 157.A N ASN 184.A O no hydrogen 3.002 N/A ASP 159.A N ASP 185.A OD1 no hydrogen 2.886 N/A VAL 160.A N ASP 185.A OD2 no hydrogen 3.009 N/A HIS 164.A N THR 161.A OG1 no hydrogen 3.000 N/A LEU 165.A N THR 161.A O no hydrogen 3.038 N/A VAL 166.A N GLU 162.A O no hydrogen 2.954 N/A ASP 167.A N ASP 163.A O no hydrogen 2.940 N/A ILE 168.A N HIS 164.A O no hydrogen 2.852 N/A ALA 169.A N LEU 165.A O no hydrogen 2.887 N/A ARG 170.A N VAL 166.A O no hydrogen 2.816 N/A ARG 170.A NE GLU 200.A O no hydrogen 3.001 N/A ARG 170.A NH1 GLU 200.A O no hydrogen 3.165 N/A ARG 170.A NH1 GLN 203.A O.B no hydrogen 3.336 N/A LYS 171.A N ASP 167.A O no hydrogen 3.128 N/A SER 172.A N ILE 168.A O no hydrogen 3.106 N/A LEU 173.A N ALA 169.A O no hydrogen 2.823 N/A ILE 174.A N ARG 170.A O no hydrogen 3.154 N/A LYS 175.A N LYS 171.A O no hydrogen 2.985 N/A ASN 176.A N SER 172.A O no hydrogen 2.969 N/A ASN 176.A ND2 SER 172.A O no hydrogen 3.115 N/A ASN 176.A ND2 SER 172.A OG no hydrogen 3.223 N/A GLN 177.A N ILE 174.A O no hydrogen 3.375 N/A GLN 177.A NE2 GLU 144.A OE2.A no hydrogen 3.048 N/A ALA 178.A N LEU 173.A O no hydrogen 2.957 N/A ASP 179.A N.A LEU 151.A O no hydrogen 2.838 N/A ASP 179.A N.B LEU 151.A O no hydrogen 2.934 N/A ILE 181.A N VAL 199.A O no hydrogen 2.887 N/A ILE 182.A N GLY 153.A O no hydrogen 2.798 N/A ALA 183.A N ILE 197.A O no hydrogen 2.878 N/A ASN 184.A N LYS 155.A O no hydrogen 2.835 N/A ASN 184.A ND2 LYS 155.A O no hydrogen 2.888 N/A LEU 186.A N LEU 157.A O no hydrogen 2.896 N/A THR 187.A N ASP 185.A OD1 no hydrogen 2.932 N/A THR 187.A OG1 ASP 185.A OD1 no hydrogen 2.928 N/A GLN 188.A N ASP 185.A O no hydrogen 2.901 N/A ILE 189.A N LEU 186.A O no hydrogen 3.420 N/A SER 190.A N GLN 193.A O no hydrogen 2.897 N/A SER 190.A OG ASP 192.A OD1.A no hydrogen 3.263 N/A ASP 192.A N.A SER 190.A OG no hydrogen 3.336 N/A ASP 192.A N.B SER 190.A OG no hydrogen 3.300 N/A GLN 193.A N SER 190.A OG no hydrogen 3.089 N/A GLN 193.A NE2 ASP 192.A O.A no hydrogen 3.069 N/A GLN 193.A NE2 ASP 192.A O.B no hydrogen 3.407 N/A HIS 194.A N GLN 208.A O no hydrogen 2.717 N/A ARG 195.A N GLN 188.A O no hydrogen 3.213 N/A ARG 195.A NE GLU 162.A OE2 no hydrogen 2.759 N/A ARG 195.A NH1 GLN 208.A OE1 no hydrogen 2.699 N/A ARG 195.A NH2 GLU 162.A OE1 no hydrogen 3.017 N/A ARG 195.A NH2 GLU 162.A OE2 no hydrogen 3.477 N/A ALA 196.A N VAL 207.A O no hydrogen 3.054 N/A ILE 197.A N ALA 183.A O no hydrogen 2.928 N/A PHE 198.A N GLN 205.A O.A no hydrogen 2.695 N/A PHE 198.A N GLN 205.A O.B no hydrogen 2.673 N/A VAL 199.A N ILE 181.A O no hydrogen 2.776 N/A GLU 200.A N GLN 203.A O.A no hydrogen 2.973 N/A GLU 200.A N GLN 203.A O.B no hydrogen 3.047 N/A GLN 205.A N.A PHE 198.A O no hydrogen 3.066 N/A GLN 205.A N.B PHE 198.A O no hydrogen 3.077 N/A VAL 207.A N ALA 196.A O no hydrogen 2.940 N/A GLN 208.A N GLU 212.A OE1 no hydrogen 2.742 N/A GLN 208.A NE2 GLN 193.A OE1 no hydrogen 2.988 N/A GLU 212.A N THR 209.A OG1 no hydrogen 3.069 N/A ILE 213.A N THR 209.A O no hydrogen 2.875 N/A ALA 214.A N LYS 210.A O no hydrogen 2.995 N/A GLU 215.A N.A GLU 211.A O no hydrogen 2.881 N/A GLU 215.A N.B GLU 211.A O no hydrogen 2.919 N/A LEU 216.A N GLU 212.A O no hydrogen 2.993 N/A LEU 217.A N ILE 213.A O no hydrogen 2.967 N/A LEU 218.A N ALA 214.A O no hydrogen 2.876 N/A GLU 219.A N.A GLU 215.A O.A no hydrogen 2.989 N/A GLU 219.A N.A GLU 215.A O.B no hydrogen 2.893 N/A GLU 219.A N.B GLU 215.A O.A no hydrogen 2.989 N/A GLU 219.A N.B GLU 215.A O.B no hydrogen 2.893 N/A LYS 220.A N LEU 216.A O no hydrogen 2.857 N/A LYS 220.A NZ GLU 200.A OE2 no hydrogen 2.966 N/A ILE 221.A N LEU 217.A O no hydrogen 2.877 N/A GLN 222.A N LEU 218.A O no hydrogen 2.802 N/A ALA 223.A N GLU 219.A O.A no hydrogen 3.091 N/A ALA 223.A N GLU 219.A O.B no hydrogen 3.064 N/A TYR 224.A N ILE 221.A O no hydrogen 2.938 N/A TYR 224.A OH ASP 179.A OD1.B no hydrogen 3.218 N/A TYR 224.A OH ASP 179.A OD2.B no hydrogen 3.244 N/A HIS 225.A NE2 TYR 41.A OH no hydrogen 2.547 N/A