Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2jko_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N VAL 75.A O no hydrogen 2.915 N/A ARG 5.A NH1 PRO 80.A O no hydrogen 2.832 N/A ARG 5.A NH2 GLU 78.A O no hydrogen 2.732 N/A ARG 5.A NH2 PRO 80.A O no hydrogen 2.767 N/A GLU 6.A N GLU 6.A OE1 no hydrogen 2.778 N/A ARG 7.A N GLN 4.A O no hydrogen 2.936 N/A ARG 7.A NH1 MET 28.A O no hydrogen 2.845 N/A ILE 8.A N ARG 5.A O no hydrogen 2.854 N/A GLU 9.A N ILE 26.A O no hydrogen 2.885 N/A GLY 11.A N GLN 24.A O no hydrogen 2.872 N/A CYS 13.A SG GLY 15.A O no hydrogen 3.424 N/A CYS 13.A SG VAL 22.A O no hydrogen 3.642 N/A ILE 14.A N VAL 22.A O no hydrogen 2.892 N/A GLY 15.A N VAL 22.A O no hydrogen 3.147 N/A GLY 17.A N GLY 20.A O no hydrogen 2.849 N/A GLN 18.A N GLN 18.A OE1 no hydrogen 2.989 N/A GLN 18.A NE2 GLY 152.A O no hydrogen 2.691 N/A VAL 22.A N GLY 15.A O no hydrogen 3.052 N/A HIS 23.A N ILE 39.A O no hydrogen 2.751 N/A GLN 24.A N ARG 12.A O no hydrogen 2.904 N/A GLY 25.A N VAL 37.A O no hydrogen 2.818 N/A ILE 26.A N GLU 9.A O no hydrogen 3.012 N/A TYR 27.A N MET 35.A O no hydrogen 2.646 N/A MET 28.A N ARG 7.A O no hydrogen 2.836 N/A SER 29.A OG GLU 31.A OE1 no hydrogen 3.397 N/A ASN 32.A N SER 29.A O no hydrogen 3.497 N/A MET 35.A N TYR 27.A O no hydrogen 2.840 N/A VAL 37.A N GLY 25.A O no hydrogen 2.884 N/A ALA 38.A N MET 85.A O no hydrogen 2.806 N/A ILE 39.A N HIS 23.A O no hydrogen 2.655 N/A LYS 40.A N ILE 83.A O no hydrogen 2.861 N/A LYS 40.A NZ ASP 150.A OD2 no hydrogen 2.829 N/A THR 41.A N ASP 21.A O no hydrogen 2.872 N/A THR 41.A OG1 ASP 21.A O no hydrogen 2.599 N/A CYS 42.A SG LYS 43.A O no hydrogen 3.697 N/A LYS 43.A N PHE 19.A O no hydrogen 2.467 N/A CYS 45.A SG CYS 42.A O no hydrogen 2.932 N/A SER 47.A N ASN 44.A O no hydrogen 3.125 N/A SER 47.A OG SER 49.A OG no hydrogen 2.913 N/A SER 49.A OG SER 47.A OG no hydrogen 2.913 N/A PHE 54.A N VAL 50.A O no hydrogen 3.023 N/A LEU 55.A N ARG 51.A O no hydrogen 2.883 N/A GLN 56.A N GLU 52.A O no hydrogen 3.059 N/A GLU 57.A N PHE 54.A O no hydrogen 3.305 N/A ALA 58.A N LEU 55.A O no hydrogen 3.128 N/A LEU 59.A N LEU 55.A O no hydrogen 3.398 N/A THR 60.A N GLN 56.A O no hydrogen 3.090 N/A THR 60.A OG1 GLN 56.A O no hydrogen 3.161 N/A MET 61.A N GLU 57.A O no hydrogen 3.345 N/A ARG 62.A N ALA 58.A O no hydrogen 2.990 N/A GLN 63.A NE2 THR 60.A O no hydrogen 2.965 N/A PHE 64.A N MET 61.A O no hydrogen 3.115 N/A ASP 65.A N TYR 122.A OH no hydrogen 2.899 N/A HIS 68.A N HIS 66.A ND1 no hydrogen 2.989 N/A HIS 68.A ND1 VAL 146.A O no hydrogen 2.880 N/A ILE 69.A N HIS 66.A O no hydrogen 3.173 N/A VAL 70.A N LEU 148.A O no hydrogen 2.985 N/A LYS 71.A N GLU 86.A OE2 no hydrogen 3.044 N/A LYS 71.A NZ LEU 72.A O no hydrogen 2.953 N/A ILE 73.A N ILE 84.A O no hydrogen 2.809 N/A GLY 74.A N ILE 84.A O no hydrogen 3.156 N/A VAL 75.A N TYR 1.A O no hydrogen 2.863 N/A ILE 76.A N TRP 82.A O no hydrogen 2.835 N/A THR 77.A N GLU 2.A OE1 no hydrogen 2.997 N/A THR 77.A OG1 GLU 2.A OE1 no hydrogen 3.118 N/A THR 77.A OG1 GLU 2.A OE2 no hydrogen 2.811 N/A ASN 79.A ND2 CYS 45.A O no hydrogen 3.178 N/A TRP 82.A N ILE 76.A O no hydrogen 3.083 N/A ILE 83.A N LYS 40.A O no hydrogen 3.004 N/A ILE 84.A N GLY 74.A O no hydrogen 2.754 N/A MET 85.A N ALA 38.A O no hydrogen 2.784 N/A GLU 86.A N LYS 71.A O no hydrogen 2.860 N/A LEU 90.A N VAL 140.A O no hydrogen 2.979 N/A GLY 91.A N CYS 88.A O no hydrogen 3.079 N/A LEU 93.A N VAL 138.A O no hydrogen 2.990 N/A ARG 94.A NE GLY 189.A O no hydrogen 3.207 N/A ARG 94.A NH2 GLY 189.A O no hydrogen 2.838 N/A PHE 96.A N GLU 92.A O no hydrogen 3.112 N/A LEU 97.A N LEU 93.A O no hydrogen 2.871 N/A GLN 98.A N ARG 94.A O no hydrogen 3.002 N/A GLN 98.A NE2 GLY 189.A O no hydrogen 3.009 N/A VAL 99.A N SER 95.A O no hydrogen 2.941 N/A ARG 100.A N PHE 96.A O no hydrogen 3.090 N/A SER 103.A N ARG 100.A O no hydrogen 3.082 N/A LEU 104.A N ARG 100.A O no hydrogen 3.087 N/A SER 108.A N ASP 105.A O no hydrogen 3.006 N/A SER 108.A OG ASP 105.A OD1 no hydrogen 2.555 N/A LEU 109.A N ASP 105.A O no hydrogen 3.396 N/A ILE 110.A N LEU 106.A O no hydrogen 2.978 N/A LEU 111.A N ALA 107.A O no hydrogen 2.932 N/A TYR 112.A N SER 108.A O no hydrogen 2.986 N/A TYR 112.A OH THR 143.A O no hydrogen 2.664 N/A ALA 113.A N LEU 109.A O no hydrogen 3.185 N/A TYR 114.A N ILE 110.A O no hydrogen 2.868 N/A GLN 115.A N LEU 111.A O no hydrogen 2.865 N/A GLN 115.A NE2 ASP 144.A O no hydrogen 2.924 N/A LEU 116.A N TYR 112.A O no hydrogen 2.977 N/A SER 117.A N ALA 113.A O no hydrogen 2.961 N/A SER 117.A OG TYR 114.A O no hydrogen 2.694 N/A THR 118.A N TYR 114.A O no hydrogen 3.048 N/A THR 118.A OG1 GLN 115.A O no hydrogen 2.696 N/A ALA 119.A N GLN 115.A O no hydrogen 3.229 N/A LEU 120.A N LEU 116.A O no hydrogen 2.907 N/A ALA 121.A N SER 117.A O no hydrogen 2.805 N/A TYR 122.A N THR 118.A O no hydrogen 3.011 N/A LEU 123.A N ALA 119.A O no hydrogen 2.912 N/A GLU 124.A N LEU 120.A O no hydrogen 2.811 N/A SER 125.A N ALA 121.A O no hydrogen 2.911 N/A SER 125.A OG TYR 122.A O no hydrogen 2.626 N/A LYS 126.A N TYR 122.A O no hydrogen 3.072 N/A LYS 126.A N LEU 123.A O no hydrogen 3.001 N/A LYS 126.A NZ GLN 63.A O no hydrogen 3.480 N/A ARG 127.A N GLU 124.A O no hydrogen 2.909 N/A PHE 128.A N LEU 123.A O no hydrogen 2.975 N/A HIS 130.A N ASP 174.A OD2 no hydrogen 2.811 N/A ARG 131.A N ASP 174.A OD1 no hydrogen 2.949 N/A ASP 132.A N HIS 130.A ND1 no hydrogen 3.031 N/A ALA 135.A N GLU 184.A OE1 no hydrogen 2.814 N/A ARG 136.A NH2 ASP 132.A OD1 no hydrogen 3.450 N/A ASN 137.A N ALA 134.A O no hydrogen 2.982 N/A ASN 137.A ND2 ASP 132.A O no hydrogen 2.823 N/A VAL 138.A N ALA 135.A O no hydrogen 3.055 N/A LEU 139.A N LYS 147.A O no hydrogen 2.895 N/A VAL 140.A N GLY 91.A O no hydrogen 2.743 N/A SER 141.A N CYS 145.A O no hydrogen 2.813 N/A ALA 142.A N CYS 145.A O no hydrogen 3.176 N/A CYS 145.A N ALA 142.A O no hydrogen 2.969 N/A VAL 146.A N GLN 115.A OE1 no hydrogen 2.977 N/A LYS 147.A N LEU 139.A O no hydrogen 2.892 N/A LYS 147.A NZ PRO 67.A O no hydrogen 3.170 N/A LYS 147.A NZ GLU 86.A OE1 no hydrogen 2.514 N/A LYS 147.A NZ GLU 86.A OE2 no hydrogen 3.568 N/A LEU 148.A N HIS 68.A O no hydrogen 2.802 N/A GLY 149.A N ASN 137.A O no hydrogen 2.821 N/A LEU 153.A N ASP 150.A OD2 no hydrogen 2.855 N/A ILE 156.A N LEU 154.A O no hydrogen 2.795 N/A LYS 157.A NZ PHE 193.A O no hydrogen 3.088 N/A LYS 157.A NZ VAL 196.A O no hydrogen 2.863 N/A TRP 158.A N PRO 155.A O no hydrogen 2.964 N/A TRP 158.A NE1 GLU 184.A OE1 no hydrogen 2.846 N/A MET 159.A N ILE 156.A O no hydrogen 3.030 N/A GLU 162.A N GLU 162.A OE1 no hydrogen 2.779 N/A SER 163.A N ALA 160.A O no hydrogen 2.919 N/A SER 163.A OG ARG 168.A O no hydrogen 2.760 N/A ILE 164.A N ALA 160.A O no hydrogen 2.983 N/A ASN 165.A N PRO 161.A O no hydrogen 2.815 N/A PHE 166.A N GLU 162.A O no hydrogen 3.025 N/A ARG 167.A N SER 163.A O no hydrogen 3.010 N/A ARG 168.A N GLU 162.A O no hydrogen 3.198 N/A THR 170.A N SER 173.A OG no hydrogen 2.827 N/A SER 173.A N THR 170.A OG1 no hydrogen 3.250 N/A SER 173.A OG THR 170.A O no hydrogen 2.810 N/A ASP 174.A N THR 170.A O no hydrogen 3.061 N/A VAL 175.A N SER 171.A O no hydrogen 2.964 N/A TRP 176.A N ALA 172.A O no hydrogen 3.313 N/A MET 177.A N SER 173.A O no hydrogen 3.201 N/A PHE 178.A N ASP 174.A O no hydrogen 2.812 N/A GLY 179.A N VAL 175.A O no hydrogen 2.950 N/A VAL 180.A N TRP 176.A O no hydrogen 3.169 N/A CYS 181.A N MET 177.A O no hydrogen 2.861 N/A MET 182.A N PHE 178.A O no hydrogen 2.777 N/A TRP 183.A N GLY 179.A O no hydrogen 3.028 N/A TRP 183.A NE1 PRO 212.A O no hydrogen 2.738 N/A GLU 184.A N VAL 180.A O no hydrogen 2.907 N/A ILE 185.A N CYS 181.A O no hydrogen 2.944 N/A LEU 186.A N MET 182.A O no hydrogen 2.962 N/A MET 187.A N TRP 183.A O no hydrogen 2.854 N/A MET 187.A N GLU 184.A O no hydrogen 3.211 N/A HIS 188.A N ILE 185.A O no hydrogen 2.946 N/A GLY 189.A N GLU 184.A O no hydrogen 2.889 N/A VAL 196.A N PHE 193.A O no hydrogen 3.104 N/A ASP 200.A N LYS 197.A O no hydrogen 2.903 N/A VAL 201.A N ASN 198.A O no hydrogen 3.089 N/A ARG 204.A N ASP 200.A O no hydrogen 3.300 N/A ILE 205.A N VAL 201.A O no hydrogen 3.030 N/A GLU 206.A N ILE 202.A O no hydrogen 2.846 N/A ASN 207.A N GLY 203.A O no hydrogen 3.010 N/A ASN 207.A N ARG 204.A O no hydrogen 3.061 N/A GLY 208.A N ILE 205.A O no hydrogen 2.929 N/A GLU 209.A N ARG 204.A O no hydrogen 3.088 N/A ARG 210.A NE TRP 229.A O no hydrogen 3.059 N/A ARG 210.A NH1 ILE 205.A O no hydrogen 2.996 N/A ARG 210.A NH1 GLU 209.A O no hydrogen 2.903 N/A ARG 210.A NH2 TRP 229.A O no hydrogen 2.991 N/A CYS 217.A N PRO 214.A O no hydrogen 3.094 N/A CYS 217.A SG PRO 218.A O no hydrogen 3.544 N/A TYR 222.A N PRO 218.A O no hydrogen 2.989 N/A TYR 222.A OH LEU 211.A O no hydrogen 2.573 N/A SER 223.A N PRO 219.A O no hydrogen 2.764 N/A LEU 224.A N THR 220.A O no hydrogen 3.083 N/A MET 225.A N LEU 221.A O no hydrogen 3.041 N/A THR 226.A N TYR 222.A O no hydrogen 2.967 N/A THR 226.A OG1 SER 223.A O no hydrogen 2.711 N/A LYS 227.A N SER 223.A O no hydrogen 3.051 N/A CYS 228.A N LEU 224.A O no hydrogen 3.204 N/A CYS 228.A SG LEU 224.A O no hydrogen 3.552 N/A TRP 229.A N THR 226.A O no hydrogen 3.173 N/A ALA 230.A N LYS 227.A O no hydrogen 3.352 N/A TYR 231.A OH GLU 206.A OE2 no hydrogen 2.642 N/A SER 234.A N ASP 232.A OD1 no hydrogen 2.981 N/A SER 234.A OG ASP 232.A OD1 no hydrogen 2.793 N/A ARG 235.A N ASP 232.A O no hydrogen 2.943 N/A ARG 236.A N PRO 233.A O no hydrogen 3.175 N/A ARG 236.A NE ALA 230.A O no hydrogen 2.851 N/A ARG 236.A NH1 GLU 162.A OE2 no hydrogen 2.766 N/A ARG 236.A NH1 ALA 172.A O no hydrogen 2.938 N/A ARG 236.A NH2 GLU 162.A OE1 no hydrogen 2.896 N/A ARG 236.A NH2 ALA 230.A O no hydrogen 3.125 N/A ARG 238.A N GLU 241.A OE1 no hydrogen 2.833 N/A PHE 239.A N GLU 124.A OE2 no hydrogen 2.972 N/A LEU 242.A N ARG 238.A O no hydrogen 3.063 N/A LYS 243.A N PHE 239.A O no hydrogen 2.888 N/A ALA 244.A N THR 240.A O no hydrogen 3.148 N/A GLN 245.A N GLU 241.A O no hydrogen 3.010 N/A LEU 246.A N LEU 242.A O no hydrogen 2.760 N/A SER 247.A N LYS 243.A O no hydrogen 2.915 N/A THR 248.A N ALA 244.A O no hydrogen 3.401 N/A THR 248.A OG1 GLN 245.A O no hydrogen 2.820 N/A ILE 249.A N GLN 245.A O no hydrogen 3.024 N/A LEU 250.A N LEU 246.A O no hydrogen 2.855 N/A GLU 251.A N SER 247.A O no hydrogen 2.938 N/A GLU 252.A N THR 248.A O no hydrogen 2.945 N/A GLU 253.A N ILE 249.A O no hydrogen 3.025 N/A LYS 254.A N LEU 250.A O no hydrogen 2.876 N/A LEU 255.A N GLU 251.A O no hydrogen 3.225 N/A LEU 255.A N GLU 252.A O no hydrogen 3.109 N/A GLN 256.A N GLU 253.A O no hydrogen 2.898 N/A