Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5ctn_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 4.A N ILE 2.A O no hydrogen 2.984 N/A SER 5.A N TYR 226.A OH no hydrogen 2.643 N/A SER 5.A OG ASP 7.A OD1.A no hydrogen 3.161 N/A GLU 8.A N GLU 8.A OE1 no hydrogen 2.743 N/A PHE 9.A N VAL 6.A O no hydrogen 3.026 N/A PHE 10.A N ASP 7.A O no hydrogen 3.068 N/A ARG 13.A NE GLU 214.A OE1 no hydrogen 3.105 N/A ARG 13.A NH1 ASN 12.A O no hydrogen 2.893 N/A ARG 13.A NH2 GLU 214.A OE2 no hydrogen 2.906 N/A THR 16.A N ASN 207.A O no hydrogen 2.815 N/A THR 16.A OG1 TYR 30.A O no hydrogen 2.671 N/A THR 16.A OG1 ASN 31.A O no hydrogen 3.138 N/A PHE 17.A N TYR 30.A O no hydrogen 3.202 N/A VAL 18.A N ALA 205.A O no hydrogen 2.900 N/A ILE 19.A N TRP 28.A O no hydrogen 2.968 N/A GLN 20.A N ILE 203.A O no hydrogen 2.906 N/A GLN 20.A NE2 GLU 24.A O no hydrogen 2.882 N/A GLU 21.A N GLU 24.A OE1 no hydrogen 2.921 N/A VAL 22.A N THR 201.A O no hydrogen 3.004 N/A LYS 23.A N GLU 21.A OE1 no hydrogen 2.887 N/A GLU 24.A N GLU 21.A O no hydrogen 2.893 N/A TRP 28.A N ILE 19.A O no hydrogen 2.756 N/A TYR 30.A N PHE 17.A O no hydrogen 2.845 N/A ASN 31.A ND2 GLU 14.A OE2 no hydrogen 2.957 N/A ASN 31.A ND2 GLY 15.A O no hydrogen 2.861 N/A ARG 34.A N ASN 31.A OD1 no hydrogen 3.253 N/A ARG 34.A NE ASN 207.A OD1 no hydrogen 2.871 N/A ARG 34.A NH1 ASN 207.A OD1 no hydrogen 2.890 N/A ALA 35.A N ASN 31.A O no hydrogen 3.057 N/A LYS 36.A N LYS 32.A O no hydrogen 3.236 N/A GLU 37.A N ARG 34.A O no hydrogen 3.102 N/A ARG 38.A NE GLU 141.A OE1 no hydrogen 2.977 N/A ARG 38.A NE GLU 141.A OE2 no hydrogen 3.234 N/A ARG 38.A NH2 GLU 141.A OE2 no hydrogen 2.708 N/A PHE 39.A N ILE 137.A O no hydrogen 2.927 N/A GLN 42.A NE2 SER 132.A OG no hydrogen 3.022 N/A GLN 42.A NE2 GLY 185.A O no hydrogen 2.842 N/A SER 43.A OG SER 91.A OG no hydrogen 3.160 N/A THR 44.A N PRO 41.A O no hydrogen 3.084 N/A THR 44.A OG1 PRO 41.A O no hydrogen 2.677 N/A PHE 45.A N GLN 42.A O no hydrogen 3.104 N/A LYS 46.A N SER 43.A O no hydrogen 3.088 N/A LYS 46.A NZ SER 91.A OG no hydrogen 3.065 N/A VAL 47.A N THR 44.A O no hydrogen 3.282 N/A ASN 49.A N PHE 45.A O no hydrogen 2.843 N/A ASN 49.A ND2 TYR 96.A O no hydrogen 3.296 N/A ALA 50.A N LYS 46.A O no hydrogen 2.866 N/A LEU 51.A N VAL 47.A O no hydrogen 3.242 N/A ILE 52.A N ALA 48.A O no hydrogen 2.922 N/A GLY 53.A N ASN 49.A O no hydrogen 2.771 N/A LEU 54.A N ALA 50.A O no hydrogen 2.984 N/A GLN 55.A N LEU 51.A O no hydrogen 2.933 N/A GLN 55.A NE2 ASP 157.A OD1 no hydrogen 3.086 N/A THR 56.A N ILE 52.A O no hydrogen 2.914 N/A THR 56.A OG1 ILE 52.A O no hydrogen 2.852 N/A THR 56.A OG1 GLY 53.A O no hydrogen 3.301 N/A GLY 57.A N LEU 54.A O no hydrogen 3.205 N/A ALA 58.A N THR 56.A OG1 no hydrogen 3.423 N/A VAL 59.A N GLY 53.A O no hydrogen 3.186 N/A ARG 60.A N ASP 64.A OD2 no hydrogen 2.798 N/A ARG 60.A NE ASP 61.A OD2 no hydrogen 2.770 N/A ARG 60.A NH2 ASP 61.A OD1 no hydrogen 3.003 N/A ARG 60.A NH2 ASP 61.A OD2 no hydrogen 3.557 N/A GLU 62.A N GLU 62.A OE2 no hydrogen 2.704 N/A TYR 63.A N ASP 61.A OD1 no hydrogen 2.809 N/A ASP 64.A N ASP 61.A O no hydrogen 3.195 N/A LYS 66.A N HIS 82.A O no hydrogen 2.842 N/A TRP 68.A N ASP 81.A OD1 no hydrogen 2.921 N/A TRP 68.A NE1 VAL 71.A O no hydrogen 2.841 N/A VAL 71.A N ASP 69.A OD1 no hydrogen 2.850 N/A ARG 73.A N ASN 79.A OD1 no hydrogen 2.866 N/A ARG 73.A NH1 ASP 69.A OD2 no hydrogen 2.852 N/A ARG 73.A NH2 ASP 69.A OD1 no hydrogen 3.003 N/A ASN 77.A ND2 ASP 90.A OD2 no hydrogen 2.784 N/A TRP 78.A N ILE 75.A O no hydrogen 2.951 N/A TRP 78.A NE1 ASP 90.A O no hydrogen 3.293 N/A ASN 79.A N ASP 76.A O no hydrogen 2.823 N/A ASN 79.A ND2 ARG 73.A O no hydrogen 3.140 N/A ARG 80.A NE ASN 77.A O no hydrogen 3.227 N/A ARG 80.A NE ASN 77.A OD1 no hydrogen 2.909 N/A ARG 80.A NH2 ASN 77.A OD1 no hydrogen 2.696 N/A HIS 82.A N LYS 66.A O no hydrogen 3.168 N/A HIS 82.A ND1 SER 86.A OG no hydrogen 2.709 N/A HIS 82.A NE2 ASN 77.A O no hydrogen 2.813 N/A THR 83.A N SER 86.A OG no hydrogen 2.884 N/A THR 83.A OG1 SER 86.A OG no hydrogen 3.189 N/A GLY 85.A N GLU 62.A O no hydrogen 2.909 N/A SER 86.A N THR 83.A OG1 no hydrogen 3.056 N/A SER 86.A OG HIS 82.A ND1 no hydrogen 2.709 N/A SER 86.A OG THR 83.A O no hydrogen 3.478 N/A SER 86.A OG THR 83.A OG1 no hydrogen 3.189 N/A GLY 87.A N THR 83.A O no hydrogen 2.771 N/A MET 88.A N LEU 84.A O no hydrogen 3.130 N/A MET 88.A N GLY 85.A O no hydrogen 3.207 N/A ARG 89.A N GLY 85.A O no hydrogen 3.118 N/A ASP 90.A N SER 86.A O no hydrogen 2.838 N/A SER 91.A N MET 88.A O no hydrogen 3.192 N/A SER 91.A OG SER 43.A OG no hydrogen 3.160 N/A VAL 92.A N GLY 87.A O no hydrogen 2.804 N/A TRP 94.A NE1 TRP 78.A O no hydrogen 2.794 N/A TYR 95.A N VAL 92.A O no hydrogen 3.139 N/A TYR 95.A OH ASP 64.A O no hydrogen 2.706 N/A TYR 96.A N VAL 92.A O no hydrogen 3.454 N/A TYR 96.A OH LEU 84.A O no hydrogen 2.772 N/A GLN 97.A N VAL 93.A O no hydrogen 2.826 N/A GLN 97.A NE2 ASP 127.A O no hydrogen 2.911 N/A ALA 98.A N TRP 94.A O no hydrogen 3.022 N/A MET 99.A N TYR 95.A O no hydrogen 3.006 N/A ALA 100.A N TYR 96.A O no hydrogen 2.907 N/A ARG 101.A N GLN 97.A O no hydrogen 2.975 N/A ARG 101.A NH1 ASP 127.A OD2 no hydrogen 2.804 N/A ASP 102.A N ALA 98.A O no hydrogen 3.133 N/A ILE 103.A N MET 99.A O no hydrogen 2.852 N/A GLY 104.A N ALA 100.A O no hydrogen 2.902 N/A ARG 107.A NE ILE 103.A O no hydrogen 2.904 N/A ARG 107.A NH1 ASP 102.A O no hydrogen 2.891 N/A ARG 107.A NH1 ILE 103.A O no hydrogen 3.349 N/A MET 108.A N GLY 104.A O no hydrogen 2.942 N/A ASN 109.A N GLU 105.A O no hydrogen 2.874 N/A HIS 110.A N GLU 106.A O no hydrogen 3.094 N/A TRP 111.A N ARG 107.A O no hydrogen 3.042 N/A VAL 112.A N MET 108.A O no hydrogen 2.945 N/A LYS 113.A N ASN 109.A O no hydrogen 3.128 N/A ALA 114.A N HIS 110.A O no hydrogen 2.832 N/A ILE 115.A N TRP 111.A O no hydrogen 3.048 N/A HIS 116.A N LYS 113.A O no hydrogen 3.051 N/A TYR 117.A N VAL 112.A O no hydrogen 3.122 N/A ASN 119.A N ARG 136.A O no hydrogen 2.952 N/A ASN 119.A ND2 THR 134.A O no hydrogen 2.952 N/A LYS 120.A N TYR 117.A O no hydrogen 3.011 N/A LYS 120.A NZ ASN 119.A O no hydrogen 3.313 N/A ASP 121.A N ASN 119.A OD1 no hydrogen 3.192 N/A SER 123.A N ASP 121.A OD1 no hydrogen 2.918 N/A SER 123.A OG ASP 121.A OD1 no hydrogen 2.548 N/A GLY 124.A N THR 134.A OG1 no hydrogen 2.939 N/A GLY 125.A N ILE 122.A O no hydrogen 3.251 N/A GLN 128.A N GLY 125.A O no hydrogen 2.980 N/A GLN 128.A NE2.C ASP 127.A OD1 no hydrogen 2.957 N/A PHE 129.A N GLY 125.A O no hydrogen 2.935 N/A LEU 131.A N GLN 128.A O no hydrogen 3.173 N/A SER 132.A N GLN 42.A OE1 no hydrogen 2.913 N/A SER 132.A OG SER 186.A OG no hydrogen 2.668 N/A THR 134.A OG1 ASP 121.A O no hydrogen 2.798 N/A LEU 135.A N PHE 129.A O no hydrogen 3.229 N/A ARG 136.A N ASN 119.A OD1 no hydrogen 2.998 N/A ARG 136.A NH1 ARG 38.A O no hydrogen 2.936 N/A ILE 137.A N PHE 39.A O no hydrogen 2.855 N/A SER 138.A N GLU 141.A OE1 no hydrogen 2.979 N/A ILE 140.A N ALA 35.A O no hydrogen 3.119 N/A GLU 141.A N SER 138.A OG no hydrogen 2.998 N/A GLN 142.A N SER 138.A O no hydrogen 2.850 N/A GLN 142.A NE2 THR 44.A OG1 no hydrogen 2.926 N/A VAL 143.A N PRO 139.A O no hydrogen 3.148 N/A ARG 144.A N ILE 140.A O no hydrogen 3.058 N/A PHE 145.A N GLU 141.A O no hydrogen 2.984 N/A LEU 146.A N GLN 142.A O no hydrogen 2.835 N/A LYS 147.A N VAL 143.A O no hydrogen 2.819 N/A LYS 147.A NZ GLU 151.A OE1 no hydrogen 3.272 N/A LYS 147.A NZ GLU 151.A OE2 no hydrogen 3.152 N/A GLN 148.A N ARG 144.A O no hydrogen 3.221 N/A LEU 149.A N PHE 145.A O no hydrogen 2.960 N/A TYR 150.A N LEU 146.A O no hydrogen 2.827 N/A GLU 151.A N LYS 147.A O no hydrogen 2.868 N/A GLU 152.A N LEU 149.A O no hydrogen 3.166 N/A THR 153.A N GLN 148.A O no hydrogen 2.922 N/A THR 153.A OG1 GLN 148.A OE1 no hydrogen 2.962 N/A ASP 157.A N GLN 55.A OE1 no hydrogen 2.867 N/A ASN 160.A N ASP 157.A O no hydrogen 2.969 N/A ASN 160.A ND2 GLN 55.A OE1 no hydrogen 2.979 N/A MET 161.A N ASP 157.A O no hydrogen 3.239 N/A ARG 162.A N LEU 158.A O no hydrogen 2.961 N/A ARG 162.A NE GLU 152.A OE2 no hydrogen 2.742 N/A ARG 162.A NH2 GLU 152.A OE1 no hydrogen 2.909 N/A ARG 162.A NH2 GLU 152.A OE2 no hydrogen 3.510 N/A THR 163.A N LYS 159.A O no hydrogen 2.953 N/A THR 163.A OG1 LYS 159.A O no hydrogen 2.930 N/A VAL 164.A N ASN 160.A O no hydrogen 3.016 N/A LYS 165.A N MET 161.A O no hydrogen 3.011 N/A LYS 165.A NZ TYR 150.A O no hydrogen 2.994 N/A LYS 165.A NZ GLU 152.A OE2 no hydrogen 2.703 N/A ARG 166.A N ARG 162.A O no hydrogen 3.023 N/A ARG 166.A NH2 GLU 62.A OE1 no hydrogen 3.004 N/A MET 167.A N THR 163.A O no hydrogen 3.023 N/A MET 168.A N VAL 164.A O no hydrogen 3.060 N/A MET 168.A N LYS 165.A O no hydrogen 3.048 N/A VAL 169.A N ARG 166.A O no hydrogen 3.285 N/A GLN 170.A N LEU 178.A O no hydrogen 2.752 N/A GLU 171.A N LEU 178.A O no hydrogen 3.262 N/A GLU 173.A N ALA 176.A O no hydrogen 2.852 N/A ALA 176.A N GLU 173.A O no hydrogen 3.427 N/A THR 177.A N LYS 196.A O no hydrogen 2.986 N/A THR 177.A OG1 GLU 172.A OE1 no hydrogen 2.738 N/A LEU 178.A N GLU 171.A O no hydrogen 2.898 N/A TYR 179.A N PHE 194.A O no hydrogen 2.825 N/A GLY 180.A N MET 168.A O no hydrogen 2.965 N/A LYS 181.A N VAL 192.A O no hydrogen 2.887 N/A LYS 181.A NZ SER 91.A OG no hydrogen 2.964 N/A LYS 181.A NZ THR 182.A O no hydrogen 3.001 N/A GLY 183.A N TRP 190.A O no hydrogen 2.998 N/A SER 186.A OG SER 132.A OG no hydrogen 2.668 N/A ILE 188.A N GLY 185.A O no hydrogen 2.932 N/A GLY 189.A N ILE 208.A O no hydrogen 2.876 N/A TRP 190.A N GLY 183.A O no hydrogen 2.816 N/A TRP 190.A NE1 ALA 40.A O no hydrogen 2.769 N/A TYR 191.A N THR 206.A O no hydrogen 2.929 N/A TYR 191.A OH GLN 170.A OE1 no hydrogen 3.020 N/A VAL 192.A N LYS 181.A O no hydrogen 3.130 N/A GLY 193.A N LEU 204.A O no hydrogen 3.015 N/A PHE 194.A N TYR 179.A O no hydrogen 2.935 N/A ILE 195.A N TYR 202.A O no hydrogen 2.861 N/A LYS 196.A N THR 177.A O no hydrogen 3.009 N/A LYS 196.A NZ TYR 150.A OH no hydrogen 2.815 N/A HIS 197.A N LYS 200.A O no hydrogen 2.849 N/A GLU 198.A N HIS 175.A O no hydrogen 3.215 N/A LYS 200.A N HIS 197.A O no hydrogen 3.053 N/A THR 201.A N GLU 21.A OE2 no hydrogen 2.948 N/A THR 201.A OG1 TYR 150.A OH no hydrogen 2.893 N/A TYR 202.A N ILE 195.A O no hydrogen 2.877 N/A ILE 203.A N GLN 20.A O no hydrogen 2.811 N/A LEU 204.A N GLY 193.A O no hydrogen 2.867 N/A ALA 205.A N VAL 18.A O no hydrogen 2.899 N/A THR 206.A N TYR 191.A O no hydrogen 2.806 N/A THR 206.A OG1 THR 219.A OG1 no hydrogen 2.739 N/A ASN 207.A N THR 16.A O no hydrogen 3.093 N/A ILE 208.A N GLY 189.A O no hydrogen 2.818 N/A LYS 209.A N GLU 14.A O no hydrogen 2.874 N/A GLY 210.A N ASP 187.A O no hydrogen 3.106 N/A THR 211.A N GLU 214.A OE1 no hydrogen 3.054 N/A GLY 212.A N SER 184.A OG no hydrogen 2.785 N/A GLU 214.A N THR 211.A OG1 no hydrogen 3.113 N/A ALA 215.A N THR 211.A O no hydrogen 2.944 N/A LYS 216.A N GLY 212.A O no hydrogen 2.852 N/A LYS 216.A NZ GLN 170.A OE1 no hydrogen 2.939 N/A ASP 217.A N ILE 213.A O no hydrogen 2.977 N/A ILE 218.A N GLU 214.A O no hydrogen 3.000 N/A THR 219.A N ALA 215.A O no hydrogen 2.997 N/A THR 219.A OG1 THR 206.A OG1 no hydrogen 2.739 N/A THR 219.A OG1 ALA 215.A O no hydrogen 2.812 N/A TYR 220.A N LYS 216.A O no hydrogen 2.930 N/A TYR 220.A OH GLU 171.A OE2 no hydrogen 2.689 N/A ARG 221.A N ASP 217.A O no hydrogen 3.040 N/A ARG 221.A NE.B ASP 217.A OD2.A no hydrogen 3.053 N/A ARG 221.A NH1.A ASP 217.A OD2.A no hydrogen 2.811 N/A ILE 222.A N ILE 218.A O no hydrogen 3.039 N/A LEU 223.A N THR 219.A O no hydrogen 2.958 N/A LYS 224.A N TYR 220.A O no hydrogen 2.828 N/A LYS 224.A NZ SER 232.A OG no hydrogen 3.376 N/A LYS 225.A N ARG 221.A O no hydrogen 2.962 N/A LYS 225.A NZ SER 5.A O no hydrogen 2.668 N/A LYS 225.A NZ GLU 8.A OE2 no hydrogen 2.691 N/A LYS 225.A NZ TYR 226.A OH no hydrogen 3.458 N/A TYR 226.A N ILE 222.A O no hydrogen 3.254 N/A TYR 226.A OH ALA 3.A O no hydrogen 3.289 N/A TYR 226.A OH SER 5.A O no hydrogen 3.145 N/A HIS 227.A N LYS 224.A O no hydrogen 2.954 N/A LEU 228.A N LEU 223.A O no hydrogen 2.883 N/A MET 229.A N LEU 223.A O no hydrogen 3.290 N/A GLU 230.A N GLU 173.A OE1 no hydrogen 2.856 N/A