Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5jga_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 4.A N TYR 68.A O no hydrogen 3.074 N/A ILE 6.A N ALA 70.A O no hydrogen 2.833 N/A GLU 10.A N ASP 7.A O no hydrogen 2.998 N/A ILE 11.A N TYR 8.A O no hydrogen 2.925 N/A GLU 12.A N LYS 29.A O no hydrogen 2.865 N/A GLU 14.A N LYS 27.A O no hydrogen 2.808 N/A GLU 15.A N GLU 15.A OE1 no hydrogen 2.935 N/A VAL 17.A N VAL 25.A O no hydrogen 2.857 N/A GLY 18.A N VAL 25.A O no hydrogen 3.310 N/A ALA 21.A N ASP 150.A OD1 no hydrogen 3.146 N/A ALA 21.A N ASP 150.A OD2 no hydrogen 3.271 N/A GLY 23.A N GLU 45.A OE2 no hydrogen 2.761 N/A VAL 24.A N GLN 39.A O no hydrogen 2.919 N/A VAL 25.A N GLY 18.A O no hydrogen 2.748 N/A CYS 26.A N ILE 37.A O no hydrogen 2.904 N/A LYS 27.A N GLU 15.A O no hydrogen 2.801 N/A ALA 28.A N VAL 35.A O no hydrogen 2.928 N/A LYS 29.A N GLU 12.A O no hydrogen 2.852 N/A LYS 29.A NZ GLU 14.A OE2 no hydrogen 3.441 N/A LYS 29.A NZ ASP 34.A OD1 no hydrogen 3.460 N/A TRP 30.A N LYS 33.A O no hydrogen 3.019 N/A ARG 31.A NE GLU 10.A OE1 no hydrogen 2.638 N/A ARG 31.A NH2 GLU 10.A OE1 no hydrogen 3.436 N/A LYS 33.A N TRP 30.A O no hydrogen 2.985 N/A LYS 33.A NZ TYR 68.A OH no hydrogen 3.337 N/A VAL 35.A N ALA 28.A O no hydrogen 2.918 N/A ALA 36.A N MET 79.A O no hydrogen 2.798 N/A ILE 37.A N CYS 26.A O no hydrogen 2.895 N/A LYS 38.A N LEU 77.A O no hydrogen 2.916 N/A LYS 38.A NZ GLU 52.A OE1 no hydrogen 2.774 N/A LYS 38.A NZ GLU 52.A OE2 no hydrogen 3.439 N/A LYS 38.A NZ ASP 150.A OD1 no hydrogen 2.701 N/A GLN 39.A N VAL 24.A O no hydrogen 2.904 N/A GLN 39.A NE2 TYR 8.A OH no hydrogen 3.064 N/A GLU 41.A N GLU 45.A OE1 no hydrogen 2.898 N/A ARG 46.A N GLU 43.A O no hydrogen 3.441 N/A PHE 49.A N GLU 45.A O no hydrogen 3.148 N/A ILE 50.A N ARG 46.A O no hydrogen 3.056 N/A VAL 51.A N LYS 47.A O no hydrogen 3.042 N/A GLU 52.A N ALA 48.A O no hydrogen 2.876 N/A LEU 53.A N PHE 49.A O no hydrogen 2.840 N/A ARG 54.A N ILE 50.A O no hydrogen 2.880 N/A GLN 55.A N VAL 51.A O no hydrogen 2.786 N/A LEU 56.A N GLU 52.A O no hydrogen 2.768 N/A SER 57.A N LEU 53.A O no hydrogen 3.261 N/A SER 57.A OG LEU 53.A O no hydrogen 2.933 N/A SER 57.A OG ARG 54.A O no hydrogen 2.998 N/A ARG 58.A N ARG 54.A O no hydrogen 3.343 N/A ARG 58.A N GLN 55.A O no hydrogen 3.082 N/A ASN 60.A N TYR 118.A OH no hydrogen 3.037 N/A ASN 63.A N HIS 61.A ND1 no hydrogen 2.961 N/A ASN 63.A ND2 GLN 111.A OE1 no hydrogen 3.333 N/A ASN 63.A ND2 LEU 146.A O no hydrogen 2.909 N/A ILE 64.A N HIS 61.A O no hydrogen 3.117 N/A VAL 65.A N ILE 148.A O no hydrogen 2.944 N/A LYS 66.A N GLU 80.A OE1 no hydrogen 2.963 N/A TYR 68.A N VAL 78.A O no hydrogen 2.818 N/A GLY 69.A N VAL 78.A O no hydrogen 3.119 N/A ALA 70.A N HIS 4.A O no hydrogen 2.964 N/A CYS 71.A N CYS 76.A O no hydrogen 2.788 N/A CYS 71.A SG ILE 6.A O no hydrogen 3.335 N/A CYS 71.A SG PRO 74.A O no hydrogen 3.304 N/A CYS 76.A N CYS 71.A O no hydrogen 2.912 N/A CYS 76.A SG PRO 74.A O no hydrogen 3.905 N/A LEU 77.A N LYS 38.A O no hydrogen 2.896 N/A VAL 78.A N GLY 69.A O no hydrogen 2.807 N/A MET 79.A N ALA 36.A O no hydrogen 2.754 N/A GLU 80.A N LYS 66.A O no hydrogen 2.878 N/A GLU 83.A N GLU 83.A OE1 no hydrogen 2.769 N/A GLY 84.A N LEU 139.A O no hydrogen 2.925 N/A GLY 85.A N ALA 82.A O no hydrogen 2.977 N/A LEU 87.A N LEU 137.A O no hydrogen 2.713 N/A TYR 88.A N PRO 134.A O no hydrogen 3.171 N/A ASN 89.A N SER 86.A OG no hydrogen 3.149 N/A VAL 90.A N SER 86.A O no hydrogen 3.159 N/A LEU 91.A N LEU 87.A O no hydrogen 2.851 N/A HIS 92.A N TYR 88.A O no hydrogen 2.762 N/A HIS 92.A NE2 GLU 185.A OE2 no hydrogen 2.616 N/A GLY 93.A N ASN 89.A O no hydrogen 2.904 N/A TYR 99.A N TYR 264.A O no hydrogen 2.950 N/A TYR 100.A N TYR 281.A OH no hydrogen 3.418 N/A TYR 100.A OH VAL 186.A O no hydrogen 2.601 N/A THR 101.A N HIS 104.A ND1 no hydrogen 3.128 N/A THR 101.A OG1 HIS 104.A ND1 no hydrogen 3.249 N/A HIS 104.A N THR 101.A OG1 no hydrogen 3.234 N/A HIS 104.A NE2 GLU 260.A O no hydrogen 2.598 N/A ALA 105.A N THR 101.A O no hydrogen 2.958 N/A MET 106.A N ALA 102.A O no hydrogen 2.933 N/A SER 107.A N ALA 103.A O no hydrogen 2.910 N/A TRP 108.A N HIS 104.A O no hydrogen 2.840 N/A TRP 108.A NE1 GLY 143.A O no hydrogen 2.878 N/A CYS 109.A N ALA 105.A O no hydrogen 3.240 N/A CYS 109.A SG ALA 105.A O no hydrogen 3.434 N/A LEU 110.A N MET 106.A O no hydrogen 2.801 N/A GLN 111.A N SER 107.A O no hydrogen 2.882 N/A GLN 111.A NE2 SER 107.A O no hydrogen 3.317 N/A GLN 111.A NE2 SER 107.A OG no hydrogen 2.894 N/A GLN 111.A NE2 THR 144.A O no hydrogen 2.999 N/A CYS 112.A N TRP 108.A O no hydrogen 2.922 N/A SER 113.A N CYS 109.A O no hydrogen 2.935 N/A SER 113.A OG CYS 109.A O no hydrogen 3.522 N/A SER 113.A OG LEU 110.A O no hydrogen 2.712 N/A GLN 114.A N LEU 110.A O no hydrogen 2.884 N/A GLY 115.A N GLN 111.A O no hydrogen 3.102 N/A VAL 116.A N CYS 112.A O no hydrogen 2.981 N/A ALA 117.A N SER 113.A O no hydrogen 2.795 N/A TYR 118.A N GLN 114.A O no hydrogen 3.131 N/A LEU 119.A N GLY 115.A O no hydrogen 3.056 N/A HIS 120.A N VAL 116.A O no hydrogen 2.836 N/A HIS 120.A NE2 ASP 175.A OD2 no hydrogen 2.814 N/A SER 121.A N TYR 118.A O no hydrogen 3.191 N/A SER 121.A OG ALA 117.A O no hydrogen 3.378 N/A SER 121.A OG TYR 118.A O no hydrogen 2.761 N/A MET 122.A N LEU 119.A O no hydrogen 3.265 N/A LEU 127.A N LEU 119.A O no hydrogen 2.937 N/A HIS 129.A N ASP 175.A OD2 no hydrogen 2.952 N/A HIS 129.A NE2 CYS 149.A O no hydrogen 2.854 N/A ARG 130.A N ASP 175.A OD1 no hydrogen 2.908 N/A ARG 130.A NE ALA 154.A O no hydrogen 3.486 N/A ARG 130.A NH1 ALA 154.A O no hydrogen 3.174 N/A ARG 130.A NH2 TYR 170.A OH no hydrogen 3.116 N/A ASP 131.A N HIS 129.A ND1 no hydrogen 3.153 N/A LYS 133.A NZ SER 156.A OG no hydrogen 2.674 N/A ASN 136.A N LYS 133.A O no hydrogen 2.864 N/A ASN 136.A ND2 ASP 131.A O no hydrogen 2.873 N/A ASN 136.A ND2 ASP 131.A OD2 no hydrogen 2.859 N/A LEU 137.A N PRO 134.A O no hydrogen 3.174 N/A LEU 138.A N LYS 147.A O no hydrogen 2.798 N/A LEU 139.A N GLY 85.A O no hydrogen 2.853 N/A VAL 140.A N VAL 145.A O no hydrogen 2.941 N/A ALA 141.A N GLU 83.A OE2 no hydrogen 3.025 N/A THR 144.A N VAL 140.A O no hydrogen 3.168 N/A THR 144.A N ALA 141.A O no hydrogen 3.427 N/A THR 144.A OG1 ALA 141.A O no hydrogen 2.706 N/A VAL 145.A N VAL 140.A O no hydrogen 3.097 N/A LEU 146.A N GLN 111.A OE1 no hydrogen 2.868 N/A LYS 147.A N LEU 138.A O no hydrogen 2.855 N/A LYS 147.A NZ GLU 80.A OE1 no hydrogen 3.037 N/A LYS 147.A NZ GLU 80.A OE2 no hydrogen 2.765 N/A ILE 148.A N ASN 63.A O no hydrogen 2.797 N/A CYS 149.A N ASN 136.A O no hydrogen 2.952 N/A CYS 149.A SG ASN 136.A O no hydrogen 3.450 N/A CYS 149.A SG ASP 150.A OD2 no hydrogen 3.646 N/A PHE 151.A N GLU 52.A OE2 no hydrogen 2.806 N/A ALA 154.A N PHE 151.A O no hydrogen 3.138 N/A SER 156.A OG ASP 131.A OD1 no hydrogen 2.632 N/A TRP 159.A N SER 156.A O no hydrogen 3.179 N/A TRP 159.A NE1 GLU 185.A OE1 no hydrogen 2.806 N/A MET 160.A N ALA 157.A O no hydrogen 3.276 N/A GLU 163.A N GLU 163.A OE1 no hydrogen 2.896 N/A VAL 164.A N ALA 161.A O no hydrogen 2.986 N/A GLU 166.A N PRO 162.A O no hydrogen 2.985 N/A GLY 167.A N VAL 164.A O no hydrogen 3.325 N/A GLU 172.A N GLU 172.A OE2 no hydrogen 2.795 N/A LYS 173.A N SER 171.A OG no hydrogen 3.253 N/A LYS 173.A NZ PRO 235.A O no hydrogen 3.295 N/A LYS 173.A NZ ARG 238.A O no hydrogen 2.736 N/A CYS 174.A N SER 171.A O no hydrogen 3.074 N/A CYS 174.A SG SER 171.A O no hydrogen 3.306 N/A ASP 175.A N GLU 172.A O no hydrogen 3.033 N/A VAL 176.A N LYS 173.A O no hydrogen 3.167 N/A PHE 177.A N LYS 173.A O no hydrogen 3.254 N/A SER 178.A N CYS 174.A O no hydrogen 3.236 N/A SER 178.A OG TRP 159.A O no hydrogen 2.660 N/A SER 178.A OG CYS 174.A O no hydrogen 3.263 N/A TRP 179.A N ASP 175.A O no hydrogen 2.915 N/A TRP 179.A NE1 CYS 109.A O no hydrogen 2.873 N/A GLY 180.A N VAL 176.A O no hydrogen 3.022 N/A ILE 181.A N PHE 177.A O no hydrogen 3.153 N/A ILE 182.A N SER 178.A O no hydrogen 3.006 N/A LEU 183.A N TRP 179.A O no hydrogen 2.872 N/A TRP 184.A N GLY 180.A O no hydrogen 3.177 N/A TRP 184.A NE1 PRO 214.A O no hydrogen 2.737 N/A GLU 185.A N ILE 181.A O no hydrogen 2.876 N/A VAL 186.A N ILE 182.A O no hydrogen 2.847 N/A ILE 187.A N LEU 183.A O no hydrogen 3.227 N/A THR 188.A N TRP 184.A O no hydrogen 2.957 N/A THR 188.A OG1 TRP 184.A O no hydrogen 2.858 N/A THR 188.A OG1 GLU 185.A O no hydrogen 3.523 N/A ARG 189.A NE LEU 91.A O no hydrogen 2.996 N/A ARG 189.A NH1 PRO 98.A O no hydrogen 2.887 N/A ARG 189.A NH2 VAL 90.A O no hydrogen 2.790 N/A ARG 189.A NH2 PRO 98.A O no hydrogen 2.816 N/A ARG 190.A N THR 188.A OG1 no hydrogen 3.187 N/A ARG 190.A NH2 PRO 271.A O no hydrogen 2.456 N/A ASP 194.A N LYS 191.A O no hydrogen 3.273 N/A GLU 195.A N GLU 195.A OE1 no hydrogen 2.730 N/A ILE 196.A N PHE 193.A O no hydrogen 3.240 N/A GLY 197.A N PHE 193.A O no hydrogen 3.297 N/A ARG 202.A N PRO 199.A O no hydrogen 3.036 N/A ARG 202.A NH1 ILE 196.A O no hydrogen 2.643 N/A ILE 203.A N ALA 200.A O no hydrogen 2.933 N/A MET 204.A N ALA 200.A O no hydrogen 3.082 N/A TRP 205.A N PHE 201.A O no hydrogen 2.951 N/A ALA 206.A N ARG 202.A O no hydrogen 3.189 N/A VAL 207.A N ILE 203.A O no hydrogen 2.849 N/A HIS 208.A N MET 204.A O no hydrogen 2.851 N/A HIS 208.A ND1 GLU 166.A OE1 no hydrogen 2.438 N/A ASN 209.A N TRP 205.A O no hydrogen 3.037 N/A ASN 209.A ND2 TRP 205.A O no hydrogen 3.069 N/A GLY 210.A N VAL 207.A O no hydrogen 2.921 N/A THR 211.A N ALA 206.A O no hydrogen 3.042 N/A THR 211.A OG1 ALA 206.A O no hydrogen 3.230 N/A ARG 212.A NE TRP 231.A O no hydrogen 2.745 N/A ARG 212.A NH1 TRP 231.A O no hydrogen 3.147 N/A ARG 212.A NH2 VAL 207.A O no hydrogen 2.998 N/A ARG 212.A NH2 THR 211.A O no hydrogen 2.855 N/A LYS 217.A N VAL 278.A O no hydrogen 2.791 N/A LEU 219.A N ILE 216.A O no hydrogen 3.284 N/A ILE 223.A N PRO 220.A O no hydrogen 2.954 N/A GLU 224.A N PRO 220.A O no hydrogen 2.941 N/A SER 225.A N LYS 221.A O no hydrogen 2.828 N/A SER 225.A OG LYS 221.A O no hydrogen 3.098 N/A LEU 226.A N PRO 222.A O no hydrogen 3.155 N/A MET 227.A N ILE 223.A O no hydrogen 2.945 N/A THR 228.A N GLU 224.A O no hydrogen 2.961 N/A THR 228.A OG1 GLU 224.A O no hydrogen 3.090 N/A THR 228.A OG1 SER 225.A O no hydrogen 3.431 N/A ARG 229.A N SER 225.A O no hydrogen 2.922 N/A ARG 229.A NH1 GLU 243.A OE1 no hydrogen 3.113 N/A ARG 229.A NH2 GLU 243.A OE1 no hydrogen 3.233 N/A ARG 229.A NH2 GLU 243.A OE2 no hydrogen 3.550 N/A CYS 230.A N LEU 226.A O no hydrogen 3.033 N/A CYS 230.A SG LEU 226.A O no hydrogen 3.335 N/A TRP 231.A N MET 227.A O no hydrogen 3.299 N/A SER 232.A N ARG 229.A O no hydrogen 3.291 N/A SER 232.A OG ARG 229.A O no hydrogen 2.625 N/A SER 236.A N ASP 234.A OD1 no hydrogen 2.984 N/A SER 236.A OG ASP 234.A OD1 no hydrogen 2.650 N/A SER 236.A OG ASP 234.A OD2 no hydrogen 3.322 N/A GLN 237.A N ASP 234.A O no hydrogen 3.067 N/A ARG 238.A N PRO 235.A O no hydrogen 3.210 N/A ARG 238.A NE SER 232.A O no hydrogen 2.739 N/A ARG 238.A NH1 GLU 163.A OE1 no hydrogen 3.533 N/A ARG 238.A NH1 GLU 163.A OE2 no hydrogen 2.666 N/A ARG 238.A NH1 LYS 173.A O no hydrogen 3.070 N/A ARG 238.A NH2 GLU 163.A OE1 no hydrogen 2.766 N/A ARG 238.A NH2 GLU 163.A OE2 no hydrogen 3.503 N/A ARG 238.A NH2 SER 232.A O no hydrogen 2.918 N/A GLU 243.A N SER 240.A OG no hydrogen 3.295 N/A ILE 244.A N SER 240.A O no hydrogen 3.205 N/A VAL 245.A N MET 241.A O no hydrogen 2.848 N/A LYS 246.A N GLU 242.A O no hydrogen 3.195 N/A ILE 247.A N GLU 243.A O no hydrogen 2.924 N/A MET 248.A N ILE 244.A O no hydrogen 2.858 N/A THR 249.A N VAL 245.A O no hydrogen 2.775 N/A THR 249.A OG1 VAL 245.A O no hydrogen 2.621 N/A HIS 250.A N LYS 246.A O no hydrogen 3.049 N/A LEU 251.A N ILE 247.A O no hydrogen 2.929 N/A MET 252.A N MET 248.A O no hydrogen 3.224 N/A MET 252.A N THR 249.A O no hydrogen 3.318 N/A ARG 253.A NE ASP 294.A OD2 no hydrogen 2.755 N/A ARG 253.A NH2 ASP 294.A OD1 no hydrogen 3.039 N/A TYR 254.A N LEU 251.A O no hydrogen 2.874 N/A TYR 254.A OH ASP 294.A OD2 no hydrogen 2.441 N/A PHE 255.A N MET 252.A O no hydrogen 2.841 N/A GLU 260.A N GLY 257.A O no hydrogen 3.139 N/A LEU 262.A N GLY 142.A O no hydrogen 2.799 N/A CYS 266.A SG TYR 281.A OH no hydrogen 3.377 N/A ARG 277.A NH1 ILE 216.A O no hydrogen 3.189 N/A ARG 277.A NH1 GLU 224.A OE2 no hydrogen 3.421 N/A VAL 278.A N LEU 215.A O no hydrogen 2.945 N/A TYR 281.A N ILE 187.A O no hydrogen 2.787 N/A VAL 282.A N ILE 187.A O no hydrogen 3.359 N/A TYR 288.A N PHE 284.A O no hydrogen 3.066 N/A TYR 288.A OH ASN 218.A O no hydrogen 2.714 N/A ARG 289.A N ALA 285.A O no hydrogen 3.087 N/A ARG 289.A NE GLU 286.A OE1 no hydrogen 3.208 N/A LEU 290.A N GLU 286.A O no hydrogen 2.908 N/A TRP 291.A N PHE 287.A O no hydrogen 2.830 N/A SER 292.A N TYR 288.A O no hydrogen 2.965 N/A SER 292.A OG GLY 296.A O no hydrogen 3.426 N/A VAL 293.A N ARG 289.A O no hydrogen 3.058 N/A ASP 294.A N LEU 290.A O no hydrogen 3.216 N/A HIS 295.A N TRP 291.A O no hydrogen 2.910 N/A HIS 295.A ND1 TRP 291.A O no hydrogen 2.988 N/A GLY 296.A N SER 292.A O no hydrogen 2.722 N/A