Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4i05_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A N GLY 97.A O no hydrogen 2.919 N/A ARG 3.A NH2 GLY 96.A O no hydrogen 3.432 N/A GLU 5.A N GLU 269.A OE2 no hydrogen 3.056 N/A GLU 6.A N GLU 6.A OE1 no hydrogen 2.546 N/A ARG 10.A N GLU 6.A O no hydrogen 2.869 N/A ARG 10.A NH1 THR 271.A OG1 no hydrogen 2.950 N/A ARG 10.A NH2 VAL 270.A O no hydrogen 2.895 N/A ARG 11.A N PRO 7.A O no hydrogen 3.084 N/A THR 12.A N LEU 9.A O no hydrogen 3.251 N/A THR 12.A OG1 ASP 8.A O no hydrogen 3.040 N/A THR 12.A OG1 LEU 9.A O no hydrogen 3.566 N/A ARG 13.A N LEU 9.A O no hydrogen 2.859 N/A ARG 13.A NH1 GLU 5.A OE2 no hydrogen 2.755 N/A ARG 14.A NE ASP 104.A OD1 no hydrogen 2.749 N/A ARG 14.A NH1 GLU 5.A OE1 no hydrogen 3.411 N/A ARG 14.A NH1 GLU 5.A OE2 no hydrogen 2.824 N/A ARG 14.A NH1 ASP 104.A OD2 no hydrogen 2.880 N/A ARG 14.A NH2 GLU 5.A OE1 no hydrogen 2.880 N/A ARG 14.A NH2 ASN 176.A OD1 no hydrogen 2.930 N/A VAL 17.A N ASN 176.A O no hydrogen 2.890 N/A HIS 19.A NE2 GLU 187.A OE1 no hydrogen 2.706 N/A ASN 20.A N ASP 18.A OD1 no hydrogen 2.714 N/A TRP 22.A N HIS 19.A O no hydrogen 2.953 N/A PHE 30.A N TRP 230.A O no hydrogen 2.935 N/A SER 32.A N ILE 228.A O no hydrogen 2.940 N/A SER 32.A OG ILE 228.A O no hydrogen 2.607 N/A ARG 33.A N ASP 31.A OD1 no hydrogen 2.877 N/A ARG 33.A NE ASP 31.A OD1 no hydrogen 3.102 N/A ARG 33.A NE ASP 31.A OD2 no hydrogen 3.314 N/A ARG 33.A NH2 ASP 31.A OD2 no hydrogen 2.964 N/A LYS 34.A N ASP 31.A O no hydrogen 2.903 N/A LYS 35.A N ASP 31.A O no hydrogen 3.173 N/A LYS 35.A NZ MET 189.A O no hydrogen 2.708 N/A TRP 36.A N SER 32.A O no hydrogen 3.088 N/A CYS 39.A N TRP 36.A O no hydrogen 3.114 N/A SER 41.A OG ASP 64.A OD1 no hydrogen 2.737 N/A ILE 42.A N CYS 39.A O no hydrogen 3.081 N/A ALA 43.A N LYS 40.A O no hydrogen 3.387 N/A THR 44.A N SER 41.A O no hydrogen 3.046 N/A THR 44.A OG1 LYS 40.A O no hydrogen 2.962 N/A ARG 46.A NH1 LEU 78.A O no hydrogen 3.038 N/A ARG 46.A NH2 LEU 78.A O no hydrogen 3.096 N/A GLN 48.A N SER 244.A O no hydrogen 2.931 N/A GLN 48.A NE2 CYS 51.A O no hydrogen 2.980 N/A SER 49.A N ASP 47.A OD1 no hydrogen 2.899 N/A SER 49.A OG PRO 129.A O no hydrogen 2.647 N/A ARG 50.A NE CYS 142.A O no hydrogen 2.787 N/A ARG 50.A NH1 TYR 147.A OH no hydrogen 3.069 N/A ARG 50.A NH2 PRO 141.A O no hydrogen 2.986 N/A CYS 51.A N SER 49.A O no hydrogen 2.926 N/A CYS 51.A SG SER 53.A OG no hydrogen 3.421 N/A CYS 51.A SG TYR 126.A OH no hydrogen 3.790 N/A GLY 52.A N CYS 94.A O no hydrogen 2.719 N/A SER 53.A OG TYR 126.A OH no hydrogen 3.013 N/A TRP 54.A NE1 GLY 93.A O no hydrogen 3.267 N/A ALA 55.A N SER 53.A O no hydrogen 2.939 N/A PHE 56.A N SER 53.A O no hydrogen 2.988 N/A VAL 59.A N ALA 55.A O no hydrogen 2.931 N/A GLU 60.A N PHE 56.A O no hydrogen 2.952 N/A ALA 61.A N GLY 57.A O no hydrogen 3.086 N/A MET 62.A N ALA 58.A O no hydrogen 2.769 N/A SER 63.A N VAL 59.A O no hydrogen 2.881 N/A SER 63.A OG VAL 59.A O no hydrogen 2.616 N/A ASP 64.A N GLU 60.A O no hydrogen 3.049 N/A ARG 65.A N ALA 61.A O no hydrogen 2.962 N/A ARG 65.A NE PRO 193.A O no hydrogen 2.764 N/A ARG 65.A NH1 TYR 175.A OH no hydrogen 3.264 N/A ARG 65.A NH1 GLU 187.A OE2 no hydrogen 3.211 N/A ARG 65.A NH1 GLY 273.A O no hydrogen 2.703 N/A ARG 65.A NH2 GLU 187.A OE2 no hydrogen 2.751 N/A ARG 65.A NH2 GLY 192.A O no hydrogen 2.892 N/A ARG 65.A NH2 PRO 193.A O no hydrogen 3.556 N/A SER 66.A N MET 62.A O no hydrogen 2.963 N/A SER 66.A OG MET 62.A O no hydrogen 2.730 N/A CYS 67.A N SER 63.A O no hydrogen 3.305 N/A CYS 67.A SG ASN 75.A OD1.B no hydrogen 3.274 N/A ILE 68.A N ASP 64.A O no hydrogen 2.879 N/A GLN 69.A N ARG 65.A O no hydrogen 2.854 N/A GLN 69.A NE2 TYR 191.A O no hydrogen 2.964 N/A SER 70.A N CYS 67.A O no hydrogen 3.355 N/A SER 70.A OG SER 66.A O no hydrogen 2.631 N/A SER 70.A OG CYS 67.A O no hydrogen 3.274 N/A GLY 71.A N ILE 68.A O no hydrogen 3.176 N/A GLY 72.A N CYS 67.A O no hydrogen 2.781 N/A LYS 73.A N SER 70.A O no hydrogen 3.452 N/A LYS 73.A NZ SER 70.A O no hydrogen 3.078 N/A GLN 74.A N SER 70.A OG no hydrogen 3.017 N/A ASN 75.A ND2.A ARG 38.A O no hydrogen 3.547 N/A ASN 75.A ND2.B GLY 72.A O no hydrogen 3.115 N/A LEU 78.A N SER 63.A OG no hydrogen 2.946 N/A SER 79.A N VAL 112.A O no hydrogen 2.733 N/A SER 79.A OG GLU 124.A O no hydrogen 2.727 N/A ASP 82.A N SER 79.A OG no hydrogen 2.974 N/A LEU 83.A N SER 79.A O no hydrogen 3.474 N/A LEU 84.A N ALA 80.A O no hydrogen 2.894 N/A SER 85.A N VAL 81.A O no hydrogen 2.926 N/A SER 85.A OG VAL 81.A O no hydrogen 2.729 N/A CYS 86.A N ASP 82.A O no hydrogen 3.065 N/A CYS 86.A SG ASP 82.A OD1 no hydrogen 3.486 N/A CYS 86.A SG SER 85.A OG no hydrogen 3.663 N/A CYS 86.A SG LYS 153.A O.B no hydrogen 3.703 N/A CYS 86.A SG TYR 164.A OH no hydrogen 3.828 N/A CYS 87.A N LEU 83.A O no hydrogen 3.130 N/A CYS 87.A SG SER 89.A OG no hydrogen 3.647 N/A LEU 92.A N GLY 96.A O no hydrogen 2.799 N/A CYS 94.A N THR 149.A OG1 no hydrogen 2.852 N/A GLU 95.A N LEU 92.A O no hydrogen 2.788 N/A GLY 96.A N GLY 93.A O no hydrogen 3.306 N/A ILE 98.A N CYS 90.A O no hydrogen 2.783 N/A ALA 102.A N LEU 99.A O no hydrogen 2.952 N/A TRP 103.A N GLY 100.A O no hydrogen 3.144 N/A TRP 103.A NE1 GLU 195.A OE1 no hydrogen 2.850 N/A ASP 104.A N GLY 100.A O no hydrogen 3.271 N/A TYR 105.A N PRO 101.A O no hydrogen 2.836 N/A TRP 106.A N ALA 102.A O no hydrogen 2.998 N/A VAL 107.A N TRP 103.A O no hydrogen 3.162 N/A LYS 108.A N ASP 104.A O no hydrogen 2.867 N/A GLU 109.A N TYR 105.A O no hydrogen 2.766 N/A GLY 110.A N TYR 105.A O no hydrogen 3.068 N/A ILE 111.A N HIS 169.A O no hydrogen 2.945 N/A VAL 112.A N ASP 82.A OD2 no hydrogen 3.011 N/A THR 113.A N ASP 167.A OD2 no hydrogen 2.815 N/A THR 113.A OG1 TYR 160.A OH no hydrogen 3.278 N/A THR 113.A OG1 ASP 167.A OD2 no hydrogen 2.725 N/A GLY 114.A N GLU 77.A O no hydrogen 2.775 N/A SER 115.A N ALA 121.A O no hydrogen 2.898 N/A SER 115.A OG SER 116.A O no hydrogen 2.695 N/A SER 115.A OG ALA 121.A O no hydrogen 3.373 N/A LYS 117.A NZ PRO 127.A O no hydrogen 2.849 N/A GLU 118.A N GLU 118.A OE1.A no hydrogen 2.586 N/A ASN 119.A N SER 116.A O no hydrogen 3.240 N/A ASN 119.A N SER 116.A OG no hydrogen 3.183 N/A HIS 120.A N SER 116.A O no hydrogen 3.185 N/A HIS 120.A N LYS 117.A O no hydrogen 3.158 N/A ALA 121.A N SER 115.A OG no hydrogen 2.811 N/A CYS 123.A N THR 113.A OG1 no hydrogen 3.149 N/A GLU 124.A N THR 113.A O no hydrogen 2.956 N/A TYR 126.A N SER 115.A O no hydrogen 2.777 N/A TYR 126.A OH GLN 48.A O no hydrogen 2.631 N/A TYR 126.A OH SER 53.A OG no hydrogen 3.013 N/A LYS 130.A N GLU 118.A OE2.A no hydrogen 3.306 N/A LYS 130.A NZ GLU 118.A OE1.A no hydrogen 3.244 N/A LYS 130.A NZ GLU 118.A OE2.B no hydrogen 3.510 N/A CYS 131.A N ASP 47.A OD2 no hydrogen 3.074 N/A CYS 131.A SG HIS 133.A NE2 no hydrogen 4.013 N/A GLU 132.A N PRO 140.A O no hydrogen 2.729 N/A HIS 133.A NE2 ASP 47.A OD1 no hydrogen 2.582 N/A THR 135.A OG1 LYS 136.A O no hydrogen 3.514 N/A LYS 138.A N ASP 248.A OD2 no hydrogen 3.230 N/A LYS 138.A NZ GLU 247.A OE1.B no hydrogen 2.660 N/A LYS 138.A NZ ASP 248.A OD1 no hydrogen 3.243 N/A TYR 139.A N GLU 132.A OE2 no hydrogen 2.923 N/A TYR 139.A OH GLU 247.A OE1.B no hydrogen 2.633 N/A CYS 142.A N GLU 132.A O no hydrogen 2.877 N/A CYS 142.A SG GLU 132.A O no hydrogen 3.161 N/A TYR 147.A N ARG 50.A O no hydrogen 2.745 N/A LYS 153.A N.B ARG 151.A O no hydrogen 2.991 N/A CYS 156.A SG THR 162.A O no hydrogen 3.308 N/A GLN 157.A N CYS 123.A O no hydrogen 2.790 N/A GLN 157.A NE2 HIS 120.A O no hydrogen 3.075 N/A GLN 157.A NE2 GLY 122.A O no hydrogen 2.792 N/A LYS 159.A NZ HIS 120.A O no hydrogen 3.099 N/A TYR 160.A N GLN 157.A O no hydrogen 3.072 N/A TYR 160.A OH ASP 167.A OD1 no hydrogen 2.538 N/A TYR 164.A OH ASP 82.A OD1 no hydrogen 2.627 N/A THR 165.A OG1.A GLN 166.A OE1 no hydrogen 2.904 N/A ASP 167.A N PRO 163.A O no hydrogen 2.928 N/A ASP 167.A N TYR 164.A O no hydrogen 2.958 N/A LYS 168.A N THR 165.A O no hydrogen 3.405 N/A LYS 168.A NZ.A ASP 82.A OD2 no hydrogen 2.848 N/A LYS 168.A NZ.A TYR 105.A OH no hydrogen 3.439 N/A LYS 168.A NZ.A GLY 110.A O no hydrogen 2.765 N/A LYS 168.A NZ.A TYR 164.A OH no hydrogen 3.116 N/A HIS 169.A N ILE 111.A O no hydrogen 2.933 N/A HIS 169.A ND1 ASP 167.A O no hydrogen 2.829 N/A ARG 170.A NE LYS 108.A O no hydrogen 3.322 N/A GLY 171.A N TRP 106.A O no hydrogen 3.023 N/A LYS 172.A N ARG 274.A O no hydrogen 2.725 N/A SER 173.A N ARG 274.A O no hydrogen 3.205 N/A SER 174.A OG ASP 104.A OD1 no hydrogen 2.770 N/A TYR 175.A N ALA 272.A O no hydrogen 2.947 N/A TYR 175.A OH GLU 187.A OE2 no hydrogen 2.651 N/A ASN 176.A N PRO 15.A O no hydrogen 2.847 N/A ASN 176.A ND2 ARG 10.A O no hydrogen 2.907 N/A VAL 177.A N VAL 270.A O no hydrogen 2.858 N/A LYS 178.A N VAL 17.A O no hydrogen 2.939 N/A ASN 179.A ND2 ASP 262.A OD2 no hydrogen 3.008 N/A ALA 183.A N ASP 180.A OD2 no hydrogen 2.805 N/A ILE 184.A N ASP 180.A O no hydrogen 3.054 N/A GLN 185.A N GLU 181.A O no hydrogen 2.991 N/A LYS 186.A N LYS 182.A O no hydrogen 2.915 N/A LYS 186.A NZ HIS 19.A O no hydrogen 3.077 N/A LYS 186.A NZ TRP 22.A O no hydrogen 2.612 N/A GLU 187.A N ALA 183.A O no hydrogen 3.051 N/A ILE 188.A N ILE 184.A O no hydrogen 3.005 N/A MET 189.A N GLN 185.A O no hydrogen 2.966 N/A LYS 190.A N LYS 186.A O no hydrogen 3.050 N/A TYR 191.A N GLU 187.A O no hydrogen 2.847 N/A GLY 192.A N ILE 188.A O no hydrogen 2.930 N/A VAL 194.A N ILE 227.A O no hydrogen 3.172 N/A GLU 195.A N THR 271.A O no hydrogen 3.056 N/A ALA 196.A N ILE 225.A O no hydrogen 2.948 N/A PHE 198.A N HIS 223.A O no hydrogen 2.919 N/A THR 199.A N CYS 264.A O no hydrogen 2.777 N/A THR 199.A OG1 CYS 264.A O no hydrogen 3.568 N/A VAL 200.A N GLY 221.A O no hydrogen 2.827 N/A GLU 202.A N GLU 218.A O no hydrogen 2.881 N/A PHE 204.A N TYR 201.A O no hydrogen 2.939 N/A LEU 205.A N GLU 202.A O no hydrogen 3.220 N/A ASN 206.A N ASP 203.A O no hydrogen 3.120 N/A TYR 207.A N PHE 204.A O no hydrogen 3.111 N/A TYR 207.A OH GLY 210.A O no hydrogen 2.714 N/A GLY 210.A N GLU 251.A OE2 no hydrogen 2.872 N/A TYR 212.A N ARG 256.A O no hydrogen 2.647 N/A TYR 212.A OH ASP 203.A OD1 no hydrogen 2.572 N/A HIS 214.A N GLU 263.A OE2 no hydrogen 2.800 N/A ILE 215.A N ASP 203.A OD2 no hydrogen 2.748 N/A THR 216.A N ASP 203.A OD2 no hydrogen 3.159 N/A GLU 218.A N GLU 202.A OE1 no hydrogen 2.632 N/A THR 219.A OG1 VAL 200.A O no hydrogen 3.426 N/A LEU 220.A N VAL 200.A O no hydrogen 2.598 N/A GLY 221.A N THR 219.A OG1 no hydrogen 3.386 N/A HIS 223.A N PHE 198.A O no hydrogen 2.973 N/A ILE 225.A N ALA 196.A O no hydrogen 2.800 N/A ARG 226.A N ALA 242.A O no hydrogen 3.260 N/A ARG 226.A NE GLU 60.A OE1 no hydrogen 3.414 N/A ARG 226.A NH1 ILE 42.A O no hydrogen 3.043 N/A ARG 226.A NH1 ASP 64.A OD2 no hydrogen 2.652 N/A ARG 226.A NH2 ILE 42.A O no hydrogen 3.350 N/A ILE 227.A N VAL 194.A O no hydrogen 2.903 N/A ILE 228.A N LEU 240.A O no hydrogen 2.844 N/A TRP 230.A N PHE 30.A O no hydrogen 2.900 N/A TRP 230.A NE1 PRO 27.A O no hydrogen 2.943 N/A GLY 231.A N TYR 238.A O no hydrogen 3.119 N/A GLU 233.A N ALA 236.A O no hydrogen 3.048 N/A ALA 236.A N GLU 233.A O no hydrogen 2.814 N/A TYR 238.A N GLY 231.A O no hydrogen 2.853 N/A TRP 239.A N ILE 257.A O no hydrogen 2.852 N/A TRP 239.A NE1 GLU 267.A OE2 no hydrogen 2.670 N/A LEU 240.A N GLY 229.A O no hydrogen 2.929 N/A ILE 241.A N PHE 255.A O no hydrogen 2.951 N/A ALA 242.A N ARG 226.A O no hydrogen 2.856 N/A ASN 243.A N GLY 253.A O no hydrogen 3.090 N/A SER 244.A N ASN 243.A OD1 no hydrogen 2.806 N/A SER 244.A OG GLN 48.A OE1 no hydrogen 2.610 N/A ASN 246.A N ARG 46.A O no hydrogen 3.009 N/A ASN 246.A ND2 ASP 47.A OD2 no hydrogen 2.812 N/A GLU 247.A N GLU 247.A OE1.A no hydrogen 2.861 N/A GLU 247.A N GLU 247.A OE2.B no hydrogen 2.925 N/A ASP 248.A N ASN 246.A OD1 no hydrogen 2.853 N/A TRP 249.A N ASN 246.A O no hydrogen 3.402 N/A GLU 251.A N TYR 254.A O no hydrogen 2.762 N/A GLY 253.A N TRP 249.A O no hydrogen 2.729 N/A TYR 254.A N GLU 251.A O no hydrogen 3.096 N/A PHE 255.A N ILE 241.A O no hydrogen 2.844 N/A ARG 256.A N TYR 207.A OH no hydrogen 3.442 N/A ARG 256.A NE GLU 251.A OE1 no hydrogen 2.929 N/A ARG 256.A NH1 GLU 233.A OE1 no hydrogen 2.828 N/A ARG 256.A NH2 GLU 251.A OE2 no hydrogen 2.846 N/A ILE 257.A N TRP 239.A O no hydrogen 3.231 N/A VAL 258.A N TYR 212.A O no hydrogen 3.082 N/A ARG 259.A N PRO 237.A O no hydrogen 3.111 N/A ARG 259.A NE TYR 238.A O no hydrogen 3.020 N/A ARG 259.A NH1 GLU 181.A OE2 no hydrogen 2.637 N/A ARG 259.A NH2 GLY 231.A O no hydrogen 2.903 N/A GLY 260.A N GLU 267.A OE2 no hydrogen 2.882 N/A ASP 262.A N GLU 267.A OE1 no hydrogen 2.885 N/A CYS 264.A SG THR 199.A O no hydrogen 3.492 N/A CYS 264.A SG GLU 263.A OE2 no hydrogen 3.405 N/A SER 265.A N ASP 262.A O no hydrogen 2.878 N/A ILE 266.A N GLU 263.A O no hydrogen 3.003 N/A GLU 267.A N ASP 262.A OD1 no hydrogen 2.879 N/A SER 268.A N SER 265.A O no hydrogen 3.055 N/A SER 268.A OG.A ASP 262.A OD1 no hydrogen 3.220 N/A SER 268.A OG.A ASP 262.A OD2 no hydrogen 2.874 N/A SER 268.A OG.B SER 265.A O no hydrogen 2.750 N/A THR 271.A N GLU 195.A O no hydrogen 3.045 N/A THR 271.A OG1 GLU 269.A O no hydrogen 3.349 N/A ALA 272.A N TYR 175.A O no hydrogen 3.015 N/A ARG 274.A N SER 173.A O no hydrogen 2.988 N/A ILE 275.A N GLN 69.A OE1 no hydrogen 2.865 N/A ASN 276.A ND2 GLN 69.A O no hydrogen 3.050 N/A