Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6pag_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 2.A N LEU 102.A O no hydrogen 2.913 N/A HIS 2.A ND1 ASP 28.A OD2 no hydrogen 2.611 N/A SER 3.A OG ASP 101.A OD1 no hydrogen 2.942 N/A MET 4.A N CYS 100.A O no hydrogen 2.911 N/A ARG 5.A N TYR 26.A O no hydrogen 2.902 N/A ARG 5.A NH2 ASP 101.A OD1 no hydrogen 2.538 N/A TYR 6.A N SER 98.A O no hydrogen 2.777 N/A PHE 7.A N VAL 24.A O no hydrogen 2.909 N/A ASP 8.A N ARG 96.A O no hydrogen 2.914 N/A THR 9.A N ILE 22.A O no hydrogen 2.750 N/A ALA 10.A N LEU 94.A O no hydrogen 2.793 N/A VAL 11.A N ARG 20.A O no hydrogen 3.100 N/A SER 12.A N HIS 92.A O no hydrogen 2.941 N/A SER 12.A OG HIS 92.A O no hydrogen 3.525 N/A ARG 13.A NE GLU 18.A O no hydrogen 2.680 N/A ARG 13.A NH1 ASP 38.A OD2 no hydrogen 2.971 N/A ARG 13.A NH2 GLU 18.A O no hydrogen 3.133 N/A ARG 13.A NH2 ASP 38.A OD1 no hydrogen 2.662 N/A ARG 13.A NH2 ASP 38.A OD2 no hydrogen 3.516 N/A ARG 16.A N ARG 13.A O no hydrogen 3.002 N/A ARG 20.A N VAL 11.A O no hydrogen 3.053 N/A ARG 20.A NE ASP 36.A OD1 no hydrogen 3.123 N/A ARG 20.A NH2 ASP 36.A OD1 no hydrogen 3.261 N/A ARG 20.A NH2 ASP 36.A OD2 no hydrogen 2.695 N/A PHE 21.A N SER 37.A OG no hydrogen 2.775 N/A ILE 22.A N THR 9.A O no hydrogen 2.900 N/A SER 23.A N PHE 35.A O no hydrogen 3.005 N/A SER 23.A OG ASP 8.A OD1 no hydrogen 2.724 N/A VAL 24.A N PHE 7.A O no hydrogen 2.937 N/A GLY 25.A N VAL 33.A O no hydrogen 3.088 N/A TYR 26.A N ARG 5.A O no hydrogen 2.845 N/A VAL 27.A N THR 30.A O no hydrogen 2.870 N/A ASP 28.A N SER 3.A O no hydrogen 2.930 N/A ASP 29.A N TYR 208.A OH no hydrogen 3.200 N/A THR 30.A N VAL 27.A O no hydrogen 2.925 N/A THR 30.A OG1 TYR 208.A OH no hydrogen 2.506 N/A GLN 31.A NE2 VAL 33.A O no hydrogen 3.045 N/A PHE 32.A N GLY 25.A O no hydrogen 2.915 N/A ARG 34.A N GLU 45.A O no hydrogen 3.071 N/A PHE 35.A N SER 23.A O no hydrogen 2.806 N/A SER 37.A N PHE 21.A O no hydrogen 3.034 N/A SER 37.A OG PHE 21.A O no hydrogen 3.313 N/A ASP 38.A N ASP 36.A OD1 no hydrogen 2.995 N/A ALA 39.A N ASP 36.A O no hydrogen 3.300 N/A ARG 43.A NH2 ASP 60.A OD1 no hydrogen 2.837 N/A GLY 44.A N THR 63.A OG1 no hydrogen 2.995 N/A GLU 45.A N ARG 34.A O no hydrogen 2.918 N/A ARG 47.A N PHE 32.A O no hydrogen 2.745 N/A VAL 51.A N ALA 48.A O no hydrogen 3.143 N/A GLU 52.A N PRO 49.A O no hydrogen 3.173 N/A GLN 53.A N GLN 53.A OE1 no hydrogen 2.491 N/A TYR 58.A N GLY 55.A O no hydrogen 2.972 N/A TYR 58.A OH TYR 170.A OH no hydrogen 2.382 N/A TRP 59.A N GLY 55.A O no hydrogen 3.404 N/A ASP 60.A N PRO 56.A O no hydrogen 2.907 N/A ARG 61.A N GLU 57.A O no hydrogen 3.364 N/A GLU 62.A N TYR 58.A O no hydrogen 2.989 N/A THR 63.A N TRP 59.A O no hydrogen 2.901 N/A THR 63.A OG1 TRP 59.A O no hydrogen 2.820 N/A GLN 64.A N ASP 60.A O no hydrogen 2.936 N/A LYS 65.A N ARG 61.A O no hydrogen 2.998 N/A LYS 65.A NZ GLU 62.A OE2 no hydrogen 2.394 N/A TYR 66.A N GLU 62.A O no hydrogen 2.932 N/A LYS 67.A N THR 63.A O no hydrogen 2.909 N/A ARG 68.A N GLN 64.A O no hydrogen 3.016 N/A GLN 69.A N LYS 65.A O no hydrogen 2.911 N/A GLN 69.A NE2 ASP 73.A OD1 no hydrogen 2.808 N/A ALA 70.A N TYR 66.A O no hydrogen 2.898 N/A GLN 71.A N.A LYS 67.A O no hydrogen 3.044 N/A GLN 71.A N.B LYS 67.A O no hydrogen 3.037 N/A ALA 72.A N ARG 68.A O no hydrogen 2.909 N/A ASP 73.A N GLN 69.A O no hydrogen 2.885 N/A ARG 74.A N ALA 70.A O no hydrogen 2.964 N/A VAL 75.A N GLN 71.A O.A no hydrogen 2.956 N/A VAL 75.A N GLN 71.A O.B no hydrogen 2.949 N/A SER 76.A N ALA 72.A O no hydrogen 2.885 N/A SER 76.A OG ALA 72.A O no hydrogen 2.852 N/A LEU 77.A N ASP 73.A O no hydrogen 2.882 N/A ARG 78.A N ARG 74.A O no hydrogen 3.054 N/A ARG 78.A NH1 ARG 78.A O no hydrogen 3.202 N/A ASN 79.A N VAL 75.A O no hydrogen 2.891 N/A LEU 80.A N SER 76.A O no hydrogen 2.888 N/A ARG 81.A N LEU 77.A O no hydrogen 2.929 N/A GLY 82.A N ARG 78.A O no hydrogen 2.984 N/A TYR 83.A N ASN 79.A O no hydrogen 2.848 N/A TYR 84.A N LEU 80.A O no hydrogen 3.165 N/A TYR 84.A OH ASP 136.A OD2 no hydrogen 2.567 N/A ASN 85.A N GLY 82.A O no hydrogen 3.030 N/A GLN 86.A N ARG 81.A O no hydrogen 3.035 N/A ASP 89.A N SER 87.A OG no hydrogen 2.723 N/A SER 91.A OG SER 12.A O no hydrogen 2.494 N/A HIS 92.A N SER 12.A OG no hydrogen 3.001 N/A HIS 92.A ND1 ASP 118.A OD2 no hydrogen 2.824 N/A THR 93.A N ASP 118.A OD1 no hydrogen 2.855 N/A LEU 94.A N ALA 10.A O no hydrogen 2.756 N/A GLN 95.A N ALA 116.A O no hydrogen 2.913 N/A ARG 96.A NH1 ASP 8.A OD2 no hydrogen 2.919 N/A ARG 96.A NH1 ASP 73.A OD2 no hydrogen 3.374 N/A ARG 96.A NH2 ASP 73.A OD1 no hydrogen 2.967 N/A MET 97.A N GLN 114.A O no hydrogen 2.904 N/A SER 98.A N TYR 6.A O no hydrogen 3.012 N/A GLY 99.A N TYR 112.A O no hydrogen 2.932 N/A CYS 100.A N MET 4.A O no hydrogen 2.924 N/A ASP 101.A N ARG 110.A O no hydrogen 2.816 N/A LEU 102.A N HIS 2.A O no hydrogen 2.891 N/A GLY 103.A N ARG 107.A O no hydrogen 3.106 N/A GLY 106.A N GLY 103.A O no hydrogen 2.973 N/A ARG 107.A N ASP 105.A OD1 no hydrogen 3.085 N/A LEU 109.A N ASP 101.A O no hydrogen 2.591 N/A ARG 110.A N ASP 101.A O no hydrogen 3.037 N/A ARG 110.A NH1 GLY 111.A O no hydrogen 2.427 N/A TYR 112.A N GLY 99.A O no hydrogen 2.868 N/A GLN 114.A N MET 97.A O no hydrogen 2.898 N/A SER 115.A N ILE 123.A O no hydrogen 2.845 N/A ALA 116.A N GLN 95.A O no hydrogen 2.899 N/A TYR 117.A N LYS 120.A O no hydrogen 2.731 N/A TYR 117.A OH GLN 86.A OE1 no hydrogen 2.894 N/A ASP 118.A N THR 93.A O no hydrogen 2.794 N/A LYS 120.A N TYR 117.A O no hydrogen 3.087 N/A LYS 120.A NZ ASP 136.A OD2 no hydrogen 3.257 N/A TYR 122.A N SER 115.A O no hydrogen 2.784 N/A TYR 122.A OH THR 142.A OG1 no hydrogen 2.475 N/A ILE 123.A N SER 115.A O no hydrogen 3.005 N/A ALA 124.A N THR 133.A O no hydrogen 2.942 N/A LEU 125.A N ASP 113.A O no hydrogen 2.897 N/A ASN 126.A N SER 131.A O no hydrogen 2.945 N/A ASN 126.A ND2 SER 131.A OG no hydrogen 2.584 N/A GLU 127.A N GLU 127.A OE1 no hydrogen 2.338 N/A LEU 129.A N ASN 126.A O no hydrogen 2.869 N/A ARG 130.A N ASP 128.A OD1 no hydrogen 2.756 N/A SER 131.A N ASP 128.A OD1 no hydrogen 3.076 N/A SER 131.A OG ASP 128.A OD1 no hydrogen 3.459 N/A SER 131.A OG ASP 128.A OD2 no hydrogen 3.464 N/A THR 133.A N ALA 124.A O no hydrogen 2.865 N/A THR 133.A OG1 ASN 126.A OD1 no hydrogen 2.355 N/A ALA 135.A N TYR 122.A O no hydrogen 3.029 N/A ALA 139.A N ASP 136.A OD1 no hydrogen 3.006 N/A GLN 140.A N ASP 136.A O no hydrogen 3.232 N/A ILE 141.A N ALA 138.A O no hydrogen 3.158 N/A THR 142.A N ALA 138.A O no hydrogen 3.512 N/A THR 142.A OG1 TYR 122.A OH no hydrogen 2.475 N/A GLN 143.A N ALA 139.A O no hydrogen 2.881 N/A GLN 143.A NE2 GLU 147.A OE2 no hydrogen 3.257 N/A ARG 144.A N GLN 140.A O no hydrogen 2.906 N/A LYS 145.A N ILE 141.A O no hydrogen 2.978 N/A LEU 146.A N THR 142.A O no hydrogen 2.871 N/A GLU 147.A N GLN 143.A O no hydrogen 2.903 N/A ALA 148.A N ARG 144.A O no hydrogen 2.932 N/A ALA 149.A N LYS 145.A O no hydrogen 2.931 N/A ALA 149.A N LEU 146.A O no hydrogen 3.268 N/A ARG 150.A N GLU 147.A O no hydrogen 2.980 N/A ALA 151.A N LEU 146.A O no hydrogen 3.118 N/A GLN 154.A NE2 ARG 150.A O no hydrogen 3.055 N/A LEU 155.A N ALA 151.A O no hydrogen 2.951 N/A ARG 156.A N ALA 152.A O no hydrogen 2.902 N/A ALA 157.A N GLU 153.A O no hydrogen 2.909 N/A TYR 158.A N GLN 154.A O no hydrogen 2.939 N/A LEU 159.A N LEU 155.A O no hydrogen 2.878 N/A GLU 160.A N ARG 156.A O no hydrogen 2.923 N/A GLY 161.A N ALA 157.A O no hydrogen 2.943 N/A CYS 163.A N TYR 158.A O no hydrogen 2.775 N/A CYS 163.A SG TYR 158.A OH no hydrogen 3.806 N/A GLU 165.A N GLY 161.A O no hydrogen 3.055 N/A TRP 166.A N THR 162.A O no hydrogen 2.950 N/A LEU 167.A N CYS 163.A O no hydrogen 2.907 N/A ARG 168.A N VAL 164.A O no hydrogen 2.921 N/A ARG 169.A N GLU 165.A O no hydrogen 2.942 N/A ARG 169.A NE GLU 54.A OE2 no hydrogen 2.531 N/A TYR 170.A N TRP 166.A O no hydrogen 2.887 N/A TYR 170.A OH TYR 58.A OH no hydrogen 2.382 N/A LEU 171.A N LEU 167.A O no hydrogen 2.888 N/A GLU 172.A N ARG 168.A O no hydrogen 2.968 N/A ASN 173.A N ARG 169.A O no hydrogen 2.894 N/A GLY 174.A N TYR 170.A O no hydrogen 3.127 N/A LYS 175.A N GLU 172.A O no hydrogen 3.067 N/A THR 177.A OG1 GLY 174.A O no hydrogen 3.437 N/A LEU 178.A N GLY 174.A O no hydrogen 2.857 N/A GLN 179.A N LYS 175.A O no hydrogen 2.935 N/A GLN 179.A NE2 LEU 171.A O no hydrogen 3.144 N/A LYS 185.A N LEU 205.A O no hydrogen 2.759 N/A THR 189.A N ARG 201.A O no hydrogen 2.869 N/A THR 189.A OG1 HIS 191.A NE2 no hydrogen 3.026 N/A THR 189.A OG1 ARG 201.A O no hydrogen 3.199 N/A HIS 191.A N THR 199.A O no hydrogen 2.906 N/A HIS 191.A NE2 THR 189.A OG1 no hydrogen 3.026 N/A LEU 193.A N GLU 197.A O no hydrogen 3.083 N/A SER 194.A N GLU 197.A O no hydrogen 2.900 N/A HIS 196.A ND1 ASP 195.A O no hydrogen 2.200 N/A GLU 197.A N SER 194.A O no hydrogen 2.914 N/A ALA 198.A N VAL 248.A O no hydrogen 2.890 N/A THR 199.A N HIS 191.A O no hydrogen 2.752 N/A LEU 200.A N VAL 246.A O no hydrogen 2.915 N/A ARG 201.A N THR 189.A O no hydrogen 2.985 N/A CYS 202.A N ALA 244.A O no hydrogen 2.849 N/A TRP 203.A N HIS 187.A O no hydrogen 2.979 N/A TRP 203.A NE1 THR 189.A OG1 no hydrogen 2.826 N/A ALA 204.A N LYS 242.A O no hydrogen 2.848 N/A LEU 205.A N LYS 185.A O no hydrogen 2.796 N/A PHE 207.A N PHE 240.A O no hydrogen 3.207 N/A TYR 208.A N GLU 182.A O no hydrogen 3.189 N/A TYR 208.A OH THR 30.A OG1 no hydrogen 2.506 N/A ALA 210.A N ASP 29.A OD2 no hydrogen 2.899 N/A THR 213.A N GLN 261.A O no hydrogen 2.963 N/A THR 213.A OG1 GLN 261.A O no hydrogen 3.377 N/A THR 215.A N HIS 259.A O no hydrogen 2.886 N/A THR 215.A OG1 HIS 259.A O no hydrogen 3.348 N/A TRP 216.A NE1 ALA 244.A O no hydrogen 2.633 N/A GLN 217.A N THR 257.A O no hydrogen 2.873 N/A GLN 217.A NE2 GLY 220.A O no hydrogen 2.273 N/A ARG 218.A N GLU 221.A O no hydrogen 3.021 N/A ASP 219.A N ARG 255.A O no hydrogen 2.348 N/A GLU 221.A N ARG 218.A O no hydrogen 2.997 N/A GLN 223.A N TRP 216.A O no hydrogen 3.197 N/A THR 224.A N ASP 222.A OD1 no hydrogen 3.108 N/A THR 224.A OG1 ASP 222.A OD1 no hydrogen 2.411 N/A ASP 226.A N GLN 223.A O no hydrogen 2.909 N/A THR 227.A N THR 224.A O no hydrogen 3.260 N/A THR 227.A OG1 GLN 223.A O no hydrogen 2.339 N/A GLU 228.A N ALA 245.A O no hydrogen 2.718 N/A ARG 233.A N GLN 241.A O no hydrogen 3.039 N/A ARG 233.A NH2 GLN 241.A OE1 no hydrogen 2.702 N/A ALA 235.A N THR 239.A O no hydrogen 2.805 N/A THR 239.A OG1 PHE 207.A O no hydrogen 2.810 N/A PHE 240.A N PHE 207.A O no hydrogen 2.884 N/A GLN 241.A N ARG 233.A O no hydrogen 2.857 N/A LYS 242.A N ALA 204.A O no hydrogen 2.913 N/A LYS 242.A NZ VAL 230.A O no hydrogen 2.431 N/A ALA 244.A N CYS 202.A O no hydrogen 2.948 N/A ALA 245.A N GLU 228.A O no hydrogen 2.749 N/A VAL 246.A N LEU 200.A O no hydrogen 2.932 N/A VAL 248.A N ALA 198.A O no hydrogen 2.860 N/A SER 250.A N HIS 196.A O no hydrogen 3.394 N/A GLY 251.A N GLU 253.A OE2 no hydrogen 3.008 N/A GLN 252.A N PRO 249.A O no hydrogen 3.081 N/A GLU 253.A N GLU 253.A OE1 no hydrogen 2.419 N/A ARG 255.A NE ASP 219.A OD2 no hydrogen 2.616 N/A ARG 255.A NH2 ASP 219.A OD2 no hydrogen 2.831 N/A TYR 256.A N GLU 253.A O no hydrogen 2.730 N/A THR 257.A N GLN 217.A O no hydrogen 2.887 N/A THR 257.A OG1 GLN 217.A O no hydrogen 3.098 N/A CYS 258.A N LEU 271.A O no hydrogen 2.835 N/A HIS 259.A N THR 215.A O no hydrogen 2.896 N/A MET 260.A N LEU 269.A O no hydrogen 2.887 N/A GLN 261.A N THR 213.A O no hydrogen 2.872 N/A HIS 262.A NE2 PRO 209.A O no hydrogen 3.066 N/A GLY 264.A N HIS 262.A ND1 no hydrogen 2.920 N/A LEU 265.A N HIS 262.A O no hydrogen 3.400 N/A GLN 266.A N GLN 266.A OE1 no hydrogen 2.647 N/A LEU 269.A N MET 260.A O no hydrogen 2.893 N/A THR 270.A OG1 HIS 259.A ND1 no hydrogen 2.766 N/A LEU 271.A N CYS 258.A O no hydrogen 2.954 N/A SER 272.A OG TYR 256.A O no hydrogen 2.586 N/A