Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4cmd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 7.A N THR 3.A O no hydrogen 3.043 N/A PHE 8.A N MET 4.A O no hydrogen 2.899 N/A ALA 9.A N ASP 5.A O no hydrogen 2.947 N/A GLY 10.A N LYS 6.A O no hydrogen 3.113 N/A TYR 11.A N VAL 7.A O no hydrogen 3.180 N/A ALA 12.A N PHE 8.A O no hydrogen 2.864 N/A GLU 13.A N ALA 9.A O no hydrogen 3.005 N/A ARG 14.A N GLY 10.A O no hydrogen 3.041 N/A ARG 14.A NE ASP 111.A OD1 no hydrogen 3.308 N/A ARG 14.A NE ASP 111.A OD2 no hydrogen 2.818 N/A ARG 14.A NH2 ASP 111.A OD1 no hydrogen 2.912 N/A ARG 14.A NH2 ASP 111.A OD2 no hydrogen 3.478 N/A GLN 15.A N TYR 11.A O no hydrogen 2.826 N/A GLN 15.A NE2 GLU 19.A OE2.B no hydrogen 3.498 N/A ALA 16.A N ALA 12.A O no hydrogen 3.054 N/A VAL 17.A N GLU 13.A O no hydrogen 3.346 N/A LEU 18.A N ARG 14.A O no hydrogen 2.887 N/A GLU 19.A N GLN 15.A O no hydrogen 2.796 N/A ALA 20.A N ALA 16.A O no hydrogen 3.277 N/A ALA 20.A N VAL 17.A O no hydrogen 3.181 N/A SER 21.A N LEU 18.A O no hydrogen 3.113 N/A ASN 23.A N SER 21.A OG no hydrogen 3.179 N/A ASN 23.A ND2 LYS 106.A O no hydrogen 2.838 N/A LEU 25.A N ASN 23.A OD1 no hydrogen 2.946 N/A ALA 26.A N ASN 23.A O no hydrogen 2.960 N/A LYS 27.A N PRO 24.A O no hydrogen 3.523 N/A GLY 28.A N LEU 25.A O no hydrogen 2.838 N/A VAL 29.A N ILE 142.A O no hydrogen 3.033 N/A ALA 30.A N VAL 37.A O no hydrogen 2.778 N/A TRP 31.A N MET 140.A O no hydrogen 2.782 N/A ILE 32.A N GLU 35.A O no hydrogen 2.816 N/A GLU 35.A N ILE 32.A O no hydrogen 3.054 N/A VAL 37.A N ALA 30.A O no hydrogen 2.840 N/A LEU 39.A N GLY 28.A O no hydrogen 3.042 N/A GLU 41.A N PRO 38.A O no hydrogen 2.915 N/A ALA 42.A N LEU 39.A O no hydrogen 3.170 N/A ASP 48.A N PRO 45.A O no hydrogen 3.054 N/A GLN 49.A N GLY 121.A O no hydrogen 2.824 N/A GLY 50.A N ASP 48.A OD1 no hydrogen 2.693 N/A PHE 51.A N ASP 48.A O no hydrogen 2.856 N/A MET 52.A N ASP 48.A O no hydrogen 2.880 N/A HIS 53.A N GLN 49.A O no hydrogen 2.945 N/A HIS 53.A ND1 GLN 49.A OE1 no hydrogen 2.839 N/A ASP 55.A N GLN 49.A O no hydrogen 2.960 N/A THR 57.A N VAL 118.A O no hydrogen 3.002 N/A THR 57.A OG1 LYS 179.A O no hydrogen 2.656 N/A ASP 59.A N LEU 116.A O no hydrogen 2.889 N/A VAL 60.A N ASP 59.A OD1 no hydrogen 2.924 N/A VAL 63.A N ALA 112.A O no hydrogen 2.981 N/A TRP 64.A N ARG 67.A O no hydrogen 2.887 N/A ASP 65.A N ASP 111.A OD1 no hydrogen 2.825 N/A GLY 66.A N ARG 110.A O no hydrogen 2.863 N/A ARG 67.A N TRP 64.A O no hydrogen 2.913 N/A ARG 67.A NE HIS 309.A O no hydrogen 3.161 N/A ARG 67.A NE SER 315.A OG no hydrogen 2.978 N/A ARG 67.A NH2 ASP 312.A OD1 no hydrogen 3.302 N/A ARG 67.A NH2 SER 315.A OG no hydrogen 2.885 N/A PHE 68.A N PHE 316.A O no hydrogen 2.870 N/A PHE 69.A N SER 62.A O no hydrogen 2.951 N/A ARG 70.A N PHE 314.A O no hydrogen 2.730 N/A ARG 70.A NE ASP 73.A OD2 no hydrogen 2.702 N/A ARG 70.A NH1 SER 241.A OG no hydrogen 2.927 N/A ARG 70.A NH1 ASP 244.A OD2 no hydrogen 2.794 N/A ARG 70.A NH2 ASP 73.A OD2 no hydrogen 3.026 N/A ARG 70.A NH2 ASP 244.A OD2 no hydrogen 3.463 N/A HIS 74.A N ARG 70.A O no hydrogen 3.250 N/A HIS 74.A ND1 ASP 59.A OD1 no hydrogen 2.839 N/A LEU 75.A N LEU 71.A O no hydrogen 2.891 N/A ASN 76.A N GLU 72.A O no hydrogen 2.762 N/A ARG 77.A N ASP 73.A O no hydrogen 2.916 N/A ARG 77.A NE ASP 59.A OD2 no hydrogen 2.827 N/A ARG 77.A NH1 GLN 235.A O no hydrogen 3.093 N/A ARG 77.A NH2 ASP 59.A OD1 no hydrogen 2.729 N/A LEU 78.A N HIS 74.A O no hydrogen 2.886 N/A GLU 79.A N LEU 75.A O no hydrogen 2.912 N/A ALA 80.A N ASN 76.A O no hydrogen 2.919 N/A SER 81.A N ARG 77.A O no hydrogen 2.791 N/A SER 81.A OG ARG 77.A O no hydrogen 3.152 N/A CYS 82.A N LEU 78.A O no hydrogen 2.872 N/A CYS 82.A SG LEU 78.A O no hydrogen 3.336 N/A LYS 83.A N GLU 79.A O no hydrogen 2.968 N/A LYS 84.A N ALA 80.A O no hydrogen 3.122 N/A MET 85.A N SER 81.A O no hydrogen 3.089 N/A MET 85.A N CYS 82.A O no hydrogen 3.051 N/A ARG 86.A N LYS 83.A O no hydrogen 3.186 N/A LEU 87.A N CYS 82.A O no hydrogen 2.853 N/A ARG 88.A N ASN 136.A OD1 no hydrogen 2.825 N/A ARG 93.A NH1 GLU 72.A OE1 no hydrogen 2.828 N/A ARG 93.A NH1 ASN 76.A OD1 no hydrogen 2.881 N/A ARG 93.A NH2 ASN 76.A OD1 no hydrogen 3.110 N/A GLU 94.A N GLU 94.A OE1 no hydrogen 2.749 N/A VAL 96.A N PRO 92.A O no hydrogen 3.087 N/A ILE 97.A N ARG 93.A O no hydrogen 2.923 N/A LYS 98.A N GLU 94.A O no hydrogen 3.013 N/A THR 99.A N GLU 95.A O no hydrogen 2.971 N/A THR 99.A OG1 GLU 95.A O no hydrogen 2.722 N/A LEU 100.A N VAL 96.A O no hydrogen 2.941 N/A VAL 101.A N ILE 97.A O no hydrogen 2.888 N/A ASP 102.A N LYS 98.A O no hydrogen 2.995 N/A MET 103.A N THR 99.A O no hydrogen 2.899 N/A VAL 104.A N LEU 100.A O no hydrogen 2.956 N/A ALA 105.A N VAL 101.A O no hydrogen 2.846 N/A LYS 106.A N ASP 102.A O no hydrogen 2.916 N/A LYS 106.A NZ.A ASP 102.A OD1 no hydrogen 3.249 N/A LYS 106.A NZ.A ASP 102.A OD2 no hydrogen 2.730 N/A LYS 106.A NZ.B ASP 102.A OD1 no hydrogen 2.905 N/A SER 107.A N MET 103.A O no hydrogen 3.094 N/A SER 107.A OG VAL 104.A O no hydrogen 2.759 N/A GLY 108.A N VAL 104.A O no hydrogen 3.162 N/A GLY 108.A N ALA 105.A O no hydrogen 3.268 N/A ILE 109.A N SER 107.A OG no hydrogen 2.959 N/A ARG 110.A NH1 GLY 108.A O no hydrogen 2.856 N/A ALA 112.A N VAL 63.A O no hydrogen 2.815 N/A PHE 113.A N GLN 143.A O no hydrogen 2.819 N/A VAL 114.A N PRO 61.A O no hydrogen 3.125 N/A GLU 115.A N PHE 141.A O no hydrogen 2.786 N/A LEU 116.A N ASP 59.A O no hydrogen 2.891 N/A ILE 117.A N TYR 139.A O no hydrogen 2.750 N/A VAL 118.A N THR 57.A O no hydrogen 2.962 N/A THR 119.A N ASN 137.A O no hydrogen 2.838 N/A THR 119.A OG1 ASP 48.A OD1 no hydrogen 2.715 N/A THR 119.A OG1 ASP 48.A OD2 no hydrogen 3.285 N/A ARG 120.A N ASP 55.A O no hydrogen 2.927 N/A ARG 120.A NE ASP 55.A OD1 no hydrogen 3.368 N/A ARG 120.A NE ASP 55.A OD2 no hydrogen 2.817 N/A ARG 120.A NH1 MET 85.A O no hydrogen 2.787 N/A ARG 120.A NH2 ASP 55.A OD1 no hydrogen 2.889 N/A ARG 120.A NH2 MET 85.A O no hydrogen 2.986 N/A GLY 121.A N THR 119.A OG1 no hydrogen 3.132 N/A ALA 128.A N VAL 125.A O no hydrogen 2.973 N/A LYS 129.A N GLU 132.A OE1 no hydrogen 2.736 N/A GLU 131.A N GLU 131.A OE1 no hydrogen 2.761 N/A GLU 132.A N LYS 129.A O no hydrogen 2.878 N/A LEU 133.A N PRO 130.A O no hydrogen 3.083 N/A ASN 136.A ND2 ARG 120.A O no hydrogen 2.972 N/A ASN 136.A ND2 LEU 133.A O no hydrogen 3.130 N/A ASN 137.A N THR 119.A O no hydrogen 3.000 N/A ASN 137.A ND2 ASP 48.A OD2 no hydrogen 2.924 N/A TYR 139.A N ILE 117.A O no hydrogen 2.895 N/A TYR 139.A OH ASP 48.A OD2 no hydrogen 2.568 N/A MET 140.A N TRP 31.A O no hydrogen 3.455 N/A PHE 141.A N GLU 115.A O no hydrogen 2.885 N/A ILE 142.A N VAL 29.A O no hydrogen 2.872 N/A GLN 143.A N PHE 113.A O no hydrogen 2.952 N/A TYR 145.A N ASP 111.A O no hydrogen 2.957 N/A TRP 147.A NE1 TYR 11.A OH no hydrogen 3.055 N/A VAL 148.A N ALA 275.A O no hydrogen 2.835 N/A GLN 154.A N ASP 150.A O no hydrogen 3.188 N/A GLN 154.A N PRO 151.A O no hydrogen 3.037 N/A GLN 154.A NE2 MET 149.A O no hydrogen 2.974 N/A GLN 154.A NE2 GLY 276.A O no hydrogen 3.093 N/A TYR 155.A N ASP 152.A O no hydrogen 3.389 N/A TYR 155.A OH ASP 5.A OD1 no hydrogen 2.602 N/A THR 156.A N VAL 153.A O no hydrogen 3.055 N/A THR 156.A OG1 VAL 153.A O no hydrogen 3.439 N/A GLY 157.A N VAL 153.A O no hydrogen 2.694 N/A GLY 158.A N PRO 280.A O no hydrogen 2.876 N/A ARG 159.A NE GLY 197.A O no hydrogen 3.080 N/A ALA 160.A N THR 283.A O no hydrogen 2.814 N/A ILE 161.A N TYR 200.A O no hydrogen 2.956 N/A VAL 162.A N ASP 285.A OD1 no hydrogen 2.842 N/A ALA 163.A N PHE 202.A O no hydrogen 2.881 N/A ARG 164.A N GLU 192.A OE2 no hydrogen 2.775 N/A THR 165.A N GLU 192.A OE1 no hydrogen 2.857 N/A THR 165.A OG1 GLU 192.A OE1 no hydrogen 2.634 N/A ARG 167.A NE ARG 168.A O no hydrogen 2.944 N/A ARG 167.A NH2 ARG 168.A O no hydrogen 3.498 N/A ARG 168.A N THR 204.A O no hydrogen 2.935 N/A ARG 168.A NE GLU 212.A OE2 no hydrogen 2.836 N/A ARG 168.A NH1 ASP 185.A OD2 no hydrogen 2.724 N/A ARG 168.A NH2 GLU 212.A OE2 no hydrogen 2.766 N/A VAL 169.A N ASP 185.A OD2 no hydrogen 3.013 N/A SER 173.A N PRO 170.A O no hydrogen 2.820 N/A ILE 174.A N PRO 170.A O no hydrogen 3.112 N/A THR 177.A N ASP 175.A OD1 no hydrogen 2.962 N/A THR 177.A OG1 ASP 175.A OD1 no hydrogen 2.775 N/A THR 177.A OG1 ASP 175.A OD2 no hydrogen 3.341 N/A ILE 178.A N ASP 175.A O no hydrogen 3.069 N/A LYS 179.A NZ TYR 58.A OH no hydrogen 3.453 N/A ASN 180.A ND2 ILE 178.A O no hydrogen 2.998 N/A GLN 182.A N ASN 180.A OD1 no hydrogen 2.926 N/A GLN 182.A NE2 SER 54.A O no hydrogen 2.987 N/A VAL 187.A N TRP 183.A O no hydrogen 2.745 N/A ARG 188.A N GLY 184.A O no hydrogen 3.118 N/A ARG 188.A NH2 THR 165.A O no hydrogen 2.849 N/A GLY 189.A N ASP 185.A O no hydrogen 2.857 N/A LEU 190.A N LEU 186.A O no hydrogen 2.861 N/A PHE 191.A N VAL 187.A O no hydrogen 2.992 N/A GLU 192.A N ARG 188.A O no hydrogen 2.908 N/A ALA 193.A N GLY 189.A O no hydrogen 2.823 N/A ASN 194.A N LEU 190.A O no hydrogen 2.966 N/A ASP 195.A N PHE 191.A O no hydrogen 2.805 N/A ARG 196.A N GLU 192.A O no hydrogen 2.875 N/A ARG 196.A N ALA 193.A O no hydrogen 3.040 N/A ARG 196.A NH1 VAL 162.A O no hydrogen 2.991 N/A ARG 196.A NH1 GLU 192.A OE2 no hydrogen 2.828 N/A GLY 197.A N ASN 194.A O no hydrogen 3.103 N/A ALA 198.A N ALA 193.A O no hydrogen 2.766 N/A THR 199.A N ARG 159.A O no hydrogen 3.006 N/A TYR 200.A N ARG 159.A O no hydrogen 3.164 N/A TYR 200.A OH VAL 148.A O no hydrogen 2.659 N/A PHE 202.A N ILE 161.A O no hydrogen 2.774 N/A LEU 203.A N GLU 212.A O no hydrogen 2.944 N/A ASP 205.A N ASN 209.A O no hydrogen 2.983 N/A GLY 206.A N THR 204.A OG1 no hydrogen 3.195 N/A ASP 207.A N ASP 205.A OD1 no hydrogen 2.866 N/A ASN 209.A N ASP 205.A OD1 no hydrogen 2.947 N/A ASN 209.A ND2 ASP 205.A OD2 no hydrogen 2.807 N/A LEU 210.A N VAL 258.A O no hydrogen 2.820 N/A THR 211.A N LEU 203.A O no hydrogen 2.911 N/A THR 211.A OG1 LEU 203.A O no hydrogen 2.707 N/A GLU 212.A N THR 211.A OG1 no hydrogen 2.692 N/A GLY 213.A N PHE 216.A O no hydrogen 2.994 N/A SER 214.A OG.B LEU 186.A O no hydrogen 2.706 N/A GLY 215.A N GLY 213.A O no hydrogen 2.803 N/A ASN 217.A N CYS 272.A O no hydrogen 2.937 N/A ASN 217.A ND2 LEU 234.A O no hydrogen 2.900 N/A VAL 219.A N LEU 270.A O no hydrogen 2.798 N/A LEU 220.A N TYR 227.A O no hydrogen 2.801 N/A ILE 221.A N GLU 268.A O no hydrogen 2.818 N/A LYS 222.A N VAL 225.A O no hydrogen 2.929 N/A LYS 222.A NZ GLN 265.A O no hydrogen 2.833 N/A ASP 223.A N ASP 267.A OD2 no hydrogen 2.767 N/A VAL 225.A N LYS 222.A O no hydrogen 3.095 N/A LEU 226.A N GLU 252.A O no hydrogen 2.905 N/A TYR 227.A N LEU 220.A O no hydrogen 2.757 N/A THR 228.A N ARG 254.A O no hydrogen 2.952 N/A THR 228.A OG1 VAL 218.A O no hydrogen 2.730 N/A ASP 230.A N GLU 256.A O no hydrogen 3.201 N/A ARG 231.A N ASP 230.A OD1.B no hydrogen 2.727 N/A LEU 234.A N GLU 212.A OE1 no hydrogen 2.950 N/A LYS 240.A N GLY 236.A O no hydrogen 2.868 N/A LYS 240.A NZ.A ASP 73.A OD1 no hydrogen 3.031 N/A SER 241.A N ILE 237.A O no hydrogen 2.941 N/A SER 241.A OG ILE 237.A O no hydrogen 2.884 N/A VAL 242.A N THR 238.A O no hydrogen 2.760 N/A ILE 243.A N ARG 239.A O no hydrogen 2.868 N/A ASP 244.A N LYS 240.A O no hydrogen 2.923 N/A ALA 245.A N SER 241.A O no hydrogen 2.716 N/A ALA 246.A N VAL 242.A O no hydrogen 2.797 N/A ARG 247.A N ILE 243.A O no hydrogen 3.230 N/A SER 248.A N ASP 244.A O no hydrogen 2.901 N/A CYS 249.A N ALA 245.A O no hydrogen 2.831 N/A CYS 249.A SG ALA 245.A O no hydrogen 3.360 N/A CYS 249.A SG ALA 300.A O no hydrogen 3.910 N/A GLY 250.A N ARG 247.A O no hydrogen 3.063 N/A TYR 251.A N ALA 246.A O no hydrogen 2.832 N/A ARG 254.A N LEU 226.A O no hydrogen 2.738 N/A ARG 254.A NE.A GLU 256.A OE1 no hydrogen 3.039 N/A ARG 254.A NE.A GLU 256.A OE2 no hydrogen 3.286 N/A ARG 254.A NE.B GLU 252.A OE2.A no hydrogen 2.635 N/A ARG 254.A NH1.A GLU 252.A OE2.A no hydrogen 3.120 N/A ARG 254.A NH2.A GLU 256.A OE1 no hydrogen 3.196 N/A ARG 254.A NH2.B GLU 252.A OE1.A no hydrogen 3.015 N/A ARG 254.A NH2.B GLU 252.A OE2.A no hydrogen 3.219 N/A GLU 256.A N THR 228.A O no hydrogen 3.054 N/A ILE 260.A N ALA 208.A O no hydrogen 2.779 N/A ALA 262.A N PRO 259.A O.A no hydrogen 3.003 N/A ALA 262.A N PRO 259.A O.B no hydrogen 2.996 N/A THR 263.A N ILE 260.A O no hydrogen 2.952 N/A THR 263.A OG1.A ILE 260.A O no hydrogen 2.622 N/A THR 263.A OG1.B ILE 260.A O no hydrogen 2.668 N/A TYR 264.A N GLU 261.A O no hydrogen 3.065 N/A TYR 264.A OH ASP 285.A OD2 no hydrogen 2.646 N/A GLN 265.A N ALA 262.A O no hydrogen 3.184 N/A GLN 265.A NE2.B GLU 261.A OE2 no hydrogen 2.792 N/A ASP 267.A N ILE 221.A O no hydrogen 2.733 N/A GLU 268.A N ILE 221.A O no hydrogen 3.099 N/A LEU 270.A N VAL 219.A O no hydrogen 2.957 N/A MET 271.A N MET 279.A O no hydrogen 2.837 N/A CYS 272.A N ASN 217.A O no hydrogen 2.931 N/A THR 273.A N GLY 277.A O no hydrogen 3.064 N/A THR 273.A OG1 GLY 215.A O no hydrogen 2.731 N/A THR 274.A OG1 VAL 60.A O no hydrogen 3.529 N/A GLY 276.A N THR 274.A O no hydrogen 2.925 N/A GLY 277.A N THR 273.A O no hydrogen 2.765 N/A MET 279.A N MET 271.A O no hydrogen 2.830 N/A ILE 281.A N ILE 269.A O no hydrogen 2.893 N/A THR 282.A N GLY 158.A O no hydrogen 2.964 N/A THR 282.A OG1 THR 156.A O no hydrogen 2.735 N/A THR 283.A N GLY 158.A O no hydrogen 3.237 N/A LEU 284.A N LYS 287.A O no hydrogen 2.817 N/A ASP 285.A N ALA 160.A O no hydrogen 2.907 N/A LYS 287.A N LEU 284.A O no hydrogen 2.965 N/A VAL 289.A N THR 282.A O no hydrogen 2.774 N/A LYS 290.A NZ.A GLN 265.A O no hydrogen 3.157 N/A LYS 290.A NZ.A ALA 266.A O no hydrogen 3.455 N/A LYS 290.A NZ.A ASP 267.A OD1 no hydrogen 2.945 N/A LYS 290.A NZ.B ASP 267.A OD1 no hydrogen 3.464 N/A GLY 292.A N VAL 289.A O no hydrogen 2.774 N/A LYS 293.A N ASP 291.A OD1 no hydrogen 3.150 N/A ILE 297.A N GLU 268.A OE2 no hydrogen 3.072 N/A THR 298.A N GLU 268.A OE1 no hydrogen 2.759 N/A THR 298.A OG1 GLU 268.A OE1 no hydrogen 2.681 N/A LYS 299.A N GLY 295.A O no hydrogen 3.119 N/A ALA 300.A N PRO 296.A O no hydrogen 3.009 N/A ILE 301.A N ILE 297.A O no hydrogen 2.974 N/A TRP 302.A N THR 298.A O no hydrogen 2.812 N/A TRP 302.A NE1 GLN 154.A OE1 no hydrogen 2.905 N/A ASP 303.A N LYS 299.A O no hydrogen 3.103 N/A ARG 304.A N ALA 300.A O no hydrogen 3.095 N/A ARG 304.A NH1 GLU 311.A OE2 no hydrogen 2.896 N/A ARG 304.A NH2 GLU 311.A OE1 no hydrogen 2.937 N/A TYR 305.A N ILE 301.A O no hydrogen 2.873 N/A TRP 306.A N TRP 302.A O no hydrogen 3.217 N/A ALA 307.A N ASP 303.A O no hydrogen 2.897 N/A MET 308.A N ARG 304.A O no hydrogen 3.017 N/A HIS 309.A N TRP 306.A O no hydrogen 2.975 N/A HIS 309.A ND1 TYR 305.A O no hydrogen 2.941 N/A TRP 310.A N ALA 307.A O no hydrogen 3.136 N/A TRP 310.A NE1 ASP 65.A OD2 no hydrogen 2.763 N/A GLU 311.A N MET 308.A O no hydrogen 3.200 N/A PHE 314.A N GLU 311.A O no hydrogen 3.006 N/A SER 315.A OG HIS 309.A O no hydrogen 3.096 N/A SER 315.A OG GLU 311.A O no hydrogen 2.736 N/A PHE 316.A N PHE 68.A O no hydrogen 3.090 N/A ILE 318.A N GLY 66.A O no hydrogen 2.851 N/A TYR 320.A OH ILE 109.A O no hydrogen 2.718 N/A LEU 321.A N ASN 319.A OD1 no hydrogen 2.983 N/A