Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5cmi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 16.A N LYS 13.A O no hydrogen 2.957 N/A CYS 18.A SG GLY 36.A O no hydrogen 3.250 N/A ARG 19.A NE ASP 21.A OD1 no hydrogen 2.827 N/A ARG 19.A NH1 ASP 21.A OD1 no hydrogen 3.430 N/A ARG 19.A NH1 ASP 21.A OD2 no hydrogen 2.905 N/A ARG 19.A NH1 VAL 272.A O no hydrogen 2.965 N/A ARG 19.A NH2 GLU 35.A O no hydrogen 2.964 N/A ASP 21.A N ASP 21.A OD1 no hydrogen 2.617 N/A THR 26.A N ALA 30.A O no hydrogen 2.796 N/A THR 26.A OG1 ALA 30.A O no hydrogen 3.559 N/A TRP 28.A N THR 26.A OG1 no hydrogen 3.188 N/A TRP 28.A NE1 PRO 252.A O no hydrogen 2.734 N/A LEU 29.A N THR 26.A O no hydrogen 2.941 N/A ALA 30.A N THR 26.A OG1 no hydrogen 3.025 N/A ILE 32.A N VAL 24.A O no hydrogen 2.841 N/A VAL 33.A N VAL 255.A O no hydrogen 2.903 N/A TRP 34.A NE1 LEU 23.A O no hydrogen 2.991 N/A GLU 35.A N GLU 259.A OE1 no hydrogen 2.738 N/A GLU 35.A N GLU 259.A OE2 no hydrogen 3.255 N/A THR 37.A N TRP 34.A O no hydrogen 3.054 N/A THR 37.A OG1 TRP 34.A O no hydrogen 2.744 N/A ILE 42.A N ASN 39.A OD1 no hydrogen 3.040 N/A LEU 43.A N ASN 39.A O no hydrogen 3.245 N/A ASN 44.A N ILE 40.A O no hydrogen 2.817 N/A GLU 45.A N ASP 41.A O no hydrogen 3.108 N/A GLN 46.A N ILE 42.A O no hydrogen 3.061 N/A PHE 47.A N LEU 43.A O no hydrogen 2.889 N/A ARG 48.A N ASN 44.A O no hydrogen 2.822 N/A ARG 48.A NH2 ASN 51.A OD1 no hydrogen 2.915 N/A LEU 49.A N GLU 45.A O no hydrogen 2.939 N/A GLN 50.A N PHE 47.A O no hydrogen 3.087 N/A ASN 51.A N ARG 48.A O no hydrogen 2.764 N/A THR 52.A N PHE 47.A O no hydrogen 3.336 N/A THR 52.A OG1 PHE 47.A O no hydrogen 2.834 N/A THR 53.A N ASP 142.A OD2 no hydrogen 2.812 N/A ILE 54.A N ARG 84.A O no hydrogen 2.886 N/A GLY 55.A N TYR 143.A O no hydrogen 2.829 N/A LEU 56.A N HIS 86.A O no hydrogen 2.918 N/A THR 57.A N VAL 145.A O no hydrogen 2.789 N/A THR 57.A OG1 VAL 145.A O no hydrogen 3.521 N/A VAL 58.A N TYR 88.A O no hydrogen 3.001 N/A ALA 60.A N PHE 90.A O no hydrogen 2.747 N/A LYS 62.A N ASP 92.A OD1 no hydrogen 2.997 N/A LYS 62.A NZ TYR 116.A O no hydrogen 3.440 N/A TYR 64.A N ILE 61.A O no hydrogen 2.962 N/A VAL 65.A N LYS 62.A O no hydrogen 3.346 N/A ALA 66.A N LYS 63.A O no hydrogen 3.112 N/A PHE 67.A N TYR 64.A O no hydrogen 3.034 N/A LEU 68.A N VAL 65.A O no hydrogen 3.231 N/A LYS 69.A NZ GLU 73.A OE2 no hydrogen 2.657 N/A PHE 71.A N PHE 67.A O no hydrogen 3.133 N/A LEU 72.A N LEU 68.A O no hydrogen 2.903 N/A GLU 73.A N LYS 69.A O no hydrogen 3.008 N/A THR 74.A N LEU 70.A O no hydrogen 2.950 N/A THR 74.A OG1 LEU 70.A O no hydrogen 2.702 N/A THR 74.A OG1 PHE 71.A O no hydrogen 3.099 N/A ALA 75.A N PHE 71.A O no hydrogen 2.927 N/A GLU 76.A N LEU 72.A O no hydrogen 2.898 N/A LYS 77.A N THR 74.A O no hydrogen 3.094 N/A HIS 78.A N ALA 75.A O no hydrogen 3.173 N/A PHE 79.A N ALA 75.A O no hydrogen 2.845 N/A MET 80.A N VAL 157.A O no hydrogen 2.835 N/A HIS 83.A N MET 80.A O no hydrogen 2.968 N/A HIS 83.A NE2 ASN 44.A OD1 no hydrogen 2.863 N/A VAL 85.A N GLY 105.A O no hydrogen 3.163 N/A HIS 86.A N ILE 54.A O no hydrogen 2.911 N/A HIS 86.A NE2 SER 109.A OG no hydrogen 2.757 N/A TYR 87.A N GLN 107.A O no hydrogen 2.682 N/A TYR 87.A OH GLU 76.A OE2 no hydrogen 2.493 N/A TYR 88.A N LEU 56.A O no hydrogen 2.810 N/A TYR 88.A OH GLU 140.A OE1 no hydrogen 2.508 N/A VAL 89.A N SER 109.A O no hydrogen 2.925 N/A PHE 90.A N VAL 58.A O no hydrogen 2.847 N/A THR 91.A N LEU 111.A O no hydrogen 2.966 N/A THR 91.A OG1 ALA 60.A O no hydrogen 2.681 N/A GLN 93.A N THR 91.A OG1 no hydrogen 2.998 N/A ALA 96.A N GLN 93.A O no hydrogen 2.915 N/A VAL 97.A N PRO 94.A O no hydrogen 3.205 N/A GLY 103.A N GLU 76.A OE1 no hydrogen 2.696 N/A ARG 106.A NE GLU 76.A OE2 no hydrogen 2.848 N/A ARG 106.A NH1 GLU 76.A OE2 no hydrogen 3.501 N/A ARG 106.A NH1 PHE 79.A O no hydrogen 2.816 N/A ARG 106.A NH1 TYR 87.A OH no hydrogen 2.922 N/A ARG 106.A NH2 PHE 79.A O no hydrogen 2.907 N/A GLN 107.A N VAL 85.A O no hydrogen 2.861 N/A SER 109.A N TYR 87.A O no hydrogen 2.826 N/A SER 109.A OG HIS 86.A NE2 no hydrogen 2.757 N/A LEU 111.A N VAL 89.A O no hydrogen 2.833 N/A VAL 113.A N THR 91.A O no hydrogen 2.804 N/A GLN 120.A N GLN 120.A OE1 no hydrogen 3.043 N/A VAL 122.A N ARG 118.A O no hydrogen 2.991 N/A SER 123.A N TRP 119.A O no hydrogen 2.992 N/A SER 123.A OG TRP 119.A O no hydrogen 3.265 N/A SER 123.A OG ASP 239.A OD1 no hydrogen 2.571 N/A ARG 125.A N VAL 122.A O no hydrogen 3.058 N/A MET 126.A N SER 123.A O no hydrogen 3.054 N/A MET 128.A N ARG 124.A O no hydrogen 2.193 N/A SER 130.A N GLU 127.A O no hydrogen 2.709 N/A SER 130.A OG MET 126.A O no hydrogen 3.286 N/A SER 130.A OG GLU 127.A O no hydrogen 3.224 N/A SER 130.A OG SER 130.A O no hydrogen 2.422 N/A ARG 136.A NE GLU 140.A OE1 no hydrogen 2.872 N/A ARG 136.A NE GLU 140.A OE2 no hydrogen 3.255 N/A PHE 137.A N CYS 133.A O no hydrogen 2.961 N/A LEU 138.A N GLU 134.A O no hydrogen 3.085 N/A SER 139.A N ARG 135.A O no hydrogen 3.033 N/A SER 139.A N ARG 136.A O no hydrogen 2.978 N/A SER 139.A OG ARG 135.A O no hydrogen 2.733 N/A GLU 140.A N ARG 136.A O no hydrogen 2.986 N/A GLU 140.A N PHE 137.A O no hydrogen 3.208 N/A VAL 141.A N PHE 137.A O no hydrogen 3.146 N/A ASP 142.A N THR 53.A O no hydrogen 2.852 N/A TYR 143.A N THR 53.A O no hydrogen 3.333 N/A LEU 144.A N GLY 209.A O no hydrogen 2.855 N/A VAL 145.A N GLY 55.A O no hydrogen 2.755 N/A CYS 146.A N PHE 207.A O no hydrogen 2.785 N/A CYS 146.A SG THR 57.A OG1 no hydrogen 3.450 N/A VAL 147.A N THR 57.A O no hydrogen 3.197 N/A ASP 148.A N GLY 205.A O no hydrogen 3.131 N/A GLU 152.A N THR 279.A O no hydrogen 2.859 N/A PHE 153.A N THR 74.A OG1 no hydrogen 2.983 N/A ARG 154.A N ARG 277.A O no hydrogen 2.800 N/A ARG 154.A NH1 GLN 264.A OE1 no hydrogen 2.781 N/A ARG 154.A NH2 GLN 264.A OE1 no hydrogen 2.760 N/A ASP 155.A N ARG 277.A O no hydrogen 3.246 N/A HIS 156.A N ASP 155.A OD1 no hydrogen 2.701 N/A HIS 156.A NE2 GLU 160.A OE2 no hydrogen 2.766 N/A VAL 157.A N HIS 78.A O no hydrogen 2.984 N/A GLY 158.A N GLU 160.A OE1 no hydrogen 2.937 N/A GLU 160.A N GLU 160.A OE2 no hydrogen 2.823 N/A ILE 161.A N GLY 158.A O no hydrogen 3.102 N/A LEU 162.A N VAL 159.A O no hydrogen 2.936 N/A THR 163.A OG1 THR 253.A OG1 no hydrogen 2.636 N/A LEU 165.A N THR 253.A OG1 no hydrogen 3.017 N/A PHE 166.A N GLY 208.A O no hydrogen 2.859 N/A THR 168.A OG1 PHE 206.A O no hydrogen 2.787 N/A LEU 169.A N LEU 256.A O no hydrogen 3.047 N/A HIS 170.A N TYR 201.A O no hydrogen 2.805 N/A GLY 172.A N HIS 170.A ND1 no hydrogen 2.940 N/A PHE 173.A N HIS 170.A O no hydrogen 3.168 N/A SER 176.A N PHE 173.A O no hydrogen 2.915 N/A SER 176.A OG PHE 173.A O no hydrogen 3.541 N/A ARG 178.A NE GLY 198.A O no hydrogen 3.040 N/A ARG 178.A NH1 GLY 198.A O no hydrogen 2.858 N/A ALA 180.A N SER 177.A O no hydrogen 2.965 N/A PHE 181.A N ARG 178.A O no hydrogen 3.025 N/A THR 182.A OG1 TYR 201.A OH no hydrogen 3.084 N/A TYR 183.A OH PHE 200.A O no hydrogen 2.734 N/A ARG 185.A NH1 ILE 193.A O no hydrogen 2.724 N/A ARG 185.A NH2 ARG 178.A O no hydrogen 3.028 N/A ARG 185.A NH2 PHE 181.A O no hydrogen 3.061 N/A ARG 186.A N GLU 184.A OE1 no hydrogen 2.769 N/A ARG 186.A NE GLU 184.A OE1 no hydrogen 2.814 N/A ARG 186.A NH2 GLU 184.A OE1 no hydrogen 3.489 N/A ARG 186.A NH2 GLU 184.A OE2 no hydrogen 2.921 N/A ARG 186.A NH2 GLU 234.A O no hydrogen 2.537 N/A SER 189.A N ARG 186.A O no hydrogen 3.041 N/A SER 189.A OG ASP 228.A OD2 no hydrogen 2.740 N/A GLN 190.A N ASP 228.A OD1 no hydrogen 2.807 N/A ALA 191.A N SER 189.A OG no hydrogen 3.042 N/A TYR 192.A N SER 189.A O no hydrogen 3.020 N/A ILE 193.A N GLU 184.A O no hydrogen 2.956 N/A GLU 197.A N PRO 194.A O no hydrogen 3.074 N/A TYR 201.A OH THR 182.A O no hydrogen 3.354 N/A TYR 202.A N ASN 244.A OD1 no hydrogen 2.902 N/A LEU 203.A N THR 168.A O no hydrogen 3.120 N/A GLY 204.A N ASP 240.A OD2 no hydrogen 2.887 N/A PHE 207.A N CYS 146.A O no hydrogen 3.071 N/A GLY 208.A N PHE 166.A O no hydrogen 3.164 N/A GLY 209.A N LEU 144.A O no hydrogen 3.007 N/A SER 210.A N PRO 164.A O no hydrogen 2.892 N/A VAL 211.A N ASP 142.A O no hydrogen 3.468 N/A GLU 213.A N SER 210.A OG no hydrogen 3.066 N/A VAL 214.A N SER 210.A O no hydrogen 2.932 N/A GLN 215.A N VAL 211.A O no hydrogen 2.870 N/A ARG 216.A N GLN 212.A O no hydrogen 3.065 N/A ARG 216.A NH2 GLU 213.A OE2 no hydrogen 2.788 N/A LEU 217.A N GLU 213.A O no hydrogen 2.916 N/A THR 218.A N VAL 214.A O no hydrogen 2.931 N/A THR 218.A OG1 VAL 214.A O no hydrogen 2.844 N/A THR 218.A OG1 GLN 215.A O no hydrogen 3.190 N/A ARG 219.A N GLN 215.A O no hydrogen 2.839 N/A ARG 219.A NH1 GLU 134.A OE1 no hydrogen 3.154 N/A ALA 220.A N ARG 216.A O no hydrogen 2.917 N/A CYS 221.A N LEU 217.A O no hydrogen 2.896 N/A CYS 221.A SG LEU 217.A O no hydrogen 3.328 N/A HIS 222.A N THR 218.A O no hydrogen 2.857 N/A GLN 223.A N ARG 219.A O no hydrogen 3.048 N/A ALA 224.A N ALA 220.A O no hydrogen 3.006 N/A MET 225.A N CYS 221.A O no hydrogen 2.887 N/A MET 226.A N HIS 222.A O no hydrogen 2.992 N/A VAL 227.A N GLN 223.A O no hydrogen 2.980 N/A ASP 228.A N ALA 224.A O no hydrogen 3.022 N/A GLN 229.A N MET 225.A O no hydrogen 2.936 N/A ALA 230.A N MET 226.A O no hydrogen 2.986 N/A ASN 231.A N VAL 227.A O no hydrogen 3.020 N/A GLY 232.A N GLN 229.A O no hydrogen 3.052 N/A ILE 233.A N ASP 228.A O no hydrogen 2.890 N/A VAL 236.A N GLU 184.A OE2 no hydrogen 2.744 N/A TRP 237.A N SER 241.A OG no hydrogen 3.070 N/A HIS 238.A N ALA 235.A O no hydrogen 2.960 N/A HIS 238.A ND1 ALA 235.A O no hydrogen 3.207 N/A ASP 240.A N TRP 237.A O no hydrogen 3.024 N/A SER 241.A N HIS 238.A O no hydrogen 3.203 N/A LEU 243.A N ASP 239.A O no hydrogen 2.845 N/A ASN 244.A N ASP 240.A O no hydrogen 3.050 N/A ASN 244.A ND2 TYR 202.A O no hydrogen 2.830 N/A ASN 244.A ND2 ASP 240.A O no hydrogen 2.709 N/A LYS 245.A N SER 241.A O no hydrogen 3.078 N/A LYS 245.A NZ GLN 190.A O no hydrogen 2.938 N/A LYS 245.A NZ TYR 192.A O no hydrogen 2.803 N/A TYR 246.A N HIS 242.A O no hydrogen 2.973 N/A LEU 247.A N LEU 243.A O no hydrogen 2.966 N/A LEU 248.A N ASN 244.A O no hydrogen 2.906 N/A ARG 249.A N LYS 245.A O no hydrogen 3.177 N/A HIS 250.A N TYR 246.A O no hydrogen 2.843 N/A HIS 250.A ND1 TYR 246.A O no hydrogen 2.992 N/A LYS 251.A NZ ASP 199.A OD2 no hydrogen 2.695 N/A LYS 251.A NZ LEU 248.A O no hydrogen 2.886 N/A THR 253.A N LEU 165.A O no hydrogen 2.712 N/A THR 253.A OG1 THR 163.A OG1 no hydrogen 2.636 N/A THR 253.A OG1 LEU 165.A O no hydrogen 3.102 N/A LYS 254.A N LEU 165.A O no hydrogen 3.360 N/A LYS 254.A NZ GLU 160.A O no hydrogen 2.793 N/A LYS 254.A NZ LEU 162.A O no hydrogen 2.821 N/A VAL 255.A N PRO 31.A O no hydrogen 2.938 N/A LEU 256.A N GLY 167.A O no hydrogen 2.811 N/A SER 257.A N VAL 33.A O no hydrogen 3.176 N/A SER 257.A OG VAL 33.A O no hydrogen 2.788 N/A TYR 260.A N SER 257.A O no hydrogen 3.006 N/A TYR 260.A OH GLU 160.A OE1 no hydrogen 2.622 N/A LEU 261.A N PRO 258.A O no hydrogen 3.087 N/A TRP 262.A N PHE 278.A O no hydrogen 2.906 N/A TRP 262.A NE1 GLY 268.A O no hydrogen 2.766 N/A LEU 266.A N ASP 263.A OD1 no hydrogen 3.007 N/A LEU 267.A N ASP 263.A O no hydrogen 2.852 N/A GLY 268.A N GLN 264.A O no hydrogen 2.832 N/A TRP 269.A NE1 LEU 273.A O no hydrogen 2.707 N/A LEU 273.A N PRO 270.A O no hydrogen 3.005 N/A ARG 277.A N GLU 259.A O no hydrogen 2.841 N/A ARG 277.A NE GLU 259.A OE2 no hydrogen 2.796 N/A ARG 277.A NH1 HIS 156.A O no hydrogen 2.885 N/A ARG 277.A NH2 GLU 35.A OE2 no hydrogen 2.947 N/A ARG 277.A NH2 GLU 259.A OE2 no hydrogen 2.830 N/A THR 279.A N GLU 152.A O no hydrogen 2.877 N/A ALA 280.A N TRP 262.A O no hydrogen 2.879 N/A VAL 281.A N ASP 150.A O no hydrogen 3.405 N/A