Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4xmo_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 7.A N ASP 4.A O no hydrogen 3.063 N/A LEU 8.A N LEU 5.A O no hydrogen 3.271 N/A GLU 11.A N ASN 9.A OD1 no hydrogen 3.109 N/A LEU 12.A N ASN 9.A O no hydrogen 2.846 N/A VAL 13.A N PRO 10.A O no hydrogen 3.502 N/A ALA 15.A N LEU 12.A O no hydrogen 2.970 N/A VAL 16.A N VAL 13.A O no hydrogen 3.266 N/A GLN 17.A NE2 GLN 14.A O no hydrogen 2.985 N/A HIS 18.A N ALA 15.A O no hydrogen 3.097 N/A VAL 19.A N VAL 16.A O no hydrogen 3.055 N/A VAL 20.A N VAL 16.A O no hydrogen 3.009 N/A ILE 21.A N ILE 89.A O no hydrogen 2.754 N/A SER 25.A N GLY 22.A O no hydrogen 2.760 N/A LEU 26.A N PRO 23.A O no hydrogen 3.418 N/A ILE 27.A N THR 46.A O no hydrogen 2.989 N/A HIS 29.A N HIS 44.A O no hydrogen 2.919 N/A ILE 34.A N VAL 42.A O no hydrogen 2.879 N/A GLY 35.A N VAL 42.A O no hydrogen 3.384 N/A GLY 37.A N GLY 40.A O no hydrogen 2.890 N/A HIS 38.A N MET 173.A O no hydrogen 3.297 N/A PHE 39.A N ASP 172.A OD1 no hydrogen 3.147 N/A PHE 39.A N ASP 172.A OD2 no hydrogen 2.968 N/A GLY 40.A N GLY 37.A O no hydrogen 3.341 N/A VAL 42.A N GLY 35.A O no hydrogen 2.792 N/A TYR 43.A N VAL 53.A O no hydrogen 2.795 N/A HIS 44.A ND1 HIS 50.A NE2 no hydrogen 2.687 N/A GLY 45.A N CYS 51.A O no hydrogen 2.953 N/A THR 46.A N ILE 27.A O no hydrogen 2.762 N/A LEU 47.A N ILE 49.A O no hydrogen 2.846 N/A ILE 49.A N LEU 47.A O no hydrogen 2.934 N/A HIS 50.A NE2 HIS 44.A ND1 no hydrogen 2.687 N/A CYS 51.A N GLY 45.A O no hydrogen 2.851 N/A ALA 52.A N LEU 101.A O no hydrogen 2.755 N/A VAL 53.A N TYR 43.A O no hydrogen 2.808 N/A LYS 54.A N VAL 99.A O no hydrogen 2.825 N/A LYS 54.A NZ ASP 172.A OD2 no hydrogen 2.471 N/A LYS 54.A NZ TYR 174.A OH no hydrogen 2.996 N/A SER 55.A N CYS 41.A O no hydrogen 2.826 N/A ASN 57.A N SER 55.A OG no hydrogen 3.398 N/A ARG 58.A N PHE 39.A O no hydrogen 3.147 N/A ARG 58.A NH1 HIS 38.A O no hydrogen 2.907 N/A ILE 59.A N LEU 56.A O no hydrogen 3.275 N/A GLN 67.A NE2 GLU 71.A OE1 no hydrogen 3.079 N/A PHE 68.A N GLU 64.A O no hydrogen 3.043 N/A LEU 69.A N VAL 65.A O no hydrogen 3.028 N/A THR 70.A N SER 66.A O no hydrogen 3.031 N/A THR 70.A OG1 SER 66.A O no hydrogen 2.666 N/A GLU 71.A N GLN 67.A O no hydrogen 2.796 N/A GLY 72.A N PHE 68.A O no hydrogen 3.006 N/A ILE 73.A N LEU 69.A O no hydrogen 2.791 N/A ILE 74.A N THR 70.A O no hydrogen 2.956 N/A MET 75.A N GLU 71.A O no hydrogen 2.938 N/A LYS 76.A N GLY 72.A O no hydrogen 2.874 N/A LYS 76.A NZ HIS 18.A O no hydrogen 2.882 N/A ASP 77.A N ILE 73.A O no hydrogen 3.400 N/A PHE 78.A N MET 75.A O no hydrogen 3.194 N/A SER 79.A N TYR 138.A OH no hydrogen 2.967 N/A ASN 82.A N HIS 80.A ND1 no hydrogen 3.011 N/A ASN 82.A ND2 VAL 162.A O no hydrogen 2.960 N/A VAL 83.A N HIS 80.A O no hydrogen 3.047 N/A LEU 84.A N VAL 164.A O no hydrogen 2.770 N/A LEU 87.A N VAL 100.A O no hydrogen 2.896 N/A GLY 88.A N VAL 100.A O no hydrogen 3.333 N/A ILE 89.A N VAL 19.A O no hydrogen 2.856 N/A CYS 90.A N LEU 98.A O no hydrogen 2.925 N/A CYS 90.A SG ILE 21.A O no hydrogen 3.464 N/A CYS 90.A SG LEU 91.A O no hydrogen 3.848 N/A ARG 92.A NE SER 96.A O no hydrogen 2.700 N/A ARG 92.A NH2 SER 96.A O no hydrogen 3.547 N/A SER 93.A OG GLU 94.A OE1 no hydrogen 2.870 N/A LEU 98.A N CYS 90.A O no hydrogen 2.815 N/A VAL 99.A N LYS 54.A O no hydrogen 2.955 N/A VAL 100.A N GLY 88.A O no hydrogen 2.868 N/A LEU 101.A N ALA 52.A O no hydrogen 2.877 N/A HIS 106.A N LEU 156.A O no hydrogen 3.098 N/A GLY 107.A N MET 104.A O no hydrogen 3.126 N/A LEU 109.A N CYS 154.A O no hydrogen 2.754 N/A ARG 110.A N ALA 151.A O no hydrogen 3.187 N/A ARG 110.A NE GLY 224.A O no hydrogen 3.158 N/A ARG 110.A NH2 GLY 224.A O no hydrogen 3.001 N/A ASN 111.A N ASP 108.A OD2 no hydrogen 2.971 N/A ASN 111.A ND2 ASP 108.A OD1 no hydrogen 2.782 N/A PHE 112.A N ASP 108.A O no hydrogen 2.999 N/A ILE 113.A N LEU 109.A O no hydrogen 3.007 N/A ARG 114.A N ARG 110.A O no hydrogen 3.080 N/A ARG 114.A NH2 GLY 224.A O no hydrogen 2.878 N/A ASN 115.A N PHE 112.A O no hydrogen 3.303 N/A THR 117.A N ASN 115.A OD1 no hydrogen 2.560 N/A THR 117.A OG1 ASN 115.A OD1 no hydrogen 3.210 N/A THR 121.A N ASP 124.A OD2 no hydrogen 2.813 N/A LYS 123.A NZ PHE 285.A O no hydrogen 2.961 N/A LYS 123.A NZ PHE 288.A O no hydrogen 3.112 N/A ASP 124.A N THR 121.A OG1 no hydrogen 2.982 N/A LEU 125.A N THR 121.A O no hydrogen 2.943 N/A ILE 126.A N VAL 122.A O no hydrogen 2.970 N/A GLY 127.A N LYS 123.A O no hydrogen 2.918 N/A PHE 128.A N ASP 124.A O no hydrogen 2.872 N/A GLY 129.A N LEU 125.A O no hydrogen 3.120 N/A LEU 130.A N ILE 126.A O no hydrogen 2.817 N/A GLN 131.A N GLY 127.A O no hydrogen 2.926 N/A GLN 131.A NE2 GLY 127.A O no hydrogen 3.434 N/A VAL 132.A N PHE 128.A O no hydrogen 3.065 N/A ALA 133.A N GLY 129.A O no hydrogen 2.997 N/A LYS 134.A N LEU 130.A O no hydrogen 3.019 N/A GLY 135.A N GLN 131.A O no hydrogen 3.038 N/A MET 136.A N VAL 132.A O no hydrogen 2.884 N/A LYS 137.A N ALA 133.A O no hydrogen 2.829 N/A TYR 138.A N LYS 134.A O no hydrogen 3.092 N/A LEU 139.A N GLY 135.A O no hydrogen 2.940 N/A ALA 140.A N MET 136.A O no hydrogen 2.829 N/A SER 141.A N LYS 137.A O no hydrogen 2.986 N/A SER 141.A OG TYR 138.A O no hydrogen 2.652 N/A LYS 142.A N TYR 138.A O no hydrogen 3.195 N/A LYS 142.A N LEU 139.A O no hydrogen 3.113 N/A LYS 143.A N ALA 140.A O no hydrogen 2.874 N/A PHE 144.A N LEU 139.A O no hydrogen 2.969 N/A HIS 146.A N ASP 209.A OD2 no hydrogen 2.895 N/A HIS 146.A NE2 ALA 165.A O no hydrogen 2.769 N/A ARG 147.A N ASP 209.A OD1 no hydrogen 3.045 N/A ASP 148.A N HIS 146.A ND1 no hydrogen 3.042 N/A ALA 151.A N GLU 219.A OE1 no hydrogen 2.963 N/A ARG 152.A NE TYR 179.A OH no hydrogen 2.985 N/A ARG 152.A NH1 ASP 148.A OD1 no hydrogen 3.090 N/A ARG 152.A NH1 TYR 179.A OH no hydrogen 3.316 N/A ASN 153.A N ALA 150.A O no hydrogen 3.012 N/A ASN 153.A ND2 ASP 148.A O no hydrogen 2.695 N/A ASN 153.A ND2 TYR 179.A OH no hydrogen 3.523 N/A CYS 154.A N ALA 151.A O no hydrogen 3.398 N/A CYS 154.A SG ALA 150.A O no hydrogen 3.710 N/A MET 155.A N LYS 163.A O no hydrogen 2.918 N/A LEU 156.A N GLY 107.A O no hydrogen 2.882 N/A ASP 157.A N THR 161.A O no hydrogen 3.090 N/A GLU 158.A N GLU 158.A OE1 no hydrogen 2.780 N/A LYS 159.A N ASP 157.A OD1 no hydrogen 2.912 N/A PHE 160.A N ASP 157.A O no hydrogen 2.887 N/A THR 161.A N ASP 157.A OD1 no hydrogen 3.026 N/A THR 161.A OG1 ASP 157.A OD1 no hydrogen 3.526 N/A VAL 162.A N GLN 131.A OE1 no hydrogen 2.797 N/A LYS 163.A N MET 155.A O no hydrogen 2.768 N/A LYS 163.A NZ PRO 81.A O no hydrogen 2.801 N/A VAL 164.A N ASN 82.A O no hydrogen 2.769 N/A ALA 165.A N ASN 153.A O no hydrogen 3.018 N/A ALA 170.A N PHE 167.A O no hydrogen 3.054 N/A ARG 171.A N GLY 168.A O no hydrogen 3.152 N/A ARG 171.A NE ASP 166.A O no hydrogen 2.903 N/A ARG 171.A NH1 HIS 146.A O no hydrogen 2.614 N/A ARG 171.A NH1 ASP 166.A O no hydrogen 2.893 N/A ARG 171.A NH2 HIS 146.A O no hydrogen 3.220 N/A ASP 172.A N ASP 166.A OD1 no hydrogen 2.857 N/A MET 173.A N ASP 172.A OD1 no hydrogen 2.780 N/A TYR 174.A OH ALA 170.A O no hydrogen 2.589 N/A LYS 176.A NZ HIS 38.A ND1 no hydrogen 3.158 N/A GLU 177.A N ASP 175.A OD1 no hydrogen 3.325 N/A TYR 178.A N ASP 175.A O no hydrogen 3.307 N/A TYR 179.A N LYS 176.A O no hydrogen 3.281 N/A TYR 179.A OH ASP 148.A OD1 no hydrogen 3.325 N/A TYR 179.A OH ASP 148.A OD2 no hydrogen 2.528 N/A SER 180.A N LEU 189.A O no hydrogen 2.933 N/A HIS 182.A N ALA 187.A O no hydrogen 2.819 N/A LYS 184.A N HIS 182.A ND1 no hydrogen 3.256 N/A THR 185.A N HIS 182.A ND1 no hydrogen 3.328 N/A GLY 186.A N HIS 182.A O no hydrogen 2.824 N/A ALA 187.A N THR 185.A OG1 no hydrogen 3.358 N/A LEU 189.A N SER 180.A O no hydrogen 2.784 N/A VAL 191.A N LEU 189.A O no hydrogen 2.896 N/A LYS 192.A NZ TYR 228.A O no hydrogen 2.608 N/A LYS 192.A NZ VAL 231.A O no hydrogen 2.933 N/A TRP 193.A N PRO 190.A O no hydrogen 2.898 N/A TRP 193.A NE1 GLU 219.A OE1 no hydrogen 2.873 N/A MET 194.A N VAL 191.A O no hydrogen 3.194 N/A GLU 197.A N GLU 197.A OE2 no hydrogen 2.797 N/A SER 198.A OG LYS 203.A O no hydrogen 2.737 N/A LEU 199.A N ALA 195.A O no hydrogen 2.986 N/A GLN 200.A N LEU 196.A O no hydrogen 3.193 N/A THR 201.A N GLU 197.A O no hydrogen 2.811 N/A THR 201.A OG1 GLU 197.A O no hydrogen 2.904 N/A GLN 202.A N SER 198.A O no hydrogen 2.703 N/A GLN 202.A NE2 THR 185.A OG1 no hydrogen 2.586 N/A LYS 203.A N THR 201.A OG1 no hydrogen 3.047 N/A THR 205.A N SER 208.A OG no hydrogen 2.679 N/A LYS 207.A NZ ARG 271.A O no hydrogen 2.748 N/A SER 208.A N THR 205.A OG1 no hydrogen 3.034 N/A SER 208.A OG THR 205.A O no hydrogen 2.806 N/A ASP 209.A N THR 205.A O no hydrogen 2.958 N/A VAL 210.A N THR 206.A O no hydrogen 2.946 N/A TRP 211.A N LYS 207.A O no hydrogen 3.271 N/A SER 212.A N SER 208.A O no hydrogen 3.184 N/A SER 212.A OG TRP 193.A O no hydrogen 2.700 N/A SER 212.A OG SER 208.A O no hydrogen 3.398 N/A PHE 213.A N ASP 209.A O no hydrogen 2.866 N/A GLY 214.A N VAL 210.A O no hydrogen 3.058 N/A VAL 215.A N TRP 211.A O no hydrogen 3.215 N/A LEU 216.A N SER 212.A O no hydrogen 2.857 N/A LEU 217.A N PHE 213.A O no hydrogen 2.816 N/A TRP 218.A N GLY 214.A O no hydrogen 3.174 N/A TRP 218.A NE1 LEU 247.A O no hydrogen 2.744 N/A GLU 219.A N VAL 215.A O no hydrogen 2.896 N/A LEU 220.A N LEU 216.A O no hydrogen 2.947 N/A MET 221.A N LEU 217.A O no hydrogen 3.077 N/A THR 222.A N TRP 218.A O no hydrogen 3.067 N/A THR 222.A OG1 TRP 218.A O no hydrogen 3.007 N/A THR 222.A OG1 GLU 219.A O no hydrogen 3.146 N/A ARG 223.A N LEU 220.A O no hydrogen 3.142 N/A ARG 223.A NH1 PRO 120.A O no hydrogen 2.804 N/A ARG 223.A NH2 PRO 120.A O no hydrogen 2.749 N/A GLY 224.A N GLU 219.A O no hydrogen 2.734 N/A ALA 225.A N THR 222.A OG1 no hydrogen 3.207 N/A VAL 231.A N TYR 228.A O no hydrogen 3.228 N/A ASP 235.A N ASN 232.A O no hydrogen 2.905 N/A ILE 236.A N THR 233.A O no hydrogen 3.194 N/A THR 237.A N PHE 234.A O no hydrogen 3.472 N/A TYR 239.A N ASP 235.A O no hydrogen 3.037 N/A LEU 240.A N ILE 236.A O no hydrogen 2.860 N/A LEU 241.A N THR 237.A O no hydrogen 3.032 N/A GLN 242.A N VAL 238.A O no hydrogen 3.159 N/A GLN 242.A N TYR 239.A O no hydrogen 3.164 N/A GLY 243.A N LEU 240.A O no hydrogen 2.919 N/A ARG 244.A N LEU 240.A O no hydrogen 3.193 N/A ARG 244.A NE GLN 242.A OE1 no hydrogen 2.727 N/A ARG 244.A NH1 GLN 242.A OE1 no hydrogen 3.331 N/A ARG 245.A NE TRP 264.A O no hydrogen 3.318 N/A ARG 245.A NH1 ARG 244.A O no hydrogen 2.921 N/A ARG 245.A NH2 TRP 264.A O no hydrogen 2.854 N/A GLN 248.A NE2 CYS 252.A O no hydrogen 2.833 N/A GLN 248.A NE2 ASP 254.A OD1 no hydrogen 2.887 N/A CYS 252.A N PRO 249.A O no hydrogen 3.036 N/A CYS 252.A SG PRO 253.A O no hydrogen 3.436 N/A TYR 257.A N PRO 253.A O no hydrogen 3.024 N/A TYR 257.A OH LEU 246.A O no hydrogen 2.603 N/A GLU 258.A N ASP 254.A O no hydrogen 2.942 N/A VAL 259.A N PRO 255.A O no hydrogen 3.009 N/A MET 260.A N LEU 256.A O no hydrogen 3.012 N/A LEU 261.A N TYR 257.A O no hydrogen 2.929 N/A LYS 262.A N GLU 258.A O no hydrogen 3.052 N/A CYS 263.A N VAL 259.A O no hydrogen 2.937 N/A CYS 263.A SG VAL 259.A O no hydrogen 3.371 N/A TRP 264.A N MET 260.A O no hydrogen 3.155 N/A TRP 264.A N LEU 261.A O no hydrogen 3.179 N/A TRP 264.A NE1 TRP 211.A O no hydrogen 3.139 N/A HIS 265.A N LYS 262.A O no hydrogen 3.217 N/A LYS 267.A N HIS 265.A ND1 no hydrogen 2.993 N/A GLU 269.A N GLU 269.A OE1 no hydrogen 2.688 N/A MET 270.A N LYS 267.A O no hydrogen 2.882 N/A ARG 271.A N ALA 268.A O no hydrogen 3.104 N/A ARG 271.A NE HIS 265.A O no hydrogen 2.865 N/A ARG 271.A NH1 GLU 197.A OE1 no hydrogen 2.695 N/A ARG 271.A NH1 LYS 207.A O no hydrogen 3.102 N/A ARG 271.A NH2 GLU 197.A OE1 no hydrogen 3.455 N/A ARG 271.A NH2 GLU 197.A OE2 no hydrogen 2.834 N/A ARG 271.A NH2 HIS 265.A O no hydrogen 2.988 N/A GLU 276.A N SER 273.A OG no hydrogen 3.042 N/A LEU 277.A N SER 273.A O no hydrogen 2.953 N/A VAL 278.A N PHE 274.A O no hydrogen 2.921 N/A SER 279.A N SER 275.A O no hydrogen 3.103 N/A ARG 280.A N GLU 276.A O no hydrogen 2.893 N/A ARG 280.A NE GLU 276.A OE2 no hydrogen 2.785 N/A ARG 280.A NH1 GLU 276.A OE2 no hydrogen 3.295 N/A ILE 281.A N LEU 277.A O no hydrogen 2.930 N/A SER 282.A N VAL 278.A O no hydrogen 2.901 N/A SER 282.A OG VAL 278.A O no hydrogen 2.624 N/A ALA 283.A N SER 279.A O no hydrogen 3.202 N/A ILE 284.A N ARG 280.A O no hydrogen 3.155 N/A PHE 285.A N ILE 281.A O no hydrogen 2.812 N/A SER 286.A N SER 282.A O no hydrogen 3.036 N/A SER 286.A OG ALA 283.A O no hydrogen 2.642 N/A THR 287.A N ILE 284.A O no hydrogen 3.095 N/A THR 287.A OG1 ILE 284.A O no hydrogen 2.683 N/A PHE 288.A N PHE 285.A O no hydrogen 3.195 N/A