Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4rl3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A N PRO 242.A O no hydrogen 3.298 N/A VAL 2.A N PRO 242.A O no hydrogen 3.173 N/A PHE 3.A N THR 26.A O no hydrogen 2.860 N/A ARG 4.A N ILE 244.A O no hydrogen 3.047 N/A ARG 4.A NE HIS 28.A ND1 no hydrogen 2.924 N/A ARG 4.A NH1 SER 154.A OG no hydrogen 2.925 N/A ARG 4.A NH1 ASN 180.A OD1 no hydrogen 2.920 N/A ARG 4.A NH2 HIS 28.A ND1 no hydrogen 3.349 N/A GLU 5.A N HIS 28.A O no hydrogen 2.845 N/A TYR 6.A N ILE 246.A O no hydrogen 3.194 N/A TYR 6.A OH ASP 119.A OD2 no hydrogen 2.670 N/A ILE 7.A N ILE 30.A O no hydrogen 2.871 N/A GLY 8.A N ASP 250.A OD1 no hydrogen 2.870 N/A GLY 8.A N ASP 250.A OD2 no hydrogen 3.228 N/A LEU 10.A N ASP 250.A OD2 no hydrogen 3.067 N/A ASN 12.A ND2 ASP 250.A O no hydrogen 3.044 N/A GLY 13.A N GLN 53.A OE1 no hydrogen 2.917 N/A VAL 14.A N ASN 12.A OD1 no hydrogen 3.190 N/A GLN 15.A N ASP 18.A OD2 no hydrogen 2.907 N/A ASP 18.A N GLN 15.A O no hydrogen 3.081 N/A VAL 19.A N PHE 16.A O no hydrogen 3.054 N/A ASN 22.A N GLN 266.A OE1 no hydrogen 2.887 N/A GLY 24.A N ASN 22.A OD1 no hydrogen 2.807 N/A VAL 25.A N ASN 22.A O no hydrogen 3.516 N/A THR 26.A N LYS 1.A O no hydrogen 2.893 N/A PHE 27.A N ASN 71.A O no hydrogen 2.995 N/A HIS 28.A N PHE 3.A O no hydrogen 2.856 N/A PHE 29.A N LYS 73.A O no hydrogen 2.952 N/A ILE 30.A N GLU 5.A O no hydrogen 2.816 N/A LEU 31.A N MET 75.A O no hydrogen 2.857 N/A ALA 32.A N ILE 7.A O no hydrogen 2.906 N/A PHE 33.A N TYR 51.A O no hydrogen 3.228 N/A ALA 34.A N SER 77.A O no hydrogen 2.866 N/A ILE 35.A N ASN 49.A O no hydrogen 2.931 N/A ASP 36.A N ASP 36.A OD1 no hydrogen 2.690 N/A TYR 37.A OH GLN 89.A O no hydrogen 2.612 N/A THR 38.A N ALA 42.A O no hydrogen 2.749 N/A THR 38.A OG1 ALA 42.A O no hydrogen 3.500 N/A ALA 41.A N THR 38.A O no hydrogen 2.787 N/A ALA 42.A N THR 38.A OG1 no hydrogen 3.176 N/A THR 44.A N ASP 36.A O no hydrogen 2.885 N/A THR 44.A OG1 VAL 47.A O no hydrogen 2.616 N/A ASN 45.A ND2 SER 97.A OG no hydrogen 2.932 N/A PHE 48.A N SER 105.A OG no hydrogen 2.986 N/A ASN 49.A N ILE 35.A O no hydrogen 2.852 N/A ASN 49.A ND2 TYR 37.A O no hydrogen 2.979 N/A TYR 51.A N PHE 33.A O no hydrogen 2.798 N/A TYR 51.A OH TYR 37.A O no hydrogen 2.669 N/A TRP 52.A NE1 LEU 57.A O no hydrogen 3.153 N/A GLN 53.A N GLY 8.A O no hydrogen 2.965 N/A ASN 54.A N TRP 52.A O no hydrogen 2.744 N/A ASN 54.A ND2 TYR 113.A OH no hydrogen 3.146 N/A VAL 56.A N GLN 53.A O no hydrogen 3.082 N/A LEU 57.A N GLN 53.A O no hydrogen 2.829 N/A ALA 61.A N THR 58.A OG1 no hydrogen 2.963 N/A VAL 62.A N THR 58.A O no hydrogen 3.070 N/A GLN 63.A N PRO 59.A O no hydrogen 2.970 N/A ALA 64.A N ALA 60.A O no hydrogen 2.928 N/A ILE 65.A N ALA 61.A O no hydrogen 3.088 N/A LYS 66.A N VAL 62.A O no hydrogen 3.122 N/A LYS 66.A NZ HIS 114.A O no hydrogen 2.802 N/A LYS 66.A NZ ASP 116.A OD1 no hydrogen 3.319 N/A LYS 66.A NZ ASP 116.A OD2 no hydrogen 2.812 N/A ALA 67.A N GLN 63.A O no hydrogen 2.859 N/A GLN 68.A N ALA 64.A O no hydrogen 3.015 N/A GLN 68.A NE2 ALA 64.A O no hydrogen 3.542 N/A HIS 69.A N ILE 65.A O no hydrogen 3.072 N/A ASN 71.A ND2 ASN 22.A O no hydrogen 2.927 N/A ASN 71.A ND2 VAL 25.A O no hydrogen 2.820 N/A VAL 72.A N HIS 69.A O no hydrogen 3.000 N/A LYS 73.A N PHE 27.A O no hydrogen 2.888 N/A LYS 73.A NZ SER 151.A OG no hydrogen 2.921 N/A VAL 74.A N ASP 116.A OD2 no hydrogen 2.953 N/A MET 75.A N PHE 29.A O no hydrogen 2.780 N/A VAL 76.A N GLY 117.A O no hydrogen 3.012 N/A SER 77.A N LEU 31.A O no hydrogen 2.753 N/A SER 77.A OG ASP 119.A OD2 no hydrogen 2.815 N/A LEU 78.A N ASP 119.A O no hydrogen 2.791 N/A GLY 79.A N ALA 34.A O no hydrogen 2.981 N/A GLY 80.A N ASP 121.A O no hydrogen 2.935 N/A ILE 83.A N SER 86.A O no hydrogen 2.696 N/A SER 84.A OG SER 39.A O no hydrogen 2.692 N/A SER 86.A N ILE 83.A O no hydrogen 2.899 N/A VAL 88.A N ASP 81.A O no hydrogen 2.890 N/A GLN 89.A NE2 ASP 126.A OD2 no hydrogen 2.883 N/A PHE 90.A N HIS 124.A O no hydrogen 3.017 N/A THR 93.A N ASN 45.A OD1 no hydrogen 2.846 N/A SER 94.A OG SER 97.A OG no hydrogen 2.674 N/A SER 97.A N SER 94.A OG no hydrogen 3.084 N/A SER 97.A OG SER 94.A O no hydrogen 3.303 N/A SER 97.A OG SER 94.A OG no hydrogen 2.674 N/A TRP 98.A N SER 94.A O no hydrogen 3.007 N/A TRP 98.A NE1 ASP 36.A OD2 no hydrogen 2.847 N/A VAL 99.A N VAL 95.A O no hydrogen 2.943 N/A ALA 100.A N SER 96.A O no hydrogen 3.007 N/A ASN 101.A N SER 97.A O no hydrogen 3.054 N/A ASN 101.A ND2 ASN 45.A O no hydrogen 3.013 N/A ALA 102.A N TRP 98.A O no hydrogen 2.774 N/A VAL 103.A N VAL 99.A O no hydrogen 2.891 N/A SER 104.A N ALA 100.A O no hydrogen 3.203 N/A SER 104.A OG ALA 100.A O no hydrogen 2.766 N/A SER 104.A OG ASN 101.A O no hydrogen 3.221 N/A SER 105.A N ASN 101.A O no hydrogen 2.888 N/A SER 105.A OG GLY 46.A O no hydrogen 3.152 N/A SER 105.A OG ASN 101.A O no hydrogen 2.724 N/A LEU 106.A N ALA 102.A O no hydrogen 2.943 N/A THR 107.A N VAL 103.A O no hydrogen 2.926 N/A THR 107.A OG1 VAL 103.A O no hydrogen 2.664 N/A SER 108.A N SER 104.A O no hydrogen 2.995 N/A SER 108.A OG SER 104.A O no hydrogen 3.141 N/A LEU 109.A N SER 105.A O no hydrogen 3.043 N/A ILE 110.A N LEU 106.A O no hydrogen 2.789 N/A ASN 111.A N THR 107.A O no hydrogen 2.955 N/A GLN 112.A N SER 108.A O no hydrogen 2.930 N/A TYR 113.A N LEU 109.A O no hydrogen 2.924 N/A LEU 115.A N ILE 110.A O no hydrogen 2.920 N/A ASP 116.A N VAL 74.A O no hydrogen 2.797 N/A ILE 118.A N VAL 152.A O no hydrogen 3.213 N/A ASP 119.A N VAL 76.A O no hydrogen 2.868 N/A ILE 120.A N SER 154.A O no hydrogen 2.840 N/A ASP 121.A N LEU 78.A O no hydrogen 2.915 N/A TYR 122.A OH ASP 36.A OD1 no hydrogen 2.694 N/A HIS 124.A NE2 ASP 81.A OD1 no hydrogen 2.854 N/A ASP 126.A N GLN 89.A OE1 no hydrogen 2.996 N/A SER 129.A OG SER 131.A OG.B no hydrogen 3.124 N/A SER 129.A OG THR 132.A OG1 no hydrogen 2.981 N/A SER 131.A OG.B SER 129.A OG no hydrogen 3.124 N/A THR 132.A N SER 129.A OG no hydrogen 3.084 N/A THR 132.A OG1 SER 129.A OG no hydrogen 2.981 N/A PHE 133.A N SER 129.A O no hydrogen 3.059 N/A VAL 134.A N THR 130.A O no hydrogen 2.903 N/A SER 135.A N SER 131.A O.A no hydrogen 2.988 N/A SER 135.A N SER 131.A O.B no hydrogen 2.994 N/A CYS 136.A N THR 132.A O no hydrogen 3.004 N/A CYS 136.A SG THR 132.A O no hydrogen 3.427 N/A ILE 137.A N PHE 133.A O no hydrogen 3.016 N/A GLY 138.A N VAL 134.A O no hydrogen 2.835 N/A GLN 139.A N SER 135.A O no hydrogen 3.047 N/A GLN 139.A NE2 SER 135.A O no hydrogen 3.427 N/A GLN 139.A NE2 SER 135.A OG no hydrogen 2.914 N/A LEU 140.A N CYS 136.A O no hydrogen 3.008 N/A ILE 141.A N ILE 137.A O no hydrogen 2.912 N/A THR 142.A N GLY 138.A O no hydrogen 2.943 N/A THR 142.A OG1 GLY 138.A O no hydrogen 2.747 N/A GLN 143.A N GLN 139.A O no hydrogen 2.886 N/A LEU 144.A N LEU 140.A O no hydrogen 3.001 N/A LYS 145.A N ILE 141.A O no hydrogen 2.969 N/A LYS 145.A NZ VAL 175.A O no hydrogen 2.877 N/A LYS 145.A NZ ASP 177.A OD2 no hydrogen 2.775 N/A ALA 146.A N THR 142.A O no hydrogen 2.900 N/A ASN 147.A N GLN 143.A O no hydrogen 2.840 N/A ASN 148.A N LYS 145.A O no hydrogen 3.009 N/A VAL 149.A N LEU 144.A O no hydrogen 2.930 N/A SER 151.A N ASP 116.A O no hydrogen 2.915 N/A SER 151.A OG ASP 116.A O no hydrogen 3.366 N/A VAL 152.A N ASP 116.A O no hydrogen 3.282 N/A ALA 153.A N ASP 177.A OD2 no hydrogen 2.847 N/A SER 154.A N ILE 118.A O no hydrogen 3.017 N/A SER 154.A OG ASP 119.A OD1 no hydrogen 2.656 N/A ILE 155.A N LEU 178.A O no hydrogen 3.189 N/A ALA 156.A N ILE 120.A O no hydrogen 2.883 N/A VAL 161.A N PHE 158.A O no hydrogen 3.099 N/A GLU 162.A N ASP 159.A O no hydrogen 3.032 N/A TYR 165.A N VAL 161.A O no hydrogen 3.109 N/A TYR 165.A OH TYR 122.A O no hydrogen 2.624 N/A THR 166.A N GLU 162.A O no hydrogen 2.887 N/A THR 166.A OG1 GLU 162.A O no hydrogen 2.637 N/A LEU 168.A N GLN 164.A O no hydrogen 3.088 N/A PHE 169.A N TYR 165.A O no hydrogen 2.809 N/A GLY 170.A N THR 166.A O no hydrogen 2.884 N/A GLN 171.A N ALA 167.A O no hydrogen 3.295 N/A GLN 171.A N LEU 168.A O no hydrogen 3.324 N/A TYR 172.A N LEU 168.A O no hydrogen 3.007 N/A VAL 175.A N TYR 172.A O no hydrogen 2.996 N/A ILE 176.A N SER 173.A O no hydrogen 3.250 N/A ASP 177.A N ALA 153.A O no hydrogen 2.827 N/A LEU 178.A N ALA 153.A O no hydrogen 3.296 N/A VAL 179.A N LYS 211.A O no hydrogen 2.795 N/A ASN 180.A N ILE 155.A O no hydrogen 2.702 N/A ASN 180.A ND2 TYR 6.A OH no hydrogen 2.909 N/A GLN 182.A N PRO 157.A O no hydrogen 2.905 N/A GLN 182.A NE2 ALA 156.A O no hydrogen 2.917 N/A PHE 183.A N SER 215.A OG no hydrogen 3.021 N/A SER 185.A N GLN 182.A O no hydrogen 3.171 N/A SER 185.A OG GLN 182.A O no hydrogen 2.692 N/A TYR 186.A N PHE 183.A O no hydrogen 3.150 N/A TYR 186.A OH ASP 159.A OD2 no hydrogen 2.619 N/A THR 190.A N GLY 187.A O no hydrogen 3.039 N/A THR 190.A OG1 GLY 187.A O no hydrogen 2.680 N/A SER 191.A N GLN 194.A OE1 no hydrogen 2.957 N/A SER 191.A OG SER 193.A OG.B no hydrogen 3.063 N/A SER 191.A OG GLN 194.A OE1 no hydrogen 3.398 N/A SER 193.A OG.B SER 191.A OG no hydrogen 3.063 N/A GLN 194.A N SER 191.A OG no hydrogen 3.064 N/A TYR 195.A N SER 191.A O no hydrogen 2.885 N/A TYR 195.A OH SER 215.A O no hydrogen 2.669 N/A VAL 196.A N ALA 192.A O no hydrogen 3.085 N/A SER 197.A N SER 193.A O.A no hydrogen 3.129 N/A SER 197.A N SER 193.A O.B no hydrogen 3.119 N/A SER 197.A OG SER 193.A O.A no hydrogen 3.401 N/A SER 197.A OG SER 193.A O.B no hydrogen 3.354 N/A LEU 198.A N GLN 194.A O no hydrogen 2.797 N/A TYR 199.A N TYR 195.A O no hydrogen 2.783 N/A TYR 199.A OH VAL 212.A O no hydrogen 2.657 N/A ASN 200.A N VAL 196.A O no hydrogen 2.975 N/A ASN 200.A ND2 VAL 196.A O no hydrogen 2.841 N/A THR 201.A N SER 197.A O no hydrogen 3.023 N/A THR 201.A OG1 SER 197.A O no hydrogen 3.321 N/A ALA 202.A N LEU 198.A O no hydrogen 2.993 N/A ALA 203.A N TYR 199.A O no hydrogen 2.788 N/A SER 204.A N ASN 200.A O no hydrogen 2.974 N/A SER 204.A OG THR 201.A O no hydrogen 2.625 N/A LYS 205.A N ALA 202.A O no hydrogen 3.019 N/A LYS 205.A NZ GLU 162.A OE1 no hydrogen 2.816 N/A TYR 206.A N ALA 203.A O no hydrogen 3.107 N/A GLY 208.A N ALA 203.A O no hydrogen 2.810 N/A LYS 211.A NZ ILE 176.A O no hydrogen 2.933 N/A VAL 212.A N GLY 209.A O no hydrogen 2.994 N/A LEU 213.A N VAL 179.A O no hydrogen 2.983 N/A ALA 214.A N GLY 243.A O no hydrogen 3.086 N/A SER 215.A N TYR 195.A OH no hydrogen 2.955 N/A SER 215.A OG PHE 181.A O no hydrogen 2.732 N/A PHE 216.A N PHE 245.A O no hydrogen 3.414 N/A SER 217.A OG PHE 247.A O no hydrogen 3.367 N/A THR 218.A N PHE 247.A O no hydrogen 3.056 N/A THR 218.A OG1 SER 248.A O no hydrogen 3.029 N/A THR 218.A OG1 SER 252.A OG no hydrogen 2.726 N/A GLY 219.A N SER 217.A OG no hydrogen 2.823 N/A VAL 228.A N ALA 224.A O no hydrogen 2.904 N/A LEU 229.A N PRO 225.A O no hydrogen 2.841 N/A SER 230.A N SER 226.A O no hydrogen 3.113 N/A SER 230.A OG SER 226.A O no hydrogen 3.257 N/A ALA 231.A N THR 227.A O no hydrogen 3.052 N/A CYS 232.A N VAL 228.A O no hydrogen 2.803 N/A CYS 232.A SG VAL 228.A O no hydrogen 3.366 N/A GLN 233.A N LEU 229.A O no hydrogen 3.040 N/A GLN 233.A NE2 SER 237.A OG no hydrogen 3.143 N/A GLN 234.A N SER 230.A O no hydrogen 3.430 N/A LEU 235.A N ALA 231.A O no hydrogen 3.126 N/A LYS 236.A N CYS 232.A O no hydrogen 2.895 N/A LYS 236.A NZ SER 271.A O no hydrogen 3.147 N/A SER 237.A N GLN 233.A O no hydrogen 2.897 N/A SER 237.A OG GLN 233.A O no hydrogen 3.181 N/A SER 238.A N GLN 234.A O no hydrogen 3.109 N/A SER 238.A OG GLN 234.A O no hydrogen 3.165 N/A GLY 239.A N LYS 236.A O no hydrogen 2.930 N/A THR 240.A N LEU 235.A O no hydrogen 3.008 N/A THR 240.A OG1 LEU 235.A O no hydrogen 3.385 N/A ILE 244.A N VAL 2.A O no hydrogen 2.962 N/A PHE 245.A N ALA 214.A O no hydrogen 2.866 N/A ILE 246.A N ARG 4.A O no hydrogen 2.973 N/A PHE 247.A N PHE 216.A O no hydrogen 3.245 N/A SER 248.A N THR 218.A OG1 no hydrogen 3.261 N/A ALA 249.A N TYR 6.A O no hydrogen 2.780 N/A GLY 251.A N SER 248.A OG no hydrogen 3.114 N/A SER 252.A N SER 248.A O no hydrogen 2.956 N/A SER 252.A OG THR 218.A OG1 no hydrogen 2.726 N/A SER 252.A OG SER 248.A O no hydrogen 3.257 N/A SER 252.A OG GLU 262.A OE1 no hydrogen 2.684 N/A SER 252.A OG GLU 262.A OE2 no hydrogen 3.401 N/A TYR 253.A N ALA 249.A O no hydrogen 2.829 N/A ALA 254.A N ASP 250.A O no hydrogen 3.138 N/A SER 255.A N SER 252.A O no hydrogen 3.032 N/A SER 255.A OG SER 252.A O no hydrogen 2.806 N/A LYS 258.A N SER 255.A O no hydrogen 3.303 N/A LYS 258.A NZ TYR 253.A O no hydrogen 2.807 N/A GLN 260.A N ALA 257.A O no hydrogen 3.514 N/A GLN 260.A NE2 ALA 257.A O no hydrogen 2.917 N/A GLU 262.A N GLU 262.A OE2 no hydrogen 2.799 N/A GLN 263.A N PHE 259.A O no hydrogen 3.332 N/A GLN 264.A N GLN 260.A O no hydrogen 3.003 N/A GLN 264.A NE2 GLN 260.A O no hydrogen 3.665 N/A ALA 265.A N TYR 261.A O no hydrogen 2.857 N/A GLN 266.A N GLU 262.A O no hydrogen 3.221 N/A GLN 266.A NE2 PRO 20.A O no hydrogen 2.852 N/A GLN 266.A NE2 GLU 262.A O no hydrogen 3.079 N/A THR 267.A N GLN 263.A O no hydrogen 2.876 N/A THR 267.A OG1 GLN 263.A O no hydrogen 3.254 N/A THR 267.A OG1 GLN 263.A OE1 no hydrogen 2.959 N/A LEU 268.A N GLN 264.A O no hydrogen 2.904 N/A LEU 269.A N ALA 265.A O no hydrogen 3.123 N/A THR 270.A N GLN 266.A O no hydrogen 3.110 N/A THR 270.A N THR 267.A O no hydrogen 3.217 N/A THR 270.A OG1 GLN 266.A O no hydrogen 2.973 N/A THR 270.A OG1 THR 267.A O no hydrogen 3.286 N/A SER 271.A OG LEU 268.A O no hydrogen 3.333 N/A