Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5c3a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 17.A N LYS 14.A O no hydrogen 3.064 N/A ARG 20.A NE ASP 22.A OD1 no hydrogen 2.933 N/A ARG 20.A NH1 ASP 22.A OD1 no hydrogen 3.462 N/A ARG 20.A NH1 ASP 22.A OD2 no hydrogen 2.896 N/A ARG 20.A NH1 VAL 271.A O no hydrogen 3.012 N/A ARG 20.A NH2 GLU 36.A O no hydrogen 2.890 N/A ASP 22.A N ASP 22.A OD1 no hydrogen 2.577 N/A THR 27.A N ALA 31.A O no hydrogen 2.803 N/A THR 27.A OG1 ALA 31.A O no hydrogen 3.560 N/A TRP 29.A N THR 27.A OG1 no hydrogen 3.251 N/A TRP 29.A NE1 PRO 251.A O no hydrogen 2.767 N/A LEU 30.A N THR 27.A O no hydrogen 2.881 N/A ALA 31.A N THR 27.A OG1 no hydrogen 3.021 N/A ILE 33.A N VAL 25.A O no hydrogen 2.869 N/A VAL 34.A N VAL 254.A O no hydrogen 2.846 N/A TRP 35.A NE1 LEU 24.A O no hydrogen 2.981 N/A GLU 36.A N GLU 258.A OE1 no hydrogen 2.764 N/A GLU 36.A N GLU 258.A OE2 no hydrogen 3.204 N/A THR 38.A N TRP 35.A O no hydrogen 3.120 N/A THR 38.A OG1 TRP 35.A O no hydrogen 2.712 N/A ASP 42.A N ASN 40.A OD1 no hydrogen 2.846 N/A ILE 43.A N ASN 40.A OD1 no hydrogen 3.177 N/A LEU 44.A N ASN 40.A O no hydrogen 3.225 N/A ASN 45.A N ILE 41.A O no hydrogen 2.760 N/A GLU 46.A N ASP 42.A O no hydrogen 3.121 N/A GLN 47.A N ILE 43.A O no hydrogen 2.967 N/A PHE 48.A N LEU 44.A O no hydrogen 3.015 N/A ARG 49.A N ASN 45.A O no hydrogen 2.802 N/A ARG 49.A NH2 ASN 52.A OD1 no hydrogen 3.018 N/A LEU 50.A N GLU 46.A O no hydrogen 2.910 N/A GLN 51.A N PHE 48.A O no hydrogen 3.247 N/A ASN 52.A N ARG 49.A O no hydrogen 2.912 N/A THR 53.A N PHE 48.A O no hydrogen 3.292 N/A THR 53.A OG1 PHE 48.A O no hydrogen 2.825 N/A THR 54.A N ASP 141.A OD2 no hydrogen 2.871 N/A ILE 55.A N ARG 85.A O no hydrogen 2.919 N/A GLY 56.A N TYR 142.A O no hydrogen 2.825 N/A LEU 57.A N HIS 87.A O no hydrogen 2.921 N/A THR 58.A N VAL 144.A O no hydrogen 2.825 N/A VAL 59.A N TYR 89.A O no hydrogen 3.032 N/A ALA 61.A N PHE 91.A O no hydrogen 2.816 N/A LYS 63.A N ASP 93.A OD1 no hydrogen 2.992 N/A LYS 63.A N ASP 93.A OD2 no hydrogen 3.351 N/A LYS 63.A NZ TYR 117.A O no hydrogen 3.201 N/A TYR 65.A N ILE 62.A O no hydrogen 3.205 N/A VAL 66.A N LYS 63.A O no hydrogen 3.406 N/A ALA 67.A N LYS 64.A O no hydrogen 3.219 N/A PHE 68.A N TYR 65.A O no hydrogen 3.047 N/A LEU 69.A N VAL 66.A O no hydrogen 3.183 N/A LYS 70.A NZ.A GLU 74.A OE2 no hydrogen 3.002 N/A LYS 70.A NZ.B GLU 74.A OE1 no hydrogen 2.706 N/A LYS 70.A NZ.B GLU 74.A OE2 no hydrogen 3.245 N/A PHE 72.A N PHE 68.A O no hydrogen 3.145 N/A LEU 73.A N LEU 69.A O no hydrogen 2.875 N/A GLU 74.A N LYS 70.A O no hydrogen 2.906 N/A THR 75.A N LEU 71.A O no hydrogen 2.979 N/A THR 75.A OG1 LEU 71.A O no hydrogen 2.753 N/A THR 75.A OG1 PHE 72.A O no hydrogen 3.223 N/A ALA 76.A N PHE 72.A O no hydrogen 2.882 N/A GLU 77.A N LEU 73.A O no hydrogen 2.976 N/A HIS 79.A N ALA 76.A O no hydrogen 3.243 N/A PHE 80.A N ALA 76.A O no hydrogen 2.845 N/A MET 81.A N VAL 156.A O no hydrogen 2.866 N/A HIS 84.A N MET 81.A O no hydrogen 2.985 N/A HIS 84.A NE2 ASN 45.A OD1 no hydrogen 2.837 N/A ARG 85.A NH1 THR 54.A OG1 no hydrogen 2.714 N/A VAL 86.A N GLY 106.A O no hydrogen 3.229 N/A HIS 87.A N ILE 55.A O no hydrogen 2.940 N/A HIS 87.A NE2 SER 110.A OG no hydrogen 2.748 N/A TYR 88.A N GLN 108.A O no hydrogen 2.808 N/A TYR 88.A OH GLU 77.A OE1 no hydrogen 2.600 N/A TYR 89.A N LEU 57.A O no hydrogen 2.818 N/A TYR 89.A OH GLU 139.A OE2 no hydrogen 2.680 N/A VAL 90.A N SER 110.A O no hydrogen 2.924 N/A PHE 91.A N VAL 59.A O no hydrogen 2.896 N/A THR 92.A N LEU 112.A O no hydrogen 2.954 N/A THR 92.A OG1 ALA 61.A O no hydrogen 2.675 N/A GLN 94.A N THR 92.A OG1 no hydrogen 2.979 N/A GLN 94.A NE2 LYS 63.A O no hydrogen 2.833 N/A GLN 94.A NE2 ASP 93.A OD1 no hydrogen 2.885 N/A ALA 97.A N GLN 94.A O no hydrogen 2.914 N/A VAL 98.A N PRO 95.A O no hydrogen 3.265 N/A GLY 104.A N GLU 77.A OE2 no hydrogen 2.792 N/A ARG 107.A NE GLU 77.A OE1 no hydrogen 2.772 N/A ARG 107.A NH1 PHE 80.A O no hydrogen 3.070 N/A ARG 107.A NH1 MET 81.A O no hydrogen 3.287 N/A ARG 107.A NH2 GLU 77.A OE1 no hydrogen 3.534 N/A ARG 107.A NH2 PHE 80.A O no hydrogen 2.851 N/A ARG 107.A NH2 TYR 88.A OH no hydrogen 3.038 N/A GLN 108.A N VAL 86.A O no hydrogen 2.934 N/A SER 110.A N TYR 88.A O no hydrogen 2.880 N/A SER 110.A OG HIS 87.A NE2 no hydrogen 2.748 N/A LEU 112.A N VAL 90.A O no hydrogen 2.815 N/A VAL 114.A N THR 92.A O no hydrogen 2.975 N/A SER 121.A OG ASP 238.A OD1 no hydrogen 3.452 N/A SER 121.A OG ASP 238.A OD2 no hydrogen 2.800 N/A MET 122.A N GLN 118.A O no hydrogen 2.970 N/A ARG 123.A N ASP 119.A O no hydrogen 2.997 N/A ARG 124.A NE SER 121.A O no hydrogen 3.010 N/A ARG 124.A NH1 ASP 147.A OD1 no hydrogen 2.801 N/A ARG 124.A NH2 ASP 147.A OD1 no hydrogen 3.470 N/A ARG 124.A NH2 ASP 238.A OD1 no hydrogen 2.951 N/A MET 125.A N MET 122.A O no hydrogen 3.155 N/A MET 127.A N ARG 123.A O no hydrogen 3.048 N/A ILE 128.A N ARG 124.A O no hydrogen 2.776 N/A SER 129.A N MET 125.A O no hydrogen 3.007 N/A SER 129.A OG MET 125.A O no hydrogen 3.058 N/A SER 129.A OG GLU 126.A O no hydrogen 3.309 N/A ASP 130.A N GLU 126.A O no hydrogen 2.513 N/A CYS 132.A SG MET 127.A O no hydrogen 3.351 N/A ARG 135.A NE GLU 139.A OE2 no hydrogen 2.989 N/A PHE 136.A N CYS 132.A O no hydrogen 3.015 N/A LEU 137.A N GLU 133.A O no hydrogen 3.263 N/A SER 138.A N ARG 134.A O no hydrogen 3.280 N/A SER 138.A OG ARG 134.A O no hydrogen 3.368 N/A SER 138.A OG ARG 135.A O no hydrogen 2.697 N/A GLU 139.A N ARG 135.A O no hydrogen 3.101 N/A GLU 139.A N PHE 136.A O no hydrogen 3.157 N/A VAL 140.A N PHE 136.A O no hydrogen 3.081 N/A ASP 141.A N THR 54.A O no hydrogen 2.872 N/A TYR 142.A N THR 54.A O no hydrogen 3.320 N/A LEU 143.A N GLY 208.A O no hydrogen 2.854 N/A VAL 144.A N GLY 56.A O no hydrogen 2.840 N/A CYS 145.A N PHE 206.A O no hydrogen 2.813 N/A CYS 145.A SG THR 58.A OG1 no hydrogen 3.401 N/A VAL 146.A N THR 58.A O no hydrogen 3.160 N/A ASP 147.A N GLY 204.A O no hydrogen 3.026 N/A MET 150.A N VAL 148.A O no hydrogen 2.813 N/A GLU 151.A N THR 278.A O no hydrogen 2.892 N/A PHE 152.A N THR 75.A OG1 no hydrogen 2.937 N/A ARG 153.A N ARG 276.A O no hydrogen 2.814 N/A ARG 153.A NE THR 278.A OG1 no hydrogen 2.864 N/A ARG 153.A NH1 GLN 263.A OE1 no hydrogen 3.061 N/A ARG 153.A NH2 GLN 263.A OE1 no hydrogen 2.716 N/A ASP 154.A N ARG 276.A O no hydrogen 3.292 N/A HIS 155.A N ASP 154.A OD1 no hydrogen 2.759 N/A HIS 155.A NE2 GLU 159.A OE2 no hydrogen 2.684 N/A VAL 156.A N HIS 79.A O no hydrogen 2.961 N/A GLY 157.A N GLU 159.A OE1 no hydrogen 2.901 N/A GLU 159.A N GLU 159.A OE2 no hydrogen 2.836 N/A ILE 160.A N GLY 157.A O no hydrogen 3.099 N/A LEU 161.A N VAL 158.A O no hydrogen 2.962 N/A THR 162.A OG1 THR 252.A OG1 no hydrogen 2.698 N/A LEU 164.A N THR 252.A OG1 no hydrogen 2.991 N/A PHE 165.A N GLY 207.A O no hydrogen 2.831 N/A THR 167.A OG1 PHE 205.A O no hydrogen 2.807 N/A LEU 168.A N LEU 255.A O no hydrogen 2.948 N/A HIS 169.A N TYR 200.A O no hydrogen 2.968 N/A SER 171.A N HIS 169.A ND1 no hydrogen 3.122 N/A PHE 172.A N HIS 169.A O no hydrogen 3.185 N/A SER 175.A N PHE 172.A O no hydrogen 2.999 N/A ARG 177.A NE GLY 197.A O no hydrogen 2.879 N/A ARG 177.A NH1 GLY 197.A O no hydrogen 2.890 N/A ALA 179.A N SER 176.A O no hydrogen 2.900 N/A PHE 180.A N ARG 177.A O no hydrogen 3.058 N/A THR 181.A OG1 TYR 200.A OH no hydrogen 3.186 N/A TYR 182.A OH PHE 199.A O no hydrogen 2.672 N/A ARG 184.A NH1 ILE 192.A O no hydrogen 2.857 N/A ARG 184.A NH2 ARG 177.A O no hydrogen 3.015 N/A ARG 184.A NH2 PHE 180.A O no hydrogen 2.997 N/A ARG 185.A N GLU 183.A OE1 no hydrogen 2.871 N/A ARG 185.A NE GLU 183.A OE1 no hydrogen 2.789 N/A ARG 185.A NH2 GLU 183.A OE2 no hydrogen 3.010 N/A ARG 185.A NH2 GLU 233.A O no hydrogen 2.817 N/A SER 188.A N ARG 185.A O no hydrogen 3.031 N/A SER 188.A OG ASP 227.A OD2 no hydrogen 2.709 N/A GLN 189.A N ASP 227.A OD1 no hydrogen 2.847 N/A ALA 190.A N SER 188.A OG no hydrogen 3.064 N/A TYR 191.A N SER 188.A O no hydrogen 3.073 N/A ILE 192.A N GLU 183.A O no hydrogen 3.017 N/A LYS 194.A NZ GLU 178.A O no hydrogen 2.730 N/A GLU 196.A N PRO 193.A O no hydrogen 3.054 N/A TYR 200.A OH GLU 239.A OE1 no hydrogen 2.645 N/A TYR 201.A N ASN 243.A OD1 no hydrogen 2.832 N/A MET 202.A N THR 167.A O no hydrogen 2.828 N/A GLY 203.A N GLU 239.A OE2 no hydrogen 2.800 N/A PHE 205.A N MET 202.A O no hydrogen 3.495 N/A PHE 206.A N CYS 145.A O no hydrogen 3.121 N/A GLY 207.A N PHE 165.A O no hydrogen 3.174 N/A GLY 208.A N LEU 143.A O no hydrogen 2.941 N/A SER 209.A N PRO 163.A O no hydrogen 2.878 N/A VAL 210.A N ASP 141.A O no hydrogen 3.325 N/A GLU 212.A N SER 209.A OG no hydrogen 3.110 N/A VAL 213.A N SER 209.A O no hydrogen 2.916 N/A GLN 214.A N VAL 210.A O no hydrogen 2.913 N/A GLN 214.A NE2 ILE 128.A O no hydrogen 3.064 N/A ARG 215.A N GLN 211.A O no hydrogen 3.026 N/A ARG 215.A NH2 GLU 212.A OE1 no hydrogen 2.719 N/A LEU 216.A N GLU 212.A O no hydrogen 2.970 N/A THR 217.A N VAL 213.A O no hydrogen 2.880 N/A THR 217.A OG1 VAL 213.A O no hydrogen 2.942 N/A THR 217.A OG1 GLN 214.A O no hydrogen 3.350 N/A ARG 218.A N GLN 214.A O no hydrogen 2.938 N/A ALA 219.A N ARG 215.A O no hydrogen 2.980 N/A CYS 220.A N LEU 216.A O no hydrogen 2.908 N/A CYS 220.A SG LEU 216.A O no hydrogen 3.389 N/A HIS 221.A N THR 217.A O no hydrogen 2.886 N/A GLN 222.A N ARG 218.A O no hydrogen 2.908 N/A ALA 223.A N ALA 219.A O no hydrogen 2.944 N/A MET 224.A N CYS 220.A O no hydrogen 2.928 N/A MET 225.A N HIS 221.A O no hydrogen 2.968 N/A VAL 226.A N GLN 222.A O no hydrogen 3.090 N/A ASP 227.A N ALA 223.A O no hydrogen 3.030 N/A GLN 228.A N MET 224.A O no hydrogen 2.941 N/A ALA 229.A N MET 225.A O no hydrogen 2.957 N/A ASN 230.A N VAL 226.A O no hydrogen 2.967 N/A GLY 231.A N GLN 228.A O no hydrogen 3.084 N/A ILE 232.A N ASP 227.A O no hydrogen 3.006 N/A VAL 235.A N GLU 183.A OE2 no hydrogen 2.798 N/A TRP 236.A N SER 240.A OG no hydrogen 2.855 N/A HIS 237.A N ALA 234.A O no hydrogen 2.954 N/A HIS 237.A ND1 GLU 233.A OE2 no hydrogen 2.678 N/A GLU 239.A N TRP 236.A O no hydrogen 3.018 N/A SER 240.A N HIS 237.A O no hydrogen 3.011 N/A HIS 241.A N HIS 237.A O no hydrogen 3.474 N/A HIS 241.A ND1 HIS 237.A O no hydrogen 3.263 N/A LEU 242.A N ASP 238.A O no hydrogen 2.836 N/A ASN 243.A N GLU 239.A O no hydrogen 2.977 N/A ASN 243.A ND2 TYR 201.A O no hydrogen 2.894 N/A ASN 243.A ND2 GLU 239.A O no hydrogen 2.951 N/A LYS 244.A N SER 240.A O no hydrogen 3.080 N/A LYS 244.A NZ GLN 189.A O no hydrogen 2.940 N/A LYS 244.A NZ TYR 191.A O no hydrogen 2.839 N/A TYR 245.A N HIS 241.A O no hydrogen 2.889 N/A LEU 246.A N LEU 242.A O no hydrogen 2.924 N/A LEU 247.A N ASN 243.A O no hydrogen 3.021 N/A ARG 248.A N LYS 244.A O no hydrogen 3.263 N/A HIS 249.A N TYR 245.A O no hydrogen 2.784 N/A HIS 249.A ND1 TYR 245.A O no hydrogen 3.025 N/A LYS 250.A NZ ASP 198.A OD2 no hydrogen 2.756 N/A LYS 250.A NZ LEU 247.A O no hydrogen 2.839 N/A THR 252.A N LEU 164.A O no hydrogen 2.717 N/A THR 252.A OG1 THR 162.A OG1 no hydrogen 2.698 N/A THR 252.A OG1 LEU 164.A O no hydrogen 3.055 N/A LYS 253.A N LEU 164.A O no hydrogen 3.298 N/A LYS 253.A NZ GLU 159.A O no hydrogen 2.776 N/A LYS 253.A NZ LEU 161.A O no hydrogen 2.707 N/A VAL 254.A N PRO 32.A O no hydrogen 2.921 N/A LEU 255.A N GLY 166.A O no hydrogen 2.828 N/A SER 256.A N VAL 34.A O no hydrogen 3.102 N/A SER 256.A OG VAL 34.A O no hydrogen 2.745 N/A TYR 259.A N SER 256.A O no hydrogen 3.014 N/A TYR 259.A OH GLU 159.A OE1 no hydrogen 2.699 N/A LEU 260.A N PRO 257.A O no hydrogen 3.101 N/A TRP 261.A N PHE 277.A O no hydrogen 2.986 N/A TRP 261.A NE1 GLY 267.A O no hydrogen 2.751 N/A LEU 265.A N ASP 262.A OD1 no hydrogen 3.112 N/A LEU 266.A N ASP 262.A O no hydrogen 2.945 N/A GLY 267.A N GLN 263.A O no hydrogen 2.848 N/A TRP 268.A NE1 LEU 272.A O no hydrogen 2.729 N/A LEU 272.A N PRO 269.A O no hydrogen 3.003 N/A LYS 274.A NZ ASP 154.A OD1 no hydrogen 3.301 N/A ARG 276.A N GLU 258.A O no hydrogen 2.856 N/A ARG 276.A NE GLU 258.A OE2 no hydrogen 2.813 N/A ARG 276.A NH1 HIS 155.A O no hydrogen 2.917 N/A ARG 276.A NH2 GLU 36.A OE1 no hydrogen 2.845 N/A ARG 276.A NH2 GLU 258.A OE2 no hydrogen 2.881 N/A THR 278.A N GLU 151.A O no hydrogen 2.880 N/A ALA 279.A N TRP 261.A O no hydrogen 2.886 N/A VAL 280.A N ASP 149.A O no hydrogen 3.083 N/A LYS 282.A NZ ASP 149.A OD2 no hydrogen 2.705 N/A