Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5ia3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A N LEU 1.A O no hydrogen 2.842 N/A THR 4.A OG1 LEU 1.A O no hydrogen 2.941 N/A ILE 7.A N VAL 76.A O no hydrogen 2.812 N/A HIS 8.A ND1 SER 10.A OG no hydrogen 2.519 N/A SER 10.A N HIS 8.A ND1 no hydrogen 3.052 N/A SER 10.A OG HIS 8.A ND1 no hydrogen 2.519 N/A CYS 11.A N HIS 8.A O no hydrogen 2.997 N/A VAL 12.A N PRO 9.A O no hydrogen 3.162 N/A THR 13.A N MET 30.A O no hydrogen 3.210 N/A GLN 15.A N LYS 28.A O no hydrogen 2.951 N/A LYS 16.A N LYS 28.A O no hydrogen 3.242 N/A ILE 18.A N VAL 26.A O no hydrogen 2.605 N/A GLU 25.A N THR 42.A OG1 no hydrogen 3.108 N/A VAL 26.A N GLY 19.A O no hydrogen 3.262 N/A TYR 27.A N ILE 40.A O no hydrogen 2.807 N/A TYR 27.A OH GLU 25.A OE1 no hydrogen 2.638 N/A LYS 28.A N LYS 16.A O no hydrogen 2.814 N/A LYS 28.A NZ GLN 15.A OE1 no hydrogen 2.509 N/A GLY 29.A N VAL 38.A O no hydrogen 2.803 N/A MET 30.A N THR 13.A O no hydrogen 3.124 N/A LEU 31.A N VAL 36.A O no hydrogen 2.873 N/A LYS 32.A N CYS 11.A O no hydrogen 2.773 N/A VAL 36.A N LEU 31.A O no hydrogen 3.090 N/A VAL 38.A N GLY 29.A O no hydrogen 2.919 N/A ALA 39.A N THR 87.A O no hydrogen 2.940 N/A ILE 40.A N TYR 27.A O no hydrogen 2.785 N/A LYS 41.A N ILE 85.A O no hydrogen 2.847 N/A LYS 41.A NZ GLU 58.A OE1 no hydrogen 2.649 N/A THR 42.A N GLU 25.A O no hydrogen 3.022 N/A THR 42.A OG1 GLU 25.A O no hydrogen 3.429 N/A LEU 43.A N MET 83.A O no hydrogen 3.031 N/A LYS 44.A N PHE 23.A O no hydrogen 2.996 N/A THR 48.A N GLN 51.A OE1 no hydrogen 2.636 N/A THR 48.A OG1 GLN 51.A OE1 no hydrogen 3.364 N/A LYS 50.A NZ ASP 54.A OD2 no hydrogen 3.065 N/A GLN 51.A N THR 48.A OG1 no hydrogen 3.005 N/A ARG 52.A N THR 48.A O no hydrogen 2.919 N/A VAL 53.A N GLU 49.A O no hydrogen 2.878 N/A ASP 54.A N LYS 50.A O no hydrogen 2.845 N/A PHE 55.A N GLN 51.A O no hydrogen 2.803 N/A LEU 56.A N ARG 52.A O no hydrogen 2.917 N/A GLY 57.A N VAL 53.A O no hydrogen 2.790 N/A GLU 58.A N ASP 54.A O no hydrogen 3.062 N/A ALA 59.A N PHE 55.A O no hydrogen 3.477 N/A GLY 60.A N LEU 56.A O no hydrogen 2.820 N/A ILE 61.A N GLY 57.A O no hydrogen 2.883 N/A MET 62.A N GLU 58.A O no hydrogen 2.931 N/A GLY 63.A N ALA 59.A O no hydrogen 2.889 N/A GLN 64.A N ILE 61.A O no hydrogen 3.003 N/A PHE 65.A N MET 62.A O no hydrogen 3.208 N/A SER 66.A N.A TYR 124.A OH no hydrogen 2.989 N/A SER 66.A N.B TYR 124.A OH no hydrogen 2.984 N/A ASN 69.A N HIS 67.A ND1 no hydrogen 2.877 N/A ASN 69.A ND2 CYS 148.A O no hydrogen 2.892 N/A ILE 70.A N HIS 67.A O no hydrogen 3.137 N/A ILE 71.A N VAL 150.A O no hydrogen 3.242 N/A ARG 72.A N GLU 88.A OE2 no hydrogen 2.874 N/A ARG 72.A NE GLU 74.A OE2 no hydrogen 3.085 N/A ARG 72.A NH2 GLU 74.A OE2 no hydrogen 2.596 N/A GLU 74.A N ILE 86.A O no hydrogen 2.714 N/A GLY 75.A N ILE 86.A O no hydrogen 3.156 N/A VAL 76.A N THR 5.A O no hydrogen 2.819 N/A ILE 77.A N MET 84.A O no hydrogen 2.939 N/A SER 78.A N GLU 6.A OE2 no hydrogen 2.875 N/A SER 78.A OG GLU 6.A OE1 no hydrogen 2.791 N/A LYS 79.A N GLU 6.A OE2 no hydrogen 3.047 N/A LYS 81.A NZ TYR 47.A OH no hydrogen 3.338 N/A MET 84.A N ILE 77.A O no hydrogen 2.956 N/A ILE 85.A N LYS 41.A O no hydrogen 2.793 N/A ILE 86.A N GLY 75.A O no hydrogen 2.910 N/A THR 87.A N ALA 39.A O no hydrogen 2.956 N/A THR 87.A OG1 GLU 88.A O no hydrogen 2.785 N/A GLU 88.A N ARG 72.A O no hydrogen 3.028 N/A GLU 91.A N GLU 91.A OE1 no hydrogen 2.751 N/A ASN 92.A N VAL 142.A O no hydrogen 2.926 N/A ASN 92.A ND2 ASN 143.A O no hydrogen 2.846 N/A GLY 93.A N MET 90.A O no hydrogen 3.302 N/A LEU 95.A N ILE 140.A O no hydrogen 2.793 N/A LYS 97.A N ASP 96.A OD1 no hydrogen 2.724 N/A LYS 97.A NZ GLU 101.A OE2 no hydrogen 2.521 N/A PHE 98.A N ALA 94.A O no hydrogen 2.958 N/A LEU 99.A N LEU 95.A O no hydrogen 2.990 N/A ARG 100.A N ASP 96.A O no hydrogen 3.163 N/A ARG 100.A NE GLY 193.A O no hydrogen 2.774 N/A ARG 100.A NH1 GLY 193.A O no hydrogen 3.509 N/A GLU 101.A N LYS 97.A O no hydrogen 3.020 N/A LYS 102.A N LEU 99.A O no hydrogen 3.226 N/A GLU 105.A N LYS 102.A O no hydrogen 3.147 N/A PHE 106.A N TYR 192.A OH no hydrogen 2.992 N/A SER 107.A N GLN 110.A OE1 no hydrogen 2.846 N/A SER 107.A OG GLN 110.A OE1 no hydrogen 3.432 N/A GLN 110.A N SER 107.A OG no hydrogen 2.950 N/A LEU 111.A N SER 107.A O no hydrogen 3.073 N/A VAL 112.A N VAL 108.A O no hydrogen 2.922 N/A GLY 113.A N LEU 109.A O no hydrogen 2.923 N/A MET 114.A N GLN 110.A O no hydrogen 3.020 N/A LEU 115.A N LEU 111.A O no hydrogen 3.207 N/A ARG 116.A N.A VAL 112.A O no hydrogen 2.933 N/A ARG 116.A N.B VAL 112.A O no hydrogen 2.940 N/A ARG 116.A NE.B ASP 251.A OD1 no hydrogen 2.498 N/A ARG 116.A NH1.B ASP 251.A OD2 no hydrogen 3.308 N/A GLY 117.A N GLY 113.A O no hydrogen 3.096 N/A ILE 118.A N MET 114.A O no hydrogen 3.047 N/A ALA 119.A N LEU 115.A O no hydrogen 2.887 N/A ALA 120.A N ARG 116.A O.A no hydrogen 2.849 N/A ALA 120.A N ARG 116.A O.B no hydrogen 2.856 N/A GLY 121.A N GLY 117.A O no hydrogen 2.963 N/A MET 122.A N ILE 118.A O no hydrogen 2.900 N/A LYS 123.A N ALA 119.A O no hydrogen 2.754 N/A TYR 124.A N ALA 120.A O no hydrogen 3.069 N/A LEU 125.A N GLY 121.A O no hydrogen 2.951 N/A ALA 126.A N MET 122.A O no hydrogen 2.861 N/A ASN 127.A N LYS 123.A O no hydrogen 2.968 N/A MET 128.A N TYR 124.A O no hydrogen 2.924 N/A ASN 129.A N ALA 126.A O no hydrogen 2.971 N/A TYR 130.A N LEU 125.A O no hydrogen 2.932 N/A TYR 130.A OH GLY 154.A O no hydrogen 3.074 N/A HIS 132.A N ASP 178.A OD2 no hydrogen 2.786 N/A HIS 132.A NE2 SER 151.A O no hydrogen 2.903 N/A ARG 133.A N ASP 178.A OD1 no hydrogen 3.037 N/A ASP 134.A N HIS 132.A ND1 no hydrogen 3.075 N/A ALA 137.A N GLU 188.A OE2 no hydrogen 2.948 N/A ARG 138.A NH2 ASP 134.A OD1 no hydrogen 3.263 N/A ASN 139.A N ALA 136.A O no hydrogen 2.869 N/A ASN 139.A ND2 ASP 134.A O no hydrogen 2.735 N/A ILE 140.A N ALA 137.A O no hydrogen 3.051 N/A LEU 141.A N LYS 149.A O no hydrogen 2.923 N/A VAL 142.A N GLY 93.A O no hydrogen 2.978 N/A ASN 143.A N VAL 147.A O no hydrogen 3.099 N/A SER 144.A N GLU 91.A OE1 no hydrogen 3.027 N/A ASN 145.A N ASN 143.A OD1 no hydrogen 2.823 N/A LEU 146.A N ASN 143.A O no hydrogen 2.888 N/A VAL 147.A N ASN 143.A OD1 no hydrogen 2.919 N/A LYS 149.A N LEU 141.A O no hydrogen 2.849 N/A LYS 149.A NZ HIS 68.A O no hydrogen 3.190 N/A LYS 149.A NZ GLU 88.A OE1 no hydrogen 3.289 N/A LYS 149.A NZ GLU 88.A OE2 no hydrogen 3.246 N/A VAL 150.A N ASN 69.A O no hydrogen 2.898 N/A SER 151.A N ASN 139.A O no hydrogen 2.975 N/A SER 151.A OG ASN 139.A O no hydrogen 2.909 N/A PHE 153.A N GLU 58.A OE2 no hydrogen 2.996 N/A GLY 154.A N TYR 130.A OH no hydrogen 2.789 N/A ARG 161.A NH1 LEU 200.A O no hydrogen 2.409 N/A ARG 161.A NH1 ASN 202.A OD1 no hydrogen 3.532 N/A ARG 161.A NH2 PRO 196.A O no hydrogen 3.063 N/A ARG 161.A NH2 LEU 200.A O no hydrogen 3.006 N/A TRP 162.A N PRO 159.A O no hydrogen 3.081 N/A TRP 162.A NE1 GLU 188.A OE2 no hydrogen 2.785 N/A THR 163.A N ILE 160.A O no hydrogen 3.015 N/A THR 163.A OG1 PRO 159.A O no hydrogen 2.724 N/A GLU 166.A N GLU 166.A OE1 no hydrogen 2.748 N/A ALA 167.A N ALA 164.A O no hydrogen 3.050 N/A ILE 168.A N ALA 164.A O no hydrogen 3.065 N/A SER 169.A N PRO 165.A O no hydrogen 2.838 N/A SER 169.A OG PRO 165.A O no hydrogen 3.073 N/A TYR 170.A N GLU 166.A O no hydrogen 3.000 N/A ARG 171.A N ALA 167.A O no hydrogen 3.049 N/A LYS 172.A N GLU 166.A O no hydrogen 3.338 N/A THR 174.A N SER 177.A OG no hydrogen 2.876 N/A ALA 176.A N THR 174.A OG1 no hydrogen 3.044 N/A SER 177.A N THR 174.A OG1 no hydrogen 3.284 N/A SER 177.A OG THR 174.A O no hydrogen 2.863 N/A ASP 178.A N THR 174.A O no hydrogen 3.051 N/A VAL 179.A N SER 175.A O no hydrogen 2.994 N/A TRP 180.A N ALA 176.A O no hydrogen 3.293 N/A SER 181.A N SER 177.A O no hydrogen 3.101 N/A SER 181.A OG TRP 162.A O no hydrogen 2.748 N/A SER 181.A OG SER 177.A O no hydrogen 3.349 N/A PHE 182.A N ASP 178.A O no hydrogen 2.772 N/A GLY 183.A N VAL 179.A O no hydrogen 2.977 N/A ILE 184.A N TRP 180.A O no hydrogen 3.230 N/A VAL 185.A N SER 181.A O no hydrogen 2.878 N/A MET 186.A N PHE 182.A O no hydrogen 2.794 N/A TRP 187.A N GLY 183.A O no hydrogen 3.111 N/A TRP 187.A NE1 PRO 216.A O no hydrogen 2.907 N/A GLU 188.A N ILE 184.A O no hydrogen 2.809 N/A VAL 189.A N VAL 185.A O no hydrogen 2.860 N/A MET 190.A N MET 186.A O no hydrogen 2.974 N/A THR 191.A N TRP 187.A O no hydrogen 3.034 N/A THR 191.A OG1 TRP 187.A O no hydrogen 2.815 N/A THR 191.A OG1 GLU 188.A O no hydrogen 3.228 N/A TYR 192.A N VAL 189.A O no hydrogen 3.106 N/A GLY 193.A N GLU 188.A O no hydrogen 2.729 N/A GLU 194.A N THR 191.A OG1 no hydrogen 3.084 N/A TRP 198.A N ARG 195.A O no hydrogen 2.935 N/A TRP 198.A NE1 GLU 194.A OE2 no hydrogen 2.735 N/A GLU 199.A N GLU 199.A OE1 no hydrogen 2.849 N/A LEU 200.A N TYR 197.A O no hydrogen 3.066 N/A SER 201.A N GLU 204.A OE1 no hydrogen 2.809 N/A GLU 204.A N SER 201.A OG no hydrogen 3.045 N/A VAL 205.A N SER 201.A O no hydrogen 2.805 N/A MET 206.A N ASN 202.A O no hydrogen 3.027 N/A LYS 207.A N HIS 203.A O no hydrogen 3.001 N/A LYS 207.A NZ ASP 211.A OD1 no hydrogen 3.548 N/A LYS 207.A NZ ASP 211.A OD2 no hydrogen 3.395 N/A ALA 208.A N GLU 204.A O no hydrogen 2.830 N/A ILE 209.A N VAL 205.A O no hydrogen 2.872 N/A ASN 210.A N MET 206.A O no hydrogen 2.972 N/A ASP 211.A N LYS 207.A O no hydrogen 3.002 N/A GLY 212.A N ILE 209.A O no hydrogen 2.886 N/A PHE 213.A N ALA 208.A O no hydrogen 2.876 N/A ARG 214.A NE TRP 233.A O no hydrogen 2.903 N/A ARG 214.A NH1 ILE 209.A O no hydrogen 3.099 N/A ARG 214.A NH1 PHE 213.A O no hydrogen 2.816 N/A ARG 214.A NH2 TRP 233.A O no hydrogen 3.025 N/A CYS 221.A SG PRO 222.A O no hydrogen 3.607 N/A SER 223.A N THR 262.A O no hydrogen 2.733 N/A TYR 226.A N PRO 222.A O no hydrogen 3.048 N/A TYR 226.A OH LEU 215.A O no hydrogen 2.927 N/A GLN 227.A N SER 223.A O no hydrogen 2.955 N/A GLN 227.A NE2 SER 223.A O no hydrogen 3.563 N/A GLN 227.A NE2 SER 223.A OG no hydrogen 2.888 N/A LEU 228.A N ALA 224.A O no hydrogen 3.057 N/A MET 229.A N ILE 225.A O no hydrogen 3.020 N/A MET 230.A N TYR 226.A O no hydrogen 2.950 N/A GLN 231.A N GLN 227.A O no hydrogen 3.066 N/A GLN 231.A NE2 GLN 227.A O no hydrogen 3.011 N/A CYS 232.A N LEU 228.A O no hydrogen 3.090 N/A CYS 232.A SG LEU 228.A O no hydrogen 3.477 N/A TRP 233.A N MET 230.A O no hydrogen 3.053 N/A ARG 239.A N GLU 236.A O no hydrogen 3.002 N/A ARG 240.A N ARG 237.A O no hydrogen 3.173 N/A ARG 240.A NE GLN 234.A O no hydrogen 2.805 N/A ARG 240.A NH1 GLU 166.A OE1 no hydrogen 3.560 N/A ARG 240.A NH1 GLU 166.A OE2 no hydrogen 2.778 N/A ARG 240.A NH1 ALA 176.A O no hydrogen 3.005 N/A ARG 240.A NH2 GLU 166.A OE1 no hydrogen 2.760 N/A ARG 240.A NH2 GLU 166.A OE2 no hydrogen 3.528 N/A ARG 240.A NH2 GLN 234.A O no hydrogen 3.190 N/A ARG 240.A NH2 GLN 235.A O no hydrogen 3.279 N/A LYS 242.A N ASP 245.A OD2 no hydrogen 2.867 N/A ILE 246.A N LYS 242.A O no hydrogen 3.116 N/A VAL 247.A N PHE 243.A O no hydrogen 2.912 N/A SER 248.A N ALA 244.A O no hydrogen 3.055 N/A ILE 249.A N ASP 245.A O no hydrogen 2.969 N/A LEU 250.A N ILE 246.A O no hydrogen 2.970 N/A ASP 251.A N VAL 247.A O no hydrogen 2.883 N/A LYS 252.A N SER 248.A O no hydrogen 3.076 N/A LEU 253.A N ILE 249.A O no hydrogen 2.990 N/A ILE 254.A N LEU 250.A O no hydrogen 2.913 N/A ARG 255.A N ASP 251.A O no hydrogen 2.935 N/A ALA 256.A N LYS 252.A O no hydrogen 3.115 N/A SER 259.A N ALA 256.A O no hydrogen 2.855 N/A SER 259.A OG LEU 253.A O no hydrogen 3.272 N/A SER 259.A OG ALA 256.A O no hydrogen 2.681 N/A LEU 260.A N PRO 257.A O no hydrogen 3.041 N/A LYS 261.A N ASP 258.A O no hydrogen 3.059 N/A LYS 261.A NZ ASP 258.A OD1 no hydrogen 2.709 N/A ALA 264.A N CYS 221.A O no hydrogen 2.916 N/A