Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4wa9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A NH1 GLU 53.A O no hydrogen 1.953 N/A ASP 6.A N GLU 3.A O no hydrogen 3.095 N/A ILE 7.A N ARG 4.A O no hydrogen 3.103 N/A THR 8.A N VAL 25.A O no hydrogen 3.018 N/A LYS 10.A N GLU 23.A O no hydrogen 2.828 N/A HIS 11.A N GLU 23.A O no hydrogen 3.426 N/A LEU 13.A N VAL 21.A O no hydrogen 2.716 N/A TYR 22.A N VAL 35.A O no hydrogen 2.751 N/A GLU 23.A N HIS 11.A O no hydrogen 2.788 N/A GLY 24.A N VAL 33.A O no hydrogen 2.746 N/A VAL 25.A N THR 8.A O no hydrogen 2.851 N/A TRP 26.A N LEU 31.A O no hydrogen 2.706 N/A LYS 27.A N ASP 6.A O no hydrogen 3.173 N/A LYS 27.A NZ THR 5.A O no hydrogen 2.705 N/A TYR 29.A N TRP 26.A O no hydrogen 3.151 N/A SER 30.A N LYS 27.A O no hydrogen 2.981 N/A LEU 31.A N TRP 26.A O no hydrogen 3.182 N/A VAL 33.A N GLY 24.A O no hydrogen 2.768 N/A ALA 34.A N THR 57.A O no hydrogen 2.907 N/A VAL 35.A N TYR 22.A O no hydrogen 2.748 N/A LYS 36.A N ILE 55.A O no hydrogen 3.057 N/A LYS 36.A NZ GLU 20.A O no hydrogen 3.259 N/A LYS 39.A N TYR 95.A OH no hydrogen 3.161 N/A LYS 39.A NZ GLN 45.A OE1 no hydrogen 3.348 N/A ASN 42.A N HIS 40.A ND1 no hydrogen 2.798 N/A ASN 42.A ND2 VAL 119.A O no hydrogen 2.915 N/A LEU 43.A N HIS 40.A O no hydrogen 3.202 N/A VAL 44.A N VAL 121.A O no hydrogen 2.912 N/A GLN 45.A N GLU 58.A OE2 no hydrogen 2.907 N/A GLN 45.A NE2 LEU 46.A O no hydrogen 3.181 N/A LEU 47.A N ILE 56.A O no hydrogen 2.602 N/A GLY 48.A N ILE 56.A O no hydrogen 3.158 N/A THR 51.A N GLU 1.A OE2 no hydrogen 2.633 N/A THR 51.A OG1 GLU 1.A OE1 no hydrogen 3.286 N/A ILE 56.A N GLY 48.A O no hydrogen 2.515 N/A THR 57.A N ALA 34.A O no hydrogen 3.040 N/A THR 57.A OG1 GLU 58.A O no hydrogen 3.133 N/A GLU 58.A N GLN 45.A O no hydrogen 2.968 N/A TYR 62.A N VAL 113.A O no hydrogen 2.850 N/A GLY 63.A N MET 60.A O no hydrogen 3.170 N/A ASN 64.A ND2 ASP 67.A OD2 no hydrogen 2.624 N/A LEU 65.A N CYS 111.A O no hydrogen 2.822 N/A ASP 67.A N ASN 64.A OD1 no hydrogen 2.821 N/A TYR 68.A N ASN 64.A O no hydrogen 3.164 N/A TYR 68.A OH HIS 117.A ND1 no hydrogen 3.126 N/A LEU 69.A N LEU 65.A O no hydrogen 3.013 N/A ARG 70.A N LEU 66.A O no hydrogen 3.145 N/A ARG 70.A NE GLY 178.A O no hydrogen 2.617 N/A ARG 70.A NH2 GLY 178.A O no hydrogen 2.857 N/A GLU 71.A N ASP 67.A O no hydrogen 2.941 N/A GLU 71.A N TYR 68.A O no hydrogen 3.256 N/A CYS 72.A SG LEU 69.A O no hydrogen 3.300 N/A GLN 75.A N ASN 73.A OD1 no hydrogen 2.839 N/A GLU 76.A N ASN 73.A O no hydrogen 2.887 N/A VAL 77.A N ASN 73.A O no hydrogen 2.919 N/A VAL 81.A N ASN 78.A OD1 no hydrogen 3.417 N/A LEU 82.A N ASN 78.A O no hydrogen 2.872 N/A LEU 83.A N ALA 79.A O no hydrogen 3.106 N/A TYR 84.A N VAL 80.A O no hydrogen 2.928 N/A MET 85.A N VAL 81.A O no hydrogen 2.907 N/A ALA 86.A N LEU 82.A O no hydrogen 3.108 N/A THR 87.A N LEU 83.A O no hydrogen 2.926 N/A THR 87.A OG1 LEU 83.A O no hydrogen 2.655 N/A GLN 88.A N TYR 84.A O no hydrogen 3.051 N/A GLN 88.A NE2 TYR 84.A O no hydrogen 3.428 N/A GLN 88.A NE2 HIS 117.A O no hydrogen 2.846 N/A ILE 89.A N MET 85.A O no hydrogen 3.072 N/A SER 90.A N ALA 86.A O no hydrogen 2.895 N/A SER 90.A OG ALA 86.A O no hydrogen 3.095 N/A SER 90.A OG THR 87.A O no hydrogen 3.016 N/A SER 91.A N THR 87.A O no hydrogen 2.973 N/A SER 91.A OG HIS 40.A NE2 no hydrogen 3.193 N/A ALA 92.A N GLN 88.A O no hydrogen 3.118 N/A MET 93.A N ILE 89.A O no hydrogen 2.951 N/A GLU 94.A N SER 90.A O no hydrogen 2.819 N/A TYR 95.A N SER 91.A O no hydrogen 3.154 N/A LEU 96.A N ALA 92.A O no hydrogen 3.076 N/A GLU 97.A N MET 93.A O no hydrogen 2.898 N/A LYS 98.A N GLU 94.A O no hydrogen 2.903 N/A LYS 98.A NZ GLU 94.A OE2 no hydrogen 3.357 N/A LYS 99.A N TYR 95.A O no hydrogen 2.937 N/A ASN 100.A N GLU 97.A O no hydrogen 3.155 N/A PHE 101.A N LEU 96.A O no hydrogen 2.883 N/A ILE 102.A N SER 127.A O no hydrogen 2.966 N/A HIS 103.A N ASP 163.A OD2 no hydrogen 2.743 N/A HIS 103.A NE2 ALA 122.A O no hydrogen 2.829 N/A ARG 104.A N GLY 125.A O no hydrogen 2.633 N/A ARG 104.A NE SER 127.A OG no hydrogen 2.778 N/A ARG 104.A NH2 LEU 126.A O no hydrogen 3.180 N/A ARG 104.A NH2 SER 127.A OG no hydrogen 3.270 N/A ASP 105.A N HIS 103.A ND1 no hydrogen 2.962 N/A ALA 108.A N GLU 173.A OE1 no hydrogen 2.923 N/A ARG 109.A NH2 ASP 105.A OD1 no hydrogen 3.051 N/A ASN 110.A N ALA 107.A O no hydrogen 2.944 N/A ASN 110.A ND2 ASP 105.A O no hydrogen 2.805 N/A CYS 111.A N ALA 108.A O no hydrogen 3.148 N/A CYS 111.A SG ALA 107.A O no hydrogen 3.526 N/A LEU 112.A N LYS 120.A O no hydrogen 2.754 N/A VAL 113.A N GLY 63.A O no hydrogen 2.777 N/A GLY 114.A N LEU 118.A O no hydrogen 2.760 N/A HIS 117.A ND1 TYR 68.A OH no hydrogen 3.126 N/A LEU 118.A N GLU 115.A O no hydrogen 3.272 N/A VAL 119.A N GLN 88.A OE1 no hydrogen 2.817 N/A LYS 120.A N LEU 112.A O no hydrogen 2.906 N/A LYS 120.A NZ GLU 58.A OE1 no hydrogen 2.955 N/A LYS 120.A NZ GLU 58.A OE2 no hydrogen 2.874 N/A VAL 121.A N ASN 42.A O no hydrogen 2.784 N/A ALA 122.A N ASN 110.A O no hydrogen 3.058 N/A LEU 126.A N ASP 123.A O no hydrogen 2.891 N/A SER 127.A N ILE 102.A O no hydrogen 3.053 N/A LEU 129.A N ASN 100.A O no hydrogen 2.862 N/A THR 134.A OG1 ASP 133.A OD1 no hydrogen 2.792 N/A TYR 135.A N PHE 158.A O no hydrogen 2.780 N/A ALA 137.A N ASN 156.A O no hydrogen 2.920 N/A HIS 138.A ND1 ALA 139.A O no hydrogen 2.783 N/A ALA 141.A N HIS 138.A O no hydrogen 3.189 N/A LYS 146.A NZ PRO 181.A O no hydrogen 3.333 N/A LYS 146.A NZ TYR 182.A O no hydrogen 2.716 N/A LYS 146.A NZ ILE 185.A O no hydrogen 2.718 N/A TRP 147.A N PRO 144.A O no hydrogen 3.024 N/A TRP 147.A NE1 GLU 173.A OE1 no hydrogen 2.864 N/A THR 148.A N ILE 145.A O no hydrogen 3.101 N/A THR 148.A OG1 PRO 144.A O no hydrogen 2.532 N/A GLU 151.A N GLU 151.A OE1 no hydrogen 2.810 N/A SER 152.A N ALA 149.A O no hydrogen 2.919 N/A SER 152.A OG LYS 157.A O no hydrogen 2.546 N/A LEU 153.A N ALA 149.A O no hydrogen 2.987 N/A ALA 154.A N PRO 150.A O no hydrogen 2.905 N/A TYR 155.A N GLU 151.A O no hydrogen 2.861 N/A ASN 156.A N SER 152.A O no hydrogen 2.872 N/A ASN 156.A ND2 ALA 137.A O no hydrogen 3.352 N/A LYS 157.A NZ THR 136.A OG1 no hydrogen 3.112 N/A PHE 158.A N TYR 135.A O no hydrogen 2.776 N/A SER 159.A N SER 162.A OG no hydrogen 2.958 N/A LYS 161.A N SER 159.A OG no hydrogen 2.979 N/A LYS 161.A NZ ARG 225.A O no hydrogen 2.826 N/A SER 162.A N SER 159.A O no hydrogen 2.985 N/A SER 162.A OG GLU 151.A OE2 no hydrogen 2.898 N/A SER 162.A OG SER 159.A O no hydrogen 3.425 N/A ASP 163.A N SER 159.A O no hydrogen 3.437 N/A VAL 164.A N ILE 160.A O no hydrogen 2.905 N/A TRP 165.A N LYS 161.A O no hydrogen 2.994 N/A ALA 166.A N SER 162.A O no hydrogen 3.049 N/A PHE 167.A N ASP 163.A O no hydrogen 2.736 N/A GLY 168.A N VAL 164.A O no hydrogen 3.106 N/A VAL 169.A N TRP 165.A O no hydrogen 3.296 N/A LEU 170.A N ALA 166.A O no hydrogen 2.892 N/A LEU 171.A N PHE 167.A O no hydrogen 2.812 N/A TRP 172.A N GLY 168.A O no hydrogen 3.138 N/A TRP 172.A NE1 GLU 201.A O no hydrogen 3.317 N/A GLU 173.A N VAL 169.A O no hydrogen 2.884 N/A ILE 174.A N LEU 170.A O no hydrogen 2.887 N/A ALA 175.A N LEU 171.A O no hydrogen 2.825 N/A THR 176.A N TRP 172.A O no hydrogen 2.994 N/A THR 176.A OG1 TRP 172.A O no hydrogen 2.966 N/A THR 176.A OG1 GLU 173.A O no hydrogen 3.192 N/A TYR 177.A N ILE 174.A O no hydrogen 3.003 N/A TYR 177.A OH VAL 77.A O no hydrogen 2.716 N/A GLY 178.A N GLU 173.A O no hydrogen 2.757 N/A MET 179.A N THR 176.A OG1 no hydrogen 3.109 N/A ILE 185.A N TYR 182.A O no hydrogen 3.029 N/A SER 188.A N ASP 186.A OD2 no hydrogen 3.140 N/A SER 188.A OG ASP 186.A OD1 no hydrogen 2.903 N/A SER 188.A OG ASP 186.A OD2 no hydrogen 3.034 N/A GLN 189.A N ASP 186.A O no hydrogen 2.919 N/A GLN 189.A NE2 ASP 186.A OD1 no hydrogen 3.319 N/A VAL 190.A N LEU 187.A O no hydrogen 3.291 N/A LEU 193.A N GLN 189.A O no hydrogen 3.229 N/A LEU 194.A N VAL 190.A O no hydrogen 3.018 N/A GLU 195.A N TYR 191.A O no hydrogen 2.953 N/A LYS 196.A N GLU 192.A O no hydrogen 3.175 N/A LYS 196.A N LEU 193.A O no hydrogen 3.065 N/A ASP 197.A N LEU 194.A O no hydrogen 2.935 N/A TYR 198.A N LEU 193.A O no hydrogen 2.799 N/A ARG 199.A NE TRP 218.A O no hydrogen 2.840 N/A ARG 199.A NH1 LEU 194.A O no hydrogen 3.001 N/A ARG 199.A NH1 TYR 198.A O no hydrogen 2.731 N/A ARG 199.A NH2 TRP 218.A O no hydrogen 2.969 N/A ARG 202.A NH1 CYS 206.A O no hydrogen 2.557 N/A CYS 206.A N PRO 203.A O no hydrogen 3.124 N/A CYS 206.A SG PRO 207.A O no hydrogen 3.548 N/A TYR 211.A N PRO 207.A O no hydrogen 3.125 N/A TYR 211.A OH MET 200.A O no hydrogen 2.649 N/A GLU 212.A N GLU 208.A O no hydrogen 2.868 N/A LEU 213.A N LYS 209.A O no hydrogen 3.162 N/A MET 214.A N VAL 210.A O no hydrogen 2.896 N/A ARG 215.A N TYR 211.A O no hydrogen 2.836 N/A ARG 215.A NH1 TYR 211.A OH no hydrogen 2.965 N/A ALA 216.A N GLU 212.A O no hydrogen 2.924 N/A CYS 217.A N LEU 213.A O no hydrogen 2.932 N/A CYS 217.A SG VAL 164.A O no hydrogen 3.584 N/A CYS 217.A SG LEU 213.A O no hydrogen 3.330 N/A TRP 218.A N MET 214.A O no hydrogen 3.046 N/A TRP 218.A N ARG 215.A O no hydrogen 3.233 N/A GLN 219.A N ALA 216.A O no hydrogen 3.293 N/A ASN 221.A ND2 ASP 224.A OD2 no hydrogen 3.135 N/A ASP 224.A N ASN 221.A O no hydrogen 2.957 N/A ARG 225.A N PRO 222.A O no hydrogen 3.120 N/A ARG 225.A NE GLN 219.A O no hydrogen 2.804 N/A ARG 225.A NH1 GLU 151.A OE1 no hydrogen 3.487 N/A ARG 225.A NH1 GLU 151.A OE2 no hydrogen 2.834 N/A ARG 225.A NH1 LYS 161.A O no hydrogen 2.955 N/A ARG 225.A NH2 GLU 151.A OE1 no hydrogen 2.797 N/A ARG 225.A NH2 GLN 219.A O no hydrogen 3.335 N/A ARG 225.A NH2 TRP 220.A O no hydrogen 3.077 N/A SER 227.A N GLU 230.A OE1 no hydrogen 3.098 N/A PHE 228.A N GLU 97.A OE2 no hydrogen 2.879 N/A ALA 229.A N GLU 97.A OE1 no hydrogen 3.150 N/A GLU 230.A N SER 227.A OG no hydrogen 3.223 N/A ILE 231.A N SER 227.A O no hydrogen 2.924 N/A HIS 232.A N PHE 228.A O no hydrogen 2.623 N/A GLN 233.A N ALA 229.A O no hydrogen 3.011 N/A GLN 233.A NE2 GLN 233.A O no hydrogen 3.210 N/A ALA 234.A N GLU 230.A O no hydrogen 2.872 N/A PHE 235.A N ILE 231.A O no hydrogen 2.989 N/A GLU 236.A N HIS 232.A O no hydrogen 2.895 N/A THR 237.A N GLN 233.A O no hydrogen 3.087 N/A THR 237.A OG1 GLN 233.A O no hydrogen 3.134 N/A MET 238.A N ALA 234.A O no hydrogen 3.064 N/A PHE 239.A N PHE 235.A O no hydrogen 2.695 N/A GLN 240.A N GLU 236.A O no hydrogen 2.855 N/A GLN 240.A NE2 GLU 236.A OE1 no hydrogen 3.521 N/A GLU 241.A N THR 237.A O no hydrogen 2.940 N/A SER 242.A N MET 238.A O no hydrogen 3.008 N/A SER 242.A OG MET 238.A O no hydrogen 3.459 N/A SER 243.A N PHE 239.A O no hydrogen 2.864 N/A SER 243.A OG PHE 239.A O no hydrogen 2.916 N/A ILE 244.A N GLN 240.A O no hydrogen 2.728 N/A SER 245.A N GLU 241.A O no hydrogen 3.064 N/A ASP 246.A N SER 242.A O no hydrogen 3.377 N/A