Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3w0h_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 6.A NE ASP 3.A OD2 no hydrogen 2.904 N/A ARG 6.A NH2 ASP 3.A OD2 no hydrogen 2.868 N/A SER 10.A N GLN 13.A OE1 no hydrogen 3.102 N/A GLN 13.A N SER 10.A OG no hydrogen 2.977 N/A GLN 13.A NE2 ASP 3.A O no hydrogen 3.559 N/A GLN 14.A N SER 10.A O no hydrogen 2.961 N/A GLN 14.A NE2 LEU 9.A O no hydrogen 3.075 N/A GLN 14.A NE2 SER 10.A O no hydrogen 3.270 N/A HIS 15.A N GLU 11.A O no hydrogen 2.953 N/A ILE 16.A N GLU 12.A O no hydrogen 2.970 N/A ILE 17.A N GLN 13.A O no hydrogen 3.117 N/A ALA 18.A N GLN 14.A O no hydrogen 3.002 N/A ILE 19.A N HIS 15.A O no hydrogen 2.907 N/A LEU 20.A N ILE 16.A O no hydrogen 3.042 N/A LEU 21.A N ILE 17.A O no hydrogen 2.951 N/A ASP 22.A N ALA 18.A O no hydrogen 3.013 N/A ALA 23.A N ILE 19.A O no hydrogen 2.933 N/A HIS 24.A N LEU 20.A O no hydrogen 2.947 N/A HIS 25.A N LEU 21.A O no hydrogen 2.904 N/A HIS 25.A NE2 GLU 150.A OE1 no hydrogen 2.809 N/A HIS 25.A NE2 GLU 150.A OE2 no hydrogen 2.863 N/A LYS 26.A N ASP 22.A O no hydrogen 2.943 N/A LYS 26.A NZ ASP 22.A OD1 no hydrogen 2.883 N/A LYS 26.A NZ ASP 22.A OD2 no hydrogen 3.535 N/A THR 27.A N HIS 24.A O no hydrogen 2.960 N/A THR 27.A OG1 ALA 23.A O no hydrogen 2.775 N/A THR 27.A OG1 HIS 24.A O no hydrogen 3.371 N/A TYR 28.A OH TYR 32.A OH no hydrogen 2.733 N/A THR 31.A N ASP 29.A OD1 no hydrogen 2.891 N/A THR 31.A OG1 ASP 29.A OD1 no hydrogen 2.701 N/A THR 31.A OG1 ASP 29.A OD2 no hydrogen 3.283 N/A TYR 32.A N ASP 29.A O no hydrogen 3.011 N/A TYR 32.A OH TYR 28.A OH no hydrogen 2.733 N/A ALA 33.A N ASP 29.A OD2 no hydrogen 3.218 N/A PHE 35.A N TYR 32.A O no hydrogen 3.226 N/A ASP 37.A N ASP 34.A O no hydrogen 2.922 N/A PHE 38.A N PHE 35.A O no hydrogen 3.187 N/A ARG 39.A N ASP 55.A OD1 no hydrogen 2.805 N/A ARG 39.A NE ASP 55.A OD1 no hydrogen 2.913 N/A ARG 39.A NE ASP 55.A OD2 no hydrogen 3.434 N/A ARG 39.A NH1 LYS 236.A O no hydrogen 2.970 N/A ARG 39.A NH2 ASP 55.A OD2 no hydrogen 2.950 N/A ARG 39.A NH2 LYS 236.A O no hydrogen 2.862 N/A ARG 43.A NE ASP 122.A OD1 no hydrogen 2.723 N/A ARG 43.A NE ASP 122.A OD2 no hydrogen 3.381 N/A ARG 43.A NH1 ASP 115.A O no hydrogen 2.789 N/A ARG 43.A NH2 ASP 115.A O no hydrogen 3.031 N/A ARG 43.A NH2 ASP 122.A OD2 no hydrogen 3.087 N/A SER 48.A OG VAL 42.A O no hydrogen 2.602 N/A MET 49.A N LYS 125.A O no hydrogen 3.031 N/A LEU 50.A N LEU 47.A O no hydrogen 2.972 N/A HIS 52.A ND1 ARG 39.A O no hydrogen 2.719 N/A HIS 52.A NE2 TYR 118.A OH no hydrogen 2.704 N/A LEU 53.A N MET 49.A O no hydrogen 2.888 N/A ALA 54.A N LEU 50.A O no hydrogen 2.806 N/A ASP 55.A N PRO 51.A O no hydrogen 3.051 N/A LEU 56.A N HIS 52.A O no hydrogen 2.905 N/A VAL 57.A N LEU 53.A O no hydrogen 2.817 N/A SER 58.A N ALA 54.A O no hydrogen 2.843 N/A SER 58.A OG THR 238.A OG1 no hydrogen 2.659 N/A TYR 59.A N ASP 55.A O no hydrogen 2.906 N/A TYR 59.A OH ASP 34.A OD2 no hydrogen 2.804 N/A SER 60.A N LEU 56.A O no hydrogen 2.903 N/A SER 60.A OG LEU 56.A O no hydrogen 2.777 N/A ILE 61.A N VAL 57.A O no hydrogen 2.769 N/A GLN 62.A N SER 58.A O no hydrogen 3.104 N/A LYS 63.A N TYR 59.A O no hydrogen 3.108 N/A VAL 64.A N SER 60.A O no hydrogen 2.868 N/A ILE 65.A N ILE 61.A O no hydrogen 2.918 N/A GLY 66.A N GLN 62.A O no hydrogen 3.006 N/A PHE 67.A N LYS 63.A O no hydrogen 2.884 N/A ALA 68.A N VAL 64.A O no hydrogen 2.869 N/A LYS 69.A N.A ILE 65.A O no hydrogen 3.010 N/A LYS 69.A N.B ILE 65.A O no hydrogen 2.968 N/A LYS 69.A NZ.B GLY 66.A O no hydrogen 3.195 N/A MET 70.A N PHE 67.A O no hydrogen 2.952 N/A ILE 71.A N ALA 68.A O no hydrogen 2.993 N/A PHE 74.A N ILE 71.A O no hydrogen 2.931 N/A ASP 76.A N GLY 73.A O no hydrogen 2.826 N/A LEU 77.A N PHE 74.A O no hydrogen 3.157 N/A ASP 81.A N THR 78.A OG1 no hydrogen 3.211 N/A GLN 82.A N THR 78.A O no hydrogen 2.982 N/A ILE 83.A N SER 79.A O no hydrogen 2.981 N/A VAL 84.A N ASP 80.A O no hydrogen 2.972 N/A LEU 85.A N ASP 81.A O no hydrogen 2.914 N/A LEU 86.A N GLN 82.A O no hydrogen 2.983 N/A LYS 87.A N ILE 83.A O no hydrogen 2.805 N/A LYS 87.A NZ VAL 244.A O no hydrogen 3.341 N/A SER 88.A N VAL 84.A O no hydrogen 2.983 N/A SER 88.A OG VAL 84.A O no hydrogen 2.831 N/A SER 88.A OG LEU 85.A O no hydrogen 3.158 N/A SER 89.A N LEU 85.A O no hydrogen 3.005 N/A SER 89.A OG LEU 85.A O no hydrogen 2.768 N/A ALA 90.A N LEU 86.A O no hydrogen 2.916 N/A VAL 93.A N SER 89.A O no hydrogen 2.903 N/A ILE 94.A N ALA 90.A O no hydrogen 2.905 N/A MET 95.A N ILE 91.A O no hydrogen 2.970 N/A LEU 96.A N GLU 92.A O no hydrogen 2.898 N/A ARG 97.A N VAL 93.A O no hydrogen 2.739 N/A ARG 97.A NH2 THR 27.A O no hydrogen 2.863 N/A SER 98.A N.A ILE 94.A O no hydrogen 3.014 N/A SER 98.A N.B ILE 94.A O no hydrogen 3.010 N/A SER 98.A OG.A ILE 94.A O no hydrogen 3.326 N/A SER 98.A OG.A MET 95.A O no hydrogen 2.937 N/A SER 98.A OG.B ILE 94.A O no hydrogen 2.662 N/A ASN 99.A N LEU 96.A O no hydrogen 3.111 N/A ASN 99.A ND2 GLN 140.A O no hydrogen 2.915 N/A ASN 99.A ND2 GLN 140.A OE1 no hydrogen 2.955 N/A GLN 100.A N ARG 97.A O no hydrogen 3.261 N/A GLN 100.A NE2 HIS 24.A NE2 no hydrogen 3.003 N/A SER 101.A N SER 98.A O.A no hydrogen 2.936 N/A SER 101.A N SER 98.A O.B no hydrogen 3.071 N/A SER 101.A OG SER 98.A O.A no hydrogen 3.082 N/A SER 101.A OG SER 98.A O.B no hydrogen 3.123 N/A PHE 102.A N ASN 99.A O no hydrogen 3.164 N/A THR 103.A N SER 108.A O no hydrogen 2.853 N/A ASP 105.A N THR 103.A OG1 no hydrogen 3.356 N/A SER 108.A N THR 103.A O no hydrogen 3.369 N/A SER 108.A OG ASP 106.A OD2 no hydrogen 2.925 N/A TRP 109.A N TYR 118.A O no hydrogen 2.704 N/A ASP 110.A N SER 101.A O no hydrogen 2.826 N/A CYS 111.A N TYR 116.A O no hydrogen 2.960 N/A CYS 111.A SG SER 101.A OG no hydrogen 3.680 N/A LYS 117.A N GLN 114.A O no hydrogen 3.321 N/A LYS 117.A NZ ASP 106.A OD1 no hydrogen 2.576 N/A LYS 117.A NZ ASP 106.A OD2 no hydrogen 3.507 N/A LYS 117.A NZ SER 108.A OG no hydrogen 2.966 N/A TYR 118.A N TRP 109.A O no hydrogen 2.876 N/A TYR 118.A OH HIS 52.A NE2 no hydrogen 2.704 N/A ASP 119.A N ASP 122.A OD2 no hydrogen 3.046 N/A THR 121.A OG1 ASP 119.A OD1 no hydrogen 3.080 N/A THR 121.A OG1 ASP 119.A OD2 no hydrogen 2.638 N/A ASP 122.A N ASP 119.A OD2 no hydrogen 3.298 N/A VAL 123.A N ASP 119.A O no hydrogen 3.395 N/A SER 124.A N VAL 120.A O no hydrogen 3.010 N/A LYS 125.A N THR 121.A O no hydrogen 2.856 N/A ALA 126.A N VAL 123.A O no hydrogen 3.052 N/A GLY 127.A N SER 124.A O no hydrogen 2.942 N/A HIS 128.A N VAL 123.A O no hydrogen 3.468 N/A THR 129.A OG1 GLN 223.A OE1 no hydrogen 2.997 N/A GLU 131.A N THR 129.A OG1 no hydrogen 3.321 N/A LEU 132.A N THR 129.A O no hydrogen 3.059 N/A ILE 133.A N THR 129.A O no hydrogen 3.035 N/A GLU 134.A N LEU 130.A O no hydrogen 2.973 N/A LEU 136.A N LEU 132.A O no hydrogen 2.943 N/A ILE 137.A N ILE 133.A O no hydrogen 2.897 N/A LYS 138.A N GLU 134.A O no hydrogen 3.080 N/A PHE 139.A N PRO 135.A O no hydrogen 2.926 N/A GLN 140.A N LEU 136.A O no hydrogen 3.016 N/A GLN 140.A NE2 MET 95.A O no hydrogen 2.970 N/A VAL 141.A N ILE 137.A O no hydrogen 2.950 N/A GLY 142.A N LYS 138.A O no hydrogen 2.913 N/A LEU 143.A N PHE 139.A O no hydrogen 2.797 N/A LYS 144.A N GLN 140.A O no hydrogen 2.949 N/A LYS 144.A NZ ASN 99.A O no hydrogen 2.703 N/A LYS 144.A NZ PHE 102.A O no hydrogen 2.710 N/A LYS 145.A N VAL 141.A O no hydrogen 3.005 N/A LEU 146.A N LEU 143.A O no hydrogen 3.053 N/A ASN 147.A N LYS 144.A O no hydrogen 3.087 N/A HIS 149.A N GLU 152.A OE2 no hydrogen 2.848 N/A HIS 149.A ND1 TYR 189.A OH no hydrogen 2.745 N/A GLU 151.A N GLU 151.A OE2 no hydrogen 2.670 N/A HIS 153.A N HIS 149.A O no hydrogen 3.003 N/A VAL 154.A N GLU 150.A O no hydrogen 2.899 N/A LEU 155.A N GLU 151.A O no hydrogen 3.081 N/A LEU 156.A N GLU 152.A O no hydrogen 2.866 N/A MET 157.A N HIS 153.A O no hydrogen 3.123 N/A ALA 158.A N VAL 154.A O no hydrogen 3.083 N/A ILE 159.A N LEU 155.A O no hydrogen 2.882 N/A CYS 160.A N LEU 156.A O no hydrogen 2.947 N/A CYS 160.A SG GLU 92.A OE1 no hydrogen 3.335 N/A ILE 161.A N MET 157.A O no hydrogen 3.107 N/A VAL 162.A N ALA 158.A O no hydrogen 3.017 N/A SER 163.A OG ILE 159.A O no hydrogen 3.176 N/A SER 163.A OG CYS 160.A O no hydrogen 2.883 N/A ARG 166.A NH1 GLU 92.A OE1 no hydrogen 3.509 N/A ARG 166.A NH1 GLU 92.A OE2 no hydrogen 2.707 N/A ARG 166.A NH2 GLU 92.A OE1 no hydrogen 2.873 N/A ARG 166.A NH2 CYS 160.A O no hydrogen 2.973 N/A VAL 169.A N ARG 166.A O no hydrogen 3.319 N/A GLN 170.A N ASP 81.A OD2 no hydrogen 2.737 N/A ASP 171.A N ASP 81.A OD1 no hydrogen 2.831 N/A LYS 173.A NZ GLU 176.A OE2 no hydrogen 2.703 N/A LEU 174.A N ASP 171.A O no hydrogen 3.112 N/A VAL 175.A N ASP 171.A O no hydrogen 3.160 N/A GLU 176.A N ALA 172.A O no hydrogen 2.824 N/A ALA 177.A N LYS 173.A O no hydrogen 3.022 N/A ILE 178.A N LEU 174.A O no hydrogen 3.334 N/A GLN 179.A N VAL 175.A O no hydrogen 2.964 N/A GLN 179.A NE2 ILE 159.A O no hydrogen 3.100 N/A ASP 180.A N GLU 176.A O no hydrogen 2.749 N/A ARG 181.A N ALA 177.A O no hydrogen 3.248 N/A ARG 181.A NH1 GLU 12.A OE2 no hydrogen 2.530 N/A LEU 182.A N ILE 178.A O no hydrogen 3.029 N/A SER 183.A N GLN 179.A O no hydrogen 2.747 N/A SER 183.A OG GLN 179.A O no hydrogen 3.083 N/A ASN 184.A N ASP 180.A O no hydrogen 2.867 N/A THR 185.A N ARG 181.A O no hydrogen 3.081 N/A THR 185.A OG1 ARG 181.A O no hydrogen 2.827 N/A LEU 186.A N LEU 182.A O no hydrogen 2.932 N/A GLN 187.A N SER 183.A O no hydrogen 2.904 N/A THR 188.A N ASN 184.A O no hydrogen 2.922 N/A THR 188.A OG1 ASP 3.A O no hydrogen 3.358 N/A THR 188.A OG1 ASN 184.A O no hydrogen 2.891 N/A TYR 189.A N THR 185.A O no hydrogen 2.807 N/A TYR 189.A OH HIS 149.A ND1 no hydrogen 2.745 N/A ILE 190.A N LEU 186.A O no hydrogen 2.910 N/A ARG 191.A N GLN 187.A O no hydrogen 3.084 N/A ARG 191.A NE ARG 6.A O no hydrogen 3.384 N/A ARG 191.A NH1 SER 4.A O no hydrogen 2.682 N/A ARG 191.A NH2 SER 4.A O no hydrogen 2.507 N/A ARG 191.A NH2 ARG 6.A O no hydrogen 2.635 N/A CYS 192.A N THR 188.A O no hydrogen 3.037 N/A CYS 192.A SG THR 188.A O no hydrogen 3.468 N/A ARG 193.A N TYR 189.A O no hydrogen 2.762 N/A HIS 194.A N ILE 190.A O no hydrogen 3.267 N/A HIS 194.A ND1 GLU 152.A OE1 no hydrogen 2.575 N/A SER 199.A OG HIS 194.A O no hydrogen 3.473 N/A LEU 202.A N SER 199.A O no hydrogen 3.171 N/A LYS 205.A N GLN 201.A O no hydrogen 3.047 N/A MET 206.A N LEU 202.A O no hydrogen 2.938 N/A ILE 207.A N TYR 203.A O no hydrogen 3.064 N/A GLN 208.A N ALA 204.A O no hydrogen 2.904 N/A LYS 209.A N LYS 205.A O no hydrogen 3.084 N/A LEU 210.A N MET 206.A O no hydrogen 3.164 N/A ALA 211.A N ILE 207.A O no hydrogen 3.162 N/A ASP 212.A N GLN 208.A O no hydrogen 2.898 N/A LEU 213.A N LYS 209.A O no hydrogen 2.918 N/A ARG 214.A N LEU 210.A O no hydrogen 3.317 N/A ARG 214.A NH2 ASP 165.A OD2 no hydrogen 2.775 N/A SER 215.A N ALA 211.A O no hydrogen 3.403 N/A LEU 216.A N ASP 212.A O no hydrogen 3.018 N/A ASN 217.A N LEU 213.A O no hydrogen 2.770 N/A ASN 217.A ND2 SER 88.A O no hydrogen 2.772 N/A ASN 217.A ND2 GLU 92.A OE2 no hydrogen 2.879 N/A GLU 218.A N ARG 214.A O no hydrogen 3.029 N/A GLU 219.A N SER 215.A O no hydrogen 3.020 N/A HIS 220.A N LEU 216.A O no hydrogen 2.890 N/A SER 221.A N ASN 217.A O no hydrogen 2.778 N/A SER 221.A OG ASN 217.A O no hydrogen 2.883 N/A SER 221.A OG ASN 217.A OD1 no hydrogen 3.027 N/A LYS 222.A N GLU 218.A O no hydrogen 2.969 N/A GLN 223.A N GLU 219.A O no hydrogen 3.085 N/A TYR 224.A N HIS 220.A O no hydrogen 2.785 N/A TYR 224.A OH GLY 246.A O no hydrogen 2.762 N/A ARG 225.A N SER 221.A O no hydrogen 2.806 N/A SER 226.A N LYS 222.A O no hydrogen 3.045 N/A LEU 227.A N GLN 223.A O no hydrogen 2.861 N/A SER 228.A N TYR 224.A O no hydrogen 2.779 N/A SER 228.A OG TYR 224.A O no hydrogen 2.854 N/A ASN 233.A N GLN 230.A O no hydrogen 2.818 N/A ASN 233.A ND2 LEU 227.A O no hydrogen 3.107 N/A SER 234.A N GLN 230.A O no hydrogen 3.231 N/A SER 234.A OG SER 228.A O no hydrogen 2.559 N/A MET 235.A N PRO 231.A O no hydrogen 2.847 N/A LYS 236.A N ASN 233.A O no hydrogen 2.865 N/A LEU 237.A N SER 234.A O no hydrogen 2.994 N/A THR 238.A OG1 SER 58.A OG no hydrogen 2.659 N/A VAL 241.A N THR 238.A OG1 no hydrogen 3.092 N/A LEU 242.A N THR 238.A O no hydrogen 3.017 N/A GLU 243.A N PRO 239.A O no hydrogen 2.952 N/A VAL 244.A N LEU 240.A O no hydrogen 2.859 N/A PHE 245.A N VAL 241.A O no hydrogen 2.796 N/A