Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5wci_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A N TYR 15.A OH no hydrogen 3.184 N/A SER 10.A N PRO 7.A O no hydrogen 3.261 N/A LYS 14.A NZ TYR 15.A O no hydrogen 3.124 N/A LYS 14.A NZ ASP 17.A OD2 no hydrogen 2.927 N/A LYS 14.A NZ GLY 39.A O no hydrogen 2.906 N/A LYS 14.A NZ GLN 41.A O.A no hydrogen 2.828 N/A LYS 14.A NZ GLN 41.A O.B no hydrogen 2.697 N/A LYS 18.A NZ GLU 25.A OE1 no hydrogen 3.057 N/A ILE 19.A N ILE 26.A O no hydrogen 2.880 N/A HIS 20.A N LEU 44.A O no hydrogen 2.774 N/A HIS 20.A ND1 GLU 25.A OE2 no hydrogen 2.675 N/A ILE 21.A N TYR 24.A O no hydrogen 2.900 N/A TYR 24.A N ILE 21.A O no hydrogen 2.986 N/A ILE 26.A N ILE 19.A O no hydrogen 2.866 N/A ALA 28.A N ASP 17.A O no hydrogen 2.848 N/A TRP 29.A N LEU 106.A O no hydrogen 2.848 N/A TYR 30.A N LEU 106.A O no hydrogen 2.827 N/A SER 32.A OG LEU 102.A O no hydrogen 2.654 N/A PHE 34.A N SER 32.A O no hydrogen 2.812 N/A TYR 38.A N PRO 35.A O no hydrogen 2.773 N/A LYS 40.A N GLU 36.A O no hydrogen 3.306 N/A GLN 41.A NE2.A ASP 37.A O no hydrogen 2.754 N/A GLN 41.A NE2.B LYS 55.A O no hydrogen 3.489 N/A LYS 43.A NZ GLU 25.A OE1 no hydrogen 3.521 N/A LYS 43.A NZ GLU 25.A OE2 no hydrogen 2.904 N/A LEU 44.A N LYS 18.A O no hydrogen 2.992 N/A TRP 45.A N MET 54.A O no hydrogen 2.959 N/A LEU 46.A N HIS 20.A O no hydrogen 2.862 N/A CYS 47.A N LYS 52.A O no hydrogen 2.991 N/A CYS 47.A SG HIS 63.A NE2 no hydrogen 3.568 N/A CYS 50.A SG HIS 63.A NE2 no hydrogen 3.380 N/A LEU 51.A N CYS 47.A O no hydrogen 2.922 N/A MET 54.A N TRP 45.A O no hydrogen 2.736 N/A LYS 55.A NZ ASP 37.A OD2 no hydrogen 3.195 N/A SER 59.A OG TYR 56.A O no hydrogen 3.088 N/A TYR 60.A N TYR 56.A O no hydrogen 2.985 N/A ARG 61.A N GLU 57.A O no hydrogen 2.873 N/A PHE 62.A N LYS 58.A O no hydrogen 3.084 N/A HIS 63.A N SER 59.A O no hydrogen 2.961 N/A LEU 64.A N TYR 60.A O no hydrogen 2.817 N/A GLY 65.A N ARG 61.A O no hydrogen 3.272 N/A GLN 66.A N PHE 62.A O no hydrogen 3.129 N/A GLN 66.A N HIS 63.A O no hydrogen 2.980 N/A CYS 67.A N HIS 63.A O no hydrogen 2.746 N/A ARG 70.A NH1 CYS 67.A O no hydrogen 2.868 N/A ARG 70.A NH1 TRP 69.A O.A no hydrogen 2.936 N/A ARG 70.A NH1 TRP 69.A O.B no hydrogen 3.034 N/A LYS 75.A N GLU 87.A O no hydrogen 3.241 N/A ILE 77.A N VAL 85.A O no hydrogen 2.976 N/A TYR 78.A N VAL 85.A O no hydrogen 3.354 N/A ARG 79.A N CYS 276.A O no hydrogen 3.438 N/A ARG 79.A NE SER 81.A O no hydrogen 2.885 N/A ARG 79.A NH1 GLU 76.A OE2 no hydrogen 2.882 N/A LYS 80.A N ILE 83.A O no hydrogen 2.970 N/A LYS 80.A NZ ASP 273.A OD2 no hydrogen 3.122 N/A ASN 82.A ND2 VAL 127.A O no hydrogen 3.251 N/A ILE 83.A N LYS 80.A O no hydrogen 2.939 N/A SER 84.A N THR 125.A O no hydrogen 2.974 N/A SER 84.A OG THR 125.A OG1 no hydrogen 2.533 N/A VAL 85.A N TYR 78.A O no hydrogen 2.994 N/A HIS 86.A N ILE 123.A O no hydrogen 2.999 N/A HIS 86.A NE2 GLN 71.A OE1 no hydrogen 3.124 N/A GLU 87.A N LYS 75.A O no hydrogen 2.898 N/A VAL 88.A N PHE 121.A O no hydrogen 2.829 N/A GLY 90.A N PHE 119.A O no hydrogen 2.936 N/A LYS 91.A N ASP 89.A OD1 no hydrogen 2.872 N/A ASP 92.A N ASP 89.A O no hydrogen 3.076 N/A HIS 93.A N ASP 89.A O no hydrogen 3.127 N/A LYS 94.A NZ GLN 98.A OE1 no hydrogen 2.468 N/A LYS 94.A NZ GLU 117.A OE2.B no hydrogen 3.103 N/A CYS 97.A N HIS 93.A O no hydrogen 2.974 N/A CYS 97.A SG HIS 93.A O no hydrogen 3.396 N/A GLN 98.A N LYS 94.A O no hydrogen 2.815 N/A ASN 99.A N ILE 95.A O no hydrogen 2.933 N/A ASN 99.A ND2 CYS 50.A O no hydrogen 3.343 N/A LEU 100.A N TYR 96.A O no hydrogen 2.894 N/A CYS 101.A N CYS 97.A O no hydrogen 2.876 N/A CYS 101.A SG CYS 97.A O no hydrogen 3.336 N/A LEU 102.A N GLN 98.A O no hydrogen 2.990 N/A LEU 103.A N ASN 99.A O no hydrogen 3.009 N/A ALA 104.A N LEU 100.A O no hydrogen 2.827 N/A LYS 105.A N CYS 101.A O no hydrogen 3.005 N/A LYS 105.A NZ PHE 31.A O no hydrogen 2.790 N/A LYS 105.A NZ LYS 105.A O no hydrogen 3.141 N/A LYS 105.A NZ LEU 108.A O no hydrogen 2.766 N/A LYS 105.A NZ ASP 109.A O.A no hydrogen 3.534 N/A LEU 106.A N LEU 103.A O no hydrogen 3.121 N/A PHE 107.A N ALA 104.A O no hydrogen 2.872 N/A LEU 108.A N LYS 105.A O no hydrogen 3.429 N/A HIS 110.A ND1 ASP 109.A OD1.B no hydrogen 2.577 N/A ASP 115.A N LEU 112.A O no hydrogen 3.015 N/A VAL 116.A N PHE 114.A O no hydrogen 2.934 N/A PHE 119.A N VAL 116.A O no hydrogen 3.084 N/A VAL 120.A N LYS 140.A O no hydrogen 2.980 N/A PHE 121.A N VAL 88.A O no hydrogen 2.860 N/A TYR 122.A N PHE 138.A O no hydrogen 2.764 N/A TYR 122.A OH GLU 87.A OE2 no hydrogen 2.645 N/A ILE 123.A N HIS 86.A O no hydrogen 2.930 N/A LEU 124.A N GLY 136.A O no hydrogen 2.845 N/A THR 125.A N SER 84.A O no hydrogen 2.853 N/A THR 125.A OG1 SER 84.A O no hydrogen 3.448 N/A THR 125.A OG1 SER 84.A OG no hydrogen 2.533 N/A GLU 126.A N HIS 133.A O no hydrogen 3.031 N/A VAL 127.A N ASN 82.A O no hydrogen 2.797 N/A ASP 128.A N GLY 131.A O no hydrogen 2.899 N/A GLN 130.A N ASP 128.A OD1 no hydrogen 3.102 N/A GLY 131.A N ASP 128.A OD1 no hydrogen 3.211 N/A ALA 132.A N ARG 70.A O no hydrogen 2.839 N/A HIS 133.A N GLU 126.A O no hydrogen 2.843 N/A HIS 133.A ND1 GLU 48.A OE1 no hydrogen 2.633 N/A HIS 133.A NE2 ASP 128.A OD1 no hydrogen 2.677 N/A VAL 135.A N.A LEU 124.A O no hydrogen 2.858 N/A VAL 135.A N.B LEU 124.A O no hydrogen 2.925 N/A TYR 137.A N LEU 154.A O no hydrogen 2.874 N/A PHE 138.A N TYR 122.A O no hydrogen 3.036 N/A SER 139.A N CYS 152.A O.A no hydrogen 2.910 N/A SER 139.A N CYS 152.A O.B no hydrogen 2.892 N/A LYS 140.A N VAL 120.A O no hydrogen 2.929 N/A LYS 140.A NZ GLU 179.A OE1 no hydrogen 2.792 N/A LYS 142.A N PRO 118.A O no hydrogen 2.924 N/A LYS 142.A NZ ASP 89.A OD1 no hydrogen 2.793 N/A LYS 142.A NZ ASP 89.A OD2 no hydrogen 3.533 N/A LYS 142.A NZ GLU 117.A O.A no hydrogen 2.695 N/A LYS 142.A NZ GLU 117.A O.B no hydrogen 2.709 N/A SER 144.A OG GLU 141.A OE2 no hydrogen 2.970 N/A GLY 147.A N SER 144.A O no hydrogen 3.212 N/A ASN 148.A N SER 144.A OG no hydrogen 2.893 N/A ASN 149.A N SER 184.A O no hydrogen 2.982 N/A ASN 149.A ND2 SER 176.A OG no hydrogen 2.971 N/A ALA 151.A N SER 139.A O no hydrogen 2.722 N/A CYS 152.A N.A SER 139.A OG no hydrogen 3.142 N/A CYS 152.A SG.B TYR 137.A OH no hydrogen 3.584 N/A LEU 154.A N TYR 137.A O no hydrogen 2.954 N/A LEU 156.A N VAL 135.A O.A no hydrogen 2.844 N/A LEU 156.A N VAL 135.A O.B no hydrogen 2.815 N/A TYR 159.A N LEU 156.A O no hydrogen 2.839 N/A GLN 160.A N PRO 157.A O no hydrogen 3.005 N/A GLN 160.A NE2 THR 155.A O no hydrogen 2.934 N/A TYR 164.A OH.A GLU 126.A OE2 no hydrogen 2.363 N/A TYR 164.A OH.B GLU 126.A OE2 no hydrogen 2.266 N/A LYS 166.A NZ.A SER 199.A OG no hydrogen 3.204 N/A LYS 166.A NZ.B SER 199.A OG no hydrogen 3.256 N/A PHE 167.A N GLY 163.A O no hydrogen 3.004 N/A LEU 168.A N TYR 164.A O.A no hydrogen 2.916 N/A LEU 168.A N TYR 164.A O.B no hydrogen 2.944 N/A ILE 169.A N GLY 165.A O no hydrogen 2.871 N/A ALA 170.A N LYS 166.A O no hydrogen 2.871 N/A PHE 171.A N PHE 167.A O no hydrogen 2.855 N/A SER 172.A N LEU 168.A O no hydrogen 2.948 N/A SER 172.A OG ILE 169.A O no hydrogen 2.684 N/A TYR 173.A N ILE 169.A O no hydrogen 3.182 N/A GLU 174.A N ALA 170.A O no hydrogen 2.921 N/A LEU 175.A N PHE 171.A O no hydrogen 3.064 N/A SER 176.A N SER 172.A O no hydrogen 3.149 N/A SER 176.A OG SER 172.A O no hydrogen 3.199 N/A LYS 177.A N TYR 173.A O no hydrogen 2.842 N/A LYS 177.A NZ GLU 174.A OE2 no hydrogen 2.630 N/A LEU 178.A N GLU 174.A O no hydrogen 3.113 N/A GLU 179.A N LEU 175.A O no hydrogen 2.947 N/A SER 180.A N LYS 177.A O no hydrogen 3.004 N/A THR 181.A N SER 176.A O no hydrogen 3.132 N/A THR 181.A OG1 VAL 182.A O no hydrogen 3.048 N/A GLY 183.A N SER 225.A O no hydrogen 3.041 N/A SER 184.A OG ASP 230.A OD2 no hydrogen 2.775 N/A GLU 186.A N VAL 150.A O no hydrogen 2.908 N/A LYS 187.A NZ SER 184.A OG no hydrogen 2.733 N/A LYS 187.A NZ PRO 185.A O no hydrogen 2.721 N/A GLY 193.A N SER 190.A OG no hydrogen 2.942 N/A LYS 194.A N SER 190.A O no hydrogen 2.804 N/A LEU 195.A N ASP 191.A O no hydrogen 3.131 N/A SER 196.A N LEU 192.A O no hydrogen 3.027 N/A SER 196.A OG LEU 192.A O no hydrogen 2.872 N/A TYR 197.A N GLY 193.A O no hydrogen 2.932 N/A ARG 198.A N LYS 194.A O no hydrogen 2.938 N/A ARG 198.A NH1 SER 233.A OG no hydrogen 2.941 N/A ARG 198.A NH1 THR 234.A OG1 no hydrogen 2.921 N/A SER 199.A N LEU 195.A O no hydrogen 3.047 N/A TYR 200.A N SER 196.A O no hydrogen 2.989 N/A TRP 201.A N TYR 197.A O no hydrogen 2.788 N/A TRP 201.A NE1 TYR 173.A OH no hydrogen 2.889 N/A SER 202.A N ARG 198.A O no hydrogen 2.942 N/A SER 202.A OG ARG 198.A O no hydrogen 2.743 N/A TRP 203.A N SER 199.A O no hydrogen 3.087 N/A VAL 204.A N TYR 200.A O no hydrogen 3.009 N/A LEU 205.A N TRP 201.A O no hydrogen 2.997 N/A LEU 206.A N SER 202.A O no hydrogen 2.935 N/A GLU 207.A N TRP 203.A O no hydrogen 2.901 N/A ASN 208.A N VAL 204.A O no hydrogen 3.013 N/A ASN 208.A ND2 VAL 204.A O no hydrogen 2.743 N/A LEU 209.A N LEU 205.A O no hydrogen 2.970 N/A ARG 210.A N LEU 206.A O no hydrogen 3.084 N/A ARG 210.A NE GLU 258.A OE2 no hydrogen 2.571 N/A ARG 210.A NH2 GLU 258.A OE1 no hydrogen 3.071 N/A ASP 211.A N GLU 207.A O no hydrogen 3.019 N/A PHE 212.A N ASN 208.A O no hydrogen 2.983 N/A GLY 214.A N LEU 209.A O no hydrogen 3.187 N/A SER 216.A N ASP 219.A OD2 no hydrogen 2.811 N/A ASP 219.A N SER 216.A OG no hydrogen 3.089 N/A LEU 220.A N SER 216.A O no hydrogen 3.017 N/A SER 221.A N ILE 217.A O no hydrogen 2.873 N/A SER 221.A OG ILE 226.A O no hydrogen 2.642 N/A GLN 222.A N LYS 218.A O no hydrogen 2.928 N/A MET 223.A N ASP 219.A O no hydrogen 2.942 N/A THR 224.A N LEU 220.A O no hydrogen 3.012 N/A THR 224.A OG1 LEU 220.A O no hydrogen 2.650 N/A SER 225.A N SER 221.A O no hydrogen 2.826 N/A SER 225.A OG THR 181.A O no hydrogen 2.659 N/A ILE 226.A N THR 224.A OG1 no hydrogen 3.079 N/A ASP 230.A N THR 227.A OG1 no hydrogen 3.156 N/A ILE 231.A N THR 227.A O no hydrogen 2.882 N/A ILE 232.A N GLN 228.A O no hydrogen 2.871 N/A SER 233.A N ASN 229.A O no hydrogen 2.964 N/A SER 233.A OG ASN 229.A O no hydrogen 3.478 N/A SER 233.A OG ASP 230.A O no hydrogen 3.221 N/A THR 234.A N ASP 230.A O no hydrogen 3.099 N/A THR 234.A OG1 ASP 230.A O no hydrogen 2.700 N/A LEU 235.A N ILE 231.A O no hydrogen 2.771 N/A GLN 236.A N ILE 232.A O no hydrogen 2.889 N/A SER 237.A N SER 233.A O no hydrogen 3.131 N/A SER 237.A OG THR 234.A O no hydrogen 2.741 N/A LEU 238.A N THR 234.A O no hydrogen 3.006 N/A ASN 239.A N GLN 236.A O no hydrogen 3.054 N/A MET 240.A N LEU 235.A O no hydrogen 2.878 N/A LYS 242.A N VAL 249.A O no hydrogen 2.784 N/A TYR 243.A OH GLY 246.A O.A no hydrogen 3.199 N/A TRP 244.A N GLN 247.A O.A no hydrogen 2.839 N/A TRP 244.A N GLN 247.A O.B no hydrogen 2.837 N/A GLN 247.A N.A TRP 244.A O no hydrogen 2.943 N/A VAL 249.A N LYS 242.A O no hydrogen 2.750 N/A CYS 251.A N MET 240.A O no hydrogen 2.870 N/A LEU 256.A N THR 253.A OG1 no hydrogen 3.244 N/A VAL 257.A N THR 253.A O no hydrogen 3.167 N/A GLU 258.A N PRO 254.A O no hydrogen 3.001 N/A GLU 259.A N LYS 255.A O no hydrogen 2.976 N/A HIS 260.A N LEU 256.A O no hydrogen 3.140 N/A HIS 260.A ND1 LEU 256.A O no hydrogen 2.841 N/A LEU 261.A N VAL 257.A O no hydrogen 2.937 N/A LYS 262.A N GLU 258.A O no hydrogen 2.734 N/A SER 263.A N.A HIS 260.A O no hydrogen 3.294 N/A SER 263.A N.B GLU 259.A O no hydrogen 3.167 N/A SER 263.A N.B HIS 260.A O no hydrogen 3.294 N/A SER 263.A OG.A HIS 260.A O no hydrogen 2.802 N/A ASP 273.A N TYR 78.A OH no hydrogen 2.970 N/A VAL 275.A N ASP 273.A OD1 no hydrogen 3.114 N/A CYS 276.A N ASP 273.A O no hydrogen 2.878 N/A CYS 276.A SG ASP 273.A OD2 no hydrogen 3.758 N/A LEU 277.A N SER 274.A O.A no hydrogen 3.180 N/A LEU 277.A N SER 274.A O.B no hydrogen 3.048 N/A LYS 278.A N ILE 77.A O no hydrogen 2.818 N/A TRP 279.A NE1 GLU 87.A OE2 no hydrogen 2.865 N/A