Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4dcb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 4.A N PRO 57.A O no hydrogen 2.772 N/A SER 6.A N ASN 4.A OD1 no hydrogen 2.923 N/A SER 6.A OG ASN 4.A OD1 no hydrogen 3.099 N/A SER 9.A N SER 6.A O no hydrogen 2.774 N/A SER 9.A OG ASN 4.A O no hydrogen 3.432 N/A SER 9.A OG SER 6.A O no hydrogen 2.624 N/A PHE 10.A N PRO 7.A O no hydrogen 3.030 N/A THR 11.A N SER 54.A O no hydrogen 2.898 N/A VAL 12.A N TYR 274.A O no hydrogen 2.875 N/A ALA 13.A N ASP 52.A O no hydrogen 2.825 N/A ALA 14.A N LEU 272.A O no hydrogen 3.143 N/A SER 15.A N LYS 50.A O no hydrogen 2.888 N/A SER 15.A OG THR 269.A OG1 no hydrogen 2.947 N/A THR 16.A N ALA 270.A O no hydrogen 3.076 N/A GLY 17.A N ILE 48.A O no hydrogen 3.111 N/A MET 18.A N VAL 268.A O no hydrogen 2.941 N/A LEU 19.A N VAL 46.A O no hydrogen 2.899 N/A SER 20.A N TYR 266.A O no hydrogen 3.079 N/A GLY 21.A N ILE 43.A O no hydrogen 2.957 N/A LYS 22.A N LYS 264.A O no hydrogen 3.011 N/A SER 23.A N TRP 41.A O no hydrogen 2.718 N/A SER 23.A OG GLN 166.A OE1 no hydrogen 2.617 N/A SER 23.A OG SER 262.A O no hydrogen 3.475 N/A HIS 24.A N SER 262.A O no hydrogen 2.974 N/A HIS 24.A ND1 ASP 40.A OD1 no hydrogen 2.673 N/A GLU 25.A N LEU 39.A O no hydrogen 2.908 N/A MET 26.A N GLY 260.A O no hydrogen 2.899 N/A LEU 27.A N SER 37.A O no hydrogen 2.847 N/A TYR 28.A N ALA 258.A O no hydrogen 2.832 N/A TYR 28.A OH GLU 248.A OE1 no hydrogen 3.076 N/A TYR 28.A OH GLU 248.A OE2 no hydrogen 2.568 N/A ASP 29.A N ARG 34.A O no hydrogen 2.770 N/A GLU 31.A N ASP 29.A OD1 no hydrogen 2.910 N/A THR 32.A N ASP 29.A OD1 no hydrogen 3.134 N/A GLY 33.A N ASP 29.A O no hydrogen 2.701 N/A ARG 34.A NH1 TRP 83.A O no hydrogen 2.832 N/A ARG 34.A NH2 TRP 83.A O no hydrogen 3.419 N/A LYS 35.A NZ GLN 38.A OE1 no hydrogen 2.811 N/A ILE 36.A N LEU 27.A O no hydrogen 2.932 N/A SER 37.A N LEU 27.A O no hydrogen 3.226 N/A SER 37.A OG ASP 82.A OD1 no hydrogen 3.333 N/A GLN 38.A N TYR 81.A O no hydrogen 2.906 N/A GLN 38.A NE2 ASP 40.A OD1 no hydrogen 3.161 N/A GLN 38.A NE2 ASP 40.A OD2 no hydrogen 3.295 N/A LEU 39.A N GLU 25.A O no hydrogen 2.911 N/A ASP 40.A N ASP 79.A O no hydrogen 2.783 N/A TRP 41.A N SER 23.A O no hydrogen 2.817 N/A TRP 41.A NE1 GLU 25.A OE2 no hydrogen 3.003 N/A LYS 42.A N ASN 77.A O no hydrogen 2.714 N/A ILE 43.A N GLY 21.A O no hydrogen 2.879 N/A LYS 44.A N SER 75.A O no hydrogen 3.017 N/A ASN 45.A N SER 75.A O no hydrogen 3.339 N/A VAL 46.A N LEU 19.A O no hydrogen 3.245 N/A ILE 48.A N GLY 17.A O no hydrogen 2.842 N/A LEU 49.A N THR 69.A O no hydrogen 2.952 N/A LYS 50.A N SER 15.A O no hydrogen 2.833 N/A LYS 50.A NZ GLU 240.A OE2 no hydrogen 2.434 N/A LYS 50.A NZ THR 267.A OG1 no hydrogen 3.014 N/A GLY 51.A N GLY 67.A O no hydrogen 2.850 N/A ASP 52.A N ALA 13.A O no hydrogen 2.910 N/A ILE 53.A N ALA 65.A O no hydrogen 2.852 N/A SER 54.A N THR 11.A O no hydrogen 2.861 N/A TRP 55.A N LEU 63.A O no hydrogen 2.811 N/A TRP 55.A NE1 ASN 4.A O no hydrogen 2.867 N/A ASP 56.A N SER 9.A O no hydrogen 2.902 N/A TYR 58.A OH LEU 1.A O no hydrogen 2.777 N/A LEU 61.A N TYR 58.A O no hydrogen 3.167 N/A THR 62.A N LYS 113.A O no hydrogen 2.961 N/A THR 62.A OG1 ASP 56.A OD1 no hydrogen 2.612 N/A LEU 63.A N TRP 55.A O no hydrogen 2.661 N/A ASN 64.A N ASN 111.A O no hydrogen 2.873 N/A ASN 64.A ND2 ASP 52.A OD2 no hydrogen 2.977 N/A ASN 64.A ND2 ILE 53.A O no hydrogen 2.971 N/A ALA 65.A N ILE 53.A O no hydrogen 2.858 N/A ARG 66.A N ASP 109.A O no hydrogen 2.917 N/A ARG 66.A NH1 ASP 52.A OD2 no hydrogen 3.095 N/A ARG 66.A NH2 GLU 240.A OE2 no hydrogen 2.968 N/A GLY 67.A N GLY 51.A O no hydrogen 3.087 N/A TRP 68.A N GLU 107.A O no hydrogen 2.956 N/A THR 69.A N LEU 49.A O no hydrogen 2.884 N/A THR 69.A OG1 SER 70.A O no hydrogen 3.487 N/A SER 70.A N ALA 105.A O no hydrogen 3.021 N/A SER 70.A OG ALA 105.A O no hydrogen 3.171 N/A LEU 71.A N ALA 47.A O no hydrogen 2.801 N/A SER 73.A OG VAL 102.A O no hydrogen 3.283 N/A GLY 74.A N VAL 102.A O no hydrogen 2.888 N/A SER 75.A N ASN 45.A O no hydrogen 2.991 N/A GLY 76.A N THR 100.A O no hydrogen 2.904 N/A ASN 77.A N LYS 42.A O no hydrogen 3.399 N/A MET 78.A N HIS 97.A O no hydrogen 3.287 N/A ASP 79.A N ASP 40.A O no hydrogen 2.995 N/A ASN 80.A N SER 95.A O no hydrogen 2.969 N/A TYR 81.A N GLN 38.A O no hydrogen 2.874 N/A ASP 82.A N ASP 93.A O no hydrogen 2.950 N/A TRP 83.A N ILE 36.A O no hydrogen 2.711 N/A MET 84.A N THR 92.A OG1 no hydrogen 3.098 N/A ASN 85.A ND2 GLN 88.A OE1 no hydrogen 3.502 N/A ASN 87.A N ASN 85.A OD1 no hydrogen 3.321 N/A GLN 88.A N ASN 85.A O no hydrogen 2.981 N/A GLN 88.A NE2 GLU 90.A O no hydrogen 2.781 N/A GLN 88.A NE2 TRP 91.A O no hydrogen 3.399 N/A GLN 88.A NE2 ASN 148.A OD1 no hydrogen 3.239 N/A GLU 90.A N GLU 90.A OE1 no hydrogen 3.087 N/A THR 92.A N ASP 82.A O no hydrogen 2.807 N/A THR 92.A OG1 ASP 82.A O no hydrogen 2.934 N/A THR 92.A OG1 ASP 93.A OD1 no hydrogen 2.544 N/A ASP 93.A N ASP 82.A O no hydrogen 3.191 N/A HIS 94.A N SER 145.A O no hydrogen 2.899 N/A HIS 94.A NE2 ASP 79.A OD2 no hydrogen 2.713 N/A SER 95.A N ASN 80.A O no hydrogen 2.939 N/A SER 95.A OG HIS 97.A NE2 no hydrogen 2.812 N/A SER 96.A N SER 143.A O no hydrogen 2.912 N/A HIS 97.A N MET 78.A O no hydrogen 2.878 N/A HIS 97.A ND1 GLY 141.A O no hydrogen 2.708 N/A HIS 97.A NE2 SER 95.A OG no hydrogen 2.812 N/A THR 100.A OG1 HIS 97.A O no hydrogen 2.594 N/A ASN 101.A N THR 138.A O no hydrogen 2.960 N/A VAL 102.A N GLY 74.A O no hydrogen 2.908 N/A ASN 103.A N SER 136.A O no hydrogen 2.773 N/A ASN 103.A ND2 SER 136.A OG no hydrogen 3.005 N/A ASN 103.A ND2 THR 138.A OG1 no hydrogen 2.811 N/A ALA 105.A N SER 70.A OG no hydrogen 2.982 N/A ASN 106.A N ARG 134.A O no hydrogen 2.972 N/A GLU 107.A N TRP 68.A O no hydrogen 3.017 N/A TYR 108.A N GLU 132.A O no hydrogen 2.906 N/A ASP 109.A N ARG 66.A O no hydrogen 2.792 N/A LEU 110.A N TYR 130.A O no hydrogen 2.933 N/A ASN 111.A N ASN 64.A O no hydrogen 2.926 N/A ASN 111.A ND2 ASN 64.A OD1 no hydrogen 2.941 N/A ASN 111.A ND2 ASP 109.A OD1 no hydrogen 3.097 N/A VAL 112.A N ALA 128.A O no hydrogen 2.917 N/A LYS 113.A N THR 62.A O no hydrogen 2.939 N/A LYS 113.A NZ ASN 64.A OD1 no hydrogen 2.949 N/A LYS 113.A NZ ASN 111.A OD1 no hydrogen 2.827 N/A GLY 114.A N ILE 126.A O no hydrogen 2.857 N/A TRP 115.A N PHE 60.A O no hydrogen 2.827 N/A TRP 115.A NE1 THR 62.A OG1 no hydrogen 2.848 N/A LEU 116.A N ALA 124.A O no hydrogen 2.880 N/A LEU 117.A N ALA 124.A O no hydrogen 3.152 N/A ASP 119.A N TYR 122.A O no hydrogen 2.853 N/A GLU 120.A N GLU 120.A OE1 no hydrogen 2.763 N/A ASN 121.A N ASP 119.A OD1 no hydrogen 2.843 N/A ASN 121.A ND2 ARG 180.A O no hydrogen 2.827 N/A LYS 123.A N GLN 178.A O no hydrogen 2.926 N/A ALA 124.A N LEU 117.A O no hydrogen 2.879 N/A GLY 125.A N ALA 176.A O no hydrogen 2.910 N/A ILE 126.A N GLY 114.A O no hydrogen 3.041 N/A THR 127.A N GLY 174.A O no hydrogen 2.815 N/A THR 127.A OG1 VAL 112.A O no hydrogen 2.842 N/A ALA 128.A N VAL 112.A O no hydrogen 3.080 N/A GLY 129.A N TYR 172.A O no hydrogen 3.121 N/A TYR 130.A N LEU 110.A O no hydrogen 2.868 N/A GLN 131.A N MET 170.A O no hydrogen 2.947 N/A GLN 131.A NE2 TYR 220.A OH no hydrogen 3.437 N/A GLN 131.A NE2 TYR 246.A OH no hydrogen 3.090 N/A GLU 132.A N TYR 108.A O no hydrogen 2.920 N/A THR 133.A N PHE 168.A O no hydrogen 2.961 N/A THR 133.A OG1 GLU 107.A OE1 no hydrogen 2.880 N/A THR 133.A OG1 TYR 246.A OH no hydrogen 2.730 N/A ARG 134.A N ASN 106.A O no hydrogen 2.863 N/A PHE 135.A N GLN 166.A O no hydrogen 3.081 N/A SER 136.A N HIS 104.A O no hydrogen 2.944 N/A TRP 137.A N TYR 164.A O no hydrogen 2.835 N/A TRP 137.A NE1 LYS 42.A O no hydrogen 3.046 N/A THR 138.A N ASN 101.A O no hydrogen 2.900 N/A ALA 139.A N ILE 162.A O no hydrogen 2.948 N/A THR 140.A N ALA 99.A O no hydrogen 3.034 N/A THR 140.A OG1 ALA 99.A O no hydrogen 2.710 N/A GLY 141.A N VAL 159.A O no hydrogen 3.064 N/A SER 143.A N SER 96.A O no hydrogen 2.900 N/A TYR 144.A N GLY 153.A O no hydrogen 2.874 N/A SER 145.A N HIS 94.A O no hydrogen 2.720 N/A TYR 146.A N TYR 151.A O no hydrogen 2.785 N/A ASN 147.A N ASP 93.A OD2 no hydrogen 3.003 N/A ASN 148.A N THR 92.A O no hydrogen 2.978 N/A ASN 148.A ND2 GLN 88.A OE1 no hydrogen 3.576 N/A ALA 150.A N ASN 147.A O no hydrogen 3.198 N/A TYR 151.A N TYR 146.A O no hydrogen 3.189 N/A GLY 153.A N TYR 144.A O no hydrogen 3.255 N/A PHE 155.A N GLY 142.A O no hydrogen 2.825 N/A VAL 159.A N PRO 156.A O no hydrogen 3.158 N/A VAL 161.A N ALA 139.A O no hydrogen 2.723 N/A ILE 162.A N ALA 139.A O no hydrogen 3.456 N/A GLY 163.A N GLU 203.A O no hydrogen 2.836 N/A TYR 164.A N TRP 137.A O no hydrogen 3.127 N/A TYR 164.A OH ASP 200.A OD2 no hydrogen 2.737 N/A ASN 165.A N ASN 201.A O no hydrogen 2.926 N/A GLN 166.A N PHE 135.A O no hydrogen 2.971 N/A GLN 166.A NE2 TYR 164.A OH no hydrogen 2.955 N/A GLN 166.A NE2 SER 262.A O no hydrogen 3.165 N/A ARG 167.A N HIS 199.A O no hydrogen 2.877 N/A PHE 168.A N THR 133.A O no hydrogen 2.954 N/A SER 169.A N ARG 197.A O no hydrogen 2.846 N/A MET 170.A N GLN 131.A O no hydrogen 3.012 N/A TYR 172.A N GLY 129.A O no hydrogen 2.855 N/A TYR 172.A OH ASP 109.A OD1 no hydrogen 2.549 N/A TYR 172.A OH ASP 109.A OD2 no hydrogen 3.240 N/A ILE 173.A N PHE 192.A O no hydrogen 2.934 N/A GLY 174.A N THR 127.A O no hydrogen 2.799 N/A LEU 175.A N PHE 190.A O no hydrogen 2.949 N/A ALA 176.A N GLY 125.A O no hydrogen 3.003 N/A GLY 177.A N ALA 188.A O no hydrogen 2.888 N/A GLN 178.A N LYS 123.A O no hydrogen 2.818 N/A GLN 178.A NE2 ASN 187.A OD1 no hydrogen 3.451 N/A TYR 179.A N LEU 186.A O no hydrogen 2.750 N/A ARG 180.A N ASN 121.A O no hydrogen 2.797 N/A ARG 180.A NE ASN 182.A O no hydrogen 2.826 N/A ILE 181.A N PHE 184.A O no hydrogen 2.912 N/A PHE 184.A N ILE 181.A O no hydrogen 2.850 N/A GLU 185.A N GLY 228.A O no hydrogen 2.988 N/A LEU 186.A N TYR 179.A O no hydrogen 2.836 N/A ASN 187.A N ASN 226.A O no hydrogen 2.982 N/A ASN 187.A ND2 GLU 185.A OE1 no hydrogen 3.032 N/A ASN 187.A ND2 ASN 226.A OD1 no hydrogen 3.041 N/A ALA 188.A N GLY 177.A O no hydrogen 2.983 N/A LEU 189.A N VAL 224.A O no hydrogen 2.831 N/A PHE 190.A N LEU 175.A O no hydrogen 2.966 N/A LYS 191.A N GLY 222.A O no hydrogen 2.749 N/A LYS 191.A NZ ASP 109.A OD2 no hydrogen 3.236 N/A LYS 191.A NZ GLN 131.A OE1 no hydrogen 2.723 N/A PHE 192.A N ILE 173.A O no hydrogen 2.846 N/A SER 193.A N TYR 220.A O no hydrogen 3.099 N/A SER 193.A OG PRO 171.A O no hydrogen 2.753 N/A TRP 195.A N SER 193.A OG no hydrogen 3.014 N/A VAL 196.A N SER 218.A O no hydrogen 2.818 N/A ARG 197.A N SER 169.A O no hydrogen 2.821 N/A ALA 198.A N THR 215.A O no hydrogen 2.812 N/A HIS 199.A N ARG 167.A O no hydrogen 2.937 N/A ASP 200.A N GLU 213.A O no hydrogen 2.982 N/A ASN 201.A N ASN 165.A O no hydrogen 2.948 N/A ASP 202.A N PHE 211.A O no hydrogen 2.826 N/A GLU 203.A N GLY 163.A O no hydrogen 2.713 N/A HIS 204.A N LEU 209.A O no hydrogen 2.930 N/A HIS 204.A ND1 ASP 202.A OD1 no hydrogen 2.560 N/A TYR 205.A N VAL 161.A O no hydrogen 3.114 N/A ARG 207.A N HIS 204.A O no hydrogen 3.081 N/A LEU 209.A N HIS 204.A O no hydrogen 3.336 N/A THR 210.A N ILE 256.A O no hydrogen 3.110 N/A THR 210.A OG1 GLU 203.A OE1 no hydrogen 2.770 N/A PHE 211.A N ASP 202.A O no hydrogen 2.764 N/A ARG 212.A N GLN 254.A O no hydrogen 2.842 N/A GLU 213.A N ASP 200.A O no hydrogen 3.382 N/A GLU 213.A N ASP 200.A OD1 no hydrogen 3.155 N/A LYS 214.A N GLY 252.A O no hydrogen 3.392 N/A THR 215.A N ALA 198.A O no hydrogen 2.931 N/A GLY 217.A N VAL 196.A O no hydrogen 3.013 N/A SER 218.A N VAL 196.A O no hydrogen 3.452 N/A TYR 220.A N SER 193.A O no hydrogen 2.901 N/A TYR 220.A OH SER 244.A OG no hydrogen 2.937 N/A TYR 221.A N LYS 245.A O no hydrogen 2.990 N/A GLY 222.A N LYS 191.A O no hydrogen 2.952 N/A THR 223.A N TYR 243.A O no hydrogen 2.826 N/A VAL 224.A N LEU 189.A O no hydrogen 2.982 N/A ILE 225.A N PHE 241.A O no hydrogen 2.931 N/A ASN 226.A N ASN 187.A O no hydrogen 2.941 N/A ASN 226.A ND2 GLU 240.A OE1 no hydrogen 3.027 N/A ALA 227.A N ALA 239.A O no hydrogen 3.065 N/A GLY 228.A N GLU 185.A O no hydrogen 2.962 N/A TYR 229.A N VAL 237.A O no hydrogen 2.905 N/A TYR 230.A N ASP 183.A O no hydrogen 2.857 N/A TYR 230.A OH GLU 185.A OE2 no hydrogen 2.857 N/A VAL 231.A N ALA 235.A O no hydrogen 2.839 N/A THR 232.A N ALA 235.A O no hydrogen 3.404 N/A ASN 234.A N THR 232.A OG1 no hydrogen 2.894 N/A ALA 235.A N THR 232.A O no hydrogen 3.468 N/A LYS 236.A N GLN 273.A O no hydrogen 2.899 N/A LYS 236.A NZ GLU 185.A OE1 no hydrogen 2.634 N/A VAL 237.A N TYR 229.A O no hydrogen 2.928 N/A PHE 238.A N GLY 271.A O no hydrogen 2.968 N/A ALA 239.A N ALA 227.A O no hydrogen 2.939 N/A GLU 240.A N THR 269.A O no hydrogen 2.860 N/A PHE 241.A N ILE 225.A O no hydrogen 2.854 N/A THR 242.A N THR 267.A O no hydrogen 2.950 N/A THR 242.A OG1 THR 267.A OG1 no hydrogen 2.672 N/A TYR 243.A N THR 223.A O no hydrogen 3.169 N/A SER 244.A N ASN 265.A O no hydrogen 2.966 N/A SER 244.A OG TYR 220.A OH no hydrogen 2.937 N/A LYS 245.A N TYR 221.A O no hydrogen 2.781 N/A LYS 245.A NZ ASP 247.A OD1 no hydrogen 3.113 N/A TYR 246.A N ASN 263.A O no hydrogen 2.679 N/A TYR 246.A OH THR 133.A OG1 no hydrogen 2.730 N/A ASP 247.A N ARG 219.A O no hydrogen 2.876 N/A GLY 251.A N ALA 259.A O no hydrogen 3.022 N/A GLY 252.A N LYS 214.A O no hydrogen 3.257 N/A THR 253.A OG1 GLU 213.A OE2 no hydrogen 2.959 N/A GLN 254.A N ARG 212.A O no hydrogen 2.803 N/A ILE 256.A N THR 210.A O no hydrogen 2.795 N/A ALA 258.A N TYR 28.A O no hydrogen 2.900 N/A ALA 259.A N GLY 251.A O no hydrogen 2.881 N/A GLY 260.A N MET 26.A O no hydrogen 3.062 N/A SER 262.A N HIS 24.A O no hydrogen 3.053 N/A ASN 263.A N TYR 246.A O no hydrogen 3.203 N/A ASN 263.A ND2 SER 23.A OG no hydrogen 2.835 N/A LYS 264.A N LYS 22.A O no hydrogen 3.023 N/A ASN 265.A N SER 244.A O no hydrogen 2.852 N/A ASN 265.A ND2 ASN 263.A OD1 no hydrogen 3.072 N/A TYR 266.A N SER 20.A O no hydrogen 2.801 N/A THR 267.A N THR 242.A O no hydrogen 3.077 N/A THR 267.A OG1 THR 242.A OG1 no hydrogen 2.672 N/A VAL 268.A N MET 18.A O no hydrogen 3.072 N/A THR 269.A N GLU 240.A O no hydrogen 3.004 N/A THR 269.A OG1 SER 15.A OG no hydrogen 2.947 N/A ALA 270.A N THR 16.A O no hydrogen 2.959 N/A GLY 271.A N PHE 238.A O no hydrogen 2.920 N/A LEU 272.A N ALA 14.A O no hydrogen 3.043 N/A GLN 273.A N LYS 236.A O no hydrogen 2.770 N/A TYR 274.A N VAL 12.A O no hydrogen 2.705 N/A ARG 275.A N ASN 234.A O no hydrogen 2.867 N/A ARG 275.A NH1 ASP 8.A O no hydrogen 3.100 N/A PHE 276.A N PHE 10.A O no hydrogen 3.061 N/A