Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5cgz_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A NZ TYR 30.A OH no hydrogen 3.300 N/A LYS 2.A NZ GLU 108.A OE1 no hydrogen 3.184 N/A LYS 2.A NZ GLU 108.A OE2 no hydrogen 2.849 N/A SER 3.A OG.A VAL 105.A O no hydrogen 2.520 N/A SER 3.A OG.B ALA 31.A O no hydrogen 2.462 N/A ALA 4.A N ALA 31.A O no hydrogen 3.218 N/A LEU 5.A N PHE 109.A O no hydrogen 3.058 N/A VAL 6.A N HIS 33.A O no hydrogen 2.878 N/A VAL 7.A N LEU 111.A O no hydrogen 2.826 N/A SER 8.A N VAL 35.A O no hydrogen 2.795 N/A SER 8.A OG HIS 10.A O no hydrogen 2.530 N/A ALA 9.A N HIS 113.A NE2 no hydrogen 2.944 N/A HIS 10.A N ASP 13.A OD1 no hydrogen 3.315 N/A HIS 10.A ND1 ASP 13.A OD1 no hydrogen 3.091 N/A HIS 10.A NE2 ASP 122.A OD2 no hydrogen 2.881 N/A SER 11.A OG PHE 39.A O no hydrogen 2.990 N/A ASP 13.A N HIS 10.A O no hydrogen 3.143 N/A VAL 15.A N ALA 12.A O no hydrogen 2.953 N/A TRP 16.A N ALA 12.A O no hydrogen 3.338 N/A ARG 17.A N ASP 13.A O no hydrogen 3.028 N/A ARG 17.A NE ASP 13.A OD2 no hydrogen 2.939 N/A ARG 17.A NH1 GLU 158.A O no hydrogen 3.033 N/A ARG 17.A NH1 TYR 199.A OH no hydrogen 2.652 N/A ARG 17.A NH2 ASP 13.A OD2 no hydrogen 3.400 N/A ALA 18.A N PHE 14.A O no hydrogen 2.981 N/A GLY 20.A N GLU 226.A OE2 no hydrogen 2.739 N/A ALA 21.A N GLU 226.A OE1 no hydrogen 2.855 N/A ILE 22.A N ALA 18.A O no hydrogen 2.890 N/A ALA 23.A N GLY 19.A O no hydrogen 3.007 N/A LEU 24.A N GLY 20.A O no hydrogen 2.841 N/A HIS 25.A N ALA 21.A O no hydrogen 3.117 N/A HIS 25.A ND1 ALA 21.A O no hydrogen 2.801 N/A ALA 26.A N ILE 22.A O no hydrogen 2.969 N/A GLU 27.A N ALA 23.A O no hydrogen 3.230 N/A GLN 28.A N HIS 25.A O no hydrogen 2.894 N/A GLY 29.A N ALA 26.A O no hydrogen 2.973 N/A TYR 30.A N HIS 25.A O no hydrogen 3.053 N/A TYR 30.A OH GLU 108.A OE1 no hydrogen 2.747 N/A ALA 31.A N LYS 2.A O no hydrogen 2.704 N/A HIS 33.A N ALA 4.A O no hydrogen 2.956 N/A HIS 33.A ND1 SER 77.A OG no hydrogen 2.737 N/A HIS 33.A NE2 GLU 79.A OE1 no hydrogen 2.533 N/A VAL 34.A N SER 77.A O no hydrogen 2.803 N/A VAL 35.A N VAL 6.A O no hydrogen 2.836 N/A CYS 36.A N GLU 79.A O no hydrogen 2.937 N/A CYS 36.A SG SER 11.A O no hydrogen 3.937 N/A LEU 37.A N SER 8.A O no hydrogen 2.850 N/A SER 38.A N ALA 9.A O no hydrogen 2.974 N/A SER 38.A OG ALA 9.A O no hydrogen 2.834 N/A PHE 39.A N GLU 41.A OE1 no hydrogen 2.914 N/A GLY 40.A N SER 38.A OG no hydrogen 3.398 N/A GLU 41.A N GLU 41.A OE1 no hydrogen 2.725 N/A ARG 42.A N ASP 85.A OD1 no hydrogen 2.973 N/A ARG 42.A N ASP 85.A OD2 no hydrogen 3.083 N/A ARG 42.A NE ASP 85.A O no hydrogen 2.916 N/A ARG 42.A NE TYR 86.A O no hydrogen 3.047 N/A ARG 42.A NH1 GLU 56.A OE2 no hydrogen 2.920 N/A ARG 42.A NH2 TYR 86.A O no hydrogen 2.908 N/A GLY 43.A N ASP 85.A OD2 no hydrogen 2.889 N/A GLU 44.A N.A GLY 40.A O no hydrogen 2.955 N/A GLU 44.A N.B GLY 40.A O no hydrogen 2.946 N/A SER 45.A OG GLY 40.A O no hydrogen 2.894 N/A LYS 47.A NZ GLY 191.A O no hydrogen 3.502 N/A TRP 49.A N SER 45.A O no hydrogen 3.173 N/A TRP 49.A NE1 GLU 41.A O no hydrogen 2.700 N/A ARG 50.A N ALA 46.A O no hydrogen 3.051 N/A ARG 50.A N LYS 47.A O no hydrogen 3.271 N/A LYS 51.A N LEU 48.A O no hydrogen 2.999 N/A LYS 58.A N THR 55.A OG1 no hydrogen 3.040 N/A LYS 58.A NZ GLU 53.A O no hydrogen 2.764 N/A VAL 59.A N THR 55.A O no hydrogen 2.876 N/A LYS 60.A N GLU 56.A O no hydrogen 2.806 N/A LYS 60.A NZ ASP 82.A OD1 no hydrogen 2.899 N/A LYS 60.A NZ ASP 82.A OD2 no hydrogen 3.442 N/A ASP 61.A N ALA 57.A O no hydrogen 3.068 N/A ALA 62.A N LYS 58.A O no hydrogen 3.121 N/A ARG 63.A N VAL 59.A O no hydrogen 2.856 N/A ARG 63.A NE GLU 66.A OE1 no hydrogen 3.035 N/A ARG 63.A NH1 SER 45.A OG no hydrogen 2.751 N/A ARG 63.A NH2 GLU 66.A OE1 no hydrogen 3.081 N/A ARG 63.A NH2 GLU 66.A OE2 no hydrogen 3.247 N/A ARG 64.A N LYS 60.A O no hydrogen 2.763 N/A ARG 64.A NH1 ASP 61.A OD1 no hydrogen 2.688 N/A GLU 65.A N.A ASP 61.A O no hydrogen 3.088 N/A GLU 65.A N.B ASP 61.A O no hydrogen 3.069 N/A GLU 66.A N ALA 62.A O no hydrogen 3.119 N/A ALA 67.A N ARG 63.A O no hydrogen 2.989 N/A MET 68.A N ARG 64.A O no hydrogen 2.978 N/A ALA 69.A N GLU 65.A O.A no hydrogen 2.997 N/A ALA 69.A N GLU 65.A O.B no hydrogen 2.977 N/A ALA 70.A N GLU 66.A O no hydrogen 2.881 N/A ALA 71.A N ALA 67.A O no hydrogen 2.809 N/A GLU 72.A N.A MET 68.A O no hydrogen 3.101 N/A GLU 72.A N.B MET 68.A O no hydrogen 3.127 N/A ILE 73.A N ALA 69.A O no hydrogen 3.179 N/A LEU 74.A N ALA 70.A O no hydrogen 2.921 N/A GLY 75.A N ALA 71.A O no hydrogen 2.851 N/A ALA 76.A N ALA 71.A O no hydrogen 2.893 N/A SER 77.A N MET 32.A O no hydrogen 2.907 N/A SER 77.A OG MET 32.A O no hydrogen 3.531 N/A SER 77.A OG HIS 33.A ND1 no hydrogen 2.737 N/A GLU 79.A N VAL 34.A O no hydrogen 2.857 N/A PHE 81.A N CYS 36.A O no hydrogen 3.007 N/A ILE 83.A N LEU 37.A O no hydrogen 2.914 N/A TYR 86.A N ASP 122.A OD2 no hydrogen 2.929 N/A TYR 86.A OH GLU 44.A OE2.B no hydrogen 3.302 N/A MET 88.A N ASP 122.A OD1 no hydrogen 2.937 N/A ARG 89.A NH1 MET 88.A O no hydrogen 3.027 N/A ASP 91.A N THR 94.A OG1 no hydrogen 3.162 N/A THR 94.A N ASP 91.A OD1 no hydrogen 3.080 N/A THR 94.A OG1 ASP 91.A OD1 no hydrogen 3.197 N/A LEU 95.A N ASP 91.A O no hydrogen 3.118 N/A PHE 96.A N LYS 92.A O no hydrogen 2.855 N/A ARG 97.A N ASP 93.A O no hydrogen 2.889 N/A ARG 97.A NH1.B PHE 81.A O no hydrogen 2.638 N/A LEU 98.A N THR 94.A O no hydrogen 2.970 N/A ALA 99.A N LEU 95.A O no hydrogen 2.854 N/A ASP 100.A N PHE 96.A O no hydrogen 2.871 N/A VAL 101.A N ARG 97.A O no hydrogen 3.182 N/A TYR 102.A N LEU 98.A O no hydrogen 3.046 N/A TYR 102.A OH ALA 130.A O no hydrogen 2.718 N/A ARG 103.A N ALA 99.A O no hydrogen 2.947 N/A ARG 103.A NE ALA 137.A O no hydrogen 2.779 N/A ARG 103.A NH1 TYR 142.A O no hydrogen 2.884 N/A ARG 103.A NH1 GLU 146.A OE1 no hydrogen 2.920 N/A ARG 103.A NH2 ALA 137.A O no hydrogen 3.154 N/A ARG 103.A NH2 TYR 142.A O no hydrogen 2.943 N/A ARG 104.A N ASP 100.A O no hydrogen 2.981 N/A ARG 104.A NH2 GLU 79.A OE1 no hydrogen 2.824 N/A VAL 105.A N VAL 101.A O no hydrogen 2.788 N/A GLN 106.A N TYR 102.A O no hydrogen 2.769 N/A GLN 106.A NE2 ARG 103.A O no hydrogen 3.135 N/A GLN 106.A NE2 LYS 147.A O no hydrogen 3.233 N/A GLN 106.A NE2 ILE 148.A O no hydrogen 3.580 N/A GLU 108.A N SER 3.A O.A no hydrogen 2.754 N/A GLU 108.A N SER 3.A O.B no hydrogen 2.621 N/A VAL 110.A N PRO 153.A O no hydrogen 2.836 N/A LEU 111.A N LEU 5.A O no hydrogen 2.891 N/A SER 112.A N TYR 155.A O no hydrogen 2.913 N/A SER 112.A OG VAL 7.A O no hydrogen 2.748 N/A SER 114.A OG LYS 116.A O no hydrogen 2.675 N/A LYS 116.A NZ GLU 166.A OE1 no hydrogen 3.267 N/A TYR 119.A N ASP 117.A OD1 no hydrogen 2.908 N/A ASN 120.A N ASP 117.A O no hydrogen 3.241 N/A ASN 120.A ND2 GLU 44.A OE2.B no hydrogen 3.208 N/A ASP 122.A N ASN 120.A OD1 no hydrogen 3.111 N/A HIS 123.A N ASN 120.A O no hydrogen 3.227 N/A HIS 123.A ND1 ASP 117.A OD2 no hydrogen 2.767 N/A ALA 126.A N ASP 122.A O no hydrogen 3.104 N/A MET 127.A N HIS 123.A O no hydrogen 3.281 N/A HIS 128.A N PRO 124.A O no hydrogen 2.846 N/A LEU 129.A N LEU 125.A O no hydrogen 2.862 N/A ALA 130.A N ALA 126.A O no hydrogen 2.915 N/A GLN 131.A N MET 127.A O no hydrogen 2.864 N/A GLU 132.A N HIS 128.A O no hydrogen 2.888 N/A ALA 133.A N LEU 129.A O no hydrogen 2.832 N/A ARG 134.A N ALA 130.A O no hydrogen 3.163 N/A ARG 134.A NE PRO 152.A O no hydrogen 2.820 N/A ARG 134.A NH2 PRO 152.A O no hydrogen 2.965 N/A ILE 135.A N GLN 131.A O no hydrogen 3.200 N/A ILE 136.A N GLU 132.A O no hydrogen 2.925 N/A ALA 137.A N ALA 133.A O no hydrogen 2.946 N/A GLN 138.A N ILE 135.A O no hydrogen 2.962 N/A GLN 138.A NE2 GLY 150.A O no hydrogen 2.817 N/A ALA 139.A N ILE 136.A O no hydrogen 2.966 N/A TYR 142.A N ALA 139.A O no hydrogen 2.923 N/A TYR 142.A OH ASP 100.A OD1 no hydrogen 2.669 N/A LYS 143.A NZ ASP 100.A OD1 no hydrogen 3.252 N/A LYS 143.A NZ ASP 100.A OD2 no hydrogen 3.173 N/A GLU 146.A N LYS 143.A O no hydrogen 3.159 N/A VAL 149.A N ALA 137.A O no hydrogen 2.957 N/A TYR 155.A N VAL 110.A O no hydrogen 2.830 N/A ALA 156.A N GLN 229.A O no hydrogen 2.806 N/A PHE 157.A N SER 112.A O no hydrogen 2.819 N/A HIS 160.A ND1 TYR 199.A OH no hydrogen 2.859 N/A GLU 163.A N GLU 163.A OE1 no hydrogen 2.912 N/A CYS 165.A N GLN 161.A O no hydrogen 3.123 N/A CYS 165.A N PRO 162.A O no hydrogen 3.034 N/A CYS 165.A SG GLN 161.A O no hydrogen 3.320 N/A GLU 166.A N GLU 163.A O no hydrogen 2.965 N/A TRP 167.A N PRO 162.A O no hydrogen 3.058 N/A TRP 167.A NE1 ALA 156.A O no hydrogen 3.017 N/A ARG 168.A N GLN 229.A OE1 no hydrogen 3.067 N/A ASP 170.A N LEU 228.A O no hydrogen 2.916 N/A THR 171.A N LEU 228.A O no hydrogen 3.093 N/A THR 171.A OG1 ASP 170.A OD1 no hydrogen 2.750 N/A LEU 173.A N GLU 226.A O no hydrogen 2.813 N/A ILE 175.A N TYR 224.A O no hydrogen 2.960 N/A THR 176.A N ASP 174.A OD1 no hydrogen 2.954 N/A THR 176.A OG1 ASP 174.A OD1 no hydrogen 2.703 N/A THR 176.A OG1 TYR 224.A O no hydrogen 3.386 N/A VAL 178.A N ILE 175.A O no hydrogen 2.956 N/A TRP 179.A N THR 176.A O no hydrogen 3.434 N/A LYS 181.A NZ GLU 27.A OE2 no hydrogen 2.744 N/A LYS 182.A N VAL 178.A O no hydrogen 3.087 N/A LYS 182.A NZ TRP 16.A O no hydrogen 2.830 N/A LYS 182.A NZ GLU 226.A OE2 no hydrogen 2.661 N/A TYR 183.A N TRP 179.A O no hydrogen 2.822 N/A ALA 184.A N ASP 180.A O no hydrogen 2.925 N/A ALA 185.A N LYS 181.A O no hydrogen 2.902 N/A ILE 186.A N LYS 182.A O no hydrogen 2.820 N/A GLN 187.A N TYR 183.A O no hydrogen 2.957 N/A CYS 188.A N ALA 185.A O no hydrogen 2.972 N/A CYS 188.A SG ALA 184.A O no hydrogen 3.718 N/A MET 189.A N ILE 186.A O no hydrogen 2.913 N/A ALA 190.A N CYS 188.A O no hydrogen 2.804 N/A GLN 192.A N MET 189.A O no hydrogen 3.242 N/A GLU 193.A N GLU 193.A OE1 no hydrogen 2.603 N/A TRP 196.A N GLN 192.A O no hydrogen 3.053 N/A TRP 196.A NE1 MET 189.A O no hydrogen 3.042 N/A GLU 197.A N GLU 193.A O no hydrogen 3.032 N/A TYR 198.A N HIS 194.A O no hydrogen 2.932 N/A TYR 198.A OH HIS 160.A O no hydrogen 2.582 N/A TYR 199.A N LEU 195.A O no hydrogen 2.946 N/A TYR 199.A OH HIS 160.A ND1 no hydrogen 2.859 N/A THR 200.A N TRP 196.A O no hydrogen 3.023 N/A THR 200.A OG1 TRP 196.A O no hydrogen 2.761 N/A ARG 201.A N GLU 197.A O no hydrogen 2.977 N/A VAL 202.A N TYR 198.A O no hydrogen 2.907 N/A ALA 203.A N TYR 199.A O no hydrogen 3.116 N/A LEU 204.A N THR 200.A O no hydrogen 3.030 N/A GLN 205.A N ARG 201.A O no hydrogen 2.820 N/A ARG 206.A N VAL 202.A O no hydrogen 2.871 N/A ARG 206.A NE GLU 158.A OE1 no hydrogen 2.833 N/A ARG 206.A NE GLU 158.A OE2 no hydrogen 3.346 N/A ARG 206.A NH1 GLN 209.A OE1 no hydrogen 2.859 N/A ARG 206.A NH2 GLU 158.A OE2 no hydrogen 2.826 N/A GLY 207.A N ALA 203.A O no hydrogen 2.835 N/A VAL 208.A N LEU 204.A O no hydrogen 3.025 N/A GLN 209.A N GLN 205.A O no hydrogen 3.035 N/A ALA 210.A N ARG 206.A O no hydrogen 2.781 N/A LYS 211.A N GLY 207.A O no hydrogen 2.973 N/A LYS 211.A NZ SER 218.A O no hydrogen 3.115 N/A LYS 211.A NZ ARG 220.A O no hydrogen 3.080 N/A ARG 212.A N VAL 208.A O no hydrogen 2.926 N/A ASN 213.A N GLN 209.A O no hydrogen 3.072 N/A ASN 213.A N ALA 210.A O no hydrogen 2.938 N/A ASN 213.A ND2 GLN 209.A O no hydrogen 2.746 N/A VAL 214.A N LYS 211.A O no hydrogen 3.033 N/A GLY 215.A N ARG 212.A O no hydrogen 3.294 N/A SER 218.A N GLY 215.A O no hydrogen 2.946 N/A ARG 220.A N SER 218.A OG no hydrogen 2.993 N/A VAL 223.A N THR 176.A OG1 no hydrogen 2.857 N/A TYR 224.A N THR 176.A OG1 no hydrogen 3.101 N/A ALA 225.A N ALA 203.A O no hydrogen 3.157 N/A GLU 226.A N LEU 173.A O no hydrogen 2.944 N/A LEU 228.A N THR 171.A O no hydrogen 2.792 N/A GLN 229.A N ALA 156.A O no hydrogen 2.904 N/A SER 230.A N ASP 170.A OD1 no hydrogen 3.325 N/A SER 230.A N ASP 170.A OD2 no hydrogen 2.925 N/A SER 230.A OG ASP 170.A OD1 no hydrogen 2.709 N/A SER 230.A OG ASP 170.A OD2 no hydrogen 3.559 N/A VAL 231.A N VAL 154.A O no hydrogen 2.842 N/A THR 236.A OG1 ASN 238.A O no hydrogen 3.192 N/A ASN 238.A N THR 236.A OG1 no hydrogen 3.091 N/A ALA 240.A N ASN 238.A OD1 no hydrogen 2.945 N/A