Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pg8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 5.A N GLU 148.A OE1 no hydrogen 3.018 N/A LEU 5.A N GLU 148.A OE2 no hydrogen 3.000 N/A VAL 6.A N GLU 148.A OE1 no hydrogen 3.011 N/A SER 7.A N.A PHE 3.A O no hydrogen 2.721 N/A SER 7.A N.B PHE 3.A O no hydrogen 2.716 N/A ARG 8.A N GLU 187.A O no hydrogen 2.925 N/A ARG 8.A NE ARG 185.A O no hydrogen 2.828 N/A ARG 8.A NH1 PRO 12.A O no hydrogen 2.786 N/A ARG 8.A NH1 ASP 14.A OD1 no hydrogen 2.830 N/A ARG 8.A NH2 ASP 14.A OD1 no hydrogen 2.731 N/A ARG 8.A NH2 ARG 185.A O no hydrogen 2.881 N/A GLU 9.A N SER 7.A OG.A no hydrogen 3.190 N/A GLU 9.A N SER 7.A OG.B no hydrogen 2.953 N/A HIS 11.A N ARG 8.A O no hydrogen 3.056 N/A HIS 11.A ND1 HIS 11.A O no hydrogen 2.731 N/A THR 15.A N HIS 189.A O no hydrogen 2.832 N/A THR 15.A OG1 HIS 189.A ND1 no hydrogen 2.544 N/A ILE 17.A N ILE 24.A O no hydrogen 2.797 N/A LEU 19.A N VAL 22.A O no hydrogen 2.825 N/A GLY 20.A N ASP 18.A OD1 no hydrogen 2.697 N/A ASP 21.A N TYR 86.A OH no hydrogen 2.818 N/A LYS 23.A NZ ASP 18.A OD1 no hydrogen 3.419 N/A ILE 24.A N ILE 17.A O no hydrogen 2.762 N/A TYR 28.A N GLY 25.A O no hydrogen 2.961 N/A PHE 29.A N LYS 262.A O no hydrogen 2.778 N/A THR 30.A N HIS 219.A O no hydrogen 2.870 N/A THR 30.A OG1 ASN 264.A OD1 no hydrogen 2.774 N/A ILE 31.A N ASN 264.A OXT no hydrogen 2.865 N/A ILE 32.A N ILE 221.A O no hydrogen 2.905 N/A ALA 33.A N VAL 57.A O no hydrogen 3.086 N/A GLY 34.A N VAL 223.A O no hydrogen 3.146 N/A ARG 40.A NE GLU 78.A OE2 no hydrogen 2.967 N/A LEU 43.A N GLY 39.A O no hydrogen 3.228 N/A MET 44.A N ARG 40.A O no hydrogen 2.768 N/A GLU 45.A N GLU 41.A O no hydrogen 2.898 N/A THR 46.A N MET 42.A O no hydrogen 3.202 N/A THR 46.A OG1 MET 42.A O no hydrogen 2.852 N/A ALA 47.A N LEU 43.A O no hydrogen 2.930 N/A HIS 48.A N MET 44.A O no hydrogen 2.907 N/A PHE 49.A N GLU 45.A O no hydrogen 2.940 N/A LEU 50.A N THR 46.A O no hydrogen 2.829 N/A SER 51.A N ALA 47.A O no hydrogen 2.824 N/A SER 51.A OG ALA 47.A O no hydrogen 3.054 N/A SER 51.A OG HIS 48.A O no hydrogen 3.115 N/A GLU 52.A N HIS 48.A O no hydrogen 3.180 N/A LEU 53.A N LEU 50.A O no hydrogen 2.980 N/A GLY 54.A N SER 51.A O no hydrogen 3.026 N/A VAL 55.A N LEU 50.A O no hydrogen 3.073 N/A LYS 56.A NZ GLY 84.A O no hydrogen 2.887 N/A LEU 58.A N TYR 86.A O no hydrogen 2.816 N/A ARG 59.A N ALA 33.A O no hydrogen 2.978 N/A ARG 59.A NH1 GLY 34.A O no hydrogen 2.999 N/A TYR 63.A N GLU 90.A O no hydrogen 2.970 N/A LYS 71.A N LEU 68.A O no hydrogen 3.164 N/A GLY 72.A N GLY 69.A O no hydrogen 2.909 N/A GLU 74.A N GLU 70.A O no hydrogen 3.164 N/A TYR 75.A N LYS 71.A O no hydrogen 3.022 N/A LEU 76.A N GLY 72.A O no hydrogen 2.864 N/A ARG 77.A N LEU 73.A O no hydrogen 2.912 N/A ARG 77.A NE ARG 77.A O no hydrogen 3.432 N/A ARG 77.A NE ASP 81.A OD1 no hydrogen 3.023 N/A ARG 77.A NH1 TYR 103.A O no hydrogen 2.926 N/A ARG 77.A NH1 ASP 105.A OD2 no hydrogen 2.882 N/A ARG 77.A NH2 ASP 81.A OD1 no hydrogen 3.014 N/A GLU 78.A N GLU 74.A O no hydrogen 2.832 N/A ALA 79.A N TYR 75.A O no hydrogen 2.952 N/A ALA 80.A N LEU 76.A O no hydrogen 3.167 N/A ASP 81.A N ARG 77.A O no hydrogen 2.946 N/A LYS 82.A N GLU 78.A O no hydrogen 3.009 N/A TYR 83.A N ALA 79.A O no hydrogen 3.223 N/A TYR 83.A N ALA 80.A O no hydrogen 3.185 N/A MET 85.A N ALA 80.A O no hydrogen 2.763 N/A TYR 86.A N LYS 56.A O no hydrogen 2.789 N/A TYR 86.A OH LEU 19.A O no hydrogen 3.006 N/A VAL 87.A N ASP 105.A OD2 no hydrogen 2.641 N/A VAL 88.A N.A LEU 58.A O no hydrogen 2.876 N/A VAL 88.A N.B LEU 58.A O no hydrogen 2.853 N/A THR 89.A N ILE 106.A O no hydrogen 3.211 N/A GLU 90.A N GLY 61.A O no hydrogen 3.125 N/A ALA 91.A N GLN 108.A O no hydrogen 3.042 N/A ASP 96.A N GLY 93.A O no hydrogen 2.982 N/A LEU 97.A N GLU 94.A O no hydrogen 3.250 N/A LYS 99.A NZ GLU 70.A OE1 no hydrogen 2.705 N/A VAL 100.A N ASP 96.A O no hydrogen 2.882 N/A ALA 101.A N LEU 97.A O no hydrogen 2.731 N/A GLU 102.A N LYS 99.A O no hydrogen 3.103 N/A TYR 103.A N VAL 100.A O no hydrogen 3.200 N/A ALA 104.A N VAL 100.A O no hydrogen 3.001 N/A ASP 105.A N VAL 87.A O no hydrogen 2.827 N/A ILE 106.A N VAL 87.A O no hydrogen 2.968 N/A ILE 107.A N PRO 129.A O no hydrogen 3.044 N/A GLN 108.A N THR 89.A O no hydrogen 2.829 N/A GLN 108.A NE2 GLU 90.A OE1 no hydrogen 3.092 N/A ILE 109.A N LEU 131.A O no hydrogen 2.753 N/A ASN 113.A N GLY 110.A O no hydrogen 2.793 N/A ASN 113.A ND2 LEU 92.A O no hydrogen 3.225 N/A ALA 114.A N ALA 111.A O no hydrogen 3.221 N/A GLN 115.A NE2 ASN 138.A OD1 no hydrogen 2.849 N/A GLN 115.A NE2 SER 146.A OG no hydrogen 2.869 N/A ASN 116.A N ASN 113.A O no hydrogen 2.995 N/A ASN 116.A ND2 ASN 113.A OD1 no hydrogen 3.066 N/A LEU 119.A N ASN 116.A OD1 no hydrogen 3.304 N/A LEU 120.A N ASN 116.A O no hydrogen 2.944 N/A SER 121.A N PHE 117.A O no hydrogen 3.043 N/A SER 121.A OG PHE 117.A O no hydrogen 3.195 N/A SER 121.A OG ARG 118.A O no hydrogen 3.177 N/A LYS 122.A N ARG 118.A O no hydrogen 3.129 N/A LYS 122.A NZ GLU 94.A OE2 no hydrogen 3.048 N/A ALA 123.A N LEU 119.A O no hydrogen 2.826 N/A GLY 124.A N LEU 120.A O no hydrogen 3.052 N/A SER 125.A N LYS 122.A O no hydrogen 2.948 N/A SER 125.A OG LYS 122.A O no hydrogen 2.529 N/A ASN 127.A N GLY 124.A O no hydrogen 3.276 N/A LYS 128.A NZ ALA 101.A O no hydrogen 2.666 N/A LYS 128.A NZ ALA 104.A O no hydrogen 2.706 N/A VAL 130.A N LYS 157.A O no hydrogen 2.828 N/A LEU 131.A N ILE 107.A O no hydrogen 2.813 N/A LEU 132.A N ILE 159.A O no hydrogen 2.757 N/A LYS 133.A N ILE 109.A O no hydrogen 3.076 N/A LYS 133.A NZ ASP 195.A OD2 no hydrogen 2.818 N/A ARG 134.A N CYS 161.A O no hydrogen 3.058 N/A ARG 134.A NE ASN 138.A O no hydrogen 2.844 N/A ARG 134.A NH1 GLU 162.A OE1 no hydrogen 2.760 N/A ARG 134.A NH1 ASP 177.A OD2 no hydrogen 2.935 N/A ARG 134.A NH2 ASN 138.A O no hydrogen 2.843 N/A GLY 135.A N ASN 138.A OD1 no hydrogen 2.959 N/A ASN 138.A N GLY 135.A O no hydrogen 2.966 N/A ASN 138.A ND2 GLN 115.A OE1 no hydrogen 2.990 N/A THR 139.A N GLU 142.A OE1 no hydrogen 2.884 N/A GLU 142.A N THR 139.A OG1 no hydrogen 3.115 N/A PHE 143.A N THR 139.A O no hydrogen 2.995 N/A LEU 144.A N ILE 140.A O no hydrogen 2.928 N/A LEU 145.A N GLU 141.A O no hydrogen 2.840 N/A SER 146.A N GLU 142.A O no hydrogen 3.092 N/A SER 146.A OG ALA 114.A O no hydrogen 2.675 N/A ALA 147.A N PHE 143.A O no hydrogen 3.100 N/A GLU 148.A N LEU 144.A O no hydrogen 2.830 N/A TYR 149.A N LEU 145.A O no hydrogen 2.914 N/A ILE 150.A N SER 146.A O no hydrogen 3.157 N/A ALA 151.A N ALA 147.A O no hydrogen 2.992 N/A ASN 152.A N GLU 148.A O no hydrogen 2.703 N/A SER 153.A N TYR 149.A O no hydrogen 3.014 N/A SER 153.A N ILE 150.A O no hydrogen 3.072 N/A SER 153.A OG ILE 150.A O no hydrogen 2.776 N/A GLY 154.A N ALA 151.A O no hydrogen 3.151 N/A ASN 155.A N ILE 150.A O no hydrogen 3.405 N/A ASN 155.A ND2 GLY 124.A O no hydrogen 2.923 N/A ASN 155.A ND2 LYS 128.A O no hydrogen 2.840 N/A LYS 157.A N ASN 155.A OD1 no hydrogen 2.873 N/A ILE 159.A N VAL 130.A O no hydrogen 2.824 N/A LEU 160.A N PRO 191.A O no hydrogen 2.916 N/A CYS 161.A N LEU 132.A O no hydrogen 2.995 N/A CYS 161.A SG GLU 162.A O no hydrogen 3.726 N/A CYS 161.A SG LEU 193.A O no hydrogen 3.990 N/A GLU 162.A N LEU 193.A O no hydrogen 2.860 N/A ARG 163.A NH2 GLY 164.A O no hydrogen 3.165 N/A GLY 164.A N GLU 162.A OE2 no hydrogen 2.876 N/A ILE 165.A N THR 175.A O no hydrogen 2.854 N/A ARG 166.A N PHE 136.A O no hydrogen 2.900 N/A ARG 166.A NH1 ASN 174.A OD1 no hydrogen 2.772 N/A ARG 166.A NH2 ASN 174.A OD1 no hydrogen 2.871 N/A THR 167.A OG1 THR 175.A OG1 no hydrogen 2.729 N/A GLU 169.A N THR 167.A OG1 no hydrogen 3.090 N/A THR 172.A OG1 ASN 174.A O no hydrogen 2.764 N/A ARG 173.A N GLY 200.A O no hydrogen 3.058 N/A ASN 174.A N SER 199.A O no hydrogen 2.980 N/A ASN 174.A ND2 HIS 198.A O no hydrogen 3.133 N/A ASN 174.A ND2 SER 199.A O no hydrogen 3.607 N/A THR 175.A N ILE 165.A O no hydrogen 2.881 N/A THR 175.A OG1 THR 167.A OG1 no hydrogen 2.729 N/A ASP 177.A N GLU 162.A OE2 no hydrogen 2.947 N/A SER 179.A OG.A ASP 177.A OD1 no hydrogen 3.053 N/A ALA 180.A N ASP 177.A O no hydrogen 3.028 N/A VAL 181.A N ILE 178.A O no hydrogen 3.122 N/A ILE 183.A N SER 179.A O.A no hydrogen 3.301 N/A ILE 183.A N SER 179.A O.B no hydrogen 3.203 N/A ILE 184.A N ALA 180.A O no hydrogen 2.904 N/A ARG 185.A N VAL 181.A O no hydrogen 2.843 N/A ARG 185.A NH1 GLY 217.A O no hydrogen 2.680 N/A LYS 186.A N PRO 182.A O no hydrogen 3.088 N/A GLU 187.A N ILE 183.A O no hydrogen 3.006 N/A SER 188.A N ILE 184.A O no hydrogen 2.752 N/A SER 188.A OG VAL 6.A O no hydrogen 2.662 N/A HIS 189.A N VAL 6.A O no hydrogen 3.432 N/A HIS 189.A ND1 THR 15.A OG1 no hydrogen 2.544 N/A HIS 189.A NE2 LEU 5.A O no hydrogen 2.861 N/A LEU 190.A N SER 188.A OG no hydrogen 3.172 N/A ILE 192.A N HIS 219.A ND1 no hydrogen 3.035 N/A LEU 193.A N LEU 160.A O no hydrogen 2.681 N/A VAL 194.A N GLY 220.A O no hydrogen 3.016 N/A ASP 195.A N GLU 162.A O no hydrogen 2.889 N/A SER 197.A N ASP 195.A OD1 no hydrogen 2.896 N/A HIS 198.A N ASP 195.A OD1 no hydrogen 2.847 N/A HIS 198.A ND1 ASP 195.A OD2 no hydrogen 2.635 N/A SER 199.A OG ASP 195.A O no hydrogen 2.705 N/A GLY 201.A N SER 197.A O no hydrogen 3.151 N/A ARG 202.A NE ASP 204.A OD2 no hydrogen 3.173 N/A ARG 202.A NH1 ALA 171.A O no hydrogen 3.178 N/A ARG 202.A NH2 ASP 204.A OD1 no hydrogen 2.901 N/A ARG 203.A NE SER 239.A O no hydrogen 2.938 N/A ARG 203.A NH2 GLY 236.A O no hydrogen 2.781 N/A LEU 205.A N ARG 202.A O no hydrogen 3.135 N/A VAL 206.A N ARG 203.A O no hydrogen 3.225 N/A LEU 209.A N LEU 205.A O no hydrogen 2.919 N/A SER 210.A N VAL 206.A O no hydrogen 2.965 N/A SER 210.A OG VAL 206.A O no hydrogen 2.757 N/A ARG 211.A N ILE 207.A O no hydrogen 2.949 N/A ARG 211.A NH1 GLU 251.A OE2 no hydrogen 2.789 N/A ALA 212.A N PRO 208.A O no hydrogen 3.110 N/A ALA 213.A N LEU 209.A O no hydrogen 2.871 N/A ILE 214.A N SER 210.A O no hydrogen 2.963 N/A ALA 215.A N ARG 211.A O no hydrogen 2.933 N/A VAL 216.A N ALA 212.A O no hydrogen 2.821 N/A GLY 217.A N ALA 213.A O no hydrogen 3.286 N/A GLY 217.A N ILE 214.A O no hydrogen 3.260 N/A ALA 218.A N ALA 213.A O no hydrogen 2.885 N/A HIS 219.A N ILE 192.A O no hydrogen 2.870 N/A ILE 221.A N THR 30.A O no hydrogen 3.040 N/A ILE 222.A N VAL 194.A O no hydrogen 3.003 N/A VAL 223.A N ILE 32.A O no hydrogen 2.754 N/A GLU 224.A N SER 197.A OG no hydrogen 2.942 N/A VAL 225.A N GLY 34.A O no hydrogen 2.991 N/A HIS 226.A N LEU 240.A O no hydrogen 2.956 N/A HIS 226.A NE2 GLU 38.A OE1 no hydrogen 2.861 N/A GLU 228.A N HIS 226.A ND1 no hydrogen 2.848 N/A LYS 231.A N GLU 228.A O no hydrogen 2.724 N/A ALA 232.A N PRO 229.A O no hydrogen 3.134 N/A LEU 233.A N GLU 38.A OE1 no hydrogen 2.957 N/A SER 239.A OG LEU 240.A O no hydrogen 3.449 N/A LEU 240.A N GLU 224.A O no hydrogen 3.014 N/A LEU 244.A N ASP 241.A OD1 no hydrogen 2.819 N/A PHE 245.A N ASP 241.A O no hydrogen 2.965 N/A LYS 246.A N PHE 242.A O no hydrogen 2.957 N/A GLU 247.A N GLU 243.A O no hydrogen 3.184 N/A LEU 248.A N LEU 244.A O no hydrogen 2.983 N/A VAL 249.A N PHE 245.A O no hydrogen 2.982 N/A GLN 250.A N LYS 246.A O no hydrogen 3.127 N/A GLU 251.A N GLU 247.A O no hydrogen 2.941 N/A MET 252.A N LEU 248.A O no hydrogen 2.888 N/A LYS 253.A N VAL 249.A O no hydrogen 2.959 N/A LYS 253.A NZ LEU 53.A O no hydrogen 3.429 N/A LYS 254.A N GLN 250.A O no hydrogen 3.005 N/A LEU 255.A N GLU 251.A O no hydrogen 3.025 N/A ALA 256.A N MET 252.A O no hydrogen 2.755 N/A ASP 257.A N LYS 253.A O no hydrogen 3.158 N/A ALA 258.A N LYS 254.A O no hydrogen 3.451 N/A LEU 259.A N LEU 255.A O no hydrogen 2.989 N/A LEU 259.A N ALA 256.A O no hydrogen 3.187 N/A GLY 260.A N ASP 257.A O no hydrogen 3.415 N/A VAL 261.A N ALA 256.A O no hydrogen 3.009 N/A LYS 262.A N GLY 27.A O no hydrogen 2.928 N/A ASN 264.A N PHE 29.A O no hydrogen 2.941 N/A ASN 264.A ND2 LYS 23.A O no hydrogen 2.975 N/A