Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8fnd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 5.A N PHE 1.A O no hydrogen 2.531 N/A ALA 8.A N ILE 5.A O no hydrogen 2.846 N/A GLN 9.A N ILE 5.A O no hydrogen 3.027 N/A GLU 10.A N ASP 6.A O no hydrogen 3.354 N/A HIS 12.A N ALA 8.A O no hydrogen 2.756 N/A GLU 13.A N GLN 9.A O no hydrogen 2.811 N/A LYS 14.A NZ TYR 15.A OH no hydrogen 2.713 N/A HIS 16.A N HIS 12.A O no hydrogen 2.815 N/A ALA 21.A N ASN 18.A OD1 no hydrogen 3.113 N/A MET 22.A N ASN 18.A O no hydrogen 3.170 N/A ASP 25.A N ALA 21.A O no hydrogen 3.011 N/A LEU 28.A N ALA 23.A O no hydrogen 3.215 N/A VAL 32.A N PRO 29.A O no hydrogen 3.042 N/A ALA 33.A N PRO 29.A O no hydrogen 3.213 N/A LYS 34.A N PRO 30.A O no hydrogen 2.923 N/A GLU 35.A N VAL 31.A O no hydrogen 2.872 N/A ILE 36.A N VAL 32.A O no hydrogen 2.934 N/A VAL 37.A N ALA 33.A O no hydrogen 2.964 N/A ALA 38.A N LYS 34.A O no hydrogen 2.877 N/A SER 39.A N GLU 35.A O no hydrogen 3.120 N/A SER 39.A N ILE 36.A O no hydrogen 3.390 N/A SER 39.A OG GLU 35.A OE1 no hydrogen 3.482 N/A CYS 40.A N VAL 37.A O no hydrogen 3.245 N/A CYS 40.A SG HIS 12.A NE2 no hydrogen 3.399 N/A CYS 40.A SG HIS 16.A ND1 no hydrogen 3.065 N/A CYS 43.A N CYS 40.A O no hydrogen 3.360 N/A CYS 43.A SG HIS 12.A NE2 no hydrogen 3.489 N/A CYS 43.A SG HIS 16.A ND1 no hydrogen 3.591 N/A GLN 44.A N ASP 41.A O no hydrogen 3.352 N/A LYS 46.A NZ GLY 47.A O no hydrogen 3.554 N/A MET 50.A N GLU 48.A O no hydrogen 3.198 N/A SER 57.A N ASP 55.A OD1 no hydrogen 3.005 N/A SER 57.A OG ASP 55.A OD1 no hydrogen 2.812 N/A ILE 60.A N SER 57.A O no hydrogen 3.150 N/A TRP 61.A N THR 112.A O no hydrogen 2.979 N/A GLN 62.A N VAL 77.A O no hydrogen 3.133 N/A LEU 63.A N HIS 114.A O no hydrogen 2.990 N/A ASP 64.A N VAL 75.A O no hydrogen 3.009 N/A THR 66.A N ILE 73.A O no hydrogen 2.818 N/A LEU 68.A N LYS 71.A O no hydrogen 3.023 N/A LYS 71.A N LEU 68.A O no hydrogen 2.929 N/A ILE 73.A N THR 66.A O no hydrogen 2.713 N/A LEU 74.A N GLU 87.A O no hydrogen 2.873 N/A VAL 75.A N ASP 64.A O no hydrogen 2.933 N/A ALA 76.A N GLU 85.A O no hydrogen 2.650 N/A VAL 77.A N GLN 62.A O no hydrogen 3.067 N/A HIS 78.A N TYR 83.A O no hydrogen 2.714 N/A HIS 78.A ND1 SER 81.A OG no hydrogen 2.169 N/A HIS 78.A NE2 PRO 58.A O no hydrogen 2.285 N/A VAL 79.A N ILE 60.A O no hydrogen 3.336 N/A SER 81.A N HIS 78.A O no hydrogen 3.152 N/A SER 81.A OG HIS 78.A ND1 no hydrogen 2.169 N/A GLY 82.A N HIS 78.A O no hydrogen 2.532 N/A ILE 84.A N ASN 184.A OD1 no hydrogen 3.161 N/A GLU 85.A N ALA 76.A O no hydrogen 2.913 N/A GLU 87.A N LEU 74.A O no hydrogen 3.092 N/A ILE 89.A N VAL 72.A O no hydrogen 2.689 N/A THR 97.A N THR 93.A O no hydrogen 3.037 N/A THR 97.A OG1 THR 93.A O no hydrogen 3.210 N/A ALA 98.A N GLY 94.A O no hydrogen 2.883 N/A TYR 99.A N GLN 95.A O no hydrogen 2.951 N/A PHE 100.A N GLU 96.A O no hydrogen 2.900 N/A LEU 101.A N THR 97.A O no hydrogen 2.874 N/A LEU 102.A N ALA 98.A O no hydrogen 2.880 N/A LYS 103.A N TYR 99.A O no hydrogen 2.955 N/A LEU 104.A N PHE 100.A O no hydrogen 2.912 N/A ALA 105.A N LEU 101.A O no hydrogen 2.863 N/A GLY 106.A N LEU 102.A O no hydrogen 2.928 N/A ARG 107.A N LYS 103.A O no hydrogen 2.979 N/A ARG 107.A N LEU 104.A O no hydrogen 3.075 N/A TRP 108.A N LEU 104.A O no hydrogen 2.972 N/A LYS 111.A N GLY 59.A O no hydrogen 3.223 N/A THR 112.A N GLY 59.A O no hydrogen 3.023 N/A THR 112.A OG1 LYS 111.A O no hydrogen 3.009 N/A VAL 113.A N LYS 136.A O no hydrogen 2.947 N/A HIS 114.A N TRP 61.A O no hydrogen 2.627 N/A THR 115.A N LYS 138.A O no hydrogen 3.277 N/A ASN 117.A ND2 GLY 140.A O no hydrogen 2.859 N/A GLY 118.A N ASP 116.A OD1 no hydrogen 3.096 N/A ASN 120.A ND2 THR 97.A OG1 no hydrogen 3.170 N/A THR 122.A N GLY 118.A O no hydrogen 3.000 N/A THR 122.A OG1 GLY 118.A O no hydrogen 2.874 N/A THR 122.A OG1 SER 119.A O no hydrogen 3.463 N/A SER 123.A OG ASN 120.A O no hydrogen 3.244 N/A SER 123.A OG THR 125.A OG1 no hydrogen 2.894 N/A THR 125.A OG1 SER 123.A OG no hydrogen 2.894 N/A VAL 126.A N SER 123.A OG no hydrogen 3.178 N/A LYS 127.A N SER 123.A O no hydrogen 3.328 N/A ALA 128.A N THR 124.A O no hydrogen 3.390 N/A ALA 129.A N THR 125.A O no hydrogen 3.111 N/A TRP 131.A N LYS 127.A O no hydrogen 2.893 N/A TRP 132.A N ALA 128.A O no hydrogen 3.004 N/A ALA 133.A N ALA 129.A O no hydrogen 3.347 N/A GLY 134.A N TRP 131.A O no hydrogen 3.358 N/A ILE 135.A N CYS 130.A O no hydrogen 2.675 N/A LYS 136.A N LYS 111.A O no hydrogen 3.049 N/A LYS 138.A N VAL 113.A O no hydrogen 3.031 N/A GLY 140.A N THR 115.A O no hydrogen 3.098 N/A ASN 144.A ND2 SER 147.A OG no hydrogen 2.873 N/A GLN 146.A N GLN 146.A OE1 no hydrogen 2.887 N/A SER 147.A N ASN 144.A O no hydrogen 3.029 N/A SER 147.A OG ASN 144.A O no hydrogen 3.522 N/A GLN 148.A NE2 ASN 144.A O no hydrogen 3.640 N/A GLY 149.A N GLN 146.A O no hydrogen 3.218 N/A ILE 151.A N GLN 62.A OE1 no hydrogen 3.075 N/A GLU 152.A N GLN 148.A O no hydrogen 2.957 N/A SER 153.A N GLY 149.A O no hydrogen 2.901 N/A SER 153.A OG GLY 149.A O no hydrogen 2.558 N/A SER 153.A OG VAL 150.A O no hydrogen 2.572 N/A MET 154.A N VAL 150.A O no hydrogen 2.931 N/A ASN 155.A N ILE 151.A O no hydrogen 2.714 N/A ASN 155.A ND2 ASP 64.A OD2 no hydrogen 3.085 N/A ASN 155.A ND2 GLU 152.A OE1 no hydrogen 3.378 N/A LYS 156.A N SER 153.A O no hydrogen 3.147 N/A GLU 157.A N SER 153.A O no hydrogen 3.202 N/A LEU 158.A N MET 154.A O no hydrogen 3.036 N/A LYS 159.A NZ THR 66.A OG1 no hydrogen 2.190 N/A LYS 159.A NZ HIS 67.A O no hydrogen 3.369 N/A LYS 160.A N LYS 156.A O no hydrogen 2.891 N/A ILE 161.A N GLU 157.A O no hydrogen 2.919 N/A ILE 162.A N LEU 158.A O no hydrogen 2.979 N/A GLY 163.A N LYS 159.A O no hydrogen 3.220 N/A GLN 164.A N ILE 161.A O no hydrogen 2.876 N/A VAL 165.A N ILE 161.A O no hydrogen 3.201 N/A ARG 166.A NE GLU 69.A OE1 no hydrogen 3.381 N/A ARG 166.A NE GLU 69.A OE2 no hydrogen 3.486 N/A ARG 166.A NH1 ARG 166.A O no hydrogen 2.656 N/A ARG 166.A NH1 ALA 169.A O no hydrogen 2.882 N/A ARG 166.A NH2 GLU 69.A OE1 no hydrogen 3.450 N/A ARG 166.A NH2 GLU 170.A O no hydrogen 3.509 N/A GLN 168.A N VAL 165.A O no hydrogen 3.162 N/A GLU 170.A N GLU 170.A OE1 no hydrogen 2.753 N/A VAL 176.A N LEU 172.A O no hydrogen 2.896 N/A GLN 177.A N LYS 173.A O no hydrogen 2.997 N/A GLN 177.A NE2 ALA 86.A O no hydrogen 3.215 N/A MET 178.A N THR 174.A O no hydrogen 2.896 N/A ALA 179.A N ALA 175.A O no hydrogen 2.879 N/A VAL 180.A N VAL 176.A O no hydrogen 2.929 N/A PHE 181.A N GLN 177.A O no hydrogen 2.953 N/A ILE 182.A N MET 178.A O no hydrogen 2.873 N/A HIS 183.A N ALA 179.A O no hydrogen 2.889 N/A HIS 183.A NE2 GLY 82.A O no hydrogen 2.796 N/A ASN 184.A N VAL 180.A O no hydrogen 2.922 N/A ASN 184.A ND2 ILE 84.A O no hydrogen 2.942 N/A PHE 185.A N PHE 181.A O no hydrogen 2.928 N/A LYS 186.A N ILE 182.A O no hydrogen 2.866 N/A GLY 189.A N TYR 194.A O no hydrogen 2.781 N/A TYR 194.A OH ASP 202.A OD2 no hydrogen 2.508 N/A SER 195.A OG ASN 184.A O no hydrogen 3.544 N/A SER 195.A OG GLU 198.A OE2 no hydrogen 3.421 N/A GLY 197.A N ASN 184.A O no hydrogen 2.880 N/A ARG 199.A N SER 195.A O no hydrogen 2.821 N/A ARG 199.A NH1 SER 81.A O no hydrogen 2.613 N/A ILE 200.A N ALA 196.A O no hydrogen 2.921 N/A VAL 201.A N GLY 197.A O no hydrogen 2.994 N/A ASP 202.A N GLU 198.A O no hydrogen 2.966 N/A ILE 203.A N ARG 199.A O no hydrogen 2.921 N/A ILE 204.A N ILE 200.A O no hydrogen 3.038 N/A ALA 205.A N VAL 201.A O no hydrogen 2.912 N/A THR 206.A N ASP 202.A O no hydrogen 2.832 N/A THR 206.A OG1 ASP 202.A O no hydrogen 2.264 N/A ASP 207.A N ILE 203.A O no hydrogen 2.881 N/A ILE 208.A N ILE 204.A O no hydrogen 3.006 N/A GLN 209.A N ALA 205.A O no hydrogen 2.945 N/A THR 210.A N THR 206.A O no hydrogen 2.855 N/A THR 210.A OG1 THR 206.A O no hydrogen 2.686 N/A THR 210.A OG1 ASP 207.A O no hydrogen 3.068 N/A LYS 211.A N ASP 207.A O no hydrogen 2.940 N/A GLU 212.A N ILE 208.A O no hydrogen 2.968 N/A LEU 213.A N GLN 209.A O no hydrogen 2.890 N/A GLN 214.A N THR 210.A O no hydrogen 2.871 N/A GLN 214.A NE2 GLN 214.A O no hydrogen 3.468 N/A LYS 215.A N LYS 211.A O no hydrogen 2.914 N/A GLN 216.A N GLU 212.A O no hydrogen 2.967 N/A ILE 217.A N LEU 213.A O no hydrogen 2.887 N/A THR 218.A N GLN 214.A O no hydrogen 2.885 N/A THR 218.A OG1 GLN 214.A O no hydrogen 2.922 N/A THR 218.A OG1 LYS 215.A O no hydrogen 2.880 N/A LYS 219.A N LYS 215.A O no hydrogen 2.910 N/A ILE 220.A N GLN 216.A O no hydrogen 2.924 N/A GLN 221.A N ILE 217.A O no hydrogen 2.620 N/A GLN 221.A NE2 LEU 235.A O no hydrogen 3.526 N/A ARG 224.A NH1 PRO 231.A O no hydrogen 2.864 N/A VAL 225.A N ALA 232.A O no hydrogen 2.770 N/A TYR 226.A N LYS 259.A O no hydrogen 3.097 N/A TYR 227.A OH ASP 246.A OD2 no hydrogen 2.785 N/A ARG 228.A N LYS 257.A O no hydrogen 3.297 N/A ALA 232.A N GLY 230.A O no hydrogen 2.813 N/A LYS 233.A N GLN 245.A O no hydrogen 3.288 N/A LEU 234.A N PHE 223.A O no hydrogen 3.203 N/A LEU 235.A N VAL 243.A O no hydrogen 3.098 N/A TRP 236.A N VAL 243.A O no hydrogen 3.133 N/A ALA 241.A N GLY 238.A O no hydrogen 3.060 N/A VAL 242.A N VAL 253.A O no hydrogen 2.713 N/A VAL 243.A N TRP 236.A O no hydrogen 3.013 N/A ILE 244.A N LYS 251.A O no hydrogen 3.370 N/A GLN 245.A N LYS 233.A O no hydrogen 3.035 N/A ASP 246.A N ASP 249.A O no hydrogen 3.273 N/A LYS 251.A N ILE 244.A O no hydrogen 3.304 N/A LYS 251.A NZ TYR 227.A OH no hydrogen 3.170 N/A VAL 253.A N VAL 242.A O no hydrogen 2.822 N/A ARG 255.A N GLY 240.A O no hydrogen 2.971 N/A ARG 255.A NH1 ARG 255.A O no hydrogen 2.813 N/A ARG 255.A NH1 ALA 258.A O no hydrogen 2.324 N/A LYS 259.A N TYR 226.A O no hydrogen 2.974 N/A ILE 261.A N ARG 224.A O no hydrogen 2.857 N/A