Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8jar_E.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 9.A N ASP 9.A OD1 no hydrogen 2.496 N/A THR 13.A OG1 ASP 9.A O no hydrogen 3.349 N/A THR 13.A OG1 GLU 12.A OE2 no hydrogen 3.052 N/A TRP 14.A N PHE 10.A O no hydrogen 2.870 N/A ASN 15.A N ASP 11.A O no hydrogen 2.908 N/A LYS 16.A N GLU 12.A O no hydrogen 2.933 N/A LEU 17.A N THR 13.A O no hydrogen 2.899 N/A LEU 18.A N TRP 14.A O no hydrogen 2.789 N/A THR 19.A N ASN 15.A O no hydrogen 3.009 N/A THR 19.A OG1 ASN 15.A O no hydrogen 3.449 N/A THR 19.A OG1 LYS 16.A O no hydrogen 2.431 N/A THR 20.A OG1 LEU 17.A O no hydrogen 2.972 N/A ILE 21.A N LEU 17.A O no hydrogen 2.892 N/A LYS 22.A N LEU 18.A O no hydrogen 2.887 N/A ALA 23.A N THR 19.A O no hydrogen 2.957 N/A VAL 24.A N ILE 21.A O no hydrogen 3.293 N/A VAL 25.A N ILE 21.A O no hydrogen 2.908 N/A LEU 27.A N VAL 24.A O no hydrogen 3.416 N/A GLU 28.A N ALA 23.A O no hydrogen 2.709 N/A TRP 35.A N GLU 31.A O no hydrogen 2.822 N/A ASN 36.A N ARG 32.A O no hydrogen 2.910 N/A ASP 37.A N ALA 33.A O no hydrogen 2.906 N/A ARG 38.A N THR 34.A O no hydrogen 2.941 N/A ARG 38.A NE ASP 41.A OD2 no hydrogen 2.864 N/A ARG 38.A NH2 ASP 41.A OD2 no hydrogen 2.774 N/A ASP 41.A N ASP 37.A O no hydrogen 2.960 N/A ILE 42.A N ARG 38.A O no hydrogen 2.875 N/A TYR 43.A N PHE 39.A O no hydrogen 2.927 N/A TYR 43.A OH LEU 3.A O no hydrogen 3.165 N/A ALA 44.A N SER 40.A O no hydrogen 2.874 N/A LEU 45.A N ASP 41.A O no hydrogen 2.942 N/A CYS 46.A N ILE 42.A O no hydrogen 2.906 N/A CYS 46.A SG ILE 42.A O no hydrogen 3.235 N/A VAL 47.A N TYR 43.A O no hydrogen 3.044 N/A ALA 48.A N LEU 45.A O no hydrogen 3.445 N/A TYR 49.A N ARG 6.A O no hydrogen 3.307 N/A LEU 53.A N LEU 45.A O no hydrogen 2.996 N/A GLU 55.A N GLU 55.A OE1 no hydrogen 2.850 N/A LEU 57.A N LEU 53.A O no hydrogen 3.358 N/A TYR 58.A N GLY 54.A O no hydrogen 2.893 N/A TYR 58.A OH MET 119.A O no hydrogen 3.343 N/A THR 59.A N GLU 55.A O no hydrogen 2.904 N/A THR 59.A OG1 GLU 55.A O no hydrogen 2.864 N/A THR 59.A OG1 ARG 56.A O no hydrogen 2.674 N/A GLU 60.A N ARG 56.A O no hydrogen 2.926 N/A THR 61.A N LEU 57.A O no hydrogen 2.883 N/A THR 61.A OG1 LEU 57.A O no hydrogen 2.889 N/A THR 61.A OG1 TYR 105.A OH no hydrogen 2.735 N/A LYS 62.A N TYR 58.A O no hydrogen 2.912 N/A ILE 63.A N THR 59.A O no hydrogen 2.893 N/A PHE 64.A N GLU 60.A O no hydrogen 2.893 N/A LEU 65.A N THR 61.A O no hydrogen 2.892 N/A GLU 66.A N LYS 62.A O no hydrogen 2.906 N/A ASN 67.A N ILE 63.A O no hydrogen 2.941 N/A HIS 68.A N PHE 64.A O no hydrogen 2.859 N/A VAL 69.A N LEU 65.A O no hydrogen 2.896 N/A ARG 70.A N GLU 66.A O no hydrogen 2.923 N/A HIS 71.A N ASN 67.A O no hydrogen 2.894 N/A LEU 72.A N HIS 68.A O no hydrogen 2.918 N/A HIS 73.A N VAL 69.A O no hydrogen 2.822 N/A LYS 74.A N ARG 70.A O no hydrogen 2.933 N/A ARG 75.A N HIS 71.A O no hydrogen 2.931 N/A ARG 75.A NE HIS 71.A NE2 no hydrogen 3.370 N/A ARG 75.A NH2 HIS 71.A NE2 no hydrogen 3.226 N/A VAL 76.A N LEU 72.A O no hydrogen 2.871 N/A LEU 77.A N HIS 73.A O no hydrogen 2.946 N/A GLU 78.A N LYS 74.A O no hydrogen 2.920 N/A GLN 82.A N SER 79.A O no hydrogen 3.391 N/A MET 86.A N GLN 82.A O no hydrogen 3.210 N/A TYR 87.A N VAL 83.A O no hydrogen 2.865 N/A TYR 87.A OH SER 169.A OG no hydrogen 2.914 N/A HIS 88.A N LEU 84.A O no hydrogen 2.934 N/A ARG 89.A N VAL 85.A O no hydrogen 2.925 N/A TYR 90.A N MET 86.A O no hydrogen 2.937 N/A TRP 91.A N TYR 87.A O no hydrogen 2.806 N/A GLU 92.A N HIS 88.A O no hydrogen 2.983 N/A TYR 94.A N TYR 90.A O no hydrogen 2.878 N/A TYR 94.A OH ALA 125.A O no hydrogen 2.750 N/A SER 95.A N TRP 91.A O no hydrogen 2.832 N/A LYS 96.A N GLU 92.A O no hydrogen 3.028 N/A GLY 97.A N GLU 93.A O no hydrogen 2.870 N/A ALA 98.A N TYR 94.A O no hydrogen 2.808 N/A ASP 99.A N SER 95.A O no hydrogen 2.977 N/A TYR 100.A N LYS 96.A O no hydrogen 2.925 N/A MET 101.A N GLY 97.A O no hydrogen 2.848 N/A ASP 102.A N ALA 98.A O no hydrogen 2.874 N/A CYS 103.A N ASP 99.A O no hydrogen 2.979 N/A CYS 103.A SG ASP 99.A O no hydrogen 3.456 N/A LEU 104.A N TYR 100.A O no hydrogen 2.904 N/A TYR 105.A N MET 101.A O no hydrogen 2.853 N/A TYR 105.A OH THR 61.A OG1 no hydrogen 2.735 N/A ASN 109.A N TYR 105.A O no hydrogen 2.993 N/A THR 110.A N ARG 106.A O no hydrogen 3.035 N/A THR 110.A OG1 ARG 106.A O no hydrogen 2.597 N/A THR 110.A OG1 TYR 107.A O no hydrogen 3.481 N/A GLN 111.A N TYR 107.A O no hydrogen 2.918 N/A PHE 112.A N LEU 108.A O no hydrogen 3.090 N/A ILE 113.A N LEU 108.A O no hydrogen 2.751 N/A LYS 114.A N ASN 109.A O no hydrogen 3.069 N/A LYS 114.A NZ GLU 120.A OE2 no hydrogen 2.441 N/A ASN 116.A N PHE 112.A O no hydrogen 2.798 N/A MET 119.A N TYR 58.A OH no hydrogen 3.221 N/A ILE 121.A N ASN 109.A OD1 no hydrogen 3.255 N/A LEU 124.A N GLU 120.A O no hydrogen 2.410 N/A ALA 125.A N ILE 121.A O no hydrogen 3.190 N/A ASP 127.A N GLU 123.A O no hydrogen 3.363 N/A MET 128.A N LEU 124.A O no hydrogen 2.885 N/A TRP 129.A N ALA 125.A O no hydrogen 2.923 N/A TRP 129.A NE1 TYR 87.A OH no hydrogen 3.240 N/A ARG 130.A N LEU 126.A O no hydrogen 2.895 N/A ARG 130.A NH2 TYR 176.A OH no hydrogen 3.180 N/A LYS 131.A N ASP 127.A O no hydrogen 2.928 N/A MET 133.A N TRP 129.A O no hydrogen 3.017 N/A VAL 134.A N TRP 129.A O no hydrogen 2.877 N/A GLU 135.A N ARG 130.A O no hydrogen 2.747 N/A LEU 137.A N MET 133.A O no hydrogen 3.154 N/A GLN 138.A N GLU 135.A O no hydrogen 3.178 N/A LEU 141.A N LEU 137.A O no hydrogen 3.321 N/A ARG 143.A N ALA 139.A O no hydrogen 3.112 N/A MET 144.A N ILE 140.A O no hydrogen 3.425 N/A LEU 145.A N LEU 141.A O no hydrogen 2.964 N/A LEU 146.A N ILE 142.A O no hydrogen 3.042 N/A ARG 147.A N ARG 143.A O no hydrogen 2.964 N/A GLU 148.A N MET 144.A O no hydrogen 3.183 N/A ASP 152.A N GLU 148.A O no hydrogen 3.133 N/A ARG 153.A N LYS 150.A O no hydrogen 3.244 N/A ARG 153.A NH2 THR 197.A OG1 no hydrogen 2.820 N/A GLY 154.A N ASN 151.A O no hydrogen 3.160 N/A GLY 155.A N ASP 152.A O no hydrogen 3.266 N/A GLN 160.A NE2 LYS 234.A O no hydrogen 3.264 N/A LYS 161.A NZ ASN 159.A OD1 no hydrogen 3.407 N/A VAL 162.A N ASN 159.A OD1 no hydrogen 3.310 N/A HIS 164.A N GLN 160.A O no hydrogen 3.249 N/A GLY 165.A N LYS 161.A O no hydrogen 2.796 N/A VAL 166.A N VAL 162.A O no hydrogen 3.092 N/A ILE 167.A N ILE 163.A O no hydrogen 3.137 N/A ASN 168.A N HIS 164.A O no hydrogen 2.857 N/A SER 169.A N VAL 166.A O no hydrogen 3.073 N/A SER 169.A OG TYR 87.A OH no hydrogen 2.914 N/A SER 169.A OG VAL 166.A O no hydrogen 2.323 N/A PHE 170.A N ILE 167.A O no hydrogen 3.309 N/A VAL 171.A N ASN 168.A O no hydrogen 3.169 N/A HIS 172.A N ASN 168.A O no hydrogen 2.969 N/A GLU 174.A N VAL 171.A O no hydrogen 3.077 N/A GLN 175.A NE2 HIS 172.A O no hydrogen 3.624 N/A LYS 178.A N TYR 176.A O no hydrogen 2.930 N/A LYS 183.A N PHE 180.A O no hydrogen 3.277 N/A LYS 183.A NZ GLU 187.A OE2 no hydrogen 3.547 N/A GLN 186.A N LEU 182.A O no hydrogen 3.059 N/A GLU 187.A N PHE 184.A O no hydrogen 3.170 N/A ILE 188.A N PHE 184.A O no hydrogen 2.846 N/A PHE 189.A N TYR 185.A O no hydrogen 3.325 N/A GLU 190.A N TYR 185.A O no hydrogen 3.329 N/A SER 191.A N GLN 186.A O no hydrogen 3.155 N/A SER 191.A OG GLN 186.A O no hydrogen 3.264 N/A SER 191.A OG GLU 187.A O no hydrogen 3.364 N/A PHE 193.A N PHE 189.A O no hydrogen 2.834 N/A LEU 194.A N GLU 190.A O no hydrogen 2.641 N/A THR 195.A OG1 SER 191.A O no hydrogen 3.378 N/A THR 195.A OG1 PRO 192.A O no hydrogen 2.687 N/A GLU 196.A N PRO 192.A O no hydrogen 3.041 N/A THR 197.A N PHE 193.A O no hydrogen 2.688 N/A THR 197.A OG1 GLU 228.A OE2 no hydrogen 2.847 N/A GLY 198.A N LEU 194.A O no hydrogen 2.841 N/A GLU 199.A N THR 195.A O no hydrogen 2.955 N/A TYR 200.A N GLU 196.A O no hydrogen 3.015 N/A TYR 201.A N THR 197.A O no hydrogen 3.267 N/A TYR 201.A OH GLU 228.A OE1 no hydrogen 2.257 N/A LYS 202.A N GLU 199.A O no hydrogen 3.084 N/A GLN 203.A N GLU 199.A O no hydrogen 2.777 N/A SER 206.A OG GLN 203.A O no hydrogen 2.978 N/A LEU 208.A N GLU 204.A O no hydrogen 2.608 N/A LEU 209.A N ALA 205.A O no hydrogen 3.073 N/A GLN 210.A N ASN 207.A O no hydrogen 3.276 N/A SER 212.A OG LEU 208.A O no hydrogen 2.858 N/A ASN 213.A N GLN 216.A OE1 no hydrogen 3.500 N/A SER 215.A OG ASN 213.A OD1 no hydrogen 2.257 N/A GLN 216.A N ASN 213.A OD1 no hydrogen 3.092 N/A TYR 217.A N CYS 214.A O no hydrogen 3.224 N/A LYS 220.A N GLN 216.A O no hydrogen 3.227 N/A LYS 220.A NZ SER 212.A OG no hydrogen 2.780 N/A VAL 221.A N TYR 217.A O no hydrogen 3.255 N/A ARG 224.A N LYS 220.A O no hydrogen 3.412 N/A ARG 224.A NH2 TYR 201.A OH no hydrogen 3.210 N/A LEU 225.A N VAL 221.A O no hydrogen 3.123 N/A LYS 226.A N LEU 222.A O no hydrogen 3.050 N/A ASP 227.A N GLY 223.A O no hydrogen 3.456 N/A GLU 228.A N ARG 224.A O no hydrogen 3.137 N/A GLU 229.A N LEU 225.A O no hydrogen 2.916 N/A ILE 230.A N LYS 226.A O no hydrogen 2.840 N/A ARG 231.A N ASP 227.A O no hydrogen 2.939 N/A CYS 232.A N GLU 228.A O no hydrogen 2.750 N/A CYS 232.A SG SER 240.A O no hydrogen 3.421 N/A CYS 232.A SG TYR 241.A O no hydrogen 3.829 N/A ARG 233.A N GLU 229.A O no hydrogen 2.941 N/A ARG 233.A NE GLU 229.A OE2 no hydrogen 2.918 N/A ARG 233.A NH2 GLU 229.A OE2 no hydrogen 3.263 N/A LYS 234.A N ARG 231.A O no hydrogen 3.153 N/A TYR 235.A N ARG 231.A O no hydrogen 2.691 N/A LEU 236.A N ARG 231.A O no hydrogen 3.443 N/A HIS 237.A N TYR 185.A OH no hydrogen 3.332 N/A SER 239.A N HIS 237.A ND1 no hydrogen 3.258 N/A SER 240.A N HIS 237.A O no hydrogen 3.023 N/A SER 240.A OG GLU 190.A OE1 no hydrogen 3.072 N/A SER 240.A OG GLU 190.A OE2 no hydrogen 2.898 N/A HIS 246.A N THR 242.A O no hydrogen 3.082 N/A HIS 246.A N LYS 243.A O no hydrogen 3.311 N/A GLU 247.A N LYS 243.A O no hydrogen 2.856 N/A CYS 248.A N VAL 244.A O no hydrogen 3.208 N/A CYS 248.A SG VAL 244.A O no hydrogen 3.243 N/A CYS 248.A SG ILE 245.A O no hydrogen 3.203 N/A CYS 248.A SG GLN 249.A OE1 no hydrogen 3.271 N/A ARG 251.A N GLU 247.A O no hydrogen 3.203 N/A ARG 251.A N CYS 248.A O no hydrogen 3.343 N/A MET 252.A N CYS 248.A O no hydrogen 2.884 N/A ALA 254.A N GLN 249.A O no hydrogen 2.881 N/A HIS 256.A N MET 252.A O no hydrogen 3.349 N/A LEU 260.A N HIS 256.A O no hydrogen 3.298 N/A