Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qfj_E.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 5.A N ALA 24.A O no hydrogen 2.839 N/A GLN 6.A NE2 TYR 89.A O no hydrogen 2.758 N/A THR 7.A N GLN 22.A O no hydrogen 3.374 N/A LYS 9.A NZ TYR 216.A OH no hydrogen 3.336 N/A GLN 11.A N ARG 111.A O no hydrogen 3.212 N/A LEU 13.A N THR 113.A O no hydrogen 2.886 N/A LYS 14.A N GLN 17.A OE1 no hydrogen 3.065 N/A THR 15.A N THR 115A.A O no hydrogen 2.902 N/A THR 15.A OG1 GLU 116.A OE2 no hydrogen 2.912 N/A THR 15.A OG1 THR 115A.A O no hydrogen 3.145 N/A GLY 16.A N ALA 81.A O no hydrogen 2.939 N/A GLN 17.A N LYS 14.A O no hydrogen 3.030 N/A MET 19.A N LEU 78.A O no hydrogen 3.139 N/A LEU 21.A N LEU 76.A O no hydrogen 2.741 N/A GLN 22.A N THR 7.A O no hydrogen 3.084 N/A CYS 23.A SG THR 5.A O no hydrogen 3.769 N/A ALA 24.A N THR 5.A O no hydrogen 3.104 N/A GLN 25.A N GLU 72.A O no hydrogen 2.913 N/A GLN 25.A NE2 HIS 29.A O no hydrogen 3.267 N/A GLN 25.A NE2 THR 71.A O no hydrogen 3.106 N/A MET 27.A N GLN 25.A OE1 no hydrogen 2.937 N/A HIS 29.A N GLN 25.A OE1 no hydrogen 2.679 N/A HIS 29.A ND1 SER 93.A OG no hydrogen 2.329 N/A GLU 30.A N PRO 95.A O no hydrogen 3.182 N/A TYR 31.A N ARG 94.A O no hydrogen 3.185 N/A MET 32.A N SER 49.A O no hydrogen 2.933 N/A SER 33.A N ALA 92.A O no hydrogen 2.954 N/A TRP 34.A N HIS 47.A O no hydrogen 3.026 N/A TRP 34.A NE1 PHE 74.A O no hydrogen 2.770 N/A TYR 35.A N PHE 90.A O no hydrogen 2.918 N/A ARG 36.A N ARG 44.A O no hydrogen 2.986 N/A ARG 36.A NE ASP 38.A OD1 no hydrogen 2.881 N/A ARG 36.A NE SER 87.A OG no hydrogen 2.999 N/A ARG 36.A NH1 SER 84.A O no hydrogen 2.867 N/A ARG 36.A NH2 ASP 38.A OD1 no hydrogen 3.327 N/A ARG 36.A NH2 ASP 38.A OD2 no hydrogen 2.819 N/A ARG 36.A NH2 SER 84.A O no hydrogen 2.900 N/A ARG 36.A NH2 SER 87.A OG no hydrogen 2.931 N/A GLN 37.A N VAL 88.A O no hydrogen 3.038 N/A ASP 38.A N GLY 42.A O no hydrogen 3.263 N/A MET 41.A N ASP 38.A O no hydrogen 2.716 N/A GLY 42.A N ASP 38.A O no hydrogen 3.096 N/A ARG 44.A N ARG 36.A O no hydrogen 2.849 N/A LEU 45.A N GLU 59.A OE1 no hydrogen 2.918 N/A ILE 46.A N TRP 34.A O no hydrogen 2.930 N/A HIS 47.A NE2 TYR 64.A O no hydrogen 3.013 N/A TYR 48.A N ASP 56.A O no hydrogen 2.971 N/A SER 49.A N MET 32.A O no hydrogen 2.884 N/A SER 49.A OG ILE 54.A O no hydrogen 2.735 N/A GLY 53.A N ARG 68.A O no hydrogen 2.787 N/A ASP 56.A N TYR 48.A O no hydrogen 2.897 N/A GLN 57.A N ASP 56.A OD1 no hydrogen 3.244 N/A GLY 58.A N ILE 46.A O no hydrogen 2.755 N/A VAL 60.A N LEU 45.A O no hydrogen 2.755 N/A TYR 64.A N PRO 61.A O no hydrogen 2.926 N/A TYR 64.A OH TYR 89.A OH no hydrogen 2.509 N/A ASN 65.A N ARG 77.A O no hydrogen 2.895 N/A ARG 68.A NE THR 70.A O no hydrogen 3.321 N/A ARG 68.A NE THR 71.A O no hydrogen 3.264 N/A ARG 68.A NH1 GLU 30.A O no hydrogen 2.565 N/A ARG 68.A NH1 SER 49.A OG no hydrogen 3.027 N/A ARG 68.A NH2 HIS 29.A O no hydrogen 2.991 N/A ARG 68.A NH2 GLU 30.A O no hydrogen 3.347 N/A ARG 68.A NH2 THR 71.A O no hydrogen 2.623 N/A THR 70.A OG1 ASP 73.A OD2 no hydrogen 2.934 N/A THR 71.A OG1 GLU 72.A OE1 no hydrogen 2.974 N/A ASP 73.A N THR 70.A OG1 no hydrogen 3.109 N/A PHE 74.A N CYS 23.A O no hydrogen 3.072 N/A LEU 76.A N LEU 21.A O no hydrogen 3.041 N/A ARG 77.A N ASN 65.A O no hydrogen 2.747 N/A LEU 78.A N MET 19.A O no hydrogen 2.946 N/A ALA 81.A N GLN 17.A O no hydrogen 3.128 N/A ALA 82.A N GLN 85.A OE1 no hydrogen 2.822 N/A GLN 85.A N ALA 82.A O no hydrogen 2.997 N/A GLN 85.A NE2 GLY 63.A O no hydrogen 3.376 N/A THR 86.A OG1 PRO 83.A O no hydrogen 3.501 N/A SER 87.A N LEU 112.A O no hydrogen 2.894 N/A SER 87.A OG GLN 37.A O no hydrogen 3.283 N/A SER 87.A OG ASP 38.A OD2 no hydrogen 2.802 N/A TYR 89.A N THR 110.A O no hydrogen 2.922 N/A TYR 89.A OH TYR 64.A OH no hydrogen 2.509 N/A TYR 89.A OH GLN 85.A O no hydrogen 2.485 N/A PHE 90.A N TYR 35.A O no hydrogen 3.118 N/A CYS 91.A N GLN 6.A OE1 no hydrogen 3.198 N/A CYS 91.A SG SER 33.A O no hydrogen 3.835 N/A ALA 92.A N SER 33.A O no hydrogen 2.891 N/A SER 93.A N TYR 105.A O no hydrogen 2.795 N/A SER 93.A OG HIS 29.A ND1 no hydrogen 2.329 N/A ARG 94.A N TYR 31.A O no hydrogen 2.864 N/A LEU 97.A N GLU 30.A OE1 no hydrogen 3.003 N/A ALA 98.A N PRO 95.A O no hydrogen 3.435 N/A GLU 103.A N ARG 101.A O no hydrogen 2.754 N/A GLN 104.A NE2 TYR 35.A OH no hydrogen 2.864 N/A TYR 105.A N SER 93.A O no hydrogen 2.928 N/A TYR 105.A OH GLU 103.A OE1 no hydrogen 2.804 N/A GLY 107.A N CYS 91.A O no hydrogen 2.559 N/A GLY 109.A N GLN 6.A OE1 no hydrogen 3.390 N/A THR 110.A N TYR 89.A O no hydrogen 2.978 N/A THR 110.A OG1 PRO 8.A O no hydrogen 2.452 N/A ARG 111.A N LYS 9.A O no hydrogen 2.653 N/A ARG 111.A NH1 LYS 9.A O no hydrogen 3.423 N/A ARG 111.A NH2 PRO 108.A O no hydrogen 2.804 N/A LEU 112.A N SER 87.A O no hydrogen 2.930 N/A THR 113.A N GLN 11.A O no hydrogen 2.976 N/A THR 113.A OG1 HIS 155.A NE2 no hydrogen 3.068 N/A VAL 114.A N THR 86.A OG1 no hydrogen 3.000 N/A ASN 120.A N ASP 117.A O no hydrogen 3.067 N/A ASN 120.A ND2 THR 115A.A OG1 no hydrogen 3.135 N/A VAL 121.A N LEU 118.A O no hydrogen 3.052 N/A PHE 122.A N TYR 152.A O no hydrogen 2.918 N/A GLU 125.A N THR 149.A O no hydrogen 2.818 N/A ALA 127.A N LEU 147.A O no hydrogen 3.057 N/A PHE 129.A N VAL 145.A O no hydrogen 2.719 N/A GLU 135.A N SER 132.A O no hydrogen 3.103 N/A GLU 135.A N SER 132.A OG no hydrogen 3.264 N/A ILE 136.A N SER 132.A O no hydrogen 3.436 N/A SER 137.A N GLU 133.A O no hydrogen 3.125 N/A SER 137.A OG GLU 133.A O no hydrogen 3.244 N/A HIS 138.A N ALA 134.A O no hydrogen 2.978 N/A THR 139.A N GLU 135.A O no hydrogen 2.756 N/A THR 139.A OG1 GLU 135.A O no hydrogen 2.697 N/A GLN 140.A N ILE 136.A O no hydrogen 3.077 N/A LYS 141.A NZ THR 139.A O no hydrogen 3.149 N/A ALA 142.A N VAL 197.A O no hydrogen 2.844 N/A THR 143.A N GLU 135.A OE1 no hydrogen 3.130 N/A THR 143.A OG1 GLU 135.A OE1 no hydrogen 3.551 N/A THR 143.A OG1 GLU 135.A OE2 no hydrogen 2.538 N/A LEU 144.A N LEU 195.A O no hydrogen 2.679 N/A VAL 145.A N PHE 129.A O no hydrogen 3.081 N/A CYS 146.A N SER 193.A O no hydrogen 2.924 N/A CYS 146.A SG ALA 127.A O no hydrogen 3.878 N/A LEU 147.A N ALA 127.A O no hydrogen 2.974 N/A ALA 148.A N LEU 191.A O no hydrogen 2.829 N/A THR 149.A N GLU 125.A O no hydrogen 2.803 N/A THR 149.A OG1 GLU 125.A O no hydrogen 3.557 N/A GLY 150.A N GLU 180.A OE2 no hydrogen 2.830 N/A PHE 151.A N TYR 189.A O no hydrogen 3.286 N/A TYR 152.A N PHE 122.A O no hydrogen 3.018 N/A GLU 157.A N GLN 214.A O no hydrogen 2.955 N/A SER 159.A N GLN 212.A O no hydrogen 2.945 N/A TRP 160.A NE1 SER 193.A OG no hydrogen 3.096 N/A TRP 161.A N ARG 210.A O no hydrogen 2.763 N/A TRP 161.A NE1 SER 159.A OG no hydrogen 2.870 N/A VAL 162.A N LYS 165.A O no hydrogen 2.863 N/A ASN 163.A N HIS 208.A O no hydrogen 2.907 N/A ASN 163.A ND2 ASN 207.A OD1 no hydrogen 3.422 N/A LYS 165.A N VAL 162.A O no hydrogen 2.872 N/A VAL 167.A N TRP 160.A O no hydrogen 2.857 N/A SER 172.A N ARG 194.A O no hydrogen 3.169 N/A THR 173.A OG1 SER 193.A OG no hydrogen 2.861 N/A ASP 174.A N SER 192.A O no hydrogen 3.068 N/A LEU 178.A N ALA 190.A O no hydrogen 2.655 N/A GLU 180.A N ARG 188.A O no hydrogen 2.877 N/A GLN 181.A N SER 187.A OG no hydrogen 2.948 N/A LEU 184.A N GLN 181.A O no hydrogen 2.906 N/A SER 187.A OG ARG 188.A O no hydrogen 2.966 N/A ARG 188.A NE GLY 150.A O no hydrogen 2.723 N/A ARG 188.A NH1 GLY 150.A O no hydrogen 3.078 N/A TYR 189.A N PHE 151.A O no hydrogen 2.674 N/A ALA 190.A N LEU 178.A O no hydrogen 2.856 N/A LEU 191.A N ALA 148.A O no hydrogen 2.729 N/A SER 192.A N ASP 174.A OD2 no hydrogen 3.098 N/A SER 192.A OG ASP 174.A OD1 no hydrogen 2.996 N/A SER 192.A OG ASP 174.A OD2 no hydrogen 2.936 N/A SER 193.A N CYS 146.A O no hydrogen 2.850 N/A SER 193.A OG SER 172.A O no hydrogen 3.278 N/A SER 193.A OG THR 173.A OG1 no hydrogen 2.861 N/A ARG 194.A N SER 172.A O no hydrogen 2.838 N/A ARG 194.A NH1 ASP 174.A OD1 no hydrogen 3.422 N/A LEU 195.A N LEU 144.A O no hydrogen 2.776 N/A ARG 196.A N GLY 170.A O no hydrogen 3.144 N/A VAL 197.A N ALA 142.A O no hydrogen 2.948 N/A ALA 199.A N GLN 140.A O no hydrogen 3.098 N/A PHE 201.A N SER 198.A O no hydrogen 3.225 N/A TRP 202.A N SER 198.A O no hydrogen 3.103 N/A GLN 203.A N ALA 199.A O no hydrogen 2.811 N/A ARG 206.A N ASP 204.A OD1 no hydrogen 3.273 N/A ASN 207.A N ASP 204.A O no hydrogen 3.382 N/A ASN 207.A ND2 PHE 201.A O no hydrogen 2.552 N/A HIS 208.A N ASN 163.A OD1 no hydrogen 3.080 N/A HIS 208.A NE2 GLU 239.A OE1 no hydrogen 2.498 N/A PHE 209.A N ALA 240.A O no hydrogen 2.945 N/A ARG 210.A N TRP 161.A O no hydrogen 2.827 N/A CYS 211.A N ALA 238.A O no hydrogen 2.975 N/A GLN 212.A N SER 159.A O no hydrogen 2.786 N/A VAL 213.A N VAL 236.A O no hydrogen 2.797 N/A GLN 214.A N GLU 157.A O no hydrogen 2.896 N/A GLN 214.A NE2 PHE 215.A O no hydrogen 3.000 N/A PHE 215.A N GLN 234.A O no hydrogen 2.773 N/A TYR 216.A N HIS 155.A O no hydrogen 2.994 N/A TYR 216.A OH GLU 157.A OE1 no hydrogen 2.603 N/A GLY 217.A N THR 233.A OG1 no hydrogen 3.054 N/A LEU 218.A N PRO 231.A O no hydrogen 2.973 N/A SER 219.A N ASP 222.A OD1 no hydrogen 3.356 N/A ASN 221.A N SER 219.A OG no hydrogen 3.292 N/A ASP 222.A N SER 219.A O no hydrogen 3.252 N/A TRP 224.A NE1 ARG 228.A O no hydrogen 2.666 N/A ARG 228.A NH1 VAL 121.A O no hydrogen 2.769 N/A LYS 230.A NZ GLU 220.A O no hydrogen 3.552 N/A LYS 230.A NZ ASP 222.A O no hydrogen 2.848 N/A VAL 232.A N LYS 230.A O no hydrogen 2.689 N/A THR 233.A N LEU 218.A O no hydrogen 3.100 N/A THR 233.A OG1 GLY 217.A O no hydrogen 3.554 N/A THR 233.A OG1 LEU 218.A O no hydrogen 3.504 N/A GLN 234.A N PHE 215.A O no hydrogen 2.961 N/A VAL 236.A N VAL 213.A O no hydrogen 2.855 N/A ALA 238.A N CYS 211.A O no hydrogen 3.105 N/A ALA 240.A N PHE 209.A O no hydrogen 3.098 N/A GLY 242.A N ASN 207.A O no hydrogen 2.901 N/A ARG 243.A N TRP 202.A O no hydrogen 3.118 N/A ARG 243.A NH1 ASP 245.A OD1 no hydrogen 3.399 N/A ARG 243.A NH1 ASP 245.A OD2 no hydrogen 2.489 N/A THR 115A.A N LEU 13.A O no hydrogen 3.151 N/A THR 115A.A OG1 ASP 186.A OD1 no hydrogen 3.374 N/A