Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3lul_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A OG1 SER 100.A OG no hydrogen 3.195 N/A ARG 3.A N SER 100.A O no hydrogen 2.831 N/A ARG 3.A NH1 GLN 101.A OE1 no hydrogen 3.328 N/A ILE 5.A N LEU 102.A O no hydrogen 2.887 N/A ASP 16.A N GLY 13.A O no hydrogen 2.824 N/A ARG 17.A N GLY 87.A O no hydrogen 3.039 N/A ARG 17.A NE GLU 22.A OE1 no hydrogen 2.789 N/A ARG 17.A NH1 GLY 92.A O no hydrogen 2.910 N/A ARG 17.A NH1 LEU 93.A O no hydrogen 3.463 N/A ARG 17.A NH2 GLU 22.A OE2 no hydrogen 3.219 N/A ARG 17.A NH2 LEU 93.A O no hydrogen 2.743 N/A ILE 18.A N ASP 16.A OD1 no hydrogen 2.937 N/A PHE 19.A N ASP 16.A O no hydrogen 3.205 N/A LEU 20.A N ARG 17.A O no hydrogen 3.014 N/A GLY 21.A N ILE 18.A O no hydrogen 2.952 N/A GLU 22.A N ARG 17.A O no hydrogen 3.067 N/A GLY 23.A N GLY 21.A O no hydrogen 2.991 N/A LEU 24.A N LEU 84.A O no hydrogen 2.911 N/A GLU 26.A N ALA 82.A O no hydrogen 3.015 N/A ILE 28.A N ILE 80.A O no hydrogen 2.851 N/A ARG 29.A NE.B SER 230.A O no hydrogen 3.109 N/A VAL 30.A N GLY 78.A O no hydrogen 2.780 N/A ASN 31.A N LYS 34.A O no hydrogen 2.993 N/A SER 32.A N HIS 77.A ND1 no hydrogen 3.250 N/A SER 33.A N TYR 76.A O no hydrogen 2.744 N/A SER 33.A OG LEU 75.A O no hydrogen 3.436 N/A LYS 34.A N ASN 31.A O no hydrogen 2.965 N/A SER 36.A N ARG 29.A O no hydrogen 2.852 N/A SER 36.A OG.B ARG 29.A O no hydrogen 3.495 N/A SER 36.A OG.B ASN 31.A OD1 no hydrogen 2.680 N/A HIS 40.A ND1 GLU 26.A OE1 no hydrogen 2.681 N/A TRP 41.A N ALA 38.A O no hydrogen 3.016 N/A TRP 41.A NE1 ILE 57.A O no hydrogen 2.957 N/A GLU 42.A N TYR 39.A O no hydrogen 2.854 N/A ARG 43.A NE GLU 26.A OE1 no hydrogen 3.423 N/A ARG 43.A NE GLU 26.A OE2 no hydrogen 2.881 N/A ARG 43.A NH1 PRO 192.A O no hydrogen 3.015 N/A ARG 43.A NH2 GLU 26.A OE1 no hydrogen 2.822 N/A LEU 44.A N HIS 40.A O no hydrogen 3.086 N/A GLY 45.A N TRP 41.A O no hydrogen 2.983 N/A ASN 46.A N GLU 42.A O no hydrogen 2.956 N/A SER 47.A N ARG 43.A O no hydrogen 2.944 N/A SER 47.A OG ARG 43.A O no hydrogen 3.336 N/A ALA 48.A N LEU 44.A O no hydrogen 2.857 N/A ARG 49.A N GLY 45.A O no hydrogen 2.914 N/A ARG 49.A NH2 ASN 46.A OD1 no hydrogen 2.846 N/A GLN 50.A N ASN 46.A O no hydrogen 2.991 N/A LEU 51.A N SER 47.A O no hydrogen 3.089 N/A LEU 51.A N ALA 48.A O no hydrogen 3.108 N/A GLY 52.A N ARG 49.A O no hydrogen 3.240 N/A ILE 53.A N ALA 48.A O no hydrogen 2.934 N/A GLU 56.A N THR 2.A OG1 no hydrogen 2.886 N/A ASP 61.A N SER 58.A OG no hydrogen 2.969 N/A TRP 62.A N SER 58.A O no hydrogen 2.961 N/A TRP 62.A NE1 ALA 38.A O no hydrogen 2.997 N/A PHE 63.A N PHE 59.A O no hydrogen 2.849 N/A GLU 64.A N ASP 60.A O no hydrogen 2.983 N/A HIS 65.A N ASP 61.A O no hydrogen 2.928 N/A HIS 65.A ND1 ASP 61.A O no hydrogen 3.024 N/A LEU 66.A N TRP 62.A O no hydrogen 3.048 N/A ILE 67.A N PHE 63.A O no hydrogen 2.952 N/A GLN 68.A N GLU 64.A O no hydrogen 2.996 N/A LYS 69.A N HIS 65.A O no hydrogen 3.066 N/A LYS 69.A NZ ASP 7.A OD1 no hydrogen 3.110 N/A ILE 70.A N LEU 66.A O no hydrogen 2.987 N/A GLN 71.A N ILE 67.A O no hydrogen 2.952 N/A LYS 72.A N GLN 68.A O no hydrogen 2.939 N/A ASP 73.A N LYS 69.A O no hydrogen 3.028 N/A ASN 74.A N GLN 71.A O no hydrogen 3.241 N/A LEU 75.A N ILE 70.A O no hydrogen 2.955 N/A GLY 78.A N VAL 30.A O no hydrogen 3.016 N/A GLY 79.A N PHE 107.A O no hydrogen 2.861 N/A ILE 80.A N ILE 28.A O no hydrogen 2.866 N/A LYS 81.A N GLN 105.A O no hydrogen 2.828 N/A ALA 82.A N GLU 26.A O no hydrogen 2.925 N/A ILE 83.A N ILE 103.A O no hydrogen 2.919 N/A LEU 84.A N LEU 24.A O no hydrogen 2.798 N/A SER 85.A N GLN 101.A O no hydrogen 2.812 N/A SER 85.A OG ASP 16.A OD1 no hydrogen 3.258 N/A SER 85.A OG ASP 16.A OD2 no hydrogen 2.815 N/A SER 85.A OG GLN 101.A O no hydrogen 3.522 N/A GLY 86.A N GLU 22.A O no hydrogen 2.936 N/A GLY 87.A N ASP 16.A OD1 no hydrogen 3.066 N/A GLU 95.A N GLY 92.A O no hydrogen 3.236 N/A ARG 96.A NH1 LEU 51.A O no hydrogen 3.435 N/A SER 100.A N PRO 1.A O no hydrogen 2.918 N/A SER 100.A OG PRO 1.A O no hydrogen 3.358 N/A SER 100.A OG PRO 54.A O no hydrogen 2.462 N/A GLN 101.A N SER 85.A O no hydrogen 3.257 N/A GLN 101.A NE2 VAL 99.A O no hydrogen 3.018 N/A LEU 102.A N ARG 3.A O no hydrogen 2.818 N/A ILE 103.A N ILE 83.A O no hydrogen 2.974 N/A GLN 105.A N LYS 81.A O no hydrogen 2.912 N/A THR 106.A OG1 ASP 73.A OD2 no hydrogen 2.599 N/A PHE 107.A N GLY 79.A O no hydrogen 2.914 N/A TYR 109.A OH LEU 231.A O no hydrogen 2.660 N/A GLN 112.A N GLN 232.A OE1 no hydrogen 2.882 N/A HIS 114.A NE2 ASP 154.A OD1 no hydrogen 2.898 N/A VAL 116.A N ARG 236.A O no hydrogen 2.898 N/A ARG 117.A N ASP 154.A OD2 no hydrogen 2.820 N/A ARG 117.A NH1 SER 239.A OG no hydrogen 2.970 N/A LEU 118.A N SER 239.A O no hydrogen 2.788 N/A ILE 119.A N ASP 155.A O no hydrogen 3.165 N/A SER 120.A N ASP 241.A OD1 no hydrogen 2.858 N/A SER 120.A OG ASP 241.A OD2 no hydrogen 2.758 N/A ILE 121.A N LEU 157.A O no hydrogen 2.974 N/A TRP 123.A NE1 GLU 140.A OE2 no hydrogen 2.835 N/A ARG 125.A N PHE 159.A O no hydrogen 3.108 N/A ARG 125.A NE GLU 140.A OE2 no hydrogen 2.749 N/A ARG 125.A NH2 GLU 140.A OE2 no hydrogen 3.154 N/A LYS 127.A NZ GLU 162.A OE1 no hydrogen 3.150 N/A LYS 127.A NZ GLU 162.A OE2 no hydrogen 3.077 N/A ALA 128.A N ASP 126.A OD1 no hydrogen 2.967 N/A ASN 129.A N ASP 126.A O no hydrogen 2.971 N/A LEU 131.A N ASN 129.A OD1 no hydrogen 3.105 N/A TYR 132.A N ASN 129.A O no hydrogen 3.456 N/A TYR 132.A OH GLU 140.A OE1 no hydrogen 2.620 N/A GLN 133.A N PRO 130.A O no hydrogen 3.334 N/A LEU 134.A N LEU 131.A O no hydrogen 3.096 N/A VAL 136.A N GLY 23.A O no hydrogen 3.018 N/A ASN 137.A N SER 135.A OG no hydrogen 3.147 N/A ASN 137.A ND2 GLY 21.A O no hydrogen 2.756 N/A ASN 137.A ND2 SER 135.A OG no hydrogen 3.127 N/A TYR 138.A N VAL 136.A O no hydrogen 2.992 N/A ILE 142.A N TYR 138.A O no hydrogen 2.912 N/A ILE 143.A N LEU 139.A O no hydrogen 2.933 N/A ALA 144.A N GLU 140.A O no hydrogen 3.054 N/A GLN 145.A N ALA 141.A O no hydrogen 2.856 N/A GLN 145.A NE2.B ASP 154.A O no hydrogen 2.765 N/A ARG 146.A N ILE 142.A O no hydrogen 2.928 N/A GLN 147.A N ILE 143.A O no hydrogen 3.028 N/A ALA 148.A N ALA 144.A O no hydrogen 3.000 N/A ILE 149.A N GLN 145.A O no hydrogen 2.934 N/A ALA 150.A N ARG 146.A O no hydrogen 2.956 N/A VAL 151.A N ALA 148.A O no hydrogen 3.214 N/A GLY 152.A N ILE 149.A O no hydrogen 3.002 N/A ALA 153.A N ALA 148.A O no hydrogen 2.833 N/A ASP 154.A N ARG 117.A O no hydrogen 2.823 N/A ASP 155.A N ARG 117.A O no hydrogen 3.322 N/A ALA 156.A N ASP 155.A OD1 no hydrogen 2.787 N/A LEU 157.A N ILE 119.A O no hydrogen 2.795 N/A PHE 158.A N GLU 167.A O no hydrogen 2.957 N/A ASN 160.A N HIS 164.A O no hydrogen 2.826 N/A ASN 160.A ND2 ASP 188.A O no hydrogen 2.984 N/A THR 161.A N ARG 125.A O no hydrogen 2.772 N/A GLU 162.A N ASN 160.A OD1 no hydrogen 2.912 N/A ASN 163.A N ASN 160.A O no hydrogen 2.918 N/A HIS 164.A N ASN 160.A OD1 no hydrogen 3.101 N/A VAL 165.A N LEU 214.A O no hydrogen 2.875 N/A THR 166.A N PHE 158.A O no hydrogen 3.007 N/A THR 166.A OG1 PHE 158.A O no hydrogen 3.067 N/A GLU 167.A N THR 166.A OG1 no hydrogen 2.829 N/A THR 168.A N ALA 171.A O no hydrogen 2.922 N/A THR 168.A OG1 ASP 155.A OD2 no hydrogen 2.872 N/A THR 168.A OG1 ALA 171.A O no hydrogen 3.271 N/A THR 169.A N ASP 155.A OD1 no hydrogen 3.290 N/A THR 169.A OG1 ASP 155.A OD1 no hydrogen 2.651 N/A CYS 170.A N THR 168.A OG1 no hydrogen 3.286 N/A CYS 170.A SG ASP 155.A OD2 no hydrogen 3.655 N/A ASN 172.A N THR 228.A O no hydrogen 2.978 N/A ASN 172.A ND2 LEU 191.A O no hydrogen 3.009 N/A PHE 174.A N PHE 226.A O no hydrogen 2.882 N/A LEU 175.A N TYR 182.A O no hydrogen 2.825 N/A ILE 176.A N ALA 224.A O no hydrogen 2.834 N/A GLU 177.A N ILE 180.A O no hydrogen 3.036 N/A ASN 178.A N ASP 223.A OD2 no hydrogen 2.912 N/A ILE 180.A N GLU 177.A O no hydrogen 3.059 N/A LEU 181.A N SER 208.A O no hydrogen 3.019 N/A TYR 182.A N LEU 175.A O no hydrogen 2.799 N/A THR 183.A N GLN 210.A O no hydrogen 2.947 N/A THR 183.A OG1 LEU 173.A O no hydrogen 2.616 N/A ARG 185.A N ASP 188.A OD2 no hydrogen 2.985 N/A GLU 187.A N GLU 187.A OE1 no hydrogen 3.414 N/A ASP 188.A N ARG 185.A O no hydrogen 2.929 N/A GLY 189.A N VAL 186.A O no hydrogen 2.967 N/A ILE 190.A N VAL 186.A O no hydrogen 3.496 N/A LEU 191.A N GLU 167.A OE1 no hydrogen 2.762 N/A ARG 196.A NH2 PRO 184.A O no hydrogen 2.984 N/A ARG 196.A NH2 GLU 211.A OE1 no hydrogen 2.973 N/A ALA 197.A N GLY 193.A O no hydrogen 3.004 N/A ARG 198.A N ILE 194.A O no hydrogen 2.897 N/A ARG 198.A NH2 LEU 259.A O no hydrogen 3.344 N/A ARG 198.A NH2 ASP 262.A OD2 no hydrogen 3.010 N/A LEU 199.A N THR 195.A O no hydrogen 2.897 N/A ILE 200.A N ARG 196.A O no hydrogen 3.026 N/A SER 201.A N ALA 197.A O no hydrogen 3.025 N/A SER 201.A OG.A ALA 197.A O no hydrogen 3.260 N/A SER 201.A OG.B GLN 205.A OE1 no hydrogen 2.613 N/A HIS 202.A N ARG 198.A O no hydrogen 2.852 N/A HIS 202.A NE2 ASP 262.A OD2 no hydrogen 2.505 N/A CYS 203.A N LEU 199.A O no hydrogen 2.837 N/A CYS 203.A SG LEU 199.A O no hydrogen 3.403 N/A GLN 204.A N ILE 200.A O no hydrogen 2.985 N/A GLN 205.A N SER 201.A O no hydrogen 2.920 N/A HIS 206.A N HIS 202.A O no hydrogen 3.019 N/A HIS 206.A N CYS 203.A O no hydrogen 3.165 N/A LYS 207.A N GLN 204.A O no hydrogen 3.346 N/A SER 208.A OG.A GLN 210.A OE1 no hydrogen 3.045 N/A GLN 210.A N LEU 181.A O no hydrogen 2.723 N/A ILE 212.A N THR 183.A O no hydrogen 2.971 N/A SER 213.A OG ASP 188.A OD1 no hydrogen 2.656 N/A SER 213.A OG ASP 188.A OD2 no hydrogen 3.476 N/A LYS 216.A NZ SER 120.A OG no hydrogen 3.421 N/A LYS 216.A NZ ASP 241.A OD2 no hydrogen 2.928 N/A LYS 217.A NZ ASP 221.A OD2 no hydrogen 2.799 N/A ARG 218.A N THR 215.A OG1 no hydrogen 3.176 N/A ARG 218.A NE GLU 177.A OE2 no hydrogen 3.307 N/A ILE 219.A N THR 215.A O no hydrogen 3.463 N/A GLU 220.A N LYS 216.A O no hydrogen 2.865 N/A ASP 221.A N LYS 217.A O no hydrogen 2.929 N/A ALA 222.A N ILE 219.A O no hydrogen 2.972 N/A ASP 223.A N ILE 176.A O no hydrogen 2.776 N/A ALA 224.A N ILE 176.A O no hydrogen 3.334 N/A PHE 226.A N PHE 174.A O no hydrogen 3.000 N/A LEU 227.A N ARG 235.A O no hydrogen 2.773 N/A THR 228.A N ASN 172.A O no hydrogen 2.928 N/A ASN 229.A N GLY 233.A O no hydrogen 3.252 N/A ASN 229.A ND2 CYS 170.A O no hydrogen 3.017 N/A GLN 232.A N ASN 229.A OD1 no hydrogen 2.946 N/A GLN 232.A NE2 SER 110.A O no hydrogen 2.984 N/A GLY 233.A N ASN 229.A O no hydrogen 2.920 N/A ARG 235.A N LEU 227.A O no hydrogen 2.831 N/A ARG 235.A NE HIS 114.A O no hydrogen 2.781 N/A ARG 235.A NH2 HIS 114.A O no hydrogen 2.908 N/A ARG 236.A NH1 VAL 247.A O no hydrogen 2.962 N/A ARG 236.A NH2 ASP 253.A OD1 no hydrogen 2.962 N/A VAL 237.A N VAL 225.A O no hydrogen 3.105 N/A LEU 238.A N VAL 116.A O no hydrogen 2.785 N/A LEU 240.A N ILE 243.A O no hydrogen 2.903 N/A ASP 241.A N LEU 118.A O no hydrogen 2.889 N/A ILE 243.A N LEU 240.A O no hydrogen 2.948 N/A PHE 245.A N LEU 238.A O no hydrogen 2.782 N/A ASN 248.A N GLU 246.A OE2 no hydrogen 2.899 N/A ILE 251.A N HIS 249.A ND1 no hydrogen 3.104 N/A ILE 252.A N HIS 249.A O no hydrogen 2.956 N/A ASP 253.A N HIS 249.A O no hydrogen 3.337 N/A LYS 254.A N PRO 250.A O no hydrogen 3.105 N/A LEU 255.A N ILE 251.A O no hydrogen 2.942 N/A ILE 256.A N ILE 252.A O no hydrogen 2.869 N/A PHE 257.A N ASP 253.A O no hydrogen 3.063 N/A LEU 258.A N LYS 254.A O no hydrogen 2.954 N/A LEU 259.A N LEU 255.A O no hydrogen 2.865 N/A ASN 260.A N ILE 256.A O no hydrogen 2.992 N/A GLN 261.A N PHE 257.A O no hydrogen 3.342 N/A GLU 263.A N LEU 259.A O no hydrogen 3.261 N/A