Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8jg8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 3.A N ASP 6.A OD2 no hydrogen 2.955 N/A ASP 6.A N ALA 3.A O no hydrogen 2.807 N/A PHE 7.A N LEU 4.A O no hydrogen 3.182 N/A GLU 8.A N ARG 24.A O no hydrogen 3.092 N/A LEU 13.A N VAL 20.A O no hydrogen 2.700 N/A GLY 14.A N VAL 20.A O no hydrogen 3.366 N/A VAL 20.A N GLY 14.A O no hydrogen 3.010 N/A TYR 21.A N LEU 34.A O no hydrogen 2.778 N/A LEU 22.A N ARG 11.A O no hydrogen 2.742 N/A ALA 23.A N LEU 32.A O no hydrogen 3.012 N/A ARG 24.A N GLU 8.A O no hydrogen 3.049 N/A ARG 24.A NH2 GLU 8.A OE1 no hydrogen 3.255 N/A GLU 25.A N PHE 30.A O no hydrogen 2.835 N/A LYS 26.A N ASP 6.A O no hydrogen 2.966 N/A LYS 26.A NZ GLU 5.A O no hydrogen 2.827 N/A SER 28.A N GLU 25.A OE1 no hydrogen 2.425 N/A LYS 29.A N GLU 25.A O no hydrogen 2.566 N/A LEU 32.A N ALA 23.A O no hydrogen 2.966 N/A ALA 33.A N LEU 83.A O no hydrogen 2.837 N/A LEU 34.A N TYR 21.A O no hydrogen 2.729 N/A LYS 35.A N LEU 81.A O no hydrogen 3.033 N/A VAL 36.A N ASN 19.A O no hydrogen 2.888 N/A LEU 37.A N VAL 79.A O no hydrogen 2.542 N/A LYS 39.A N THR 77.A O no hydrogen 3.151 N/A LYS 39.A NZ ALA 76.A O no hydrogen 3.164 N/A LYS 39.A NZ ARG 78.A O no hydrogen 3.419 N/A GLN 41.A N PHE 38.A O no hydrogen 2.791 N/A LEU 42.A N PHE 38.A O no hydrogen 3.313 N/A GLU 43.A N LYS 39.A O no hydrogen 2.706 N/A LYS 44.A N ALA 40.A O no hydrogen 3.151 N/A ALA 45.A N GLN 41.A O no hydrogen 3.197 N/A GLY 46.A N GLU 43.A O no hydrogen 2.846 N/A VAL 47.A N LEU 42.A O no hydrogen 3.017 N/A HIS 49.A N GLN 50.A OE1 no hydrogen 2.800 N/A GLN 50.A N GLN 50.A OE1 no hydrogen 2.210 N/A GLN 50.A NE2 GLY 46.A O no hydrogen 2.592 N/A ARG 53.A N HIS 49.A O no hydrogen 2.784 N/A GLU 54.A N GLN 50.A O no hydrogen 3.161 N/A VAL 55.A N LEU 51.A O no hydrogen 2.897 N/A GLU 56.A N ARG 53.A O no hydrogen 2.979 N/A ILE 57.A N ARG 53.A O no hydrogen 3.115 N/A GLN 58.A N GLU 54.A O no hydrogen 2.797 N/A GLN 58.A NE2 LEU 67.A O no hydrogen 2.753 N/A SER 59.A OG VAL 55.A O no hydrogen 2.655 N/A SER 59.A OG GLU 56.A O no hydrogen 2.987 N/A ARG 62.A N TYR 119.A OH no hydrogen 2.586 N/A ASN 65.A N HIS 63.A ND1 no hydrogen 2.966 N/A ASN 65.A ND2 LEU 143.A O no hydrogen 2.787 N/A ILE 66.A N HIS 63.A O no hydrogen 2.913 N/A LEU 67.A N ILE 145.A O no hydrogen 2.889 N/A ARG 68.A N GLU 84.A OE1 no hydrogen 3.347 N/A TYR 70.A N ILE 82.A O no hydrogen 2.963 N/A PHE 73.A N TYR 80.A O no hydrogen 3.126 N/A ASP 75.A N ARG 78.A O no hydrogen 3.050 N/A THR 77.A N ASP 75.A OD2 no hydrogen 2.976 N/A ARG 78.A N ASP 75.A OD1 no hydrogen 3.127 N/A ARG 78.A N ASP 75.A OD2 no hydrogen 3.349 N/A ARG 78.A NH1 TYR 80.A OH no hydrogen 3.350 N/A VAL 79.A N LEU 37.A O no hydrogen 2.456 N/A TYR 80.A N PHE 73.A O no hydrogen 2.809 N/A TYR 80.A OH ASP 75.A OD1 no hydrogen 2.925 N/A LEU 81.A N LYS 35.A O no hydrogen 3.002 N/A ILE 82.A N GLY 71.A O no hydrogen 2.999 N/A LEU 83.A N ALA 33.A O no hydrogen 2.692 N/A GLU 84.A N ARG 68.A O no hydrogen 2.961 N/A LEU 88.A N LEU 137.A O no hydrogen 3.014 N/A GLY 89.A N ALA 86.A O no hydrogen 3.254 N/A VAL 91.A N LEU 135.A O no hydrogen 2.771 N/A TYR 92.A N PRO 132.A O no hydrogen 3.035 N/A ARG 93.A N THR 90.A OG1 no hydrogen 2.841 N/A GLU 94.A N THR 90.A O no hydrogen 3.432 N/A LEU 95.A N VAL 91.A O no hydrogen 2.751 N/A GLN 96.A N TYR 92.A O no hydrogen 2.955 N/A LYS 97.A N ARG 93.A O no hydrogen 3.100 N/A LEU 98.A N GLU 94.A O no hydrogen 3.036 N/A LYS 100.A N LEU 98.A O no hydrogen 2.466 N/A PHE 101.A N PHE 187.A O no hydrogen 2.882 N/A ARG 105.A N ASP 102.A OD1 no hydrogen 2.564 N/A THR 106.A N ASP 102.A O no hydrogen 2.974 N/A THR 106.A OG1 ASP 102.A O no hydrogen 2.751 N/A ALA 107.A N GLU 103.A O no hydrogen 2.874 N/A THR 108.A N GLN 104.A O no hydrogen 2.883 N/A THR 108.A OG1 GLN 104.A O no hydrogen 2.299 N/A TYR 109.A N ARG 105.A O no hydrogen 2.898 N/A ILE 110.A N THR 106.A O no hydrogen 2.847 N/A THR 111.A N ALA 107.A O no hydrogen 2.924 N/A THR 111.A OG1 ALA 107.A O no hydrogen 2.700 N/A THR 111.A OG1 SER 252.A OG no hydrogen 2.891 N/A GLU 112.A N THR 108.A O no hydrogen 2.963 N/A LEU 113.A N TYR 109.A O no hydrogen 2.882 N/A ALA 114.A N ILE 110.A O no hydrogen 2.857 N/A ASN 115.A N THR 111.A O no hydrogen 3.028 N/A ALA 116.A N GLU 112.A O no hydrogen 3.264 N/A LEU 117.A N LEU 113.A O no hydrogen 2.971 N/A SER 118.A N ALA 114.A O no hydrogen 2.930 N/A SER 118.A OG ALA 114.A O no hydrogen 2.614 N/A TYR 119.A N ASN 115.A O no hydrogen 3.393 N/A CYS 120.A N ALA 116.A O no hydrogen 3.157 N/A CYS 120.A SG ALA 116.A O no hydrogen 3.368 N/A HIS 121.A N LEU 117.A O no hydrogen 2.706 N/A HIS 121.A NE2 ASP 176.A OD2 no hydrogen 2.832 N/A SER 122.A N SER 118.A O no hydrogen 2.803 N/A SER 122.A OG SER 118.A O no hydrogen 2.492 N/A LYS 123.A N TYR 119.A O no hydrogen 3.291 N/A ARG 124.A N HIS 121.A O no hydrogen 2.819 N/A VAL 125.A N CYS 120.A O no hydrogen 2.632 N/A ILE 126.A N VAL 152.A O no hydrogen 2.969 N/A HIS 127.A N ASP 176.A OD2 no hydrogen 3.370 N/A HIS 127.A NE2 ALA 146.A O no hydrogen 3.222 N/A ARG 128.A N ASP 176.A OD1 no hydrogen 2.863 N/A LYS 131.A NZ ASP 129.A OD1 no hydrogen 3.431 N/A LYS 131.A NZ ASP 129.A OD2 no hydrogen 3.499 N/A GLU 133.A N GLU 133.A OE1 no hydrogen 3.097 N/A ASN 134.A N LYS 131.A O no hydrogen 2.697 N/A ASN 134.A ND2 ASP 129.A O no hydrogen 3.123 N/A LEU 135.A N PRO 132.A O no hydrogen 3.372 N/A LEU 136.A N LYS 144.A O no hydrogen 2.849 N/A LEU 137.A N GLY 89.A O no hydrogen 2.621 N/A GLY 138.A N GLU 142.A O no hydrogen 2.725 N/A SER 139.A OG GLU 142.A OE2 no hydrogen 2.968 N/A ALA 140.A N GLU 142.A OE2 no hydrogen 3.261 N/A GLY 141.A N GLY 138.A O no hydrogen 2.980 N/A LEU 143.A N GLU 112.A OE1 no hydrogen 3.085 N/A LYS 144.A N LEU 136.A O no hydrogen 2.768 N/A LYS 144.A NZ PRO 64.A O no hydrogen 2.925 N/A LYS 144.A NZ GLU 84.A OE1 no hydrogen 2.884 N/A LYS 144.A NZ GLU 84.A OE2 no hydrogen 3.126 N/A ILE 145.A N ASN 65.A O no hydrogen 3.043 N/A ALA 146.A N ASN 134.A O no hydrogen 2.857 N/A SER 151.A N PHE 148.A O no hydrogen 3.113 N/A SER 151.A OG PHE 148.A O no hydrogen 2.822 N/A VAL 152.A N ILE 126.A O no hydrogen 3.273 N/A TYR 160.A OH GLU 186.A OE1 no hydrogen 2.641 N/A LEU 161.A N LEU 158.A O no hydrogen 2.882 N/A GLU 164.A N GLU 164.A OE1 no hydrogen 2.591 N/A MET 165.A N PRO 162.A O no hydrogen 3.104 N/A ILE 166.A N PRO 162.A O no hydrogen 3.198 N/A GLU 167.A N PRO 163.A O no hydrogen 3.021 N/A GLY 168.A N MET 165.A O no hydrogen 3.284 N/A ARG 169.A NH1 GLU 167.A OE1 no hydrogen 2.485 N/A ARG 169.A NH1 HIS 231.A NE2 no hydrogen 3.077 N/A GLU 173.A N GLU 173.A OE1 no hydrogen 3.069 N/A LYS 174.A N ASP 172.A OD1 no hydrogen 3.260 N/A LYS 174.A NZ ARG 236.A O no hydrogen 2.736 N/A LYS 174.A NZ PRO 237.A O no hydrogen 3.287 N/A ASP 176.A N GLU 173.A O no hydrogen 3.350 N/A LEU 177.A N LYS 174.A O no hydrogen 3.211 N/A TRP 178.A N LYS 174.A O no hydrogen 3.265 N/A TRP 178.A N VAL 175.A O no hydrogen 3.124 N/A SER 179.A N VAL 175.A O no hydrogen 3.214 N/A SER 179.A OG TYR 160.A O no hydrogen 3.170 N/A SER 179.A OG VAL 175.A O no hydrogen 3.333 N/A LEU 180.A N ASP 176.A O no hydrogen 2.942 N/A GLY 181.A N TRP 178.A O no hydrogen 2.929 N/A VAL 182.A N TRP 178.A O no hydrogen 3.071 N/A LEU 183.A N SER 179.A O no hydrogen 2.890 N/A CYS 184.A N LEU 180.A O no hydrogen 3.264 N/A TYR 185.A N GLY 181.A O no hydrogen 3.097 N/A TYR 185.A OH THR 212.A O no hydrogen 2.679 N/A GLU 186.A N VAL 182.A O no hydrogen 2.900 N/A PHE 187.A N LEU 183.A O no hydrogen 2.495 N/A LEU 188.A N CYS 184.A O no hydrogen 3.126 N/A LEU 188.A N TYR 185.A O no hydrogen 2.959 N/A VAL 189.A N TYR 185.A O no hydrogen 2.677 N/A GLY 190.A N GLU 186.A O no hydrogen 2.718 N/A GLU 195.A N PRO 192.A O no hydrogen 3.433 N/A GLN 200.A N GLN 200.A OE1 no hydrogen 2.628 N/A THR 202.A N THR 198.A O no hydrogen 2.899 N/A THR 202.A OG1 PHE 194.A O no hydrogen 3.443 N/A THR 202.A OG1 THR 198.A O no hydrogen 3.194 N/A TYR 203.A N TYR 199.A O no hydrogen 2.913 N/A TYR 203.A OH ILE 166.A O no hydrogen 2.958 N/A LYS 204.A N GLN 200.A O no hydrogen 3.302 N/A ARG 205.A N GLU 201.A O no hydrogen 2.889 N/A ARG 205.A NE GLU 210.A O no hydrogen 3.382 N/A ARG 205.A NH1 GLU 210.A O no hydrogen 2.884 N/A ARG 205.A NH2 GLU 195.A O no hydrogen 2.553 N/A ILE 206.A N THR 202.A O no hydrogen 2.789 N/A SER 207.A N TYR 203.A O no hydrogen 2.944 N/A SER 207.A OG GLU 167.A OE2 no hydrogen 2.704 N/A ARG 208.A N LYS 204.A O no hydrogen 2.967 N/A ARG 208.A NH1 GLU 210.A OE1 no hydrogen 3.300 N/A VAL 209.A N ILE 206.A O no hydrogen 2.801 N/A GLU 210.A N ARG 205.A O no hydrogen 2.825 N/A THR 218.A OG1 GLU 103.A OE1 no hydrogen 3.235 N/A THR 218.A OG1 GLU 103.A OE2 no hydrogen 2.773 N/A ALA 221.A N THR 218.A O no hydrogen 2.744 N/A ARG 222.A N THR 218.A O no hydrogen 2.658 N/A ARG 222.A NE VAL 217.A O no hydrogen 3.060 N/A ASP 223.A N GLU 219.A O no hydrogen 2.963 N/A ILE 225.A N ALA 221.A O no hydrogen 3.180 N/A SER 226.A N ARG 222.A O no hydrogen 3.214 N/A SER 226.A OG ARG 222.A O no hydrogen 2.527 N/A SER 226.A OG ASP 223.A O no hydrogen 2.819 N/A ARG 227.A N ASP 223.A O no hydrogen 2.883 N/A ARG 227.A N LEU 224.A O no hydrogen 3.112 N/A ARG 227.A NH2 ASP 223.A OD1 no hydrogen 3.131 N/A LEU 228.A N LEU 224.A O no hydrogen 2.834 N/A LEU 229.A N ILE 225.A O no hydrogen 2.733 N/A LYS 230.A NZ ARG 227.A O no hydrogen 3.308 N/A LYS 230.A NZ GLN 235.A O no hydrogen 3.468 N/A SER 234.A N ASN 232.A OD1 no hydrogen 3.273 N/A GLN 235.A N ASN 232.A O no hydrogen 3.039 N/A ARG 236.A N PRO 233.A O no hydrogen 2.867 N/A ARG 236.A NE LYS 230.A O no hydrogen 2.998 N/A ARG 236.A NH1 GLU 164.A OE2 no hydrogen 2.498 N/A ARG 236.A NH1 LYS 174.A O no hydrogen 2.918 N/A ARG 236.A NH2 GLU 164.A OE1 no hydrogen 2.680 N/A ARG 236.A NH2 LYS 230.A O no hydrogen 3.155 N/A VAL 242.A N MET 238.A O no hydrogen 3.219 N/A LEU 243.A N LEU 239.A O no hydrogen 3.274 N/A GLU 244.A N GLU 241.A O no hydrogen 3.059 N/A HIS 245.A N VAL 242.A O no hydrogen 3.202 N/A HIS 245.A NE2 ASP 223.A OD2 no hydrogen 2.895 N/A TRP 247.A N HIS 245.A ND1 no hydrogen 3.014 N/A TRP 247.A NE1 GLU 103.A OE2 no hydrogen 2.588 N/A THR 249.A N HIS 245.A O no hydrogen 2.826 N/A THR 249.A OG1 PRO 246.A O no hydrogen 2.700 N/A ALA 250.A N PRO 246.A O no hydrogen 2.815 N/A ASN 251.A N TRP 247.A O no hydrogen 3.134 N/A ASN 251.A ND2 TRP 247.A O no hydrogen 2.738 N/A SER 252.A N ILE 248.A O no hydrogen 2.727 N/A SER 252.A OG THR 111.A OG1 no hydrogen 2.891 N/A SER 252.A OG SER 253.A O no hydrogen 3.309 N/A