Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8p9u_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 3.A N ASP 145.A O no hydrogen 2.871 N/A GLY 7.A N ASP 46.A OD1 no hydrogen 2.604 N/A GLU 8.A N ASP 46.A OD1 no hydrogen 2.972 N/A ARG 10.A N THR 47.A O no hydrogen 2.636 N/A VAL 12.A N HIS 49.A O no hydrogen 2.974 N/A THR 13.A OG1 LEU 28.A O no hydrogen 2.765 N/A MET 14.A N GLU 51.A O no hydrogen 2.866 N/A TYR 15.A N GLY 27.A O no hydrogen 2.857 N/A ALA 16.A N GLU 53.A O no hydrogen 2.992 N/A GLU 17.A N GLY 25.A O no hydrogen 3.045 N/A ARG 18.A NE ASP 57.A OD1 no hydrogen 2.931 N/A ARG 18.A NH2 ASP 57.A OD1 no hydrogen 2.519 N/A LEU 19.A N.A GLN 23.A O no hydrogen 2.672 N/A LEU 19.A N.B GLN 23.A O no hydrogen 2.666 N/A MET 24.A N ASN 132.A O no hydrogen 2.902 N/A GLY 25.A N GLU 17.A O no hydrogen 3.021 N/A TYR 26.A OH SER 61.A O no hydrogen 2.921 N/A GLY 27.A N TYR 15.A O no hydrogen 2.921 N/A GLY 31.A N GLU 17.A OE2 no hydrogen 2.420 N/A LYS 32.A N GLU 29.A O no hydrogen 3.214 N/A SER 34.A N TYR 26.A O no hydrogen 3.011 N/A SER 34.A OG PRO 36.A O no hydrogen 2.604 N/A GLY 37.A N TYR 135.A O no hydrogen 2.675 N/A ILE 40.A N PRO 137.A O no hydrogen 3.067 N/A LEU 42.A N ILE 139.A O no hydrogen 2.813 N/A ASN 43.A N ASP 46.A OD2 no hydrogen 3.077 N/A GLU 44.A N ARG 141.A O no hydrogen 2.811 N/A GLY 45.A N THR 95.A OG1 no hydrogen 2.755 N/A ASP 46.A N ASN 43.A O no hydrogen 2.975 N/A THR 47.A N GLU 8.A O no hydrogen 2.988 N/A LEU 48.A N TRP 93.A O no hydrogen 2.724 N/A HIS 49.A N ARG 10.A O no hydrogen 2.811 N/A HIS 49.A ND1 THR 92.A OG1 no hydrogen 2.838 N/A VAL 50.A N TYR 91.A O no hydrogen 2.631 N/A GLU 51.A N VAL 12.A O no hydrogen 2.725 N/A PHE 52.A N ARG 89.A O no hydrogen 2.630 N/A GLU 53.A N MET 14.A O no hydrogen 2.801 N/A ASN 54.A N GLY 87.A O no hydrogen 2.910 N/A ASN 54.A ND2 VAL 58.A O no hydrogen 2.974 N/A ASN 54.A ND2 VAL 83.A O no hydrogen 3.078 N/A ASN 54.A ND2 GLU 84.A O no hydrogen 3.364 N/A THR 55.A N ALA 16.A O no hydrogen 2.944 N/A THR 55.A OG1 ALA 16.A O no hydrogen 2.931 N/A MET 56.A N ASN 54.A OD1 no hydrogen 2.824 N/A VAL 60.A N VAL 83.A O no hydrogen 2.952 N/A SER 61.A N ASP 118.A OD1 no hydrogen 3.260 N/A SER 61.A OG GLY 75.A O no hydrogen 2.656 N/A LEU 62.A N TYR 91.A OH no hydrogen 3.377 N/A HIS 63.A N HIS 117.A O no hydrogen 3.063 N/A HIS 63.A ND1 ASP 74.A O no hydrogen 3.165 N/A HIS 65.A N HIS 115.A O no hydrogen 2.860 N/A LEU 67.A N HIS 65.A O no hydrogen 2.713 N/A ASP 68.A N ARG 94.A O.A no hydrogen 2.827 N/A ASP 68.A N ARG 94.A O.B no hydrogen 2.740 N/A SER 73.A N GLU 70.A O no hydrogen 2.772 N/A ASP 74.A N ILE 71.A O no hydrogen 2.966 N/A GLY 75.A N SER 81.A OG no hydrogen 2.630 N/A THR 76.A N SER 81.A OG no hydrogen 3.035 N/A THR 76.A OG1 ASP 74.A OD2 no hydrogen 3.294 N/A LYS 77.A NZ.B GLU 124.A OE2 no hydrogen 3.116 N/A GLN 78.A N GLN 78.A OE1 no hydrogen 2.350 N/A GLN 78.A NE2 GLU 124.A O no hydrogen 3.101 N/A ASN 79.A N THR 76.A O no hydrogen 3.174 N/A ASN 79.A N THR 76.A OG1 no hydrogen 3.204 N/A LYS 80.A N LYS 77.A O.A no hydrogen 2.941 N/A LYS 80.A N LYS 77.A O.B no hydrogen 3.263 N/A SER 81.A N THR 76.A O no hydrogen 3.066 N/A SER 81.A OG THR 76.A O no hydrogen 3.478 N/A VAL 83.A N VAL 60.A O no hydrogen 2.687 N/A GLY 87.A N GLU 84.A O no hydrogen 2.855 N/A ARG 89.A N PHE 52.A O no hydrogen 2.899 N/A ARG 89.A NH1 LYS 80.A O no hydrogen 3.412 N/A ARG 89.A NH2 SER 72.A O no hydrogen 2.742 N/A TYR 91.A N VAL 50.A O no hydrogen 2.769 N/A TYR 91.A OH SER 81.A O no hydrogen 2.631 N/A THR 92.A N SER 73.A OG no hydrogen 3.079 N/A THR 92.A OG1 HIS 49.A ND1 no hydrogen 2.838 N/A TRP 93.A N LEU 48.A O no hydrogen 2.913 N/A ARG 94.A N.A ASP 68.A O no hydrogen 2.786 N/A ARG 94.A N.B ASP 68.A O no hydrogen 2.788 N/A THR 95.A OG1 ASN 43.A O no hydrogen 3.497 N/A THR 95.A OG1 ASP 46.A O no hydrogen 2.807 N/A HIS 96.A N SER 110.A OG no hydrogen 2.862 N/A HIS 96.A ND1 ASP 68.A OD2 no hydrogen 2.525 N/A HIS 96.A NE2 ALA 108.A O no hydrogen 2.608 N/A GLY 99.A N ARG 107.A O no hydrogen 3.290 N/A ARG 100.A NH1 GLY 104.A O no hydrogen 3.057 N/A ARG 101.A N THR 105.A O no hydrogen 2.650 N/A ARG 101.A NH1 THR 105.A OG1 no hydrogen 2.770 N/A GLY 104.A N ARG 101.A O no hydrogen 3.416 N/A THR 105.A N ASP 103.A OD1 no hydrogen 2.610 N/A THR 105.A OG1 ASP 103.A OD1 no hydrogen 2.458 N/A THR 105.A OG1 ASP 103.A OD2 no hydrogen 3.240 N/A ARG 107.A N GLY 99.A O no hydrogen 2.725 N/A SER 110.A N HIS 96.A O no hydrogen 2.832 N/A SER 110.A OG HIS 96.A ND1 no hydrogen 3.070 N/A SER 110.A OG HIS 96.A O no hydrogen 3.561 N/A ALA 111.A N GLU 44.A OE2 no hydrogen 2.842 N/A GLY 112.A N VAL 140.A O no hydrogen 2.812 N/A TYR 113.A OH GLU 181.A OE2 no hydrogen 2.691 N/A TRP 114.A N VAL 138.A O no hydrogen 2.629 N/A TRP 114.A NE1 SER 110.A O no hydrogen 2.978 N/A HIS 115.A NE2 ALA 227.A O no hydrogen 2.999 N/A TYR 116.A N GLY 136.A O no hydrogen 2.964 N/A TYR 116.A OH PRO 38.A O no hydrogen 2.880 N/A HIS 117.A N HIS 63.A O no hydrogen 2.774 N/A HIS 117.A ND1 ASP 118.A O no hydrogen 2.689 N/A HIS 117.A NE2 HIS 65.A NE2 no hydrogen 3.266 N/A ASP 118.A N LEU 134.A O no hydrogen 3.110 N/A HIS 119.A N SER 61.A OG no hydrogen 2.772 N/A HIS 119.A ND1 HIS 119.A O no hydrogen 2.613 N/A HIS 119.A ND1 GLU 124.A O no hydrogen 2.847 N/A VAL 120.A N ASP 118.A OD1 no hydrogen 3.024 N/A VAL 121.A N ASP 118.A OD1 no hydrogen 3.217 N/A VAL 121.A N ASP 118.A OD2 no hydrogen 2.909 N/A THR 123.A OG1 THR 127.A OG1 no hydrogen 3.162 N/A HIS 125.A N THR 123.A OG1 no hydrogen 2.971 N/A GLY 126.A N THR 123.A O no hydrogen 2.917 N/A THR 127.A OG1 THR 123.A OG1 no hydrogen 3.162 N/A GLY 129.A N VAL 121.A O no hydrogen 3.153 N/A ILE 130.A N GLY 126.A O no hydrogen 2.822 N/A ARG 131.A N THR 127.A O no hydrogen 3.028 N/A ASN 132.A N GLY 128.A O no hydrogen 2.554 N/A GLY 133.A N GLY 129.A O no hydrogen 2.878 N/A GLY 133.A N ILE 130.A O no hydrogen 3.187 N/A LEU 134.A N GLY 129.A O no hydrogen 2.979 N/A TYR 135.A N GLY 133.A O no hydrogen 2.975 N/A TYR 135.A OH ASN 163.A OD1 no hydrogen 2.620 N/A GLY 136.A N TYR 116.A O no hydrogen 2.972 N/A VAL 138.A N TRP 114.A O no hydrogen 2.865 N/A ILE 139.A N ILE 40.A O no hydrogen 2.794 N/A VAL 140.A N GLY 112.A O no hydrogen 2.957 N/A ARG 141.A N LEU 42.A O no hydrogen 2.589 N/A ARG 141.A NH1 GLU 181.A OE1 no hydrogen 3.516 N/A ARG 141.A NH1 GLU 181.A OE2 no hydrogen 2.739 N/A ARG 141.A NH2 GLU 41.A OE1 no hydrogen 3.435 N/A ARG 141.A NH2 GLU 181.A OE1 no hydrogen 2.707 N/A ARG 141.A NH2 GLU 181.A OE2 no hydrogen 3.522 N/A ARG 142.A N ASP 145.A OD2 no hydrogen 2.735 N/A ARG 142.A NE GLU 44.A OE1 no hydrogen 3.016 N/A ARG 142.A NH2 GLU 44.A OE2 no hydrogen 2.837 N/A GLY 144.A N ALA 3.A O no hydrogen 2.838 N/A ASP 145.A N ARG 142.A O no hydrogen 2.907 N/A LEU 147.A N GLY 1.A O no hydrogen 2.972 N/A ASP 149.A N ARG 179.A O no hydrogen 2.675 N/A THR 151.A OG1 GLU 181.A OE1 no hydrogen 2.513 N/A HIS 152.A N GLU 181.A O no hydrogen 2.710 N/A ILE 154.A N VAL 183.A O no hydrogen 2.808 N/A VAL 155.A N ASN 162.A OD1 no hydrogen 2.734 N/A PHE 156.A N ILE 185.A O no hydrogen 2.823 N/A ASN 157.A N THR 160.A O no hydrogen 2.837 N/A ASN 157.A ND2 ILE 130.A O no hydrogen 3.149 N/A ASN 157.A ND2 ARG 131.A O no hydrogen 3.518 N/A ASN 157.A ND2 ASN 163.A OD1 no hydrogen 2.724 N/A ASP 158.A N HIS 187.A O no hydrogen 3.104 N/A THR 160.A N ASN 157.A O no hydrogen 3.034 N/A THR 160.A OG1 ASN 157.A O no hydrogen 3.088 N/A ASN 162.A N VAL 155.A O no hydrogen 2.907 N/A ASN 162.A ND2 THR 153.A O no hydrogen 3.286 N/A ASN 163.A N THR 160.A OG1 no hydrogen 3.099 N/A ASN 163.A ND2 GLN 23.A OE1 no hydrogen 3.170 N/A ASN 163.A ND2 ARG 131.A O no hydrogen 2.862 N/A ARG 164.A N ILE 161.A O no hydrogen 3.105 N/A ARG 164.A NE THR 168.A O no hydrogen 2.602 N/A ARG 164.A NH2 THR 168.A O no hydrogen 3.161 N/A HIS 167.A N GLY 258.A O no hydrogen 3.131 N/A HIS 167.A NE2 ASP 256.A O no hydrogen 3.183 N/A THR 168.A OG1 PRO 165.A O no hydrogen 2.397 N/A PHE 172.A N LEU 262.A O no hydrogen 2.870 N/A ALA 174.A N LEU 264.A O no hydrogen 2.789 N/A THR 175.A N ASP 178.A OD2 no hydrogen 2.630 N/A THR 175.A OG1 VAL 176.A O no hydrogen 3.511 N/A THR 175.A OG1 ASP 178.A OD1 no hydrogen 3.134 N/A THR 175.A OG1 ASP 178.A OD2 no hydrogen 3.473 N/A VAL 176.A N LYS 266.A O no hydrogen 2.861 N/A GLY 177.A N ALA 236.A O no hydrogen 2.925 N/A ASP 178.A N THR 175.A O no hydrogen 2.998 N/A ARG 179.A N ASP 149.A OD2 no hydrogen 2.879 N/A ARG 179.A NH1 GLN 233.A OE1 no hydrogen 2.987 N/A VAL 180.A N ILE 234.A O no hydrogen 2.850 N/A GLU 181.A N ALA 150.A O no hydrogen 2.701 N/A ILE 182.A N PHE 232.A O no hydrogen 2.821 N/A VAL 183.A N HIS 152.A O no hydrogen 2.870 N/A MET 184.A N PHE 230.A O no hydrogen 2.816 N/A ILE 185.A N ILE 154.A O no hydrogen 3.138 N/A THR 186.A N ASN 228.A O no hydrogen 3.129 N/A HIS 187.A N PHE 156.A O no hydrogen 2.826 N/A GLU 189.A N ASP 158.A OD1 no hydrogen 2.802 N/A HIS 192.A N CYS 224.A O.A no hydrogen 2.804 N/A HIS 192.A N CYS 224.A O.B no hydrogen 2.803 N/A PHE 194.A N LYS 222.A O no hydrogen 3.184 N/A HIS 195.A N HIS 248.A O no hydrogen 2.867 N/A HIS 195.A ND1 ASP 220.A O no hydrogen 2.687 N/A MET 196.A N ASP 220.A O no hydrogen 3.311 N/A HIS 197.A N MET 246.A O no hydrogen 2.661 N/A HIS 197.A NE2 HIS 248.A NE2 no hydrogen 3.204 N/A HIS 199.A ND1 HIS 197.A O no hydrogen 2.868 N/A TRP 201.A N ILE 219.A O no hydrogen 2.881 N/A ALA 202.A N GLY 207.A O no hydrogen 3.026 N/A ASP 203.A N GLN 217.A O no hydrogen 2.809 N/A ASN 204.A N ALA 202.A O no hydrogen 2.937 N/A ASN 204.A ND2 MET 208.A O.A no hydrogen 3.101 N/A ASN 204.A ND2 MET 208.A O.B no hydrogen 3.038 N/A ARG 205.A NH1 ASP 145.A OD1 no hydrogen 3.570 N/A ARG 205.A NH1 ASP 145.A OD2 no hydrogen 2.970 N/A ARG 205.A NH2 ASP 145.A OD1 no hydrogen 2.918 N/A GLY 207.A N ASN 204.A OD1 no hydrogen 2.902 N/A MET 208.A N.A THR 206.A OG1 no hydrogen 3.174 N/A MET 208.A N.B THR 206.A OG1 no hydrogen 3.166 N/A THR 210.A N ASP 214.A OD2 no hydrogen 3.080 N/A ASP 214.A N GLY 211.A O no hydrogen 3.300 N/A SER 216.A N ASP 214.A OD1 no hydrogen 3.015 N/A SER 216.A OG ASP 214.A OD1 no hydrogen 2.520 N/A ILE 219.A N TRP 201.A O no hydrogen 2.784 N/A LYS 222.A N PHE 194.A O no hydrogen 3.254 N/A LYS 222.A NZ ASP 203.A OD1 no hydrogen 3.155 N/A CYS 224.A N.A HIS 192.A O no hydrogen 2.776 N/A CYS 224.A N.B HIS 192.A O no hydrogen 2.787 N/A CYS 224.A SG.A THR 186.A OG1 no hydrogen 3.178 N/A CYS 224.A SG.A HIS 192.A O no hydrogen 3.528 N/A CYS 224.A SG.A LYS 222.A O no hydrogen 3.952 N/A CYS 224.A SG.B ILE 223.A O no hydrogen 3.211 N/A GLY 225.A N ASN 228.A OD1 no hydrogen 2.825 N/A ALA 227.A N THR 186.A O no hydrogen 2.680 N/A ASN 228.A N GLY 225.A O no hydrogen 2.932 N/A SER 229.A OG TYR 113.A O no hydrogen 2.727 N/A PHE 230.A N MET 184.A O no hydrogen 3.017 N/A PHE 232.A N ILE 182.A O no hydrogen 2.977 N/A GLN 233.A NE2 VAL 146.A O no hydrogen 2.781 N/A GLN 233.A NE2 GLU 181.A OE2 no hydrogen 3.160 N/A ILE 234.A N VAL 180.A O no hydrogen 2.944 N/A ALA 236.A N ASP 178.A O no hydrogen 2.735 N/A GLY 237.A N HIS 199.A NE2 no hydrogen 3.024 N/A GLU 238.A N ILE 235.A O no hydrogen 3.096 N/A VAL 240.A N GLY 237.A O no hydrogen 2.981 N/A GLY 241.A N GLY 237.A O no hydrogen 2.647 N/A GLY 243.A N VAL 265.A O no hydrogen 3.015 N/A TRP 245.A N PHE 263.A O no hydrogen 3.039 N/A TRP 245.A NE1 GLY 241.A O no hydrogen 2.886 N/A TYR 247.A N GLY 261.A O no hydrogen 3.077 N/A TYR 247.A OH PRO 170.A O no hydrogen 2.893 N/A HIS 248.A N HIS 195.A O no hydrogen 2.989 N/A HIS 248.A ND1 CYS 249.A O no hydrogen 2.675 N/A HIS 248.A NE2 HIS 197.A NE2 no hydrogen 3.204 N/A CYS 249.A N MET 259.A O no hydrogen 3.079 N/A CYS 249.A SG HIS 192.A ND1 no hydrogen 3.667 N/A CYS 249.A SG THR 193.A O no hydrogen 3.846 N/A CYS 249.A SG HIS 254.A ND1 no hydrogen 3.455 N/A HIS 250.A N THR 193.A O no hydrogen 2.647 N/A HIS 250.A N THR 193.A OG1 no hydrogen 3.107 N/A HIS 250.A ND1 HIS 250.A O no hydrogen 2.582 N/A SER 255.A N VAL 251.A O no hydrogen 3.065 N/A SER 255.A OG GLN 252.A O no hydrogen 2.980 N/A ASP 256.A N GLN 252.A O no hydrogen 2.987 N/A MET 257.A N SER 253.A O no hydrogen 2.897 N/A GLY 258.A N SER 255.A O no hydrogen 3.002 N/A MET 259.A N HIS 254.A O no hydrogen 3.120 N/A GLY 261.A N TYR 247.A O no hydrogen 2.858 N/A PHE 263.A N TRP 245.A O no hydrogen 2.715 N/A LEU 264.A N PHE 172.A O no hydrogen 2.606 N/A VAL 265.A N GLY 243.A O no hydrogen 3.005 N/A LYS 266.A N ALA 174.A O no hydrogen 2.741 N/A LYS 266.A NZ GLU 173.A OE1 no hydrogen 2.907 N/A LYS 267.A N THR 271.A O no hydrogen 3.058 N/A GLY 270.A N LYS 267.A O no hydrogen 2.861 N/A THR 271.A N ASP 269.A OD1 no hydrogen 2.714 N/A THR 271.A OG1 ASP 269.A OD1 no hydrogen 2.519 N/A THR 271.A OG1 ASP 269.A OD2 no hydrogen 2.938 N/A TYR 275.A N ILE 272.A O no hydrogen 3.080 N/A