Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8r9r_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 5.A N ASP 1.A O no hydrogen 3.229 N/A MET 6.A N PRO 2.A O no hydrogen 3.323 N/A LEU 7.A N VAL 3.A O no hydrogen 2.997 N/A GLU 8.A N GLY 4.A O no hydrogen 3.105 N/A SER 9.A N ALA 5.A O no hydrogen 3.069 N/A SER 9.A OG GLU 13.A OE2 no hydrogen 3.349 N/A LYS 10.A N MET 6.A O no hydrogen 2.915 N/A LEU 11.A N LEU 7.A O no hydrogen 2.847 N/A LEU 12.A N GLU 8.A O no hydrogen 2.796 N/A GLU 13.A N SER 9.A O no hydrogen 2.983 N/A ALA 14.A N LYS 10.A O no hydrogen 2.860 N/A GLU 15.A N LEU 12.A O no hydrogen 2.946 N/A PHE 16.A N LEU 11.A O no hydrogen 3.060 N/A SER 17.A N SER 216.A OG no hydrogen 3.065 N/A SER 17.A OG GLN 220.A OE1 no hydrogen 2.553 N/A VAL 20.A N SER 17.A OG no hydrogen 3.410 N/A ALA 21.A N SER 17.A O no hydrogen 2.818 N/A ALA 22.A N PRO 18.A O no hydrogen 3.134 N/A LYS 23.A N ALA 19.A O no hydrogen 3.228 N/A LEU 24.A N VAL 20.A O no hydrogen 2.919 N/A ALA 25.A N ALA 21.A O no hydrogen 2.874 N/A ALA 26.A N ALA 22.A O no hydrogen 2.885 N/A ALA 26.A N LYS 23.A O no hydrogen 3.286 N/A LEU 27.A N LEU 24.A O no hydrogen 3.226 N/A SER 28.A N ALA 25.A O no hydrogen 3.228 N/A SER 28.A OG ALA 25.A O no hydrogen 2.688 N/A GLN 29.A N ALA 26.A O no hydrogen 3.085 N/A GLN 29.A NE2 ASP 1.A OD2 no hydrogen 3.054 N/A HIS 30.A N LEU 27.A O no hydrogen 2.948 N/A THR 32.A N GLU 35.A OE1 no hydrogen 3.293 N/A THR 32.A OG1 GLU 35.A OE1 no hydrogen 3.280 N/A LEU 36.A N THR 32.A O no hydrogen 2.823 N/A VAL 37.A N ALA 34.A O no hydrogen 3.234 N/A ARG 38.A N GLU 35.A O no hydrogen 3.174 N/A ALA 39.A N GLU 35.A O no hydrogen 2.865 N/A LEU 40.A N LEU 36.A O no hydrogen 2.933 N/A GLN 42.A N ARG 38.A O no hydrogen 3.222 N/A GLN 42.A NE2 GLN 42.A O no hydrogen 3.518 N/A GLN 42.A NE2 ASN 46.A OD1 no hydrogen 3.257 N/A SER 43.A N ALA 39.A O no hydrogen 3.000 N/A SER 43.A OG ALA 39.A O no hydrogen 2.814 N/A LEU 44.A N LEU 40.A O no hydrogen 3.112 N/A ALA 45.A N PRO 41.A O no hydrogen 2.777 N/A ASN 46.A N GLN 42.A O no hydrogen 2.990 N/A MET 47.A N SER 43.A O no hydrogen 3.048 N/A LEU 48.A N LEU 44.A O no hydrogen 3.203 N/A LEU 48.A N ALA 45.A O no hydrogen 3.148 N/A ASP 49.A N ASN 46.A O no hydrogen 3.079 N/A ASN 50.A ND2 LEU 225.A O no hydrogen 2.897 N/A ASN 50.A ND2 SER 226.A O no hydrogen 3.076 N/A GLY 52.A N ASN 50.A OD1 no hydrogen 2.791 N/A ARG 57.A N ASP 53.A O no hydrogen 3.223 N/A ARG 57.A NH1 GLN 51.A O no hydrogen 2.932 N/A GLN 58.A N ASP 54.A O no hydrogen 2.729 N/A GLY 59.A N ILE 55.A O no hydrogen 2.742 N/A GLY 60.A N LYS 139.A O no hydrogen 2.856 N/A VAL 62.A N VAL 141.A O no hydrogen 2.829 N/A ALA 63.A N ARG 171.A O no hydrogen 2.837 N/A LEU 64.A N ILE 143.A O no hydrogen 2.900 N/A VAL 65.A N TYR 173.A O no hydrogen 2.962 N/A LYS 72.A NZ GLY 66.A O no hydrogen 3.454 N/A LYS 72.A NZ PRO 67.A O no hydrogen 3.305 N/A THR 73.A OG1 ASP 144.A OD2 no hydrogen 2.671 N/A SER 75.A N GLY 71.A O no hydrogen 2.889 N/A SER 75.A OG GLY 71.A O no hydrogen 2.693 N/A LEU 76.A N LYS 72.A O no hydrogen 2.863 N/A ALA 77.A N THR 73.A O no hydrogen 3.092 N/A LYS 78.A N THR 74.A O no hydrogen 3.204 N/A LYS 78.A NZ GLY 231.A O no hydrogen 2.789 N/A LYS 78.A NZ ASP 237.A O no hydrogen 2.874 N/A LEU 79.A N SER 75.A O no hydrogen 2.948 N/A ALA 80.A N LEU 76.A O no hydrogen 2.904 N/A ALA 81.A N ALA 77.A O no hydrogen 3.116 N/A ARG 82.A N LYS 78.A O no hydrogen 3.000 N/A ARG 82.A NH1 MET 238.A O no hydrogen 3.441 N/A PHE 83.A N LEU 79.A O no hydrogen 2.899 N/A ALA 84.A N ALA 80.A O no hydrogen 2.877 N/A ALA 85.A N ALA 81.A O no hydrogen 2.762 N/A ALA 85.A N ARG 82.A O no hydrogen 3.276 N/A HIS 86.A N ARG 82.A O no hydrogen 3.401 N/A HIS 86.A ND1 ARG 82.A O no hydrogen 2.712 N/A HIS 87.A ND1 PHE 83.A O no hydrogen 3.239 N/A GLU 90.A N GLU 90.A OE1 no hydrogen 2.364 N/A GLN 91.A N GLY 88.A O no hydrogen 3.092 N/A GLN 91.A NE2 GLU 90.A OE2 no hydrogen 3.492 N/A VAL 92.A N PRO 89.A O no hydrogen 2.940 N/A ALA 93.A N LEU 140.A O no hydrogen 3.058 N/A LEU 94.A N PRO 118.A O no hydrogen 2.960 N/A ILE 95.A N LEU 142.A O no hydrogen 2.871 N/A THR 96.A N LYS 120.A O no hydrogen 3.019 N/A THR 96.A OG1 ASP 144.A O no hydrogen 3.291 N/A THR 97.A N ASP 144.A O no hydrogen 3.012 N/A THR 97.A OG1 GLN 158.A OE1 no hydrogen 2.595 N/A ASP 98.A N THR 96.A OG1 no hydrogen 3.095 N/A TYR 100.A N ASP 98.A OD1 no hydrogen 3.146 N/A ARG 101.A N ASP 98.A OD1 no hydrogen 3.191 N/A ARG 101.A NH1 GLY 147.A O no hydrogen 3.388 N/A ARG 101.A NH2 GLY 147.A O no hydrogen 2.807 N/A GLU 106.A N GLU 106.A OE1 no hydrogen 2.693 N/A GLN 107.A N GLN 107.A OE1 no hydrogen 2.671 N/A GLN 107.A NE2 ILE 102.A O no hydrogen 3.637 N/A LEU 108.A N ALA 104.A O no hydrogen 3.302 N/A ALA 109.A N TYR 105.A O no hydrogen 2.591 N/A THR 110.A N GLU 106.A O no hydrogen 2.940 N/A THR 110.A OG1 GLU 106.A O no hydrogen 2.677 N/A TYR 111.A N GLN 107.A O no hydrogen 3.168 N/A GLY 112.A N LEU 108.A O no hydrogen 2.987 N/A LYS 113.A N ALA 109.A O no hydrogen 3.142 N/A ILE 114.A N THR 110.A O no hydrogen 3.083 N/A MET 115.A N TYR 111.A O no hydrogen 2.807 N/A CYS 117.A N GLY 112.A O no hydrogen 2.969 N/A LYS 120.A N LEU 94.A O no hydrogen 2.987 N/A GLN 121.A NE2 ASP 98.A O no hydrogen 3.278 N/A ALA 122.A N THR 96.A O no hydrogen 2.898 N/A HIS 123.A N GLU 127.A OE1 no hydrogen 2.624 N/A HIS 123.A ND1 GLU 127.A OE1 no hydrogen 2.979 N/A GLU 127.A N ASP 124.A OD1 no hydrogen 3.313 N/A LEU 128.A N ASP 124.A O no hydrogen 3.122 N/A GLU 129.A N LEU 125.A O no hydrogen 2.910 N/A GLN 130.A N ASN 126.A O no hydrogen 3.000 N/A ILE 131.A N GLU 127.A O no hydrogen 2.900 N/A LEU 132.A N LEU 128.A O no hydrogen 2.980 N/A TYR 133.A N GLU 129.A O no hydrogen 3.302 N/A GLN 134.A N GLN 130.A O no hydrogen 2.784 N/A PHE 135.A N ILE 131.A O no hydrogen 2.919 N/A ARG 136.A N TYR 133.A O no hydrogen 3.116 N/A ARG 136.A NH1 TYR 133.A O no hydrogen 3.464 N/A ARG 138.A N PHE 135.A O no hydrogen 2.925 N/A ARG 138.A NH1 VAL 92.A O no hydrogen 2.837 N/A LYS 139.A N GLN 91.A O no hydrogen 2.901 N/A LYS 139.A NZ ASN 137.A O no hydrogen 2.740 N/A LEU 140.A N GLN 91.A O no hydrogen 3.003 N/A VAL 141.A N GLY 60.A O no hydrogen 3.031 N/A LEU 142.A N ALA 93.A O no hydrogen 3.010 N/A ILE 143.A N VAL 62.A O no hydrogen 2.692 N/A ASP 144.A N ILE 95.A O no hydrogen 2.769 N/A THR 145.A N LEU 64.A O no hydrogen 3.413 N/A THR 145.A OG1 LEU 64.A O no hydrogen 2.581 N/A ALA 146.A N GLN 158.A OE1 no hydrogen 2.973 N/A GLN 150.A N GLN 150.A OE1 no hydrogen 2.846 N/A GLN 150.A NE2 ASP 187.A OD2 no hydrogen 2.835 N/A ARG 151.A NH1 ASP 187.A OD2 no hydrogen 2.777 N/A ASP 152.A N GLY 149.A O no hydrogen 2.798 N/A ARG 154.A N ASP 152.A OD1 no hydrogen 2.932 N/A ARG 154.A NE ASP 152.A OD1 no hydrogen 3.121 N/A ARG 154.A NH2 ASP 152.A OD2 no hydrogen 2.766 N/A LEU 155.A N ASP 152.A O no hydrogen 2.949 N/A GLN 157.A N ARG 154.A O no hydrogen 2.930 N/A GLN 157.A NE2 TYR 156.A OH no hydrogen 3.499 N/A GLN 158.A NE2 THR 97.A O no hydrogen 2.989 N/A LEU 159.A N LEU 155.A O no hydrogen 3.226 N/A ASP 160.A N TYR 156.A O no hydrogen 2.715 N/A LEU 162.A N LEU 159.A O no hydrogen 3.040 N/A THR 163.A N ASP 160.A O no hydrogen 3.089 N/A ARG 167.A N ASN 165.A OD1 no hydrogen 2.732 N/A ILE 168.A N ASN 165.A O no hydrogen 3.328 N/A ARG 171.A N VAL 61.A O no hydrogen 2.948 N/A ARG 171.A NH1 ASP 54.A OD1 no hydrogen 2.959 N/A ARG 171.A NH2 GLY 59.A O no hydrogen 2.659 N/A TYR 173.A N ALA 63.A O no hydrogen 2.754 N/A LEU 174.A N GLY 199.A O no hydrogen 3.055 N/A VAL 175.A N VAL 65.A O no hydrogen 2.678 N/A LEU 176.A N VAL 201.A O no hydrogen 2.982 N/A SER 177.A OG THR 179.A OG1 no hydrogen 2.609 N/A ALA 178.A N THR 203.A O no hydrogen 2.891 N/A THR 179.A N SER 177.A OG no hydrogen 3.383 N/A THR 179.A OG1 SER 177.A OG no hydrogen 2.609 N/A GLY 180.A N SER 177.A O no hydrogen 3.251 N/A LEU 185.A N GLN 181.A O no hydrogen 3.001 N/A GLN 186.A N ARG 182.A O no hydrogen 2.925 N/A GLN 186.A NE2 GLN 186.A O no hydrogen 3.320 N/A GLN 186.A NE2 ASN 190.A OD1 no hydrogen 2.841 N/A GLN 186.A NE2 SER 221.A OG no hydrogen 3.088 N/A ASP 187.A N ARG 183.A O no hydrogen 2.849 N/A ALA 188.A N VAL 184.A O no hydrogen 2.777 N/A VAL 189.A N LEU 185.A O no hydrogen 2.880 N/A ASN 190.A N GLN 186.A O no hydrogen 2.918 N/A HIS 191.A N ASP 187.A O no hydrogen 3.158 N/A PHE 192.A N ALA 188.A O no hydrogen 2.892 N/A LYS 193.A N VAL 189.A O no hydrogen 2.808 N/A ARG 194.A N HIS 191.A O no hydrogen 3.349 N/A ARG 194.A NE ASP 160.A OD1 no hydrogen 2.845 N/A ARG 194.A NH2 ASP 160.A OD2 no hydrogen 2.922 N/A ILE 195.A N PHE 192.A O no hydrogen 3.310 N/A SER 198.A N SER 172.A O no hydrogen 2.752 N/A ALA 200.A N PRO 224.A O no hydrogen 2.830 N/A VAL 201.A N LEU 174.A O no hydrogen 2.762 N/A LEU 202.A N TYR 227.A O no hydrogen 2.897 N/A THR 203.A N LEU 176.A O no hydrogen 2.906 N/A THR 203.A OG1 VAL 70.A O no hydrogen 2.749 N/A THR 203.A OG1 LEU 176.A O no hydrogen 3.264 N/A LYS 204.A NZ GLY 69.A O no hydrogen 2.761 N/A LEU 205.A N THR 229.A O no hydrogen 3.225 N/A GLU 207.A N LYS 204.A O no hydrogen 3.056 N/A SER 208.A N LEU 205.A O no hydrogen 3.260 N/A SER 208.A OG LYS 204.A O no hydrogen 2.955 N/A ALA 212.A N SER 210.A OG no hydrogen 3.165 N/A LEU 215.A N LEU 211.A O no hydrogen 2.857 N/A SER 216.A N ALA 212.A O no hydrogen 3.015 N/A SER 216.A OG ALA 212.A O no hydrogen 2.659 N/A VAL 217.A N GLY 213.A O no hydrogen 3.001 N/A LEU 218.A N ALA 214.A O no hydrogen 3.329 N/A ILE 219.A N LEU 215.A O no hydrogen 3.075 N/A GLN 220.A N SER 216.A O no hydrogen 2.889 N/A GLN 220.A NE2 GLN 186.A OE1 no hydrogen 3.102 N/A SER 221.A N VAL 217.A O no hydrogen 2.933 N/A SER 221.A OG VAL 217.A O no hydrogen 2.756 N/A GLY 222.A N ILE 219.A O no hydrogen 2.969 N/A LEU 223.A N LEU 218.A O no hydrogen 2.955 N/A LEU 225.A N LEU 48.A O no hydrogen 3.025 N/A SER 226.A N ALA 200.A O no hydrogen 2.945 N/A VAL 228.A N LYS 239.A O no hydrogen 2.878 N/A THR 229.A N LEU 202.A O no hydrogen 2.925 N/A ASP 230.A N ASP 237.A O no hydrogen 3.465 N/A ARG 233.A N ASP 237.A OD2 no hydrogen 3.109 N/A GLU 236.A N GLU 236.A OE1 no hydrogen 2.617 N/A ASP 237.A N ARG 233.A O no hydrogen 3.146 N/A MET 238.A N GLU 236.A O no hydrogen 2.745 N/A LYS 239.A N VAL 228.A O no hydrogen 2.811 N/A LYS 239.A NZ ASP 230.A OD1 no hydrogen 3.224 N/A LYS 239.A NZ ASP 230.A OD2 no hydrogen 3.039 N/A LYS 239.A NZ GLU 236.A O no hydrogen 3.516 N/A ALA 241.A N SER 226.A O no hydrogen 3.161 N/A THR 243.A OG1 ALA 45.A O no hydrogen 3.568 N/A MET 245.A N ASP 242.A OD1 no hydrogen 3.411 N/A LEU 246.A N ASP 242.A O no hydrogen 3.072 N/A ALA 247.A N THR 243.A O no hydrogen 2.690 N/A GLN 248.A N LEU 244.A O no hydrogen 2.902 N/A GLN 249.A N MET 245.A O no hydrogen 2.977 N/A ALA 250.A N LEU 246.A O no hydrogen 2.899 N/A LEU 251.A N ALA 247.A O no hydrogen 2.994 N/A LEU 251.A N GLN 248.A O no hydrogen 3.167 N/A ALA 252.A N GLN 249.A O no hydrogen 3.311 N/A LEU 254.A N LEU 251.A O no hydrogen 3.191 N/A