Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1r8y_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 8.A NH2 PRO 18.A O no hydrogen 3.369 N/A VAL 12.A N SER 9.A O no hydrogen 3.346 N/A ALA 22.A N ASP 19.A O no hydrogen 2.847 N/A GLY 24.A N TYR 21.A O no hydrogen 3.198 N/A ARG 28.A N GLY 24.A O no hydrogen 3.219 N/A VAL 29.A N GLU 25.A O no hydrogen 3.132 N/A TRP 30.A N ALA 26.A O no hydrogen 2.850 N/A GLN 31.A N ALA 27.A O no hydrogen 2.981 N/A TYR 33.A N VAL 29.A O no hydrogen 2.987 N/A ILE 34.A N TRP 30.A O no hydrogen 2.884 N/A ASP 36.A N LEU 32.A O no hydrogen 2.852 N/A ASP 36.A N TYR 33.A O no hydrogen 3.207 N/A ARG 38.A NH2 THR 67.A OG1 no hydrogen 2.340 N/A ARG 40.A NE TYR 194.A OH no hydrogen 3.182 N/A ARG 40.A NH2 VAL 69.A O no hydrogen 2.736 N/A THR 41.A N TYR 193.A O no hydrogen 2.837 N/A THR 41.A OG1 ILE 192.A O no hydrogen 2.413 N/A THR 41.A OG1 TYR 193.A O no hydrogen 3.432 N/A TYR 44.A OH ASP 70.A OD1 no hydrogen 2.715 N/A LYS 45.A N THR 41.A O no hydrogen 3.205 N/A ALA 46.A N ALA 42.A O no hydrogen 3.010 N/A TRP 47.A N GLU 43.A O no hydrogen 3.059 N/A LEU 48.A N TYR 44.A O no hydrogen 3.014 N/A LEU 49.A N LYS 45.A O no hydrogen 3.214 N/A GLY 50.A N ALA 46.A O no hydrogen 2.841 N/A LEU 51.A N TRP 47.A O no hydrogen 2.731 N/A LEU 52.A N LEU 48.A O no hydrogen 2.935 N/A ARG 53.A N LEU 49.A O no hydrogen 3.257 N/A ARG 53.A NH2 GLU 77.A O no hydrogen 3.518 N/A ARG 53.A NH2 GLU 77.A OE1 no hydrogen 3.121 N/A GLN 54.A N GLY 50.A O no hydrogen 2.775 N/A HIS 55.A N LEU 51.A O no hydrogen 2.951 N/A GLY 56.A N ARG 53.A O no hydrogen 2.999 N/A CYS 57.A N LEU 52.A O no hydrogen 2.832 N/A CYS 57.A SG HIS 55.A O no hydrogen 3.840 N/A CYS 57.A SG ASP 131.A O no hydrogen 3.484 N/A HIS 58.A N ASP 131.A OD2 no hydrogen 3.021 N/A ARG 59.A N ASP 131.A OD2 no hydrogen 2.930 N/A VAL 60.A N SER 80.A O no hydrogen 2.943 N/A LEU 61.A N ALA 132.A O no hydrogen 3.021 N/A ASP 62.A N MET 82.A O no hydrogen 2.905 N/A VAL 63.A N ILE 134.A O no hydrogen 2.981 N/A ALA 64.A N ASP 62.A OD1 no hydrogen 3.460 N/A CYS 65.A N VAL 84.A O no hydrogen 3.061 N/A CYS 65.A SG GLY 66.A O no hydrogen 3.302 N/A GLY 66.A N ASP 85.A OD2 no hydrogen 2.861 N/A GLY 68.A N CYS 65.A O no hydrogen 3.169 N/A SER 71.A OG ASP 62.A OD2 no hydrogen 2.621 N/A SER 71.A OG SER 83.A OG no hydrogen 2.735 N/A ILE 72.A N GLY 68.A O no hydrogen 2.790 N/A MET 73.A N VAL 69.A O no hydrogen 3.298 N/A LEU 74.A N ASP 70.A O no hydrogen 3.138 N/A VAL 75.A N SER 71.A O no hydrogen 2.801 N/A GLU 76.A N ILE 72.A O no hydrogen 2.972 N/A GLU 77.A N MET 73.A O no hydrogen 3.182 N/A GLY 78.A N VAL 75.A O no hydrogen 3.321 N/A PHE 79.A N LEU 74.A O no hydrogen 3.320 N/A SER 80.A N HIS 58.A O no hydrogen 3.201 N/A MET 82.A N VAL 60.A O no hydrogen 2.905 N/A SER 83.A N VAL 111.A O no hydrogen 2.854 N/A SER 83.A OG SER 71.A OG no hydrogen 2.735 N/A VAL 84.A N ASP 62.A O no hydrogen 2.982 N/A ASP 85.A N GLU 113.A O no hydrogen 3.424 N/A SER 87.A N ASP 85.A OD1 no hydrogen 2.624 N/A MET 90.A N SER 87.A OG no hydrogen 3.279 N/A LEU 91.A N SER 87.A O no hydrogen 2.867 N/A LYS 92.A N ASP 88.A O no hydrogen 2.881 N/A TYR 93.A N MET 90.A O no hydrogen 2.899 N/A LEU 95.A N LEU 91.A O no hydrogen 2.961 N/A LYS 96.A N LYS 92.A O no hydrogen 3.016 N/A GLU 97.A N TYR 93.A O no hydrogen 3.225 N/A ARG 98.A N ALA 94.A O no hydrogen 3.009 N/A ARG 98.A NH1 TRP 110.A O no hydrogen 2.809 N/A TRP 99.A N LEU 95.A O no hydrogen 3.022 N/A ASN 100.A N LYS 96.A O no hydrogen 3.083 N/A ARG 101.A N GLU 97.A O no hydrogen 2.975 N/A ARG 101.A N ARG 98.A O no hydrogen 3.022 N/A ARG 101.A NE GLU 104.A OE1 no hydrogen 3.433 N/A ARG 101.A NE GLU 104.A OE2 no hydrogen 3.043 N/A ARG 101.A NH1 GLU 76.A OE2 no hydrogen 2.659 N/A ARG 101.A NH2 GLU 76.A OE2 no hydrogen 3.253 N/A ARG 101.A NH2 GLU 104.A OE1 no hydrogen 2.894 N/A ARG 102.A N TRP 99.A O no hydrogen 3.235 N/A ARG 102.A NE TRP 99.A O no hydrogen 3.095 N/A ARG 102.A NH2 TRP 99.A O no hydrogen 3.552 N/A GLU 104.A N ARG 101.A O no hydrogen 3.097 N/A PHE 107.A N GLU 104.A O no hydrogen 2.997 N/A ASP 108.A N GLU 104.A O no hydrogen 3.174 N/A ASN 109.A N PRO 105.A O no hydrogen 3.174 N/A ASN 109.A N SER 106.A O no hydrogen 3.240 N/A TRP 110.A N PHE 107.A O no hydrogen 3.139 N/A TRP 110.A NE1 SER 83.A OG no hydrogen 2.789 N/A VAL 111.A N VAL 81.A O no hydrogen 3.266 N/A GLU 113.A N SER 83.A O no hydrogen 3.104 N/A ALA 115.A N ASP 85.A O no hydrogen 2.832 N/A ASN 116.A N ASP 123.A OD2 no hydrogen 2.995 N/A LEU 118.A N ASN 116.A OD1 no hydrogen 3.368 N/A THR 119.A N ASN 116.A O no hydrogen 3.010 N/A THR 119.A OG1 ASN 116.A O no hydrogen 3.536 N/A THR 119.A OG1 ASP 123.A OD1 no hydrogen 3.171 N/A THR 119.A OG1 ASP 123.A OD2 no hydrogen 2.469 N/A LEU 120.A N TRP 117.A O no hydrogen 3.460 N/A ASP 121.A N ASN 159.A OD1 no hydrogen 3.507 N/A LYS 122.A N THR 119.A O no hydrogen 2.829 N/A ASP 123.A N LEU 120.A O no hydrogen 3.325 N/A VAL 124.A N LEU 120.A O no hydrogen 3.093 N/A GLY 129.A N SER 126.A O no hydrogen 3.108 N/A PHE 130.A N MET 163.A O no hydrogen 2.848 N/A ALA 132.A N ARG 59.A O no hydrogen 3.273 N/A VAL 133.A N LEU 169.A O no hydrogen 2.710 N/A ILE 134.A N LEU 61.A O no hydrogen 2.658 N/A CYS 135.A N VAL 171.A O no hydrogen 2.818 N/A GLY 137.A N ASP 173.A OD2 no hydrogen 2.809 N/A ASN 138.A N ASP 173.A OD1 no hydrogen 2.956 N/A ASN 138.A N ASP 173.A OD2 no hydrogen 3.327 N/A ASN 138.A ND2 TYR 177.A OH no hydrogen 2.890 N/A ALA 141.A N ASN 138.A O no hydrogen 3.297 N/A HIS 142.A N SER 139.A O no hydrogen 3.047 N/A LEU 143.A N PHE 140.A O no hydrogen 3.057 N/A LYS 147.A N GLU 152.A OE1 no hydrogen 3.168 N/A SER 151.A N ASP 149.A OD1 no hydrogen 3.471 N/A SER 151.A OG ASP 149.A OD1 no hydrogen 3.081 N/A HIS 153.A ND1 GLN 150.A OE1 no hydrogen 3.228 N/A HIS 153.A NE2 LEU 143.A O no hydrogen 2.792 N/A ARG 154.A N GLN 150.A O no hydrogen 3.030 N/A LEU 155.A N SER 151.A O no hydrogen 3.094 N/A LEU 155.A N GLU 152.A O no hydrogen 3.242 N/A ALA 156.A N GLU 152.A O no hydrogen 2.885 N/A LEU 157.A N HIS 153.A O no hydrogen 2.905 N/A LYS 158.A N ARG 154.A O no hydrogen 3.211 N/A ASN 159.A N LEU 155.A O no hydrogen 2.781 N/A ILE 160.A N ALA 156.A O no hydrogen 2.919 N/A ALA 161.A N LEU 157.A O no hydrogen 2.855 N/A SER 162.A N LYS 158.A O no hydrogen 2.939 N/A SER 162.A N ASN 159.A O no hydrogen 2.840 N/A SER 162.A OG ASN 159.A O no hydrogen 2.732 N/A MET 163.A N ILE 160.A O no hydrogen 2.986 N/A VAL 164.A N ALA 161.A O no hydrogen 3.070 N/A ARG 165.A N PHE 130.A O no hydrogen 3.122 N/A GLY 167.A N LYS 279.A O no hydrogen 2.735 N/A LEU 169.A N ASP 131.A O no hydrogen 3.074 N/A LEU 170.A N LEU 277.A O no hydrogen 2.816 N/A VAL 171.A N VAL 133.A O no hydrogen 2.831 N/A ILE 172.A N HIS 275.A O no hydrogen 2.880 N/A ASP 173.A N CYS 135.A O no hydrogen 3.228 N/A HIS 174.A N PHE 273.A O no hydrogen 3.000 N/A HIS 174.A ND1 ARG 175.A O no hydrogen 2.924 N/A HIS 174.A NE2 HIS 275.A NE2 no hydrogen 3.070 N/A ARG 175.A N ASN 138.A OD1 no hydrogen 2.919 N/A ASN 176.A N CYS 271.A O no hydrogen 2.844 N/A ASN 176.A ND2 PRO 270.A O no hydrogen 2.900 N/A TYR 179.A N ASN 176.A OD1 no hydrogen 2.834 N/A ILE 180.A N ASN 176.A O no hydrogen 3.168 N/A LEU 181.A N TYR 177.A O no hydrogen 2.946 N/A SER 182.A N ASP 178.A O no hydrogen 3.309 N/A SER 182.A OG ASP 178.A O no hydrogen 3.482 N/A SER 182.A OG TYR 179.A O no hydrogen 3.300 N/A THR 183.A N TYR 179.A O no hydrogen 2.832 N/A THR 183.A OG1 TYR 179.A O no hydrogen 3.270 N/A GLY 184.A N ILE 180.A O no hydrogen 2.487 N/A ALA 186.A N THR 204.A OG1 no hydrogen 2.743 N/A TYR 193.A N ASN 191.A OD1 no hydrogen 2.809 N/A TYR 193.A OH ASP 173.A OD2 no hydrogen 2.535 N/A TYR 194.A N ASN 191.A OD1 no hydrogen 2.810 N/A TYR 194.A OH ASP 70.A OD1 no hydrogen 2.593 N/A LYS 195.A N SER 39.A O no hydrogen 2.979 N/A THR 203.A N ASP 219.A O no hydrogen 3.187 N/A SER 205.A N THR 217.A O no hydrogen 2.818 N/A SER 205.A OG THR 217.A O no hydrogen 3.523 N/A LEU 207.A N MET 215.A O no hydrogen 2.906 N/A VAL 209.A N LYS 212.A O no hydrogen 3.129 N/A LYS 212.A N VAL 209.A O no hydrogen 2.777 N/A HIS 214.A N LEU 207.A O no hydrogen 2.916 N/A MET 215.A N LEU 207.A O no hydrogen 3.396 N/A VAL 216.A N TYR 231.A O no hydrogen 2.946 N/A THR 217.A N SER 205.A O no hydrogen 2.741 N/A THR 217.A OG1 SER 230.A OG no hydrogen 2.974 N/A LEU 218.A N LEU 229.A O no hydrogen 2.830 N/A ASP 219.A N THR 203.A O no hydrogen 3.128 N/A TYR 220.A N PHE 227.A O no hydrogen 2.832 N/A TYR 220.A OH TYR 231.A OH no hydrogen 3.024 N/A THR 221.A N ASP 201.A O no hydrogen 2.641 N/A VAL 222.A N SER 225.A O no hydrogen 2.814 N/A SER 225.A N VAL 222.A O no hydrogen 3.002 N/A SER 225.A OG GLU 25.A OE1 no hydrogen 3.343 N/A LYS 226.A N GLU 25.A OE2 no hydrogen 3.346 N/A LYS 226.A NZ THR 221.A OG1 no hydrogen 3.174 N/A PHE 227.A N TYR 220.A O no hydrogen 2.997 N/A ARG 228.A NE ASP 219.A OD1 no hydrogen 2.735 N/A ARG 228.A NH2 ASP 219.A OD1 no hydrogen 3.258 N/A ARG 228.A NH2 ASP 219.A OD2 no hydrogen 3.472 N/A LEU 229.A N LEU 218.A O no hydrogen 3.016 N/A SER 230.A OG THR 217.A OG1 no hydrogen 2.974 N/A TYR 231.A N VAL 216.A O no hydrogen 2.896 N/A TYR 231.A OH TYR 220.A OH no hydrogen 3.024 N/A TYR 232.A N ALA 141.A O no hydrogen 2.640 N/A LEU 236.A N ASP 178.A OD1 no hydrogen 3.124 N/A LEU 236.A N ASP 178.A OD2 no hydrogen 2.916 N/A PHE 239.A N CYS 235.A O no hydrogen 3.045 N/A THR 240.A N LEU 236.A O no hydrogen 3.042 N/A THR 240.A OG1 LEU 236.A O no hydrogen 2.810 N/A GLU 241.A N ALA 237.A O no hydrogen 3.092 N/A LEU 242.A N SER 238.A O no hydrogen 2.859 N/A VAL 243.A N PHE 239.A O no hydrogen 2.819 N/A ARG 244.A N THR 240.A O no hydrogen 2.937 N/A ALA 245.A N GLU 241.A O no hydrogen 2.869 N/A ALA 246.A N LEU 242.A O no hydrogen 3.127 N/A ALA 246.A N VAL 243.A O no hydrogen 3.110 N/A PHE 247.A N ARG 244.A O no hydrogen 3.079 N/A GLY 248.A N ALA 245.A O no hydrogen 2.842 N/A GLY 249.A N ARG 244.A O no hydrogen 3.379 N/A CYS 251.A N GLY 249.A O no hydrogen 2.910 N/A GLN 252.A N LYS 278.A O no hydrogen 2.790 N/A SER 254.A N VAL 276.A O no hydrogen 3.094 N/A LEU 256.A N ILE 274.A O no hydrogen 2.406 N/A GLY 257.A N LYS 260.A O no hydrogen 2.529 N/A GLN 266.A N LYS 263.A O no hydrogen 3.137 N/A GLN 266.A NE2 TYR 268.A O no hydrogen 3.157 N/A TYR 268.A OH ASP 258.A OD2 no hydrogen 2.834 N/A CYS 271.A N ASP 258.A OD1 no hydrogen 3.236 N/A CYS 271.A N ASP 258.A OD2 no hydrogen 2.767 N/A TYR 272.A N ASP 258.A OD1 no hydrogen 2.907 N/A PHE 273.A N HIS 174.A O no hydrogen 2.753 N/A ILE 274.A N LEU 256.A O no hydrogen 3.176 N/A HIS 275.A N ILE 172.A O no hydrogen 2.871 N/A HIS 275.A NE2 HIS 174.A NE2 no hydrogen 3.070 N/A VAL 276.A N SER 254.A O no hydrogen 2.897 N/A LEU 277.A N LEU 170.A O no hydrogen 2.813 N/A LYS 278.A N GLN 252.A O no hydrogen 2.768 N/A LYS 278.A NZ GLY 167.A O no hydrogen 3.173 N/A LYS 279.A N GLY 168.A O no hydrogen 3.098 N/A LYS 279.A NZ ALA 161.A O no hydrogen 2.559 N/A LYS 279.A NZ VAL 164.A O no hydrogen 2.929 N/A