Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3uk2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A N TYR 85.A O no hydrogen 3.200 N/A ILE 5.A N LEU 87.A O no hydrogen 2.820 N/A GLN 9.A NE2 GLN 9.A O no hydrogen 3.267 N/A GLN 9.A NE2 ASP 13.A OD1 no hydrogen 3.251 N/A GLU 10.A N SER 7.A OG no hydrogen 3.182 N/A LEU 11.A N SER 7.A O no hydrogen 3.005 N/A ARG 12.A N ILE 8.A O no hydrogen 2.909 N/A ARG 12.A NH1 ALA 135.A O no hydrogen 2.801 N/A ASP 13.A N GLN 9.A O no hydrogen 2.873 N/A GLN 14.A N GLU 10.A O no hydrogen 2.940 N/A LEU 15.A N LEU 11.A O no hydrogen 3.045 N/A ARG 16.A N ASP 13.A O no hydrogen 3.460 N/A ARG 16.A NH2 ASP 13.A OD1 no hydrogen 2.908 N/A GLN 18.A N LEU 15.A O no hydrogen 3.041 N/A ALA 22.A N PRO 47.A O no hydrogen 3.066 N/A PHE 23.A N VAL 141.A O no hydrogen 2.769 N/A VAL 24.A N VAL 49.A O no hydrogen 2.846 N/A THR 26.A N SER 51.A O no hydrogen 2.948 N/A THR 26.A OG1 SER 51.A O no hydrogen 2.855 N/A GLY 28.A N THR 26.A OG1 no hydrogen 3.132 N/A ASN 29.A N ASP 75.A OD2 no hydrogen 2.983 N/A ASN 29.A ND2 THR 71.A OG1 no hydrogen 3.060 N/A LEU 30.A N ASP 75.A OD1 no hydrogen 2.771 N/A HIS 31.A N HIS 34.A ND1 no hydrogen 3.102 N/A GLU 32.A N GLU 32.A OE1 no hydrogen 2.693 N/A GLY 33.A N HIS 31.A ND1 no hydrogen 3.065 N/A LEU 35.A N HIS 31.A O no hydrogen 3.123 N/A SER 36.A N GLU 32.A O no hydrogen 3.045 N/A LEU 37.A N GLY 33.A O no hydrogen 3.244 N/A MET 38.A N HIS 34.A O no hydrogen 3.040 N/A ARG 39.A N LEU 35.A O no hydrogen 3.019 N/A LEU 40.A N SER 36.A O no hydrogen 3.010 N/A ALA 41.A N LEU 37.A O no hydrogen 2.824 N/A ARG 42.A N MET 38.A O no hydrogen 3.298 N/A ARG 42.A NH1 ARG 42.A O no hydrogen 3.052 N/A GLN 43.A N LEU 40.A O no hydrogen 2.925 N/A HIS 44.A N ALA 41.A O no hydrogen 2.890 N/A ASP 46.A N ARG 20.A O no hydrogen 2.844 N/A VAL 49.A N ALA 22.A O no hydrogen 2.866 N/A ALA 50.A N VAL 86.A O no hydrogen 2.990 N/A SER 51.A N VAL 24.A O no hydrogen 3.224 N/A ILE 52.A N PHE 88.A O no hydrogen 2.957 N/A PHE 53.A N THR 26.A O no hydrogen 3.127 N/A ASN 55.A ND2 GLN 58.A OE1 no hydrogen 2.854 N/A ASN 55.A ND2 GLY 125.A O no hydrogen 3.063 N/A ARG 56.A NE GLU 92.A OE2 no hydrogen 2.939 N/A ARG 56.A NH2 GLU 92.A OE1 no hydrogen 2.979 N/A LEU 57.A N ASN 55.A OD1 no hydrogen 3.193 N/A GLN 58.A N ASN 55.A O no hydrogen 3.079 N/A PHE 59.A N ARG 56.A O no hydrogen 3.058 N/A GLY 60.A N GLU 63.A OE1 no hydrogen 2.668 N/A GLU 63.A N GLY 60.A O no hydrogen 3.006 N/A TYR 68.A N PHE 65.A O no hydrogen 3.347 N/A ARG 70.A NH1 PHE 65.A O no hydrogen 2.882 N/A ARG 70.A NH2 PHE 65.A O no hydrogen 3.271 N/A THR 71.A OG1 ASP 75.A OD1 no hydrogen 3.195 N/A ASP 75.A N THR 71.A O no hydrogen 2.960 N/A ILE 76.A N LEU 72.A O no hydrogen 2.962 N/A GLU 77.A N GLN 73.A O no hydrogen 3.165 N/A LYS 78.A N GLU 74.A O no hydrogen 2.974 N/A LYS 78.A NZ LEU 30.A O no hydrogen 2.748 N/A LEU 79.A N ASP 75.A O no hydrogen 2.935 N/A GLN 80.A N ILE 76.A O no hydrogen 2.966 N/A LYS 81.A N LYS 78.A O no hydrogen 3.276 N/A GLU 82.A N LEU 79.A O no hydrogen 3.010 N/A TYR 85.A N VAL 48.A O no hydrogen 3.161 N/A LEU 87.A N LYS 3.A O no hydrogen 2.824 N/A PHE 88.A N ALA 50.A O no hydrogen 2.757 N/A ALA 89.A N ILE 5.A O no hydrogen 2.855 N/A THR 91.A N ASP 94.A OD2 no hydrogen 3.120 N/A THR 91.A OG1 ASP 94.A OD2 no hydrogen 2.713 N/A ASP 94.A N THR 91.A OG1 no hydrogen 3.186 N/A MET 95.A N THR 91.A O no hydrogen 3.195 N/A TYR 96.A N GLU 92.A O no hydrogen 2.767 N/A TYR 96.A OH ASN 55.A OD1 no hydrogen 2.641 N/A GLN 100.A NE2 TYR 102.A O no hydrogen 2.817 N/A VAL 104.A N THR 128.A OG1 no hydrogen 2.933 N/A HIS 108.A ND1 ASP 112.A OD2 no hydrogen 2.632 N/A LEU 110.A N PRO 107.A O no hydrogen 3.433 N/A GLY 111.A N PRO 107.A O no hydrogen 2.741 N/A ASP 112.A N HIS 108.A O no hydrogen 3.093 N/A GLU 115.A N GLN 150.A OE1 no hydrogen 3.060 N/A GLY 116.A N ILE 113.A O no hydrogen 2.825 N/A GLU 117.A N LEU 114.A O no hydrogen 3.029 N/A PHE 118.A N LEU 114.A O no hydrogen 3.331 N/A ARG 119.A N GLU 115.A O no hydrogen 2.848 N/A ARG 119.A NE GLU 63.A OE2 no hydrogen 2.837 N/A ARG 119.A NH2 GLU 63.A OE1 no hydrogen 3.107 N/A PHE 122.A N ARG 119.A O no hydrogen 2.981 N/A GLY 125.A N GLY 121.A O no hydrogen 3.183 N/A VAL 126.A N PHE 122.A O no hydrogen 3.022 N/A CYS 127.A N PHE 123.A O no hydrogen 2.813 N/A CYS 127.A SG PHE 123.A O no hydrogen 3.149 N/A THR 128.A N THR 124.A O no hydrogen 3.068 N/A THR 128.A OG1 THR 124.A O no hydrogen 2.699 N/A VAL 129.A N GLY 125.A O no hydrogen 3.217 N/A VAL 130.A N VAL 126.A O no hydrogen 2.953 N/A THR 131.A N CYS 127.A O no hydrogen 2.959 N/A THR 131.A OG1 CYS 127.A O no hydrogen 2.890 N/A LYS 132.A N THR 128.A O no hydrogen 3.144 N/A LYS 132.A NZ MET 95.A O no hydrogen 2.665 N/A LYS 132.A NZ GLN 100.A OE1 no hydrogen 2.558 N/A LEU 133.A N VAL 129.A O no hydrogen 2.770 N/A MET 134.A N VAL 130.A O no hydrogen 2.886 N/A ALA 135.A N THR 131.A O no hydrogen 2.895 N/A CYS 136.A N LYS 132.A O no hydrogen 2.946 N/A CYS 136.A SG LYS 132.A O no hydrogen 3.322 N/A VAL 137.A N LEU 133.A O no hydrogen 2.958 N/A GLN 138.A N MET 134.A O no hydrogen 2.673 N/A ARG 140.A N THR 21.A O no hydrogen 2.891 N/A VAL 141.A N THR 21.A O no hydrogen 3.022 N/A ALA 142.A N GLU 167.A O no hydrogen 2.952 N/A VAL 143.A N PHE 23.A O no hydrogen 2.928 N/A PHE 144.A N VAL 169.A O no hydrogen 3.017 N/A LYS 146.A N ALA 171.A O no hydrogen 2.717 N/A LYS 146.A NZ GLU 172.A OE2 no hydrogen 2.662 N/A LYS 146.A NZ GLU 279.A OE1 no hydrogen 2.835 N/A LYS 146.A NZ GLU 279.A OE2 no hydrogen 3.468 N/A TYR 149.A OH GLU 279.A OE2 no hydrogen 2.727 N/A GLN 150.A NE2 LEU 110.A O no hydrogen 2.934 N/A GLN 150.A NE2 ILE 113.A O no hydrogen 2.803 N/A LEU 152.A N ASP 148.A O no hydrogen 2.886 N/A MET 153.A N TYR 149.A O no hydrogen 3.061 N/A ILE 154.A N GLN 150.A O no hydrogen 2.813 N/A VAL 155.A N GLN 151.A O no hydrogen 2.887 N/A ARG 156.A N LEU 152.A O no hydrogen 2.925 N/A ARG 157.A N MET 153.A O no hydrogen 3.081 N/A ARG 157.A NH2 GLU 245.A O no hydrogen 2.733 N/A MET 158.A N ILE 154.A O no hydrogen 2.914 N/A CYS 159.A N VAL 155.A O no hydrogen 3.013 N/A CYS 159.A SG VAL 155.A O no hydrogen 3.438 N/A GLN 160.A N ARG 156.A O no hydrogen 3.214 N/A GLN 161.A N ARG 157.A O no hydrogen 2.880 N/A LEU 162.A N MET 158.A O no hydrogen 2.835 N/A ALA 163.A N GLN 160.A O no hydrogen 3.214 N/A LEU 164.A N CYS 159.A O no hydrogen 2.886 N/A VAL 166.A N LEU 164.A O no hydrogen 2.760 N/A GLU 167.A N ARG 140.A O no hydrogen 2.952 N/A VAL 169.A N ALA 142.A O no hydrogen 2.855 N/A ALA 171.A N PHE 144.A O no hydrogen 2.901 N/A ARG 175.A NH1 GLY 179.A O no hydrogen 3.062 N/A ARG 175.A NH1 ASP 276.A OD1 no hydrogen 3.420 N/A ARG 175.A NH1 ASP 276.A OD2 no hydrogen 2.681 N/A ARG 175.A NH2 ASP 276.A OD1 no hydrogen 3.090 N/A ARG 175.A NH2 ASN 277.A O no hydrogen 3.278 N/A ASP 176.A N LEU 180.A O no hydrogen 2.859 N/A ASP 178.A N ASP 176.A OD2 no hydrogen 3.280 N/A GLY 179.A N ASP 176.A O no hydrogen 2.870 N/A LEU 180.A N ASP 178.A OD2 no hydrogen 3.152 N/A LEU 182.A N VAL 174.A O no hydrogen 3.112 N/A SER 184.A OG GLY 28.A O no hydrogen 3.443 N/A SER 184.A OG ASN 29.A O no hydrogen 2.887 N/A SER 184.A OG ASN 29.A OD1 no hydrogen 3.003 N/A ARG 185.A N SER 183.A OG no hydrogen 3.300 N/A ARG 185.A NE ASP 64.A OD1 no hydrogen 2.910 N/A ARG 185.A NH2 ASP 64.A OD1 no hydrogen 3.320 N/A ARG 185.A NH2 ASP 64.A OD2 no hydrogen 2.968 N/A ASN 186.A N SER 183.A O no hydrogen 2.884 N/A ASN 186.A ND2 ALA 181.A O no hydrogen 3.201 N/A ARG 187.A N SER 184.A O no hydrogen 3.229 N/A TYR 188.A N ARG 185.A O no hydrogen 2.928 N/A TYR 188.A OH ASP 64.A OD1 no hydrogen 2.730 N/A LEU 189.A N ASN 186.A O no hydrogen 3.231 N/A SER 190.A N GLU 193.A OE1 no hydrogen 3.009 N/A GLU 193.A N SER 190.A OG no hydrogen 3.128 N/A ARG 194.A N SER 190.A O no hydrogen 2.774 N/A ARG 194.A NH1 ASP 178.A OD1 no hydrogen 2.713 N/A ARG 194.A NH1 ARG 194.A O no hydrogen 2.888 N/A ARG 194.A NH2 ASP 178.A OD1 no hydrogen 2.937 N/A ARG 194.A NH2 ASP 178.A OD2 no hydrogen 3.425 N/A ALA 195.A N GLU 191.A O no hydrogen 3.118 N/A GLU 196.A N ALA 192.A O no hydrogen 3.220 N/A ALA 197.A N GLU 193.A O no hydrogen 2.790 N/A GLU 199.A N GLU 196.A O no hydrogen 2.920 N/A LEU 200.A N ALA 197.A O no hydrogen 3.127 N/A LYS 202.A N PRO 198.A O no hydrogen 3.226 N/A THR 203.A N GLU 199.A O no hydrogen 2.971 N/A THR 203.A OG1 GLU 199.A O no hydrogen 2.810 N/A LEU 204.A N LEU 200.A O no hydrogen 3.083 N/A ALA 205.A N ALA 201.A O no hydrogen 2.887 N/A ARG 206.A N LYS 202.A O no hydrogen 3.041 N/A ARG 206.A NH1 GLU 199.A OE2 no hydrogen 3.002 N/A VAL 207.A N THR 203.A O no hydrogen 2.938 N/A ARG 208.A N LEU 204.A O no hydrogen 2.870 N/A ARG 208.A NE ASP 209.A OD2 no hydrogen 2.829 N/A ARG 208.A NH2 ASP 209.A OD2 no hydrogen 2.789 N/A ASP 209.A N ALA 205.A O no hydrogen 3.047 N/A ALA 210.A N ARG 206.A O no hydrogen 3.156 N/A VAL 211.A N VAL 207.A O no hydrogen 3.109 N/A LEU 212.A N ARG 208.A O no hydrogen 3.009 N/A ASP 213.A N ASP 209.A O no hydrogen 2.694 N/A GLY 214.A N VAL 211.A O no hydrogen 3.046 N/A GLU 215.A N ALA 210.A O no hydrogen 3.025 N/A ARG 216.A NE GLU 256.A OE2 no hydrogen 2.976 N/A LEU 218.A N ARG 216.A O no hydrogen 3.076 N/A ALA 220.A N ASP 217.A OD1 no hydrogen 3.392 N/A ILE 221.A N ASP 217.A O no hydrogen 3.243 N/A GLU 222.A N LEU 218.A O no hydrogen 2.926 N/A ARG 223.A N ALA 219.A O no hydrogen 2.887 N/A ARG 224.A N ALA 220.A O no hydrogen 3.074 N/A ARG 224.A NH1 GLU 215.A OE2 no hydrogen 3.043 N/A ARG 224.A NH2 GLU 215.A OE1 no hydrogen 3.165 N/A ALA 225.A N ILE 221.A O no hydrogen 3.114 N/A VAL 226.A N GLU 222.A O no hydrogen 3.003 N/A ALA 227.A N ARG 223.A O no hydrogen 3.025 N/A HIS 228.A N ARG 224.A O no hydrogen 2.926 N/A HIS 228.A NE2 GLU 199.A OE2 no hydrogen 2.675 N/A LEU 229.A N ALA 225.A O no hydrogen 3.115 N/A SER 230.A N VAL 226.A O no hydrogen 2.956 N/A SER 230.A OG VAL 226.A O no hydrogen 3.272 N/A ALA 231.A N ALA 227.A O no hydrogen 2.973 N/A ARG 232.A N LEU 229.A O no hydrogen 3.085 N/A ARG 232.A NE GLU 196.A OE2 no hydrogen 2.738 N/A ARG 232.A NH2 GLU 196.A OE1 no hydrogen 2.814 N/A ARG 232.A NH2 GLU 196.A OE2 no hydrogen 3.383 N/A GLY 233.A N SER 230.A O no hydrogen 3.052 N/A TRP 234.A N LEU 229.A O no hydrogen 3.197 N/A TRP 234.A NE1 GLU 196.A OE2 no hydrogen 3.018 N/A GLN 235.A N LYS 268.A O no hydrogen 2.994 N/A ASP 237.A N ALA 266.A O no hydrogen 2.792 N/A TYR 238.A N ALA 266.A O no hydrogen 3.338 N/A TYR 238.A OH GLU 115.A OE1 no hydrogen 2.654 N/A SER 240.A N LEU 264.A O no hydrogen 2.942 N/A ILE 241.A N GLU 222.A OE1 no hydrogen 2.834 N/A ARG 242.A N VAL 262.A O no hydrogen 2.868 N/A ARG 242.A NH1 LEU 247.A O no hydrogen 3.017 N/A ARG 243.A N VAL 248.A O no hydrogen 2.789 N/A ARG 243.A NE ASP 259.A OD2 no hydrogen 2.941 N/A ARG 243.A NH1 ASN 246.A OD1 no hydrogen 2.907 N/A ARG 243.A NH2 ASP 259.A OD2 no hydrogen 3.382 N/A ARG 244.A N PRO 260.A O no hydrogen 3.017 N/A ARG 244.A NE LEU 261.A O no hydrogen 3.096 N/A ARG 244.A NH2 ILE 280.A O no hydrogen 2.993 N/A LEU 247.A N ARG 243.A O no hydrogen 2.913 N/A VAL 248.A N ASN 246.A OD1 no hydrogen 3.151 N/A SER 251.A N GLN 254.A OE1 no hydrogen 3.070 N/A SER 251.A OG GLN 254.A OE1 no hydrogen 3.329 N/A GLN 254.A N SER 251.A OG no hydrogen 3.314 N/A ILE 255.A N SER 251.A O no hydrogen 2.948 N/A GLU 256.A N ALA 252.A O no hydrogen 3.139 N/A ALA 257.A N ALA 253.A O no hydrogen 2.972 N/A GLY 258.A N ILE 255.A O no hydrogen 3.178 N/A ASP 259.A N GLN 254.A O no hydrogen 3.198 N/A VAL 262.A N ARG 242.A O no hydrogen 2.845 N/A VAL 263.A N LEU 278.A O no hydrogen 2.961 N/A LEU 264.A N SER 240.A O no hydrogen 2.879 N/A THR 265.A N ASP 276.A O no hydrogen 2.931 N/A THR 265.A OG1 TYR 238.A O no hydrogen 2.779 N/A ALA 266.A N TYR 238.A O no hydrogen 3.153 N/A ALA 267.A N LEU 274.A O no hydrogen 2.926 N/A LYS 268.A N GLN 235.A O no hydrogen 2.945 N/A LEU 269.A N THR 272.A O no hydrogen 2.946 N/A THR 272.A N LEU 269.A O no hydrogen 3.069 N/A ARG 273.A NE ASP 237.A OD2 no hydrogen 2.898 N/A ARG 273.A NH1 GLU 115.A OE2 no hydrogen 2.529 N/A ARG 273.A NH2 GLU 115.A OE1 no hydrogen 3.081 N/A ARG 273.A NH2 GLU 115.A OE2 no hydrogen 3.397 N/A ARG 273.A NH2 ASP 237.A OD2 no hydrogen 3.079 N/A LEU 274.A N ALA 267.A O no hydrogen 2.952 N/A ASP 276.A N THR 265.A O no hydrogen 3.182 N/A ASN 277.A N ASP 276.A OD1 no hydrogen 2.767 N/A ASN 277.A ND2 LYS 146.A O no hydrogen 2.920 N/A LEU 278.A N VAL 263.A O no hydrogen 2.916 N/A ILE 280.A N LEU 261.A O no hydrogen 2.864 N/A