Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1f12_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ ASP 176.A OD2 no hydrogen 3.529 N/A LYS 5.A N ASP 91.A OD2 no hydrogen 3.232 N/A HIS 6.A N ASP 91.A OD2 no hydrogen 2.841 N/A HIS 6.A ND1 THR 90.A OG1 no hydrogen 2.518 N/A VAL 7.A N THR 29.A O no hydrogen 2.851 N/A THR 8.A N LEU 92.A O no hydrogen 2.730 N/A THR 8.A OG1 THR 90.A OG1 no hydrogen 2.768 N/A VAL 9.A N VAL 31.A O no hydrogen 2.928 N/A ILE 10.A N VAL 94.A O no hydrogen 2.850 N/A GLY 11.A N VAL 33.A O no hydrogen 2.857 N/A GLY 12.A N ASP 34.A OD2 no hydrogen 2.715 N/A ALA 17.A N GLY 13.A O no hydrogen 2.856 N/A GLY 18.A N LEU 14.A O no hydrogen 3.186 N/A ILE 19.A N MET 15.A O no hydrogen 2.854 N/A ALA 20.A N GLY 16.A O no hydrogen 2.856 N/A GLN 21.A N ALA 17.A O no hydrogen 2.834 N/A GLN 21.A NE2 SER 50.A OG no hydrogen 3.313 N/A VAL 22.A N GLY 18.A O no hydrogen 3.006 N/A ALA 23.A N ILE 19.A O no hydrogen 2.999 N/A ALA 24.A N ALA 20.A O no hydrogen 2.830 N/A ALA 25.A N GLN 21.A O no hydrogen 2.780 N/A THR 26.A N VAL 22.A O no hydrogen 3.129 N/A THR 26.A N ALA 23.A O no hydrogen 3.297 N/A THR 26.A OG1 VAL 22.A O no hydrogen 2.541 N/A THR 26.A OG1 ALA 23.A O no hydrogen 3.031 N/A THR 26.A OG1 HIS 28.A ND1 no hydrogen 3.148 N/A GLY 27.A N ALA 24.A O no hydrogen 3.227 N/A HIS 28.A N ALA 23.A O no hydrogen 2.982 N/A HIS 28.A ND1 ALA 23.A O no hydrogen 2.887 N/A HIS 28.A ND1 THR 26.A OG1 no hydrogen 3.148 N/A THR 29.A N LYS 5.A O no hydrogen 2.829 N/A VAL 30.A N THR 76.A O no hydrogen 2.872 N/A VAL 31.A N VAL 7.A O no hydrogen 3.050 N/A LEU 32.A N ALA 78.A O no hydrogen 2.727 N/A VAL 33.A N VAL 9.A O no hydrogen 2.842 N/A ASP 34.A N SER 80.A O no hydrogen 3.371 N/A GLN 35.A N ASP 34.A OD1 no hydrogen 2.577 N/A ILE 39.A N THR 36.A OG1 no hydrogen 3.107 N/A LEU 40.A N THR 36.A O no hydrogen 3.332 N/A ALA 41.A N GLU 37.A O no hydrogen 2.905 N/A LYS 42.A N ASP 38.A O no hydrogen 2.867 N/A SER 43.A N ILE 39.A O no hydrogen 2.863 N/A SER 43.A OG GLY 12.A O no hydrogen 2.694 N/A SER 43.A OG ILE 39.A O no hydrogen 3.130 N/A LYS 44.A N LEU 40.A O no hydrogen 2.890 N/A LYS 44.A NZ LEU 74.A O no hydrogen 3.303 N/A LYS 44.A NZ ILE 77.A O no hydrogen 2.756 N/A LYS 45.A N ALA 41.A O no hydrogen 3.010 N/A LYS 45.A N LYS 42.A O no hydrogen 3.039 N/A LYS 45.A NZ GLU 48.A OE1 no hydrogen 3.373 N/A GLY 46.A N LYS 42.A O no hydrogen 3.147 N/A ILE 47.A N SER 43.A O no hydrogen 3.221 N/A GLU 48.A N LYS 44.A O no hydrogen 3.093 N/A GLU 49.A N LYS 45.A O no hydrogen 2.919 N/A SER 50.A N GLY 46.A O no hydrogen 2.957 N/A SER 50.A OG GLN 21.A OE1 no hydrogen 3.509 N/A LEU 51.A N ILE 47.A O no hydrogen 2.829 N/A ARG 52.A N GLU 48.A O no hydrogen 2.853 N/A ARG 52.A NH2 GLU 48.A OE2 no hydrogen 3.320 N/A LYS 53.A N GLU 49.A O no hydrogen 3.161 N/A VAL 54.A N SER 50.A O no hydrogen 3.217 N/A ALA 55.A N LEU 51.A O no hydrogen 2.831 N/A LYS 56.A N ARG 52.A O no hydrogen 2.976 N/A LYS 56.A NZ ASP 67.A OD1 no hydrogen 3.428 N/A LYS 58.A N VAL 54.A O no hydrogen 2.996 N/A PHE 59.A N ALA 55.A O no hydrogen 2.650 N/A ASN 62.A N PHE 59.A O no hydrogen 2.788 N/A ALA 65.A N ASN 62.A OD1 no hydrogen 2.939 N/A GLY 66.A N ASN 62.A O no hydrogen 3.011 N/A ASP 67.A N PRO 63.A O no hydrogen 2.825 N/A GLU 68.A N LYS 64.A O no hydrogen 3.063 N/A CYS 69.A N ALA 65.A O no hydrogen 3.061 N/A VAL 70.A N GLY 66.A O no hydrogen 3.156 N/A GLU 71.A N ASP 67.A O no hydrogen 2.773 N/A LYS 72.A N GLU 68.A O no hydrogen 2.876 N/A THR 73.A N CYS 69.A O no hydrogen 3.468 N/A THR 73.A OG1 CYS 69.A O no hydrogen 3.255 N/A LEU 74.A N VAL 70.A O no hydrogen 2.963 N/A SER 75.A N GLU 71.A O no hydrogen 2.813 N/A SER 75.A N LYS 72.A O no hydrogen 3.142 N/A SER 75.A OG LYS 72.A O no hydrogen 2.898 N/A THR 76.A N THR 73.A O no hydrogen 3.070 N/A THR 76.A OG1 THR 73.A O no hydrogen 2.756 N/A ILE 77.A N LEU 74.A O no hydrogen 3.439 N/A ALA 78.A N VAL 30.A O no hydrogen 2.740 N/A SER 80.A N LEU 32.A O no hydrogen 3.203 N/A SER 85.A N ASP 82.A O no hydrogen 2.856 N/A SER 85.A OG ASP 82.A O no hydrogen 2.498 N/A VAL 86.A N ALA 83.A O no hydrogen 2.812 N/A VAL 87.A N ALA 83.A O no hydrogen 3.054 N/A HIS 88.A ND1 PHE 114.A O no hydrogen 2.857 N/A SER 89.A N VAL 86.A O no hydrogen 3.091 N/A SER 89.A OG VAL 86.A O no hydrogen 3.308 N/A THR 90.A N VAL 87.A O no hydrogen 3.419 N/A THR 90.A OG1 HIS 6.A ND1 no hydrogen 2.518 N/A THR 90.A OG1 HIS 6.A O no hydrogen 3.145 N/A THR 90.A OG1 THR 8.A OG1 no hydrogen 2.768 N/A THR 90.A OG1 LEU 92.A O no hydrogen 3.270 N/A ASP 91.A N HIS 6.A O no hydrogen 3.036 N/A LEU 92.A N HIS 6.A O no hydrogen 3.264 N/A VAL 93.A N ILE 120.A O no hydrogen 2.888 N/A VAL 94.A N THR 8.A O no hydrogen 2.771 N/A GLU 95.A N ALA 122.A O no hydrogen 2.860 N/A ALA 96.A N ILE 10.A O no hydrogen 2.817 N/A ILE 97.A N GLU 95.A OE2 no hydrogen 2.544 N/A ASN 100.A N VAL 98.A O no hydrogen 2.746 N/A VAL 103.A N ASN 100.A OD1 no hydrogen 2.796 N/A LYS 104.A N ASN 100.A O no hydrogen 2.986 N/A LYS 104.A NZ ILE 97.A O no hydrogen 3.138 N/A LYS 104.A NZ VAL 98.A O no hydrogen 2.589 N/A LYS 104.A NZ GLU 99.A OE1 no hydrogen 2.622 N/A ASN 105.A N LEU 101.A O no hydrogen 3.070 N/A ASN 105.A ND2 SER 132.A O no hydrogen 3.530 N/A GLU 106.A N LYS 102.A O no hydrogen 2.927 N/A LEU 107.A N VAL 103.A O no hydrogen 3.227 N/A PHE 108.A N LYS 104.A O no hydrogen 2.949 N/A LYS 109.A N ASN 105.A O no hydrogen 2.819 N/A ARG 110.A N GLU 106.A O no hydrogen 3.221 N/A ARG 110.A NH1 ASP 82.A OD1 no hydrogen 3.170 N/A ARG 110.A NH2 ASP 82.A OD1 no hydrogen 3.347 N/A ARG 110.A NH2 ASP 82.A OD2 no hydrogen 2.846 N/A LEU 111.A N LEU 107.A O no hydrogen 3.002 N/A ASP 112.A N PHE 108.A O no hydrogen 2.898 N/A LYS 113.A N ARG 110.A O no hydrogen 3.025 N/A PHE 114.A N LEU 111.A O no hydrogen 3.040 N/A ALA 115.A N LEU 111.A O no hydrogen 2.892 N/A HIS 118.A NE2 ASP 91.A OD1 no hydrogen 2.812 N/A THR 119.A OG1 THR 90.A O no hydrogen 2.583 N/A THR 119.A OG1 ALA 116.A O no hydrogen 3.395 N/A ILE 120.A N ASP 91.A O no hydrogen 2.989 N/A PHE 121.A N ARG 142.A O no hydrogen 2.745 N/A ALA 122.A N VAL 93.A O no hydrogen 2.855 N/A SER 123.A N ALA 144.A O no hydrogen 3.197 N/A SER 123.A OG GLU 95.A OE1 no hydrogen 2.769 N/A ASN 124.A N GLU 95.A O no hydrogen 2.854 N/A THR 125.A N SER 123.A OG no hydrogen 3.055 N/A THR 125.A OG1 GLU 99.A OE1 no hydrogen 2.793 N/A SER 126.A N GLU 99.A OE2 no hydrogen 2.976 N/A SER 126.A OG HIS 147.A NE2 no hydrogen 2.934 N/A ILE 130.A N ASP 190.A OD1 no hydrogen 2.905 N/A THR 131.A N ASP 190.A OD2 no hydrogen 3.212 N/A THR 131.A OG1 ASP 190.A OD2 no hydrogen 2.867 N/A SER 132.A N GLN 129.A O no hydrogen 2.873 N/A ILE 133.A N GLN 129.A O no hydrogen 3.468 N/A ALA 134.A N ILE 130.A O no hydrogen 2.916 N/A ASN 135.A N THR 131.A O no hydrogen 3.231 N/A ALA 136.A N ILE 133.A O no hydrogen 3.216 N/A THR 137.A N ALA 134.A O no hydrogen 2.943 N/A THR 137.A OG1 ALA 134.A O no hydrogen 3.067 N/A THR 138.A N ASP 112.A OD2 no hydrogen 2.878 N/A THR 138.A OG1 ASP 112.A OD2 no hydrogen 3.229 N/A ARG 139.A N THR 137.A OG1 no hydrogen 3.062 N/A ARG 139.A NE ASP 112.A OD1 no hydrogen 2.791 N/A ARG 139.A NH1 ALA 116.A O no hydrogen 3.029 N/A ARG 139.A NH1 GLU 117.A O no hydrogen 3.140 N/A ARG 139.A NH1 THR 119.A O no hydrogen 3.182 N/A ARG 139.A NH2 ASP 112.A O no hydrogen 3.503 N/A ARG 139.A NH2 ASP 112.A OD1 no hydrogen 3.233 N/A ARG 139.A NH2 ALA 115.A O no hydrogen 3.330 N/A ARG 139.A NH2 ALA 116.A O no hydrogen 3.424 N/A GLN 140.A N GLN 140.A OE1 no hydrogen 2.584 N/A GLN 140.A NE2 ASN 135.A OD1 no hydrogen 3.571 N/A ARG 142.A N ARG 139.A O no hydrogen 2.820 N/A ARG 142.A NE ASP 141.A OD1 no hydrogen 3.024 N/A ARG 142.A NE ASP 141.A OD2 no hydrogen 3.085 N/A ARG 142.A NH1 GLU 117.A O no hydrogen 2.529 N/A ARG 142.A NH2 ASP 141.A OD1 no hydrogen 3.035 N/A PHE 143.A N GLN 140.A O no hydrogen 3.201 N/A ALA 144.A N PHE 121.A O no hydrogen 2.901 N/A GLY 145.A N ILE 161.A O no hydrogen 2.789 N/A LEU 146.A N SER 123.A O no hydrogen 3.121 N/A HIS 147.A N GLU 159.A O no hydrogen 2.712 N/A HIS 147.A ND1 GLU 159.A OE1 no hydrogen 2.990 N/A HIS 147.A NE2 SER 126.A OG no hydrogen 2.934 N/A PHE 148.A N ASN 124.A OD1 no hydrogen 2.815 N/A VAL 154.A N PRO 151.A O no hydrogen 2.884 N/A MET 155.A N PRO 151.A O no hydrogen 2.804 N/A GLU 159.A N HIS 147.A O no hydrogen 2.851 N/A VAL 160.A N VAL 186.A O no hydrogen 3.170 N/A ILE 161.A N GLY 145.A O no hydrogen 2.710 N/A LYS 162.A NZ GLN 168.A OE1 no hydrogen 2.965 N/A THR 163.A N THR 166.A OG1 no hydrogen 2.882 N/A THR 163.A OG1 THR 166.A OG1 no hydrogen 3.050 N/A MET 165.A N THR 163.A OG1 no hydrogen 3.181 N/A THR 166.A N THR 163.A O no hydrogen 3.035 N/A THR 166.A N THR 163.A OG1 no hydrogen 3.173 N/A THR 166.A OG1 PHE 143.A O no hydrogen 2.802 N/A THR 166.A OG1 THR 163.A O no hydrogen 3.553 N/A THR 166.A OG1 THR 163.A OG1 no hydrogen 3.050 N/A SER 167.A N ASP 141.A O no hydrogen 3.164 N/A SER 167.A OG ASP 141.A O no hydrogen 3.111 N/A SER 167.A OG THR 170.A OG1 no hydrogen 2.957 N/A THR 170.A N SER 167.A OG no hydrogen 3.115 N/A THR 170.A OG1 ASP 141.A O no hydrogen 2.669 N/A THR 170.A OG1 SER 167.A OG no hydrogen 2.957 N/A PHE 171.A N SER 167.A O no hydrogen 3.047 N/A GLU 172.A N GLN 168.A O no hydrogen 2.868 N/A SER 173.A N LYS 169.A O no hydrogen 3.190 N/A LEU 174.A N THR 170.A O no hydrogen 3.198 N/A VAL 175.A N PHE 171.A O no hydrogen 2.945 N/A ASP 176.A N GLU 172.A O no hydrogen 2.839 N/A PHE 177.A N SER 173.A O no hydrogen 2.887 N/A SER 178.A N LEU 174.A O no hydrogen 2.842 N/A SER 178.A OG LEU 174.A O no hydrogen 2.941 N/A LYS 179.A N VAL 175.A O no hydrogen 3.165 N/A ALA 180.A N ASP 176.A O no hydrogen 2.824 N/A LEU 181.A N PHE 177.A O no hydrogen 2.951 N/A LEU 181.A N SER 178.A O no hydrogen 3.047 N/A GLY 182.A N LYS 179.A O no hydrogen 2.835 N/A LYS 183.A N SER 178.A O no hydrogen 3.032 N/A LYS 183.A NZ VAL 152.A O no hydrogen 2.388 N/A LYS 183.A NZ MET 155.A O no hydrogen 2.878 N/A HIS 184.A N LYS 156.A O no hydrogen 2.880 N/A VAL 186.A N VAL 158.A O no hydrogen 3.276 N/A CYS 188.A SG LYS 189.A O no hydrogen 3.248 N/A THR 191.A N LYS 189.A O no hydrogen 2.862 N/A PHE 194.A N THR 191.A O no hydrogen 2.815 N/A ILE 195.A N GLU 159.A OE2 no hydrogen 2.911 N/A VAL 196.A N GLU 159.A OE2 no hydrogen 3.109 N/A ARG 198.A N GLY 193.A O no hydrogen 3.091 N/A ARG 198.A NH1 ARG 198.A O no hydrogen 2.889 N/A LEU 199.A N VAL 196.A O no hydrogen 3.067 N/A LEU 200.A N VAL 196.A O no hydrogen 2.800 N/A VAL 201.A N ASN 197.A O no hydrogen 3.059 N/A LEU 204.A N LEU 200.A O no hydrogen 2.891 N/A MET 205.A N VAL 201.A O no hydrogen 2.854 N/A GLU 206.A N PRO 202.A O no hydrogen 2.878 N/A ALA 207.A N TYR 203.A O no hydrogen 3.088 N/A ILE 208.A N LEU 204.A O no hydrogen 3.295 N/A ARG 209.A N MET 205.A O no hydrogen 3.025 N/A ARG 209.A NH1 GLU 206.A OE1 no hydrogen 3.195 N/A ARG 209.A NH1 LEU 263.A O no hydrogen 3.452 N/A ARG 209.A NH2 LEU 263.A O no hydrogen 2.948 N/A ARG 209.A NH2 GLN 265.A O no hydrogen 2.839 N/A LEU 210.A N GLU 206.A O no hydrogen 2.929 N/A TYR 211.A N ALA 207.A O no hydrogen 3.137 N/A GLU 212.A N ILE 208.A O no hydrogen 2.752 N/A ARG 213.A N ARG 209.A O no hydrogen 2.643 N/A ARG 213.A NE ASP 215.A OD2 no hydrogen 3.157 N/A GLY 214.A N TYR 211.A O no hydrogen 2.842 N/A ASP 215.A N LEU 210.A O no hydrogen 3.153 N/A LYS 218.A NZ PHE 287.A O no hydrogen 3.142 N/A ASP 220.A N SER 217.A OG no hydrogen 3.113 N/A ILE 221.A N SER 217.A O no hydrogen 2.962 N/A ASP 222.A N LYS 218.A O no hydrogen 2.913 N/A THR 223.A N GLU 219.A O no hydrogen 3.021 N/A THR 223.A OG1 GLU 219.A O no hydrogen 3.075 N/A ALA 224.A N ASP 220.A O no hydrogen 2.814 N/A MET 225.A N ILE 221.A O no hydrogen 3.175 N/A LYS 226.A N ASP 222.A O no hydrogen 3.040 N/A LYS 226.A NZ GLU 237.A OE2 no hydrogen 3.529 N/A LEU 227.A N THR 223.A O no hydrogen 2.903 N/A GLY 228.A N ALA 224.A O no hydrogen 2.649 N/A ALA 229.A N MET 225.A O no hydrogen 3.135 N/A TYR 231.A N MET 225.A O no hydrogen 3.172 N/A GLY 234.A N GLU 237.A OE1 no hydrogen 2.724 N/A PHE 236.A N ASP 222.A OD1 no hydrogen 2.875 N/A LEU 238.A N GLY 234.A O no hydrogen 3.067 N/A LEU 239.A N PRO 235.A O no hydrogen 3.120 N/A ASP 240.A N PHE 236.A O no hydrogen 3.063 N/A TYR 241.A N LEU 238.A O no hydrogen 2.767 N/A VAL 242.A N LEU 238.A O no hydrogen 2.817 N/A GLY 243.A N LEU 239.A O no hydrogen 2.916 N/A LEU 244.A N PHE 279.A O no hydrogen 2.678 N/A THR 246.A OG1 VAL 242.A O no hydrogen 3.220 N/A THR 246.A OG1 ASP 245.A OD1 no hydrogen 3.290 N/A THR 247.A N GLY 243.A O no hydrogen 2.875 N/A THR 247.A OG1 GLY 243.A O no hydrogen 2.913 N/A LYS 248.A N LEU 244.A O no hydrogen 2.811 N/A LYS 248.A NZ ASP 252.A OD1 no hydrogen 3.321 N/A LYS 248.A NZ ASP 252.A OD2 no hydrogen 2.540 N/A PHE 249.A N ASP 245.A O no hydrogen 2.988 N/A ILE 250.A N THR 246.A O no hydrogen 3.509 N/A VAL 251.A N THR 247.A O no hydrogen 2.974 N/A ASP 252.A N LYS 248.A O no hydrogen 2.679 N/A GLY 253.A N PHE 249.A O no hydrogen 3.008 N/A TRP 254.A N ILE 250.A O no hydrogen 3.153 N/A HIS 255.A N VAL 251.A O no hydrogen 2.736 N/A GLU 256.A N ASP 252.A O no hydrogen 2.755 N/A MET 257.A N GLY 253.A O no hydrogen 3.224 N/A MET 257.A N TRP 254.A O no hydrogen 3.101 N/A ASP 258.A N TRP 254.A O no hydrogen 3.167 N/A ASP 258.A N HIS 255.A O no hydrogen 2.942 N/A ASN 261.A N ASP 258.A O no hydrogen 3.118 N/A ASN 261.A N ASP 258.A OD1 no hydrogen 2.885 N/A LEU 263.A N ASN 261.A OD1 no hydrogen 2.825 N/A HIS 264.A N ASN 261.A O no hydrogen 3.442 N/A GLN 265.A N PRO 262.A O no hydrogen 2.938 N/A GLN 265.A NE2 ALA 259.A O no hydrogen 3.131 N/A GLN 265.A NE2 ASN 261.A O no hydrogen 2.954 N/A SER 267.A OG GLU 212.A OE1 no hydrogen 2.795 N/A SER 267.A OG GLU 212.A OE2 no hydrogen 3.025 N/A SER 269.A N GLU 212.A OE2 no hydrogen 2.693 N/A SER 269.A OG GLU 212.A OE2 no hydrogen 2.593 N/A ASN 271.A N SER 267.A O no hydrogen 2.907 N/A LYS 272.A N PRO 268.A O no hydrogen 2.783 N/A LYS 272.A NZ GLU 276.A OE2 no hydrogen 3.359 N/A LEU 273.A N SER 269.A O no hydrogen 3.078 N/A VAL 274.A N LEU 270.A O no hydrogen 3.028 N/A ALA 275.A N ASN 271.A O no hydrogen 2.879 N/A GLU 276.A N LEU 273.A O no hydrogen 2.875 N/A ASN 277.A N VAL 274.A O no hydrogen 3.094 N/A LYS 278.A N LEU 273.A O no hydrogen 3.077 N/A LYS 278.A NZ GLU 276.A OE1 no hydrogen 2.941 N/A PHE 279.A N THR 283.A OG1 no hydrogen 3.008 N/A GLY 280.A N GLU 285.A O no hydrogen 3.008 N/A LYS 281.A N ASP 240.A O no hydrogen 2.734 N/A LYS 282.A NZ ASP 245.A OD1 no hydrogen 2.536 N/A LYS 282.A NZ THR 246.A OG1 no hydrogen 3.301 N/A THR 283.A OG1 ASN 277.A O no hydrogen 3.530 N/A THR 283.A OG1 GLY 280.A O no hydrogen 3.426 N/A THR 283.A OG1 GLU 285.A O no hydrogen 3.142 N/A GLY 284.A N LYS 281.A O no hydrogen 2.779 N/A GLU 285.A N GLY 280.A O no hydrogen 2.920 N/A GLY 286.A N TYR 288.A O no hydrogen 2.788 N/A PHE 287.A N ASP 240.A OD1 no hydrogen 2.855 N/A TYR 288.A N ASP 240.A OD2 no hydrogen 2.955 N/A TYR 288.A OH ASP 222.A OD2 no hydrogen 2.460 N/A TYR 290.A N GLY 284.A O no hydrogen 2.873 N/A TYR 290.A OH ASP 240.A OD2 no hydrogen 2.522 N/A