Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1a46_H.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N ASN 143.A O no hydrogen 2.848 N/A ILE 1.A N ASP 196.A OD2 no hydrogen 2.834 N/A VAL 2.A N ASP 191.A O no hydrogen 2.920 N/A SER 5.A N VAL 154.A O no hydrogen 2.829 N/A ALA 7.A N LEU 152.A O no hydrogen 2.907 N/A MET 11.A N GLU 8.A O no hydrogen 3.348 N/A GLN 15.A N SER 12.A O no hydrogen 3.038 N/A GLN 15.A NE2 VAL 16.A O no hydrogen 3.501 N/A VAL 16.A N ALA 30.A O no hydrogen 3.041 N/A MET 17.A N ARG 62.A O no hydrogen 2.835 N/A LEU 18.A N CYS 28.A O no hydrogen 2.668 N/A PHE 19.A N LEU 60.A O no hydrogen 2.828 N/A ARG 20.A N GLU 25.A O no hydrogen 2.645 N/A ARG 20.A NH1 GLU 25.A OE2 no hydrogen 3.306 N/A LYS 21.A N ASP 58.A O no hydrogen 3.429 N/A LYS 21.A NZ ASN 57.A O no hydrogen 2.892 N/A GLN 24.A NE2 LYS 21.A O no hydrogen 3.326 N/A GLU 25.A N ARG 20.A O no hydrogen 3.093 N/A LEU 27.A N LEU 18.A O no hydrogen 2.887 N/A CYS 28.A SG LEU 27.A O no hydrogen 3.097 N/A GLY 29.A N SER 197.A O no hydrogen 2.818 N/A SER 31.A N LEU 39.A O no hydrogen 2.999 N/A SER 31.A OG GLN 213.A OE1 no hydrogen 2.556 N/A LEU 32.A N TRP 14.A O no hydrogen 2.648 N/A ILE 33.A N TRP 37.A O no hydrogen 3.264 N/A ARG 36.A N SER 34.A OG no hydrogen 3.318 N/A ARG 36.A NH1 LYS 106.A O no hydrogen 3.221 N/A ARG 36.A NH2 LYS 106.A O no hydrogen 3.516 N/A VAL 38.A N MET 103.A O no hydrogen 2.935 N/A LEU 39.A N SER 31.A O no hydrogen 2.849 N/A THR 40.A N ALA 101.A O no hydrogen 2.904 N/A THR 40.A OG1 GLY 29.A O no hydrogen 2.946 N/A HIS 43.A N ASP 99.A OD1 no hydrogen 2.873 N/A HIS 43.A ND1 ASP 99.A OD2 no hydrogen 2.758 N/A HIS 43.A NE2 SER 197.A OG no hydrogen 3.115 N/A CYS 44.A N ALA 41.A O no hydrogen 3.068 N/A LEU 45.A N ALA 42.A O no hydrogen 3.140 N/A LEU 46.A N ALA 42.A O no hydrogen 3.181 N/A ASP 58.A N THR 55I.A O no hydrogen 2.789 N/A LEU 59.A N GLU 56.A O no hydrogen 3.428 N/A LEU 60.A N PHE 19.A O no hydrogen 2.846 N/A VAL 61.A N SER 79.A O no hydrogen 3.083 N/A ARG 62.A N MET 17.A O no hydrogen 3.097 N/A ARG 62.A NE GLU 76.A OE2 no hydrogen 2.981 N/A ARG 62.A NH2 GLU 76.A OE1 no hydrogen 2.837 N/A ARG 62.A NH2 GLU 76.A OE2 no hydrogen 2.798 N/A ILE 63.A N LYS 77.A O no hydrogen 2.982 N/A LYS 65.A NZ ARG 70.A O no hydrogen 3.062 N/A LYS 65.A NZ GLU 72.A OE1 no hydrogen 2.851 N/A LYS 65.A NZ GLU 76.A OE1 no hydrogen 2.710 N/A HIS 66.A N GLU 72.A OE1 no hydrogen 3.000 N/A SER 67.A N GLU 72.A OE1 no hydrogen 3.219 N/A SER 67.A N GLU 72.A OE2 no hydrogen 2.897 N/A ARG 68.A N SER 150.A O no hydrogen 2.789 N/A ARG 68.A NE PRO 149.A O no hydrogen 2.732 N/A ARG 68.A NH2 PRO 149.A O no hydrogen 3.253 N/A ARG 70.A N SER 67.A OG no hydrogen 3.217 N/A GLU 72.A N GLU 76.A OE1 no hydrogen 2.832 N/A ILE 75.A N GLU 72.A O no hydrogen 2.996 N/A GLU 76.A N GLU 72.A O no hydrogen 2.992 N/A LYS 77.A N ILE 63.A O no hydrogen 2.980 N/A LYS 77.A NZ GLU 76.A O no hydrogen 3.395 N/A SER 79.A N VAL 61.A O no hydrogen 2.730 N/A GLU 82.A N LYS 104.A O no hydrogen 2.741 N/A LYS 83.A N LYS 104.A O no hydrogen 3.377 N/A LYS 83.A NZ ILE 84.A O no hydrogen 3.418 N/A TYR 85.A N LEU 102.A O no hydrogen 2.829 N/A HIS 87.A N ILE 100.A O no hydrogen 3.243 N/A ARG 89.A N HIS 87.A ND1 no hydrogen 2.881 N/A TYR 90.A N HIS 87.A O no hydrogen 3.283 N/A TYR 90.A OH LEU 46.A O no hydrogen 2.646 N/A ASN 91.A N ASP 97.A O no hydrogen 2.679 N/A ASN 95.A ND2 ARG 172.A O no hydrogen 2.814 N/A LEU 96.A N ASN 91.A O no hydrogen 2.887 N/A ARG 98.A NH1 ARG 89.A O no hydrogen 3.124 N/A ILE 100.A N ARG 98.A O no hydrogen 2.886 N/A ALA 101.A N THR 40.A O no hydrogen 2.959 N/A LEU 102.A N TYR 85.A O no hydrogen 2.766 N/A MET 103.A N VAL 38.A O no hydrogen 3.000 N/A LYS 104.A N LYS 83.A O no hydrogen 2.790 N/A LYS 104.A NZ PHE 249.A O no hydrogen 3.361 N/A LEU 105.A N ARG 36.A O no hydrogen 2.770 N/A LYS 106.A N MET 80.A O no hydrogen 2.705 N/A VAL 109.A N ASP 35.A O no hydrogen 2.772 N/A SER 112.A N ILE 115.A O no hydrogen 2.966 N/A TYR 114.A N SER 112.A OG no hydrogen 2.961 N/A HIS 116.A N PRO 13.A O no hydrogen 3.178 N/A VAL 118.A N LEU 32.A O no hydrogen 3.047 N/A CYS 119.A N TRP 211.A O no hydrogen 3.298 N/A THR 125.A N ASP 122.A OD2 no hydrogen 3.212 N/A THR 125.A OG1 ASP 122.A OD1 no hydrogen 2.409 N/A THR 125.A OG1 ASP 122.A OD2 no hydrogen 3.127 N/A ALA 126.A N ASP 122.A O no hydrogen 3.029 N/A LEU 130.A N ALA 126.A O no hydrogen 2.987 N/A GLN 131.A N LEU 129C.A O no hydrogen 2.852 N/A GLY 133.A N ILE 159.A O no hydrogen 2.860 N/A TYR 134.A N GLN 131.A O no hydrogen 2.833 N/A GLY 136.A N LEU 157.A O no hydrogen 3.122 N/A ARG 137.A N VAL 202.A O no hydrogen 2.770 N/A ARG 137.A NE ASN 156.A OD1 no hydrogen 3.285 N/A VAL 138.A N VAL 155.A O no hydrogen 2.975 N/A THR 139.A OG1 GLN 15.A OE1 no hydrogen 2.600 N/A GLY 140.A N GLN 153.A O no hydrogen 3.309 N/A TRP 141.A NE1 HIS 66.A O no hydrogen 3.202 N/A GLY 142.A N ASP 196.A OD1 no hydrogen 2.952 N/A ASN 143.A N GLU 194.A O no hydrogen 3.130 N/A LEU 144.A N GLY 147.A O no hydrogen 2.749 N/A LEU 152.A N HIS 66.A O no hydrogen 3.021 N/A GLN 153.A N GLY 140.A O no hydrogen 3.280 N/A VAL 154.A N SER 5.A O no hydrogen 2.681 N/A VAL 155.A N VAL 138.A O no hydrogen 3.257 N/A LEU 157.A N GLY 136.A O no hydrogen 3.025 N/A ILE 159.A N TYR 134.A O no hydrogen 2.812 N/A VAL 160.A N CYS 179.A O no hydrogen 3.238 N/A ARG 162.A NH2 ASP 175.A OD1 no hydrogen 3.382 N/A CYS 165.A N GLU 161.A O no hydrogen 3.065 N/A CYS 165.A SG VAL 160.A O no hydrogen 3.481 N/A CYS 165.A SG GLU 161.A O no hydrogen 3.430 N/A LYS 166.A N ARG 162.A O no hydrogen 2.889 N/A ASP 167.A N PRO 163.A O no hydrogen 3.056 N/A SER 168.A N CYS 165.A O no hydrogen 3.345 N/A SER 168.A OG CYS 165.A O no hydrogen 2.855 N/A THR 169.A N LYS 166.A O no hydrogen 3.481 N/A THR 169.A OG1 GLU 221.A OE1 no hydrogen 3.266 N/A THR 169.A OG1 GLU 221.A OE2 no hydrogen 2.969 N/A ILE 171.A N THR 169.A OG1 no hydrogen 3.208 N/A ARG 172.A NE GLU 94A.A OE2 no hydrogen 2.684 N/A ARG 172.A NH2 GLU 94A.A OE1 no hydrogen 3.353 N/A ARG 172.A NH2 GLU 94A.A OE2 no hydrogen 3.440 N/A THR 174.A OG1 ASP 97.A OD1 no hydrogen 2.459 N/A ASN 176.A N THR 174.A OG1 no hydrogen 3.132 N/A ASN 176.A ND2 ASP 97.A OD1 no hydrogen 3.054 N/A MET 177.A N THR 174.A O no hydrogen 3.257 N/A PHE 178.A N TYR 232.A O no hydrogen 3.087 N/A ALA 180.A N GLY 230.A O no hydrogen 2.795 N/A GLY 181.A N PRO 158.A O no hydrogen 3.062 N/A LYS 183.A N GLU 186B.A OE1 no hydrogen 2.438 N/A ARG 189.A NE ASP 224.A OD2 no hydrogen 2.571 N/A ARG 189.A NH1 ASP 226.A OD1 no hydrogen 2.966 N/A ARG 189.A NH2 ASP 224.A O no hydrogen 2.332 N/A ARG 189.A NH2 ASP 226.A OD1 no hydrogen 2.711 N/A GLY 190.A N ASP 224.A OD1 no hydrogen 3.118 N/A ASP 191.A N VAL 2.A O no hydrogen 3.367 N/A CYS 193.A N ASP 196.A OD2 no hydrogen 2.780 N/A CYS 193.A SG GLU 194.A OE1 no hydrogen 3.211 N/A GLU 194.A N GLU 194.A OE1 no hydrogen 3.134 N/A ASP 196.A N CYS 193.A O no hydrogen 2.986 N/A SER 197.A OG HIS 43.A NE2 no hydrogen 3.115 N/A GLY 198.A N VAL 217.A O no hydrogen 2.942 N/A GLY 199.A N ASP 196.A O no hydrogen 3.172 N/A PHE 201.A N GLY 215.A O no hydrogen 2.834 N/A VAL 202.A N ARG 137.A O no hydrogen 2.758 N/A MET 203.A N TYR 212.A O no hydrogen 3.005 N/A SER 205.A N ARG 210.A O no hydrogen 2.814 N/A ASN 209.A N SER 205.A O no hydrogen 3.039 N/A TYR 212.A N MET 203.A O no hydrogen 2.648 N/A TYR 212.A OH ASN 208B.A OD1 no hydrogen 2.743 N/A GLN 213.A N CYS 119.A O no hydrogen 2.915 N/A GLN 213.A NE2 GLY 215.A O no hydrogen 3.158 N/A MET 214.A N PHE 201.A O no hydrogen 3.063 N/A GLY 215.A N PHE 201.A O no hydrogen 3.262 N/A ILE 216.A N THR 233.A O no hydrogen 3.319 N/A VAL 217.A N GLY 199.A O no hydrogen 2.695 N/A SER 218.A N PHE 231.A O no hydrogen 3.168 N/A SER 218.A OG ASP 99.A OD2 no hydrogen 2.523 N/A TRP 219.A N PHE 231.A O no hydrogen 3.241 N/A CYS 223.A N GLU 146.A OE1 no hydrogen 3.235 N/A CYS 223.A SG ALA 192.A O no hydrogen 3.992 N/A CYS 223.A SG GLU 194.A OE1 no hydrogen 2.884 N/A ASP 224.A N ASP 191.A OD2 no hydrogen 2.747 N/A LYS 228.A N ARG 225A.A O no hydrogen 3.197 N/A LYS 228.A NZ SER 168.A O no hydrogen 3.358 N/A LYS 228.A NZ GLU 221.A OE1 no hydrogen 2.757 N/A GLY 230.A N ALA 180.A O no hydrogen 3.061 N/A PHE 231.A N TRP 219.A O no hydrogen 2.951 N/A TYR 232.A N PHE 178.A O no hydrogen 2.903 N/A THR 233.A N ILE 216.A O no hydrogen 3.053 N/A THR 233.A OG1 ASP 99.A O no hydrogen 2.930 N/A HIS 234.A N ASN 176.A O no hydrogen 2.961 N/A VAL 235.A N MET 214.A O no hydrogen 3.222 N/A ARG 237.A N HIS 234.A ND1 no hydrogen 3.372 N/A ARG 237.A NH1 ASN 176.A OD1 no hydrogen 3.558 N/A LEU 238.A N VAL 235.A O no hydrogen 3.006 N/A LYS 239.A N PHE 236.A O no hydrogen 2.895 N/A LYS 239.A NZ PRO 121.A O no hydrogen 3.369 N/A TRP 241.A N LEU 238.A O no hydrogen 3.197 N/A ILE 242.A N LEU 238.A O no hydrogen 3.402 N/A GLN 243.A N LYS 239.A O no hydrogen 3.038 N/A LYS 244.A N LYS 240.A O no hydrogen 3.149 N/A LYS 244.A NZ GLN 248.A OE1 no hydrogen 2.490 N/A VAL 245.A N TRP 241.A O no hydrogen 3.236 N/A VAL 245.A N ILE 242.A O no hydrogen 3.182 N/A ILE 246.A N ILE 242.A O no hydrogen 3.163 N/A ASP 247.A N GLN 243.A O no hydrogen 2.926 N/A GLN 248.A N LYS 244.A O no hydrogen 3.334 N/A PHE 249.A N VAL 245.A O no hydrogen 2.868 N/A TYR 47A.A N LYS 52F.A O no hydrogen 2.842 N/A ARG 73A.A N TYR 71.A O no hydrogen 2.858 N/A GLU 94A.A N ASN 91.A OD1 no hydrogen 3.205 N/A ALA 127A.A N ARG 123.A O no hydrogen 3.199 N/A TYR 182A.A OH ASN 156.A O no hydrogen 3.394 N/A PHE 207A.A N SER 205.A OG no hydrogen 3.161 N/A ARG 225A.A NE GLU 146.A OE2 no hydrogen 3.170 N/A ARG 225A.A NH2 GLU 146.A OE2 no hydrogen 3.433 N/A SER 128B.A N GLU 124.A O no hydrogen 2.987 N/A SER 128B.A OG GLU 124.A O no hydrogen 2.538 N/A ASN 208B.A N SER 205.A OG no hydrogen 3.312 N/A LEU 129C.A N THR 125.A O no hydrogen 3.053 N/A TRP 50D.A N TYR 47A.A O no hydrogen 3.084 N/A ASP 51E.A N PRO 48B.A O no hydrogen 2.754 N/A LYS 52F.A N TYR 47A.A O no hydrogen 2.971 N/A LYS 52F.A NZ HIS 43.A O no hydrogen 2.845 N/A PHE 54H.A N LEU 45.A O no hydrogen 2.589 N/A THR 55I.A N ASP 58.A OD2 no hydrogen 2.638 N/A