Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1fyd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A NE2 TYR 234.A O no hydrogen 2.824 N/A GLN 3.A NE2 LYS 238.A O no hydrogen 3.020 N/A LYS 5.A N SER 1.A O no hydrogen 3.090 N/A LYS 5.A NZ GLU 9.A OE1 no hydrogen 3.511 N/A LYS 5.A NZ GLU 9.A OE2 no hydrogen 3.296 N/A ILE 6.A N MET 2.A O no hydrogen 3.098 N/A MET 7.A N GLN 3.A O no hydrogen 3.153 N/A ARG 8.A N GLU 4.A O no hydrogen 3.215 N/A ARG 8.A NH2 GLU 4.A OE1 no hydrogen 3.247 N/A GLU 9.A N LYS 5.A O no hydrogen 3.121 N/A LEU 10.A N ILE 6.A O no hydrogen 2.878 N/A HIS 11.A N ARG 8.A O no hydrogen 2.887 N/A VAL 12.A N MET 7.A O no hydrogen 3.027 N/A GLU 21.A N ASP 17.A O no hydrogen 2.788 N/A ILE 22.A N PRO 18.A O no hydrogen 3.011 N/A GLU 23.A N LYS 19.A O no hydrogen 3.176 N/A ASP 24.A N GLN 20.A O no hydrogen 2.951 N/A ARG 25.A N GLU 21.A O no hydrogen 2.981 N/A ARG 25.A NE PRO 180.A O no hydrogen 2.988 N/A VAL 26.A N ILE 22.A O no hydrogen 3.063 N/A ASN 27.A N GLU 23.A O no hydrogen 3.065 N/A PHE 28.A N ASP 24.A O no hydrogen 3.003 N/A LEU 29.A N ARG 25.A O no hydrogen 3.005 N/A LYS 30.A N VAL 26.A O no hydrogen 2.932 N/A LYS 30.A NZ SER 64.A OG no hydrogen 3.136 N/A LYS 30.A NZ GLU 68.A OE1 no hydrogen 2.848 N/A GLN 31.A N ASN 27.A O no hydrogen 3.078 N/A TYR 32.A N PHE 28.A O no hydrogen 2.927 N/A VAL 33.A N LEU 29.A O no hydrogen 3.170 N/A LYS 34.A N LYS 30.A O no hydrogen 3.080 N/A LYS 34.A NZ GLU 68.A OE2 no hydrogen 2.982 N/A LYS 35.A N GLN 31.A O no hydrogen 3.074 N/A THR 36.A N TYR 32.A O no hydrogen 3.171 N/A THR 36.A OG1 TYR 32.A O no hydrogen 3.060 N/A THR 36.A OG1 VAL 33.A O no hydrogen 2.932 N/A GLY 37.A N VAL 33.A O no hydrogen 2.863 N/A LYS 39.A N GLY 151.A O no hydrogen 2.950 N/A PHE 41.A N GLN 73.A O no hydrogen 3.027 N/A VAL 42.A N LEU 153.A O no hydrogen 3.261 N/A LEU 43.A N ILE 75.A O no hydrogen 3.137 N/A ILE 45.A N VAL 77.A O no hydrogen 2.860 N/A SER 46.A OG SER 51.A OG no hydrogen 3.388 N/A GLY 48.A N SER 46.A OG no hydrogen 3.187 N/A GLN 49.A NE2 LYS 186.A O no hydrogen 3.256 N/A SER 51.A OG SER 46.A OG no hydrogen 3.388 N/A THR 52.A N GLY 48.A O no hydrogen 3.410 N/A THR 52.A N GLN 49.A O no hydrogen 3.245 N/A THR 52.A OG1 GLY 48.A O no hydrogen 2.788 N/A LEU 53.A N GLN 49.A O no hydrogen 3.148 N/A ALA 54.A N ASP 50.A O no hydrogen 3.059 N/A GLY 55.A N SER 51.A O no hydrogen 2.755 N/A ARG 56.A N THR 52.A O no hydrogen 3.143 N/A LEU 57.A N LEU 53.A O no hydrogen 3.085 N/A ALA 58.A N ALA 54.A O no hydrogen 3.089 N/A GLN 59.A N GLY 55.A O no hydrogen 2.979 N/A LEU 60.A N ARG 56.A O no hydrogen 2.897 N/A ALA 61.A N LEU 57.A O no hydrogen 3.081 N/A VAL 62.A N ALA 58.A O no hydrogen 2.983 N/A GLU 63.A N GLN 59.A O no hydrogen 2.969 N/A SER 64.A N LEU 60.A O no hydrogen 3.098 N/A ILE 65.A N ALA 61.A O no hydrogen 2.988 N/A ARG 66.A N VAL 62.A O no hydrogen 3.269 N/A ARG 66.A NH1 ALA 72.A O no hydrogen 3.118 N/A ARG 66.A NH1 ASP 100.A OD1 no hydrogen 3.330 N/A ARG 66.A NH1 ASP 100.A OD2 no hydrogen 2.830 N/A ARG 66.A NH2 ASP 100.A OD1 no hydrogen 3.364 N/A GLU 67.A N GLU 63.A O no hydrogen 3.066 N/A GLU 68.A N SER 64.A O no hydrogen 3.246 N/A GLU 68.A N ILE 65.A O no hydrogen 3.033 N/A GLY 69.A N ARG 66.A O no hydrogen 2.698 N/A GLY 70.A N ILE 65.A O no hydrogen 2.686 N/A GLN 73.A N LYS 39.A O no hydrogen 2.872 N/A PHE 74.A N ASP 100.A OD2 no hydrogen 2.989 N/A ILE 75.A N PHE 41.A O no hydrogen 2.989 N/A ALA 76.A N LYS 101.A O no hydrogen 2.850 N/A VAL 77.A N LEU 43.A O no hydrogen 2.928 N/A ARG 78.A N TRP 103.A O no hydrogen 3.119 N/A ARG 78.A NE GLU 87.A OE2 no hydrogen 2.841 N/A ARG 78.A NH1 ILE 45.A O no hydrogen 2.715 N/A ARG 78.A NH2 GLN 84.A OE1 no hydrogen 2.793 N/A ARG 78.A NH2 GLU 87.A OE1 no hydrogen 3.025 N/A ARG 78.A NH2 GLU 87.A OE2 no hydrogen 2.935 N/A GLY 82.A N ASP 106.A OD1 no hydrogen 2.876 N/A GLN 84.A NE2 SER 46.A O no hydrogen 2.851 N/A GLN 84.A NE2 ASP 86.A OD1 no hydrogen 2.879 N/A GLU 87.A N GLN 84.A O no hydrogen 3.058 N/A ASP 89.A N ASP 86.A O no hydrogen 3.063 N/A ALA 90.A N ASP 86.A O no hydrogen 3.447 N/A GLN 91.A N GLU 87.A O no hydrogen 3.121 N/A LEU 92.A N ASP 88.A O no hydrogen 2.946 N/A ALA 93.A N ASP 89.A O no hydrogen 2.858 N/A LEU 94.A N ALA 90.A O no hydrogen 3.097 N/A LYS 95.A N GLN 91.A O no hydrogen 2.976 N/A PHE 96.A N LEU 92.A O no hydrogen 3.189 N/A PHE 96.A N ALA 93.A O no hydrogen 2.908 N/A ILE 97.A N ALA 93.A O no hydrogen 2.807 N/A LYS 98.A N LEU 94.A O no hydrogen 2.808 N/A LYS 98.A NZ LYS 95.A O no hydrogen 3.253 N/A LYS 101.A N PHE 74.A O no hydrogen 2.991 N/A TRP 103.A N ALA 76.A O no hydrogen 2.909 N/A PHE 105.A N ARG 78.A O no hydrogen 3.068 N/A ILE 107.A N PRO 80.A O no hydrogen 2.955 N/A LYS 108.A N ASP 106.A OD1 no hydrogen 3.090 N/A THR 110.A N ILE 107.A O no hydrogen 3.215 N/A VAL 111.A N ILE 107.A O no hydrogen 3.129 N/A SER 112.A N LYS 108.A O no hydrogen 2.961 N/A SER 112.A OG LYS 108.A O no hydrogen 3.029 N/A ALA 113.A N SER 109.A O no hydrogen 2.880 N/A PHE 114.A N THR 110.A O no hydrogen 2.995 N/A SER 115.A N VAL 111.A O no hydrogen 2.966 N/A SER 115.A OG VAL 111.A O no hydrogen 2.602 N/A ASP 116.A N SER 112.A O no hydrogen 2.939 N/A GLN 117.A N ALA 113.A O no hydrogen 3.095 N/A TYR 118.A N PHE 114.A O no hydrogen 2.836 N/A GLN 119.A N SER 115.A O no hydrogen 3.049 N/A GLN 120.A N ASP 116.A O no hydrogen 2.930 N/A GLU 121.A N GLN 117.A O no hydrogen 2.713 N/A THR 122.A N TYR 118.A O no hydrogen 2.861 N/A THR 122.A OG1 TYR 118.A O no hydrogen 2.754 N/A THR 122.A OG1 ASP 124.A O no hydrogen 3.359 N/A GLY 123.A N GLN 119.A O no hydrogen 2.830 N/A ASP 124.A N THR 122.A OG1 no hydrogen 3.267 N/A GLN 125.A NE2 GLN 119.A OE1 no hydrogen 3.616 N/A ASN 130.A N THR 127.A OG1 no hydrogen 3.393 N/A ASN 130.A ND2 THR 127.A OG1 no hydrogen 2.758 N/A LYS 131.A N THR 127.A O no hydrogen 2.991 N/A GLY 132.A N ASP 128.A O no hydrogen 3.004 N/A ASN 133.A N PHE 129.A O no hydrogen 3.227 N/A VAL 134.A N ASN 130.A O no hydrogen 3.061 N/A LYS 135.A N LYS 131.A O no hydrogen 2.928 N/A LYS 135.A N GLY 132.A O no hydrogen 3.133 N/A LYS 135.A NZ LEU 211.A O no hydrogen 3.241 N/A LYS 135.A NZ ASP 213.A OD1 no hydrogen 3.228 N/A LYS 135.A NZ ASP 213.A OD2 no hydrogen 2.878 N/A ALA 136.A N GLY 132.A O no hydrogen 3.268 N/A ARG 137.A N ASN 133.A O no hydrogen 3.250 N/A ARG 137.A NE LYS 170.A O no hydrogen 2.978 N/A ARG 137.A NH2 LYS 170.A O no hydrogen 2.909 N/A THR 138.A N VAL 134.A O no hydrogen 2.970 N/A THR 138.A OG1 VAL 134.A O no hydrogen 2.702 N/A ARG 139.A N LYS 135.A O no hydrogen 2.995 N/A ARG 139.A NE LEU 79.A O no hydrogen 2.717 N/A ARG 139.A NH2 LEU 79.A O no hydrogen 2.875 N/A MET 140.A N ALA 136.A O no hydrogen 3.001 N/A ILE 141.A N ARG 137.A O no hydrogen 3.038 N/A ALA 142.A N THR 138.A O no hydrogen 2.965 N/A GLN 143.A N ARG 139.A O no hydrogen 2.963 N/A TYR 144.A N MET 140.A O no hydrogen 2.860 N/A TYR 144.A OH ASP 177.A OD1 no hydrogen 2.887 N/A ALA 145.A N ILE 141.A O no hydrogen 2.815 N/A ILE 146.A N ALA 142.A O no hydrogen 3.324 N/A GLY 147.A N GLN 143.A O no hydrogen 3.095 N/A GLY 148.A N TYR 144.A O no hydrogen 2.886 N/A GLN 149.A N ALA 145.A O no hydrogen 2.908 N/A GLN 149.A N ILE 146.A O no hydrogen 3.032 N/A GLU 150.A N ILE 146.A O no hydrogen 2.911 N/A LEU 152.A N GLY 147.A O no hydrogen 2.820 N/A LEU 153.A N GLY 40.A O no hydrogen 2.728 N/A VAL 154.A N ASP 177.A OD2 no hydrogen 2.812 N/A LEU 155.A N VAL 42.A O no hydrogen 3.251 N/A GLY 156.A N LEU 178.A O no hydrogen 2.882 N/A HIS 159.A NE2 ASP 50.A OD2 no hydrogen 2.865 N/A ALA 160.A N LEU 184.A O no hydrogen 3.026 N/A GLU 162.A N HIS 159.A O no hydrogen 3.168 N/A ALA 163.A N HIS 159.A O no hydrogen 2.771 N/A VAL 164.A N ALA 160.A O no hydrogen 2.980 N/A GLY 166.A N ALA 163.A O no hydrogen 3.174 N/A PHE 167.A N GLU 162.A O no hydrogen 3.146 N/A PHE 168.A N GLY 166.A O no hydrogen 2.976 N/A THR 169.A N ASP 173.A OD2 no hydrogen 2.957 N/A THR 169.A OG1 ASN 133.A OD1 no hydrogen 3.344 N/A THR 169.A OG1 ASP 173.A OD2 no hydrogen 3.474 N/A GLY 172.A N THR 169.A O no hydrogen 2.933 N/A ASP 173.A N ASP 173.A OD2 no hydrogen 2.550 N/A GLY 174.A N THR 169.A O no hydrogen 3.018 N/A GLY 175.A N GLY 172.A O no hydrogen 3.092 N/A ASP 177.A N VAL 154.A O no hydrogen 2.752 N/A LEU 178.A N VAL 154.A O no hydrogen 3.390 N/A LEU 184.A N LEU 181.A O no hydrogen 3.104 N/A THR 185.A N GLN 188.A OE1 no hydrogen 3.082 N/A THR 185.A OG1 GLU 236.A OE2 no hydrogen 2.736 N/A LYS 186.A N ASP 232.A OD1 no hydrogen 3.132 N/A LYS 186.A NZ ASP 50.A OD1 no hydrogen 2.916 N/A LYS 186.A NZ ASP 50.A OD2 no hydrogen 3.002 N/A ARG 187.A N ASP 232.A OD2 no hydrogen 2.756 N/A ARG 187.A NH1 ASP 233.A OD2 no hydrogen 3.027 N/A ARG 187.A NH1 GLU 236.A OE1 no hydrogen 2.833 N/A ARG 187.A NH2 ASP 229.A OD1 no hydrogen 3.411 N/A ARG 187.A NH2 ASP 233.A OD2 no hydrogen 2.698 N/A GLN 188.A N THR 185.A OG1 no hydrogen 3.292 N/A GLN 188.A NE2 LYS 13.A O no hydrogen 2.941 N/A GLY 189.A N THR 185.A O no hydrogen 3.109 N/A ARG 190.A N LYS 186.A O no hydrogen 3.332 N/A THR 191.A N ARG 187.A O no hydrogen 3.299 N/A THR 191.A OG1 ARG 187.A O no hydrogen 3.033 N/A LEU 192.A N GLN 188.A O no hydrogen 3.158 N/A LEU 192.A N GLY 189.A O no hydrogen 2.939 N/A LEU 193.A N GLY 189.A O no hydrogen 2.934 N/A LYS 194.A N ARG 190.A O no hydrogen 2.895 N/A GLU 195.A N THR 191.A O no hydrogen 3.349 N/A LEU 196.A N LEU 192.A O no hydrogen 2.898 N/A GLY 197.A N LYS 194.A O no hydrogen 3.171 N/A ALA 198.A N LEU 193.A O no hydrogen 2.824 N/A ARG 201.A NH1 ASP 89.A OD1 no hydrogen 2.914 N/A LEU 202.A N PRO 199.A O no hydrogen 2.978 N/A TYR 203.A N GLU 200.A O no hydrogen 3.030 N/A LEU 204.A N GLU 200.A O no hydrogen 2.801 N/A LYS 205.A N ARG 201.A O no hydrogen 3.234 N/A LYS 205.A NZ GLY 47.A O no hydrogen 3.265 N/A LYS 205.A NZ ASP 86.A OD2 no hydrogen 3.171 N/A LYS 205.A NZ ASP 89.A OD2 no hydrogen 2.645 N/A THR 208.A OG1 GLN 218.A O no hydrogen 2.754 N/A ASP 210.A N THR 208.A OG1 no hydrogen 3.229 N/A ASP 213.A N ASP 128.A OD1 no hydrogen 3.285 N/A GLU 214.A N ASP 128.A OD2 no hydrogen 3.099 N/A GLN 217.A N ASP 210.A OD1 no hydrogen 2.907 N/A SER 219.A OG THR 222.A OG1 no hydrogen 2.892 N/A ASP 220.A N PRO 207.A O no hydrogen 2.901 N/A THR 222.A N SER 219.A O no hydrogen 3.130 N/A THR 222.A OG1 SER 219.A OG no hydrogen 2.892 N/A LEU 224.A N ASP 220.A O no hydrogen 2.816 N/A SER 227.A N GLU 230.A OE1 no hydrogen 3.041 N/A SER 227.A OG GLU 230.A OE1 no hydrogen 3.060 N/A TYR 228.A N GLU 221.A OE2 no hydrogen 3.148 N/A TYR 228.A OH ASP 220.A OD2 no hydrogen 3.102 N/A GLU 230.A N SER 227.A O no hydrogen 3.216 N/A ILE 231.A N SER 227.A O no hydrogen 3.143 N/A ASP 232.A N TYR 228.A O no hydrogen 2.734 N/A ASP 233.A N ASP 229.A O no hydrogen 2.823 N/A TYR 234.A N GLU 230.A O no hydrogen 3.191 N/A TYR 234.A OH GLU 249.A OE2 no hydrogen 2.969 N/A LEU 235.A N ILE 231.A O no hydrogen 2.891 N/A GLU 236.A N ASP 232.A O no hydrogen 2.823 N/A GLY 237.A N TYR 234.A O no hydrogen 3.142 N/A LYS 238.A N ASP 233.A O no hydrogen 2.691 N/A VAL 244.A N SER 241.A O no hydrogen 2.736 N/A SER 245.A N SER 241.A O no hydrogen 3.329 N/A GLU 246.A N ALA 242.A O no hydrogen 2.960 N/A LEU 248.A N VAL 244.A O no hydrogen 2.913 N/A GLU 249.A N SER 245.A O no hydrogen 2.882 N/A LYS 250.A N GLU 246.A O no hydrogen 3.220 N/A ARG 251.A N ALA 247.A O no hydrogen 3.258 N/A TYR 252.A N LEU 248.A O no hydrogen 2.860 N/A TYR 252.A OH GLU 9.A OE2 no hydrogen 2.573 N/A SER 253.A N GLU 249.A O no hydrogen 3.167 N/A SER 253.A OG GLU 249.A O no hydrogen 3.393 N/A MET 254.A N LYS 250.A O no hydrogen 3.078 N/A THR 255.A N TYR 252.A O no hydrogen 3.355 N/A THR 255.A OG1 ARG 251.A O no hydrogen 2.760 N/A THR 255.A OG1 TYR 252.A O no hydrogen 3.372 N/A LYS 258.A N THR 255.A O no hydrogen 2.863 N/A LYS 258.A NZ GLY 166.A O no hydrogen 2.829 N/A LYS 258.A NZ PHE 168.A O no hydrogen 2.862 N/A ARG 259.A N GLU 256.A O no hydrogen 3.007 N/A ARG 259.A NE ALA 163.A O no hydrogen 3.121 N/A ARG 259.A NH1 GLU 256.A OE1 no hydrogen 3.255 N/A ARG 259.A NH1 GLU 256.A OE2 no hydrogen 2.652 N/A ARG 259.A NH2 GLU 256.A OE2 no hydrogen 2.834 N/A GLN 260.A NE2 GLU 256.A OE1 no hydrogen 2.848 N/A SER 264.A N ASP 267.A OD1 no hydrogen 3.143 N/A SER 264.A OG ASP 267.A OD1 no hydrogen 3.307 N/A PHE 266.A N SER 264.A OG no hydrogen 2.999 N/A ASP 267.A N SER 264.A O no hydrogen 3.353 N/A TRP 270.A NE1 SER 264.A O no hydrogen 3.018 N/A LYS 271.A N ASP 268.A O no hydrogen 2.646 N/A LYS 271.A NZ MET 265.A O no hydrogen 2.987 N/A LYS 271.A NZ ASP 267.A O no hydrogen 2.976 N/A