Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3had_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ GLU 172.A OE1 no hydrogen 3.208 N/A LYS 5.A N ASP 91.A OD2 no hydrogen 2.822 N/A HIS 6.A N ASP 91.A OD2 no hydrogen 2.692 N/A VAL 7.A N THR 29.A O no hydrogen 2.831 N/A THR 8.A N LEU 92.A O no hydrogen 2.732 N/A THR 8.A OG1 THR 90.A OG1 no hydrogen 2.772 N/A VAL 9.A N VAL 31.A O no hydrogen 2.870 N/A ILE 10.A N VAL 94.A O no hydrogen 2.901 N/A GLY 11.A N VAL 33.A O no hydrogen 2.748 N/A GLY 12.A N ASP 34.A OD2 no hydrogen 2.807 N/A ALA 17.A N GLY 13.A O no hydrogen 3.001 N/A ILE 19.A N MET 15.A O no hydrogen 2.929 N/A ALA 20.A N GLY 16.A O no hydrogen 2.862 N/A GLN 21.A N ALA 17.A O no hydrogen 3.058 N/A GLN 21.A NE2 SER 50.A OG no hydrogen 3.296 N/A VAL 22.A N GLY 18.A O no hydrogen 3.120 N/A ALA 23.A N ILE 19.A O no hydrogen 2.958 N/A ALA 24.A N ALA 20.A O no hydrogen 2.915 N/A ALA 25.A N GLN 21.A O no hydrogen 2.848 N/A THR 26.A N VAL 22.A O no hydrogen 3.091 N/A THR 26.A N ALA 23.A O no hydrogen 3.345 N/A THR 26.A OG1 VAL 22.A O no hydrogen 2.733 N/A THR 26.A OG1 ALA 23.A O no hydrogen 2.965 N/A THR 26.A OG1 HIS 28.A ND1 no hydrogen 3.013 N/A GLY 27.A N ALA 24.A O no hydrogen 3.332 N/A HIS 28.A N ALA 23.A O no hydrogen 2.953 N/A HIS 28.A ND1 ALA 23.A O no hydrogen 2.871 N/A HIS 28.A ND1 THR 26.A OG1 no hydrogen 3.013 N/A THR 29.A N LYS 5.A O no hydrogen 2.839 N/A VAL 30.A N THR 76.A O no hydrogen 2.990 N/A VAL 31.A N VAL 7.A O no hydrogen 3.025 N/A LEU 32.A N ALA 78.A O no hydrogen 2.860 N/A VAL 33.A N VAL 9.A O no hydrogen 2.804 N/A GLN 35.A N ASP 34.A OD1 no hydrogen 2.679 N/A LEU 40.A N THR 36.A O no hydrogen 3.013 N/A ALA 41.A N GLU 37.A O no hydrogen 2.932 N/A LYS 42.A N ASP 38.A O no hydrogen 2.842 N/A SER 43.A N ILE 39.A O no hydrogen 2.792 N/A SER 43.A OG GLY 12.A O no hydrogen 2.617 N/A SER 43.A OG ILE 39.A O no hydrogen 2.918 N/A LYS 44.A N LEU 40.A O no hydrogen 2.751 N/A LYS 44.A NZ ILE 77.A O no hydrogen 3.143 N/A LYS 45.A N ALA 41.A O no hydrogen 2.814 N/A GLY 46.A N LYS 42.A O no hydrogen 3.028 N/A ILE 47.A N SER 43.A O no hydrogen 3.017 N/A GLU 48.A N LYS 44.A O no hydrogen 2.961 N/A GLU 49.A N LYS 45.A O no hydrogen 3.022 N/A SER 50.A N GLY 46.A O no hydrogen 2.972 N/A SER 50.A OG GLN 21.A OE1 no hydrogen 3.162 N/A LEU 51.A N ILE 47.A O no hydrogen 2.870 N/A ARG 52.A N GLU 48.A O no hydrogen 2.778 N/A ARG 52.A NE GLU 48.A OE2 no hydrogen 2.986 N/A ARG 52.A NH2 GLU 48.A OE2 no hydrogen 2.925 N/A LYS 53.A N GLU 49.A O no hydrogen 3.048 N/A VAL 54.A N SER 50.A O no hydrogen 3.026 N/A ALA 55.A N LEU 51.A O no hydrogen 2.679 N/A LYS 56.A N ARG 52.A O no hydrogen 2.837 N/A LYS 57.A N VAL 54.A O no hydrogen 3.218 N/A LYS 58.A N VAL 54.A O no hydrogen 2.927 N/A PHE 59.A N ALA 55.A O no hydrogen 2.804 N/A ASN 62.A N PHE 59.A O no hydrogen 2.885 N/A ALA 65.A N ASN 62.A OD1 no hydrogen 2.703 N/A GLY 66.A N ASN 62.A O no hydrogen 3.116 N/A ASP 67.A N PRO 63.A O no hydrogen 2.795 N/A GLU 68.A N LYS 64.A O no hydrogen 3.030 N/A PHE 69.A N ALA 65.A O no hydrogen 3.170 N/A VAL 70.A N GLY 66.A O no hydrogen 3.027 N/A GLU 71.A N ASP 67.A O no hydrogen 2.842 N/A LYS 72.A N GLU 68.A O no hydrogen 2.973 N/A THR 73.A N PHE 69.A O no hydrogen 3.255 N/A THR 73.A OG1 PHE 69.A O no hydrogen 3.124 N/A LEU 74.A N VAL 70.A O no hydrogen 2.895 N/A SER 75.A N GLU 71.A O no hydrogen 2.918 N/A SER 75.A OG GLU 71.A O no hydrogen 3.069 N/A SER 75.A OG LYS 72.A O no hydrogen 2.990 N/A THR 76.A N THR 73.A O no hydrogen 3.191 N/A THR 76.A OG1 LYS 72.A O no hydrogen 3.532 N/A THR 76.A OG1 THR 73.A O no hydrogen 2.835 N/A ILE 77.A N LEU 74.A O no hydrogen 3.320 N/A ALA 78.A N VAL 30.A O no hydrogen 2.785 N/A SER 80.A N LEU 32.A O no hydrogen 3.045 N/A ALA 84.A N ASP 82.A OD1 no hydrogen 3.034 N/A SER 85.A N ASP 82.A O no hydrogen 3.013 N/A SER 85.A OG ASP 82.A O no hydrogen 2.483 N/A VAL 86.A N ALA 83.A O no hydrogen 2.900 N/A VAL 87.A N ALA 83.A O no hydrogen 3.111 N/A HIS 88.A ND1 ARG 114.A O no hydrogen 2.614 N/A SER 89.A N VAL 86.A O no hydrogen 3.305 N/A THR 90.A N VAL 87.A O no hydrogen 3.128 N/A THR 90.A OG1 HIS 6.A O no hydrogen 3.136 N/A THR 90.A OG1 THR 8.A OG1 no hydrogen 2.772 N/A THR 90.A OG1 LEU 92.A O no hydrogen 3.396 N/A ASP 91.A N HIS 6.A O no hydrogen 2.845 N/A LEU 92.A N HIS 6.A O no hydrogen 3.195 N/A VAL 93.A N ILE 120.A O no hydrogen 2.848 N/A VAL 94.A N THR 8.A O no hydrogen 2.847 N/A GLU 95.A N ALA 122.A O no hydrogen 2.777 N/A ALA 96.A N ILE 10.A O no hydrogen 2.733 N/A ILE 97.A N GLU 95.A OE2 no hydrogen 2.877 N/A ASN 100.A N VAL 98.A O no hydrogen 2.890 N/A VAL 103.A N ASN 100.A OD1 no hydrogen 2.980 N/A LYS 104.A N ASN 100.A O no hydrogen 3.142 N/A LYS 104.A NZ GLU 95.A OE2 no hydrogen 2.922 N/A LYS 104.A NZ VAL 98.A O no hydrogen 2.716 N/A LYS 104.A NZ GLU 99.A OE1 no hydrogen 3.121 N/A ASN 105.A N LEU 101.A O no hydrogen 2.920 N/A GLU 106.A N LYS 102.A O no hydrogen 2.962 N/A LEU 107.A N VAL 103.A O no hydrogen 2.940 N/A PHE 108.A N LYS 104.A O no hydrogen 2.921 N/A LYS 109.A N ASN 105.A O no hydrogen 2.825 N/A ARG 110.A N GLU 106.A O no hydrogen 3.268 N/A ARG 110.A NH1 ASP 82.A OD1 no hydrogen 2.915 N/A ARG 110.A NH2 ASP 82.A OD1 no hydrogen 3.421 N/A ARG 110.A NH2 ASP 82.A OD2 no hydrogen 2.863 N/A LEU 111.A N LEU 107.A O no hydrogen 3.030 N/A ASP 112.A N PHE 108.A O no hydrogen 2.920 N/A LYS 113.A N ARG 110.A O no hydrogen 3.002 N/A ARG 114.A N LEU 111.A O no hydrogen 2.905 N/A ALA 115.A N LEU 111.A O no hydrogen 2.964 N/A HIS 118.A NE2 ASP 91.A OD1 no hydrogen 2.961 N/A THR 119.A N ALA 116.A O no hydrogen 3.098 N/A THR 119.A OG1 THR 90.A O no hydrogen 2.784 N/A THR 119.A OG1 ALA 116.A O no hydrogen 3.190 N/A ILE 120.A N ASP 91.A O no hydrogen 3.165 N/A PHE 121.A N ARG 142.A O no hydrogen 2.790 N/A ALA 122.A N VAL 93.A O no hydrogen 2.826 N/A SER 123.A N ALA 144.A O no hydrogen 3.198 N/A SER 123.A OG GLU 95.A OE1 no hydrogen 2.690 N/A ASN 124.A N GLU 95.A O no hydrogen 2.807 N/A THR 125.A N SER 123.A OG no hydrogen 3.061 N/A THR 125.A OG1 GLU 99.A OE1 no hydrogen 2.896 N/A THR 125.A OG1 GLU 99.A OE2 no hydrogen 2.613 N/A SER 126.A OG HIS 147.A NE2 no hydrogen 2.799 N/A SER 127.A N GLU 99.A OE2 no hydrogen 2.796 N/A SER 127.A OG GLU 99.A OE2 no hydrogen 2.803 N/A LEU 128.A N THR 125.A OG1 no hydrogen 3.155 N/A ILE 130.A N ASP 190.A OD1 no hydrogen 3.038 N/A THR 131.A N ASP 190.A OD2 no hydrogen 2.784 N/A THR 131.A OG1 ASP 190.A OD2 no hydrogen 2.658 N/A ILE 133.A N GLN 129.A O no hydrogen 3.195 N/A ALA 134.A N ILE 130.A O no hydrogen 2.770 N/A ASN 135.A N THR 131.A O no hydrogen 3.090 N/A ALA 136.A N ILE 133.A O no hydrogen 3.075 N/A THR 137.A N ALA 134.A O no hydrogen 2.895 N/A THR 137.A OG1 ALA 134.A O no hydrogen 2.747 N/A THR 138.A N ASP 112.A OD2 no hydrogen 3.121 N/A THR 138.A OG1 ASP 112.A OD2 no hydrogen 3.128 N/A ARG 139.A N THR 137.A OG1 no hydrogen 3.065 N/A ARG 139.A NE ASP 112.A OD1 no hydrogen 2.669 N/A ARG 139.A NH1 ALA 116.A O no hydrogen 2.847 N/A ARG 139.A NH1 THR 119.A O no hydrogen 2.875 N/A ARG 139.A NH2 ASP 112.A O no hydrogen 3.094 N/A ARG 139.A NH2 ALA 115.A O no hydrogen 3.062 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 2.713 N/A GLN 140.A NE2 ASN 135.A OD1 no hydrogen 3.250 N/A ARG 142.A N ARG 139.A O no hydrogen 2.823 N/A ARG 142.A NE ASP 141.A OD1 no hydrogen 3.147 N/A ARG 142.A NE ASP 141.A OD2 no hydrogen 2.881 N/A ARG 142.A NH1 GLU 117.A O no hydrogen 2.781 N/A ARG 142.A NH2 ASP 141.A OD1 no hydrogen 2.878 N/A PHE 143.A N GLN 140.A O no hydrogen 3.184 N/A ALA 144.A N PHE 121.A O no hydrogen 3.046 N/A GLY 145.A N ILE 161.A O no hydrogen 2.866 N/A LEU 146.A N SER 123.A O no hydrogen 2.941 N/A HIS 147.A N GLU 159.A O no hydrogen 2.870 N/A HIS 147.A ND1 GLU 159.A OE1 no hydrogen 2.530 N/A HIS 147.A NE2 SER 126.A OG no hydrogen 2.799 N/A PHE 148.A N ASN 124.A OD1 no hydrogen 2.795 N/A VAL 154.A N PRO 151.A O no hydrogen 2.896 N/A MET 155.A N PRO 151.A O no hydrogen 2.917 N/A VAL 158.A N HIS 184.A O.A no hydrogen 3.316 N/A VAL 158.A N HIS 184.A O.B no hydrogen 3.364 N/A GLU 159.A N HIS 147.A O no hydrogen 2.880 N/A VAL 160.A N VAL 186.A O no hydrogen 2.783 N/A ILE 161.A N GLY 145.A O no hydrogen 2.746 N/A LYS 162.A N CYS 188.A O no hydrogen 3.377 N/A THR 163.A N THR 166.A OG1 no hydrogen 3.066 N/A THR 163.A OG1 THR 166.A OG1 no hydrogen 3.276 N/A MET 165.A N THR 163.A OG1 no hydrogen 2.924 N/A THR 166.A N THR 163.A O no hydrogen 3.162 N/A THR 166.A N THR 163.A OG1 no hydrogen 3.171 N/A THR 166.A OG1 PHE 143.A O no hydrogen 2.604 N/A THR 166.A OG1 THR 163.A OG1 no hydrogen 3.276 N/A SER 167.A N ASP 141.A O no hydrogen 2.958 N/A SER 167.A OG ASP 141.A O no hydrogen 3.138 N/A SER 167.A OG THR 170.A OG1 no hydrogen 2.906 N/A GLN 168.A NE2 GLU 172.A OE2 no hydrogen 3.486 N/A THR 170.A N SER 167.A OG no hydrogen 2.910 N/A THR 170.A OG1 ASP 141.A O no hydrogen 2.594 N/A THR 170.A OG1 SER 167.A OG no hydrogen 2.906 N/A PHE 171.A N SER 167.A O no hydrogen 2.898 N/A GLU 172.A N GLN 168.A O no hydrogen 2.780 N/A SER 173.A N LYS 169.A O no hydrogen 3.142 N/A LEU 174.A N THR 170.A O no hydrogen 3.212 N/A VAL 175.A N PHE 171.A O no hydrogen 3.025 N/A ASP 176.A N GLU 172.A O no hydrogen 2.867 N/A PHE 177.A N SER 173.A O no hydrogen 2.870 N/A SER 178.A N LEU 174.A O no hydrogen 2.758 N/A SER 178.A OG LEU 174.A O no hydrogen 2.695 N/A LYS 179.A N VAL 175.A O no hydrogen 2.990 N/A ALA 180.A N ASP 176.A O no hydrogen 2.823 N/A LEU 181.A N PHE 177.A O no hydrogen 2.869 N/A LEU 181.A N SER 178.A O no hydrogen 3.022 N/A GLY 182.A N LYS 179.A O no hydrogen 2.850 N/A LYS 183.A N SER 178.A O no hydrogen 2.994 N/A LYS 183.A NZ VAL 152.A O no hydrogen 2.584 N/A LYS 183.A NZ MET 155.A O no hydrogen 2.714 N/A HIS 184.A N.A LYS 156.A O no hydrogen 2.727 N/A HIS 184.A N.B LYS 156.A O no hydrogen 2.747 N/A VAL 186.A N VAL 158.A O no hydrogen 3.047 N/A CYS 188.A N VAL 160.A O no hydrogen 3.439 N/A CYS 188.A SG LYS 189.A O no hydrogen 3.456 N/A THR 191.A N LYS 189.A O no hydrogen 2.739 N/A THR 191.A OG1 LYS 189.A O no hydrogen 3.513 N/A PHE 194.A N THR 191.A O no hydrogen 2.934 N/A ILE 195.A N GLU 159.A OE2 no hydrogen 2.828 N/A VAL 196.A N GLU 159.A OE2 no hydrogen 3.033 N/A ARG 198.A N GLY 193.A O no hydrogen 3.175 N/A ARG 198.A NH1 ARG 198.A O no hydrogen 3.035 N/A LEU 199.A N ILE 195.A O no hydrogen 3.103 N/A LEU 199.A N VAL 196.A O no hydrogen 3.016 N/A LEU 200.A N VAL 196.A O no hydrogen 2.645 N/A VAL 201.A N ASN 197.A O no hydrogen 2.866 N/A LEU 204.A N LEU 200.A O no hydrogen 3.081 N/A MET 205.A N VAL 201.A O no hydrogen 2.973 N/A GLU 206.A N PRO 202.A O no hydrogen 3.068 N/A ALA 207.A N TYR 203.A O no hydrogen 3.010 N/A ILE 208.A N LEU 204.A O no hydrogen 3.065 N/A ARG 209.A N MET 205.A O no hydrogen 2.856 N/A ARG 209.A NH1 GLU 206.A OE1 no hydrogen 3.015 N/A ARG 209.A NH1 LEU 263.A O no hydrogen 3.375 N/A ARG 209.A NH2 LEU 263.A O no hydrogen 2.901 N/A ARG 209.A NH2 GLN 265.A O no hydrogen 2.747 N/A LEU 210.A N GLU 206.A O no hydrogen 2.909 N/A TYR 211.A N ALA 207.A O no hydrogen 3.116 N/A GLU 212.A N ILE 208.A O no hydrogen 2.816 N/A ARG 213.A N ARG 209.A O no hydrogen 2.952 N/A ARG 213.A NE ASP 215.A OD2 no hydrogen 2.775 N/A GLY 214.A N TYR 211.A O no hydrogen 2.686 N/A ASP 215.A N LEU 210.A O no hydrogen 3.141 N/A LYS 218.A NZ TYR 211.A OH no hydrogen 3.395 N/A LYS 218.A NZ PHE 287.A O no hydrogen 3.497 N/A ASP 220.A N SER 217.A OG no hydrogen 3.050 N/A ILE 221.A N SER 217.A O no hydrogen 2.974 N/A ASP 222.A N LYS 218.A O no hydrogen 2.938 N/A THR 223.A N GLU 219.A O no hydrogen 2.941 N/A THR 223.A OG1 GLU 219.A O no hydrogen 3.119 N/A ALA 224.A N ASP 220.A O no hydrogen 2.736 N/A MET 225.A N ILE 221.A O no hydrogen 2.961 N/A LYS 226.A N ASP 222.A O no hydrogen 2.996 N/A LYS 226.A NZ GLU 237.A OE1.A no hydrogen 3.086 N/A LYS 226.A NZ GLU 237.A OE2.A no hydrogen 3.233 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 2.729 N/A ALA 229.A N MET 225.A O no hydrogen 2.983 N/A TYR 231.A N MET 225.A O no hydrogen 3.249 N/A GLY 234.A N GLU 237.A OE1.A no hydrogen 2.609 N/A PHE 236.A N ASP 222.A OD1 no hydrogen 2.904 N/A GLU 237.A N.B GLY 234.A O no hydrogen 3.151 N/A LEU 238.A N GLY 234.A O no hydrogen 2.959 N/A LEU 239.A N PRO 235.A O no hydrogen 2.860 N/A ASP 240.A N PHE 236.A O no hydrogen 3.083 N/A TYR 241.A N GLU 237.A O.A no hydrogen 3.144 N/A TYR 241.A N GLU 237.A O.B no hydrogen 3.015 N/A VAL 242.A N LEU 238.A O no hydrogen 2.769 N/A GLY 243.A N LEU 239.A O no hydrogen 2.863 N/A LEU 244.A N PHE 279.A O no hydrogen 3.024 N/A THR 246.A OG1 VAL 242.A O no hydrogen 3.463 N/A THR 246.A OG1 ASP 245.A OD1 no hydrogen 3.497 N/A THR 247.A N GLY 243.A O no hydrogen 2.921 N/A THR 247.A OG1 GLY 243.A O no hydrogen 2.871 N/A LYS 248.A N LEU 244.A O no hydrogen 2.904 N/A LYS 248.A NZ ASP 252.A OD1 no hydrogen 2.895 N/A LYS 248.A NZ ASP 252.A OD2 no hydrogen 2.635 N/A PHE 249.A N ASP 245.A O no hydrogen 2.910 N/A ILE 250.A N THR 246.A O no hydrogen 3.302 N/A VAL 251.A N THR 247.A O no hydrogen 3.042 N/A ASP 252.A N LYS 248.A O no hydrogen 2.792 N/A GLY 253.A N PHE 249.A O no hydrogen 3.189 N/A TRP 254.A N ILE 250.A O no hydrogen 3.214 N/A HIS 255.A N VAL 251.A O no hydrogen 2.723 N/A GLU 256.A N ASP 252.A O no hydrogen 2.691 N/A MET 257.A N GLY 253.A O no hydrogen 3.043 N/A ASP 258.A N TRP 254.A O no hydrogen 3.070 N/A ASP 258.A N HIS 255.A O no hydrogen 3.059 N/A ASN 261.A N ASP 258.A O no hydrogen 2.752 N/A ASN 261.A ND2 ASP 258.A OD2 no hydrogen 3.217 N/A LEU 263.A N ASN 261.A OD1 no hydrogen 2.712 N/A HIS 264.A N ASN 261.A O no hydrogen 3.245 N/A GLN 265.A N PRO 262.A O no hydrogen 3.023 N/A GLN 265.A NE2 ALA 259.A O no hydrogen 2.841 N/A GLN 265.A NE2 ASN 261.A O no hydrogen 3.093 N/A SER 267.A OG GLU 212.A OE1 no hydrogen 2.912 N/A SER 267.A OG GLU 212.A OE2 no hydrogen 3.369 N/A SER 269.A N GLU 212.A OE2 no hydrogen 2.669 N/A SER 269.A OG GLU 212.A OE2 no hydrogen 2.613 N/A LEU 270.A N SER 267.A OG no hydrogen 3.065 N/A ASN 271.A N SER 267.A O no hydrogen 2.796 N/A LYS 272.A N PRO 268.A O no hydrogen 2.740 N/A LYS 272.A NZ GLU 276.A OE2 no hydrogen 2.354 N/A LEU 273.A N SER 269.A O no hydrogen 3.059 N/A VAL 274.A N LEU 270.A O no hydrogen 3.082 N/A ALA 275.A N ASN 271.A O no hydrogen 2.721 N/A GLU 276.A N LYS 272.A O no hydrogen 2.776 N/A ASN 277.A N VAL 274.A O no hydrogen 2.919 N/A LYS 278.A N LEU 273.A O no hydrogen 2.626 N/A LYS 278.A NZ GLU 276.A OE1 no hydrogen 2.617 N/A PHE 279.A N THR 283.A OG1 no hydrogen 3.248 N/A GLY 280.A N GLU 285.A O no hydrogen 2.792 N/A LYS 281.A N ASP 240.A O no hydrogen 2.846 N/A LYS 282.A NZ ASP 245.A OD1 no hydrogen 3.026 N/A LYS 282.A NZ ASP 245.A OD2 no hydrogen 3.196 N/A LYS 282.A NZ THR 246.A OG1 no hydrogen 3.351 N/A THR 283.A N GLY 280.A O no hydrogen 3.134 N/A THR 283.A OG1 GLY 280.A O no hydrogen 3.483 N/A GLU 285.A N GLY 280.A O no hydrogen 2.874 N/A GLY 286.A N TYR 288.A O no hydrogen 2.840 N/A PHE 287.A N ASP 240.A OD1 no hydrogen 2.688 N/A PHE 287.A N ASP 240.A OD2 no hydrogen 3.145 N/A TYR 288.A N ASP 240.A OD2 no hydrogen 2.937 N/A TYR 288.A OH ASP 222.A OD2 no hydrogen 2.718 N/A TYR 290.A N GLY 284.A O no hydrogen 2.842 N/A TYR 290.A OH ASP 240.A OD2 no hydrogen 2.493 N/A