Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7dua_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 2.A N GLU 2.A OE2 no hydrogen 2.865 N/A LYS 5.A N ASP 3.A OD1 no hydrogen 3.199 N/A TRP 6.A N ASP 3.A O no hydrogen 2.985 N/A GLU 7.A N ASP 3.A O no hydrogen 2.792 N/A PHE 8.A N ALA 82.A O no hydrogen 2.768 N/A ARG 10.A NE.A GLN 85.A O no hydrogen 2.921 N/A ARG 10.A NH1.A PRO 88.A O no hydrogen 2.888 N/A ARG 10.A NH1.B ARG 10.A O.B no hydrogen 2.721 N/A ARG 10.A NH1.B LEU 13.A O no hydrogen 2.742 N/A ARG 10.A NH2.A GLN 85.A O no hydrogen 3.057 N/A ARG 10.A NH2.A PRO 88.A O no hydrogen 2.850 N/A ASN 12.A N PRO 9.A O no hydrogen 3.092 N/A LEU 13.A N ARG 10.A O.A no hydrogen 3.100 N/A LEU 13.A N ARG 10.A O.B no hydrogen 3.141 N/A VAL 14.A N THR 31.A O no hydrogen 2.965 N/A GLY 16.A N LYS 29.A O no hydrogen 2.745 N/A LEU 19.A N VAL 27.A O no hydrogen 2.808 N/A GLY 20.A N VAL 27.A O no hydrogen 3.155 N/A GLY 22.A N GLY 25.A O no hydrogen 2.984 N/A GLY 25.A N GLY 22.A O no hydrogen 3.073 N/A LYS 26.A N MET 48.A O no hydrogen 2.954 N/A VAL 27.A N GLY 20.A O no hydrogen 2.818 N/A VAL 28.A N VAL 46.A O no hydrogen 2.875 N/A LYS 29.A N LYS 17.A O no hydrogen 2.902 N/A LYS 29.A NZ TYR 95.A OH no hydrogen 3.166 N/A ALA 30.A N VAL 44.A O no hydrogen 2.907 N/A THR 31.A N VAL 14.A O no hydrogen 2.937 N/A THR 31.A OG1 THR 42.A O no hydrogen 3.363 N/A ALA 32.A N THR 42.A O no hydrogen 2.910 N/A PHE 33.A N ASN 12.A O no hydrogen 2.745 N/A HIS 34.A N GLY 40.A O no hydrogen 2.906 N/A LYS 36.A NZ LYS 5.A O no hydrogen 2.787 N/A ARG 38.A N LEU 35.A O no hydrogen 2.862 N/A THR 42.A N ALA 32.A O no hydrogen 2.895 N/A VAL 44.A N ALA 30.A O no hydrogen 2.954 N/A ALA 45.A N VAL 93.A O no hydrogen 2.935 N/A VAL 46.A N VAL 28.A O no hydrogen 2.846 N/A LYS 47.A N LEU 91.A O no hydrogen 2.928 N/A LYS 47.A NZ GLU 64.A OE2 no hydrogen 2.608 N/A MET 48.A N LYS 26.A O no hydrogen 2.887 N/A SER 54.A N GLU 57.A OE1 no hydrogen 3.101 N/A SER 54.A OG SER 56.A OG no hydrogen 3.133 N/A SER 54.A OG GLU 57.A OE1 no hydrogen 2.761 N/A SER 56.A OG SER 54.A OG no hydrogen 3.133 N/A LEU 58.A N SER 54.A O no hydrogen 3.212 N/A ARG 59.A N PRO 55.A O no hydrogen 2.821 N/A ASP 60.A N SER 56.A O no hydrogen 2.876 N/A LEU 61.A N GLU 57.A O no hydrogen 2.982 N/A LEU 62.A N LEU 58.A O no hydrogen 2.950 N/A SER 63.A N ARG 59.A O no hydrogen 2.784 N/A GLU 64.A N ASP 60.A O no hydrogen 2.938 N/A PHE 65.A N LEU 61.A O no hydrogen 3.051 N/A ASN 66.A N LEU 62.A O no hydrogen 3.005 N/A VAL 67.A N SER 63.A O no hydrogen 2.909 N/A LEU 68.A N GLU 64.A O no hydrogen 2.833 N/A LYS 69.A N PHE 65.A O no hydrogen 3.033 N/A GLN 70.A N VAL 67.A O no hydrogen 2.976 N/A VAL 71.A N VAL 67.A O no hydrogen 3.118 N/A ASN 72.A N TYR 140.A OH no hydrogen 3.043 N/A HIS 75.A N HIS 73.A ND1 no hydrogen 3.178 N/A HIS 75.A ND1 MET 164.A O no hydrogen 2.859 N/A VAL 76.A N HIS 73.A O no hydrogen 3.088 N/A ILE 77.A N.A ILE 166.A O no hydrogen 2.907 N/A ILE 77.A N.B ILE 166.A O no hydrogen 2.923 N/A LYS 78.A N GLU 94.A OE1 no hydrogen 2.920 N/A TYR 80.A N ILE 92.A O no hydrogen 2.772 N/A GLY 81.A N ILE 92.A O no hydrogen 3.285 N/A ALA 82.A N TRP 6.A O no hydrogen 2.965 N/A CYS 83.A N LEU 90.A O no hydrogen 2.888 N/A CYS 83.A SG PHE 8.A O no hydrogen 3.422 N/A SER 84.A N GLU 7.A OE2 no hydrogen 2.889 N/A SER 84.A OG GLU 7.A OE1 no hydrogen 2.680 N/A SER 84.A OG GLU 7.A OE2 no hydrogen 3.466 N/A GLN 85.A NE2 SER 84.A OG no hydrogen 2.803 N/A LEU 90.A N CYS 83.A O no hydrogen 2.891 N/A LEU 91.A N LYS 47.A O no hydrogen 2.945 N/A ILE 92.A N GLY 81.A O no hydrogen 2.803 N/A VAL 93.A N ALA 45.A O no hydrogen 2.867 N/A GLU 94.A N LYS 78.A O no hydrogen 2.990 N/A TYR 98.A N VAL 158.A O no hydrogen 3.086 N/A TYR 98.A OH GLU 119.A OE1 no hydrogen 2.473 N/A GLY 99.A N ALA 96.A O no hydrogen 3.099 N/A LEU 101.A N ILE 156.A O no hydrogen 2.712 N/A ARG 102.A N ALA 153.A O no hydrogen 3.133 N/A ARG 102.A NH2 ASN 226.A OD1 no hydrogen 2.721 N/A GLY 103.A N SER 100.A OG no hydrogen 2.999 N/A PHE 104.A N SER 100.A O no hydrogen 2.846 N/A LEU 105.A N LEU 101.A O no hydrogen 2.868 N/A ARG 106.A N ARG 102.A O no hydrogen 2.934 N/A ARG 106.A NH1 GLY 224.A O no hydrogen 2.687 N/A GLU 107.A N GLY 103.A O no hydrogen 2.908 N/A SER 108.A N PHE 104.A O no hydrogen 3.129 N/A SER 108.A OG LEU 105.A O no hydrogen 2.637 N/A ARG 109.A N ARG 106.A O no hydrogen 3.307 N/A ARG 109.A NE LEU 223.A O no hydrogen 2.960 N/A ARG 109.A NH2 THR 222.A O no hydrogen 2.971 N/A ARG 109.A NH2 LEU 223.A O no hydrogen 3.175 N/A LYS 110.A N GLU 107.A O no hydrogen 2.921 N/A VAL 111.A N GLU 107.A O no hydrogen 2.800 N/A GLY 114.A N ARG 120.A O no hydrogen 3.018 N/A TYR 115.A OH ASN 251.A OD1 no hydrogen 2.565 N/A LEU 116.A N LEU 122.A O no hydrogen 2.708 N/A ARG 120.A NH1 GLU 107.A OE1 no hydrogen 2.954 N/A ALA 121.A N ASP 118.A O no hydrogen 3.129 N/A LEU 122.A N GLY 114.A O no hydrogen 2.914 N/A THR 123.A N ASP 126.A OD2 no hydrogen 2.964 N/A MET 124.A N GLY 117.A O no hydrogen 2.925 N/A ASP 126.A N THR 123.A OG1 no hydrogen 3.268 N/A LEU 127.A N THR 123.A O no hydrogen 3.191 N/A ILE 128.A N MET 124.A O no hydrogen 2.883 N/A SER 129.A N GLY 125.A O no hydrogen 2.941 N/A PHE 130.A N ASP 126.A O no hydrogen 2.913 N/A ALA 131.A N LEU 127.A O no hydrogen 3.075 N/A TRP 132.A N ILE 128.A O no hydrogen 2.894 N/A TRP 132.A NE1 GLU 282.A OE2 no hydrogen 2.821 N/A GLN 133.A N SER 129.A O no hydrogen 2.897 N/A GLN 133.A NE2 SER 129.A O no hydrogen 3.539 N/A GLN 133.A NE2 SER 129.A OG no hydrogen 3.097 N/A ILE 134.A N PHE 130.A O no hydrogen 3.108 N/A SER 135.A N ALA 131.A O no hydrogen 2.909 N/A SER 135.A OG SER 278.A OG no hydrogen 2.927 N/A GLN 136.A N TRP 132.A O no hydrogen 2.882 N/A GLN 136.A NE2 SER 278.A OG no hydrogen 2.926 N/A GLY 137.A N GLN 133.A O no hydrogen 3.085 N/A MET 138.A N ILE 134.A O no hydrogen 2.878 N/A GLN 139.A N SER 135.A O no hydrogen 2.813 N/A TYR 140.A N GLN 136.A O no hydrogen 3.208 N/A LEU 141.A N GLY 137.A O no hydrogen 2.990 N/A ALA 142.A N MET 138.A O no hydrogen 2.834 N/A GLU 143.A N GLN 139.A O no hydrogen 3.047 N/A MET 144.A N TYR 140.A O no hydrogen 2.943 N/A LYS 145.A N ALA 142.A O no hydrogen 3.004 N/A LYS 145.A NZ ASP 179.A OD1 no hydrogen 2.829 N/A LEU 146.A N LEU 141.A O no hydrogen 3.079 N/A VAL 147.A N.A ARG 173.A O no hydrogen 2.912 N/A VAL 147.A N.B ARG 173.A O no hydrogen 2.913 N/A HIS 148.A N ASP 209.A OD2 no hydrogen 2.836 N/A HIS 148.A NE2 SER 167.A O no hydrogen 2.830 N/A ARG 149.A N ASP 209.A OD1 no hydrogen 2.895 N/A ARG 149.A NH1 LEU 171.A O no hydrogen 2.814 N/A ASP 150.A N HIS 148.A ND1 no hydrogen 3.238 N/A ALA 153.A N GLU 219.A OE1 no hydrogen 2.872 N/A ARG 154.A NH2 ASP 150.A OD1 no hydrogen 3.107 N/A ASN 155.A N ALA 152.A O no hydrogen 2.938 N/A ASN 155.A ND2 ASP 150.A O no hydrogen 2.756 N/A ILE 156.A N ALA 153.A O no hydrogen 3.383 N/A LEU 157.A N LYS 165.A O no hydrogen 2.823 N/A VAL 158.A N GLY 99.A O no hydrogen 2.830 N/A ALA 159.A N LYS 163.A O no hydrogen 2.862 N/A ARG 162.A NH1 GLU 119.A O no hydrogen 2.992 N/A ARG 162.A NH1 ALA 121.A O no hydrogen 2.750 N/A LYS 163.A N ALA 159.A O no hydrogen 3.256 N/A MET 164.A N GLN 133.A OE1 no hydrogen 2.821 N/A LYS 165.A N LEU 157.A O no hydrogen 2.815 N/A LYS 165.A NZ PRO 74.A O no hydrogen 2.730 N/A LYS 165.A NZ GLU 94.A OE2 no hydrogen 3.214 N/A ILE 166.A N HIS 75.A O no hydrogen 2.788 N/A SER 167.A N ASN 155.A O no hydrogen 2.975 N/A SER 167.A OG ASN 155.A O no hydrogen 2.915 N/A PHE 169.A N GLU 64.A OE1 no hydrogen 2.802 N/A SER 172.A N.A PHE 169.A O no hydrogen 3.078 N/A SER 172.A N.B PHE 169.A O no hydrogen 3.082 N/A SER 172.A OG.A PHE 169.A O no hydrogen 2.790 N/A SER 172.A OG.B HIS 148.A O no hydrogen 3.049 N/A SER 172.A OG.B PHE 169.A O no hydrogen 3.444 N/A ARG 173.A N VAL 147.A O.A no hydrogen 2.917 N/A ARG 173.A N VAL 147.A O.B no hydrogen 2.933 N/A ARG 173.A NH1 GLY 170.A O no hydrogen 3.086 N/A ARG 173.A NH1 SER 172.A O.A no hydrogen 2.681 N/A ARG 173.A NH1 SER 172.A O.B no hydrogen 2.658 N/A ARG 173.A NH2 ASP 60.A OD1 no hydrogen 3.498 N/A VAL 175.A N LYS 145.A O no hydrogen 2.839 N/A TYR 176.A N ASP 174.A OD1 no hydrogen 2.921 N/A ASP 179.A N VAL 175.A O no hydrogen 2.915 N/A TYR 181.A N TYR 204.A O no hydrogen 2.776 N/A LYS 183.A NZ SER 185.A OG no hydrogen 2.918 N/A LYS 183.A NZ GLN 186.A O no hydrogen 2.815 N/A ARG 188.A NH1 ASP 60.A OD2 no hydrogen 3.098 N/A ARG 188.A NH2 ASP 60.A OD1 no hydrogen 3.436 N/A ARG 188.A NH2 ASP 60.A OD2 no hydrogen 2.729 N/A LYS 192.A NZ PRO 227.A O no hydrogen 3.315 N/A LYS 192.A NZ TYR 228.A O no hydrogen 2.910 N/A LYS 192.A NZ ILE 231.A O no hydrogen 2.827 N/A TRP 193.A N PRO 190.A O no hydrogen 3.170 N/A TRP 193.A NE1 GLU 219.A OE1 no hydrogen 2.869 N/A MET 194.A N VAL 191.A O no hydrogen 3.053 N/A GLU 197.A N GLU 197.A OE1 no hydrogen 2.765 N/A SER 198.A OG ILE 203.A O no hydrogen 2.767 N/A LEU 199.A N ALA 195.A O no hydrogen 2.974 N/A PHE 200.A N ILE 196.A O no hydrogen 2.940 N/A ASP 201.A N GLU 197.A O no hydrogen 2.896 N/A HIS 202.A N SER 198.A O no hydrogen 3.016 N/A HIS 202.A ND1 LYS 183.A O no hydrogen 2.839 N/A ILE 203.A N GLU 197.A O no hydrogen 3.354 N/A TYR 204.A N TYR 181.A O no hydrogen 2.862 N/A THR 205.A N SER 208.A OG no hydrogen 2.831 N/A GLN 207.A NE2 PRO 268.A O no hydrogen 3.335 N/A GLN 207.A NE2 PRO 272.A O no hydrogen 3.079 N/A SER 208.A N THR 205.A O no hydrogen 3.030 N/A SER 208.A N THR 205.A OG1 no hydrogen 3.251 N/A SER 208.A OG THR 205.A O no hydrogen 2.791 N/A ASP 209.A N THR 205.A O no hydrogen 3.140 N/A VAL 210.A N THR 206.A O no hydrogen 2.922 N/A TRP 211.A N GLN 207.A O no hydrogen 3.219 N/A SER 212.A N SER 208.A O no hydrogen 3.130 N/A SER 212.A OG TRP 193.A O no hydrogen 2.703 N/A SER 212.A OG SER 208.A O no hydrogen 3.315 N/A PHE 213.A N ASP 209.A O no hydrogen 2.787 N/A GLY 214.A N VAL 210.A O no hydrogen 2.993 N/A VAL 215.A N TRP 211.A O no hydrogen 3.190 N/A LEU 216.A N SER 212.A O no hydrogen 2.863 N/A LEU 217.A N PHE 213.A O no hydrogen 2.798 N/A TRP 218.A N GLY 214.A O no hydrogen 3.117 N/A GLU 219.A N VAL 215.A O no hydrogen 2.899 N/A ILE 220.A N LEU 216.A O no hydrogen 2.829 N/A VAL 221.A N LEU 217.A O no hydrogen 2.995 N/A THR 222.A N TRP 218.A O no hydrogen 3.108 N/A THR 222.A OG1 TRP 218.A O no hydrogen 2.825 N/A THR 222.A OG1 GLU 219.A O no hydrogen 3.205 N/A LEU 223.A N ILE 220.A O no hydrogen 2.952 N/A GLY 224.A N GLU 219.A O no hydrogen 2.764 N/A GLY 225.A N THR 222.A OG1 no hydrogen 2.950 N/A ILE 231.A N TYR 228.A O no hydrogen 3.033 N/A GLU 234.A N GLU 234.A OE1 no hydrogen 2.825 N/A ARG 235.A N PRO 232.A O no hydrogen 2.995 N/A LEU 236.A N PRO 233.A O no hydrogen 2.999 N/A LEU 239.A N ARG 235.A O no hydrogen 2.981 N/A LEU 240.A N LEU 236.A O no hydrogen 2.893 N/A LYS 241.A N PHE 237.A O no hydrogen 3.106 N/A THR 242.A N ASN 238.A O no hydrogen 3.051 N/A THR 242.A OG1 ASN 238.A O no hydrogen 2.831 N/A THR 242.A OG1 LEU 239.A O no hydrogen 3.122 N/A THR 242.A OG1 HIS 244.A ND1 no hydrogen 2.887 N/A GLY 243.A N LEU 240.A O no hydrogen 3.036 N/A HIS 244.A N LEU 239.A O no hydrogen 3.083 N/A HIS 244.A ND1 THR 242.A OG1 no hydrogen 2.887 N/A ARG 245.A NE TRP 264.A O no hydrogen 2.806 N/A ARG 245.A NH1 LEU 240.A O no hydrogen 3.017 N/A ARG 245.A NH1 HIS 244.A O no hydrogen 2.895 N/A ARG 245.A NH2 TRP 264.A O no hydrogen 2.978 N/A ARG 248.A NE CYS 252.A O no hydrogen 2.792 N/A ARG 248.A NH2 CYS 252.A O no hydrogen 2.947 N/A ASN 251.A ND2 VAL 221.A O no hydrogen 2.896 N/A CYS 252.A SG SER 253.A O no hydrogen 3.518 N/A MET 256.A N SER 253.A OG no hydrogen 3.019 N/A TYR 257.A N SER 253.A O no hydrogen 3.006 N/A TYR 257.A OH MET 246.A O no hydrogen 2.661 N/A ARG 258.A N GLU 254.A O no hydrogen 2.860 N/A LEU 259.A N GLU 255.A O no hydrogen 3.146 N/A MET 260.A N MET 256.A O no hydrogen 3.116 N/A LEU 261.A N TYR 257.A O no hydrogen 2.878 N/A GLN 262.A N.A ARG 258.A O no hydrogen 2.908 N/A GLN 262.A N.B ARG 258.A O no hydrogen 2.925 N/A GLN 262.A NE2.A ARG 258.A O no hydrogen 3.604 N/A GLN 262.A NE2.B LYS 270.A O no hydrogen 2.800 N/A CYS 263.A N LEU 259.A O no hydrogen 2.991 N/A CYS 263.A SG LEU 259.A O no hydrogen 3.358 N/A TRP 264.A N MET 260.A O no hydrogen 3.115 N/A TRP 264.A N LEU 261.A O no hydrogen 3.177 N/A LYS 265.A N GLN 262.A O.A no hydrogen 3.372 N/A LYS 265.A N GLN 262.A O.B no hydrogen 3.411 N/A ASP 269.A N GLU 267.A OE2 no hydrogen 3.026 N/A LYS 270.A N GLU 267.A O no hydrogen 3.061 N/A ARG 271.A N PRO 268.A O no hydrogen 3.170 N/A ARG 271.A NE LYS 265.A O no hydrogen 2.817 N/A ARG 271.A NH1 GLU 197.A OE1 no hydrogen 3.372 N/A ARG 271.A NH1 GLU 197.A OE2 no hydrogen 2.746 N/A ARG 271.A NH1 GLN 207.A O no hydrogen 2.928 N/A ARG 271.A NH2 GLU 197.A OE1 no hydrogen 2.750 N/A ARG 271.A NH2 LYS 265.A O no hydrogen 2.957 N/A ILE 277.A N VAL 273.A O no hydrogen 2.966 N/A SER 278.A N PHE 274.A O no hydrogen 2.885 N/A SER 278.A OG SER 135.A OG no hydrogen 2.927 N/A SER 278.A OG GLN 139.A OE1 no hydrogen 3.466 N/A SER 278.A OG PHE 274.A O no hydrogen 3.228 N/A LYS 279.A N ALA 275.A O no hydrogen 3.174 N/A LYS 279.A NZ ASP 276.A OD1 no hydrogen 3.348 N/A ASP 280.A N ASP 276.A O no hydrogen 2.836 N/A LEU 281.A N ILE 277.A O no hydrogen 2.939 N/A GLU 282.A N SER 278.A O no hydrogen 2.939 N/A LYS 283.A N LYS 279.A O no hydrogen 2.981 N/A MET 284.A N ASP 280.A O no hydrogen 3.146 N/A MET 285.A N LEU 281.A O no hydrogen 3.077 N/A VAL 286.A N GLU 282.A O no hydrogen 3.146 N/A LYS 287.A N LYS 283.A O no hydrogen 3.306 N/A