Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3r9w_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A N GLU 52.A O no hydrogen 3.086 N/A LYS 3.A NZ LEU 171.A O no hydrogen 2.667 N/A VAL 4.A N PRO 175.A O no hydrogen 2.842 N/A TYR 6.A N ASP 88.A OD2 no hydrogen 2.833 N/A VAL 7.A N ILE 56.A O no hydrogen 2.924 N/A ALA 8.A N VAL 89.A O no hydrogen 3.041 N/A ILE 9.A N LEU 58.A O no hydrogen 2.834 N/A VAL 10.A N LEU 91.A O no hydrogen 2.949 N/A LYS 12.A NZ GLU 98.A OE1 no hydrogen 2.664 N/A LYS 12.A NZ ASP 104.A OD1 no hydrogen 3.512 N/A LYS 12.A NZ ASP 104.A OD2 no hydrogen 2.802 N/A ASN 14.A ND2 PRO 34.A O no hydrogen 3.357 N/A LYS 17.A NZ LYS 12.A O no hydrogen 2.917 N/A SER 18.A OG SER 30.A OG no hydrogen 3.054 N/A SER 18.A OG THR 39.A OG1 no hydrogen 2.812 N/A SER 18.A OG ASP 59.A OD1 no hydrogen 3.493 N/A SER 18.A OG ASP 59.A OD2 no hydrogen 2.398 N/A LEU 20.A N GLY 16.A O no hydrogen 3.059 N/A LEU 21.A N LYS 17.A O no hydrogen 3.168 N/A ASN 22.A N SER 18.A O no hydrogen 3.007 N/A ASN 22.A ND2 SER 30.A O no hydrogen 2.931 N/A ASN 23.A N THR 19.A O no hydrogen 3.134 N/A ASN 23.A ND2 THR 19.A O no hydrogen 3.058 N/A LEU 24.A N LEU 20.A O no hydrogen 2.849 N/A LEU 25.A N LEU 21.A O no hydrogen 2.991 N/A LEU 25.A N ASN 22.A O no hydrogen 3.235 N/A GLY 26.A N ASN 22.A O no hydrogen 2.765 N/A LYS 28.A NZ GLU 201.A OE1 no hydrogen 3.096 N/A LYS 28.A NZ GLU 201.A OE2 no hydrogen 3.233 N/A LYS 28.A NZ GLU 267.A OE2 no hydrogen 2.736 N/A VAL 29.A N ASN 22.A OD1 no hydrogen 3.047 N/A SER 30.A N ASN 22.A OD1 no hydrogen 3.143 N/A SER 30.A OG SER 18.A OG no hydrogen 3.054 N/A SER 30.A OG ASP 59.A OD2 no hydrogen 2.607 N/A ILE 32.A N GLU 201.A OE2 no hydrogen 2.977 N/A SER 33.A OG THR 38.A OG1 no hydrogen 2.624 N/A LYS 35.A N SER 33.A OG no hydrogen 3.245 N/A LYS 35.A NZ ALA 36.A O no hydrogen 3.408 N/A THR 38.A OG1 SER 33.A OG no hydrogen 2.624 N/A THR 38.A OG1 LYS 35.A O no hydrogen 3.063 N/A THR 39.A OG1 SER 18.A OG no hydrogen 2.812 N/A ARG 40.A NH1 ILE 215.A O no hydrogen 2.710 N/A ARG 40.A NH2 ILE 215.A O no hydrogen 3.437 N/A ARG 42.A NH1 GLU 86.A OE1 no hydrogen 2.865 N/A ARG 42.A NH2 ASP 188.A OD2 no hydrogen 3.247 N/A VAL 43.A N ASP 59.A O no hydrogen 3.055 N/A GLY 45.A N PHE 57.A O no hydrogen 2.877 N/A VAL 46.A N ILE 186.A O no hydrogen 2.808 N/A LYS 47.A N ILE 55.A O no hydrogen 2.695 N/A LYS 47.A NZ LEU 24.A O no hydrogen 2.868 N/A ILE 49.A N ALA 53.A O no hydrogen 2.857 N/A GLU 52.A N ILE 49.A O no hydrogen 2.865 N/A ALA 53.A N ILE 49.A O no hydrogen 3.131 N/A GLN 54.A N LYS 3.A O no hydrogen 2.840 N/A GLN 54.A NE2 ASN 48.A OD1 no hydrogen 2.951 N/A GLN 54.A NE2 PHE 181.A O no hydrogen 3.017 N/A ILE 55.A N LYS 47.A O no hydrogen 2.818 N/A ILE 56.A N GLY 5.A O no hydrogen 2.976 N/A PHE 57.A N GLY 45.A O no hydrogen 2.697 N/A LEU 58.A N VAL 7.A O no hydrogen 2.868 N/A ASP 59.A N VAL 43.A O no hydrogen 2.907 N/A THR 60.A OG1 ILE 9.A O no hydrogen 2.817 N/A ILE 63.A N GLY 11.A O no hydrogen 2.892 N/A TYR 64.A OH ASP 70.A OD2 no hydrogen 2.746 N/A ASP 70.A N LYS 67.A O no hydrogen 3.116 N/A VAL 71.A N SER 69.A O no hydrogen 2.746 N/A LEU 72.A N ARG 289.A O no hydrogen 3.157 N/A GLY 73.A N ASP 70.A OD1 no hydrogen 3.071 N/A HIS 74.A N ASP 70.A O no hydrogen 2.976 N/A SER 75.A N VAL 71.A O no hydrogen 2.960 N/A SER 75.A OG TYR 300.A O no hydrogen 2.726 N/A MET 76.A N LEU 72.A O no hydrogen 2.884 N/A VAL 77.A N GLY 73.A O no hydrogen 3.031 N/A GLU 78.A N HIS 74.A O no hydrogen 3.090 N/A ILE 79.A N SER 75.A O no hydrogen 3.017 N/A ALA 80.A N MET 76.A O no hydrogen 3.131 N/A LYS 81.A N VAL 77.A O no hydrogen 2.849 N/A GLN 82.A N GLU 78.A O no hydrogen 2.794 N/A SER 83.A N ILE 79.A O no hydrogen 3.068 N/A SER 83.A OG ILE 79.A O no hydrogen 3.286 N/A LEU 84.A N ALA 80.A O no hydrogen 3.082 N/A GLU 85.A N LYS 81.A O no hydrogen 3.126 N/A GLU 86.A N GLN 82.A O no hydrogen 3.225 N/A ALA 87.A N SER 83.A O no hydrogen 3.118 N/A ASP 88.A N TYR 6.A O no hydrogen 2.704 N/A VAL 89.A N TYR 6.A O no hydrogen 3.056 N/A ILE 90.A N PRO 118.A O no hydrogen 2.907 N/A LEU 91.A N ALA 8.A O no hydrogen 2.738 N/A PHE 92.A N ILE 120.A O no hydrogen 2.880 N/A MET 93.A N.A VAL 10.A O no hydrogen 2.863 N/A MET 93.A N.B VAL 10.A O no hydrogen 2.848 N/A ILE 94.A N VAL 122.A O no hydrogen 2.948 N/A ALA 96.A N ASN 124.A O no hydrogen 2.833 N/A THR 97.A N ASP 95.A OD1 no hydrogen 2.825 N/A THR 97.A OG1 ASP 95.A OD1 no hydrogen 2.661 N/A THR 97.A OG1 ASP 95.A OD2 no hydrogen 3.336 N/A GLU 98.A N ASP 95.A O no hydrogen 2.885 N/A GLY 99.A N ASP 95.A O no hydrogen 2.757 N/A TRP 100.A NE1 GLU 105.A OE1 no hydrogen 2.696 N/A ARG 101.A N ASP 104.A OD2 no hydrogen 2.897 N/A ARG 103.A NE GLU 106.A OE1 no hydrogen 2.743 N/A ARG 103.A NH2 GLU 106.A OE1 no hydrogen 3.419 N/A GLU 105.A N ARG 101.A O no hydrogen 2.931 N/A GLU 106.A N PRO 102.A O no hydrogen 2.877 N/A ILE 107.A N ARG 103.A O no hydrogen 2.960 N/A TYR 108.A N ASP 104.A O no hydrogen 2.849 N/A TYR 108.A OH GLU 148.A OE1 no hydrogen 2.520 N/A GLN 109.A N GLU 105.A O no hydrogen 2.771 N/A GLN 109.A NE2 GLU 105.A OE2 no hydrogen 2.737 N/A ASN 110.A N GLU 106.A O no hydrogen 2.710 N/A PHE 111.A N ILE 107.A O no hydrogen 2.879 N/A ILE 112.A N TYR 108.A O no hydrogen 3.136 N/A LYS 113.A N TYR 108.A O no hydrogen 2.881 N/A LEU 115.A N ILE 112.A O no hydrogen 3.071 N/A LYS 117.A NZ LEU 84.A O no hydrogen 2.795 N/A LYS 117.A NZ GLU 85.A O no hydrogen 2.754 N/A LYS 117.A NZ ALA 87.A O no hydrogen 2.804 N/A ILE 120.A N ILE 90.A O no hydrogen 2.669 N/A VAL 121.A N GLU 151.A O no hydrogen 2.871 N/A VAL 122.A N PHE 92.A O no hydrogen 2.764 N/A ILE 123.A N VAL 153.A O no hydrogen 2.952 N/A ASN 124.A N ILE 94.A O no hydrogen 2.876 N/A ASN 124.A ND2 VAL 15.A O no hydrogen 3.102 N/A LYS 125.A NZ ASN 14.A O no hydrogen 3.266 N/A ILE 126.A N ILE 155.A O no hydrogen 3.429 N/A LYS 128.A N LYS 125.A O no hydrogen 3.120 N/A ILE 129.A N ILE 126.A O no hydrogen 3.422 N/A ASN 134.A N PRO 131.A O no hydrogen 2.757 N/A ASN 134.A ND2 ILE 129.A O no hydrogen 2.811 N/A VAL 135.A N ALA 132.A O no hydrogen 3.107 N/A LEU 136.A N LYS 133.A O no hydrogen 3.260 N/A ILE 139.A N VAL 135.A O no hydrogen 3.129 N/A ASP 140.A N LEU 136.A O no hydrogen 2.931 N/A GLU 141.A N PRO 137.A O no hydrogen 2.872 N/A ILE 142.A N LEU 138.A O no hydrogen 3.044 N/A HIS 143.A N ILE 139.A O no hydrogen 3.033 N/A LYS 144.A N ASP 140.A O no hydrogen 2.897 N/A LYS 144.A NZ ASP 140.A OD1 no hydrogen 3.328 N/A LYS 145.A N GLU 141.A O no hydrogen 2.989 N/A HIS 146.A N ILE 142.A O no hydrogen 2.835 N/A HIS 146.A NE2 GLU 105.A OE1 no hydrogen 2.798 N/A LEU 149.A N HIS 146.A O no hydrogen 2.883 N/A VAL 153.A N VAL 121.A O no hydrogen 2.733 N/A ILE 155.A N ILE 123.A O no hydrogen 2.837 N/A SER 156.A N ALA 161.A O no hydrogen 3.183 N/A SER 156.A OG ASP 127.A OD1 no hydrogen 2.769 N/A ALA 157.A N ASN 124.A OD1 no hydrogen 2.760 N/A LYS 159.A N SER 156.A OG no hydrogen 3.300 N/A GLY 160.A N SER 156.A O no hydrogen 2.795 N/A ASN 162.A ND2.A PRO 154.A O no hydrogen 2.857 N/A ASN 162.A ND2.B PRO 154.A O no hydrogen 3.226 N/A LEU 163.A N GLY 160.A O no hydrogen 3.426 N/A GLU 165.A N ASP 164.A OD1 no hydrogen 2.786 N/A LEU 166.A N ASN 162.A O no hydrogen 3.232 N/A VAL 167.A N LEU 163.A O no hydrogen 2.971 N/A LYS 168.A N ASP 164.A O no hydrogen 2.907 N/A LYS 168.A NZ.A GLU 165.A OE1 no hydrogen 2.933 N/A THR 169.A N GLU 165.A O no hydrogen 2.978 N/A THR 169.A N LEU 166.A O no hydrogen 2.970 N/A THR 169.A OG1 GLU 165.A O no hydrogen 2.940 N/A ILE 170.A N LEU 166.A O no hydrogen 2.929 N/A LEU 171.A N VAL 167.A O no hydrogen 2.815 N/A LYS 172.A N THR 169.A O no hydrogen 3.043 N/A TYR 173.A N ILE 170.A O no hydrogen 2.932 N/A TYR 173.A OH GLU 151.A OE2 no hydrogen 2.683 N/A LEU 174.A N LEU 171.A O no hydrogen 3.428 N/A GLY 177.A N MET 2.A O no hydrogen 2.761 N/A LEU 180.A N GLN 54.A OE1 no hydrogen 3.032 N/A PHE 181.A N GLN 54.A OE1 no hydrogen 3.001 N/A MET 185.A N PRO 182.A O no hydrogen 2.903 N/A THR 187.A OG1 LEU 44.A O no hydrogen 2.732 N/A LEU 193.A N PRO 190.A O no hydrogen 2.964 N/A LEU 194.A N PRO 190.A O no hydrogen 2.939 N/A ALA 195.A N LEU 191.A O no hydrogen 2.915 N/A GLU 197.A N LEU 193.A O no hydrogen 2.857 N/A ILE 198.A N LEU 194.A O no hydrogen 2.867 N/A VAL 199.A N ALA 195.A O no hydrogen 3.077 N/A ARG 200.A N ALA 196.A O no hydrogen 2.748 N/A ARG 200.A NE GLU 197.A OE2 no hydrogen 3.194 N/A ARG 200.A NH1 THR 38.A O no hydrogen 3.104 N/A ARG 200.A NH2 THR 38.A O no hydrogen 2.871 N/A ARG 200.A NH2 GLU 197.A OE1 no hydrogen 3.266 N/A ARG 200.A NH2 GLU 197.A OE2 no hydrogen 3.147 N/A GLU 201.A N GLU 197.A O no hydrogen 2.870 N/A LYS 202.A N ILE 198.A O no hydrogen 3.258 N/A LYS 202.A N VAL 199.A O no hydrogen 3.133 N/A LYS 202.A NZ.A GLU 201.A OE1 no hydrogen 2.873 N/A LYS 202.A NZ.A GLU 267.A OE1 no hydrogen 2.807 N/A LYS 202.A NZ.B GLU 201.A OE1 no hydrogen 3.027 N/A LYS 202.A NZ.B GLU 267.A OE1 no hydrogen 2.885 N/A ALA 203.A N VAL 199.A O no hydrogen 3.107 N/A MET 204.A N ARG 200.A O no hydrogen 2.926 N/A MET 205.A N GLU 201.A O no hydrogen 3.110 N/A LEU 206.A N LYS 202.A O no hydrogen 3.202 N/A LEU 206.A N ALA 203.A O no hydrogen 3.334 N/A THR 207.A N MET 204.A O no hydrogen 3.401 N/A THR 207.A OG1 ALA 203.A O no hydrogen 2.928 N/A THR 207.A OG1 MET 204.A O no hydrogen 3.479 N/A ARG 208.A NH2 GLU 209.A OE2 no hydrogen 3.329 N/A GLU 210.A N GLU 210.A OE1 no hydrogen 2.711 N/A VAL 211.A N ARG 208.A O no hydrogen 3.151 N/A SER 214.A N VAL 211.A O no hydrogen 2.805 N/A SER 214.A OG GLU 210.A O no hydrogen 2.623 N/A ALA 216.A N ILE 239.A O no hydrogen 2.819 N/A VAL 217.A N TYR 300.A OH no hydrogen 3.364 N/A LYS 218.A N GLU 237.A O no hydrogen 3.013 N/A LYS 218.A NZ ILE 219.A O no hydrogen 3.091 N/A ASN 220.A N LYS 235.A O no hydrogen 2.845 N/A GLU 221.A N LYS 235.A O no hydrogen 3.262 N/A LYS 223.A N VAL 233.A O no hydrogen 3.010 N/A LYS 223.A NZ PRO 224.A O no hydrogen 2.734 N/A LYS 223.A NZ ASP 226.A OD1 no hydrogen 3.233 N/A GLY 225.A N MET 231.A O no hydrogen 2.647 N/A ASN 230.A N ASN 228.A OD1 no hydrogen 3.175 N/A ASN 230.A ND2 ASN 228.A OD1 no hydrogen 2.502 N/A LEU 232.A N PRO 275.A O no hydrogen 3.073 N/A VAL 233.A N LYS 223.A O no hydrogen 2.813 N/A ILE 234.A N TYR 277.A O no hydrogen 2.860 N/A LYS 235.A N GLU 221.A O no hydrogen 2.970 N/A LYS 235.A NZ ASN 220.A OD1 no hydrogen 3.275 N/A GLY 236.A N GLU 279.A O no hydrogen 2.993 N/A GLU 237.A N LYS 218.A O no hydrogen 2.896 N/A ILE 238.A N TRP 281.A O no hydrogen 2.952 N/A ILE 239.A N ALA 216.A O no hydrogen 2.635 N/A VAL 240.A N LYS 283.A O no hydrogen 3.058 N/A ARG 242.A NH2 GLU 210.A OE2 no hydrogen 2.997 N/A LEU 245.A N ARG 242.A O no hydrogen 2.998 N/A LYS 246.A N GLU 243.A O no hydrogen 3.013 N/A LYS 246.A NZ GLU 243.A OE1 no hydrogen 3.557 N/A ILE 249.A N LEU 245.A O no hydrogen 2.901 N/A ILE 250.A N LYS 246.A O no hydrogen 2.905 N/A GLY 251.A N PRO 247.A O no hydrogen 2.751 N/A GLY 254.A N GLY 251.A O no hydrogen 3.111 N/A GLN 255.A N LYS 252.A O no hydrogen 2.953 N/A GLN 255.A NE2 LYS 253.A O no hydrogen 2.904 N/A ARG 256.A N ILE 250.A O no hydrogen 3.224 N/A ARG 256.A NE ILE 248.A O no hydrogen 2.576 N/A ARG 256.A NH2 ILE 248.A O no hydrogen 2.906 N/A LEU 257.A N ILE 250.A O no hydrogen 3.192 N/A LYS 258.A N GLY 254.A O no hydrogen 2.886 N/A LYS 258.A NZ GLN 255.A OE1 no hydrogen 2.941 N/A GLU 259.A N GLN 255.A O no hydrogen 3.240 N/A ILE 260.A N ARG 256.A O no hydrogen 2.814 N/A GLY 261.A N LEU 257.A O no hydrogen 2.826 N/A LYS 262.A N LYS 258.A O no hydrogen 2.938 N/A ARG 263.A N GLU 259.A O no hydrogen 3.187 N/A ARG 263.A NE GLU 259.A OE2 no hydrogen 2.912 N/A ALA 264.A N ILE 260.A O no hydrogen 3.061 N/A ARG 265.A N GLY 261.A O no hydrogen 2.762 N/A ARG 265.A NH1 GLU 269.A OE2 no hydrogen 2.836 N/A GLN 266.A N LYS 262.A O no hydrogen 3.086 N/A GLU 267.A N ARG 263.A O no hydrogen 3.206 N/A LEU 268.A N ALA 264.A O no hydrogen 2.909 N/A GLU 269.A N ARG 265.A O no hydrogen 2.690 N/A LEU 270.A N GLN 266.A O no hydrogen 3.014 N/A ILE 271.A N GLU 267.A O no hydrogen 3.244 N/A LEU 272.A N LEU 268.A O no hydrogen 2.964 N/A ARG 274.A NH1 ASN 230.A O no hydrogen 2.856 N/A VAL 276.A N GLU 269.A OE2 no hydrogen 2.922 N/A TYR 277.A N LEU 232.A O no hydrogen 2.874 N/A GLU 279.A N ILE 234.A O no hydrogen 2.693 N/A TRP 281.A N GLY 236.A O no hydrogen 3.144 N/A TRP 281.A NE1 GLU 279.A OE2 no hydrogen 3.276 N/A LYS 283.A N ILE 238.A O no hydrogen 2.850 N/A LYS 283.A NZ GLU 237.A OE2 no hydrogen 3.160 N/A VAL 285.A N VAL 240.A O no hydrogen 3.050 N/A ASP 287.A N ASP 241.A O no hydrogen 3.187 N/A TRP 288.A NE1 SER 214.A O no hydrogen 2.807 N/A ARG 289.A NH2 ASP 241.A OD2 no hydrogen 2.897 N/A ARG 290.A N ASP 287.A O no hydrogen 3.150 N/A ARG 291.A N TRP 288.A O no hydrogen 2.964 N/A ARG 291.A NH1 PRO 286.A O no hydrogen 3.165 N/A VAL 295.A N ARG 291.A O no hydrogen 2.960 N/A ARG 296.A N PRO 292.A O no hydrogen 3.042 N/A LEU 297.A N GLU 293.A O no hydrogen 3.017 N/A PHE 298.A N TYR 294.A O no hydrogen 3.067 N/A GLY 299.A N ARG 296.A O no hydrogen 2.911 N/A TYR 300.A N VAL 295.A O no hydrogen 3.213 N/A