Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3w0s_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A N SER 5.A OG no hydrogen 3.034 N/A SER 5.A OG THR 2.A O no hydrogen 2.915 N/A VAL 6.A N THR 2.A O no hydrogen 2.909 N/A GLU 7.A N ALA 3.A O no hydrogen 3.119 N/A LYS 8.A N THR 4.A O no hydrogen 3.028 N/A PHE 9.A N SER 5.A O no hydrogen 2.784 N/A LEU 10.A N VAL 6.A O no hydrogen 2.819 N/A ILE 11.A N GLU 7.A O no hydrogen 2.592 N/A GLU 12.A N LYS 8.A O no hydrogen 3.046 N/A LYS 13.A N PHE 9.A O no hydrogen 3.266 N/A ASP 15.A N ILE 11.A O no hydrogen 2.279 N/A SER 16.A N PHE 14.A O no hydrogen 2.651 N/A SER 16.A OG SER 16.A O no hydrogen 2.311 N/A SER 18.A N ASP 35.A O no hydrogen 2.939 N/A MET 21.A N SER 33.A O no hydrogen 2.933 N/A LEU 23.A N ALA 31.A O no hydrogen 2.705 N/A SER 24.A N ALA 31.A O no hydrogen 3.245 N/A GLY 26.A N SER 29.A O no hydrogen 2.750 N/A ARG 30.A N VAL 45.A O no hydrogen 2.977 N/A ALA 31.A N SER 24.A O no hydrogen 2.991 N/A PHE 32.A N LEU 43.A O no hydrogen 2.798 N/A SER 33.A N MET 21.A O no hydrogen 2.790 N/A PHE 34.A N TYR 41.A O no hydrogen 3.065 N/A ASP 35.A N SER 18.A O no hydrogen 2.910 N/A VAL 36.A N ARG 39.A O no hydrogen 3.020 N/A ARG 39.A N VAL 36.A O no hydrogen 2.885 N/A TYR 41.A N PHE 34.A O no hydrogen 2.810 N/A VAL 42.A N SER 87.A O no hydrogen 2.841 N/A LEU 43.A N PHE 32.A O no hydrogen 2.724 N/A ARG 44.A N CYS 85.A O no hydrogen 2.902 N/A ARG 44.A NH1 ASP 55.A OD2 no hydrogen 3.070 N/A ARG 44.A NH2 ASP 55.A OD2 no hydrogen 2.653 N/A VAL 45.A N ARG 30.A O no hydrogen 2.923 N/A ASN 46.A N THR 83.A O no hydrogen 2.966 N/A TYR 53.A N ALA 49.A O no hydrogen 3.346 N/A LYS 54.A N ASP 50.A O no hydrogen 3.350 N/A LYS 54.A NZ PHE 131.A O no hydrogen 3.358 N/A LYS 54.A NZ SER 213.A O no hydrogen 2.886 N/A LYS 54.A NZ ALA 215.A O no hydrogen 2.781 N/A ASP 55.A N GLY 51.A O no hydrogen 2.843 N/A ARG 56.A N PHE 52.A O no hydrogen 3.061 N/A TYR 57.A N TYR 53.A O no hydrogen 2.918 N/A VAL 58.A N LYS 54.A O no hydrogen 2.906 N/A TYR 59.A N ASP 55.A O no hydrogen 3.094 N/A ARG 60.A N ARG 56.A O no hydrogen 3.065 N/A HIS 61.A N TYR 57.A O no hydrogen 2.966 N/A HIS 61.A ND1 TYR 57.A O no hydrogen 2.832 N/A PHE 62.A N VAL 58.A O no hydrogen 2.722 N/A ALA 63.A N TYR 59.A O no hydrogen 3.397 N/A SER 64.A N LEU 67.A O no hydrogen 2.906 N/A LEU 67.A N SER 64.A O no hydrogen 3.144 N/A LEU 67.A N SER 64.A OG no hydrogen 3.053 N/A LEU 73.A N ILE 86.A O no hydrogen 2.700 N/A ASP 74.A N ILE 86.A O no hydrogen 3.376 N/A GLY 76.A N TYR 84.A O no hydrogen 3.122 N/A PHE 78.A N LEU 82.A O no hydrogen 2.817 N/A SER 79.A N LEU 82.A O no hydrogen 3.175 N/A SER 79.A OG SER 81.A OG no hydrogen 3.396 N/A SER 81.A N SER 79.A OG no hydrogen 3.215 N/A SER 81.A OG SER 79.A OG no hydrogen 3.396 N/A LEU 82.A N SER 79.A O no hydrogen 3.452 N/A THR 83.A N ASN 46.A O no hydrogen 2.932 N/A TYR 84.A N GLY 76.A O no hydrogen 2.764 N/A TYR 84.A OH ASP 74.A OD1 no hydrogen 2.684 N/A CYS 85.A N ARG 44.A O no hydrogen 2.839 N/A CYS 85.A SG ASP 74.A O no hydrogen 4.026 N/A ILE 86.A N ASP 74.A O no hydrogen 2.833 N/A SER 87.A N VAL 42.A O no hydrogen 2.991 N/A ARG 88.A N GLU 71.A O no hydrogen 2.905 N/A ARG 88.A NE GLU 71.A OE1 no hydrogen 2.790 N/A ARG 88.A NH1 TYR 41.A OH no hydrogen 3.182 N/A ARG 89.A N GLY 40.A O no hydrogen 2.908 N/A ARG 89.A NH1 PHE 34.A O no hydrogen 3.311 N/A ARG 89.A NH1 ASP 35.A OD1 no hydrogen 3.010 N/A ARG 89.A NH1 TYR 41.A O no hydrogen 3.468 N/A ARG 89.A NH2 ASP 35.A OD1 no hydrogen 3.209 N/A VAL 93.A N THR 201.A O no hydrogen 2.963 N/A THR 94.A OG1 ASP 97.A OD2 no hydrogen 2.769 N/A LEU 95.A N SER 196.A O no hydrogen 3.222 N/A LEU 95.A N VAL 199.A O no hydrogen 2.934 N/A GLN 96.A N THR 94.A OG1 no hydrogen 3.197 N/A ASP 97.A N THR 94.A O no hydrogen 2.947 N/A LEU 98.A N THR 94.A O no hydrogen 3.069 N/A GLU 102.A N PRO 99.A O no hydrogen 2.827 N/A LEU 103.A N GLU 100.A O no hydrogen 3.182 N/A VAL 106.A N LEU 103.A O no hydrogen 2.828 N/A LEU 107.A N PRO 104.A O no hydrogen 3.426 N/A VAL 110.A N VAL 106.A O no hydrogen 2.860 N/A ALA 111.A N LEU 107.A O no hydrogen 2.865 N/A GLU 112.A N GLN 108.A O no hydrogen 2.812 N/A ALA 113.A N PRO 109.A O no hydrogen 2.962 N/A MET 114.A N VAL 110.A O no hydrogen 2.895 N/A ASP 115.A N ALA 111.A O no hydrogen 2.877 N/A ALA 116.A N GLU 112.A O no hydrogen 2.852 N/A ILE 117.A N ALA 113.A O no hydrogen 2.946 N/A ALA 118.A N MET 114.A O no hydrogen 3.093 N/A ALA 119.A N ASP 115.A O no hydrogen 2.916 N/A ALA 120.A N ILE 117.A O no hydrogen 3.187 N/A SER 123.A N ASP 121.A OD2 no hydrogen 2.963 N/A SER 123.A OG ASP 121.A OD2 no hydrogen 2.715 N/A THR 125.A N LEU 122.A O no hydrogen 2.893 N/A THR 125.A OG1 LEU 122.A O no hydrogen 2.711 N/A SER 126.A N GLY 135.A O no hydrogen 3.248 N/A PHE 128.A N TYR 139.A O no hydrogen 2.889 N/A GLY 129.A N PHE 217.A O no hydrogen 2.827 N/A PHE 131.A N ALA 215.A O no hydrogen 3.390 N/A GLY 132.A N ILE 136.A O no hydrogen 3.213 N/A GLY 135.A N GLY 132.A O no hydrogen 3.007 N/A GLY 137.A N SER 126.A O no hydrogen 2.731 N/A GLN 138.A N PRO 130.A O no hydrogen 2.935 N/A TYR 139.A N PHE 128.A O no hydrogen 2.874 N/A TRP 142.A N GLU 185.A OE2 no hydrogen 2.857 N/A TRP 142.A NE1 TYR 260.A OH no hydrogen 2.827 N/A ARG 143.A N GLU 185.A OE1 no hydrogen 3.106 N/A ASP 144.A N THR 141.A OG1 no hydrogen 2.927 N/A PHE 145.A N THR 141.A O no hydrogen 3.258 N/A ILE 146.A N TRP 142.A O no hydrogen 2.868 N/A CYS 147.A N ARG 143.A O no hydrogen 2.806 N/A CYS 147.A SG ARG 143.A O no hydrogen 3.437 N/A ALA 148.A N PHE 145.A O no hydrogen 3.259 N/A ALA 150.A N CYS 147.A O no hydrogen 3.019 N/A ASP 151.A N ALA 148.A O no hydrogen 2.919 N/A HIS 153.A N ASP 151.A OD2 no hydrogen 2.970 N/A VAL 154.A N ASP 151.A O no hydrogen 2.863 N/A TYR 155.A N ASP 151.A O no hydrogen 2.898 N/A TYR 155.A OH ASP 267.A OD1 no hydrogen 2.665 N/A HIS 156.A N TYR 270.A OH no hydrogen 2.985 N/A HIS 156.A ND1 PRO 152.A O no hydrogen 2.784 N/A TRP 157.A N TYR 155.A O no hydrogen 3.018 N/A TRP 157.A NE1 ILE 149.A O no hydrogen 2.879 N/A THR 159.A N HIS 156.A O no hydrogen 3.180 N/A THR 159.A OG1 HIS 156.A O no hydrogen 2.746 N/A VAL 160.A N TRP 157.A O no hydrogen 2.973 N/A MET 161.A N TRP 157.A O no hydrogen 2.901 N/A THR 164.A OG1 ASP 162.A OD1 no hydrogen 2.457 N/A THR 164.A OG1 ASP 162.A OD2 no hydrogen 2.444 N/A VAL 165.A N ASP 162.A O no hydrogen 3.243 N/A SER 166.A N ASP 162.A O no hydrogen 2.791 N/A SER 168.A OG GLN 285.A OE1 no hydrogen 2.966 N/A SER 168.A OG ASP 289.A OD1 no hydrogen 2.701 N/A SER 168.A OG ASP 289.A OD2 no hydrogen 3.278 N/A VAL 169.A N VAL 165.A O no hydrogen 2.989 N/A ALA 170.A N SER 166.A O no hydrogen 2.882 N/A GLN 171.A N ALA 167.A O no hydrogen 2.944 N/A ALA 172.A N SER 168.A O no hydrogen 3.029 N/A LEU 173.A N VAL 169.A O no hydrogen 2.852 N/A ASP 174.A N ALA 170.A O no hydrogen 2.954 N/A GLU 175.A N GLN 171.A O no hydrogen 3.245 N/A LEU 176.A N ALA 172.A O no hydrogen 2.898 N/A MET 177.A N LEU 173.A O no hydrogen 2.727 N/A LEU 178.A N ASP 174.A O no hydrogen 3.207 N/A TRP 179.A N GLU 175.A O no hydrogen 2.961 N/A ALA 180.A N LEU 176.A O no hydrogen 2.895 N/A GLU 181.A N LEU 178.A O no hydrogen 3.242 N/A ASP 182.A N TRP 179.A O no hydrogen 2.884 N/A CYS 183.A N ALA 180.A O no hydrogen 2.997 N/A CYS 183.A SG PRO 184.A O no hydrogen 3.599 N/A ARG 187.A NH1 LEU 122.A O no hydrogen 3.502 N/A ARG 187.A NH1 THR 125.A O no hydrogen 3.359 N/A ARG 187.A NH1 THR 125.A OG1 no hydrogen 3.262 N/A ARG 187.A NH2 THR 125.A OG1 no hydrogen 3.059 N/A ARG 187.A NH2 GLY 127.A O no hydrogen 2.994 N/A HIS 188.A N GLY 218.A O no hydrogen 2.790 N/A HIS 188.A ND1 ALA 118.A O no hydrogen 2.876 N/A VAL 190.A N MET 216.A O no hydrogen 2.864 N/A HIS 191.A N GLU 223.A OE1 no hydrogen 2.855 N/A HIS 191.A NE2 ILE 210.A O no hydrogen 2.814 N/A ALA 192.A N GLU 223.A OE2 no hydrogen 2.789 N/A ASP 193.A N HIS 191.A ND1 no hydrogen 3.033 N/A SER 196.A OG ASN 197.A OD1 no hydrogen 3.112 N/A ASN 198.A ND2 ASP 193.A O no hydrogen 2.903 N/A VAL 199.A N SER 196.A O no hydrogen 3.342 N/A LEU 200.A N ALA 208.A O no hydrogen 2.886 N/A THR 201.A N VAL 93.A O no hydrogen 2.797 N/A THR 201.A OG1 ARG 205.A O no hydrogen 2.805 N/A ASP 202.A N ARG 205.A O no hydrogen 2.911 N/A ARG 205.A N ASP 202.A O no hydrogen 2.996 N/A THR 207.A N LEU 200.A O no hydrogen 2.931 N/A THR 207.A OG1 GLN 91.A O no hydrogen 2.648 N/A VAL 209.A N PRO 68.A O no hydrogen 2.789 N/A ILE 210.A N ASN 198.A O no hydrogen 2.873 N/A TRP 212.A N ASP 55.A OD1 no hydrogen 2.718 N/A TRP 212.A NE1 VAL 209.A O no hydrogen 2.915 N/A SER 213.A N ASP 211.A OD2 no hydrogen 3.038 N/A SER 213.A OG ASP 211.A OD2 no hydrogen 3.197 N/A ALA 215.A N TRP 212.A O no hydrogen 3.022 N/A MET 216.A N VAL 190.A O no hydrogen 2.822 N/A PHE 217.A N GLY 129.A O no hydrogen 3.032 N/A GLY 218.A N HIS 188.A O no hydrogen 2.805 N/A GLN 221.A N ASP 219.A OD1 no hydrogen 2.943 N/A TYR 222.A N ASP 219.A O no hydrogen 2.868 N/A GLU 223.A N SER 220.A O no hydrogen 3.102 N/A ALA 225.A N GLN 221.A O no hydrogen 2.923 N/A ASN 226.A N TYR 222.A O no hydrogen 3.316 N/A ASN 226.A N GLU 223.A O no hydrogen 3.035 N/A PHE 228.A N VAL 224.A O no hydrogen 3.110 N/A PHE 229.A N ALA 225.A O no hydrogen 2.873 N/A TRP 230.A N ASN 226.A O no hydrogen 3.051 N/A ARG 231.A N PHE 228.A O no hydrogen 3.256 N/A ARG 231.A NE GLU 238.A OE1 no hydrogen 2.909 N/A ARG 231.A NH1 GLU 238.A OE1 no hydrogen 3.557 N/A ARG 231.A NH1 GLU 238.A OE2 no hydrogen 3.015 N/A ARG 231.A NH1 GLU 245.A OE2 no hydrogen 3.287 N/A ARG 231.A NH2 GLU 245.A OE1 no hydrogen 2.961 N/A TRP 233.A N TRP 230.A O no hydrogen 2.859 N/A CYS 236.A SG GLY 195.A O no hydrogen 3.463 N/A MET 237.A N LEU 234.A O no hydrogen 3.060 N/A GLU 238.A N LEU 234.A O no hydrogen 3.018 N/A GLN 239.A N ALA 235.A O no hydrogen 2.821 N/A GLN 240.A N CYS 236.A O no hydrogen 3.063 N/A THR 241.A N MET 237.A O no hydrogen 2.880 N/A THR 241.A OG1 MET 237.A O no hydrogen 2.828 N/A ARG 242.A N GLU 238.A O no hydrogen 2.918 N/A ARG 242.A NE GLU 238.A OE2 no hydrogen 2.533 N/A ARG 242.A NH1 GLU 238.A OE2 no hydrogen 3.131 N/A TYR 243.A N GLN 239.A O no hydrogen 3.038 N/A PHE 244.A N GLN 240.A O no hydrogen 2.993 N/A GLU 245.A N THR 241.A O no hydrogen 2.766 N/A ARG 246.A N ARG 242.A O no hydrogen 2.929 N/A ARG 247.A N TYR 243.A O no hydrogen 3.374 N/A ARG 247.A N PHE 244.A O no hydrogen 3.129 N/A ARG 247.A NH2 TYR 243.A O no hydrogen 3.436 N/A HIS 248.A N PHE 244.A O no hydrogen 2.869 N/A HIS 248.A N GLU 245.A O no hydrogen 3.342 N/A HIS 248.A ND1 PHE 244.A O no hydrogen 3.208 N/A LEU 251.A N HIS 248.A O no hydrogen 3.168 N/A SER 254.A N LEU 251.A O no hydrogen 3.067 N/A ARG 256.A NH1 ASP 219.A OD2 no hydrogen 2.815 N/A LEU 257.A N SER 254.A OG no hydrogen 3.064 N/A ARG 258.A N SER 254.A O no hydrogen 3.013 N/A ARG 258.A NE GLU 175.A OE1 no hydrogen 3.330 N/A ARG 258.A NH1 GLY 253.A O no hydrogen 2.766 N/A ALA 259.A N PRO 255.A O no hydrogen 2.934 N/A TYR 260.A N ARG 256.A O no hydrogen 2.918 N/A TYR 260.A OH ASP 219.A OD2 no hydrogen 2.623 N/A MET 261.A N LEU 257.A O no hydrogen 2.804 N/A LEU 262.A N ARG 258.A O no hydrogen 2.916 N/A ARG 263.A N ALA 259.A O no hydrogen 2.880 N/A ARG 263.A NE PHE 145.A O no hydrogen 3.276 N/A ARG 263.A NE ILE 146.A O no hydrogen 2.997 N/A ARG 263.A NH1 TYR 155.A OH no hydrogen 3.550 N/A ARG 263.A NH1 ARG 263.A O no hydrogen 3.357 N/A ARG 263.A NH2 PHE 145.A O no hydrogen 3.028 N/A ILE 264.A N TYR 260.A O no hydrogen 2.906 N/A GLY 265.A N MET 261.A O no hydrogen 2.806 N/A LEU 266.A N LEU 262.A O no hydrogen 2.811 N/A ASP 267.A N ARG 263.A O no hydrogen 3.291 N/A GLN 268.A N ILE 264.A O no hydrogen 2.918 N/A LEU 269.A N GLY 265.A O no hydrogen 2.754 N/A TYR 270.A N LEU 266.A O no hydrogen 2.811 N/A GLN 271.A N ASP 267.A O no hydrogen 2.825 N/A GLN 271.A NE2 ASP 275.A OD2 no hydrogen 3.079 N/A SER 272.A N GLN 268.A O no hydrogen 2.935 N/A SER 272.A OG GLN 268.A O no hydrogen 2.851 N/A LEU 273.A N LEU 269.A O no hydrogen 2.912 N/A VAL 274.A N TYR 270.A O no hydrogen 2.896 N/A ASP 275.A N GLN 271.A O no hydrogen 2.828 N/A GLY 276.A N LEU 273.A O no hydrogen 3.152 N/A ASN 277.A N SER 272.A O no hydrogen 2.805 N/A ALA 281.A N ASN 277.A O no hydrogen 2.912 N/A ALA 282.A N PHE 278.A O no hydrogen 2.961 N/A TRP 283.A N ASP 279.A O no hydrogen 3.006 N/A ALA 284.A N ASP 280.A O no hydrogen 2.978 N/A GLN 285.A N ALA 281.A O no hydrogen 2.892 N/A GLY 286.A N ALA 282.A O no hydrogen 2.952 N/A ARG 287.A N TRP 283.A O no hydrogen 2.885 N/A ARG 287.A NE PHE 229.A O no hydrogen 2.860 N/A ARG 287.A NH1 PHE 228.A O no hydrogen 2.856 N/A CYS 288.A N ALA 284.A O no hydrogen 2.860 N/A CYS 288.A SG ALA 284.A O no hydrogen 3.372 N/A ASP 289.A N GLN 285.A O no hydrogen 2.848 N/A ALA 290.A N GLY 286.A O no hydrogen 3.050 N/A ILE 291.A N ARG 287.A O no hydrogen 3.040 N/A VAL 292.A N CYS 288.A O no hydrogen 2.838 N/A ARG 293.A N ASP 289.A O no hydrogen 2.827 N/A SER 294.A N ALA 290.A O no hydrogen 2.981 N/A SER 294.A OG ILE 291.A O no hydrogen 2.692 N/A GLY 295.A N ILE 291.A O no hydrogen 3.278 N/A GLY 295.A N VAL 292.A O no hydrogen 3.040 N/A ALA 296.A N ARG 293.A O no hydrogen 3.221 N/A