Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3n6w_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 5.A OG1 SER 1.A O no hydrogen 3.193 N/A ILE 6.A N ARG 72.A O no hydrogen 2.882 N/A GLN 7.A N LEU 21.A O no hydrogen 2.804 N/A LYS 8.A N LEU 21.A O no hydrogen 3.138 N/A GLU 10.A N GLN 19.A O no hydrogen 3.062 N/A LEU 12.A N LEU 17.A O no hydrogen 2.826 N/A HIS 16.A N ASP 13.A O no hydrogen 3.121 N/A LEU 17.A N LEU 12.A O no hydrogen 3.112 N/A MET 18.A N TYR 30.A O no hydrogen 2.725 N/A GLN 19.A N GLU 10.A O no hydrogen 2.821 N/A ILE 20.A N SER 28.A O no hydrogen 2.765 N/A LEU 21.A N LYS 8.A O no hydrogen 2.752 N/A TRP 22.A N GLU 26.A O no hydrogen 2.934 N/A TRP 22.A NE1 SER 28.A OG no hydrogen 3.001 N/A TYR 23.A N THR 5.A O no hydrogen 2.977 N/A ASP 24.A N MET 2.A O no hydrogen 2.921 N/A GLU 25.A N TRP 22.A O no hydrogen 2.788 N/A SER 28.A N ILE 20.A O no hydrogen 2.897 N/A TYR 30.A N MET 18.A O no hydrogen 2.767 N/A TYR 30.A OH LEU 92.A O no hydrogen 2.641 N/A ALA 32.A N HIS 16.A O no hydrogen 2.827 N/A LEU 35.A N PRO 31.A O no hydrogen 3.123 N/A ARG 36.A N ALA 32.A O no hydrogen 2.943 N/A ARG 36.A NH1 ARG 36.A O no hydrogen 2.980 N/A ASP 37.A N VAL 33.A O no hydrogen 2.895 N/A ASN 38.A N TRP 34.A O no hydrogen 3.054 N/A ASN 38.A N LEU 35.A O no hydrogen 3.228 N/A ASN 38.A ND2 TRP 34.A O no hydrogen 2.931 N/A CYS 39.A N ARG 36.A O no hydrogen 3.325 N/A CYS 39.A SG HIS 83.A NE2 no hydrogen 3.575 N/A CYS 39.A SG TYR 84.A O no hydrogen 3.906 N/A CYS 39.A SG SER 85.A OG no hydrogen 3.127 N/A CYS 41.A SG HIS 83.A NE2 no hydrogen 3.466 N/A CYS 44.A N CYS 41.A O no hydrogen 3.063 N/A CYS 44.A SG HIS 83.A NE2 no hydrogen 3.267 N/A LEU 46.A N ALA 51.A O no hydrogen 2.791 N/A LYS 50.A N ASP 47.A O no hydrogen 3.105 N/A ALA 51.A N LEU 46.A O no hydrogen 3.163 N/A ARG 52.A NE ASP 37.A O no hydrogen 3.038 N/A ARG 52.A NH2 ASN 38.A OD1 no hydrogen 2.734 N/A LYS 53.A N CYS 44.A O no hydrogen 2.818 N/A LYS 53.A NZ SER 42.A O no hydrogen 2.772 N/A LEU 54.A N CYS 44.A O no hydrogen 3.269 N/A ALA 58.A N LEU 55.A O no hydrogen 2.967 N/A LEU 59.A N VAL 56.A O no hydrogen 2.982 N/A ASN 62.A N ASP 60.A OD1 no hydrogen 3.002 N/A ILE 63.A N ASP 60.A O no hydrogen 3.103 N/A ILE 65.A N ALA 15.A O no hydrogen 2.809 N/A LYS 66.A N THR 78.A O no hydrogen 2.936 N/A LYS 66.A NZ GLU 82.A OE2 no hydrogen 2.667 N/A GLY 67.A N THR 78.A O no hydrogen 3.077 N/A ILE 69.A N TYR 76.A O no hydrogen 2.907 N/A ASP 71.A N LYS 74.A O no hydrogen 3.087 N/A LYS 73.A N ASP 71.A OD2 no hydrogen 2.962 N/A LYS 74.A N ASP 71.A OD2 no hydrogen 2.877 N/A LYS 74.A NZ GLN 88.A OE1 no hydrogen 2.957 N/A VAL 75.A N PHE 87.A O no hydrogen 2.954 N/A TYR 76.A N ILE 69.A O no hydrogen 2.753 N/A TYR 76.A OH ASP 71.A OD1 no hydrogen 2.538 N/A ILE 77.A N SER 85.A O no hydrogen 2.757 N/A THR 78.A N GLY 67.A O no hydrogen 2.815 N/A TRP 79.A N HIS 83.A O no hydrogen 2.795 N/A TRP 79.A NE1 SER 85.A OG no hydrogen 2.814 N/A GLU 82.A N TRP 79.A O no hydrogen 2.867 N/A HIS 83.A N ASP 81.A OD1 no hydrogen 3.003 N/A TYR 84.A OH GLU 86.A OE1 no hydrogen 3.096 N/A SER 85.A N ILE 77.A O no hydrogen 2.838 N/A PHE 87.A N VAL 75.A O no hydrogen 2.941 N/A GLN 88.A NE2 LYS 73.A O no hydrogen 3.691 N/A ALA 89.A N LYS 73.A O no hydrogen 2.753 N/A LEU 92.A N GLN 88.A O no hydrogen 3.078 N/A LYS 93.A N ALA 89.A O no hydrogen 2.894 N/A LYS 93.A NZ ALA 3.A O no hydrogen 2.920 N/A LYS 93.A NZ GLU 26.A OE1 no hydrogen 2.897 N/A LYS 94.A N ASP 90.A O no hydrogen 3.101 N/A ARG 95.A N TRP 91.A O no hydrogen 3.326 N/A ARG 95.A NH1 TRP 91.A O no hydrogen 3.221 N/A CYS 96.A N LYS 93.A O no hydrogen 3.375 N/A CYS 96.A SG SER 28.A OG no hydrogen 3.148 N/A CYS 96.A SG SER 98.A OG no hydrogen 3.681 N/A ALA 101.A N SER 98.A OG no hydrogen 3.100 N/A ARG 102.A N SER 98.A O no hydrogen 2.942 N/A ARG 102.A NE PHE 97.A O no hydrogen 2.837 N/A ALA 103.A N LYS 99.A O no hydrogen 2.982 N/A LYS 104.A N GLN 100.A O no hydrogen 3.056 N/A LYS 104.A NZ GLU 108.A OE2 no hydrogen 3.248 N/A LEU 105.A N ALA 101.A O no hydrogen 3.036 N/A GLN 106.A N ARG 102.A O no hydrogen 2.975 N/A ARG 107.A N ALA 103.A O no hydrogen 3.065 N/A GLU 108.A N LYS 104.A O no hydrogen 3.144 N/A LEU 109.A N LEU 105.A O no hydrogen 3.016 N/A PHE 110.A N GLN 106.A O no hydrogen 2.884 N/A PHE 111.A N ARG 107.A O no hydrogen 2.901 N/A CYS 114.A SG LYS 147.A O no hydrogen 4.016 N/A GLN 115.A N LYS 147.A O no hydrogen 2.939 N/A TRP 117.A N ASP 217.A OD2 no hydrogen 3.070 N/A TRP 117.A NE1 VAL 148.A O no hydrogen 2.760 N/A GLY 118.A N GLU 120.A OE2 no hydrogen 2.927 N/A SER 119.A N GLU 309.A O no hydrogen 3.061 N/A SER 119.A OG LYS 308.A O no hydrogen 3.306 N/A SER 119.A OG GLU 309.A O no hydrogen 3.482 N/A GLU 120.A N GLU 120.A OE1 no hydrogen 2.816 N/A LEU 121.A N GLY 118.A O no hydrogen 3.205 N/A GLN 122.A NE2 GLU 120.A O no hydrogen 3.300 N/A THR 125.A OG1 LEU 123.A O no hydrogen 2.830 N/A LEU 126.A N ARG 152.A O no hydrogen 3.077 N/A PHE 128.A N THR 154.A O no hydrogen 2.852 N/A ASP 130.A N ASP 127.A OD2 no hydrogen 3.081 N/A VAL 131.A N ASP 127.A O no hydrogen 3.136 N/A LEU 132.A N PHE 128.A O no hydrogen 2.949 N/A ARG 133.A N GLU 129.A O no hydrogen 2.920 N/A ARG 133.A N ASP 130.A O no hydrogen 3.252 N/A TYR 134.A N ASP 130.A O no hydrogen 2.921 N/A ALA 138.A N TYR 134.A O no hydrogen 2.969 N/A TYR 139.A N ASP 135.A O no hydrogen 2.762 N/A LYS 140.A N GLU 136.A O no hydrogen 3.083 N/A TRP 141.A N HIS 137.A O no hydrogen 2.920 N/A LEU 142.A N ALA 138.A O no hydrogen 3.016 N/A SER 143.A N TYR 139.A O no hydrogen 2.911 N/A SER 143.A OG TYR 139.A O no hydrogen 2.975 N/A SER 143.A OG LYS 140.A O no hydrogen 3.261 N/A THR 144.A N LYS 140.A O no hydrogen 2.987 N/A THR 144.A OG1 LYS 140.A O no hydrogen 2.646 N/A LEU 145.A N TRP 141.A O no hydrogen 3.014 N/A LYS 146.A N LEU 142.A O no hydrogen 2.985 N/A LYS 146.A NZ PHE 111.A O no hydrogen 2.996 N/A LYS 147.A N SER 143.A O no hydrogen 2.955 N/A LYS 147.A NZ GLN 115.A OE1 no hydrogen 3.352 N/A VAL 148.A N THR 144.A O no hydrogen 2.765 N/A GLY 149.A N LEU 145.A O no hydrogen 2.780 N/A VAL 151.A N THR 323.A O no hydrogen 3.009 N/A ARG 152.A N PRO 124.A O no hydrogen 2.875 N/A ARG 152.A NE THR 125.A OG1 no hydrogen 3.031 N/A ARG 152.A NH2 THR 125.A OG1 no hydrogen 2.896 N/A LEU 153.A N VAL 321.A O no hydrogen 2.716 N/A THR 154.A N LEU 126.A O no hydrogen 3.070 N/A ALA 156.A N GLY 319.A O no hydrogen 3.034 N/A SER 157.A N GLU 162.A OE1 no hydrogen 2.859 N/A LYS 159.A N SER 157.A OG no hydrogen 3.198 N/A GLY 161.A N GLU 338.A OE1 no hydrogen 2.902 N/A VAL 163.A N GLU 338.A OE2 no hydrogen 3.324 N/A LYS 165.A N GLY 161.A O no hydrogen 2.855 N/A LYS 165.A NZ GLU 162.A OE2 no hydrogen 2.745 N/A LEU 166.A N GLU 162.A O no hydrogen 2.822 N/A GLY 167.A N VAL 163.A O no hydrogen 2.850 N/A LYS 168.A N SER 164.A O no hydrogen 2.934 N/A ARG 169.A N LYS 165.A O no hydrogen 3.097 N/A ARG 169.A NH1 LEU 132.A O no hydrogen 2.814 N/A MET 170.A N LEU 166.A O no hydrogen 2.997 N/A GLY 171.A N LYS 168.A O no hydrogen 3.066 N/A PHE 172.A N GLY 167.A O no hydrogen 2.854 N/A TYR 174.A OH VAL 163.A O no hydrogen 2.822 N/A LEU 175.A N TYR 341.A O no hydrogen 2.835 N/A PHE 177.A N HIS 180.A O no hydrogen 3.183 N/A GLY 179.A N ASP 249.A OD2 no hydrogen 2.821 N/A HIS 180.A N PHE 177.A O no hydrogen 2.761 N/A HIS 180.A ND1 HIS 180.A O no hydrogen 2.945 N/A THR 181.A OG1 ASP 249.A OD2 no hydrogen 2.740 N/A GLN 185.A N GLY 339.A O no hydrogen 2.928 N/A LYS 187.A N LEU 337.A O no hydrogen 3.033 N/A LYS 187.A NZ TYR 341.A OH no hydrogen 2.947 N/A HIS 191.A N HIS 331.A O no hydrogen 2.998 N/A HIS 191.A ND1 SER 189.A O no hydrogen 2.884 N/A THR 192.A N PHE 275.A O no hydrogen 2.770 N/A THR 192.A OG1 PHE 275.A O no hydrogen 3.369 N/A ASP 193.A N ASN 326.A OD1 no hydrogen 2.787 N/A LEU 197.A N TYR 194.A O no hydrogen 3.246 N/A HIS 199.A NE2 ASP 343.A OD1 no hydrogen 2.988 N/A VAL 203.A N ALA 342.A O no hydrogen 2.952 N/A GLN 204.A N PHE 324.A O no hydrogen 2.931 N/A LEU 205.A N ALA 340.A O no hydrogen 2.816 N/A LEU 206.A N ILE 322.A O no hydrogen 2.764 N/A HIS 207.A N GLU 338.A O no hydrogen 2.820 N/A HIS 207.A ND1 ASP 320.A O no hydrogen 3.072 N/A HIS 207.A NE2 LYS 159.A O no hydrogen 3.212 N/A CYS 208.A N ASP 320.A O no hydrogen 2.982 N/A CYS 208.A SG MET 316.A O no hydrogen 3.871 N/A ILE 209.A N HIS 336.A O no hydrogen 2.888 N/A LYS 210.A N HIS 336.A O no hydrogen 3.207 N/A SER 213.A N PHE 314.A O no hydrogen 3.024 N/A GLU 214.A N GLY 332.A O no hydrogen 2.943 N/A ILE 215.A N PHE 312.A O no hydrogen 2.867 N/A VAL 216.A N LEU 330.A O no hydrogen 3.018 N/A PHE 219.A N ASP 217.A OD1 no hydrogen 3.168 N/A ASN 220.A N ASP 217.A OD1 no hydrogen 3.443 N/A ASN 220.A ND2 TRP 117.A O no hydrogen 2.889 N/A VAL 221.A N ASP 217.A O no hydrogen 2.952 N/A CYS 222.A N GLY 218.A O no hydrogen 2.975 N/A CYS 222.A SG GLY 218.A O no hydrogen 3.230 N/A GLN 223.A N PHE 219.A O no hydrogen 3.041 N/A LYS 224.A N ASN 220.A O no hydrogen 3.033 N/A LEU 225.A N VAL 221.A O no hydrogen 2.837 N/A LYS 226.A N CYS 222.A O no hydrogen 2.872 N/A LYS 227.A N GLN 223.A O no hydrogen 3.290 N/A ASN 228.A N LYS 224.A O no hydrogen 2.899 N/A ASN 229.A N LEU 225.A O no hydrogen 2.772 N/A PHE 233.A N ASN 229.A O no hydrogen 3.080 N/A GLN 234.A N PRO 230.A O no hydrogen 2.926 N/A ILE 235.A N GLN 231.A O no hydrogen 2.919 N/A LEU 236.A N ALA 232.A O no hydrogen 2.948 N/A SER 237.A N PHE 233.A O no hydrogen 2.933 N/A SER 237.A OG PHE 233.A O no hydrogen 2.673 N/A SER 237.A OG GLN 234.A O no hydrogen 3.353 N/A SER 238.A N ILE 235.A O no hydrogen 3.173 N/A SER 238.A OG GLN 234.A O no hydrogen 2.664 N/A SER 238.A OG ILE 235.A O no hydrogen 3.519 N/A THR 239.A N ILE 235.A O no hydrogen 2.978 N/A THR 239.A OG1 ILE 235.A O no hydrogen 2.687 N/A VAL 241.A N HIS 259.A O no hydrogen 2.726 N/A PHE 243.A N SER 257.A O no hydrogen 2.792 N/A THR 244.A N THR 279.A O no hydrogen 2.878 N/A THR 244.A OG1.A ASP 281.A OD2 no hydrogen 2.770 N/A ASP 245.A N VAL 255.A O no hydrogen 2.760 N/A GLY 247.A N PHE 253.A O no hydrogen 3.134 N/A ASP 249.A N CYS 251.A O no hydrogen 2.897 N/A CYS 251.A SG TYR 178.A OH no hydrogen 3.796 N/A CYS 251.A SG ASP 252.A O no hydrogen 3.499 N/A PHE 253.A N GLY 247.A O no hydrogen 2.874 N/A VAL 255.A N ASP 245.A O no hydrogen 2.779 N/A SER 257.A N PHE 243.A O no hydrogen 3.024 N/A SER 257.A OG.A ALA 196.A O no hydrogen 2.687 N/A SER 257.A OG.A HIS 198.A ND1.A no hydrogen 2.466 N/A SER 257.A OG.B PRO 195.A O no hydrogen 3.087 N/A SER 257.A OG.B ALA 196.A O no hydrogen 2.829 N/A LYS 258.A NZ ASP 285.A OD2 no hydrogen 2.890 N/A HIS 259.A N VAL 241.A O no hydrogen 2.868 N/A HIS 259.A NE2 LEU 197.A O no hydrogen 2.707 N/A ILE 262.A N LEU 236.A O no hydrogen 3.068 N/A GLU 263.A N ARG 272.A O no hydrogen 2.903 N/A ASP 265.A N GLN 269.A O no hydrogen 2.765 N/A LYS 267.A N ASP 265.A OD1 no hydrogen 2.910 N/A GLY 268.A N ASP 265.A O no hydrogen 2.922 N/A GLN 269.A N ASP 265.A OD1 no hydrogen 2.892 N/A VAL 271.A N GLU 263.A O no hydrogen 2.842 N/A ARG 272.A N GLU 263.A O no hydrogen 3.461 N/A ARG 272.A NE ASN 274.A OD1 no hydrogen 2.945 N/A ARG 272.A NH2 GLU 263.A OE1 no hydrogen 2.991 N/A ILE 273.A N TRP 327.A O no hydrogen 2.902 N/A ASN 274.A N ILE 261.A O no hydrogen 2.983 N/A ASN 274.A ND2 LYS 260.A O no hydrogen 2.946 N/A ASN 274.A ND2 GLU 263.A OE1 no hydrogen 2.960 N/A PHE 275.A N THR 192.A OG1 no hydrogen 2.951 N/A ALA 278.A N ASN 276.A OD1 no hydrogen 3.073 N/A THR 279.A N ASN 276.A O no hydrogen 3.051 N/A ARG 280.A N ASN 276.A O no hydrogen 3.084 N/A ARG 280.A NE ASN 277.A OD1 no hydrogen 3.079 N/A ARG 280.A NH1 TYR 295.A OH no hydrogen 3.505 N/A ARG 280.A NH2 ASN 277.A OD1 no hydrogen 2.768 N/A ASP 281.A N ASP 242.A O no hydrogen 2.782 N/A THR 282.A N ASP 281.A OD1 no hydrogen 2.781 N/A THR 282.A OG1 ASP 281.A OD1 no hydrogen 3.506 N/A ILE 283.A N ASP 281.A OD1 no hydrogen 3.361 N/A GLU 289.A N GLU 289.A OE1 no hydrogen 2.785 N/A ARG 290.A N PRO 287.A O no hydrogen 2.984 N/A VAL 291.A N VAL 288.A O no hydrogen 3.231 N/A PHE 294.A N ARG 290.A O no hydrogen 3.168 N/A TYR 295.A N VAL 291.A O no hydrogen 3.103 N/A ALA 296.A N GLN 292.A O no hydrogen 2.980 N/A ALA 297.A N PRO 293.A O no hydrogen 3.017 N/A LEU 298.A N PHE 294.A O no hydrogen 2.883 N/A LYS 299.A N TYR 295.A O no hydrogen 2.886 N/A GLU 300.A N ALA 296.A O no hydrogen 3.112 N/A PHE 301.A N ALA 297.A O no hydrogen 2.995 N/A VAL 302.A N LEU 298.A O no hydrogen 2.853 N/A ASP 303.A N LYS 299.A O no hydrogen 2.743 N/A LEU 304.A N GLU 300.A O no hydrogen 3.074 N/A MET 305.A N PHE 301.A O no hydrogen 3.107 N/A ASN 306.A N VAL 302.A O no hydrogen 2.988 N/A ASN 306.A ND2 VAL 302.A O no hydrogen 3.048 N/A SER 307.A N LEU 304.A O no hydrogen 3.214 N/A SER 307.A OG LEU 304.A O no hydrogen 3.150 N/A GLU 309.A N GLU 309.A OE1 no hydrogen 2.928 N/A SER 310.A N SER 307.A O no hydrogen 2.944 N/A SER 310.A OG LEU 304.A O no hydrogen 2.930 N/A LYS 311.A N SER 307.A O no hydrogen 3.393 N/A LYS 311.A NZ ASN 306.A O no hydrogen 2.688 N/A PHE 312.A N ILE 215.A O no hydrogen 2.833 N/A PHE 314.A N SER 213.A O no hydrogen 3.042 N/A ASN 317.A N ASP 320.A OD2 no hydrogen 2.933 N/A GLY 319.A N CYS 208.A O no hydrogen 3.063 N/A ASP 320.A N ASN 317.A O no hydrogen 2.928 N/A VAL 321.A N LEU 153.A O no hydrogen 2.752 N/A ILE 322.A N LEU 206.A O no hydrogen 2.715 N/A THR 323.A N VAL 151.A O no hydrogen 2.918 N/A THR 323.A OG1.B VAL 151.A O no hydrogen 3.123 N/A PHE 324.A N GLN 204.A O no hydrogen 2.937 N/A ASP 325.A N GLY 149.A O no hydrogen 2.830 N/A ASN 326.A N GLY 202.A O no hydrogen 2.815 N/A ASN 326.A ND2 ASP 193.A O no hydrogen 3.051 N/A ASN 326.A ND2 PRO 201.A O no hydrogen 2.777 N/A TRP 327.A N ASP 325.A OD1 no hydrogen 2.930 N/A TRP 327.A NE1 PRO 200.A O no hydrogen 2.859 N/A ARG 328.A N ASP 325.A O no hydrogen 3.141 N/A ARG 328.A NE ASP 217.A OD1 no hydrogen 2.791 N/A ARG 328.A NH1 LYS 147.A O no hydrogen 2.849 N/A ARG 328.A NH2 GLN 115.A O no hydrogen 2.824 N/A ARG 328.A NH2 ASP 217.A OD1 no hydrogen 3.425 N/A ARG 328.A NH2 ASP 217.A OD2 no hydrogen 2.746 N/A LEU 329.A N ASP 325.A O no hydrogen 3.015 N/A LEU 330.A N VAL 216.A O no hydrogen 3.219 N/A HIS 331.A N HIS 191.A O no hydrogen 2.972 N/A GLY 332.A N GLU 214.A O no hydrogen 3.046 N/A HIS 336.A N LYS 210.A O no hydrogen 3.006 N/A GLU 338.A N HIS 207.A O no hydrogen 3.019 N/A GLY 339.A N GLN 185.A O no hydrogen 2.785 N/A ALA 340.A N LEU 205.A O no hydrogen 2.973 N/A TYR 341.A OH ASP 193.A OD2 no hydrogen 2.680 N/A ALA 342.A N VAL 203.A O no hydrogen 2.845 N/A TRP 344.A NE1 ASP 325.A OD1 no hydrogen 3.033 N/A ASP 345.A N ASP 343.A OD2 no hydrogen 2.743 N/A VAL 346.A N ASP 343.A O no hydrogen 3.015 N/A VAL 347.A N ASP 343.A O no hydrogen 3.397 N/A MET 348.A N TRP 344.A O no hydrogen 2.746 N/A SER 349.A N ASP 345.A O no hydrogen 3.040 N/A ARG 350.A N VAL 346.A O no hydrogen 3.149 N/A LEU 351.A N VAL 347.A O no hydrogen 2.918 N/A ARG 352.A N MET 348.A O no hydrogen 2.923 N/A ARG 352.A NE LEU 109.A O no hydrogen 3.015 N/A ARG 352.A NH2 LEU 109.A O no hydrogen 3.189 N/A ILE 353.A N SER 349.A O no hydrogen 2.994 N/A LEU 354.A N ARG 350.A O no hydrogen 2.813 N/A ARG 355.A N LEU 351.A O no hydrogen 2.963 N/A GLN 356.A N ARG 352.A O no hydrogen 3.128 N/A GLN 356.A NE2 ASN 360.A OD1 no hydrogen 2.798 N/A ARG 357.A N ILE 353.A O no hydrogen 2.967 N/A VAL 358.A N LEU 354.A O no hydrogen 2.888 N/A GLU 359.A N ARG 355.A O no hydrogen 2.988 N/A ASN 360.A N GLN 356.A O no hydrogen 3.179 N/A