Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3cwv_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 6.A N GLY 2.A O no hydrogen 3.001 N/A VAL 7.A N ILE 3.A O no hydrogen 2.980 N/A ARG 8.A N VAL 4.A O no hydrogen 2.905 N/A ARG 8.A NH1 ALA 99.A O no hydrogen 2.957 N/A ARG 8.A NH1 ASP 152.A OD2 no hydrogen 3.031 N/A ARG 8.A NH2 ASP 152.A OD2 no hydrogen 2.870 N/A LYS 9.A N GLU 5.A O no hydrogen 2.941 N/A MET 13.A N ARG 10.A O no hydrogen 3.055 N/A TYR 14.A N PRO 11.A O no hydrogen 2.952 N/A CYS 15.A N PRO 11.A O no hydrogen 3.041 N/A CYS 15.A SG PRO 11.A O no hydrogen 3.399 N/A CYS 15.A SG ASP 17.A O no hydrogen 3.219 N/A GLY 16.A N GLY 12.A O no hydrogen 3.039 N/A GLY 19.A N ASP 17.A OD1 no hydrogen 2.881 N/A GLY 22.A N ASP 17.A OD1 no hydrogen 2.859 N/A LEU 23.A N GLY 19.A O no hydrogen 3.062 N/A HIS 24.A N GLU 20.A O no hydrogen 3.127 N/A HIS 25.A N TYR 21.A O no hydrogen 2.928 N/A HIS 25.A ND1 TYR 21.A O no hydrogen 2.831 N/A LEU 26.A N GLY 22.A O no hydrogen 3.207 N/A LEU 26.A N LEU 23.A O no hydrogen 3.341 N/A TYR 28.A N HIS 24.A O no hydrogen 3.026 N/A PHE 29.A N HIS 25.A O no hydrogen 2.805 N/A LEU 31.A N VAL 27.A O no hydrogen 3.029 N/A ASP 32.A N TYR 28.A O no hydrogen 2.851 N/A VAL 33.A N PHE 29.A O no hydrogen 3.165 N/A ALA 34.A N LEU 30.A O no hydrogen 3.234 N/A TYR 35.A N LEU 31.A O no hydrogen 2.866 N/A GLU 36.A N ASP 32.A O no hydrogen 3.026 N/A GLU 37.A N VAL 33.A O no hydrogen 3.198 N/A ALA 38.A N ALA 34.A O no hydrogen 2.886 N/A ARG 39.A N TYR 35.A O no hydrogen 2.688 N/A ARG 39.A NE GLU 36.A OE1 no hydrogen 2.877 N/A ARG 39.A NH2 GLU 36.A OE2 no hydrogen 2.805 N/A ARG 40.A N GLU 36.A O no hydrogen 3.216 N/A ARG 40.A N GLU 37.A O no hydrogen 3.205 N/A GLY 41.A N ALA 38.A O no hydrogen 2.931 N/A GLU 42.A N GLU 37.A O no hydrogen 2.806 N/A CYS 43.A SG ASP 45.A O no hydrogen 3.205 N/A CYS 43.A SG THR 61.A O no hydrogen 3.486 N/A VAL 46.A N ARG 181.A O no hydrogen 2.859 N/A VAL 47.A N PHE 59.A O no hydrogen 2.808 N/A LEU 48.A N SER 183.A O no hydrogen 2.820 N/A GLU 49.A N ALA 57.A O no hydrogen 2.774 N/A VAL 50.A N ALA 185.A O no hydrogen 3.148 N/A GLY 51.A N SER 55.A O no hydrogen 3.340 N/A GLY 54.A N GLY 51.A O no hydrogen 3.438 N/A SER 55.A N ASP 53.A OD1 no hydrogen 3.150 N/A SER 55.A OG ASP 53.A OD1 no hydrogen 2.800 N/A SER 55.A OG HIS 148.A NE2 no hydrogen 3.024 N/A ILE 56.A N PHE 149.A O no hydrogen 2.946 N/A ALA 57.A N GLU 49.A O no hydrogen 2.808 N/A LEU 58.A N VAL 147.A O no hydrogen 2.927 N/A PHE 59.A N VAL 47.A O no hydrogen 2.836 N/A CYS 60.A N VAL 145.A O no hydrogen 2.879 N/A THR 61.A N ASP 45.A O no hydrogen 3.079 N/A THR 61.A OG1 ASP 45.A OD2 no hydrogen 2.958 N/A SER 62.A N ARG 143.A O no hydrogen 2.873 N/A ARG 63.A NH1 GLY 41.A O no hydrogen 3.172 N/A THR 64.A N SER 62.A OG no hydrogen 3.024 N/A VAL 65.A N SER 62.A OG no hydrogen 2.992 N/A ASN 69.A N THR 66.A OG1 no hydrogen 2.961 N/A LEU 70.A N THR 66.A O no hydrogen 3.153 N/A VAL 71.A N ALA 67.A O no hydrogen 2.948 N/A ARG 72.A N GLU 68.A O no hydrogen 3.044 N/A VAL 73.A N ASN 69.A O no hydrogen 3.011 N/A ALA 74.A N LEU 70.A O no hydrogen 2.886 N/A THR 75.A N ARG 72.A O no hydrogen 3.208 N/A THR 75.A OG1 ARG 72.A O no hydrogen 3.395 N/A GLY 76.A N VAL 73.A O no hydrogen 3.015 N/A ALA 77.A N ARG 72.A O no hydrogen 3.121 N/A GLY 78.A N ARG 82.A O.A no hydrogen 2.967 N/A GLY 78.A N ARG 82.A O.B no hydrogen 2.887 N/A PHE 79.A N GLY 76.A O no hydrogen 3.113 N/A GLY 81.A N GLY 78.A O no hydrogen 3.208 N/A GLY 81.A N ASP 91.A OD1 no hydrogen 2.842 N/A ARG 82.A N.A PHE 79.A O no hydrogen 3.183 N/A ARG 82.A N.B PHE 79.A O no hydrogen 3.161 N/A TRP 90.A N GLY 87.A O no hydrogen 2.972 N/A TRP 90.A NE1 PRO 83.A O no hydrogen 3.096 N/A SER 92.A N GLY 89.A O no hydrogen 3.244 N/A SER 92.A OG GLY 89.A O no hydrogen 2.545 N/A LEU 94.A N SER 92.A OG no hydrogen 2.933 N/A VAL 96.A N MET 93.A O no hydrogen 3.011 N/A SER 97.A N MET 93.A O no hydrogen 3.492 N/A SER 97.A OG LEU 26.A O no hydrogen 2.724 N/A LEU 98.A N LEU 94.A O no hydrogen 3.088 N/A ALA 99.A N VAL 95.A O no hydrogen 2.701 N/A LEU 100.A N VAL 96.A O no hydrogen 2.980 N/A SER 101.A N LEU 98.A O no hydrogen 3.177 N/A SER 101.A OG LEU 98.A O no hydrogen 2.622 N/A SER 102.A N VAL 150.A O no hydrogen 2.940 N/A TYR 104.A N GLY 119.A O no hydrogen 3.074 N/A GLN 105.A N HIS 148.A O no hydrogen 2.825 N/A GLN 105.A NE2 ASP 107.A OD2 no hydrogen 2.905 N/A VAL 106.A N VAL 117.A O no hydrogen 2.851 N/A ASP 107.A N ARG 146.A O no hydrogen 2.904 N/A ILE 108.A N TRP 115.A O no hydrogen 2.814 N/A TRP 109.A N GLY 144.A O no hydrogen 2.882 N/A TRP 109.A NE1 GLU 135.A O no hydrogen 2.879 N/A ALA 110.A N ARG 113.A O no hydrogen 2.807 N/A ARG 113.A N ALA 110.A O no hydrogen 2.902 N/A GLN 114.A NE2 ASP 107.A OD1 no hydrogen 2.889 N/A TRP 115.A N ILE 108.A O no hydrogen 2.794 N/A TRP 115.A NE1 GLU 127.A O no hydrogen 2.835 N/A ARG 116.A N ALA 129.A O no hydrogen 2.918 N/A ARG 116.A NE ASP 107.A OD1 no hydrogen 2.757 N/A ARG 116.A NH2 ASP 107.A OD1 no hydrogen 3.266 N/A ARG 116.A NH2 GLU 135.A OE1 no hydrogen 2.998 N/A VAL 117.A N VAL 106.A O no hydrogen 2.896 N/A GLY 119.A N TYR 104.A O no hydrogen 2.828 N/A GLU 120.A N HIS 123.A O no hydrogen 3.023 N/A HIS 121.A N SER 102.A O no hydrogen 2.787 N/A HIS 123.A N GLU 120.A O no hydrogen 3.082 N/A HIS 123.A NE2 GLU 5.A OE2 no hydrogen 2.743 N/A GLN 125.A N MET 118.A O no hydrogen 2.771 N/A GLN 125.A NE2 HIS 123.A O no hydrogen 3.005 N/A ALA 129.A N ARG 116.A O no hydrogen 2.846 N/A VAL 131.A N GLN 114.A O no hydrogen 2.963 N/A GLU 135.A N GLN 114.A OE1 no hydrogen 2.780 N/A ARG 143.A N SER 62.A O no hydrogen 2.972 N/A ARG 143.A NH1 VAL 65.A O no hydrogen 2.784 N/A GLY 144.A N TRP 109.A O no hydrogen 3.098 N/A VAL 145.A N CYS 60.A O no hydrogen 2.921 N/A ARG 146.A N ASP 107.A O no hydrogen 2.876 N/A VAL 147.A N LEU 58.A O no hydrogen 2.854 N/A HIS 148.A N GLN 105.A O no hydrogen 2.872 N/A HIS 148.A NE2 SER 55.A OG no hydrogen 3.024 N/A PHE 149.A N ILE 56.A O no hydrogen 2.923 N/A VAL 150.A N ARG 103.A O no hydrogen 3.102 N/A ASP 152.A N LEU 100.A O no hydrogen 3.000 N/A THR 154.A N ASP 152.A OD1 no hydrogen 2.891 N/A THR 154.A OG1 ASP 152.A OD1 no hydrogen 2.594 N/A ILE 155.A N ASP 152.A O no hydrogen 2.966 N/A PHE 156.A N ASP 152.A O no hydrogen 3.084 N/A GLU 157.A N VAL 18.A O no hydrogen 2.848 N/A ARG 165.A N ASP 162.A OD1 no hydrogen 3.155 N/A ARG 165.A NH1 GLU 20.A OE1 no hydrogen 3.350 N/A ARG 165.A NH2 GLU 20.A OE1 no hydrogen 2.877 N/A ARG 165.A NH2 ASP 162.A OD2 no hydrogen 3.376 N/A LEU 166.A N ASP 162.A O no hydrogen 3.235 N/A SER 167.A N ARG 163.A O no hydrogen 2.897 N/A SER 167.A OG ARG 163.A O no hydrogen 2.721 N/A ARG 168.A N ALA 164.A O no hydrogen 3.002 N/A ARG 169.A N ARG 165.A O no hydrogen 3.043 N/A CYS 170.A N LEU 166.A O no hydrogen 3.050 N/A CYS 170.A SG LEU 166.A O no hydrogen 3.479 N/A ASN 171.A N SER 167.A O no hydrogen 2.983 N/A GLU 172.A N ARG 168.A O no hydrogen 3.069 N/A LEU 173.A N ARG 169.A O no hydrogen 2.980 N/A ALA 174.A N CYS 170.A O no hydrogen 3.042 N/A ALA 175.A N ASN 171.A O no hydrogen 3.166 N/A LEU 176.A N GLU 172.A O no hydrogen 2.835 N/A ALA 177.A N LEU 173.A O no hydrogen 3.008 N/A LEU 180.A N ALA 177.A O no hydrogen 2.875 N/A ARG 181.A N ARG 44.A O no hydrogen 3.158 N/A VAL 182.A N TRP 195.A O no hydrogen 2.991 N/A SER 183.A N VAL 46.A O no hydrogen 2.808 N/A PHE 184.A N THR 193.A O no hydrogen 2.842 N/A ALA 185.A N LEU 48.A O no hydrogen 2.714 N/A ASP 186.A N GLU 191.A O no hydrogen 2.879 N/A ARG 189.A NE GLU 191.A OE1 no hydrogen 3.146 N/A ARG 189.A NH2 GLU 191.A OE1 no hydrogen 3.503 N/A GLY 190.A N LEU 187.A O no hydrogen 3.358 N/A GLU 191.A N ASP 186.A O no hydrogen 3.327 N/A THR 193.A N PHE 184.A O no hydrogen 2.932 N/A TRP 195.A N VAL 182.A O no hydrogen 2.772 N/A GLY 199.A N GLN 203.A OE1 no hydrogen 3.055 N/A GLY 200.A N LEU 197.A O no hydrogen 2.781 N/A GLN 203.A N GLY 199.A O no hydrogen 3.401 N/A TRP 204.A N GLY 200.A O no hydrogen 3.082 N/A ALA 205.A N VAL 201.A O no hydrogen 2.861 N/A HIS 206.A N ALA 202.A O no hydrogen 3.184 N/A VAL 207.A N GLN 203.A O no hydrogen 3.186 N/A LEU 208.A N TRP 204.A O no hydrogen 2.922 N/A THR 209.A N ALA 205.A O no hydrogen 3.070 N/A THR 209.A N HIS 206.A O no hydrogen 3.113 N/A THR 209.A OG1 ALA 205.A O no hydrogen 2.865 N/A THR 209.A OG1 HIS 206.A O no hydrogen 3.194 N/A GLU 210.A N VAL 207.A O no hydrogen 3.215 N/A ARG 212.A N THR 209.A O no hydrogen 2.808 N/A GLN 214.A NE2 HIS 206.A O no hydrogen 3.632 N/A GLN 214.A NE2 THR 209.A OG1 no hydrogen 2.725 N/A LEU 215.A N TRP 237.A O no hydrogen 2.910 N/A HIS 216.A ND1 GLU 218.A O no hydrogen 2.726 N/A VAL 220.A N LEU 235.A O no hydrogen 2.851 N/A PHE 222.A N CYS 233.A O no hydrogen 3.023 N/A PHE 224.A N VAL 231.A O no hydrogen 2.945 N/A TRP 226.A N LEU 229.A O no hydrogen 2.777 N/A LEU 229.A N TRP 226.A O no hydrogen 2.842 N/A ARG 230.A N SER 299.A O no hydrogen 2.925 N/A ARG 230.A NE ASP 223.A OD1 no hydrogen 2.798 N/A ARG 230.A NH2 ASP 223.A OD2 no hydrogen 2.673 N/A VAL 231.A N PHE 224.A O no hydrogen 2.717 N/A GLN 232.A N ALA 297.A O no hydrogen 2.907 N/A CYS 233.A N PHE 222.A O no hydrogen 2.958 N/A CYS 233.A SG ILE 295.A O no hydrogen 3.767 N/A ALA 234.A N ILE 295.A O no hydrogen 2.917 N/A LEU 235.A N VAL 220.A O no hydrogen 2.793 N/A GLN 236.A N THR 293.A O no hydrogen 2.875 N/A GLN 236.A NE2 HIS 216.A O no hydrogen 3.211 N/A GLN 236.A NE2 TRP 237.A O no hydrogen 2.990 N/A TRP 237.A N HIS 216.A NE2 no hydrogen 3.051 N/A TRP 237.A NE1 VAL 288.A O no hydrogen 3.071 N/A CYS 238.A N GLY 291.A O no hydrogen 2.883 N/A GLU 239.A N PRO 213.A O no hydrogen 2.788 N/A SER 243.A OG ALA 289.A O no hydrogen 2.719 N/A THR 244.A N LEU 292.A O no hydrogen 2.804 N/A LEU 246.A N ALA 294.A O no hydrogen 2.947 N/A SER 247.A OG THR 254.A O no hydrogen 2.833 N/A SER 247.A OG THR 254.A OG1 no hydrogen 2.821 N/A SER 247.A OG HIS 257.A ND1 no hydrogen 2.689 N/A PHE 248.A N VAL 296.A O no hydrogen 2.931 N/A ALA 249.A N VAL 252.A O no hydrogen 2.933 N/A ASN 250.A N VAL 298.A O no hydrogen 2.835 N/A ASN 250.A ND2 GLY 300.A O no hydrogen 2.867 N/A VAL 252.A N ALA 249.A O no hydrogen 3.147 N/A THR 254.A N SER 247.A O no hydrogen 2.918 N/A THR 254.A OG1 SER 247.A OG no hydrogen 2.821 N/A ARG 256.A N GLU 313.A O no hydrogen 2.870 N/A ARG 256.A NE GLU 313.A OE1 no hydrogen 2.935 N/A ARG 256.A NH1 THR 311.A OG1 no hydrogen 3.178 N/A ARG 256.A NH1 GLU 313.A OE1 no hydrogen 3.504 N/A HIS 257.A N THR 254.A O no hydrogen 2.883 N/A HIS 257.A ND1 SER 247.A OG no hydrogen 2.689 N/A ALA 259.A N LEU 315.A O no hydrogen 2.985 N/A LYS 262.A N GLY 258.A O no hydrogen 2.868 N/A GLY 263.A N ALA 259.A O no hydrogen 3.023 N/A THR 265.A N VAL 261.A O no hydrogen 2.942 N/A THR 265.A OG1 LYS 262.A O no hydrogen 3.432 N/A GLN 266.A N LYS 262.A O no hydrogen 2.926 N/A ALA 267.A N GLY 263.A O no hydrogen 3.114 N/A LEU 268.A N VAL 264.A O no hydrogen 2.996 N/A ARG 269.A N THR 265.A O no hydrogen 2.881 N/A ARG 269.A NE PHE 283.A O no hydrogen 2.648 N/A ARG 269.A NH2 ARG 280.A O no hydrogen 2.714 N/A GLY 270.A N GLN 266.A O no hydrogen 3.012 N/A ALA 271.A N ALA 267.A O no hydrogen 2.969 N/A LEU 272.A N LEU 268.A O no hydrogen 2.971 N/A ALA 273.A N ARG 269.A O no hydrogen 3.048 N/A LYS 274.A N GLY 270.A O no hydrogen 3.173 N/A LEU 275.A N ALA 271.A O no hydrogen 3.066 N/A SER 276.A N LEU 272.A O no hydrogen 3.015 N/A SER 276.A OG LEU 272.A O no hydrogen 3.039 N/A SER 276.A OG ALA 273.A O no hydrogen 3.132 N/A GLY 277.A N LYS 274.A O no hydrogen 2.950 N/A GLU 278.A N ALA 273.A O no hydrogen 2.715 N/A GLU 278.A N SER 276.A OG no hydrogen 3.305 N/A ARG 280.A NE GLN 266.A O no hydrogen 3.083 N/A ARG 280.A NH2 GLN 266.A O no hydrogen 2.986 N/A ALA 282.A N THR 279.A O no hydrogen 2.832 N/A PHE 283.A N ARG 280.A O no hydrogen 2.955 N/A ARG 287.A N PRO 284.A O no hydrogen 3.130 N/A VAL 288.A N PRO 284.A O no hydrogen 3.102 N/A ALA 289.A N TRP 285.A O no hydrogen 2.789 N/A GLN 290.A N ARG 287.A O no hydrogen 3.110 N/A LEU 292.A N ALA 289.A O no hydrogen 2.913 N/A THR 293.A N GLN 236.A O no hydrogen 2.776 N/A ALA 294.A N THR 244.A O no hydrogen 2.771 N/A ILE 295.A N ALA 234.A O no hydrogen 2.917 N/A VAL 296.A N LEU 246.A O no hydrogen 2.926 N/A ALA 297.A N GLN 232.A O no hydrogen 2.877 N/A VAL 298.A N PHE 248.A O no hydrogen 2.975 N/A SER 299.A N ARG 230.A O no hydrogen 2.924 N/A GLY 300.A N ASN 250.A OD1 no hydrogen 2.866 N/A GLN 304.A N PRO 301.A O no hydrogen 2.933 N/A MET 305.A N ARG 302.A O no hydrogen 3.197 N/A ALA 308.A N LEU 314.A O no hydrogen 2.846 N/A LYS 312.A N GLY 309.A O no hydrogen 3.195 N/A GLU 313.A N THR 311.A OG1 no hydrogen 3.242 N/A LEU 315.A N HIS 257.A O no hydrogen 2.901 N/A ALA 316.A N ALA 306.A O no hydrogen 2.794 N/A LEU 320.A N ILE 317.A O no hydrogen 3.074 N/A ALA 323.A N GLY 319.A O no hydrogen 2.935 N/A ILE 324.A N LEU 320.A O no hydrogen 2.978 N/A ARG 325.A N GLU 321.A O no hydrogen 2.951 N/A ARG 325.A NE GLU 322.A OE1 no hydrogen 2.828 N/A ARG 325.A NE GLU 322.A OE2 no hydrogen 3.363 N/A ARG 325.A NH1 GLU 322.A OE2 no hydrogen 2.971 N/A LYS 326.A N GLU 322.A O no hydrogen 2.886 N/A GLN 327.A N ALA 323.A O no hydrogen 3.144 N/A LEU 328.A N ILE 324.A O no hydrogen 2.827 N/A GLN 329.A N ARG 325.A O no hydrogen 2.871 N/A PHE 332.A N LEU 328.A O no hydrogen 2.815 N/A ILE 333.A N GLN 329.A O no hydrogen 3.074 N/A GLU 334.A N PRO 330.A O no hydrogen 3.156 N/A LEU 335.A N LEU 331.A O no hydrogen 2.935 N/A LEU 336.A N PHE 332.A O no hydrogen 2.828 N/A ARG 337.A N GLU 334.A O no hydrogen 3.210 N/A ARG 337.A NE GLU 334.A OE2 no hydrogen 3.379 N/A HIS 339.A N LEU 336.A O no hydrogen 3.384 N/A VAL 341.A N HIS 339.A ND1 no hydrogen 3.134 N/A THR 342.A N HIS 339.A O no hydrogen 3.361 N/A THR 342.A OG1 LEU 336.A O no hydrogen 2.488 N/A THR 342.A OG1 HIS 339.A O no hydrogen 3.283 N/A LEU 345.A N VAL 341.A O no hydrogen 3.107 N/A LEU 346.A N THR 342.A O no hydrogen 2.631 N/A ALA 347.A N PRO 343.A O no hydrogen 2.866 N/A ARG 348.A N LEU 345.A O no hydrogen 2.995 N/A ARG 348.A NH1 ARG 287.A O no hydrogen 3.145 N/A ARG 348.A NH1 GLN 290.A O no hydrogen 2.875 N/A ARG 348.A NH2 GLN 290.A O no hydrogen 3.341 N/A ARG 349.A NH1 LEU 346.A O no hydrogen 3.190 N/A ARG 349.A NH2 GLU 278.A OE2 no hydrogen 3.079 N/A