Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4l7p_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A NZ LYS 124.A O no hydrogen 2.802 N/A LYS 2.A NZ VAL 126.A O no hydrogen 3.190 N/A ARG 3.A N GLU 127.A O no hydrogen 3.418 N/A GLN 5.A N VAL 129.A O no hydrogen 2.888 N/A GLN 5.A NE2 GLU 128.A OE1 no hydrogen 2.856 N/A CYS 7.A SG HIS 131.A ND1 no hydrogen 3.813 N/A CYS 7.A SG ASP 134.A OD2 no hydrogen 3.569 N/A SER 8.A N ASP 134.A OD2 no hydrogen 2.817 N/A SER 8.A OG ASP 134.A OD1 no hydrogen 2.670 N/A SER 8.A OG ASP 134.A OD2 no hydrogen 3.561 N/A THR 13.A N ASP 10.A OD1 no hydrogen 2.857 N/A THR 13.A OG1 ASP 10.A OD1 no hydrogen 2.786 N/A THR 13.A OG1 ASP 10.A OD2 no hydrogen 2.703 N/A GLN 14.A N ASP 10.A O no hydrogen 2.980 N/A GLN 14.A NE2 LEU 9.A O no hydrogen 2.795 N/A LYS 15.A N PRO 11.A O no hydrogen 3.072 N/A LEU 16.A N ALA 12.A O no hydrogen 3.112 N/A ILE 17.A N THR 13.A O no hydrogen 2.909 N/A THR 18.A N GLN 14.A O no hydrogen 2.901 N/A THR 18.A OG1 GLN 14.A O no hydrogen 2.734 N/A ASN 19.A N LYS 15.A O no hydrogen 2.889 N/A ASN 19.A ND2 TYR 256.A OH no hydrogen 2.805 N/A ILE 20.A N LEU 16.A O no hydrogen 2.954 N/A PHE 21.A N ILE 17.A O no hydrogen 3.304 N/A SER 22.A N ASN 19.A O no hydrogen 3.327 N/A LYS 23.A NZ GLN 114.A OE1 no hydrogen 2.864 N/A MET 25.A N SER 22.A OG no hydrogen 3.141 N/A PHE 26.A N SER 22.A O no hydrogen 2.940 N/A LYS 27.A N LYS 23.A O no hydrogen 2.874 N/A ASN 28.A N GLU 24.A O no hydrogen 2.832 N/A THR 29.A N MET 25.A O no hydrogen 3.029 N/A THR 29.A OG1 MET 25.A O no hydrogen 2.768 N/A MET 30.A N PHE 26.A O no hydrogen 3.158 N/A ALA 31.A N LYS 27.A O no hydrogen 2.953 N/A LEU 32.A N ASN 28.A O no hydrogen 2.919 N/A MET 33.A N MET 30.A O no hydrogen 3.333 N/A ASP 34.A N ALA 31.A O no hydrogen 3.119 N/A LEU 35.A N MET 30.A O no hydrogen 2.800 N/A ASP 36.A N PRO 80.A O no hydrogen 3.065 N/A LYS 39.A N ASP 36.A OD1 no hydrogen 2.993 N/A LYS 44.A N PRO 41.A O no hydrogen 2.912 N/A LEU 45.A N PRO 41.A O no hydrogen 3.042 N/A LYS 47.A NZ GLU 111.A OE1 no hydrogen 2.780 N/A LYS 47.A NZ GLU 111.A OE2 no hydrogen 3.480 N/A GLN 49.A N SER 46.A OG no hydrogen 3.051 N/A GLN 49.A NE2 VAL 78.A O no hydrogen 3.064 N/A ILE 50.A N SER 46.A O no hydrogen 3.254 N/A ALA 51.A N LYS 47.A O no hydrogen 2.840 N/A ARG 52.A N GLN 48.A O no hydrogen 2.825 N/A GLY 53.A N GLN 49.A O no hydrogen 2.971 N/A PHE 54.A N ILE 50.A O no hydrogen 3.019 N/A GLU 55.A N ALA 51.A O no hydrogen 3.033 N/A ALA 56.A N ARG 52.A O no hydrogen 3.109 N/A LEU 57.A N GLY 53.A O no hydrogen 3.122 N/A GLU 58.A N PHE 54.A O no hydrogen 2.787 N/A ALA 59.A N GLU 55.A O no hydrogen 2.972 N/A LEU 60.A N ALA 56.A O no hydrogen 2.921 N/A GLU 61.A N LEU 57.A O no hydrogen 2.838 N/A GLU 62.A N GLU 58.A O no hydrogen 3.326 N/A ALA 63.A N ALA 59.A O no hydrogen 3.197 N/A LEU 64.A N LEU 60.A O no hydrogen 3.234 N/A LYS 65.A N GLU 61.A O no hydrogen 3.255 N/A LEU 71.A N SER 67.A O no hydrogen 3.176 N/A SER 72.A N LEU 68.A O no hydrogen 2.856 N/A SER 72.A OG LEU 68.A O no hydrogen 2.759 N/A SER 73.A N GLU 69.A O no hydrogen 2.893 N/A HIS 74.A N GLU 70.A O no hydrogen 3.134 N/A PHE 75.A N LEU 71.A O no hydrogen 3.202 N/A TYR 76.A N SER 72.A O no hydrogen 2.957 N/A TYR 76.A OH PRO 89.A O no hydrogen 2.694 N/A THR 77.A N HIS 74.A O no hydrogen 3.290 N/A THR 77.A OG1 SER 73.A O no hydrogen 2.728 N/A VAL 78.A N HIS 74.A O no hydrogen 3.197 N/A ILE 79.A N PHE 75.A O no hydrogen 2.800 N/A HIS 81.A ND1 ILE 79.A O no hydrogen 2.771 N/A ASN 82.A N ASP 34.A O no hydrogen 2.791 N/A SER 86.A N PHE 83.A O no hydrogen 2.950 N/A SER 86.A OG PHE 83.A O no hydrogen 3.183 N/A SER 86.A OG GLY 84.A O no hydrogen 3.561 N/A ILE 91.A N SER 72.A OG no hydrogen 2.917 N/A GLU 95.A N GLU 95.A OE1 no hydrogen 2.913 N/A LEU 96.A N SER 93.A OG no hydrogen 3.376 N/A LEU 97.A N SER 93.A O no hydrogen 3.011 N/A GLN 98.A N PRO 94.A O no hydrogen 3.168 N/A GLN 98.A NE2 ASP 102.A OD1 no hydrogen 3.016 N/A GLN 98.A NE2 HIS 222.A O no hydrogen 3.276 N/A ALA 99.A N GLU 95.A O no hydrogen 3.031 N/A LYS 100.A N LEU 96.A O no hydrogen 3.238 N/A LYS 100.A NZ HIS 81.A NE2 no hydrogen 2.896 N/A LYS 101.A N LEU 97.A O no hydrogen 3.146 N/A LYS 101.A NZ GLU 61.A OE1 no hydrogen 2.813 N/A ASP 102.A N GLN 98.A O no hydrogen 2.789 N/A MET 103.A N ALA 99.A O no hydrogen 2.887 N/A LEU 104.A N LYS 100.A O no hydrogen 3.067 N/A LEU 105.A N LYS 101.A O no hydrogen 2.961 N/A VAL 106.A N ASP 102.A O no hydrogen 3.068 N/A LEU 107.A N MET 103.A O no hydrogen 3.002 N/A ALA 108.A N LEU 104.A O no hydrogen 2.927 N/A ASP 109.A N LEU 105.A O no hydrogen 3.344 N/A ILE 110.A N VAL 106.A O no hydrogen 2.917 N/A GLU 111.A N LEU 107.A O no hydrogen 2.915 N/A LEU 112.A N ALA 108.A O no hydrogen 3.007 N/A ALA 113.A N ASP 109.A O no hydrogen 3.186 N/A GLN 114.A N ILE 110.A O no hydrogen 2.983 N/A ALA 115.A N GLU 111.A O no hydrogen 2.763 N/A LEU 116.A N LEU 112.A O no hydrogen 2.967 N/A GLN 117.A N ALA 113.A O no hydrogen 3.338 N/A GLN 117.A N GLN 114.A O no hydrogen 3.234 N/A GLN 117.A NE2 ASP 136.A OD1 no hydrogen 2.928 N/A ALA 118.A N ALA 115.A O no hydrogen 3.329 N/A SER 120.A N GLU 123.A OE1 no hydrogen 3.206 N/A SER 120.A OG GLU 123.A OE1 no hydrogen 3.141 N/A GLU 123.A N SER 120.A O no hydrogen 3.335 N/A LYS 124.A N SER 120.A O no hydrogen 3.222 N/A THR 125.A OG1 GLU 121.A O no hydrogen 2.957 N/A THR 125.A OG1 GLN 122.A O no hydrogen 3.319 N/A VAL 129.A N ARG 3.A O no hydrogen 2.843 N/A LEU 133.A N HIS 131.A ND1 no hydrogen 3.112 N/A ARG 135.A N HIS 131.A O no hydrogen 2.947 N/A ARG 135.A NE GLU 123.A OE2 no hydrogen 2.770 N/A ARG 135.A NH1 GLN 117.A O no hydrogen 3.124 N/A ARG 135.A NH1 ALA 118.A O no hydrogen 3.023 N/A ARG 135.A NH1 GLU 123.A OE1 no hydrogen 2.958 N/A ARG 135.A NH1 GLU 123.A OE2 no hydrogen 3.338 N/A ARG 135.A NH2 GLN 117.A O no hydrogen 2.818 N/A ASP 136.A N PRO 132.A O no hydrogen 3.123 N/A TYR 137.A N LEU 133.A O no hydrogen 2.879 N/A GLN 138.A N ASP 134.A O no hydrogen 2.899 N/A LEU 139.A N ARG 135.A O no hydrogen 3.032 N/A LEU 140.A N TYR 137.A O no hydrogen 3.271 N/A LYS 141.A N GLN 138.A O no hydrogen 3.180 N/A CYS 142.A SG GLN 143.A O no hydrogen 3.819 N/A GLN 143.A N ASN 180.A O no hydrogen 3.211 N/A LEU 144.A N TYR 137.A OH no hydrogen 3.087 N/A GLN 145.A N LYS 178.A O no hydrogen 2.947 N/A LEU 147.A N ILE 176.A O no hydrogen 2.703 N/A GLY 150.A N ASP 148.A OD2 no hydrogen 2.846 N/A ALA 151.A N ASP 148.A O no hydrogen 2.860 N/A GLU 153.A N GLU 153.A OE1 no hydrogen 3.198 N/A TYR 154.A N ALA 151.A O no hydrogen 3.038 N/A VAL 156.A N PRO 152.A O no hydrogen 3.184 N/A ILE 157.A N GLU 153.A O no hydrogen 2.926 N/A GLN 158.A N TYR 154.A O no hydrogen 2.912 N/A THR 159.A N LYS 155.A O no hydrogen 3.053 N/A THR 159.A OG1 LYS 155.A O no hydrogen 2.693 N/A TYR 160.A N VAL 156.A O no hydrogen 3.094 N/A TYR 160.A OH LEU 199.A O no hydrogen 2.711 N/A LEU 161.A N ILE 157.A O no hydrogen 2.872 N/A GLU 162.A N GLN 158.A O no hydrogen 2.895 N/A GLN 163.A N THR 159.A O no hydrogen 2.791 N/A THR 164.A N TYR 160.A O no hydrogen 3.089 N/A THR 164.A OG1 TYR 160.A O no hydrogen 2.663 N/A HIS 168.A N ASN 167.A OD1 no hydrogen 3.071 N/A CYS 170.A N HIS 168.A O no hydrogen 2.852 N/A CYS 170.A SG PRO 171.A O no hydrogen 3.970 N/A THR 172.A N HIS 350.A O no hydrogen 3.301 N/A GLN 174.A N GLU 348.A O no hydrogen 2.928 N/A TRP 177.A N LEU 346.A O no hydrogen 2.755 N/A TRP 177.A NE1 THR 13.A OG1 no hydrogen 3.026 N/A LYS 178.A N GLN 145.A O no hydrogen 2.719 N/A VAL 179.A N ARG 344.A O no hydrogen 2.797 N/A ASN 180.A N GLN 143.A O no hydrogen 2.952 N/A ASN 180.A ND2 GLN 143.A OE1 no hydrogen 3.142 N/A GLN 181.A NE2 LEU 213.A O no hydrogen 3.035 N/A GLU 184.A N GLN 181.A O no hydrogen 3.008 N/A ARG 187.A NH2 CYS 341.A O no hydrogen 3.428 N/A PHE 188.A N GLU 184.A O no hydrogen 3.244 N/A ALA 190.A N ARG 187.A O no hydrogen 3.286 N/A HIS 191.A N PHE 188.A O no hydrogen 3.077 N/A HIS 191.A NE2 SER 339.A OG no hydrogen 2.975 N/A SER 192.A N GLN 189.A O no hydrogen 3.156 N/A SER 192.A OG GLN 189.A O no hydrogen 2.968 N/A LEU 194.A N HIS 191.A O no hydrogen 2.904 N/A ASN 196.A ND2 GLY 265.A O no hydrogen 3.095 N/A ASN 196.A ND2 GLU 267.A OE2 no hydrogen 2.765 N/A ARG 197.A NH1 GLU 261.A OE2 no hydrogen 3.475 N/A ARG 197.A NH2 SER 192.A O no hydrogen 3.118 N/A LYS 198.A N VAL 262.A O no hydrogen 3.032 N/A LEU 199.A N VAL 311.A O no hydrogen 2.807 N/A LEU 200.A N GLY 260.A O no hydrogen 2.869 N/A TRP 201.A N ALA 234.A O no hydrogen 2.861 N/A HIS 202.A N PHE 258.A O no hydrogen 2.904 N/A HIS 202.A ND1 TYR 232.A O no hydrogen 2.716 N/A MET 206.A N ILE 245.A O no hydrogen 3.170 N/A VAL 208.A N ASN 205.A O no hydrogen 3.189 N/A VAL 209.A N MET 206.A O no hydrogen 3.330 N/A ILE 212.A N VAL 208.A O no hydrogen 3.033 N/A LEU 213.A N VAL 209.A O no hydrogen 2.860 N/A THR 214.A N ALA 210.A O no hydrogen 2.959 N/A THR 214.A OG1 ALA 210.A O no hydrogen 2.682 N/A SER 215.A N ALA 211.A O no hydrogen 2.802 N/A SER 215.A OG ALA 211.A O no hydrogen 3.437 N/A GLY 216.A N ILE 212.A O no hydrogen 2.686 N/A ARG 218.A NE GLY 216.A O no hydrogen 2.900 N/A ARG 218.A NH1 ASP 109.A OD1 no hydrogen 3.215 N/A ARG 218.A NH2 ASP 109.A OD2 no hydrogen 3.289 N/A ARG 218.A NH2 GLY 216.A O no hydrogen 3.507 N/A ILE 219.A N GLU 338.A OE2 no hydrogen 2.791 N/A HIS 222.A NE2 GLU 58.A OE2 no hydrogen 2.751 N/A SER 223.A N MET 220.A O no hydrogen 3.162 N/A SER 223.A OG MET 220.A O no hydrogen 2.834 N/A ARG 226.A NE ASP 273.A OD2 no hydrogen 2.744 N/A ARG 226.A NH2 ASP 273.A OD1 no hydrogen 2.865 N/A ARG 226.A NH2 ASP 273.A OD2 no hydrogen 3.426 N/A ARG 226.A NH2 THR 327.A O no hydrogen 2.758 N/A VAL 227.A N TYR 232.A OH no hydrogen 2.866 N/A GLY 228.A N GLY 225.A O no hydrogen 3.284 N/A LYS 229.A N LEU 277.A O no hydrogen 2.809 N/A GLY 230.A N GLY 228.A O no hydrogen 3.230 N/A ILE 231.A N ILE 335.A O no hydrogen 2.920 N/A TYR 232.A OH GLY 228.A O no hydrogen 2.725 N/A PHE 233.A N TYR 333.A O no hydrogen 2.907 N/A ALA 234.A N TRP 201.A O no hydrogen 3.014 N/A SER 235.A OG GLU 294.A OE2 no hydrogen 2.639 N/A ASN 237.A N THR 164.A OG1 no hydrogen 3.086 N/A SER 238.A N THR 164.A O no hydrogen 3.067 N/A LYS 239.A N GLU 236.A O no hydrogen 3.149 N/A LYS 239.A NZ TYR 243.A OH no hydrogen 2.760 N/A LYS 239.A NZ GLU 332.A OE2 no hydrogen 3.226 N/A SER 240.A N GLU 236.A O no hydrogen 3.390 N/A ALA 241.A N ASN 237.A O no hydrogen 2.795 N/A GLY 242.A N LYS 239.A O no hydrogen 3.339 N/A TYR 243.A N SER 240.A O no hydrogen 3.024 N/A VAL 244.A N ALA 241.A O no hydrogen 3.230 N/A MET 247.A N VAL 254.A O no hydrogen 3.024 N/A LYS 248.A NZ HIS 253.A ND1 no hydrogen 3.100 N/A CYS 249.A N HIS 252.A O no hydrogen 2.846 N/A VAL 254.A N MET 247.A O no hydrogen 3.097 N/A GLY 255.A N VAL 349.A O no hydrogen 2.815 N/A TYR 256.A OH GLU 348.A OE1 no hydrogen 2.728 N/A MET 257.A N LEU 347.A O no hydrogen 3.005 N/A PHE 258.A N HIS 202.A O no hydrogen 2.851 N/A LEU 259.A N TYR 345.A O no hydrogen 2.845 N/A GLY 260.A N LEU 200.A O no hydrogen 2.812 N/A GLU 261.A N ARG 342.A O no hydrogen 2.741 N/A VAL 262.A N LYS 198.A O no hydrogen 2.907 N/A ALA 263.A N GLN 340.A O no hydrogen 2.904 N/A LEU 264.A N ASN 196.A O no hydrogen 2.957 N/A GLY 265.A N GLY 195.A O no hydrogen 2.986 N/A ARG 266.A N ASP 285.A OD2 no hydrogen 2.844 N/A ARG 266.A NE GLY 283.A O no hydrogen 3.359 N/A HIS 268.A N SER 286.A O no hydrogen 2.977 N/A HIS 269.A NE2 GLU 267.A OE1 no hydrogen 2.768 N/A ILE 270.A N ILE 288.A O no hydrogen 2.979 N/A ASN 271.A ND2 SER 325.A O no hydrogen 3.032 N/A THR 272.A OG1 ASN 271.A OD1 no hydrogen 3.206 N/A ASN 274.A N ARG 226.A O no hydrogen 2.793 N/A SER 276.A OG ASN 274.A OD1 no hydrogen 2.879 N/A LEU 277.A N ASN 274.A O no hydrogen 3.487 N/A SER 279.A OG PRO 280.A O no hydrogen 3.469 N/A PHE 284.A N PRO 281.A O no hydrogen 3.096 N/A ASP 285.A N ARG 266.A O no hydrogen 2.826 N/A SER 286.A OG LEU 264.A O no hydrogen 2.687 N/A VAL 287.A N LEU 334.A O no hydrogen 2.987 N/A ILE 288.A N HIS 268.A O no hydrogen 2.800 N/A ALA 289.A N GLU 332.A O no hydrogen 2.855 N/A ARG 290.A N ILE 270.A O no hydrogen 2.997 N/A GLY 291.A N SER 331.A OG no hydrogen 2.797 N/A HIS 292.A N SER 329.A O no hydrogen 2.847 N/A HIS 292.A NE2 SER 326.A O no hydrogen 2.860 N/A THR 293.A OG1 GLU 236.A OE2 no hydrogen 2.890 N/A GLU 294.A N VAL 318.A O no hydrogen 3.018 N/A ASP 296.A N GLN 316.A O no hydrogen 3.028 N/A THR 298.A N ASP 296.A OD1 no hydrogen 3.206 N/A THR 298.A OG1 ASP 296.A OD1 no hydrogen 3.532 N/A GLN 299.A N ASP 296.A O no hydrogen 3.123 N/A ASP 300.A N PRO 297.A O no hydrogen 3.141 N/A THR 301.A N VAL 312.A O no hydrogen 3.003 N/A LEU 303.A N VAL 310.A O no hydrogen 2.844 N/A LEU 305.A N GLN 308.A O no hydrogen 2.796 N/A GLN 308.A N LEU 305.A O no hydrogen 2.948 N/A GLN 308.A NE2 SER 192.A O no hydrogen 3.481 N/A GLN 309.A NE2 GLU 302.A OE1 no hydrogen 2.809 N/A VAL 310.A N LEU 303.A O no hydrogen 2.793 N/A VAL 311.A N ARG 197.A O no hydrogen 2.841 N/A VAL 312.A N THR 301.A O no hydrogen 2.876 N/A GLN 314.A NE2 VAL 156.A O no hydrogen 2.860 N/A GLN 314.A NE2 PRO 313.A O no hydrogen 3.144 N/A VAL 318.A N GLU 294.A O no hydrogen 3.041 N/A CYS 320.A N HIS 292.A O no hydrogen 2.793 N/A PHE 323.A N CYS 320.A O no hydrogen 2.920 N/A SER 324.A N PRO 321.A O no hydrogen 3.235 N/A SER 324.A OG PRO 321.A O no hydrogen 3.160 N/A SER 326.A OG ARG 290.A O no hydrogen 2.643 N/A THR 327.A N ASN 271.A O no hydrogen 2.975 N/A THR 327.A OG1 ASN 271.A O no hydrogen 3.471 N/A THR 327.A OG1 ASP 273.A OD1 no hydrogen 2.733 N/A PHE 328.A N SER 326.A OG no hydrogen 3.089 N/A GLN 330.A NE2 GLU 236.A OE1 no hydrogen 2.715 N/A GLN 330.A NE2 SER 238.A OG no hydrogen 2.775 N/A SER 331.A OG GLU 294.A OE1 no hydrogen 2.635 N/A GLU 332.A N ALA 289.A O no hydrogen 2.980 N/A TYR 333.A N PHE 233.A O no hydrogen 2.796 N/A TYR 333.A OH GLU 294.A OE2 no hydrogen 2.651 N/A LEU 334.A N VAL 287.A O no hydrogen 2.805 N/A ILE 335.A N ILE 231.A O no hydrogen 3.474 N/A TYR 336.A OH VAL 227.A O no hydrogen 2.684 N/A GLN 337.A NE2 GLN 340.A OE1 no hydrogen 2.861 N/A SER 339.A OG HIS 191.A NE2 no hydrogen 2.975 N/A GLN 340.A N GLN 337.A O no hydrogen 3.172 N/A GLN 340.A NE2 ALA 263.A O no hydrogen 2.799 N/A GLN 340.A NE2 ASP 285.A O no hydrogen 2.825 N/A CYS 341.A N GLU 338.A O no hydrogen 3.272 N/A ARG 342.A N GLU 261.A O no hydrogen 2.938 N/A ARG 342.A NH2 ASN 180.A OD1 no hydrogen 3.431 N/A LEU 343.A N GLU 184.A OE1 no hydrogen 3.077 N/A ARG 344.A N LEU 259.A O no hydrogen 2.957 N/A ARG 344.A NE GLU 261.A OE1 no hydrogen 2.782 N/A ARG 344.A NH1 ASP 306.A OD2 no hydrogen 2.929 N/A ARG 344.A NH2 GLU 261.A OE1 no hydrogen 2.838 N/A ARG 344.A NH2 ASP 306.A OD2 no hydrogen 2.756 N/A TYR 345.A N LEU 259.A O no hydrogen 3.049 N/A LEU 346.A N TRP 177.A O no hydrogen 2.902 N/A LEU 347.A N MET 257.A O no hydrogen 2.847 N/A GLU 348.A N HIS 175.A O no hydrogen 2.816 N/A VAL 349.A N GLY 255.A O no hydrogen 2.860 N/A HIS 350.A N THR 172.A O no hydrogen 2.945 N/A HIS 350.A NE2 GLU 348.A OE2 no hydrogen 3.094 N/A