Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4l7l_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A NZ GLU 126.A O no hydrogen 3.410 N/A LYS 2.A NZ LYS 127.A O no hydrogen 2.466 N/A LYS 2.A NZ VAL 129.A O no hydrogen 2.725 N/A ARG 3.A N GLU 130.A O no hydrogen 3.280 N/A GLN 5.A N VAL 132.A O no hydrogen 2.825 N/A GLN 5.A NE2 GLU 131.A OE1 no hydrogen 2.666 N/A CYS 7.A SG HIS 134.A ND1 no hydrogen 3.754 N/A CYS 7.A SG ASP 137.A OD2 no hydrogen 3.821 N/A SER 8.A N ASP 137.A OD2 no hydrogen 2.789 N/A SER 8.A OG ASP 137.A OD1 no hydrogen 2.848 N/A ALA 12.A N ASP 10.A OD1 no hydrogen 2.921 N/A THR 13.A N ASP 10.A OD1 no hydrogen 3.030 N/A THR 13.A OG1 ASP 10.A OD1 no hydrogen 3.311 N/A THR 13.A OG1 ASP 10.A OD2 no hydrogen 2.655 N/A GLN 14.A N ASP 10.A O no hydrogen 2.996 N/A GLN 14.A NE2 LEU 9.A O no hydrogen 2.928 N/A LYS 15.A N PRO 11.A O no hydrogen 2.996 N/A LEU 16.A N ALA 12.A O no hydrogen 3.011 N/A ILE 17.A N THR 13.A O no hydrogen 2.920 N/A THR 18.A N GLN 14.A O no hydrogen 2.868 N/A THR 18.A OG1 GLN 14.A O no hydrogen 2.736 N/A ASN 19.A N LYS 15.A O no hydrogen 2.840 N/A ASN 19.A ND2 TYR 259.A OH no hydrogen 2.935 N/A ILE 20.A N LEU 16.A O no hydrogen 2.984 N/A PHE 21.A N ILE 17.A O no hydrogen 3.400 N/A SER 22.A N ASN 19.A O no hydrogen 3.413 N/A MET 25.A N SER 22.A OG no hydrogen 3.061 N/A PHE 26.A N SER 22.A O no hydrogen 2.966 N/A LYS 27.A N LYS 23.A O no hydrogen 2.805 N/A ASN 28.A N GLU 24.A O no hydrogen 2.715 N/A THR 29.A N MET 25.A O no hydrogen 2.818 N/A THR 29.A OG1 MET 25.A O no hydrogen 2.874 N/A MET 30.A N PHE 26.A O no hydrogen 2.973 N/A ALA 31.A N LYS 27.A O no hydrogen 2.840 N/A LEU 32.A N ASN 28.A O no hydrogen 3.010 N/A MET 33.A N THR 29.A O no hydrogen 3.081 N/A MET 33.A N MET 30.A O no hydrogen 2.939 N/A ASP 34.A N ALA 31.A O no hydrogen 3.057 N/A LEU 35.A N MET 30.A O no hydrogen 2.989 N/A ASP 36.A N PRO 83.A O no hydrogen 2.816 N/A LYS 38.A N ASP 36.A OD1 no hydrogen 3.059 N/A LYS 39.A N ASP 36.A OD1 no hydrogen 3.205 N/A LYS 44.A N PRO 41.A O no hydrogen 2.873 N/A LEU 45.A N PRO 41.A O no hydrogen 3.215 N/A LEU 45.A N LEU 42.A O no hydrogen 3.370 N/A LYS 47.A NZ GLU 114.A OE1 no hydrogen 2.610 N/A LYS 47.A NZ GLU 114.A OE2 no hydrogen 3.472 N/A GLN 49.A N SER 46.A OG no hydrogen 3.051 N/A GLN 49.A NE2 VAL 81.A O no hydrogen 3.015 N/A ILE 50.A N SER 46.A O no hydrogen 3.128 N/A ALA 51.A N LYS 47.A O no hydrogen 2.812 N/A ARG 52.A N GLN 48.A O no hydrogen 2.940 N/A GLY 53.A N GLN 49.A O no hydrogen 2.963 N/A PHE 54.A N ILE 50.A O no hydrogen 3.009 N/A GLU 55.A N ALA 51.A O no hydrogen 3.010 N/A ALA 56.A N ARG 52.A O no hydrogen 2.994 N/A LEU 57.A N GLY 53.A O no hydrogen 2.980 N/A GLU 58.A N PHE 54.A O no hydrogen 2.904 N/A ALA 59.A N GLU 55.A O no hydrogen 3.110 N/A LEU 60.A N ALA 56.A O no hydrogen 3.151 N/A GLU 61.A N LEU 57.A O no hydrogen 2.816 N/A GLU 62.A N GLU 58.A O no hydrogen 3.024 N/A ALA 63.A N ALA 59.A O no hydrogen 3.187 N/A LEU 64.A N LEU 60.A O no hydrogen 2.995 N/A LYS 65.A N GLU 61.A O no hydrogen 3.326 N/A LYS 65.A N GLU 62.A O no hydrogen 3.130 N/A LYS 65.A NZ GLU 61.A OE2 no hydrogen 2.834 N/A GLY 68.A N ASP 66.A OD1 no hydrogen 3.125 N/A GLU 73.A N SER 70.A OG no hydrogen 3.207 N/A LEU 74.A N SER 70.A O no hydrogen 3.075 N/A SER 75.A N LEU 71.A O no hydrogen 2.826 N/A SER 75.A OG LEU 71.A O no hydrogen 2.890 N/A SER 76.A N GLU 72.A O no hydrogen 2.921 N/A HIS 77.A N GLU 73.A O no hydrogen 3.007 N/A PHE 78.A N LEU 74.A O no hydrogen 3.118 N/A TYR 79.A N SER 75.A O no hydrogen 2.962 N/A TYR 79.A OH PRO 92.A O no hydrogen 2.476 N/A THR 80.A N SER 76.A O no hydrogen 3.070 N/A THR 80.A OG1 SER 76.A O no hydrogen 3.152 N/A VAL 81.A N HIS 77.A O no hydrogen 3.154 N/A ILE 82.A N PHE 78.A O no hydrogen 2.727 N/A HIS 84.A ND1 ILE 82.A O no hydrogen 2.695 N/A ASN 85.A N ASP 34.A O no hydrogen 2.726 N/A SER 89.A N PHE 86.A O no hydrogen 3.062 N/A ILE 94.A N SER 75.A OG no hydrogen 2.856 N/A GLU 98.A N GLU 98.A OE1 no hydrogen 2.891 N/A LEU 99.A N SER 96.A OG no hydrogen 3.130 N/A LEU 100.A N SER 96.A O no hydrogen 3.033 N/A GLN 101.A N PRO 97.A O no hydrogen 3.058 N/A GLN 101.A NE2 ASP 105.A OD1 no hydrogen 2.872 N/A GLN 101.A NE2 HIS 225.A O no hydrogen 3.157 N/A ALA 102.A N GLU 98.A O no hydrogen 3.158 N/A LYS 103.A N LEU 99.A O no hydrogen 3.012 N/A LYS 103.A NZ HIS 84.A NE2 no hydrogen 3.111 N/A LYS 104.A N LEU 100.A O no hydrogen 2.967 N/A LYS 104.A NZ GLU 61.A OE1 no hydrogen 2.781 N/A ASP 105.A N GLN 101.A O no hydrogen 2.761 N/A MET 106.A N ALA 102.A O no hydrogen 2.936 N/A LEU 107.A N LYS 103.A O no hydrogen 3.042 N/A LEU 108.A N LYS 104.A O no hydrogen 3.052 N/A VAL 109.A N ASP 105.A O no hydrogen 3.090 N/A LEU 110.A N MET 106.A O no hydrogen 2.808 N/A ALA 111.A N LEU 107.A O no hydrogen 2.815 N/A ASP 112.A N LEU 108.A O no hydrogen 3.299 N/A ASP 112.A N VAL 109.A O no hydrogen 3.008 N/A ILE 113.A N VAL 109.A O no hydrogen 3.073 N/A GLU 114.A N LEU 110.A O no hydrogen 2.998 N/A LEU 115.A N ALA 111.A O no hydrogen 2.927 N/A ALA 116.A N ASP 112.A O no hydrogen 3.192 N/A GLN 117.A N ILE 113.A O no hydrogen 2.958 N/A ALA 118.A N GLU 114.A O no hydrogen 2.828 N/A LEU 119.A N LEU 115.A O no hydrogen 2.869 N/A GLN 120.A N ALA 116.A O no hydrogen 3.357 N/A GLN 120.A N GLN 117.A O no hydrogen 3.098 N/A ALA 121.A N ALA 118.A O no hydrogen 3.078 N/A SER 123.A N GLU 126.A OE1 no hydrogen 2.792 N/A SER 123.A OG GLU 126.A OE1 no hydrogen 2.899 N/A GLU 126.A N SER 123.A OG no hydrogen 3.231 N/A LYS 127.A N SER 123.A O no hydrogen 3.305 N/A LYS 127.A N GLU 124.A O no hydrogen 3.039 N/A THR 128.A N GLU 124.A O no hydrogen 3.245 N/A THR 128.A N GLN 125.A O no hydrogen 3.019 N/A THR 128.A OG1 GLN 125.A O no hydrogen 3.141 N/A VAL 129.A N GLN 125.A O no hydrogen 2.975 N/A VAL 132.A N ARG 3.A O no hydrogen 2.840 N/A LEU 136.A N HIS 134.A ND1 no hydrogen 3.101 N/A ARG 138.A N HIS 134.A O no hydrogen 2.909 N/A ARG 138.A NE GLU 126.A OE2 no hydrogen 2.565 N/A ARG 138.A NH1 GLN 120.A O no hydrogen 2.921 N/A ARG 138.A NH1 ALA 121.A O no hydrogen 3.031 N/A ARG 138.A NH1 GLU 126.A OE1 no hydrogen 2.992 N/A ARG 138.A NH1 GLU 126.A OE2 no hydrogen 3.367 N/A ARG 138.A NH2 GLN 120.A O no hydrogen 2.939 N/A ASP 139.A N PRO 135.A O no hydrogen 2.952 N/A TYR 140.A N LEU 136.A O no hydrogen 2.860 N/A GLN 141.A N ASP 137.A O no hydrogen 2.998 N/A LEU 142.A N ARG 138.A O no hydrogen 2.997 N/A LEU 143.A N TYR 140.A O no hydrogen 3.095 N/A LYS 144.A N GLN 141.A O no hydrogen 3.063 N/A CYS 145.A SG GLN 146.A O no hydrogen 4.012 N/A GLN 146.A N ASN 183.A O no hydrogen 3.044 N/A LEU 147.A N TYR 140.A OH no hydrogen 3.035 N/A GLN 148.A N LYS 181.A O no hydrogen 3.016 N/A LEU 150.A N ILE 179.A O no hydrogen 2.876 N/A ALA 154.A N ASP 151.A O no hydrogen 3.044 N/A GLU 156.A N GLU 156.A OE1 no hydrogen 2.843 N/A TYR 157.A N ALA 154.A O no hydrogen 3.039 N/A ILE 160.A N GLU 156.A O no hydrogen 2.937 N/A GLN 161.A N TYR 157.A O no hydrogen 2.904 N/A THR 162.A N LYS 158.A O no hydrogen 2.841 N/A THR 162.A OG1 LYS 158.A O no hydrogen 2.551 N/A TYR 163.A N VAL 159.A O no hydrogen 3.024 N/A TYR 163.A OH LEU 202.A O no hydrogen 2.633 N/A LEU 164.A N ILE 160.A O no hydrogen 2.819 N/A GLU 165.A N GLN 161.A O no hydrogen 2.852 N/A GLN 166.A N THR 162.A O no hydrogen 2.867 N/A THR 167.A N TYR 163.A O no hydrogen 3.157 N/A THR 167.A OG1 TYR 163.A O no hydrogen 2.661 N/A GLY 168.A N LEU 164.A O no hydrogen 2.966 N/A CYS 173.A SG LEU 164.A O no hydrogen 3.698 N/A CYS 173.A SG PRO 174.A O no hydrogen 3.552 N/A THR 175.A N HIS 353.A O no hydrogen 2.977 N/A GLN 177.A N GLU 351.A O no hydrogen 2.884 N/A HIS 178.A N GLU 351.A O no hydrogen 3.498 N/A TRP 180.A N LEU 349.A O no hydrogen 2.803 N/A TRP 180.A NE1 THR 13.A OG1 no hydrogen 2.886 N/A LYS 181.A N GLN 148.A O no hydrogen 2.798 N/A VAL 182.A N ARG 347.A O no hydrogen 2.887 N/A ASN 183.A N GLN 146.A O no hydrogen 2.904 N/A ASN 183.A ND2 GLU 185.A OE1 no hydrogen 3.327 N/A GLU 187.A N GLN 184.A O no hydrogen 3.071 N/A ARG 190.A NH2 GLU 187.A OE2 no hydrogen 2.899 N/A PHE 191.A N GLU 187.A O no hydrogen 3.211 N/A GLN 192.A N GLU 188.A O no hydrogen 3.024 N/A ALA 193.A N ARG 190.A O no hydrogen 3.153 N/A HIS 194.A N PHE 191.A O no hydrogen 3.105 N/A HIS 194.A NE2 SER 342.A OG no hydrogen 2.609 N/A SER 195.A N GLN 192.A O no hydrogen 2.822 N/A LEU 197.A N HIS 194.A O no hydrogen 3.013 N/A ASN 199.A ND2 GLY 268.A O no hydrogen 2.708 N/A ASN 199.A ND2 GLU 270.A OE2 no hydrogen 2.665 N/A ARG 200.A NH1 GLU 264.A OE2 no hydrogen 2.703 N/A ARG 200.A NH2 LEU 197.A O no hydrogen 3.221 N/A LYS 201.A N VAL 265.A O no hydrogen 2.987 N/A LEU 202.A N VAL 314.A O no hydrogen 2.734 N/A LEU 203.A N GLY 263.A O no hydrogen 2.864 N/A TRP 204.A N ALA 237.A O no hydrogen 2.876 N/A HIS 205.A N PHE 261.A O no hydrogen 2.986 N/A HIS 205.A ND1 TYR 235.A O no hydrogen 2.586 N/A THR 207.A OG1 ASN 208.A O no hydrogen 3.179 N/A VAL 211.A N ASN 208.A O no hydrogen 3.187 N/A VAL 212.A N MET 209.A O no hydrogen 3.350 N/A ILE 215.A N VAL 211.A O no hydrogen 3.066 N/A LEU 216.A N VAL 212.A O no hydrogen 2.834 N/A THR 217.A N ALA 213.A O no hydrogen 2.890 N/A THR 217.A OG1 ALA 213.A O no hydrogen 2.625 N/A SER 218.A N ALA 214.A O no hydrogen 2.780 N/A SER 218.A OG ALA 214.A O no hydrogen 3.542 N/A GLY 219.A N ILE 215.A O no hydrogen 2.714 N/A ARG 221.A NE GLY 219.A O no hydrogen 2.957 N/A ARG 221.A NH1 ASP 112.A OD1 no hydrogen 2.862 N/A ARG 221.A NH2 ASP 112.A OD2 no hydrogen 3.012 N/A ILE 222.A N GLU 341.A OE2 no hydrogen 2.856 N/A MET 223.A N SER 226.A OG no hydrogen 2.840 N/A SER 226.A N MET 223.A O no hydrogen 2.958 N/A SER 226.A OG MET 223.A O no hydrogen 3.155 N/A ARG 229.A NE ASP 276.A OD2 no hydrogen 2.839 N/A ARG 229.A NH2 ASP 276.A OD1 no hydrogen 2.897 N/A ARG 229.A NH2 ASP 276.A OD2 no hydrogen 3.491 N/A ARG 229.A NH2 THR 330.A O no hydrogen 2.706 N/A VAL 230.A N TYR 235.A OH no hydrogen 2.884 N/A GLY 231.A N GLY 228.A O no hydrogen 3.167 N/A LYS 232.A N LEU 280.A O no hydrogen 2.896 N/A ILE 234.A N ILE 338.A O no hydrogen 3.016 N/A TYR 235.A OH GLY 231.A O no hydrogen 2.665 N/A PHE 236.A N TYR 336.A O no hydrogen 2.808 N/A ALA 237.A N TRP 204.A O no hydrogen 2.908 N/A SER 238.A OG GLU 297.A OE2 no hydrogen 2.727 N/A ASN 240.A N THR 167.A OG1 no hydrogen 3.028 N/A SER 241.A N THR 167.A O no hydrogen 3.211 N/A LYS 242.A N GLU 239.A O no hydrogen 3.074 N/A ALA 244.A N ASN 240.A O no hydrogen 2.777 N/A GLY 245.A N LYS 242.A O no hydrogen 3.167 N/A TYR 246.A N SER 243.A O no hydrogen 2.960 N/A VAL 247.A N ALA 244.A O no hydrogen 3.130 N/A MET 250.A N VAL 257.A O no hydrogen 3.007 N/A LYS 251.A NZ HIS 256.A NE2 no hydrogen 2.907 N/A CYS 252.A N HIS 255.A O no hydrogen 2.904 N/A CYS 252.A SG MET 250.A O no hydrogen 3.955 N/A HIS 255.A N CYS 252.A O no hydrogen 3.257 N/A VAL 257.A N MET 250.A O no hydrogen 2.882 N/A GLY 258.A N VAL 352.A O no hydrogen 2.931 N/A TYR 259.A OH GLU 351.A OE1 no hydrogen 2.853 N/A MET 260.A N LEU 350.A O no hydrogen 3.008 N/A PHE 261.A N HIS 205.A O no hydrogen 3.006 N/A LEU 262.A N TYR 348.A O no hydrogen 2.918 N/A GLY 263.A N LEU 203.A O no hydrogen 2.784 N/A GLU 264.A N ARG 345.A O no hydrogen 2.902 N/A VAL 265.A N LYS 201.A O no hydrogen 2.908 N/A ALA 266.A N GLN 343.A O no hydrogen 2.878 N/A LEU 267.A N ASN 199.A O no hydrogen 2.904 N/A ARG 269.A N ASP 288.A OD2 no hydrogen 2.724 N/A HIS 271.A N SER 289.A O no hydrogen 2.950 N/A HIS 272.A NE2 GLU 270.A OE1 no hydrogen 2.891 N/A ILE 273.A N ILE 291.A O no hydrogen 2.939 N/A THR 275.A OG1 ASN 274.A OD1 no hydrogen 2.816 N/A ASN 277.A N ARG 229.A O no hydrogen 2.794 N/A SER 279.A N ASN 277.A OD1 no hydrogen 3.278 N/A SER 279.A OG ASN 277.A OD1 no hydrogen 2.922 N/A LEU 280.A N ASN 277.A O no hydrogen 3.479 N/A SER 282.A OG PRO 283.A O no hydrogen 3.064 N/A PHE 287.A N PRO 284.A O no hydrogen 3.077 N/A ASP 288.A N ARG 269.A O no hydrogen 3.045 N/A SER 289.A OG LEU 267.A O no hydrogen 2.520 N/A VAL 290.A N LEU 337.A O no hydrogen 3.130 N/A ILE 291.A N HIS 271.A O no hydrogen 2.841 N/A ALA 292.A N GLU 335.A O no hydrogen 2.822 N/A ARG 293.A N ILE 273.A O no hydrogen 2.999 N/A GLY 294.A N SER 334.A OG no hydrogen 2.827 N/A HIS 295.A N PHE 331.A O no hydrogen 3.187 N/A HIS 295.A NE2 SER 329.A O no hydrogen 2.582 N/A THR 296.A OG1 GLU 239.A OE1 no hydrogen 3.542 N/A THR 296.A OG1 GLU 239.A OE2 no hydrogen 2.748 N/A GLU 297.A N VAL 321.A O no hydrogen 2.995 N/A ASP 299.A N GLN 319.A O no hydrogen 2.872 N/A THR 301.A N ASP 299.A OD1 no hydrogen 3.091 N/A THR 301.A OG1 ASP 299.A OD1 no hydrogen 2.745 N/A THR 301.A OG1 ASP 299.A OD2 no hydrogen 2.963 N/A THR 301.A OG1 GLN 302.A OE1 no hydrogen 3.316 N/A GLN 302.A N ASP 299.A O no hydrogen 2.980 N/A ASP 303.A N PRO 300.A O no hydrogen 3.013 N/A THR 304.A N VAL 315.A O no hydrogen 2.825 N/A GLU 305.A N THR 304.A OG1 no hydrogen 2.797 N/A LEU 306.A N VAL 313.A O no hydrogen 2.867 N/A LEU 308.A N GLN 311.A O no hydrogen 3.006 N/A GLN 311.A N LEU 308.A O no hydrogen 3.007 N/A GLN 311.A NE2 SER 195.A O no hydrogen 3.036 N/A GLN 312.A NE2 GLU 305.A OE1 no hydrogen 2.709 N/A VAL 313.A N LEU 306.A O no hydrogen 2.727 N/A VAL 314.A N ARG 200.A O no hydrogen 2.924 N/A VAL 315.A N THR 304.A O no hydrogen 2.838 N/A GLN 317.A NE2 VAL 159.A O no hydrogen 2.921 N/A GLN 317.A NE2 PRO 316.A O no hydrogen 2.860 N/A VAL 321.A N GLU 297.A O no hydrogen 2.842 N/A CYS 323.A N HIS 295.A O no hydrogen 2.991 N/A PHE 326.A N CYS 323.A O no hydrogen 2.836 N/A SER 327.A N PRO 324.A O no hydrogen 3.313 N/A SER 327.A OG PRO 324.A O no hydrogen 3.093 N/A SER 329.A N PHE 326.A O no hydrogen 2.892 N/A SER 329.A OG ASN 274.A O no hydrogen 3.458 N/A SER 329.A OG ARG 293.A O no hydrogen 2.660 N/A THR 330.A N ASN 274.A O no hydrogen 2.948 N/A THR 330.A OG1 ASN 274.A O no hydrogen 3.476 N/A THR 330.A OG1 ASP 276.A OD1 no hydrogen 2.644 N/A PHE 331.A N SER 329.A OG no hydrogen 3.019 N/A GLN 333.A NE2 GLU 239.A OE1 no hydrogen 2.957 N/A GLN 333.A NE2 SER 241.A OG no hydrogen 2.936 N/A SER 334.A OG GLU 297.A OE1 no hydrogen 2.611 N/A GLU 335.A N ALA 292.A O no hydrogen 2.924 N/A TYR 336.A N PHE 236.A O no hydrogen 2.802 N/A TYR 336.A OH GLU 297.A OE2 no hydrogen 2.668 N/A LEU 337.A N VAL 290.A O no hydrogen 2.783 N/A ILE 338.A N ILE 234.A O no hydrogen 3.313 N/A TYR 339.A OH VAL 230.A O no hydrogen 2.592 N/A GLN 340.A NE2 GLN 343.A OE1 no hydrogen 3.002 N/A SER 342.A OG HIS 194.A NE2 no hydrogen 2.609 N/A GLN 343.A N GLN 340.A O no hydrogen 3.161 N/A GLN 343.A NE2 ALA 266.A O no hydrogen 2.652 N/A GLN 343.A NE2 ASP 288.A O no hydrogen 3.015 N/A CYS 344.A N GLU 341.A O no hydrogen 3.355 N/A ARG 345.A N GLU 264.A O no hydrogen 2.990 N/A LEU 346.A N GLU 187.A OE1 no hydrogen 2.843 N/A ARG 347.A N LEU 262.A O no hydrogen 2.991 N/A ARG 347.A NE GLU 264.A OE1 no hydrogen 2.845 N/A ARG 347.A NH1 ASP 309.A OD2 no hydrogen 3.098 N/A ARG 347.A NH2 GLU 264.A OE1 no hydrogen 2.823 N/A ARG 347.A NH2 ASP 309.A OD2 no hydrogen 3.005 N/A TYR 348.A N LEU 262.A O no hydrogen 3.147 N/A TYR 348.A OH GLU 156.A OE2 no hydrogen 2.642 N/A LEU 349.A N TRP 180.A O no hydrogen 2.913 N/A LEU 350.A N MET 260.A O no hydrogen 2.769 N/A GLU 351.A N HIS 178.A O no hydrogen 2.894 N/A VAL 352.A N GLY 258.A O no hydrogen 2.773 N/A HIS 353.A N THR 175.A O no hydrogen 2.967 N/A HIS 353.A NE2 GLU 351.A OE2 no hydrogen 3.029 N/A