Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4qfr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A NZ GLU 28.A OE2 no hydrogen 2.815 N/A ILE 5.A N TYR 8.A O no hydrogen 3.050 N/A HIS 7.A ND1 GLU 28.A OE1 no hydrogen 3.063 N/A TYR 8.A N ILE 5.A O no hydrogen 3.323 N/A TYR 8.A OH HIS 32.A ND1 no hydrogen 2.836 N/A ILE 9.A N LYS 26.A O no hydrogen 2.743 N/A LEU 10.A N VAL 3.A O no hydrogen 2.763 N/A GLY 11.A N VAL 24.A O no hydrogen 2.784 N/A LEU 14.A N VAL 22.A O no hydrogen 2.665 N/A THR 18.A OG1 ASP 149.A OD1 no hydrogen 3.094 N/A VAL 22.A N GLY 15.A O no hydrogen 2.933 N/A LYS 23.A N VAL 36.A O no hydrogen 3.055 N/A LYS 23.A NZ THR 13.A OG1 no hydrogen 2.888 N/A VAL 24.A N ASP 12.A O no hydrogen 2.996 N/A GLY 25.A N VAL 34.A O no hydrogen 2.763 N/A LYS 26.A N ILE 9.A O no hydrogen 2.973 N/A HIS 27.A N HIS 32.A O no hydrogen 2.782 N/A GLU 28.A N HIS 7.A O no hydrogen 2.791 N/A LEU 29.A N HIS 27.A ND1 no hydrogen 3.119 N/A THR 30.A N HIS 27.A ND1 no hydrogen 3.046 N/A GLY 31.A N HIS 27.A O no hydrogen 2.808 N/A HIS 32.A N THR 30.A OG1 no hydrogen 3.257 N/A HIS 32.A ND1 TYR 8.A OH no hydrogen 2.836 N/A VAL 34.A N GLY 25.A O no hydrogen 2.721 N/A ALA 35.A N MET 85.A O no hydrogen 2.963 N/A VAL 36.A N LYS 23.A O no hydrogen 2.728 N/A LYS 37.A N MET 83.A O no hydrogen 2.817 N/A LYS 37.A NZ GLU 56.A OE2 no hydrogen 3.381 N/A ILE 38.A N LYS 21.A O no hydrogen 2.810 N/A LEU 39.A N ILE 81.A O no hydrogen 2.770 N/A ARG 41.A N SER 79.A O no hydrogen 3.208 N/A ARG 41.A NE THR 77.A O no hydrogen 3.302 N/A ARG 41.A NE PRO 78.A O no hydrogen 3.325 N/A ARG 41.A NH2 PRO 78.A O no hydrogen 3.210 N/A LYS 43.A N ASN 40.A OD1 no hydrogen 3.179 N/A ILE 44.A N ASN 40.A O no hydrogen 2.758 N/A ARG 45.A N ARG 41.A O no hydrogen 2.997 N/A SER 46.A N GLN 42.A O no hydrogen 3.242 N/A SER 46.A OG GLN 42.A O no hydrogen 3.357 N/A LEU 47.A N LYS 43.A O no hydrogen 3.409 N/A VAL 49.A N LEU 47.A O no hydrogen 2.811 N/A ILE 53.A N VAL 49.A O no hydrogen 3.040 N/A ARG 54.A N VAL 50.A O no hydrogen 3.060 N/A ARG 55.A N GLY 51.A O no hydrogen 3.081 N/A GLU 56.A N LYS 52.A O no hydrogen 2.859 N/A ILE 57.A N ILE 53.A O no hydrogen 2.859 N/A GLN 58.A N ARG 54.A O no hydrogen 3.072 N/A ASN 59.A N ARG 55.A O no hydrogen 2.910 N/A LEU 60.A N GLU 56.A O no hydrogen 3.166 N/A LYS 61.A N ILE 57.A O no hydrogen 2.962 N/A LYS 61.A NZ GLN 73.A OE1 no hydrogen 3.163 N/A LEU 62.A N ASN 59.A O no hydrogen 2.909 N/A ARG 64.A N TYR 121.A OH no hydrogen 2.849 N/A HIS 65.A NE2 SER 117.A OG no hydrogen 2.787 N/A HIS 67.A N HIS 65.A ND1 no hydrogen 2.847 N/A HIS 67.A ND1 ALA 145.A O no hydrogen 2.748 N/A HIS 67.A NE2 TYR 266.A OH no hydrogen 3.182 N/A ILE 68.A N HIS 65.A O no hydrogen 3.295 N/A ILE 69.A N ILE 147.A O no hydrogen 3.103 N/A LYS 70.A N GLU 86.A OE1 no hydrogen 3.186 N/A LYS 70.A NZ GLU 86.A OE1 no hydrogen 3.129 N/A GLN 73.A N VAL 84.A O no hydrogen 3.348 N/A VAL 74.A N GLN 73.A OE1 no hydrogen 3.298 N/A ILE 75.A N PHE 82.A O no hydrogen 2.795 N/A THR 77.A N ASP 80.A O no hydrogen 2.927 N/A THR 77.A OG1 SER 79.A OG no hydrogen 3.412 N/A THR 77.A OG1 ASP 80.A O no hydrogen 2.759 N/A SER 79.A OG THR 77.A OG1 no hydrogen 3.412 N/A SER 79.A OG ASP 80.A OD1 no hydrogen 3.292 N/A ASP 80.A N THR 77.A OG1 no hydrogen 3.114 N/A ILE 81.A N LEU 39.A O no hydrogen 2.782 N/A PHE 82.A N ILE 75.A O no hydrogen 2.829 N/A MET 83.A N LYS 37.A O no hydrogen 2.811 N/A VAL 84.A N GLN 73.A O no hydrogen 2.771 N/A MET 85.A N ALA 35.A O no hydrogen 2.751 N/A GLU 86.A N LYS 70.A O no hydrogen 2.975 N/A LEU 93.A N VAL 137.A O no hydrogen 2.850 N/A PHE 94.A N PRO 134.A O no hydrogen 3.130 N/A TYR 96.A N GLU 92.A O no hydrogen 3.400 N/A ILE 97.A N LEU 93.A O no hydrogen 2.915 N/A CYS 98.A N PHE 94.A O no hydrogen 2.952 N/A CYS 98.A N ASP 95.A O no hydrogen 3.140 N/A CYS 98.A SG PHE 94.A O no hydrogen 3.512 N/A LYS 99.A N ASP 95.A O no hydrogen 2.957 N/A ASN 100.A N TYR 96.A O no hydrogen 2.973 N/A ASN 100.A ND2 TYR 96.A O no hydrogen 2.905 N/A LEU 103.A N LEU 198.A O no hydrogen 2.875 N/A SER 108.A N ASP 104.A O no hydrogen 2.953 N/A SER 108.A OG ASP 104.A O no hydrogen 2.803 N/A SER 108.A OG LEU 198.A O no hydrogen 3.343 N/A ARG 109.A N GLU 105.A O no hydrogen 3.040 N/A ARG 109.A NH1 TRP 258.A O no hydrogen 2.791 N/A ARG 110.A N LYS 106.A O no hydrogen 3.208 N/A ARG 110.A NH2 HIS 142.A O no hydrogen 3.072 N/A ARG 110.A NH2 MET 143.A O no hydrogen 2.689 N/A ARG 110.A NH2 ASN 144.A OD1 no hydrogen 3.302 N/A LEU 111.A N GLU 107.A O no hydrogen 3.205 N/A PHE 112.A N SER 108.A O no hydrogen 2.832 N/A GLN 113.A N ARG 109.A O no hydrogen 2.853 N/A GLN 113.A NE2 PHE 259.A O no hydrogen 2.765 N/A GLN 113.A NE2 GLN 261.A O no hydrogen 3.001 N/A GLN 114.A N ARG 110.A O no hydrogen 3.134 N/A GLN 114.A NE2 ASN 144.A OD1 no hydrogen 3.299 N/A ILE 115.A N LEU 111.A O no hydrogen 2.878 N/A LEU 116.A N PHE 112.A O no hydrogen 2.923 N/A SER 117.A N GLN 113.A O no hydrogen 2.893 N/A SER 117.A OG HIS 65.A NE2 no hydrogen 2.787 N/A GLY 118.A N GLN 114.A O no hydrogen 3.250 N/A VAL 119.A N ILE 115.A O no hydrogen 2.969 N/A ASP 120.A N LEU 116.A O no hydrogen 2.806 N/A TYR 121.A N SER 117.A O no hydrogen 2.970 N/A CYS 122.A N GLY 118.A O no hydrogen 3.015 N/A CYS 122.A SG GLY 118.A O no hydrogen 3.562 N/A HIS 123.A N VAL 119.A O no hydrogen 3.294 N/A HIS 123.A NE2 ASP 187.A OD2 no hydrogen 3.014 N/A ARG 124.A N ASP 120.A O no hydrogen 2.881 N/A ARG 124.A NH1 ASP 120.A OD1 no hydrogen 3.249 N/A ARG 124.A NH1 ASP 120.A OD2 no hydrogen 2.794 N/A HIS 125.A N CYS 122.A O no hydrogen 2.898 N/A MET 126.A N HIS 123.A O no hydrogen 3.011 N/A VAL 127.A N CYS 122.A O no hydrogen 2.835 N/A VAL 128.A N ASN 154.A O no hydrogen 2.937 N/A ARG 130.A NE LEU 152.A O no hydrogen 2.797 N/A ARG 130.A NH1 TYR 181.A OH no hydrogen 2.762 N/A ARG 130.A NH2 LEU 152.A O no hydrogen 2.818 N/A ARG 130.A NH2 SER 153.A O no hydrogen 3.546 N/A LYS 133.A NZ ASP 131.A OD1 no hydrogen 2.817 N/A GLU 135.A N GLU 135.A OE1 no hydrogen 2.783 N/A ASN 136.A N LYS 133.A O no hydrogen 2.768 N/A ASN 136.A ND2 ASP 131.A O no hydrogen 2.794 N/A ASN 136.A ND2 ASP 131.A OD2 no hydrogen 3.161 N/A VAL 137.A N PRO 134.A O no hydrogen 3.315 N/A LEU 138.A N LYS 146.A O no hydrogen 2.955 N/A LEU 139.A N GLY 91.A O no hydrogen 2.780 N/A ASP 140.A N ASN 144.A O no hydrogen 3.213 N/A MET 143.A N ASP 140.A O no hydrogen 2.960 N/A ASN 144.A N ASP 140.A OD1 no hydrogen 2.778 N/A ASN 144.A ND2 ASP 140.A OD2 no hydrogen 3.036 N/A ALA 145.A N GLN 114.A OE1 no hydrogen 3.030 N/A LYS 146.A NZ PRO 66.A O no hydrogen 2.698 N/A LYS 146.A NZ GLU 86.A OE1 no hydrogen 3.170 N/A ILE 147.A N HIS 67.A O no hydrogen 2.772 N/A ALA 148.A N ASN 136.A O no hydrogen 2.998 N/A GLY 151.A N ASP 149.A OD1 no hydrogen 3.395 N/A SER 153.A OG PHE 150.A O no hydrogen 3.272 N/A ASN 154.A N VAL 128.A O no hydrogen 2.972 N/A MET 155.A N ASN 154.A OD1 no hydrogen 3.315 N/A MET 156.A N MET 126.A O no hydrogen 2.783 N/A GLU 160.A N SER 157.A O no hydrogen 3.006 N/A LEU 162.A N TYR 181.A O no hydrogen 2.758 N/A SER 164.A OG VAL 175.A O no hydrogen 3.154 N/A CYS 165.A SG LEU 152.A O no hydrogen 3.707 N/A ASN 169.A ND2 PHE 205.A O no hydrogen 3.179 N/A GLU 174.A N GLU 174.A OE1 no hydrogen 2.971 N/A VAL 175.A N ALA 172.A O no hydrogen 3.158 N/A ILE 176.A N ALA 172.A O no hydrogen 3.028 N/A SER 177.A N PRO 173.A O no hydrogen 2.802 N/A SER 177.A OG PRO 173.A O no hydrogen 2.716 N/A GLY 178.A N VAL 175.A O no hydrogen 2.799 N/A ARG 179.A N GLU 174.A O no hydrogen 2.746 N/A TYR 181.A N LEU 162.A O no hydrogen 3.145 N/A ALA 182.A N GLU 185.A OE2 no hydrogen 3.126 N/A GLY 183.A N GLU 185.A OE1 no hydrogen 2.884 N/A GLU 185.A N GLU 185.A OE1 no hydrogen 3.027 N/A VAL 186.A N GLY 183.A O no hydrogen 3.187 N/A ASP 187.A N PRO 184.A O no hydrogen 3.041 N/A ILE 188.A N PRO 184.A O no hydrogen 3.175 N/A ILE 188.A N GLU 185.A O no hydrogen 3.270 N/A TRP 189.A N GLU 185.A O no hydrogen 3.204 N/A SER 190.A N VAL 186.A O no hydrogen 3.296 N/A SER 190.A OG TYR 170.A O no hydrogen 3.060 N/A SER 190.A OG VAL 186.A O no hydrogen 2.994 N/A SER 191.A N ASP 187.A O no hydrogen 3.001 N/A SER 191.A OG ASP 187.A O no hydrogen 2.686 N/A GLY 192.A N ILE 188.A O no hydrogen 2.776 N/A VAL 193.A N TRP 189.A O no hydrogen 3.314 N/A ILE 194.A N SER 190.A O no hydrogen 3.095 N/A LEU 195.A N SER 191.A O no hydrogen 2.957 N/A TYR 196.A N GLY 192.A O no hydrogen 3.018 N/A TYR 196.A OH TYR 223.A O no hydrogen 2.656 N/A ALA 197.A N VAL 193.A O no hydrogen 2.859 N/A LEU 198.A N ILE 194.A O no hydrogen 2.790 N/A LEU 199.A N LEU 195.A O no hydrogen 3.068 N/A CYS 200.A N TYR 196.A O no hydrogen 2.858 N/A GLY 201.A N ALA 197.A O no hydrogen 2.848 N/A HIS 209.A N ASP 207.A OD1 no hydrogen 3.310 N/A THR 212.A OG1 HIS 209.A O no hydrogen 2.881 N/A LEU 213.A N HIS 209.A O no hydrogen 3.056 N/A PHE 214.A N VAL 210.A O no hydrogen 2.871 N/A LYS 215.A N PRO 211.A O no hydrogen 2.956 N/A LYS 216.A N THR 212.A O no hydrogen 3.004 N/A LYS 216.A NZ ASP 206.A O no hydrogen 3.398 N/A LYS 216.A NZ ASP 207.A OD2 no hydrogen 2.789 N/A ILE 217.A N LEU 213.A O no hydrogen 3.030 N/A CYS 218.A N PHE 214.A O no hydrogen 3.253 N/A CYS 218.A SG PHE 214.A O no hydrogen 3.233 N/A ASP 219.A N LYS 215.A O no hydrogen 2.747 N/A ASP 219.A N LYS 216.A O no hydrogen 3.178 N/A GLY 220.A N ILE 217.A O no hydrogen 3.386 N/A TYR 227.A OH CYS 200.A O no hydrogen 3.268 N/A LEU 228.A N PRO 225.A O no hydrogen 3.127 N/A ASN 229.A ND2 GLU 105.A OE1 no hydrogen 3.528 N/A ASN 229.A ND2 GLU 105.A OE2 no hydrogen 3.226 N/A SER 231.A N ASN 229.A OD1 no hydrogen 2.841 N/A ILE 233.A N ASN 229.A O no hydrogen 2.904 N/A SER 234.A N PRO 230.A O no hydrogen 2.750 N/A LEU 235.A N SER 231.A O no hydrogen 3.195 N/A LEU 236.A N VAL 232.A O no hydrogen 2.789 N/A LYS 237.A N ILE 233.A O no hydrogen 2.913 N/A HIS 238.A N SER 234.A O no hydrogen 3.189 N/A MET 239.A N LEU 235.A O no hydrogen 3.062 N/A LEU 240.A N LEU 236.A O no hydrogen 3.008 N/A GLN 241.A NE2 LYS 237.A O no hydrogen 3.203 N/A MET 245.A N ASP 243.A OD1 no hydrogen 2.824 N/A LYS 246.A N ASP 243.A O no hydrogen 2.901 N/A ARG 247.A N PRO 244.A O no hydrogen 3.237 N/A ARG 247.A NE GLN 241.A O no hydrogen 2.936 N/A ARG 247.A NH1 GLU 174.A OE1 no hydrogen 3.542 N/A ARG 247.A NH1 GLU 174.A OE2 no hydrogen 2.872 N/A ARG 247.A NH1 GLU 185.A O no hydrogen 3.129 N/A ARG 247.A NH2 GLU 174.A OE1 no hydrogen 2.842 N/A ARG 247.A NH2 GLN 241.A O no hydrogen 2.831 N/A ARG 247.A NH2 VAL 242.A O no hydrogen 3.358 N/A ALA 248.A N HIS 238.A O no hydrogen 2.868 N/A THR 249.A N ASP 252.A OD2 no hydrogen 3.303 N/A LYS 251.A NZ GLU 255.A OE2 no hydrogen 3.149 N/A ASP 252.A N THR 249.A OG1 no hydrogen 3.330 N/A ILE 253.A N THR 249.A O no hydrogen 3.114 N/A ARG 254.A N ILE 250.A O no hydrogen 2.806 N/A GLU 255.A N LYS 251.A O no hydrogen 2.942 N/A HIS 256.A N ILE 253.A O no hydrogen 2.923 N/A TRP 258.A N HIS 256.A ND1 no hydrogen 2.918 N/A TRP 258.A NE1 GLU 105.A OE1 no hydrogen 2.918 N/A LYS 260.A N HIS 256.A O no hydrogen 2.984 N/A LYS 260.A NZ GLU 257.A OE1 no hydrogen 3.084 N/A LEU 263.A N LYS 260.A O no hydrogen 3.440 N/A TYR 266.A OH HIS 67.A NE2 no hydrogen 3.182 N/A ILE 274.A N LEU 335.A O no hydrogen 3.338 N/A ARG 279.A N ASP 282.A OD2 no hydrogen 3.307 N/A ASP 282.A N ARG 279.A O no hydrogen 2.771 N/A ILE 283.A N ARG 279.A O no hydrogen 3.237 N/A MET 284.A N PRO 280.A O no hydrogen 3.279 N/A ALA 285.A N ASN 281.A O no hydrogen 3.178 N/A GLU 286.A N ASP 282.A O no hydrogen 2.779 N/A VAL 287.A N ILE 283.A O no hydrogen 2.821 N/A CYS 288.A N MET 284.A O no hydrogen 3.150 N/A CYS 288.A SG MET 284.A O no hydrogen 3.307 N/A ARG 289.A N ALA 285.A O no hydrogen 2.848 N/A ALA 290.A N VAL 287.A O no hydrogen 3.046 N/A ILE 291.A N VAL 287.A O no hydrogen 2.798 N/A LYS 292.A N CYS 288.A O no hydrogen 3.235 N/A LEU 294.A N ILE 291.A O no hydrogen 3.218 N/A ASP 295.A N LYS 292.A O no hydrogen 3.087 N/A LYS 299.A N ARG 307.A O no hydrogen 2.858 N/A VAL 301.A N TYR 305.A O no hydrogen 3.193 N/A LEU 306.A N LEU 323.A O no hydrogen 2.841 N/A ARG 307.A N LYS 299.A O no hydrogen 3.161 N/A VAL 308.A N MET 321.A O no hydrogen 2.987 N/A ARG 309.A N GLU 297.A O no hydrogen 2.695 N/A ARG 309.A NH1 GLU 297.A OE1 no hydrogen 3.327 N/A ARG 310.A N SER 319.A O no hydrogen 3.149 N/A VAL 314.A N ASN 312.A OD1 no hydrogen 2.799 N/A THR 315.A N ASN 312.A OD1 no hydrogen 2.975 N/A THR 315.A OG1 THR 317.A OG1 no hydrogen 3.091 N/A SER 316.A OG VAL 314.A O no hydrogen 3.385 N/A THR 317.A OG1 THR 315.A OG1 no hydrogen 3.091 N/A SER 319.A N ARG 310.A O no hydrogen 3.086 N/A SER 319.A OG GLU 347.A OE1 no hydrogen 3.563 N/A MET 321.A N VAL 308.A O no hydrogen 2.998 N/A SER 322.A N ARG 338.A O no hydrogen 2.803 N/A LEU 323.A N LEU 306.A O no hydrogen 2.823 N/A GLN 324.A N ASP 336.A O no hydrogen 2.992 N/A GLN 324.A NE2 LEU 325.A O no hydrogen 2.816 N/A LEU 325.A N TYR 304.A O no hydrogen 2.988 N/A TYR 326.A N LEU 334.A O no hydrogen 2.949 N/A GLN 327.A NE2 ASP 329.A O no hydrogen 3.124 N/A VAL 328.A N THR 332.A O no hydrogen 3.061 N/A ASP 329.A N THR 332.A O no hydrogen 2.820 N/A TYR 333.A N SER 276.A O no hydrogen 3.345 N/A LEU 334.A N TYR 326.A O no hydrogen 2.977 N/A LEU 335.A N ILE 274.A O no hydrogen 2.862 N/A ASP 336.A N GLN 324.A O no hydrogen 2.755 N/A ARG 338.A N SER 322.A O no hydrogen 2.877 N/A SER 339.A OG HIS 344.A NE2 no hydrogen 3.376 N/A ILE 340.A N LYS 320.A O no hydrogen 3.269 N/A GLU 347.A N SER 343.A O no hydrogen 2.979 N/A PHE 348.A N HIS 344.A O no hydrogen 2.990 N/A PHE 349.A N THR 345.A O no hydrogen 3.041 N/A GLU 350.A N ILE 346.A O no hydrogen 2.998 N/A MET 351.A N GLU 347.A O no hydrogen 3.089 N/A CYS 352.A N PHE 348.A O no hydrogen 3.151 N/A CYS 352.A SG PHE 348.A O no hydrogen 3.373 N/A ALA 353.A N PHE 349.A O no hydrogen 2.906 N/A ASN 354.A N GLU 350.A O no hydrogen 3.280 N/A ASN 354.A ND2 TYR 296.A OH no hydrogen 3.316 N/A ILE 356.A N CYS 352.A O no hydrogen 3.234 N/A ILE 356.A N ALA 353.A O no hydrogen 2.976 N/A LYS 357.A N ALA 353.A O no hydrogen 3.126 N/A LEU 359.A N ILE 356.A O no hydrogen 2.789 N/A