Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5xsu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A N ASP 127.A OD1 no hydrogen 3.289 N/A GLN 9.A N PRO 5.A O no hydrogen 3.009 N/A ASP 10.A N LYS 6.A O no hydrogen 2.717 N/A LEU 11.A N PRO 7.A O no hydrogen 2.900 N/A ILE 12.A N VAL 8.A O no hydrogen 2.903 N/A LYS 13.A N GLN 9.A O no hydrogen 2.896 N/A MET 14.A N ASP 10.A O no hydrogen 3.023 N/A ILE 15.A N LEU 11.A O no hydrogen 3.089 N/A PHE 16.A N ILE 12.A O no hydrogen 3.128 N/A GLU 19.A N ASP 17.A OD1 no hydrogen 3.256 N/A SER 20.A OG ASP 17.A OD2 no hydrogen 2.495 N/A MET 21.A N ASP 17.A O no hydrogen 3.298 N/A LYS 22.A N VAL 18.A O no hydrogen 3.101 N/A LYS 23.A N GLU 19.A O no hydrogen 2.880 N/A LYS 23.A NZ GLU 19.A OE2 no hydrogen 3.520 N/A ALA 24.A N SER 20.A O no hydrogen 2.915 N/A MET 25.A N MET 21.A O no hydrogen 3.107 N/A VAL 26.A N LYS 22.A O no hydrogen 2.882 N/A GLU 27.A N LYS 23.A O no hydrogen 2.846 N/A TYR 28.A N ALA 24.A O no hydrogen 3.043 N/A TYR 28.A OH ASN 106.A OD1 no hydrogen 2.914 N/A GLU 29.A N VAL 26.A O no hydrogen 2.752 N/A ILE 30.A N MET 25.A O no hydrogen 3.065 N/A ASP 31.A N PRO 80.A O no hydrogen 2.956 N/A MET 35.A N ASP 31.A O no hydrogen 2.816 N/A LYS 39.A N PRO 36.A O no hydrogen 2.907 N/A LEU 40.A N LEU 37.A O no hydrogen 3.272 N/A GLN 44.A N SER 41.A OG no hydrogen 2.758 N/A ILE 45.A N SER 41.A O no hydrogen 2.926 N/A GLN 46.A N LYS 42.A O no hydrogen 2.787 N/A GLN 46.A NE2 GLU 219.A OE2 no hydrogen 3.527 N/A ALA 47.A N ARG 43.A O no hydrogen 2.957 N/A ALA 48.A N GLN 44.A O no hydrogen 2.855 N/A TYR 49.A N ILE 45.A O no hydrogen 2.978 N/A SER 50.A N GLN 46.A O no hydrogen 3.140 N/A ILE 51.A N ALA 47.A O no hydrogen 3.030 N/A LEU 52.A N ALA 48.A O no hydrogen 2.995 N/A SER 53.A N TYR 49.A O no hydrogen 2.915 N/A SER 53.A OG GLU 219.A O no hydrogen 2.643 N/A GLU 54.A N SER 50.A O no hydrogen 2.971 N/A VAL 55.A N ILE 51.A O no hydrogen 2.809 N/A GLN 56.A N LEU 52.A O no hydrogen 2.902 N/A GLN 57.A N SER 53.A O no hydrogen 2.929 N/A ALA 58.A N GLU 54.A O no hydrogen 3.039 N/A ALA 58.A N VAL 55.A O no hydrogen 2.911 N/A VAL 59.A N VAL 55.A O no hydrogen 2.947 N/A SER 60.A N GLN 56.A O no hydrogen 3.323 N/A SER 60.A OG GLN 56.A O no hydrogen 3.265 N/A GLN 61.A N GLN 57.A O no hydrogen 2.849 N/A GLY 62.A N VAL 59.A O no hydrogen 3.032 N/A SER 63.A N ALA 58.A O no hydrogen 3.035 N/A ILE 68.A N SER 64.A O no hydrogen 3.064 N/A LEU 69.A N ASP 65.A O no hydrogen 2.803 N/A ASP 70.A N SER 66.A O no hydrogen 2.988 N/A LEU 71.A N GLN 67.A O no hydrogen 3.066 N/A SER 72.A N ILE 68.A O no hydrogen 2.796 N/A ASN 73.A N LEU 69.A O no hydrogen 2.860 N/A ASN 73.A N ASP 70.A O no hydrogen 3.207 N/A ARG 74.A N ASP 70.A O no hydrogen 2.959 N/A PHE 75.A N LEU 71.A O no hydrogen 3.089 N/A TYR 76.A N SER 72.A O no hydrogen 3.295 N/A TYR 76.A OH PRO 89.A O no hydrogen 3.105 N/A THR 77.A N ASN 73.A O no hydrogen 2.901 N/A THR 77.A OG1 ASN 73.A O no hydrogen 3.023 N/A LEU 78.A N ARG 74.A O no hydrogen 2.938 N/A ILE 79.A N PHE 75.A O no hydrogen 2.914 N/A HIS 81.A ND1 ILE 79.A O no hydrogen 2.711 N/A ASP 82.A N GLU 29.A O no hydrogen 2.882 N/A GLY 84.A N ASP 82.A OD1 no hydrogen 3.132 N/A LEU 91.A N SER 72.A OG no hydrogen 3.180 N/A ASN 93.A ND2 ASN 92.A OD1 no hydrogen 2.923 N/A ASN 93.A ND2 SER 96.A OG no hydrogen 2.781 N/A SER 96.A N ASN 93.A OD1 no hydrogen 2.793 N/A VAL 97.A N ASN 93.A O no hydrogen 2.995 N/A GLN 98.A N ALA 94.A O no hydrogen 2.890 N/A GLN 98.A NE2 GLU 102.A OE1 no hydrogen 2.845 N/A ALA 99.A N ASP 95.A O no hydrogen 3.141 N/A LYS 100.A N SER 96.A O no hydrogen 3.140 N/A ALA 101.A N VAL 97.A O no hydrogen 2.901 N/A GLU 102.A N GLN 98.A O no hydrogen 2.841 N/A MET 103.A N ALA 99.A O no hydrogen 3.000 N/A LEU 104.A N LYS 100.A O no hydrogen 2.823 N/A ASP 105.A N ALA 101.A O no hydrogen 2.943 N/A ASN 106.A N GLU 102.A O no hydrogen 3.148 N/A ASN 106.A ND2 THR 203.A OG1 no hydrogen 3.175 N/A ASN 106.A ND2 ASN 204.A OD1 no hydrogen 2.867 N/A LEU 107.A N MET 103.A O no hydrogen 2.802 N/A LEU 108.A N LEU 104.A O no hydrogen 2.908 N/A ASP 109.A N ASP 105.A O no hydrogen 3.342 N/A ILE 110.A N ASN 106.A O no hydrogen 3.081 N/A GLU 111.A N LEU 107.A O no hydrogen 2.929 N/A VAL 112.A N LEU 108.A O no hydrogen 2.965 N/A ALA 113.A N ASP 109.A O no hydrogen 2.899 N/A TYR 114.A N ILE 110.A O no hydrogen 2.906 N/A SER 115.A N GLU 111.A O no hydrogen 2.974 N/A SER 115.A OG GLU 111.A O no hydrogen 3.131 N/A SER 115.A OG VAL 112.A O no hydrogen 3.515 N/A LEU 116.A N VAL 112.A O no hydrogen 2.966 N/A LEU 117.A N ALA 113.A O no hydrogen 2.854 N/A ARG 118.A N TYR 114.A O no hydrogen 2.987 N/A GLY 119.A N LEU 116.A O no hydrogen 3.041 N/A VAL 128.A N ASP 124.A O no hydrogen 3.258 N/A TYR 130.A N ILE 126.A O no hydrogen 3.043 N/A GLU 131.A N ASP 127.A O no hydrogen 3.173 N/A LYS 132.A N ASN 129.A O no hydrogen 3.012 N/A LYS 132.A NZ LEU 116.A O no hydrogen 3.033 N/A LYS 132.A NZ ASN 129.A OD1 no hydrogen 2.997 N/A LEU 133.A N TYR 130.A O no hydrogen 3.163 N/A LYS 134.A N GLU 131.A O no hydrogen 3.157 N/A THR 135.A OG1 LEU 133.A O no hydrogen 2.701 N/A ASP 136.A N GLU 176.A O no hydrogen 2.827 N/A ILE 137.A N TYR 130.A OH no hydrogen 3.253 N/A LYS 138.A N LYS 174.A O no hydrogen 2.949 N/A VAL 140.A N ILE 172.A O no hydrogen 2.857 N/A SER 144.A N ASP 141.A O no hydrogen 3.101 N/A GLU 148.A N SER 144.A O no hydrogen 3.165 N/A ILE 149.A N GLU 145.A O no hydrogen 2.962 N/A ILE 150.A N GLU 146.A O no hydrogen 3.257 N/A ARG 151.A N ALA 147.A O no hydrogen 2.934 N/A ARG 151.A NH2 ARG 142.A O no hydrogen 2.591 N/A LYS 152.A N GLU 148.A O no hydrogen 3.100 N/A TYR 153.A N ILE 149.A O no hydrogen 2.920 N/A TYR 153.A OH LEU 195.A O no hydrogen 2.574 N/A VAL 154.A N ILE 150.A O no hydrogen 2.939 N/A LYS 155.A N ARG 151.A O no hydrogen 2.788 N/A ASN 156.A N LYS 152.A O no hydrogen 2.725 N/A ASN 156.A ND2 LEU 307.A O no hydrogen 3.029 N/A THR 157.A N TYR 153.A O no hydrogen 3.142 N/A THR 157.A OG1 TYR 153.A O no hydrogen 2.775 N/A HIS 158.A NE2 HIS 162.A O no hydrogen 3.014 N/A ALA 159.A N SER 238.A OG no hydrogen 2.875 N/A THR 161.A N TYR 322.A OH no hydrogen 3.337 N/A HIS 162.A N ALA 159.A O no hydrogen 3.350 N/A HIS 162.A ND1 SER 238.A OG no hydrogen 2.696 N/A TYR 165.A OH ASN 242.A OD1 no hydrogen 2.403 N/A ASP 166.A N ASN 344.A O no hydrogen 3.046 N/A GLU 168.A N LYS 342.A O no hydrogen 3.028 N/A ILE 170.A N LYS 340.A O no hydrogen 2.828 N/A ASP 171.A N LYS 340.A O no hydrogen 3.369 N/A PHE 173.A N LEU 338.A O no hydrogen 2.908 N/A LYS 174.A N LYS 138.A O no hydrogen 2.874 N/A ILE 175.A N LYS 336.A O no hydrogen 2.907 N/A GLU 176.A N ASP 136.A O no hydrogen 2.882 N/A ARG 177.A NE LEU 209.A O no hydrogen 2.721 N/A ARG 177.A NH1 GLU 180.A OE2 no hydrogen 2.754 N/A ARG 177.A NH2 SER 210.A O no hydrogen 3.046 N/A GLU 178.A N LYS 134.A O no hydrogen 2.857 N/A GLU 180.A N ARG 177.A O no hydrogen 3.131 N/A ARG 183.A N GLY 179.A O no hydrogen 3.031 N/A TYR 184.A N GLU 180.A O no hydrogen 2.696 N/A TYR 184.A OH GLU 259.A OE2 no hydrogen 2.485 N/A LYS 185.A N GLN 182.A O no hydrogen 3.137 N/A PHE 187.A N TYR 184.A O no hydrogen 2.959 N/A LYS 188.A N LYS 185.A O no hydrogen 3.054 N/A LYS 188.A NZ GLU 259.A OE2 no hydrogen 3.495 N/A LEU 190.A N PHE 187.A O no hydrogen 3.024 N/A HIS 191.A N HIS 191.A ND1 no hydrogen 2.879 N/A ASN 192.A ND2 GLY 263.A O no hydrogen 3.139 N/A ARG 193.A NE GLU 259.A OE2 no hydrogen 2.969 N/A ARG 194.A N VAL 260.A O no hydrogen 2.997 N/A ARG 194.A NH2 ASN 192.A OD1 no hydrogen 2.950 N/A LEU 195.A N ASP 304.A O no hydrogen 2.930 N/A LEU 196.A N GLY 258.A O no hydrogen 2.906 N/A TRP 197.A N ALA 234.A O no hydrogen 2.948 N/A HIS 198.A N LEU 256.A O no hydrogen 3.082 N/A HIS 198.A ND1 TYR 232.A O no hydrogen 2.662 N/A ASN 204.A N ARG 201.A O no hydrogen 2.780 N/A ASN 204.A ND2 SER 200.A OG no hydrogen 2.882 N/A PHE 205.A N THR 202.A O no hydrogen 3.050 N/A ILE 208.A N ASN 204.A O no hydrogen 2.931 N/A LEU 209.A N PHE 205.A O no hydrogen 2.790 N/A SER 210.A N ALA 206.A O no hydrogen 2.917 N/A SER 210.A OG ALA 206.A O no hydrogen 3.050 N/A GLN 211.A N GLY 207.A O no hydrogen 2.762 N/A GLY 212.A N ILE 208.A O no hydrogen 2.534 N/A ARG 214.A NE GLY 212.A O no hydrogen 2.933 N/A ARG 214.A NH1 ASP 109.A OD1 no hydrogen 2.634 N/A ARG 214.A NH1 GLN 211.A OE1 no hydrogen 3.216 N/A ARG 214.A NH2 ASP 109.A OD1 no hydrogen 2.658 N/A ARG 214.A NH2 ASP 109.A OD2 no hydrogen 3.088 N/A ALA 220.A N PRO 217.A O no hydrogen 2.996 N/A VAL 222.A N GLN 56.A OE1 no hydrogen 2.981 N/A PHE 227.A N TYR 232.A OH no hydrogen 2.990 N/A LYS 229.A N SER 275.A OG no hydrogen 3.124 N/A LYS 229.A NZ PRO 217.A O no hydrogen 2.631 N/A LYS 229.A NZ ALA 220.A O no hydrogen 2.736 N/A ILE 231.A N VAL 327.A O no hydrogen 2.858 N/A TYR 232.A OH GLY 228.A O no hydrogen 2.657 N/A PHE 233.A N TYR 325.A O no hydrogen 2.703 N/A ALA 234.A N TRP 197.A O no hydrogen 2.977 N/A VAL 237.A N THR 157.A OG1 no hydrogen 3.076 N/A SER 238.A OG HIS 162.A ND1 no hydrogen 2.696 N/A LYS 239.A N MET 236.A O no hydrogen 3.032 N/A LYS 239.A NZ TYR 322.A O no hydrogen 3.029 N/A LYS 239.A NZ ASN 323.A O no hydrogen 3.068 N/A LYS 239.A NZ GLU 324.A OE1 no hydrogen 2.739 N/A ALA 241.A N VAL 237.A O no hydrogen 2.722 N/A ASN 242.A N SER 238.A O no hydrogen 2.904 N/A TYR 243.A N SER 240.A O no hydrogen 2.948 N/A CYS 244.A N ALA 241.A O no hydrogen 2.889 N/A CYS 244.A SG SER 200.A O no hydrogen 3.955 N/A CYS 244.A SG LEU 254.A O no hydrogen 3.440 N/A HIS 245.A N ASN 242.A O no hydrogen 3.399 N/A SER 247.A N ASP 250.A O no hydrogen 3.059 N/A GLY 253.A N LEU 341.A O no hydrogen 2.979 N/A ILE 255.A N LEU 339.A O no hydrogen 2.984 N/A LEU 256.A N HIS 198.A O no hydrogen 2.896 N/A LEU 257.A N TYR 337.A O no hydrogen 2.758 N/A GLY 258.A N LEU 196.A O no hydrogen 2.930 N/A GLU 259.A N ASN 334.A O no hydrogen 2.711 N/A VAL 260.A N ARG 194.A O no hydrogen 2.730 N/A ALA 261.A N GLN 332.A O no hydrogen 3.073 N/A LEU 262.A N ASN 192.A O no hydrogen 3.177 N/A GLY 263.A N HIS 191.A O no hydrogen 2.902 N/A ASN 264.A N HIS 282.A ND1 no hydrogen 2.924 N/A TYR 266.A N SER 283.A O no hydrogen 2.695 N/A LEU 268.A N LYS 285.A O no hydrogen 2.855 N/A HIS 270.A ND1 SER 319.A OG no hydrogen 2.944 N/A LYS 281.A N PRO 278.A O no hydrogen 3.066 N/A LYS 281.A NZ MET 265.A O no hydrogen 3.302 N/A HIS 282.A N ASN 264.A O no hydrogen 2.907 N/A SER 283.A OG LEU 262.A O no hydrogen 2.855 N/A VAL 284.A N ILE 326.A O no hydrogen 2.879 N/A LYS 285.A N TYR 266.A O no hydrogen 2.919 N/A GLY 286.A N GLU 324.A O no hydrogen 2.767 N/A LEU 287.A N LEU 268.A O no hydrogen 2.919 N/A GLY 288.A N ASN 323.A OD1 no hydrogen 2.907 N/A LYS 289.A N LEU 320.A O no hydrogen 3.021 N/A THR 290.A N LEU 321.A O no hydrogen 2.850 N/A THR 291.A N ILE 311.A O no hydrogen 2.853 N/A ASP 293.A N THR 309.A O no hydrogen 2.703 N/A SER 295.A N ASP 293.A OD1 no hydrogen 3.191 N/A ALA 296.A N ASP 293.A O no hydrogen 2.925 N/A ASN 297.A N PRO 294.A O no hydrogen 3.173 N/A ILE 298.A N VAL 305.A O no hydrogen 3.271 N/A LEU 300.A N VAL 303.A O no hydrogen 2.794 N/A VAL 303.A N LEU 300.A O no hydrogen 3.096 N/A ASP 304.A N ARG 193.A O no hydrogen 2.837 N/A VAL 305.A N ILE 298.A O no hydrogen 2.736 N/A LEU 307.A N VAL 305.A O no hydrogen 2.912 N/A ILE 311.A N THR 291.A O no hydrogen 2.800 N/A SER 313.A N LYS 289.A O no hydrogen 2.853 N/A SER 313.A OG GLY 288.A O no hydrogen 2.804 N/A SER 313.A OG LYS 289.A O no hydrogen 3.156 N/A VAL 315.A N SER 313.A OG no hydrogen 2.916 N/A SER 319.A N LYS 269.A O no hydrogen 2.950 N/A SER 319.A OG HIS 270.A ND1 no hydrogen 2.944 N/A ASN 323.A ND2 ASP 235.A OD2 no hydrogen 2.925 N/A ASN 323.A ND2 THR 291.A OG1 no hydrogen 2.929 N/A GLU 324.A N GLY 286.A O no hydrogen 3.048 N/A TYR 325.A N PHE 233.A O no hydrogen 2.861 N/A TYR 325.A OH ASP 235.A OD2 no hydrogen 2.563 N/A ILE 326.A N VAL 284.A O no hydrogen 2.902 N/A VAL 327.A N ILE 231.A O no hydrogen 3.064 N/A TYR 328.A OH PHE 227.A O no hydrogen 2.721 N/A ALA 331.A N ASP 329.A OD1 no hydrogen 3.045 N/A GLN 332.A N ASP 329.A O no hydrogen 3.062 N/A GLN 332.A NE2 ALA 261.A O no hydrogen 2.960 N/A GLN 332.A NE2 HIS 282.A O no hydrogen 2.956 N/A ASN 334.A N GLU 259.A O no hydrogen 2.890 N/A ASN 334.A ND2 GLU 180.A OE1 no hydrogen 2.894 N/A LEU 335.A N GLU 180.A OE1 no hydrogen 2.645 N/A LYS 336.A N LEU 257.A O no hydrogen 2.829 N/A LYS 336.A NZ ASN 334.A OD1 no hydrogen 3.010 N/A TYR 337.A N LEU 257.A O no hydrogen 3.004 N/A TYR 337.A OH GLU 146.A OE2 no hydrogen 2.791 N/A LEU 338.A N PHE 173.A O no hydrogen 2.934 N/A LEU 339.A N ILE 255.A O no hydrogen 2.777 N/A LYS 340.A N ASP 171.A O no hydrogen 3.009 N/A LEU 341.A N GLY 253.A O no hydrogen 2.753 N/A LYS 342.A N GLU 168.A O no hydrogen 2.940 N/A PHE 343.A N PRO 251.A O no hydrogen 2.937 N/A ASN 344.A N ASP 166.A O no hydrogen 3.062 N/A LYS 346.A N ALA 164.A O no hydrogen 3.078 N/A