Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5w8i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 5.A N THR 2.A OG1 no hydrogen 3.050 N/A GLN 6.A N THR 2.A O no hydrogen 2.895 N/A LEU 7.A N LEU 3.A O no hydrogen 2.927 N/A ILE 8.A N LYS 4.A O no hydrogen 2.813 N/A ASN 10.A ND2 LEU 12.A O no hydrogen 2.963 N/A GLN 17.A NE2 THR 15.A O no hydrogen 2.827 N/A ASN 18.A N ASP 43.A OD1 no hydrogen 2.775 N/A LYS 19.A NZ GLU 44.A OE2 no hydrogen 2.863 N/A LYS 19.A NZ VAL 82.A O no hydrogen 2.780 N/A LYS 19.A NZ ALA 84.A O no hydrogen 2.916 N/A ILE 20.A N GLU 44.A O no hydrogen 3.005 N/A THR 21.A N LEU 88.A O no hydrogen 3.006 N/A THR 21.A OG1 SER 86.A OG no hydrogen 2.632 N/A VAL 22.A N ALA 46.A O no hydrogen 2.854 N/A VAL 23.A N ILE 90.A O no hydrogen 2.831 N/A GLY 24.A N VAL 48.A O no hydrogen 2.742 N/A VAL 25.A N ASP 49.A OD2 no hydrogen 2.832 N/A MET 30.A N GLY 26.A O no hydrogen 3.001 N/A ALA 31.A N ALA 27.A O no hydrogen 2.998 N/A CYS 32.A N VAL 28.A O no hydrogen 3.017 N/A CYS 32.A SG VAL 28.A O no hydrogen 3.337 N/A ALA 33.A N GLY 29.A O no hydrogen 2.903 N/A ILE 34.A N MET 30.A O no hydrogen 2.895 N/A SER 35.A N ALA 31.A O no hydrogen 3.089 N/A SER 35.A OG ALA 31.A O no hydrogen 2.717 N/A ILE 36.A N CYS 32.A O no hydrogen 2.959 N/A LEU 37.A N ALA 33.A O no hydrogen 2.911 N/A MET 38.A N ILE 34.A O no hydrogen 2.873 N/A LYS 39.A N SER 35.A O no hydrogen 3.105 N/A LYS 39.A N ILE 36.A O no hydrogen 3.269 N/A LYS 39.A NZ GLU 258.A OE1 no hydrogen 2.999 N/A ASP 40.A N LEU 37.A O no hydrogen 3.314 N/A LEU 41.A N ILE 36.A O no hydrogen 3.454 N/A ASP 43.A N ASN 18.A O no hydrogen 3.014 N/A LEU 45.A N LYS 73.A O no hydrogen 2.957 N/A ALA 46.A N ILE 20.A O no hydrogen 2.975 N/A LEU 47.A N VAL 75.A O no hydrogen 2.883 N/A VAL 48.A N VAL 22.A O no hydrogen 3.099 N/A VAL 50.A N ASP 49.A OD1 no hydrogen 2.777 N/A LYS 54.A N ASP 53.A OD1.A no hydrogen 2.739 N/A LYS 54.A NZ GLU 58.A OE2 no hydrogen 2.711 N/A LEU 55.A N ILE 51.A O no hydrogen 3.038 N/A LYS 56.A N GLU 52.A O no hydrogen 3.011 N/A GLY 57.A N ASP 53.A O no hydrogen 2.881 N/A GLU 58.A N LYS 54.A O no hydrogen 2.951 N/A MET 59.A N LEU 55.A O no hydrogen 3.047 N/A MET 60.A N LYS 56.A O no hydrogen 2.928 N/A ASP 61.A N GLY 57.A O no hydrogen 2.978 N/A LEU 62.A N GLU 58.A O no hydrogen 3.023 N/A GLN 63.A N MET 59.A O no hydrogen 2.879 N/A GLN 63.A NE2 ILE 74.A O no hydrogen 2.896 N/A HIS 64.A N MET 60.A O no hydrogen 2.903 N/A GLY 65.A N LEU 62.A O no hydrogen 2.981 N/A SER 66.A N GLN 63.A O no hydrogen 2.966 N/A SER 66.A OG GLN 63.A O no hydrogen 2.627 N/A PHE 68.A N GLY 65.A O no hydrogen 2.861 N/A LEU 69.A N SER 66.A O no hydrogen 3.034 N/A THR 71.A OG1 ALA 42.A O no hydrogen 3.111 N/A VAL 75.A N LEU 45.A O no hydrogen 2.958 N/A GLY 77.A N LEU 47.A O no hydrogen 3.179 N/A ASN 81.A N ASP 79.A OD1 no hydrogen 2.880 N/A VAL 82.A N ASP 79.A O no hydrogen 3.295 N/A THR 83.A N TYR 80.A O no hydrogen 2.933 N/A THR 83.A OG1 TYR 80.A O no hydrogen 2.714 N/A ALA 84.A N ASN 81.A O no hydrogen 3.305 N/A ASN 85.A N TYR 124.A O no hydrogen 3.091 N/A SER 86.A N SER 125.A OG no hydrogen 2.972 N/A SER 86.A OG THR 21.A OG1 no hydrogen 2.632 N/A SER 86.A OG THR 83.A O no hydrogen 2.774 N/A LYS 87.A N LYS 19.A O no hydrogen 2.870 N/A LYS 87.A NZ GLN 17.A O no hydrogen 3.164 N/A LYS 87.A NZ ASN 18.A OD1 no hydrogen 2.986 N/A VAL 89.A N LYS 129.A O no hydrogen 2.871 N/A ILE 90.A N THR 21.A O no hydrogen 2.736 N/A ILE 91.A N LEU 131.A O no hydrogen 2.915 N/A THR 92.A N VAL 23.A O no hydrogen 2.847 N/A THR 92.A OG1 VAL 23.A O no hydrogen 2.834 N/A ALA 95.A N ASN 110.A OD1 no hydrogen 2.700 N/A GLN 97.A NE2 GLU 101.A O no hydrogen 2.915 N/A GLN 98.A N GLU 101.A OE2 no hydrogen 2.914 N/A GLN 98.A NE2 ARG 96.A O no hydrogen 2.868 N/A GLU 101.A N GLN 98.A O no hydrogen 2.888 N/A ARG 103.A NH2 GLU 189.A OE2 no hydrogen 3.207 N/A ASN 105.A N SER 102.A OG no hydrogen 3.074 N/A LEU 106.A N SER 102.A O no hydrogen 2.964 N/A VAL 107.A N ARG 103.A O no hydrogen 2.972 N/A GLN 108.A N LEU 104.A O no hydrogen 2.939 N/A GLN 108.A NE2 ASN 112.A OD1 no hydrogen 3.142 N/A GLN 108.A NE2 GLN 328.A O no hydrogen 3.033 N/A ARG 109.A N ASN 105.A O no hydrogen 3.048 N/A ARG 109.A NE GLU 101.A OE1 no hydrogen 2.695 N/A ARG 109.A NH1 ARG 96.A O no hydrogen 3.019 N/A ARG 109.A NH1 GLU 101.A OE1 no hydrogen 3.222 N/A ARG 109.A NH1 GLU 101.A OE2 no hydrogen 2.830 N/A ASN 110.A N LEU 106.A O no hydrogen 3.030 N/A ASN 110.A ND2 ALA 95.A O no hydrogen 3.268 N/A VAL 111.A N VAL 107.A O no hydrogen 2.749 N/A ASN 112.A N GLN 108.A O no hydrogen 3.077 N/A ILE 113.A N ARG 109.A O no hydrogen 3.175 N/A PHE 114.A N ASN 110.A O no hydrogen 2.789 N/A LYS 115.A N VAL 111.A O no hydrogen 2.882 N/A LYS 115.A NZ PHE 329.A O no hydrogen 2.967 N/A PHE 116.A N ILE 113.A O no hydrogen 3.074 N/A ILE 117.A N ILE 113.A O no hydrogen 3.128 N/A ILE 118.A N PHE 114.A O no hydrogen 2.890 N/A ASN 120.A ND2 PHE 116.A O no hydrogen 2.873 N/A VAL 121.A N ILE 117.A O no hydrogen 2.937 N/A VAL 122.A N ILE 118.A O no hydrogen 2.869 N/A LYS 123.A N PRO 119.A O no hydrogen 2.869 N/A TYR 124.A N ASN 120.A O no hydrogen 3.375 N/A TYR 124.A N VAL 121.A O no hydrogen 3.160 N/A SER 125.A N VAL 121.A O no hydrogen 2.860 N/A CYS 128.A N SER 125.A O no hydrogen 3.142 N/A CYS 128.A SG SER 125.A O no hydrogen 3.299 N/A CYS 128.A SG LYS 129.A O no hydrogen 3.785 N/A LYS 129.A N LYS 87.A O no hydrogen 2.999 N/A LYS 129.A NZ LYS 87.A O no hydrogen 3.242 N/A LYS 129.A NZ GLN 294.A O no hydrogen 3.026 N/A LEU 130.A N ARG 154.A O no hydrogen 2.849 N/A LEU 131.A N VAL 89.A O no hydrogen 2.923 N/A ILE 132.A N ILE 156.A O no hydrogen 2.819 N/A VAL 133.A N ILE 91.A O no hydrogen 2.881 N/A SER 134.A N ILE 91.A O no hydrogen 3.236 N/A SER 134.A OG ILE 91.A O no hydrogen 3.170 N/A SER 134.A OG ALA 93.A O no hydrogen 2.674 N/A LEU 140.A N PRO 136.A O no hydrogen 2.948 N/A THR 141.A N VAL 137.A O no hydrogen 2.831 N/A THR 141.A OG1 VAL 137.A O no hydrogen 2.697 N/A TYR 142.A N ASP 138.A O no hydrogen 3.342 N/A VAL 143.A N ILE 139.A O no hydrogen 2.930 N/A ALA 144.A N LEU 140.A O no hydrogen 2.846 N/A TRP 145.A N THR 141.A O no hydrogen 2.987 N/A LYS 146.A N TYR 142.A O no hydrogen 2.870 N/A ILE 147.A N VAL 143.A O no hydrogen 2.959 N/A SER 148.A N ALA 144.A O no hydrogen 2.875 N/A SER 148.A OG ALA 144.A O no hydrogen 2.893 N/A SER 148.A OG TRP 145.A O no hydrogen 3.241 N/A GLY 149.A N TRP 145.A O no hydrogen 3.097 N/A PHE 150.A N SER 148.A OG no hydrogen 2.957 N/A ASN 153.A ND2 ASN 295.A O no hydrogen 2.875 N/A ARG 154.A N PRO 151.A O no hydrogen 2.978 N/A ARG 154.A NH1 PRO 126.A O no hydrogen 3.111 N/A ARG 154.A NH1 CYS 128.A O no hydrogen 2.788 N/A VAL 155.A N LYS 152.A O no hydrogen 3.350 N/A ILE 156.A N LEU 130.A O no hydrogen 2.888 N/A GLY 157.A N SER 271.A O no hydrogen 2.995 N/A SER 158.A N ILE 132.A O no hydrogen 2.918 N/A SER 158.A OG ILE 132.A O no hydrogen 3.490 N/A CYS 160.A N SER 287.A OG no hydrogen 2.908 N/A CYS 160.A SG GLY 188.A O no hydrogen 3.764 N/A ASN 161.A N SER 158.A O no hydrogen 3.346 N/A ASN 161.A ND2 SER 252.A O no hydrogen 3.391 N/A ASN 161.A ND2 SER 252.A OG no hydrogen 2.957 N/A ASN 161.A ND2 ASP 255.A OD2 no hydrogen 3.241 N/A SER 164.A N CYS 160.A O no hydrogen 2.917 N/A SER 164.A OG CYS 160.A O no hydrogen 3.085 N/A ALA 165.A N ASN 161.A O no hydrogen 3.054 N/A ARG 166.A N LEU 162.A O no hydrogen 2.849 N/A PHE 167.A N ASP 163.A O no hydrogen 2.884 N/A ARG 168.A N SER 164.A O no hydrogen 2.871 N/A ARG 168.A NE PRO 179.A O no hydrogen 3.296 N/A ARG 168.A NE CYS 182.A O no hydrogen 2.739 N/A ARG 168.A NH2 PRO 179.A O no hydrogen 2.963 N/A TYR 169.A N ALA 165.A O no hydrogen 2.960 N/A LEU 170.A N ARG 166.A O no hydrogen 3.081 N/A MET 171.A N PHE 167.A O no hydrogen 2.963 N/A GLY 172.A N ARG 168.A O no hydrogen 2.919 N/A GLU 173.A N TYR 169.A O no hydrogen 2.885 N/A ARG 174.A N LEU 170.A O no hydrogen 3.037 N/A ARG 174.A NH1 GLU 222.A O no hydrogen 2.945 N/A ARG 174.A NH2 GLN 223.A O no hydrogen 3.339 N/A LEU 175.A N MET 171.A O no hydrogen 2.910 N/A VAL 177.A N GLY 172.A O no hydrogen 3.104 N/A LEU 180.A N HIS 178.A ND1 no hydrogen 3.028 N/A SER 181.A N HIS 178.A O no hydrogen 2.876 N/A CYS 182.A N PRO 179.A O no hydrogen 3.099 N/A CYS 182.A SG VAL 177.A O no hydrogen 3.791 N/A CYS 182.A SG HIS 178.A O no hydrogen 3.611 N/A HIS 183.A N ASN 202.A O no hydrogen 2.897 N/A VAL 186.A N SER 164.A OG no hydrogen 2.944 N/A LEU 187.A N VAL 195.A O no hydrogen 2.806 N/A GLY 188.A N SER 287.A O no hydrogen 2.981 N/A HIS 190.A N ASP 138.A OD2 no hydrogen 2.848 N/A HIS 190.A ND1 ASP 163.A OD1 no hydrogen 2.674 N/A GLY 191.A N ASP 163.A OD2 no hydrogen 3.061 N/A SER 194.A N GLY 191.A O no hydrogen 3.168 N/A SER 194.A OG GLY 191.A O no hydrogen 3.155 N/A SER 194.A OG HIS 228.A NE2 no hydrogen 2.707 N/A VAL 195.A N LEU 187.A O no hydrogen 2.703 N/A VAL 197.A N TRP 185.A O no hydrogen 2.910 N/A GLY 200.A N VAL 197.A O no hydrogen 2.992 N/A MET 201.A N TRP 198.A O no hydrogen 3.145 N/A ASN 202.A N HIS 183.A O no hydrogen 2.948 N/A ASN 202.A ND2 GLY 200.A O no hydrogen 2.960 N/A VAL 203.A N VAL 206.A O no hydrogen 3.413 N/A GLY 205.A N ASN 202.A OD1 no hydrogen 3.017 N/A VAL 206.A N VAL 203.A O no hydrogen 2.788 N/A SER 207.A OG THR 210.A OG1 no hydrogen 3.293 N/A LEU 208.A N MET 201.A O no hydrogen 2.923 N/A LYS 209.A NZ PRO 213.A O no hydrogen 2.812 N/A LYS 209.A NZ LEU 215.A O no hydrogen 3.053 N/A THR 210.A N SER 207.A OG no hydrogen 3.245 N/A THR 210.A OG1 SER 207.A OG no hydrogen 3.293 N/A LEU 211.A N SER 207.A O no hydrogen 2.993 N/A HIS 212.A N LEU 208.A O no hydrogen 2.687 N/A HIS 212.A NE2 ASP 220.A OD1 no hydrogen 2.794 N/A LEU 215.A N HIS 212.A O no hydrogen 2.897 N/A THR 217.A N ASP 214.A O no hydrogen 2.886 N/A THR 217.A OG1 ASP 214.A O no hydrogen 2.632 N/A ASP 220.A N THR 217.A O no hydrogen 3.392 N/A GLU 222.A N ASP 220.A OD1 no hydrogen 2.777 N/A GLN 223.A N ASP 220.A O no hydrogen 2.969 N/A GLN 223.A NE2 ASP 218.A O no hydrogen 2.841 N/A GLN 223.A NE2 ASP 220.A O no hydrogen 2.632 N/A TRP 224.A N ASP 220.A OD2 no hydrogen 2.960 N/A TRP 224.A NE1 GLU 222.A OE1 no hydrogen 2.840 N/A GLU 226.A N GLN 223.A O no hydrogen 2.984 N/A VAL 227.A N TRP 224.A O no hydrogen 3.013 N/A HIS 228.A NE2 SER 194.A OG no hydrogen 2.707 N/A LYS 229.A N LYS 225.A O no hydrogen 3.036 N/A GLN 230.A N GLU 226.A O no hydrogen 2.841 N/A VAL 231.A N VAL 227.A O no hydrogen 3.031 N/A VAL 232.A N HIS 228.A O no hydrogen 3.134 N/A GLU 233.A N LYS 229.A O no hydrogen 2.926 N/A SER 234.A N GLN 230.A O no hydrogen 2.714 N/A SER 234.A OG.A VAL 231.A O no hydrogen 2.659 N/A SER 234.A OG.B GLN 230.A O no hydrogen 2.838 N/A TYR 236.A OH ASP 192.A OD1 no hydrogen 2.772 N/A TYR 236.A OH ASP 192.A OD2 no hydrogen 3.162 N/A GLU 237.A N GLU 233.A O no hydrogen 2.991 N/A VAL 238.A N SER 234.A O no hydrogen 2.974 N/A ILE 239.A N ALA 235.A O no hydrogen 2.848 N/A LYS 240.A N TYR 236.A O no hydrogen 2.971 N/A LEU 241.A N GLU 237.A O no hydrogen 2.935 N/A LYS 242.A N VAL 238.A O no hydrogen 2.830 N/A LYS 242.A NZ SER 246.A OG no hydrogen 3.130 N/A GLY 243.A N ILE 239.A O no hydrogen 2.707 N/A GLY 250.A N SER 246.A O no hydrogen 2.992 N/A LEU 251.A N TRP 247.A O no hydrogen 3.099 N/A SER 252.A N ALA 248.A O no hydrogen 2.832 N/A VAL 253.A N ILE 249.A O no hydrogen 2.849 N/A ALA 254.A N GLY 250.A O no hydrogen 2.970 N/A ASP 255.A N LEU 251.A O no hydrogen 3.010 N/A LEU 256.A N SER 252.A O no hydrogen 3.108 N/A ALA 257.A N VAL 253.A O no hydrogen 2.760 N/A GLU 258.A N ALA 254.A O no hydrogen 2.808 N/A SER 259.A N ASP 255.A O no hydrogen 3.346 N/A SER 259.A OG HIS 268.A NE2 no hydrogen 2.776 N/A ILE 260.A N LEU 256.A O no hydrogen 3.123 N/A MET 261.A N ALA 257.A O no hydrogen 2.794 N/A LYS 262.A N GLU 258.A O no hydrogen 2.925 N/A ASN 263.A N ILE 260.A O no hydrogen 3.356 N/A LEU 264.A N SER 259.A O no hydrogen 3.011 N/A ARG 265.A N LEU 292.A O no hydrogen 2.910 N/A ARG 265.A NH1 SER 298.A OG no hydrogen 3.045 N/A ARG 265.A NH2 ASP 299.A OD1 no hydrogen 3.121 N/A ARG 266.A NE SER 259.A OG no hydrogen 2.859 N/A ARG 266.A NH1 ASP 255.A OD1 no hydrogen 2.906 N/A ARG 266.A NH1 SER 259.A OG no hydrogen 2.751 N/A ARG 266.A NH2 ASP 255.A OD1 no hydrogen 2.967 N/A HIS 268.A N CYS 290.A O no hydrogen 2.850 N/A HIS 268.A ND1 ASN 161.A OD1 no hydrogen 3.231 N/A HIS 268.A NE2 SER 259.A OG no hydrogen 2.776 N/A SER 271.A N GLY 157.A O no hydrogen 2.888 N/A SER 271.A OG.A ASP 138.A OD1 no hydrogen 2.654 N/A SER 271.A OG.B ASP 138.A OD1 no hydrogen 2.860 N/A THR 272.A N LEU 286.A O no hydrogen 3.129 N/A ILE 274.A N VAL 284.A O no hydrogen 2.985 N/A LYS 275.A NZ ASP 283.A OD1 no hydrogen 2.897 N/A GLY 276.A N ILE 280.A O no hydrogen 2.958 N/A LEU 277.A N ILE 274.A O no hydrogen 3.006 N/A TYR 278.A OH VAL 303.A O no hydrogen 2.902 N/A ILE 280.A N LEU 277.A O no hydrogen 2.882 N/A VAL 284.A N ASP 282.A O no hydrogen 2.988 N/A LEU 286.A N THR 272.A O no hydrogen 3.131 N/A SER 287.A N GLY 188.A O no hydrogen 2.887 N/A SER 287.A OG PRO 269.A O no hydrogen 3.552 N/A VAL 288.A N VAL 270.A O no hydrogen 3.384 N/A CYS 290.A N HIS 268.A O no hydrogen 2.772 N/A CYS 290.A SG VAL 288.A O no hydrogen 3.465 N/A ILE 291.A N ASP 299.A O no hydrogen 2.858 N/A LEU 292.A N ARG 266.A O no hydrogen 2.985 N/A GLY 293.A N GLY 296.A O no hydrogen 2.935 N/A GLN 294.A N ASN 263.A OD1 no hydrogen 2.901 N/A GLY 296.A N GLY 293.A O no hydrogen 2.967 N/A ILE 297.A N ASN 153.A O no hydrogen 2.926 N/A SER 298.A N ILE 291.A O no hydrogen 3.166 N/A SER 298.A OG ASP 299.A OD1 no hydrogen 2.449 N/A VAL 301.A N PRO 289.A O no hydrogen 2.841 N/A THR 306.A N GLU 309.A OE1 no hydrogen 2.923 N/A GLU 309.A N THR 306.A OG1 no hydrogen 3.198 N/A GLU 310.A N THR 306.A O no hydrogen 2.880 N/A ALA 311.A N SER 307.A O no hydrogen 2.995 N/A ARG 312.A N GLU 308.A O no hydrogen 2.988 N/A LEU 313.A N GLU 309.A O no hydrogen 3.011 N/A LYS 314.A N GLU 310.A O no hydrogen 2.981 N/A LYS 315.A N ALA 311.A O no hydrogen 2.938 N/A SER 316.A N ARG 312.A O no hydrogen 3.121 N/A SER 316.A OG GLU 189.A OE1 no hydrogen 2.952 N/A SER 316.A OG ARG 312.A O no hydrogen 3.405 N/A ALA 317.A N LEU 313.A O no hydrogen 2.970 N/A ASP 318.A N LYS 314.A O no hydrogen 2.893 N/A THR 319.A N LYS 315.A O no hydrogen 2.963 N/A THR 319.A OG1 LYS 315.A O no hydrogen 2.916 N/A LEU 320.A N SER 316.A O no hydrogen 2.740 N/A TRP 321.A N ALA 317.A O no hydrogen 2.753 N/A GLY 322.A N ASP 318.A O no hydrogen 2.870 N/A ILE 323.A N THR 319.A O no hydrogen 3.316 N/A ILE 323.A N LEU 320.A O no hydrogen 3.013 N/A GLN 324.A N LEU 320.A O no hydrogen 2.919 N/A GLN 324.A NE2 ASP 283.A O no hydrogen 2.841 N/A LYS 325.A N TRP 321.A O no hydrogen 2.914 N/A GLU 326.A N ILE 323.A O no hydrogen 2.933 N/A LEU 327.A N GLN 324.A O no hydrogen 2.969 N/A GLN 328.A N GLN 108.A OE1 no hydrogen 2.968 N/A GLN 328.A NE2 PHE 329.A OXT no hydrogen 3.179 N/A