Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5i5v_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG PHE 3.A O no hydrogen 2.782 N/A LYS 4.A NZ SER 2.A O no hydrogen 3.001 N/A ALA 5.A N GLU 111.A OE1 no hydrogen 2.915 N/A ASP 7.A N LYS 4.A O no hydrogen 3.078 N/A LEU 8.A N ALA 5.A O no hydrogen 3.067 N/A GLN 9.A N PRO 46.A O no hydrogen 3.018 N/A GLN 9.A NE2 LEU 10.A O no hydrogen 3.346 N/A GLU 11.A N ILE 48.A O no hydrogen 2.726 N/A THR 13.A N HIS 32.A NE2 no hydrogen 3.142 N/A LYS 15.A N THR 13.A OG1 no hydrogen 2.994 N/A HIS 17.A N ASP 31.A OD1 no hydrogen 2.832 N/A THR 30.A N LEU 162.A O no hydrogen 3.081 N/A THR 30.A OG1 HIS 32.A O no hydrogen 3.449 N/A THR 30.A OG1 ASP 123.A OD2 no hydrogen 2.626 N/A HIS 32.A N ASP 123.A OD2 no hydrogen 2.884 N/A HIS 32.A ND1 ASP 123.A OD1 no hydrogen 2.696 N/A MET 33.A N GLN 49.A O no hydrogen 2.824 N/A LEU 34.A N VAL 160.A O no hydrogen 2.928 N/A MET 35.A N ARG 47.A O no hydrogen 2.834 N/A VAL 36.A N LEU 158.A O no hydrogen 2.775 N/A TRP 38.A N ALA 156.A O no hydrogen 2.984 N/A ASN 39.A N GLY 42.A O no hydrogen 3.082 N/A LYS 41.A N ASN 39.A OD1 no hydrogen 2.719 N/A GLY 42.A N ASN 39.A O no hydrogen 2.739 N/A TRP 43.A NE1 SER 106.A O no hydrogen 2.907 N/A GLY 44.A N GLU 37.A O no hydrogen 2.850 N/A GLN 45.A NE2 ASP 7.A O no hydrogen 3.436 N/A ARG 47.A N MET 35.A O no hydrogen 2.899 N/A ARG 47.A NE GLN 49.A OE1 no hydrogen 3.017 N/A ARG 47.A NH2 GLU 11.A OE1 no hydrogen 3.007 N/A ILE 48.A N GLN 9.A O no hydrogen 2.956 N/A GLN 49.A N MET 33.A O no hydrogen 2.936 N/A PHE 51.A N ASP 31.A O no hydrogen 2.845 N/A GLN 52.A NE2 PRO 50.A O no hydrogen 2.864 N/A ALA 59.A N HIS 57.A ND1 no hydrogen 3.128 N/A SER 60.A N HIS 57.A O no hydrogen 2.963 N/A SER 60.A OG SER 62.A OG no hydrogen 2.895 N/A SER 60.A OG ASN 144.A OD1 no hydrogen 2.701 N/A SER 61.A N GLU 145.A O no hydrogen 3.203 N/A SER 62.A OG SER 60.A OG no hydrogen 2.895 N/A LEU 63.A N SER 60.A O no hydrogen 2.816 N/A HIS 64.A NE2 PRO 58.A O no hydrogen 2.643 N/A TYR 65.A N SER 61.A O no hydrogen 3.110 N/A TYR 65.A OH LEU 148.A O no hydrogen 2.467 N/A LEU 67.A N.A SER 61.A O no hydrogen 3.486 N/A LEU 67.A N.B SER 61.A O no hydrogen 3.467 N/A GLN 68.A NE2 SER 62.A O no hydrogen 3.142 N/A LEU 69.A N LEU 141.A O no hydrogen 2.980 N/A PHE 70.A N LYS 197.A O no hydrogen 3.154 N/A GLU 71.A N PRO 139.A O no hydrogen 2.958 N/A GLY 72.A N GLU 71.A OE1 no hydrogen 3.222 N/A MET 73.A N VAL 137.A O no hydrogen 3.175 N/A LYS 74.A NZ THR 308.A O no hydrogen 3.110 N/A LYS 74.A NZ ALA 309.A O no hydrogen 3.078 N/A ALA 75.A N LEU 135.A O no hydrogen 2.916 N/A PHE 76.A N ARG 84.A O no hydrogen 2.828 N/A LYS 77.A NZ GLN 81.A OE1 no hydrogen 3.308 N/A GLY 78.A N GLN 82.A O no hydrogen 3.114 N/A GLN 81.A N GLY 78.A O no hydrogen 2.921 N/A GLN 81.A NE2 GLY 78.A O no hydrogen 2.986 N/A GLN 81.A NE2 LYS 79.A O no hydrogen 3.422 N/A GLN 82.A N ASP 80.A OD1 no hydrogen 3.190 N/A GLN 82.A NE2 VAL 83.A O no hydrogen 2.914 N/A GLN 82.A NE2 VAL 360.A OXT no hydrogen 3.016 N/A ARG 84.A N PHE 76.A O no hydrogen 2.958 N/A ARG 84.A NH1 ASP 80.A OD1 no hydrogen 3.369 N/A ARG 84.A NH2 ASP 80.A OD1 no hydrogen 3.537 N/A ARG 84.A NH2 ASP 80.A OD2 no hydrogen 2.849 N/A LEU 85.A N PHE 358.A O no hydrogen 2.797 N/A PHE 86.A N LYS 74.A O no hydrogen 3.354 N/A ARG 87.A N TRP 356.A O no hydrogen 2.778 N/A ARG 87.A NH1 SER 268.A OG no hydrogen 2.949 N/A ARG 87.A NH1 ASP 271.A OD2 no hydrogen 3.153 N/A ARG 87.A NH2 ASP 271.A OD2 no hydrogen 3.564 N/A LEU 90.A N ARG 87.A O no hydrogen 3.065 N/A ASN 91.A ND2 GLU 71.A OE1 no hydrogen 2.896 N/A MET 92.A N PRO 88.A O no hydrogen 2.994 N/A ASP 93.A N TRP 89.A O no hydrogen 2.921 N/A ARG 94.A N LEU 90.A O no hydrogen 2.993 N/A ARG 94.A NE GLU 71.A OE2 no hydrogen 2.797 N/A ARG 94.A NH1 PRO 262.A O no hydrogen 2.995 N/A ARG 94.A NH2 GLU 71.A OE1 no hydrogen 2.810 N/A MET 95.A N ASN 91.A O no hydrogen 2.889 N/A LEU 96.A N MET 92.A O no hydrogen 3.054 N/A ARG 97.A N ASP 93.A O no hydrogen 3.066 N/A SER 98.A N ARG 94.A O no hydrogen 2.946 N/A SER 98.A OG ARG 94.A O no hydrogen 3.179 N/A ALA 99.A N MET 95.A O no hydrogen 2.929 N/A MET 100.A N LEU 96.A O no hydrogen 3.035 N/A ARG 101.A N ARG 97.A O no hydrogen 3.049 N/A ARG 101.A NH1 ARG 101.A O no hydrogen 2.939 N/A LEU 102.A N SER 98.A O no hydrogen 3.230 N/A LEU 102.A N ALA 99.A O no hydrogen 3.184 N/A CYS 103.A N MET 100.A O no hydrogen 3.174 N/A LEU 104.A N ALA 99.A O no hydrogen 2.899 N/A ASP 108.A N SER 2.A OG no hydrogen 2.914 N/A LYS 109.A NZ ASP 93.A OD1 no hydrogen 2.776 N/A GLU 111.A N ASP 108.A OD1 no hydrogen 3.083 N/A LEU 112.A N ASP 108.A O no hydrogen 3.079 N/A LEU 113.A N LYS 109.A O no hydrogen 2.995 N/A GLU 114.A N LEU 110.A O no hydrogen 2.951 N/A CYS 115.A N GLU 111.A O no hydrogen 2.993 N/A CYS 115.A SG GLU 111.A O no hydrogen 3.424 N/A ILE 116.A N LEU 112.A O no hydrogen 2.821 N/A ARG 117.A N LEU 113.A O no hydrogen 2.831 N/A ARG 117.A NE GLU 114.A OE1 no hydrogen 2.881 N/A ARG 117.A NE GLU 114.A OE2 no hydrogen 3.419 N/A ARG 117.A NH1 GLU 121.A OE2 no hydrogen 3.389 N/A ARG 117.A NH1 VAL 360.A O no hydrogen 2.760 N/A ARG 117.A NH2 GLU 114.A OE2 no hydrogen 2.917 N/A ARG 118.A N GLU 114.A O no hydrogen 2.923 N/A LEU 119.A N CYS 115.A O no hydrogen 2.936 N/A ILE 120.A N ILE 116.A O no hydrogen 2.913 N/A GLU 121.A N ARG 117.A O no hydrogen 2.879 N/A VAL 122.A N ARG 118.A O no hydrogen 3.058 N/A ASP 123.A N LEU 119.A O no hydrogen 3.064 N/A LYS 124.A N GLU 121.A O no hydrogen 3.199 N/A TRP 126.A N ASP 123.A O no hydrogen 2.813 N/A TRP 126.A NE1 ASP 31.A OD2 no hydrogen 2.983 N/A VAL 127.A N LYS 124.A O no hydrogen 3.071 N/A THR 133.A N ALA 130.A O no hydrogen 3.029 N/A THR 133.A OG1 ALA 130.A O no hydrogen 2.633 N/A SER 134.A N VAL 165.A O no hydrogen 3.250 N/A LEU 135.A N ALA 75.A O no hydrogen 2.941 N/A TYR 136.A N CYS 163.A O no hydrogen 2.663 N/A VAL 137.A N MET 73.A O no hydrogen 2.754 N/A ARG 138.A N ILE 161.A O no hydrogen 2.882 N/A ARG 138.A NE GLU 71.A O no hydrogen 2.871 N/A ARG 138.A NH2 TYR 136.A OH no hydrogen 2.847 N/A VAL 140.A N PHE 159.A O no hydrogen 2.721 N/A LEU 141.A N LEU 69.A O no hydrogen 3.089 N/A ILE 142.A N LEU 157.A O no hydrogen 2.851 N/A GLY 143.A N LEU 67.A O.A no hydrogen 2.847 N/A GLY 143.A N LEU 67.A O.B no hydrogen 2.918 N/A ASN 144.A N ARG 155.A O no hydrogen 2.810 N/A GLY 149.A N SER 147.A OG no hydrogen 3.183 N/A THR 154.A N GLU 145.A OE1 no hydrogen 3.034 N/A THR 154.A OG1 GLU 145.A OE1 no hydrogen 2.243 N/A ALA 156.A N TRP 38.A O no hydrogen 3.012 N/A LEU 157.A N ILE 142.A O no hydrogen 2.841 N/A LEU 158.A N VAL 36.A O no hydrogen 2.816 N/A PHE 159.A N VAL 140.A O no hydrogen 2.904 N/A VAL 160.A N LEU 34.A O no hydrogen 3.096 N/A ILE 161.A N ARG 138.A O no hydrogen 3.145 N/A CYS 163.A N TYR 136.A O no hydrogen 2.867 N/A CYS 163.A SG THR 28.A O no hydrogen 3.545 N/A VAL 165.A N SER 134.A O no hydrogen 2.824 N/A GLY 172.A N PHE 169.A O no hydrogen 2.939 N/A VAL 177.A N PRO 314.A O no hydrogen 2.906 N/A SER 178.A N GLU 218.A OE1 no hydrogen 2.828 N/A SER 178.A OG GLU 218.A OE1 no hydrogen 3.372 N/A LEU 179.A N ARG 317.A O no hydrogen 2.934 N/A LEU 180.A N GLN 219.A O no hydrogen 2.892 N/A ALA 181.A N LEU 319.A O no hydrogen 2.714 N/A ALA 184.A N ASP 182.A OD1 no hydrogen 2.850 N/A PHE 185.A N ASP 182.A O no hydrogen 3.128 N/A ARG 187.A NH2 GLY 194.A O no hydrogen 2.911 N/A ARG 187.A NH2 VAL 259.A O no hydrogen 3.029 N/A VAL 190.A N TYR 224.A OH no hydrogen 2.972 N/A GLY 192.A N TRP 189.A O no hydrogen 2.820 N/A ASN 195.A N ASN 195.A OD1 no hydrogen 2.694 N/A TYR 196.A N VAL 193.A O no hydrogen 3.071 N/A LYS 197.A N SER 98.A OG no hydrogen 3.354 N/A GLY 199.A N GLN 68.A O no hydrogen 3.326 N/A ASN 201.A N LEU 198.A O no hydrogen 2.985 N/A ASN 201.A ND2 VAL 193.A O no hydrogen 2.924 N/A TYR 202.A N GLY 199.A O no hydrogen 2.933 N/A THR 205.A N TYR 202.A O no hydrogen 2.848 N/A THR 205.A OG1 TYR 202.A O no hydrogen 2.685 N/A VAL 206.A N GLY 203.A O no hydrogen 3.365 N/A GLN 209.A N THR 205.A O no hydrogen 2.913 N/A GLN 209.A NE2 GLU 218.A O no hydrogen 2.903 N/A GLN 210.A N VAL 206.A O no hydrogen 3.095 N/A GLU 211.A N LEU 207.A O no hydrogen 3.056 N/A ALA 212.A N VAL 208.A O no hydrogen 2.991 N/A LEU 213.A N GLN 209.A O no hydrogen 3.054 N/A LYS 214.A N GLN 210.A O no hydrogen 2.925 N/A ARG 215.A N.A GLU 211.A O no hydrogen 3.008 N/A ARG 215.A N.B GLU 211.A O no hydrogen 3.012 N/A ARG 215.A NE.B GLU 211.A OE2 no hydrogen 3.195 N/A ARG 215.A NH1.A LYS 321.A O no hydrogen 2.773 N/A ARG 215.A NH1.B ASP 182.A OD2 no hydrogen 2.891 N/A ARG 215.A NH2.A LYS 321.A O no hydrogen 2.849 N/A ARG 215.A NH2.B GLU 211.A OE2 no hydrogen 3.355 N/A GLY 216.A N LEU 213.A O no hydrogen 2.821 N/A CYS 217.A N ALA 212.A O no hydrogen 2.736 N/A GLU 218.A N SER 178.A O no hydrogen 2.998 N/A GLU 218.A N SER 178.A OG no hydrogen 2.980 N/A GLN 219.A N SER 178.A O no hydrogen 3.060 N/A LEU 221.A N LEU 180.A O no hydrogen 2.962 N/A TRP 222.A N GLU 232.A O no hydrogen 2.964 N/A TYR 224.A N GLN 229.A O no hydrogen 2.931 N/A ASP 227.A N ASP 227.A OD1 no hydrogen 2.571 N/A HIS 228.A N GLY 225.A O no hydrogen 3.171 N/A GLN 229.A N TYR 224.A O no hydrogen 2.738 N/A GLN 229.A NE2 ASP 227.A OD1 no hydrogen 3.098 N/A GLN 229.A NE2 ASP 227.A OD2 no hydrogen 3.568 N/A LEU 230.A N ILE 286.A O no hydrogen 2.695 N/A THR 231.A N TRP 222.A O no hydrogen 2.930 N/A THR 231.A OG1 TRP 222.A O no hydrogen 2.770 N/A VAL 233.A N MET 236.A O no hydrogen 2.836 N/A GLY 234.A N VAL 220.A O no hydrogen 2.758 N/A MET 236.A N VAL 233.A O no hydrogen 2.782 N/A ASN 237.A N SER 306.A O no hydrogen 2.895 N/A ASN 237.A ND2 LEU 261.A O no hydrogen 2.976 N/A PHE 239.A N PHE 304.A O no hydrogen 2.815 N/A VAL 240.A N VAL 252.A O no hydrogen 2.964 N/A TYR 241.A N GLU 302.A O no hydrogen 2.768 N/A TRP 242.A N GLU 250.A O no hydrogen 3.081 N/A TRP 242.A NE1 GLU 250.A OE2 no hydrogen 2.938 N/A THR 243.A N ARG 299.A O no hydrogen 2.990 N/A HIS 244.A N VAL 248.A O no hydrogen 2.885 N/A GLY 247.A N HIS 244.A O no hydrogen 2.842 N/A VAL 248.A N ASP 246.A OD1 no hydrogen 3.376 N/A GLU 250.A N TRP 242.A O no hydrogen 2.813 N/A LEU 251.A N ARG 280.A O no hydrogen 2.798 N/A VAL 252.A N VAL 240.A O no hydrogen 2.981 N/A THR 253.A N VAL 282.A O no hydrogen 3.146 N/A THR 253.A OG1 ILE 238.A O no hydrogen 2.644 N/A ASN 257.A N PRO 255.A O no hydrogen 2.968 N/A LEU 261.A N GLU 232.A OE2 no hydrogen 2.766 N/A ARG 266.A NH2 PRO 254.A O no hydrogen 2.954 N/A ARG 266.A NH2 GLU 283.A OE1 no hydrogen 2.790 N/A GLN 267.A N GLY 263.A O no hydrogen 3.084 N/A GLN 267.A NE2 ASP 271.A OD1 no hydrogen 2.918 N/A SER 268.A N VAL 264.A O no hydrogen 3.055 N/A SER 268.A OG VAL 264.A O no hydrogen 2.737 N/A LEU 269.A N VAL 265.A O no hydrogen 2.770 N/A LEU 270.A N ARG 266.A O no hydrogen 3.094 N/A ASP 271.A N GLN 267.A O no hydrogen 2.838 N/A MET 272.A N SER 268.A O no hydrogen 2.898 N/A ALA 273.A N LEU 269.A O no hydrogen 2.946 N/A GLN 274.A N.A LEU 270.A O no hydrogen 2.844 N/A GLN 274.A N.B LEU 270.A O no hydrogen 2.815 N/A THR 275.A N ASP 271.A O no hydrogen 2.923 N/A THR 275.A OG1 ASP 271.A O no hydrogen 2.835 N/A TRP 276.A N MET 272.A O no hydrogen 3.021 N/A TRP 276.A NE1 GLU 343.A OE1 no hydrogen 3.092 N/A GLY 277.A N ALA 273.A O no hydrogen 3.437 N/A ARG 280.A N LEU 249.A O no hydrogen 3.296 N/A ARG 280.A NE GLU 250.A OE1 no hydrogen 2.945 N/A ARG 280.A NH1 ASP 246.A OD2 no hydrogen 2.852 N/A ARG 280.A NH2 ASP 246.A OD1 no hydrogen 3.125 N/A ARG 280.A NH2 ASP 246.A OD2 no hydrogen 3.006 N/A ARG 280.A NH2 GLU 250.A OE1 no hydrogen 2.975 N/A VAL 282.A N LEU 251.A O no hydrogen 2.836 N/A ARG 284.A N THR 253.A O no hydrogen 3.001 N/A ARG 284.A NH1 GLU 250.A OE1 no hydrogen 3.255 N/A ARG 284.A NH2 GLU 250.A OE2 no hydrogen 2.561 N/A THR 287.A N GLN 290.A OE1 no hydrogen 3.093 N/A MET 288.A N HIS 228.A O no hydrogen 3.031 N/A GLN 290.A N THR 287.A OG1 no hydrogen 3.108 N/A LEU 291.A N THR 287.A O no hydrogen 3.051 N/A LEU 292.A N MET 288.A O no hydrogen 2.905 N/A ARG 293.A N LYS 289.A O no hydrogen 3.113 N/A ALA 294.A N GLN 290.A O no hydrogen 2.903 N/A LEU 295.A N LEU 291.A O no hydrogen 2.846 N/A GLU 296.A N LEU 292.A O no hydrogen 2.987 N/A GLU 297.A N ARG 293.A O no hydrogen 2.979 N/A GLY 298.A N LEU 295.A O no hydrogen 2.984 N/A ARG 299.A N ALA 294.A O no hydrogen 2.849 N/A ARG 299.A NE GLU 297.A OE1 no hydrogen 2.734 N/A ARG 299.A NH1 THR 243.A O no hydrogen 2.782 N/A ARG 299.A NH2 GLU 297.A OE1 no hydrogen 2.976 N/A ARG 301.A N TYR 241.A O no hydrogen 2.908 N/A GLU 302.A N TYR 241.A O no hydrogen 3.101 N/A VAL 303.A N THR 329.A OG1 no hydrogen 3.045 N/A PHE 304.A N PHE 239.A O no hydrogen 3.048 N/A GLY 305.A N CYS 313.A O no hydrogen 2.854 N/A SER 306.A N ASN 237.A O no hydrogen 2.805 N/A GLY 307.A N GLN 311.A O no hydrogen 3.254 N/A CYS 310.A SG GLY 307.A O no hydrogen 3.956 N/A GLN 311.A N GLY 307.A O no hydrogen 2.702 N/A GLN 311.A NE2 THR 308.A O no hydrogen 2.970 N/A CYS 313.A N GLY 305.A O no hydrogen 2.837 N/A CYS 313.A SG PRO 314.A O no hydrogen 3.861 N/A VAL 315.A N VAL 303.A O no hydrogen 2.891 N/A HIS 316.A N VAL 177.A O no hydrogen 3.065 N/A ARG 317.A NH1 ASN 324.A OD1 no hydrogen 3.002 N/A ARG 317.A NH2 GLY 216.A O no hydrogen 2.846 N/A ILE 318.A N LEU 325.A O no hydrogen 2.942 N/A LEU 319.A N LEU 179.A O no hydrogen 2.763 N/A TYR 320.A N ARG 323.A O no hydrogen 2.876 N/A LYS 321.A N ALA 181.A O no hydrogen 3.224 N/A ARG 323.A N TYR 320.A O no hydrogen 3.055 N/A LEU 325.A N ILE 318.A O no hydrogen 2.847 N/A HIS 326.A NE2 GLU 331.A OE1 no hydrogen 2.780 N/A ILE 327.A N HIS 316.A O no hydrogen 2.787 N/A THR 329.A N ILE 327.A O no hydrogen 2.904 N/A THR 329.A OG1 VAL 303.A O no hydrogen 3.414 N/A THR 329.A OG1 VAL 315.A O no hydrogen 2.705 N/A GLU 331.A N PRO 328.A O no hydrogen 3.046 N/A ASN 332.A N THR 329.A O no hydrogen 3.078 N/A ASN 332.A ND2 ARG 301.A O no hydrogen 3.017 N/A ASN 332.A ND2 PRO 328.A O no hydrogen 2.932 N/A GLU 335.A N ASN 332.A O no hydrogen 2.890 N/A LEU 336.A N GLU 302.A OE2 no hydrogen 2.802 N/A ILE 337.A N GLU 302.A OE1 no hydrogen 3.033 N/A LEU 338.A N PRO 334.A O no hydrogen 2.921 N/A ARG 339.A N GLU 335.A O no hydrogen 3.088 N/A ARG 339.A NH1 GLU 278.A OE1 no hydrogen 2.909 N/A ARG 339.A NH1 GLU 278.A OE2 no hydrogen 3.247 N/A ARG 339.A NH2 GLU 278.A OE2 no hydrogen 2.892 N/A PHE 340.A N LEU 336.A O no hydrogen 2.814 N/A GLN 341.A N ILE 337.A O no hydrogen 2.977 N/A GLN 341.A NE2 VAL 312.A O no hydrogen 3.094 N/A LYS 342.A N LEU 338.A O no hydrogen 2.904 N/A LYS 342.A NZ GLU 346.A OE2 no hydrogen 2.801 N/A GLU 343.A N ARG 339.A O no hydrogen 3.139 N/A LEU 344.A N PHE 340.A O no hydrogen 2.879 N/A LYS 345.A N GLN 341.A O no hydrogen 2.896 N/A GLU 346.A N LYS 342.A O no hydrogen 2.997 N/A ILE 347.A N GLU 343.A O no hydrogen 3.054 N/A GLN 348.A N LEU 344.A O no hydrogen 2.744 N/A GLN 348.A NE2 GLN 311.A OE1 no hydrogen 2.850 N/A TYR 349.A N LYS 345.A O no hydrogen 2.936 N/A TYR 349.A OH THR 133.A O no hydrogen 2.690 N/A ARG 352.A N GLU 346.A O no hydrogen 3.074 N/A ARG 352.A NH2 GLU 343.A OE2 no hydrogen 3.412 N/A TRP 356.A N HIS 354.A ND1 no hydrogen 3.155 N/A MET 357.A N HIS 354.A O no hydrogen 3.227 N/A PHE 358.A N LEU 85.A O no hydrogen 2.838 N/A VAL 360.A N VAL 83.A O no hydrogen 2.764 N/A