Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5xn0_B.pdb H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 10.B N ASP 121.B OD2 no hydrogen 3.064 N/A LYS 11.B N GLN 85.B OE1 no hydrogen 3.103 N/A LYS 13.B N ARG 83.B O no hydrogen 2.806 N/A LYS 13.B NZ LYS 82.B O no hydrogen 3.040 N/A MET 16.B N LYS 13.B O no hydrogen 3.076 N/A VAL 21.B N ASN 57.B O no hydrogen 2.928 N/A GLN 23.B NE2 TRP 24.B O no hydrogen 3.055 N/A GLN 23.B NE2 VAL 60.B O no hydrogen 2.812 N/A LYS 30.B NZ ALA 62.B O no hydrogen 3.488 N/A LYS 30.B NZ GLU 404.B OE2 no hydrogen 3.142 N/A ILE 31.B N THR 27.B O no hydrogen 2.957 N/A LYS 32.B N GLU 28.B O no hydrogen 2.876 N/A ALA 33.B N GLU 29.B O no hydrogen 3.130 N/A LEU 34.B N LYS 30.B O no hydrogen 2.936 N/A VAL 35.B N ILE 31.B O no hydrogen 2.911 N/A GLU 36.B N LYS 32.B O no hydrogen 2.976 N/A ILE 37.B N ALA 33.B O no hydrogen 2.894 N/A CYS 38.B N LEU 34.B O no hydrogen 2.838 N/A CYS 38.B SG LEU 34.B O no hydrogen 3.232 N/A THR 39.B N VAL 35.B O no hydrogen 3.111 N/A THR 39.B OG1 VAL 35.B O no hydrogen 2.857 N/A THR 39.B OG1 GLU 36.B O no hydrogen 3.146 N/A GLU 40.B N GLU 36.B O no hydrogen 3.200 N/A MET 41.B N ILE 37.B O no hydrogen 2.854 N/A GLU 42.B N CYS 38.B O no hydrogen 2.799 N/A LYS 43.B N THR 39.B O no hydrogen 2.924 N/A GLU 44.B N GLU 40.B O no hydrogen 3.031 N/A GLY 45.B N GLU 42.B O no hydrogen 2.991 N/A LYS 46.B N MET 41.B O no hydrogen 2.891 N/A LYS 46.B NZ GLU 44.B OE2 no hydrogen 3.196 N/A SER 48.B N GLN 145.B O no hydrogen 2.862 N/A ILE 50.B N ARG 143.B O no hydrogen 2.921 N/A GLU 53.B N GLU 53.B OE1 no hydrogen 2.735 N/A ASN 54.B ND2 LYS 126.B O no hydrogen 3.110 N/A ASN 54.B ND2 GLN 145.B OE1 no hydrogen 3.244 N/A TYR 56.B N ASN 54.B OD1 no hydrogen 2.962 N/A TYR 56.B OH ASP 17.B OD1 no hydrogen 2.766 N/A ASN 57.B N PRO 19.B O no hydrogen 2.964 N/A ASN 57.B ND2 VAL 21.B O no hydrogen 2.824 N/A VAL 60.B N GLN 23.B OE1 no hydrogen 2.767 N/A PHE 61.B N LEU 74.B O no hydrogen 2.889 N/A ILE 63.B N ARG 72.B O no hydrogen 2.870 N/A LYS 65.B NZ ASP 110.B OD2 no hydrogen 2.940 N/A LYS 70.B NZ GLU 36.B OE2 no hydrogen 3.164 N/A ARG 72.B N ILE 63.B O no hydrogen 2.718 N/A ARG 72.B NE ASP 110.B OD2 no hydrogen 3.033 N/A ARG 72.B NH1 LYS 73.B O no hydrogen 3.124 N/A ARG 72.B NH2 ASP 110.B OD1 no hydrogen 3.018 N/A ARG 72.B NH2 ASP 110.B OD2 no hydrogen 3.307 N/A ARG 72.B NH2 ASP 185.B OD2 no hydrogen 3.177 N/A LYS 73.B NZ TYR 146.B OH no hydrogen 2.616 N/A LEU 74.B N PHE 61.B O no hydrogen 2.805 N/A ASP 76.B N PRO 59.B O no hydrogen 3.008 N/A PHE 77.B N VAL 75.B O no hydrogen 2.814 N/A ARG 78.B N ASP 76.B OD1 no hydrogen 3.320 N/A ARG 78.B NE ASP 76.B OD1 no hydrogen 2.816 N/A ARG 78.B NH1 PRO 412.B O no hydrogen 2.781 N/A ARG 78.B NH2 ASP 76.B OD2 no hydrogen 2.743 N/A ASN 81.B N PHE 77.B O no hydrogen 2.810 N/A ASN 81.B ND2 GLY 152.B O no hydrogen 2.886 N/A LYS 82.B N ARG 78.B O no hydrogen 3.065 N/A LYS 82.B NZ GLU 79.B OE1 no hydrogen 3.507 N/A LYS 82.B NZ GLU 413.B OE1 no hydrogen 3.368 N/A LYS 82.B NZ GLU 413.B OE2 no hydrogen 3.107 N/A ARG 83.B N GLU 79.B O no hydrogen 3.178 N/A ARG 83.B N LEU 80.B O no hydrogen 3.030 N/A ARG 83.B NE GLU 79.B OE2 no hydrogen 3.172 N/A ARG 83.B NH1 ASP 17.B O no hydrogen 2.671 N/A ARG 83.B NH2 GLU 79.B OE2 no hydrogen 3.286 N/A THR 84.B N ASN 81.B O no hydrogen 3.238 N/A THR 84.B OG1 LEU 80.B O no hydrogen 2.650 N/A GLN 85.B N LYS 11.B O no hydrogen 3.080 N/A LEU 92.B N PHE 87.B O no hydrogen 2.829 N/A HIS 96.B NE2 VAL 381.B O no hydrogen 2.942 N/A GLN 102.B N GLY 99.B O no hydrogen 2.911 N/A LYS 103.B NZ ASP 177.B O no hydrogen 2.844 N/A LYS 104.B N ASP 192.B OD2 no hydrogen 2.905 N/A SER 105.B N SER 191.B O no hydrogen 3.043 N/A SER 105.B OG HIS 235.B ND1 no hydrogen 2.793 N/A VAL 106.B N LEU 234.B O no hydrogen 2.730 N/A THR 107.B N VAL 189.B O no hydrogen 2.475 N/A THR 107.B OG1 HIS 198.B NE2 no hydrogen 2.991 N/A VAL 108.B N TYR 232.B O no hydrogen 3.132 N/A LEU 109.B N LEU 187.B O no hydrogen 2.762 N/A VAL 111.B N ASP 185.B O no hydrogen 2.844 N/A GLY 112.B N ASP 110.B OD1 no hydrogen 3.137 N/A ALA 114.B N VAL 111.B O no hydrogen 3.265 N/A TYR 115.B N GLY 112.B O no hydrogen 3.055 N/A TYR 115.B OH GLN 182.B OE1 no hydrogen 2.754 N/A TYR 115.B OH MET 184.B O no hydrogen 2.488 N/A PHE 116.B N ASP 113.B O no hydrogen 2.796 N/A SER 117.B N ALA 114.B O no hydrogen 3.443 N/A SER 117.B OG ALA 114.B O no hydrogen 3.202 N/A VAL 118.B N TYR 115.B O no hydrogen 3.287 N/A LEU 120.B N ASN 147.B O no hydrogen 2.838 N/A ASP 123.B N ASP 121.B OD1 no hydrogen 3.223 N/A PHE 124.B N ASP 121.B O no hydrogen 3.055 N/A ARG 125.B NE LEU 120.B O no hydrogen 2.818 N/A ARG 125.B NH1 ASN 147.B OD1 no hydrogen 3.371 N/A ARG 125.B NH2 LEU 120.B O no hydrogen 2.954 N/A LYS 126.B NZ ASP 123.B O no hydrogen 3.307 N/A TYR 127.B N PHE 124.B O no hydrogen 3.221 N/A THR 128.B N ARG 125.B O no hydrogen 2.935 N/A THR 128.B OG1 ARG 125.B O no hydrogen 2.557 N/A PHE 130.B N TYR 144.B O no hydrogen 2.921 N/A THR 131.B OG1 ASN 57.B OD1 no hydrogen 2.737 N/A ILE 132.B N ILE 142.B O no hydrogen 2.696 N/A SER 134.B OG THR 139.B O no hydrogen 3.072 N/A ASN 137.B N SER 134.B O no hydrogen 3.045 N/A GLU 138.B N ILE 135.B O no hydrogen 3.397 N/A THR 139.B N SER 134.B OG no hydrogen 3.173 N/A THR 139.B OG1 PRO 140.B O no hydrogen 2.918 N/A ILE 142.B N ILE 132.B O no hydrogen 3.157 N/A ARG 143.B NE GLY 51.B O no hydrogen 2.954 N/A ARG 143.B NH1 TYR 56.B O no hydrogen 3.434 N/A ARG 143.B NH1 ASN 57.B OD1 no hydrogen 3.075 N/A ARG 143.B NH1 THR 131.B OG1 no hydrogen 3.027 N/A ARG 143.B NH2 TYR 56.B O no hydrogen 2.831 N/A TYR 144.B N PHE 130.B O no hydrogen 3.007 N/A GLN 145.B N SER 48.B O no hydrogen 3.009 N/A TYR 146.B N THR 128.B OG1 no hydrogen 2.892 N/A ASN 147.B N LYS 46.B O no hydrogen 2.884 N/A ASN 147.B ND2 GLY 45.B O no hydrogen 2.872 N/A ASN 147.B ND2 SER 48.B OG no hydrogen 3.205 N/A LEU 149.B N VAL 118.B O no hydrogen 2.997 N/A GLY 152.B N ASP 185.B OD1 no hydrogen 3.059 N/A TRP 153.B NE1 THR 84.B OG1 no hydrogen 3.247 N/A LYS 154.B N ASN 81.B OD1 no hydrogen 2.830 N/A LYS 154.B NZ THR 84.B O no hydrogen 3.261 N/A LYS 154.B NZ GLN 85.B O no hydrogen 3.354 N/A LYS 154.B NZ ASP 86.B OD1 no hydrogen 3.162 N/A SER 156.B N TRP 153.B O no hydrogen 3.251 N/A SER 156.B OG PRO 150.B O no hydrogen 2.669 N/A ILE 159.B N GLY 155.B O no hydrogen 2.839 N/A PHE 160.B N SER 156.B O no hydrogen 2.949 N/A GLN 161.B N ALA 158.B O no hydrogen 3.295 N/A MET 164.B N PHE 160.B O no hydrogen 2.865 N/A THR 165.B N GLN 161.B O no hydrogen 3.079 N/A THR 165.B OG1 GLN 161.B O no hydrogen 3.126 N/A LYS 166.B N SER 162.B O no hydrogen 3.393 N/A ILE 167.B N SER 163.B O no hydrogen 3.179 N/A LEU 168.B N MET 164.B O no hydrogen 3.103 N/A GLU 169.B N LYS 166.B O no hydrogen 3.296 N/A ARG 172.B N LEU 168.B O no hydrogen 2.791 N/A LYS 173.B N GLU 169.B O no hydrogen 2.904 N/A GLN 174.B N PRO 170.B O no hydrogen 2.716 N/A ASN 175.B N PHE 171.B O no hydrogen 2.725 N/A ASN 175.B ND2 PHE 171.B O no hydrogen 3.014 N/A VAL 179.B N GLY 190.B O no hydrogen 3.129 N/A TYR 181.B N TYR 188.B O no hydrogen 2.933 N/A TYR 181.B OH GLY 384.B O no hydrogen 2.726 N/A TYR 183.B N ASP 186.B O no hydrogen 2.815 N/A ASP 186.B N TYR 183.B O no hydrogen 2.768 N/A LEU 187.B N LEU 109.B O no hydrogen 2.980 N/A TYR 188.B N TYR 181.B O no hydrogen 2.750 N/A VAL 189.B N THR 107.B O no hydrogen 2.589 N/A GLY 190.B N VAL 179.B O no hydrogen 2.863 N/A SER 191.B N SER 105.B O no hydrogen 2.957 N/A SER 191.B OG HIS 198.B ND1 no hydrogen 2.860 N/A LEU 193.B N SER 191.B OG no hydrogen 3.273 N/A HIS 198.B N GLU 194.B O no hydrogen 2.891 N/A HIS 198.B NE2 THR 107.B OG1 no hydrogen 2.991 N/A ARG 199.B N ILE 195.B O no hydrogen 2.693 N/A THR 200.B N GLY 196.B O no hydrogen 3.101 N/A THR 200.B OG1 GLY 196.B O no hydrogen 2.930 N/A LYS 201.B N GLN 197.B O no hydrogen 3.074 N/A LYS 201.B NZ ASN 175.B OD1 no hydrogen 2.998 N/A ILE 202.B N HIS 198.B O no hydrogen 3.008 N/A GLU 203.B N ARG 199.B O no hydrogen 2.855 N/A GLU 204.B N THR 200.B O no hydrogen 2.730 N/A LEU 205.B N LYS 201.B O no hydrogen 2.972 N/A ARG 206.B N ILE 202.B O no hydrogen 2.826 N/A GLN 207.B N GLU 203.B O no hydrogen 2.938 N/A HIS 208.B N GLU 204.B O no hydrogen 2.928 N/A LEU 209.B N LEU 205.B O no hydrogen 2.899 N/A LEU 210.B N ARG 206.B O no hydrogen 2.920 N/A ARG 211.B N GLN 207.B O no hydrogen 2.916 N/A ARG 211.B NH1 GLN 207.B OE1 no hydrogen 2.944 N/A TRP 212.B N HIS 208.B O no hydrogen 3.258 N/A GLY 213.B N LEU 209.B O no hydrogen 3.059 N/A LEU 234.B N VAL 106.B O no hydrogen 2.772 N/A HIS 235.B ND1 LYS 104.B O no hydrogen 2.882 N/A LYS 238.B N HIS 235.B O no hydrogen 3.005 N/A TRP 239.B N PRO 236.B O no hydrogen 2.755 N/A GLN 242.B N THR 351.B O no hydrogen 3.129 N/A THR 253.B N ASP 256.B OD2 no hydrogen 3.225 N/A VAL 254.B N GLU 291.B O no hydrogen 2.865 N/A ASN 255.B N LEU 289.B O no hydrogen 3.149 N/A ASP 256.B N THR 253.B OG1 no hydrogen 3.034 N/A ILE 257.B N THR 253.B O no hydrogen 2.999 N/A GLN 258.B N VAL 254.B O no hydrogen 2.803 N/A LYS 259.B N ASN 255.B O no hydrogen 2.834 N/A LEU 260.B N ASP 256.B O no hydrogen 2.755 N/A VAL 261.B N ILE 257.B O no hydrogen 2.652 N/A GLY 262.B N GLN 258.B O no hydrogen 2.925 N/A LYS 263.B N LYS 259.B O no hydrogen 3.091 N/A LYS 263.B NZ VAL 245.B O no hydrogen 2.800 N/A LYS 263.B NZ LEU 425.B O no hydrogen 3.419 N/A LEU 264.B N LEU 260.B O no hydrogen 3.023 N/A ASN 265.B N VAL 261.B O no hydrogen 2.729 N/A TRP 266.B N GLY 262.B O no hydrogen 3.087 N/A ALA 267.B N LYS 263.B O no hydrogen 2.890 N/A SER 268.B OG ASN 265.B O no hydrogen 2.828 N/A GLN 269.B N TRP 266.B O no hydrogen 3.220 N/A ILE 270.B N ALA 267.B O no hydrogen 3.051 N/A TYR 271.B N ALA 267.B O no hydrogen 2.830 N/A LYS 275.B N ASN 306.B OD1 no hydrogen 3.371 N/A GLN 278.B N GLU 302.B OE1 no hydrogen 2.910 N/A GLN 278.B N GLU 302.B OE2 no hydrogen 2.951 N/A LEU 279.B N GLU 302.B OE1 no hydrogen 2.789 N/A SER 280.B N VAL 276.B O no hydrogen 2.917 N/A LYS 281.B N ARG 277.B O no hydrogen 3.328 N/A LEU 282.B N LEU 279.B O no hydrogen 3.214 N/A LEU 283.B N SER 280.B O no hydrogen 2.817 N/A ARG 284.B N LYS 281.B O no hydrogen 3.066 N/A LYS 287.B NZ GLU 291.B OE2 no hydrogen 3.050 N/A GLU 291.B N ALA 288.B O no hydrogen 3.188 N/A VAL 293.B N TRP 252.B O no hydrogen 2.720 N/A ALA 299.B N THR 296.B OG1 no hydrogen 3.033 N/A GLU 300.B N THR 296.B O no hydrogen 2.926 N/A LEU 301.B N GLU 297.B O no hydrogen 2.899 N/A GLU 302.B N GLU 298.B O no hydrogen 2.796 N/A LEU 303.B N ALA 299.B O no hydrogen 2.802 N/A ALA 304.B N GLU 300.B O no hydrogen 3.081 N/A GLU 305.B N LEU 301.B O no hydrogen 3.079 N/A ASN 306.B N GLU 302.B O no hydrogen 3.160 N/A ASN 306.B ND2 LYS 275.B O no hydrogen 2.908 N/A ARG 307.B N LEU 303.B O no hydrogen 2.893 N/A ARG 307.B NH1 PRO 247.B O no hydrogen 3.486 N/A ARG 307.B NH2 PRO 247.B O no hydrogen 3.174 N/A GLU 308.B N ALA 304.B O no hydrogen 2.942 N/A ILE 309.B N GLU 305.B O no hydrogen 2.920 N/A LEU 310.B N ASN 306.B O no hydrogen 2.933 N/A LYS 311.B N ARG 307.B O no hydrogen 3.085 N/A LYS 311.B N GLU 308.B O no hydrogen 3.039 N/A ASP 320.B N GLN 343.B OE1 no hydrogen 3.049 N/A SER 322.B N ASP 320.B OD1 no hydrogen 2.925 N/A SER 322.B OG ASP 320.B OD1 no hydrogen 2.828 N/A SER 322.B OG ASP 320.B OD2 no hydrogen 3.223 N/A LYS 323.B N ASP 320.B O no hydrogen 3.237 N/A LYS 323.B NZ GLU 344.B OE2 no hydrogen 3.248 N/A ILE 326.B N TYR 342.B O no hydrogen 2.793 N/A ALA 327.B N LYS 388.B O no hydrogen 3.033 N/A GLU 328.B N GLN 340.B O no hydrogen 2.950 N/A GLN 330.B N THR 338.B O no hydrogen 2.906 N/A GLN 330.B NE2 GLN 340.B OE1 no hydrogen 2.786 N/A LYS 331.B NZ ASP 364.B OD2 no hydrogen 3.394 N/A GLN 332.B N GLN 336.B O no hydrogen 3.090 N/A GLN 332.B NE2 THR 338.B OG1 no hydrogen 2.802 N/A GLN 336.B N GLY 333.B O no hydrogen 3.069 N/A GLN 336.B NE2 TYR 427.B OH no hydrogen 2.877 N/A TRP 337.B N TYR 354.B O no hydrogen 2.907 N/A TRP 337.B NE1 GLN 367.B OE1 no hydrogen 2.784 N/A THR 338.B N GLN 330.B O no hydrogen 3.099 N/A THR 338.B OG1 GLN 330.B O no hydrogen 3.533 N/A THR 338.B OG1 GLN 330.B OE1 no hydrogen 2.471 N/A TYR 339.B N GLY 352.B O no hydrogen 3.062 N/A GLN 340.B N GLU 328.B O no hydrogen 3.027 N/A GLN 340.B NE2 GLN 330.B OE1 no hydrogen 2.913 N/A ILE 341.B N LYS 350.B O no hydrogen 2.732 N/A TYR 342.B N ILE 326.B O no hydrogen 2.859 N/A TYR 342.B OH GLU 328.B OE1 no hydrogen 3.016 N/A GLN 343.B NE2 ASP 320.B O no hydrogen 2.544 N/A GLN 343.B NE2 LYS 323.B O no hydrogen 2.688 N/A LYS 347.B N GLU 344.B O no hydrogen 3.227 N/A LEU 349.B N ILE 341.B O no hydrogen 2.740 N/A LYS 350.B N ILE 341.B O no hydrogen 3.285 N/A LYS 350.B NZ GLU 378.B OE2 no hydrogen 2.528 N/A THR 351.B OG1 GLN 242.B O no hydrogen 3.191 N/A GLY 352.B N TYR 339.B O no hydrogen 2.742 N/A TYR 354.B N TRP 337.B O no hydrogen 2.552 N/A ARG 356.B N GLY 335.B O no hydrogen 3.378 N/A ASN 363.B ND2 TYR 405.B OH no hydrogen 2.724 N/A VAL 365.B N ASN 363.B OD1 no hydrogen 2.860 N/A LYS 366.B N ASN 363.B OD1 no hydrogen 3.087 N/A GLN 367.B N ASN 363.B O no hydrogen 3.023 N/A GLN 367.B NE2 HIS 361.B ND1 no hydrogen 3.541 N/A LEU 368.B N ASP 364.B O no hydrogen 2.894 N/A THR 369.B N VAL 365.B O no hydrogen 2.894 N/A THR 369.B OG1 VAL 365.B O no hydrogen 2.577 N/A GLU 370.B N LYS 366.B O no hydrogen 2.879 N/A ALA 371.B N GLN 367.B O no hydrogen 2.693 N/A VAL 372.B N LEU 368.B O no hydrogen 2.780 N/A GLN 373.B N THR 369.B O no hydrogen 3.124 N/A GLN 373.B NE2 THR 369.B O no hydrogen 3.108 N/A GLN 373.B NE2 TYR 405.B O no hydrogen 3.326 N/A LYS 374.B N GLU 370.B O no hydrogen 3.004 N/A ILE 375.B N ALA 371.B O no hydrogen 2.863 N/A ALA 376.B N VAL 372.B O no hydrogen 2.868 N/A THR 377.B N GLN 373.B O no hydrogen 2.823 N/A THR 377.B OG1 GLN 373.B O no hydrogen 2.626 N/A GLU 378.B N LYS 374.B O no hydrogen 3.065 N/A SER 379.B N ILE 375.B O no hydrogen 3.072 N/A SER 379.B OG ILE 375.B O no hydrogen 3.255 N/A ILE 380.B N ALA 376.B O no hydrogen 2.941 N/A VAL 381.B N THR 377.B O no hydrogen 3.014 N/A ILE 382.B N GLU 378.B O no hydrogen 2.748 N/A TRP 383.B N SER 379.B O no hydrogen 2.631 N/A GLY 384.B N SER 379.B O no hydrogen 3.072 N/A GLY 384.B N ILE 380.B O no hydrogen 2.896 N/A LYS 385.B NZ PRO 321.B O no hydrogen 3.481 N/A LYS 385.B NZ LYS 323.B O no hydrogen 2.828 N/A THR 386.B OG1 TYR 183.B OH no hydrogen 3.387 N/A LYS 388.B N LEU 325.B O no hydrogen 2.784 N/A LYS 388.B NZ GLU 415.B OE1 no hydrogen 2.583 N/A PHE 389.B N GLU 413.B O no hydrogen 2.825 N/A LYS 390.B N ALA 327.B O no hydrogen 2.870 N/A LEU 391.B N GLU 415.B O no hydrogen 2.851 N/A ILE 393.B N LEU 391.B O no hydrogen 2.805 N/A LYS 395.B NZ GLU 399.B OE2 no hydrogen 2.934 N/A TRP 398.B N GLN 394.B O no hydrogen 3.053 N/A GLU 399.B N LYS 395.B O no hydrogen 2.880 N/A ALA 400.B N GLU 396.B O no hydrogen 3.072 N/A ALA 400.B N THR 397.B O no hydrogen 3.243 N/A TRP 401.B N TRP 398.B O no hydrogen 3.142 N/A TRP 402.B N TRP 398.B O no hydrogen 2.992 N/A GLU 404.B N TRP 401.B O no hydrogen 2.899 N/A TYR 405.B N TRP 402.B O no hydrogen 2.790 N/A TRP 406.B NE1 TRP 410.B O no hydrogen 2.832 N/A GLN 407.B N GLN 373.B OE1 no hydrogen 2.635 N/A THR 409.B OG1 ASP 186.B OD1 no hydrogen 3.103 N/A THR 409.B OG1 ASP 186.B OD2 no hydrogen 3.543 N/A GLU 415.B N PHE 389.B O no hydrogen 2.789 N/A VAL 417.B N LEU 391.B O no hydrogen 3.057 N/A