Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8pvk_LB.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 9.A NE GLY 11.A O no hydrogen 3.093 N/A ARG 9.A NH1 THR 263.A O no hydrogen 2.891 N/A ALA 14.A N SER 12.A OG no hydrogen 3.292 N/A PHE 15.A N SER 12.A O no hydrogen 3.421 N/A ARG 18.A NE HIS 273.A NE2 no hydrogen 3.568 N/A ARG 18.A NH1 ARG 232.A O no hydrogen 3.164 N/A ARG 20.A NE GLN 269.A OE1 no hydrogen 2.950 N/A ALA 21.A N TYR 272.A O no hydrogen 2.971 N/A ARG 23.A NE ARG 25.A O no hydrogen 2.857 N/A ARG 23.A NH2 ARG 25.A O no hydrogen 3.040 N/A ARG 23.A NH2 GLY 26.A O no hydrogen 2.848 N/A HIS 24.A ND1 TYR 272.A OH no hydrogen 2.639 N/A ARG 27.A N HIS 274.A NE2 no hydrogen 3.026 N/A LYS 38.A N ASP 35.A O no hydrogen 3.182 N/A HIS 41.A N ASN 184.A O no hydrogen 2.889 N/A HIS 41.A ND1 PRO 39.A O no hydrogen 2.759 N/A THR 43.A N GLN 182.A O no hydrogen 2.988 N/A THR 43.A OG1 GLN 182.A O no hydrogen 2.706 N/A ALA 45.A N LEU 338.A O no hydrogen 2.888 N/A GLY 47.A N MET 336.A O no hydrogen 2.938 N/A TYR 48.A N ASP 79.A O no hydrogen 2.924 N/A TYR 48.A OH THR 164.A OG1 no hydrogen 2.804 N/A TYR 48.A OH HIS 177.A ND1 no hydrogen 2.746 N/A LYS 49.A N ARG 334.A O no hydrogen 2.980 N/A LYS 49.A NZ GLY 330.A O no hydrogen 2.625 N/A ALA 50.A N ILE 77.A O no hydrogen 2.943 N/A THR 53.A N VAL 75.A O no hydrogen 3.086 N/A THR 53.A OG1 ASP 360.A O no hydrogen 2.636 N/A THR 54.A N THR 53.A OG1 no hydrogen 2.646 N/A ILE 55.A N GLU 73.A O no hydrogen 3.158 N/A VAL 56.A N TRP 358.A O no hydrogen 2.908 N/A ARG 57.A N VAL 71.A O no hydrogen 2.774 N/A ARG 57.A NH2 GLU 352.A OE1 no hydrogen 3.086 N/A ASP 58.A N GLU 355.A O no hydrogen 3.102 N/A LEU 59.A N LYS 69.A O no hydrogen 2.987 N/A ARG 61.A N HIS 67.A ND1 no hydrogen 3.067 N/A ARG 61.A NE GLU 352.A OE1 no hydrogen 3.537 N/A ARG 61.A NE GLU 352.A OE2 no hydrogen 2.884 N/A ARG 61.A NH2 GLU 352.A OE1 no hydrogen 3.267 N/A ALA 64.A N ARG 61.A O no hydrogen 3.168 N/A HIS 67.A N ALA 64.A O no hydrogen 3.382 N/A LYS 68.A N LEU 59.A O no hydrogen 2.940 N/A LYS 68.A NZ ASP 60.A OD1 no hydrogen 3.210 N/A LYS 69.A N ALA 66.A O no hydrogen 3.311 N/A LYS 69.A NZ LYS 65.A O no hydrogen 3.133 N/A VAL 71.A N ARG 57.A O no hydrogen 2.829 N/A GLU 73.A N ILE 55.A O no hydrogen 3.433 N/A VAL 75.A N THR 53.A O no hydrogen 3.099 N/A THR 76.A N ILE 324.A O no hydrogen 2.823 N/A THR 76.A OG1 GLY 326.A O no hydrogen 2.592 N/A ILE 77.A N GLY 51.A O no hydrogen 2.769 N/A ILE 78.A N VAL 322.A O no hydrogen 2.934 N/A ASP 79.A N TYR 48.A O no hydrogen 2.858 N/A CYS 80.A N ASP 320.A O no hydrogen 2.654 N/A CYS 80.A SG ILE 78.A O no hydrogen 3.505 N/A MET 83.A N VAL 203.A O no hydrogen 2.926 N/A VAL 84.A N HIS 163.A O no hydrogen 2.900 N/A VAL 85.A N LYS 201.A O no hydrogen 2.985 N/A VAL 86.A N LEU 161.A O no hydrogen 2.849 N/A LEU 88.A N VAL 104.A O no hydrogen 2.892 N/A VAL 89.A N ARG 159.A O no hydrogen 2.724 N/A GLY 90.A N THR 102.A O no hydrogen 2.958 N/A TYR 91.A N VAL 157.A O no hydrogen 2.918 N/A TYR 91.A OH GLU 180.A OE1 no hydrogen 2.647 N/A TYR 91.A OH GLU 180.A OE2 no hydrogen 2.894 N/A ILE 92.A N ARG 99.A O no hydrogen 2.891 N/A THR 94.A N GLY 97.A O no hydrogen 2.877 N/A THR 94.A OG1 GLY 97.A O no hydrogen 2.695 N/A ARG 96.A N THR 94.A OG1 no hydrogen 3.165 N/A GLY 97.A N THR 94.A O no hydrogen 2.913 N/A ARG 99.A N ILE 92.A O no hydrogen 2.924 N/A LEU 101.A N GLY 90.A O no hydrogen 2.884 N/A VAL 104.A N LEU 88.A O no hydrogen 2.852 N/A TRP 105.A N TYR 132.A OH no hydrogen 3.000 N/A ALA 106.A N VAL 86.A O no hydrogen 2.884 N/A HIS 108.A N GLU 200.A OE2 no hydrogen 3.072 N/A GLU 112.A N SER 110.A OG no hydrogen 3.337 N/A LYS 114.A N SER 110.A O no hydrogen 2.934 N/A LYS 114.A NZ ALA 128.A O no hydrogen 3.340 N/A ARG 115.A N ASP 111.A O no hydrogen 2.906 N/A ARG 116.A N VAL 113.A O no hydrogen 3.301 N/A ARG 116.A NE ALA 176.A O no hydrogen 2.706 N/A ARG 116.A NH2 ALA 176.A O no hydrogen 2.769 N/A PHE 117.A N LYS 114.A O no hydrogen 3.288 N/A TYR 118.A N ARG 115.A O no hydrogen 3.300 N/A LYS 123.A N ASN 120.A O no hydrogen 2.892 N/A SER 124.A N TRP 121.A O no hydrogen 3.376 N/A LYS 126.A N SER 124.A OG no hydrogen 2.650 N/A THR 130.A N LYS 127.A O no hydrogen 3.227 N/A THR 130.A OG1 LYS 127.A O no hydrogen 2.393 N/A ALA 133.A N PHE 129.A O no hydrogen 2.915 N/A LYS 134.A N LYS 131.A O no hydrogen 3.376 N/A LYS 135.A N TYR 132.A O no hydrogen 3.320 N/A TYR 136.A OH TRP 105.A O no hydrogen 2.798 N/A ALA 137.A N LYS 134.A O no hydrogen 2.924 N/A GLU 138.A N LYS 134.A O no hydrogen 2.928 N/A GLY 141.A N GLU 138.A O no hydrogen 3.246 N/A THR 145.A N GLY 141.A O no hydrogen 2.939 N/A THR 145.A OG1 GLY 141.A O no hydrogen 2.939 N/A ARG 146.A N ALA 142.A O no hydrogen 2.871 N/A GLU 147.A N SER 143.A O no hydrogen 2.935 N/A LEU 148.A N ILE 144.A O no hydrogen 2.957 N/A GLU 149.A N THR 145.A O no hydrogen 2.896 N/A ARG 150.A N ARG 146.A O no hydrogen 2.916 N/A ARG 150.A NE GLU 147.A OE1 no hydrogen 3.134 N/A ILE 151.A N GLU 147.A O no hydrogen 2.975 N/A LYS 152.A N LEU 148.A O no hydrogen 2.912 N/A LYS 152.A NZ GLU 193.A OE1 no hydrogen 2.436 N/A LYS 153.A N GLU 149.A O no hydrogen 2.906 N/A LYS 153.A NZ TYR 154.A OH no hydrogen 3.074 N/A TYR 154.A N ARG 150.A O no hydrogen 2.949 N/A CYS 155.A N ILE 151.A O no hydrogen 3.312 N/A THR 156.A N TYR 91.A O no hydrogen 2.767 N/A THR 156.A OG1 TYR 91.A O no hydrogen 3.345 N/A VAL 157.A N TYR 91.A O no hydrogen 3.309 N/A ARG 159.A N VAL 89.A O no hydrogen 3.064 N/A ARG 159.A NE GLN 182.A OE1 no hydrogen 3.333 N/A ARG 159.A NH1 GLU 180.A OE1 no hydrogen 2.969 N/A VAL 160.A N ILE 181.A O no hydrogen 2.862 N/A LEU 161.A N GLY 87.A O no hydrogen 2.942 N/A ALA 162.A N MET 179.A O no hydrogen 2.946 N/A HIS 163.A N VAL 84.A O no hydrogen 2.944 N/A HIS 163.A ND1 THR 164.A O no hydrogen 2.943 N/A THR 164.A N HIS 177.A O no hydrogen 2.940 N/A THR 164.A OG1 TYR 48.A OH no hydrogen 2.804 N/A THR 164.A OG1 HIS 177.A O no hydrogen 3.517 N/A GLN 165.A NE2 PRO 82.A O no hydrogen 2.843 N/A LYS 168.A N GLN 165.A O no hydrogen 3.362 N/A THR 169.A N ILE 166.A O no hydrogen 3.349 N/A THR 169.A OG1 ILE 166.A O no hydrogen 2.443 N/A GLN 173.A NE2 LYS 175.A O no hydrogen 2.533 N/A LYS 175.A NZ TYR 118.A O no hydrogen 3.309 N/A ALA 176.A N GLU 112.A O no hydrogen 2.938 N/A HIS 177.A N THR 164.A OG1 no hydrogen 3.128 N/A HIS 177.A ND1 TYR 48.A OH no hydrogen 2.746 N/A MET 179.A N ALA 162.A O no hydrogen 2.895 N/A ILE 181.A N VAL 160.A O no hydrogen 2.884 N/A GLN 182.A NE2 ASN 184.A OD1 no hydrogen 2.870 N/A ILE 183.A N VAL 158.A O no hydrogen 2.941 N/A ASN 184.A N HIS 41.A O no hydrogen 2.902 N/A ASN 184.A ND2 PRO 32.A O no hydrogen 3.010 N/A GLY 185.A N ASP 34.A OD1 no hydrogen 2.531 N/A GLY 186.A N LYS 38.A O no hydrogen 2.667 N/A SER 187.A N ASP 190.A OD2 no hydrogen 3.203 N/A ASP 190.A N SER 187.A OG no hydrogen 3.373 N/A LYS 191.A N SER 187.A O no hydrogen 2.930 N/A LYS 191.A NZ ASP 34.A OD2 no hydrogen 2.590 N/A LYS 191.A NZ ILE 183.A O no hydrogen 2.836 N/A LYS 191.A NZ GLY 185.A O no hydrogen 3.221 N/A VAL 192.A N VAL 188.A O no hydrogen 2.928 N/A GLU 193.A N ALA 189.A O no hydrogen 2.933 N/A PHE 194.A N ASP 190.A O no hydrogen 2.893 N/A GLY 195.A N LYS 191.A O no hydrogen 2.944 N/A ARG 196.A N VAL 192.A O no hydrogen 2.932 N/A ARG 196.A NH2 GLU 193.A OE2 no hydrogen 2.406 N/A SER 197.A N GLU 193.A O no hydrogen 2.916 N/A SER 197.A OG GLU 193.A O no hydrogen 2.887 N/A LEU 198.A N PHE 194.A O no hydrogen 2.916 N/A PHE 199.A N ARG 196.A O no hydrogen 3.366 N/A GLU 200.A N VAL 85.A O no hydrogen 2.714 N/A LYS 201.A NZ SER 197.A O no hydrogen 3.123 N/A VAL 203.A N MET 83.A O no hydrogen 2.821 N/A THR 204.A OG1 ASP 206.A OD1 no hydrogen 3.138 N/A THR 207.A N THR 204.A O no hydrogen 3.425 N/A THR 207.A OG1 THR 204.A O no hydrogen 2.714 N/A ILE 208.A N ILE 205.A O no hydrogen 3.175 N/A PHE 209.A N ILE 205.A O no hydrogen 2.938 N/A GLU 210.A N GLU 213.A OE1 no hydrogen 3.247 N/A LYS 211.A NZ ASP 212.A OD1 no hydrogen 2.557 N/A LYS 211.A NZ ASP 212.A OD2 no hydrogen 3.184 N/A LYS 211.A NZ VAL 354.A O no hydrogen 2.597 N/A ASP 212.A N ILE 282.A O no hydrogen 3.051 N/A ILE 215.A N HIS 280.A O no hydrogen 2.870 N/A ASP 216.A N ARG 339.A O no hydrogen 2.888 N/A VAL 217.A N SER 277.A O no hydrogen 2.864 N/A ILE 218.A N THR 337.A O no hydrogen 2.884 N/A ALA 219.A N ARG 275.A O no hydrogen 3.000 N/A THR 221.A N HIS 273.A O no hydrogen 2.878 N/A THR 221.A OG1 HIS 273.A O no hydrogen 3.240 N/A HIS 224.A N MET 270.A O no hydrogen 2.976 N/A VAL 227.A N GLY 268.A O no hydrogen 2.789 N/A ARG 232.A N GLY 228.A O no hydrogen 2.910 N/A ARG 232.A NE GLN 269.A O no hydrogen 2.919 N/A ARG 232.A NH1 ARG 266.A O no hydrogen 2.735 N/A ARG 232.A NH2 ARG 18.A O no hydrogen 2.997 N/A ARG 232.A NH2 GLN 269.A O no hydrogen 3.026 N/A TRP 233.A N VAL 229.A O no hydrogen 2.895 N/A TRP 233.A NE1 ARG 266.A O no hydrogen 3.179 N/A LEU 238.A N LEU 246.A O no hydrogen 3.018 N/A THR 242.A OG1 PRO 239.A O no hydrogen 2.341 N/A GLY 245.A N THR 242.A O no hydrogen 3.300 N/A LYS 248.A NZ LYS 244.A O no hydrogen 2.577 N/A HIS 259.A N PRO 257.A O no hydrogen 2.805 N/A VAL 264.A N GLN 261.A O no hydrogen 3.313 N/A GLY 268.A N VAL 227.A O no hydrogen 3.096 N/A GLN 269.A NE2 GLY 271.A O no hydrogen 3.063 N/A MET 270.A N GLY 225.A O no hydrogen 2.985 N/A GLY 271.A N HIS 273.A NE2 no hydrogen 3.104 N/A TYR 272.A N LYS 222.A O no hydrogen 3.103 N/A TYR 272.A OH HIS 24.A ND1 no hydrogen 2.639 N/A HIS 273.A N THR 221.A OG1 no hydrogen 2.839 N/A HIS 273.A ND1 LYS 19.A O no hydrogen 2.727 N/A HIS 274.A NE2 ARG 27.A O no hydrogen 3.115 N/A ARG 275.A N ALA 219.A O no hydrogen 2.879 N/A ARG 275.A NH1 HIS 274.A O no hydrogen 2.647 N/A SER 277.A N VAL 217.A O no hydrogen 2.922 N/A SER 277.A OG VAL 217.A O no hydrogen 3.274 N/A SER 277.A OG HIS 280.A NE2 no hydrogen 2.986 N/A ASN 279.A N ASP 216.A OD1 no hydrogen 3.461 N/A HIS 280.A N ILE 215.A O no hydrogen 2.922 N/A HIS 280.A NE2 SER 277.A OG no hydrogen 2.986 N/A LYS 281.A NZ LYS 349.A O no hydrogen 2.471 N/A LYS 281.A NZ ALA 350.A O no hydrogen 3.040 N/A LYS 281.A NZ GLU 352.A O no hydrogen 2.747 N/A ILE 282.A N GLU 213.A O no hydrogen 2.868 N/A TYR 283.A N MET 323.A O no hydrogen 2.769 N/A TYR 283.A OH GLU 73.A OE1 no hydrogen 2.974 N/A TYR 283.A OH GLU 73.A OE2 no hydrogen 3.390 N/A ARG 284.A NH1 ASN 293.A O no hydrogen 2.627 N/A ARG 284.A NH1 SER 295.A O no hydrogen 2.985 N/A ARG 284.A NH2 SER 295.A O no hydrogen 3.394 N/A GLY 286.A N TYR 321.A O no hydrogen 2.923 N/A LYS 287.A NZ ASP 206.A OD1 no hydrogen 2.962 N/A LYS 287.A NZ ASP 320.A OD2 no hydrogen 2.956 N/A GLY 288.A N ASP 320.A OD1 no hydrogen 2.690 N/A ALA 292.A N ASP 290.A OD1 no hydrogen 3.424 N/A ASN 293.A ND2 LYS 287.A O no hydrogen 2.736 N/A ALA 294.A N LYS 303.A O no hydrogen 3.148 N/A SER 295.A N ALA 292.A O no hydrogen 3.217 N/A SER 295.A OG THR 296.A O no hydrogen 3.380 N/A SER 295.A OG ASP 299.A O no hydrogen 2.717 N/A THR 296.A N ASP 299.A O no hydrogen 3.164 N/A THR 296.A OG1 LYS 357.A O no hydrogen 2.501 N/A THR 298.A OG1 LYS 357.A O no hydrogen 3.020 N/A ASP 299.A N THR 296.A OG1 no hydrogen 2.992 N/A THR 301.A N ASP 299.A OD1 no hydrogen 3.422 N/A THR 301.A OG1 ASP 299.A OD1 no hydrogen 3.042 N/A LYS 303.A NZ ILE 359.A O no hydrogen 2.830 N/A LYS 303.A NZ THR 361.A OG1 no hydrogen 2.864 N/A MET 308.A N THR 361.A O no hydrogen 3.146 N/A GLY 310.A N PRO 307.A O no hydrogen 2.838 N/A PHE 311.A N GLY 315.A O no hydrogen 2.849 N/A VAL 312.A N GLU 364.A OE2 no hydrogen 2.548 N/A TYR 314.A N PHE 311.A O no hydrogen 3.261 N/A TYR 314.A OH ASP 79.A OD2 no hydrogen 3.232 N/A GLY 315.A N PHE 311.A O no hydrogen 3.276 N/A VAL 317.A N THR 306.A OG1 no hydrogen 3.204 N/A ASN 319.A ND2 ASP 79.A OD1 no hydrogen 3.160 N/A ASN 319.A ND2 ASP 79.A OD2 no hydrogen 3.270 N/A ASN 319.A ND2 LYS 168.A O no hydrogen 3.013 N/A TYR 321.A N GLY 286.A O no hydrogen 2.898 N/A TYR 321.A OH ASN 293.A O no hydrogen 2.588 N/A VAL 322.A N ILE 78.A O no hydrogen 2.899 N/A MET 323.A N ARG 284.A O no hydrogen 2.875 N/A ILE 324.A N THR 76.A O no hydrogen 2.926 N/A LYS 325.A N LYS 281.A O no hydrogen 2.970 N/A LYS 325.A NZ GLU 73.A OE1 no hydrogen 2.817 N/A GLY 326.A N ALA 74.A O no hydrogen 2.843 N/A LYS 332.A NZ ALA 50.A O no hydrogen 3.184 N/A LYS 332.A NZ VAL 312.A O no hydrogen 2.673 N/A LYS 332.A NZ GLU 364.A OE2 no hydrogen 3.261 N/A LYS 333.A N LYS 49.A O no hydrogen 2.976 N/A LYS 333.A NZ ARG 313.A O no hydrogen 3.208 N/A ARG 334.A N VAL 331.A O no hydrogen 3.328 N/A ARG 334.A NH1 VAL 220.A O no hydrogen 2.975 N/A MET 336.A N GLY 47.A O no hydrogen 2.849 N/A THR 337.A N ILE 218.A O no hydrogen 2.990 N/A LEU 338.A N ALA 45.A O no hydrogen 2.896 N/A ARG 339.A N ASP 216.A O no hydrogen 2.898 N/A ARG 339.A NE ASP 216.A OD2 no hydrogen 3.364 N/A ARG 339.A NE LYS 340.A O no hydrogen 3.352 N/A ARG 339.A NH2 ASP 216.A OD2 no hydrogen 2.439 N/A LYS 340.A N THR 43.A O no hydrogen 3.087 N/A LYS 340.A NZ ILE 208.A O no hydrogen 2.980 N/A LYS 340.A NZ GLU 213.A OE1 no hydrogen 3.485 N/A LYS 340.A NZ GLU 213.A OE2 no hydrogen 2.894 N/A SER 341.A OG PHE 343.A O no hydrogen 3.175 N/A SER 341.A OG HIS 345.A NE2 no hydrogen 2.938 N/A LEU 351.A N ARG 348.A O no hydrogen 3.045 N/A VAL 354.A N ASP 212.A OD1 no hydrogen 3.147 N/A LYS 357.A N VAL 56.A O no hydrogen 2.845 N/A ASP 360.A N THR 54.A O no hydrogen 2.649 N/A THR 361.A N GLN 371.A OE1 no hydrogen 2.616 N/A THR 361.A OG1 GLN 371.A O no hydrogen 3.425 N/A THR 361.A OG1 GLN 371.A OE1 no hydrogen 2.928 N/A SER 362.A N ASP 360.A OD1 no hydrogen 3.109 N/A SER 362.A OG ASP 360.A OD1 no hydrogen 2.737 N/A SER 362.A OG ASP 360.A OD2 no hydrogen 3.320 N/A SER 362.A OG GLY 368.A O no hydrogen 3.437 N/A PHE 365.A N SER 363.A OG no hydrogen 3.081 N/A GLN 371.A N GLU 375.A OE1 no hydrogen 2.818 N/A GLN 371.A NE2 ASP 360.A OD1 no hydrogen 3.249 N/A GLU 375.A N THR 372.A OG1 no hydrogen 3.323 N/A LYS 376.A N THR 372.A O no hydrogen 2.945 N/A LYS 377.A N ALA 373.A O no hydrogen 2.906 N/A LYS 377.A NZ ALA 373.A O no hydrogen 2.924 N/A GLN 378.A N ALA 374.A O no hydrogen 2.885 N/A PHE 379.A N GLU 375.A O no hydrogen 2.944 N/A MET 380.A N LYS 376.A O no hydrogen 2.892 N/A GLY 381.A N LYS 377.A O no hydrogen 2.911 N/A LEU 383.A N ASP 386.A OD2 no hydrogen 2.890 N/A ASP 386.A N LEU 383.A O no hydrogen 3.278 N/A GLN 388.A N LYS 384.A O no hydrogen 2.956 N/A THR 389.A N LYS 385.A O no hydrogen 2.889 N/A THR 389.A OG1 LYS 385.A O no hydrogen 2.966 N/A