Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4x0b_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 4.A NE2 GLU 8.A OE2 no hydrogen 3.453 N/A ILE 5.A N MET 1.A O no hydrogen 2.956 N/A ALA 6.A N VAL 2.A O no hydrogen 2.909 N/A LYS 7.A N GLY 3.A O no hydrogen 2.909 N/A GLU 8.A N GLN 4.A O no hydrogen 2.911 N/A MET 9.A N ILE 5.A O no hydrogen 2.894 N/A GLY 10.A N LYS 7.A O no hydrogen 3.429 N/A LEU 11.A N ALA 6.A O no hydrogen 2.884 N/A ARG 12.A NE TYR 14.A OH no hydrogen 2.574 N/A ALA 13.A N ASN 106.A OD1 no hydrogen 3.167 N/A TYR 14.A N VAL 35.A O no hydrogen 2.924 N/A ILE 15.A N ILE 103.A O no hydrogen 2.896 N/A VAL 16.A N ASP 33.A O no hydrogen 2.896 N/A GLY 17.A N MET 101.A O no hydrogen 3.437 N/A ARG 21.A N GLY 17.A O no hydrogen 3.347 N/A ARG 21.A NE ASP 22.A OD1 no hydrogen 3.440 N/A ARG 21.A NH1 ASN 99.A OD1 no hydrogen 2.358 N/A ARG 21.A NH2 ASP 22.A OD1 no hydrogen 3.316 N/A ASP 22.A N GLY 18.A O no hydrogen 2.762 N/A ILE 23.A N VAL 19.A O no hydrogen 2.756 N/A LEU 24.A N VAL 20.A O no hydrogen 2.869 N/A LEU 25.A N ARG 21.A O no hydrogen 2.650 N/A GLY 26.A N ILE 23.A O no hydrogen 3.106 N/A VAL 32.A N LYS 72.A O no hydrogen 2.892 N/A PHE 34.A N GLU 74.A O no hydrogen 2.848 N/A VAL 35.A N TYR 14.A O no hydrogen 2.870 N/A VAL 36.A N ALA 76.A O no hydrogen 2.906 N/A GLU 37.A N ARG 12.A O no hydrogen 2.889 N/A ALA 40.A N THR 77.A OG1 no hydrogen 3.351 N/A GLU 42.A N ASN 39.A OD1 no hydrogen 2.627 N/A ALA 44.A N ALA 40.A O no hydrogen 2.930 N/A LYS 45.A N ILE 41.A O no hydrogen 2.907 N/A GLU 46.A N GLU 42.A O no hydrogen 2.903 N/A LEU 47.A N LEU 43.A O no hydrogen 2.927 N/A ALA 48.A N ALA 44.A O no hydrogen 2.911 N/A ARG 49.A N LYS 45.A O no hydrogen 2.920 N/A ARG 49.A NH2 GLU 46.A OE2 no hydrogen 3.253 N/A ARG 50.A N GLU 46.A O no hydrogen 2.907 N/A ARG 50.A NH2 GLU 8.A OE2 no hydrogen 2.997 N/A HIS 51.A N LEU 47.A O no hydrogen 3.299 N/A HIS 51.A ND1 LEU 47.A O no hydrogen 3.070 N/A GLY 52.A N ARG 49.A O no hydrogen 3.112 N/A VAL 53.A N ALA 48.A O no hydrogen 2.839 N/A HIS 56.A N HIS 65.A O no hydrogen 2.890 N/A PHE 58.A N THR 63.A O no hydrogen 2.851 N/A GLY 62.A N PHE 58.A O no hydrogen 2.761 N/A THR 63.A N PHE 58.A O no hydrogen 2.945 N/A ALA 64.A N PHE 75.A O no hydrogen 2.904 N/A HIS 65.A N HIS 56.A O no hydrogen 2.924 N/A LEU 66.A N LEU 73.A O no hydrogen 2.940 N/A ILE 68.A N LEU 71.A O no hydrogen 2.912 N/A LEU 71.A N ILE 68.A O no hydrogen 2.903 N/A LYS 72.A N TRP 30.A O no hydrogen 2.564 N/A LEU 73.A N LEU 66.A O no hydrogen 2.865 N/A GLU 74.A N VAL 32.A O no hydrogen 2.942 N/A PHE 75.A N ALA 64.A O no hydrogen 2.889 N/A ALA 76.A N PHE 34.A O no hydrogen 2.909 N/A THR 77.A N GLY 62.A O no hydrogen 3.251 N/A THR 77.A OG1 GLY 62.A O no hydrogen 2.844 N/A ALA 78.A N VAL 36.A O no hydrogen 2.956 N/A ARG 79.A N ASP 90.A OD2 no hydrogen 3.011 N/A ARG 79.A NH1 GLU 81.A O no hydrogen 3.170 N/A ARG 80.A NH1 GLU 83.A O no hydrogen 2.472 N/A ARG 80.A NH2 PRO 84.A O no hydrogen 2.993 N/A ARG 80.A NH2 GLU 89.A OE2 no hydrogen 3.529 N/A LEU 87.A N GLU 37.A OE2 no hydrogen 2.978 N/A GLU 89.A N SER 86.A OG no hydrogen 3.406 N/A ASP 90.A N SER 86.A O no hydrogen 3.162 N/A LEU 91.A N LEU 87.A O no hydrogen 2.892 N/A ILE 92.A N LYS 88.A O no hydrogen 2.933 N/A ARG 93.A NE ARG 79.A O no hydrogen 3.223 N/A ARG 93.A NH2 ASP 90.A OD2 no hydrogen 3.209 N/A ARG 94.A N LEU 91.A O no hydrogen 3.357 N/A ARG 94.A NH2 ASP 90.A OD1 no hydrogen 2.656 N/A PHE 96.A N ASP 95.A OD1 no hydrogen 2.623 N/A THR 97.A N ARG 129.A O no hydrogen 2.903 N/A THR 97.A OG1 ASP 122.A OD2 no hydrogen 2.775 N/A ASN 99.A N PHE 96.A O no hydrogen 2.873 N/A ASN 99.A ND2 ASP 95.A OD1 no hydrogen 3.467 N/A ASN 99.A ND2 ASP 95.A OD2 no hydrogen 3.483 N/A ALA 100.A N THR 97.A O no hydrogen 3.111 N/A ALA 102.A N ILE 114.A O no hydrogen 2.965 N/A ILE 103.A N ILE 15.A O no hydrogen 2.890 N/A SER 104.A N THR 112.A O no hydrogen 3.208 N/A SER 104.A OG ASP 109.A OD1 no hydrogen 2.959 N/A SER 104.A OG ASP 109.A OD2 no hydrogen 2.727 N/A VAL 105.A N ALA 13.A O no hydrogen 3.349 N/A ASN 106.A N SER 104.A OG no hydrogen 3.158 N/A GLU 108.A N GLU 108.A OE1 no hydrogen 2.503 N/A ASP 109.A N ASP 109.A OD1 no hydrogen 2.538 N/A THR 112.A OG1 ASP 109.A O no hydrogen 2.521 N/A ILE 114.A N ALA 102.A O no hydrogen 2.528 N/A GLY 119.A N ASP 115.A OD1 no hydrogen 2.921 N/A LEU 120.A N ASP 115.A OD2 no hydrogen 2.719 N/A ASP 122.A N GLY 118.A O no hydrogen 3.435 N/A LEU 123.A N GLY 119.A O no hydrogen 2.908 N/A LYS 124.A N LEU 120.A O no hydrogen 2.897 N/A LYS 124.A NZ ASP 125.A OD1 no hydrogen 3.442 N/A ASP 125.A N ARG 121.A O no hydrogen 2.641 N/A VAL 127.A N ASP 122.A O no hydrogen 2.704 N/A ILE 128.A N LYS 156.A O no hydrogen 2.788 N/A ARG 129.A NE ASP 122.A OD1 no hydrogen 3.453 N/A VAL 130.A N THR 161.A OG1 no hydrogen 3.115 N/A LEU 131.A N ASP 95.A O no hydrogen 3.327 N/A HIS 132.A N SER 135.A OG no hydrogen 3.198 N/A SER 135.A N HIS 132.A O no hydrogen 2.952 N/A SER 135.A OG HIS 132.A O no hydrogen 2.287 N/A GLU 138.A N VAL 134.A O no hydrogen 3.096 N/A ASP 139.A N SER 135.A O no hydrogen 3.315 N/A ARG 142.A N ASP 139.A O no hydrogen 2.973 N/A ARG 142.A NH2 ARG 93.A O no hydrogen 3.038 N/A ILE 143.A N PRO 140.A O no hydrogen 2.937 N/A ARG 145.A N VAL 141.A O no hydrogen 3.223 N/A ARG 145.A NE ASP 95.A OD2 no hydrogen 3.441 N/A ARG 145.A NH2 ASP 95.A OD2 no hydrogen 3.255 N/A ALA 146.A N ARG 142.A O no hydrogen 2.524 N/A LEU 147.A N ILE 143.A O no hydrogen 3.111 N/A ARG 148.A N LEU 144.A O no hydrogen 2.711 N/A PHE 149.A N ARG 145.A O no hydrogen 2.728 N/A ALA 150.A N ALA 146.A O no hydrogen 2.783 N/A GLY 151.A N LEU 147.A O no hydrogen 2.673 N/A GLY 151.A N ARG 148.A O no hydrogen 2.945 N/A ARG 152.A N ARG 148.A O no hydrogen 2.990 N/A ARG 152.A NH2 GLU 192.A OE2 no hydrogen 3.299 N/A LEU 153.A N PHE 149.A O no hydrogen 2.960 N/A LYS 156.A N LYS 126.A O no hydrogen 2.892 N/A SER 158.A N ILE 128.A O no hydrogen 3.279 N/A GLU 162.A N SER 158.A O no hydrogen 2.657 N/A LYS 163.A N ARG 159.A O no hydrogen 2.922 N/A LEU 164.A N SER 160.A O no hydrogen 2.902 N/A LEU 165.A N THR 161.A O no hydrogen 2.903 N/A LYS 166.A N GLU 162.A O no hydrogen 2.928 N/A GLN 167.A N LYS 163.A O no hydrogen 2.885 N/A ALA 168.A N LEU 164.A O no hydrogen 2.912 N/A VAL 169.A N LEU 165.A O no hydrogen 2.932 N/A ASN 170.A N LYS 166.A O no hydrogen 2.894 N/A LEU 171.A N GLN 167.A O no hydrogen 3.032 N/A GLY 172.A N VAL 169.A O no hydrogen 2.838 N/A LEU 173.A N ALA 168.A O no hydrogen 3.336 N/A LYS 175.A NZ GLU 210.A O no hydrogen 2.888 N/A ALA 177.A N LEU 173.A O no hydrogen 3.204 N/A ARG 179.A NE GLU 269.A OE1 no hydrogen 2.649 N/A ARG 179.A NH1 ILE 211.A O no hydrogen 2.639 N/A ARG 179.A NH2 ILE 211.A O no hydrogen 3.457 N/A ARG 179.A NH2 GLU 269.A OE1 no hydrogen 3.347 N/A LEU 182.A N PRO 178.A O no hydrogen 3.407 N/A ILE 183.A N ARG 179.A O no hydrogen 2.916 N/A ASN 184.A N GLY 180.A O no hydrogen 2.907 N/A GLU 185.A N ARG 181.A O no hydrogen 2.906 N/A ILE 186.A N LEU 182.A O no hydrogen 2.919 N/A LYS 187.A N ILE 183.A O no hydrogen 2.911 N/A LYS 187.A NZ MET 270.A O no hydrogen 3.397 N/A LYS 187.A NZ SER 271.A OG no hydrogen 2.620 N/A LEU 188.A N ASN 184.A O no hydrogen 2.905 N/A ALA 189.A N GLU 185.A O no hydrogen 2.903 N/A LEU 190.A N ILE 186.A O no hydrogen 2.926 N/A ARG 191.A N LEU 188.A O no hydrogen 3.387 N/A GLU 192.A N ALA 189.A O no hydrogen 3.038 N/A GLU 197.A N ARG 194.A O no hydrogen 2.823 N/A GLU 197.A N GLU 197.A OE1 no hydrogen 2.575 N/A ILE 198.A N ARG 194.A O no hydrogen 3.377 N/A LEU 199.A N PHE 195.A O no hydrogen 2.897 N/A GLU 200.A N LEU 196.A O no hydrogen 2.927 N/A LEU 201.A N GLU 197.A O no hydrogen 2.923 N/A TYR 202.A N ILE 198.A O no hydrogen 2.881 N/A ARG 203.A N LEU 199.A O no hydrogen 2.908 N/A ARG 203.A NE GLU 200.A OE1 no hydrogen 3.278 N/A ARG 203.A NH2 GLU 200.A OE1 no hydrogen 3.535 N/A LYS 204.A N GLU 200.A O no hydrogen 2.921 N/A TYR 205.A N LEU 201.A O no hydrogen 3.149 N/A ARG 206.A N ARG 203.A O no hydrogen 3.313 N/A VAL 207.A N TYR 202.A O no hydrogen 3.235 N/A GLU 209.A N GLU 209.A OE1 no hydrogen 2.456 N/A GLU 210.A N VAL 207.A O no hydrogen 3.118 N/A ILE 211.A N VAL 207.A O no hydrogen 2.931 N/A ILE 212.A N LEU 208.A O no hydrogen 2.794 N/A VAL 221.A N ASN 218.A OD1 no hydrogen 2.969 N/A GLN 223.A N GLU 219.A O no hydrogen 2.918 N/A LYS 224.A N LYS 220.A O no hydrogen 2.912 N/A LEU 225.A N VAL 221.A O no hydrogen 2.890 N/A TYR 226.A N LEU 222.A O no hydrogen 2.964 N/A ALA 227.A N GLN 223.A O no hydrogen 2.910 N/A LEU 228.A N LYS 224.A O no hydrogen 2.904 N/A ARG 229.A N LEU 225.A O no hydrogen 2.889 N/A LYS 230.A N TYR 226.A O no hydrogen 2.952 N/A VAL 231.A N ALA 227.A O no hydrogen 2.926 N/A VAL 232.A N LEU 228.A O no hydrogen 2.879 N/A ASP 233.A N ARG 229.A O no hydrogen 2.914 N/A TRP 234.A N LYS 230.A O no hydrogen 2.955 N/A HIS 235.A N VAL 231.A O no hydrogen 2.904 N/A HIS 235.A ND1 TYR 246.A OH no hydrogen 2.763 N/A ALA 236.A N VAL 232.A O no hydrogen 2.890 N/A LEU 237.A N TRP 234.A O no hydrogen 2.982 N/A GLU 238.A N TRP 234.A O no hydrogen 2.960 N/A PHE 239.A N HIS 235.A O no hydrogen 2.993 N/A GLU 241.A N GLU 241.A OE1 no hydrogen 2.736 N/A GLU 242.A N PHE 239.A O no hydrogen 2.573 N/A ARG 243.A N SER 240.A O no hydrogen 3.295 N/A ARG 243.A NH2 ALA 236.A O no hydrogen 3.204 N/A TYR 246.A OH HIS 235.A ND1 no hydrogen 2.763 N/A LEU 249.A N TYR 246.A O no hydrogen 2.915 N/A LEU 251.A N GLY 247.A O no hydrogen 2.939 N/A LEU 252.A N TRP 248.A O no hydrogen 2.895 N/A ILE 253.A N LEU 249.A O no hydrogen 2.914 N/A LEU 254.A N TYR 250.A O no hydrogen 2.924 N/A ILE 255.A N LEU 251.A O no hydrogen 3.143 N/A SER 256.A N ILE 253.A O no hydrogen 3.350 N/A SER 256.A OG ILE 253.A O no hydrogen 2.706 N/A SER 256.A OG ASN 257.A OD1 no hydrogen 3.302 N/A LEU 258.A N ILE 255.A O no hydrogen 3.128 N/A GLY 263.A N ASP 259.A O no hydrogen 3.048 N/A LYS 264.A N TYR 260.A O no hydrogen 2.892 N/A HIS 265.A N GLU 261.A O no hydrogen 2.923 N/A PHE 266.A N ARG 262.A O no hydrogen 2.889 N/A LEU 267.A N GLY 263.A O no hydrogen 2.907 N/A GLU 268.A N LYS 264.A O no hydrogen 2.901 N/A GLU 269.A N HIS 265.A O no hydrogen 2.939 N/A MET 270.A N PHE 266.A O no hydrogen 2.875 N/A SER 271.A N GLU 268.A O no hydrogen 3.397 N/A SER 271.A OG MET 270.A O no hydrogen 2.477 N/A ALA 272.A N LEU 267.A O no hydrogen 3.419 N/A VAL 276.A N PRO 273.A O no hydrogen 3.221 N/A ARG 277.A N PRO 273.A O no hydrogen 3.308 N/A GLU 278.A N SER 274.A O no hydrogen 2.917 N/A THR 279.A N TRP 275.A O no hydrogen 2.898 N/A THR 279.A OG1 TRP 275.A O no hydrogen 2.486 N/A THR 279.A OG1 SER 313.A OG no hydrogen 2.767 N/A TYR 280.A N VAL 276.A O no hydrogen 2.902 N/A LYS 281.A N ARG 277.A O no hydrogen 2.907 N/A LYS 281.A NZ TYR 260.A OH no hydrogen 2.358 N/A PHE 282.A N GLU 278.A O no hydrogen 2.916 N/A MET 283.A N THR 279.A O no hydrogen 2.895 N/A MET 283.A N TYR 280.A O no hydrogen 2.862 N/A LYS 284.A N TYR 280.A O no hydrogen 2.920 N/A LYS 284.A NZ SER 256.A O no hydrogen 2.974 N/A SER 289.A OG LYS 286.A O no hydrogen 2.912 N/A LEU 290.A N LYS 286.A O no hydrogen 2.912 N/A LYS 291.A N LEU 287.A O no hydrogen 2.891 N/A LYS 291.A NZ GLU 321.A OE2 no hydrogen 2.722 N/A GLU 292.A N GLY 288.A O no hydrogen 2.921 N/A GLU 293.A N SER 289.A O no hydrogen 2.905 N/A LEU 294.A N LEU 290.A O no hydrogen 2.893 N/A LYS 295.A N LYS 291.A O no hydrogen 2.911 N/A LYS 296.A N GLU 292.A O no hydrogen 3.107 N/A LYS 296.A NZ GLU 292.A O no hydrogen 3.358 N/A ALA 297.A N LEU 294.A O no hydrogen 3.378 N/A ASN 300.A N ASN 367.A OD1 no hydrogen 3.095 N/A TYR 301.A OH GLU 359.A OE1 no hydrogen 2.901 N/A TYR 304.A N ASN 300.A O no hydrogen 2.924 N/A ARG 305.A N TYR 301.A O no hydrogen 2.898 N/A LEU 306.A N GLU 302.A O no hydrogen 2.909 N/A LEU 307.A N TYR 304.A O no hydrogen 3.385 N/A LYS 308.A N TYR 304.A O no hydrogen 2.945 N/A LEU 310.A N LEU 307.A O no hydrogen 2.650 N/A SER 313.A OG THR 279.A OG1 no hydrogen 2.767 N/A LEU 316.A N THR 312.A O no hydrogen 2.904 N/A LEU 317.A N SER 313.A O no hydrogen 2.904 N/A LEU 318.A N VAL 314.A O no hydrogen 2.913 N/A MET 319.A N LEU 316.A O no hydrogen 3.262 N/A LEU 320.A N LEU 317.A O no hydrogen 3.447 N/A LYS 325.A N GLU 322.A O no hydrogen 3.381 N/A LYS 327.A NZ LEU 294.A O no hydrogen 2.528 N/A ILE 328.A N LEU 324.A O no hydrogen 2.842 N/A LYS 329.A N LYS 325.A O no hydrogen 2.917 N/A LYS 329.A NZ GLU 333.A OE2 no hydrogen 3.068 N/A LEU 330.A N GLU 326.A O no hydrogen 2.901 N/A TYR 331.A N LYS 327.A O no hydrogen 2.908 N/A LEU 332.A N ILE 328.A O no hydrogen 2.901 N/A GLU 333.A N LYS 329.A O no hydrogen 2.944 N/A LYS 334.A N LEU 330.A O no hydrogen 3.244 N/A LYS 334.A NZ GLU 333.A O no hydrogen 3.383 N/A LEU 335.A N LEU 330.A O no hydrogen 2.659 N/A ARG 336.A NH2 GLU 242.A OE2 no hydrogen 3.561 N/A LYS 339.A NZ VAL 338.A O no hydrogen 2.515 N/A GLU 346.A N LYS 342.A O no hydrogen 2.892 N/A GLU 347.A N GLU 343.A O no hydrogen 2.927 N/A LEU 348.A N LYS 344.A O no hydrogen 2.890 N/A LEU 348.A N ILE 345.A O no hydrogen 2.860 N/A LYS 349.A N ILE 345.A O no hydrogen 3.051 N/A GLU 356.A N LYS 352.A O no hydrogen 2.919 N/A ARG 357.A N GLU 353.A O no hydrogen 2.897 N/A ILE 358.A N LEU 354.A O no hydrogen 2.906 N/A GLU 359.A N GLY 355.A O no hydrogen 2.921 N/A GLU 360.A N GLU 356.A O no hydrogen 2.907 N/A LEU 361.A N ARG 357.A O no hydrogen 2.901 N/A LYS 362.A N ILE 358.A O no hydrogen 2.911 N/A LYS 362.A NZ GLU 359.A OE2 no hydrogen 3.195 N/A ARG 363.A N GLU 359.A O no hydrogen 2.907 N/A GLU 364.A N GLU 360.A O no hydrogen 2.926 N/A ILE 365.A N LEU 361.A O no hydrogen 2.905 N/A ILE 365.A N LYS 362.A O no hydrogen 3.022 N/A MET 366.A N LYS 362.A O no hydrogen 2.908 N/A