Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2rkj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 5.A N PRO 1.A O no hydrogen 3.327 N/A ALA 5.A N LYS 2.A O no hydrogen 2.897 N/A LYS 6.A NZ GLU 9.A OE2 no hydrogen 3.242 N/A ILE 7.A N TYR 3.A O no hydrogen 3.375 N/A ASN 8.A N THR 4.A O no hydrogen 3.230 N/A GLU 9.A N ALA 5.A O no hydrogen 3.233 N/A ALA 10.A N LYS 6.A O no hydrogen 2.782 N/A GLU 11.A N ILE 7.A O no hydrogen 3.231 N/A GLU 12.A N ASN 8.A O no hydrogen 3.413 N/A ASN 13.A N GLU 9.A O no hydrogen 3.313 N/A TRP 14.A N ALA 10.A O no hydrogen 2.956 N/A GLN 15.A N GLU 12.A O no hydrogen 2.587 N/A ALA 16.A N GLU 12.A O no hydrogen 3.074 N/A ARG 17.A N ASN 13.A O no hydrogen 3.219 N/A ARG 17.A NH1 MET 53.A O no hydrogen 3.516 N/A ARG 17.A NH1 ARG 54.A O no hydrogen 2.583 N/A ARG 17.A NH2 THR 29.A OG1 no hydrogen 3.231 N/A ARG 17.A NH2 MET 53.A O no hydrogen 3.230 N/A ALA 18.A N TRP 14.A O no hydrogen 2.933 N/A GLU 19.A N GLN 15.A O no hydrogen 2.832 N/A ALA 20.A N ALA 16.A O no hydrogen 3.086 N/A ILE 21.A N ARG 17.A O no hydrogen 3.150 N/A LYS 22.A N ALA 18.A O no hydrogen 3.191 N/A LYS 22.A NZ GLU 19.A OE2 no hydrogen 3.555 N/A LYS 23.A N GLU 19.A O no hydrogen 3.104 N/A LYS 23.A N ALA 20.A O no hydrogen 3.004 N/A LYS 23.A NZ GLU 19.A O no hydrogen 2.857 N/A GLY 24.A N ILE 21.A O no hydrogen 3.001 N/A LYS 25.A N ALA 20.A O no hydrogen 2.484 N/A GLN 27.A NE2 GLU 35.A OE1 no hydrogen 3.420 N/A THR 29.A OG1 TYR 90.A OH no hydrogen 2.634 N/A LEU 32.A N THR 29.A O no hydrogen 3.061 N/A PHE 33.A N THR 29.A O no hydrogen 3.198 N/A PHE 33.A N TRP 30.A O no hydrogen 2.762 N/A GLU 34.A N TRP 30.A O no hydrogen 3.193 N/A GLU 35.A N ASP 31.A O no hydrogen 3.189 N/A GLU 35.A N LEU 32.A O no hydrogen 3.019 N/A ARG 36.A NH1 MET 318.A O no hydrogen 3.540 N/A ARG 36.A NH2 THR 316.A O no hydrogen 3.042 N/A ARG 36.A NH2 MET 318.A O no hydrogen 2.844 N/A TYR 38.A N PHE 33.A O no hydrogen 2.791 N/A TYR 38.A OH LEU 314.A O no hydrogen 2.570 N/A LYS 40.A N THR 264.A O no hydrogen 2.843 N/A ASP 41.A N THR 264.A O no hydrogen 3.340 N/A ALA 43.A N GLY 262.A O no hydrogen 3.242 N/A ILE 49.A N THR 45.A O no hydrogen 2.835 N/A ALA 50.A N LYS 46.A O no hydrogen 3.392 N/A GLU 51.A N GLU 47.A O no hydrogen 3.210 N/A LEU 52.A N HIS 48.A O no hydrogen 2.914 N/A MET 53.A N ILE 49.A O no hydrogen 3.085 N/A MET 53.A N ALA 50.A O no hydrogen 2.817 N/A ARG 54.A N ALA 50.A O no hydrogen 2.912 N/A ARG 54.A NE GLU 51.A OE1 no hydrogen 3.119 N/A ARG 54.A NE GLU 51.A OE2 no hydrogen 3.039 N/A ARG 54.A NH1 ALA 18.A O no hydrogen 2.534 N/A ARG 54.A NH2 GLU 51.A OE1 no hydrogen 2.553 N/A THR 55.A N GLU 51.A O no hydrogen 2.848 N/A THR 55.A OG1 GLU 51.A O no hydrogen 2.589 N/A THR 55.A OG1 LEU 52.A O no hydrogen 2.892 N/A ARG 56.A NH1 ASP 258.A OD2 no hydrogen 3.259 N/A ARG 57.A NH1 GLY 89.A O no hydrogen 3.117 N/A ARG 57.A NH2 ALA 10.A O no hydrogen 3.242 N/A ALA 60.A N LYS 91.A O no hydrogen 2.915 N/A TYR 61.A OH GLN 218.A OE1 no hydrogen 2.573 N/A VAL 62.A N PHE 93.A O no hydrogen 3.099 N/A ILE 64.A N LEU 95.A O no hydrogen 2.878 N/A THR 67.A N ASP 65.A O no hydrogen 2.612 N/A SER 70.A OG LEU 71.A O no hydrogen 2.972 N/A SER 70.A OG GLN 120.A OE1 no hydrogen 2.679 N/A LEU 71.A N GLN 120.A OE1 no hydrogen 2.841 N/A VAL 73.A N ILE 284.A O no hydrogen 3.454 N/A GLY 74.A N HIS 72.A ND1 no hydrogen 3.139 N/A HIS 75.A N HIS 72.A O no hydrogen 2.982 N/A LEU 76.A N VAL 73.A O no hydrogen 2.611 N/A MET 80.A N LEU 76.A O no hydrogen 3.320 N/A MET 80.A N LEU 77.A O no hydrogen 3.144 N/A PHE 83.A N LEU 79.A O no hydrogen 2.861 N/A TRP 84.A N MET 80.A O no hydrogen 2.801 N/A MET 85.A N PRO 81.A O no hydrogen 2.996 N/A TYR 86.A N LEU 82.A O no hydrogen 2.899 N/A TYR 86.A OH ASP 129.A OD2 no hydrogen 2.771 N/A LEU 87.A N PHE 83.A O no hydrogen 2.802 N/A GLU 88.A N TRP 84.A O no hydrogen 3.044 N/A GLU 88.A N MET 85.A O no hydrogen 3.114 N/A GLY 89.A N MET 85.A O no hydrogen 3.255 N/A GLY 89.A N TYR 86.A O no hydrogen 3.109 N/A TYR 90.A N MET 85.A O no hydrogen 3.233 N/A TYR 90.A OH THR 29.A OG1 no hydrogen 2.634 N/A TYR 90.A OH MET 53.A O no hydrogen 3.185 N/A LYS 91.A N ILE 58.A O no hydrogen 3.254 N/A ALA 92.A N LYS 144.A O no hydrogen 2.692 N/A PHE 93.A N ALA 60.A O no hydrogen 3.011 N/A THR 94.A N GLY 146.A O no hydrogen 3.115 N/A THR 94.A OG1 GLY 146.A O no hydrogen 3.464 N/A ILE 96.A N VAL 148.A O no hydrogen 2.784 N/A GLY 97.A N ILE 64.A O no hydrogen 3.027 N/A SER 99.A N ASN 150.A OD1 no hydrogen 2.983 N/A THR 100.A OG1 ASP 65.A OD1 no hydrogen 2.792 N/A THR 100.A OG1 GLY 97.A O no hydrogen 3.368 N/A ALA 101.A N GLY 97.A O no hydrogen 2.851 N/A LYS 102.A N SER 99.A O no hydrogen 2.752 N/A ILE 103.A N THR 100.A O no hydrogen 2.723 N/A GLY 104.A N THR 100.A O no hydrogen 2.633 N/A THR 107.A N ASP 105.A O no hydrogen 2.702 N/A THR 107.A OG1 ASP 223.A OD2 no hydrogen 3.016 N/A MET 114.A N ALA 110.A O no hydrogen 3.034 N/A THR 115.A N THR 111.A O no hydrogen 2.715 N/A THR 115.A OG1 THR 111.A O no hydrogen 2.755 N/A LYS 116.A N MET 112.A O no hydrogen 3.213 N/A ILE 117.A N ASN 113.A O no hydrogen 3.188 N/A HIS 118.A N MET 114.A O no hydrogen 3.170 N/A TYR 119.A N THR 115.A O no hydrogen 3.385 N/A GLN 120.A N LYS 116.A O no hydrogen 2.808 N/A LEU 121.A N ILE 117.A O no hydrogen 2.828 N/A LEU 121.A N HIS 118.A O no hydrogen 2.624 N/A LYS 122.A N HIS 118.A O no hydrogen 3.127 N/A LYS 123.A N TYR 119.A O no hydrogen 2.954 N/A LEU 124.A N GLN 120.A O no hydrogen 3.502 N/A TRP 125.A N LEU 121.A O no hydrogen 3.357 N/A GLU 126.A N LYS 122.A O no hydrogen 2.834 N/A ASN 127.A N LYS 123.A O no hydrogen 3.055 N/A ASN 127.A N LEU 124.A O no hydrogen 2.722 N/A VAL 128.A N LEU 124.A O no hydrogen 2.610 N/A ASP 129.A N TRP 125.A O no hydrogen 2.735 N/A THR 130.A OG1 GLU 126.A O no hydrogen 3.119 N/A THR 130.A OG1 ASN 127.A O no hydrogen 2.491 N/A GLN 131.A N ASN 127.A O no hydrogen 2.610 N/A MET 132.A N VAL 128.A O no hydrogen 2.591 N/A ARG 133.A N ASP 129.A O no hydrogen 2.905 N/A ALA 134.A N THR 130.A O no hydrogen 3.125 N/A ARG 135.A N GLN 131.A O no hydrogen 2.725 N/A ARG 135.A NH1 GLU 346.A OE1 no hydrogen 3.225 N/A GLY 136.A N ARG 133.A O no hydrogen 3.303 N/A ARG 143.A N ASP 140.A OD1 no hydrogen 3.080 N/A ARG 143.A NH1 LEU 87.A O no hydrogen 3.315 N/A ARG 143.A NH1 GLU 138.A O no hydrogen 2.692 N/A ARG 143.A NH2 TYR 86.A O no hydrogen 2.637 N/A LYS 144.A N TYR 90.A O no hydrogen 3.013 N/A ARG 145.A NE ASP 129.A OD1 no hydrogen 3.542 N/A VAL 148.A N THR 94.A O no hydrogen 3.108 N/A ASN 150.A N ILE 96.A O no hydrogen 2.795 N/A ASN 151.A N ASN 149.A OD1 no hydrogen 3.099 N/A HIS 152.A N ASN 149.A O no hydrogen 2.755 N/A TRP 154.A N ASN 150.A O no hydrogen 3.251 N/A TRP 154.A NE1 ASP 205.A OD2 no hydrogen 3.258 N/A ASN 155.A N ASN 151.A O no hydrogen 2.877 N/A ASN 155.A ND2 ASN 151.A O no hydrogen 3.491 N/A LYS 156.A N TRP 153.A O no hydrogen 2.988 N/A GLN 157.A N TRP 153.A O no hydrogen 2.670 N/A GLN 157.A NE2 GLU 208.A OE1 no hydrogen 3.568 N/A LEU 163.A N MET 159.A O no hydrogen 2.824 N/A ARG 164.A N LEU 160.A O no hydrogen 2.990 N/A ARG 165.A N GLU 161.A O no hydrogen 2.682 N/A ARG 165.A NE ALA 238.A O no hydrogen 3.402 N/A ARG 165.A NH2 ALA 238.A O no hydrogen 3.072 N/A VAL 166.A N VAL 162.A O no hydrogen 2.946 N/A ALA 169.A N VAL 166.A O no hydrogen 2.667 N/A LEU 170.A N VAL 166.A O no hydrogen 3.258 N/A MET 175.A N ILE 172.A O no hydrogen 3.190 N/A LEU 176.A N ILE 172.A O no hydrogen 2.483 N/A SER 177.A N GLY 173.A O no hydrogen 2.849 N/A ARG 178.A N MET 175.A O no hydrogen 2.989 N/A LYS 182.A N ARG 178.A O no hydrogen 2.686 N/A ASN 183.A N ASP 179.A O no hydrogen 2.678 N/A LYS 184.A N VAL 181.A O no hydrogen 2.501 N/A MET 185.A N LYS 182.A O no hydrogen 3.100 N/A THR 186.A N LYS 182.A O no hydrogen 3.402 N/A THR 186.A OG1 LYS 182.A O no hydrogen 3.264 N/A THR 186.A OG1 ASN 183.A O no hydrogen 2.939 N/A GLN 187.A N ASN 183.A O no hydrogen 2.791 N/A ALA 194.A N SER 192.A OG no hydrogen 2.967 N/A GLU 195.A N SER 192.A OG no hydrogen 3.341 N/A PHE 196.A N SER 192.A O no hydrogen 3.132 N/A THR 197.A N PHE 193.A O no hydrogen 2.979 N/A THR 197.A OG1 PHE 193.A O no hydrogen 2.541 N/A TYR 198.A N ALA 194.A O no hydrogen 2.691 N/A TYR 198.A N GLU 195.A O no hydrogen 2.988 N/A TYR 198.A OH GLN 202.A OE1 no hydrogen 3.197 N/A MET 201.A N THR 197.A O no hydrogen 3.107 N/A MET 201.A N TYR 198.A O no hydrogen 2.841 N/A GLN 202.A N TYR 198.A O no hydrogen 3.001 N/A GLY 203.A N PRO 199.A O no hydrogen 2.985 N/A GLY 203.A N ILE 200.A O no hydrogen 3.231 N/A TRP 204.A N ILE 200.A O no hydrogen 3.026 N/A TRP 204.A NE1 GLU 208.A OE1 no hydrogen 2.708 N/A ASP 205.A N MET 201.A O no hydrogen 2.704 N/A TRP 206.A N GLN 202.A O no hydrogen 3.317 N/A PHE 207.A N GLY 203.A O no hydrogen 3.173 N/A GLU 208.A N TRP 204.A O no hydrogen 2.826 N/A LEU 209.A N ASP 205.A O no hydrogen 2.918 N/A PHE 210.A N TRP 206.A O no hydrogen 2.973 N/A TYR 211.A N PHE 207.A O no hydrogen 2.601 N/A GLN 212.A N GLU 208.A O no hydrogen 2.428 N/A GLN 213.A NE2 GLN 212.A O no hydrogen 3.192 N/A GLY 214.A N PHE 210.A O no hydrogen 2.768 N/A GLN 216.A N GLY 59.A O no hydrogen 2.986 N/A GLN 216.A NE2 LEU 257.A O no hydrogen 3.604 N/A ILE 219.A N TYR 61.A O no hydrogen 3.105 N/A SER 222.A OG VAL 265.A O no hydrogen 3.260 N/A GLN 224.A N GLY 221.A O no hydrogen 2.676 N/A TYR 225.A OH THR 42.A O no hydrogen 2.954 N/A ASN 227.A N GLN 224.A O no hydrogen 3.225 N/A ILE 228.A N GLN 224.A O no hydrogen 2.717 N/A ILE 229.A N TYR 225.A O no hydrogen 2.868 N/A SER 230.A OG GLY 226.A O no hydrogen 2.802 N/A SER 230.A OG ASN 227.A O no hydrogen 2.896 N/A GLY 231.A N ASN 227.A O no hydrogen 2.776 N/A LEU 232.A N ILE 228.A O no hydrogen 3.198 N/A GLU 233.A N ILE 229.A O no hydrogen 3.318 N/A VAL 234.A N SER 230.A O no hydrogen 3.358 N/A VAL 235.A N GLY 231.A O no hydrogen 2.763 N/A LYS 236.A N LEU 232.A O no hydrogen 3.068 N/A ALA 237.A N GLU 233.A O no hydrogen 3.014 N/A ALA 238.A N VAL 234.A O no hydrogen 3.348 N/A ARG 239.A N VAL 235.A O no hydrogen 3.324 N/A ARG 239.A NE VAL 251.A O no hydrogen 3.127 N/A ARG 239.A NH1 ASP 258.A O no hydrogen 2.836 N/A GLU 240.A N LYS 236.A O no hydrogen 2.737 N/A SER 241.A N ALA 237.A O no hydrogen 3.032 N/A SER 241.A OG ARG 165.A O no hydrogen 2.700 N/A SER 241.A OG ALA 237.A O no hydrogen 2.919 N/A SER 241.A OG ALA 238.A O no hydrogen 3.518 N/A GLU 242.A N GLU 240.A O no hydrogen 2.639 N/A TYR 250.A N GLU 247.A O no hydrogen 3.127 N/A VAL 251.A N GLU 247.A O no hydrogen 3.204 N/A THR 252.A N ARG 248.A O no hydrogen 3.204 N/A THR 252.A OG1 ARG 239.A O no hydrogen 3.478 N/A LYS 254.A N ASP 258.A OD1 no hydrogen 3.104 N/A LEU 257.A N THR 255.A OG1 no hydrogen 3.320 N/A ASP 258.A N THR 255.A O no hydrogen 2.955 N/A CYS 260.A SG VAL 215.A O no hydrogen 3.776 N/A VAL 261.A N GLN 216.A O no hydrogen 2.795 N/A GLY 262.A N ALA 43.A O no hydrogen 3.195 N/A PHE 263.A N GLN 218.A O no hydrogen 3.455 N/A THR 264.A N ASP 41.A O no hydrogen 3.317 N/A VAL 265.A N GLY 220.A O no hydrogen 3.353 N/A ASP 270.A N ALA 274.A O no hydrogen 3.242 N/A SER 271.A N GLU 307.A OE1 no hydrogen 2.826 N/A SER 271.A OG SER 304.A OG no hydrogen 3.384 N/A SER 271.A OG GLN 306.A OE1 no hydrogen 3.033 N/A SER 272.A N ASP 270.A OD1 no hydrogen 2.976 N/A GLY 273.A N ASP 270.A OD1 no hydrogen 3.290 N/A LYS 275.A NZ PHE 276.A O no hydrogen 2.945 N/A PHE 276.A N LEU 268.A O no hydrogen 3.033 N/A SER 279.A N ASN 282.A O no hydrogen 2.864 N/A GLY 281.A N SER 279.A O no hydrogen 2.597 N/A ILE 284.A N GLY 277.A O no hydrogen 2.705 N/A ASP 287.A N SER 70.A OG no hydrogen 3.198 N/A THR 291.A N PRO 288.A O no hydrogen 3.182 N/A THR 291.A OG1 GLN 290.A O no hydrogen 2.394 N/A PHE 294.A N SER 292.A OG no hydrogen 2.928 N/A PHE 296.A N SER 292.A O no hydrogen 2.872 N/A TYR 297.A N VAL 293.A O no hydrogen 2.932 N/A TYR 297.A OH HIS 341.A O no hydrogen 2.878 N/A GLY 298.A N PHE 294.A O no hydrogen 2.819 N/A TYR 299.A N ASP 295.A O no hydrogen 3.163 N/A VAL 301.A N TYR 297.A O no hydrogen 3.050 N/A ARG 302.A N GLY 298.A O no hydrogen 2.760 N/A ARG 303.A NE TYR 299.A O no hydrogen 3.317 N/A SER 304.A OG SER 271.A OG no hydrogen 3.384 N/A VAL 308.A N SER 304.A O no hydrogen 3.171 N/A LEU 311.A N GLU 307.A O no hydrogen 2.838 N/A LEU 312.A N GLU 309.A O no hydrogen 2.978 N/A LYS 313.A N GLU 309.A O no hydrogen 3.289 N/A PHE 315.A N LEU 311.A O no hydrogen 3.451 N/A THR 316.A OG1 LEU 312.A O no hydrogen 2.971 N/A ILE 323.A N PRO 319.A O no hydrogen 2.831 N/A THR 324.A N ILE 320.A O no hydrogen 3.090 N/A THR 324.A OG1 ILE 320.A O no hydrogen 3.339 N/A LYS 325.A N GLU 322.A O no hydrogen 2.985 N/A LYS 325.A NZ GLU 328.A OE1 no hydrogen 3.234 N/A THR 326.A N GLU 322.A O no hydrogen 3.222 N/A THR 326.A N ILE 323.A O no hydrogen 2.939 N/A THR 326.A OG1 GLU 322.A OE2 no hydrogen 3.533 N/A MET 327.A N ILE 323.A O no hydrogen 2.905 N/A GLU 328.A N THR 324.A O no hydrogen 2.754 N/A GLU 329.A N THR 326.A O no hydrogen 3.204 N/A HIS 330.A N THR 326.A O no hydrogen 2.888 N/A ILE 331.A N MET 327.A O no hydrogen 2.928 N/A LYS 332.A N GLU 329.A O no hydrogen 3.420 N/A LYS 332.A NZ GLU 328.A OE2 no hydrogen 3.286 N/A ASP 333.A N HIS 330.A O no hydrogen 2.800 N/A LYS 336.A N ASP 333.A OD2 no hydrogen 3.324 N/A ARG 337.A N PRO 334.A O no hydrogen 2.890 N/A ARG 337.A NH1 VAL 301.A O no hydrogen 2.530 N/A ARG 337.A NH1 ARG 302.A O no hydrogen 3.367 N/A ARG 337.A NH2 VAL 301.A O no hydrogen 2.521 N/A HIS 341.A N ARG 337.A O no hydrogen 3.210 N/A THR 342.A N VAL 338.A O no hydrogen 3.199 N/A THR 342.A OG1 VAL 338.A O no hydrogen 2.797 N/A LEU 343.A N ALA 339.A O no hydrogen 3.048 N/A ALA 344.A N GLN 340.A O no hydrogen 3.270 N/A ARG 345.A N HIS 341.A O no hydrogen 3.287 N/A GLU 346.A N THR 342.A O no hydrogen 2.840 N/A VAL 347.A N LEU 343.A O no hydrogen 3.323 N/A VAL 348.A N ALA 344.A O no hydrogen 3.150 N/A THR 349.A N ARG 345.A O no hydrogen 3.226 N/A THR 349.A N GLU 346.A O no hydrogen 3.138 N/A THR 349.A OG1 ARG 345.A O no hydrogen 2.671 N/A THR 349.A OG1 GLU 346.A O no hydrogen 3.261 N/A LEU 350.A N GLU 346.A O no hydrogen 3.374 N/A VAL 351.A N VAL 347.A O no hydrogen 3.293 N/A HIS 352.A N VAL 348.A O no hydrogen 2.643 N/A GLY 353.A N THR 349.A O no hydrogen 2.310 N/A ALA 357.A N GLY 353.A O no hydrogen 3.142 N/A SER 358.A N LYS 354.A O no hydrogen 2.859 N/A SER 358.A OG LYS 354.A O no hydrogen 2.991 N/A SER 358.A OG GLN 355.A O no hydrogen 2.457 N/A ALA 360.A N GLU 356.A O no hydrogen 2.871 N/A GLU 361.A N SER 358.A O no hydrogen 3.114 N/A GLN 363.A N ALA 359.A O no hydrogen 3.349 N/A HIS 364.A N ALA 360.A O no hydrogen 3.465 N/A HIS 364.A ND1 HIS 364.A O no hydrogen 2.917 N/A ARG 365.A N GLU 361.A O no hydrogen 2.851 N/A ARG 365.A NE GLU 361.A OE1 no hydrogen 3.275 N/A MET 366.A N GLN 363.A O no hydrogen 3.072 N/A