Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6msj_V.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 7.A N GLY 4.A O no hydrogen 3.184 N/A GLU 8.A N GLY 5.A O no hydrogen 3.422 N/A GLN 16.A N PRO 12.A O no hydrogen 2.695 N/A GLN 16.A NE2 GLN 101.A O no hydrogen 3.654 N/A ASP 17.A N ALA 14.A O no hydrogen 3.156 N/A VAL 18.A N ALA 14.A O no hydrogen 2.946 N/A LYS 21.A N ASP 17.A O no hydrogen 3.116 N/A GLU 22.A N GLU 19.A O no hydrogen 3.328 N/A GLU 23.A N GLU 23.A OE1 no hydrogen 2.833 N/A ALA 24.A N MET 20.A O no hydrogen 3.091 N/A ALA 25.A N LYS 21.A O no hydrogen 3.087 N/A THR 26.A N GLU 22.A O no hydrogen 2.800 N/A THR 26.A OG1 GLU 22.A O no hydrogen 2.790 N/A GLY 27.A N GLU 23.A O no hydrogen 2.678 N/A GLY 28.A N ALA 24.A O no hydrogen 3.107 N/A GLY 29.A N ALA 25.A O no hydrogen 2.687 N/A SER 30.A N THR 26.A O no hydrogen 2.425 N/A SER 30.A OG THR 26.A O no hydrogen 3.005 N/A SER 30.A OG GLY 27.A O no hydrogen 3.397 N/A THR 31.A OG1 GLY 27.A O no hydrogen 2.477 N/A GLY 32.A N GLY 28.A O no hydrogen 3.277 N/A GLU 33.A N GLY 29.A O no hydrogen 3.136 N/A ALA 34.A N SER 30.A O no hydrogen 2.959 N/A ASP 35.A N THR 31.A O no hydrogen 2.964 N/A ASP 35.A N GLY 32.A O no hydrogen 3.226 N/A GLY 36.A N GLY 32.A O no hydrogen 2.947 N/A GLU 44.A N GLU 44.A OE1 no hydrogen 2.734 N/A ARG 48.A N GLU 44.A O no hydrogen 3.179 N/A ARG 48.A NE THR 26.A OG1 no hydrogen 2.954 N/A ARG 48.A NH1 GLU 22.A OE1 no hydrogen 3.433 N/A ARG 48.A NH2 THR 26.A OG1 no hydrogen 2.549 N/A GLU 49.A N HIS 45.A O no hydrogen 3.046 N/A LEU 50.A N SER 46.A O no hydrogen 2.565 N/A ASP 51.A N GLN 47.A O no hydrogen 2.606 N/A THR 52.A N ARG 48.A O no hydrogen 2.755 N/A THR 52.A OG1 ARG 48.A O no hydrogen 3.403 N/A THR 52.A OG1 GLU 49.A O no hydrogen 2.936 N/A VAL 53.A N GLU 49.A O no hydrogen 3.228 N/A THR 54.A N LEU 50.A O no hydrogen 3.246 N/A THR 54.A OG1 LEU 50.A O no hydrogen 2.644 N/A THR 54.A OG1 ASP 51.A O no hydrogen 3.447 N/A LEU 55.A N ASP 51.A O no hydrogen 2.371 N/A GLU 56.A N ASP 51.A O no hydrogen 3.296 N/A GLU 56.A N GLU 56.A OE1 no hydrogen 2.759 N/A ILE 58.A N THR 54.A O no hydrogen 3.403 N/A LYS 59.A N LEU 55.A O no hydrogen 2.393 N/A GLU 60.A N GLU 56.A O no hydrogen 3.343 N/A GLN 64.A NE2 VAL 62.A O no hydrogen 3.614 N/A ALA 68.A N GLN 64.A O no hydrogen 3.054 N/A VAL 69.A N GLN 64.A O no hydrogen 3.470 N/A SER 70.A OG LYS 63.A O no hydrogen 2.589 N/A SER 70.A OG ALA 109.A O no hydrogen 3.353 N/A LYS 72.A N VAL 69.A O no hydrogen 3.150 N/A LYS 72.A NZ ALA 68.A O no hydrogen 2.378 N/A ARG 75.A N GLY 71.A O no hydrogen 2.849 N/A ARG 75.A NE GLN 101.A OE1 no hydrogen 2.807 N/A PHE 76.A N LYS 72.A O no hydrogen 2.897 N/A ARG 79.A NH1 LEU 78.A O no hydrogen 2.785 N/A THR 87.A N MET 83.A O no hydrogen 2.677 N/A THR 87.A OG1 MET 83.A O no hydrogen 3.378 N/A THR 87.A OG1 LEU 84.A O no hydrogen 2.661 N/A SER 88.A N LEU 84.A O no hydrogen 3.148 N/A SER 88.A OG LEU 84.A O no hydrogen 3.268 N/A SER 88.A OG PRO 85.A O no hydrogen 2.888 N/A ARG 89.A N PRO 85.A O no hydrogen 2.568 N/A ARG 90.A N SER 86.A O no hydrogen 3.220 N/A LEU 91.A N THR 87.A O no hydrogen 2.556 N/A ASN 92.A N SER 88.A O no hydrogen 3.315 N/A HIS 93.A N ARG 89.A O no hydrogen 3.078 N/A HIS 93.A ND1 ARG 89.A O no hydrogen 2.470 N/A TYR 94.A N ARG 90.A O no hydrogen 2.562 N/A LEU 96.A N ASN 92.A O no hydrogen 2.944 N/A TYR 97.A N HIS 93.A O no hydrogen 2.985 N/A ALA 99.A N VAL 95.A O no hydrogen 3.326 N/A VAL 100.A N LEU 96.A O no hydrogen 2.946 N/A GLN 101.A N TYR 97.A O no hydrogen 2.998 N/A GLN 101.A NE2 GLY 71.A O no hydrogen 2.410 N/A GLY 102.A N LYS 98.A O no hydrogen 2.918 N/A PHE 103.A N ALA 99.A O no hydrogen 2.847 N/A PHE 103.A N VAL 100.A O no hydrogen 3.182 N/A PHE 104.A N VAL 100.A O no hydrogen 2.650 N/A PHE 117.A N PHE 113.A O no hydrogen 2.871 N/A LEU 118.A N LEU 115.A O no hydrogen 3.023 N/A GLU 119.A N LEU 115.A O no hydrogen 2.991 N/A GLU 120.A N GLU 120.A OE1 no hydrogen 2.772 N/A ASP 123.A N GLU 119.A O no hydrogen 2.434 N/A THR 124.A OG1 VAL 77.A O no hydrogen 3.254 N/A THR 124.A OG1 GLU 120.A O no hydrogen 3.562 N/A ARG 131.A NH1 LEU 128.A O no hydrogen 3.109 N/A THR 134.A N PHE 130.A O no hydrogen 2.892 N/A THR 134.A OG1 ARG 131.A O no hydrogen 3.162 N/A GLY 135.A N ARG 131.A O no hydrogen 2.846 N/A LYS 136.A N PRO 132.A O no hydrogen 2.814 N/A ALA 137.A N ARG 133.A O no hydrogen 2.890 N/A SER 139.A N GLY 135.A O no hydrogen 3.244 N/A SER 139.A OG GLY 135.A O no hydrogen 2.985 N/A SER 139.A OG LYS 136.A O no hydrogen 3.074 N/A THR 140.A N LYS 136.A O no hydrogen 2.823 N/A THR 140.A OG1 LYS 136.A O no hydrogen 2.474 N/A LEU 142.A N SER 139.A O no hydrogen 3.324 N/A LEU 143.A N THR 140.A O no hydrogen 3.390 N/A VAL 146.A N LEU 142.A O no hydrogen 2.638 N/A TYR 149.A N VAL 146.A O no hydrogen 2.734 N/A MET 158.A N VAL 154.A O no hydrogen 2.677 N/A MET 159.A N VAL 155.A O no hydrogen 2.855 N/A ASN 160.A N ILE 156.A O no hydrogen 2.798 N/A SER 161.A N PHE 157.A O no hydrogen 3.374 N/A SER 161.A OG PHE 157.A O no hydrogen 2.881 N/A SER 161.A OG MET 158.A O no hydrogen 2.621 N/A LYS 162.A N MET 158.A O no hydrogen 3.042 N/A ARG 163.A N MET 159.A O no hydrogen 3.217 N/A TYR 164.A N ASN 160.A O no hydrogen 2.867 N/A LYS 165.A N SER 161.A O no hydrogen 3.040 N/A GLU 166.A N LYS 162.A O no hydrogen 2.712 N/A ALA 167.A N ARG 163.A O no hydrogen 3.020 N/A GLN 168.A N TYR 164.A O no hydrogen 3.013 N/A LYS 169.A N LYS 165.A O no hydrogen 2.937 N/A ILE 170.A N GLU 166.A O no hydrogen 2.681 N/A SER 171.A N ALA 167.A O no hydrogen 2.842 N/A SER 171.A OG ALA 167.A O no hydrogen 3.315 N/A SER 171.A OG GLN 168.A O no hydrogen 2.598 N/A ASP 172.A N GLN 168.A O no hydrogen 2.938 N/A ASP 173.A N LYS 169.A O no hydrogen 2.902 N/A LEU 174.A N ILE 170.A O no hydrogen 2.978 N/A MET 175.A N SER 171.A O no hydrogen 3.268 N/A LYS 177.A NZ ASP 173.A O no hydrogen 2.687 N/A THR 180.A OG1 ILE 178.A O no hydrogen 3.073 N/A ASN 182.A ND2 ASP 172.A OD2 no hydrogen 2.686 N/A ARG 183.A NH1 HIS 225.A O no hydrogen 2.366 N/A LEU 186.A N ASN 182.A O no hydrogen 2.613 N/A ASP 187.A N ARG 183.A O no hydrogen 2.782 N/A VAL 189.A N ALA 185.A O no hydrogen 3.444 N/A ALA 190.A N LEU 186.A O no hydrogen 2.956 N/A ALA 191.A N ASP 187.A O no hydrogen 2.838 N/A LYS 192.A N LEU 188.A O no hydrogen 2.628 N/A CYS 193.A N VAL 189.A O no hydrogen 3.134 N/A CYS 193.A SG GLU 166.A OE2 no hydrogen 3.310 N/A CYS 193.A SG VAL 189.A O no hydrogen 3.227 N/A CYS 193.A SG ALA 190.A O no hydrogen 3.221 N/A TYR 194.A N ALA 191.A O no hydrogen 2.881 N/A TYR 195.A N ALA 191.A O no hydrogen 2.635 N/A HIS 197.A N CYS 193.A O no hydrogen 3.091 N/A ALA 198.A N TYR 194.A O no hydrogen 3.327 N/A ARG 199.A N TYR 195.A O no hydrogen 3.114 N/A VAL 200.A N TYR 196.A O no hydrogen 2.609 N/A TYR 201.A N HIS 197.A O no hydrogen 3.153 N/A GLU 202.A N ARG 199.A O no hydrogen 2.987 N/A PHE 203.A N ARG 199.A O no hydrogen 3.071 N/A LEU 204.A N VAL 200.A O no hydrogen 3.085 N/A LEU 207.A N TYR 244.A OH no hydrogen 2.718 N/A ARG 211.A NE LEU 237.A O no hydrogen 3.412 N/A SER 212.A N ASP 208.A O no hydrogen 3.125 N/A LEU 214.A N VAL 210.A O no hydrogen 2.769 N/A HIS 215.A N ARG 211.A O no hydrogen 2.898 N/A HIS 215.A ND1 ARG 211.A O no hydrogen 2.368 N/A ALA 216.A N SER 212.A O no hydrogen 3.360 N/A ARG 217.A N PHE 213.A O no hydrogen 2.921 N/A ARG 217.A NH1 ASP 173.A OD2 no hydrogen 3.063 N/A ARG 217.A NH2 ASP 173.A OD2 no hydrogen 2.639 N/A LEU 218.A N LEU 214.A O no hydrogen 3.055 N/A ARG 219.A N HIS 215.A O no hydrogen 2.472 N/A THR 220.A N ALA 216.A O no hydrogen 2.992 N/A ALA 221.A N ARG 217.A O no hydrogen 2.946 N/A GLN 230.A N ASP 226.A OD1 no hydrogen 3.108 N/A THR 232.A N ASP 228.A O no hydrogen 3.110 N/A THR 232.A OG1 ASP 228.A O no hydrogen 3.016 N/A THR 232.A OG1 GLY 229.A O no hydrogen 3.306 N/A LEU 233.A N GLY 229.A O no hydrogen 3.268 N/A LEU 234.A N GLN 230.A O no hydrogen 3.107 N/A ASN 235.A ND2 GLU 267.A O no hydrogen 3.456 N/A LEU 236.A N THR 232.A O no hydrogen 3.383 N/A LEU 237.A N LEU 233.A O no hydrogen 2.817 N/A LEU 238.A N LEU 234.A O no hydrogen 2.951 N/A ARG 239.A N LEU 236.A O no hydrogen 3.213 N/A LEU 242.A N LEU 238.A O no hydrogen 2.953 N/A HIS 243.A N ARG 239.A O no hydrogen 2.640 N/A TYR 244.A N ASN 240.A O no hydrogen 2.701 N/A LEU 246.A N ASP 248.A OD2 no hydrogen 2.927 N/A LYS 252.A N GLN 249.A O no hydrogen 3.164 N/A LYS 252.A NZ ASP 248.A O no hydrogen 2.303 N/A LEU 253.A N GLN 249.A O no hydrogen 3.129 N/A VAL 254.A N ALA 250.A O no hydrogen 3.221 N/A SER 255.A N LYS 252.A O no hydrogen 3.060 N/A SER 255.A OG GLU 251.A O no hydrogen 2.535 N/A ASN 266.A N ALA 263.A O no hydrogen 3.398 N/A GLU 267.A N ALA 263.A O no hydrogen 3.327 N/A TYR 271.A N GLU 267.A O no hydrogen 2.890 N/A TYR 271.A OH VAL 258.A O no hydrogen 3.277 N/A LEU 272.A N TRP 268.A O no hydrogen 3.270 N/A TYR 273.A N ARG 270.A O no hydrogen 3.158 N/A TYR 274.A N ARG 270.A O no hydrogen 3.161 N/A THR 275.A N TYR 271.A O no hydrogen 3.159 N/A GLY 276.A N LEU 272.A O no hydrogen 3.198 N/A ARG 277.A N TYR 273.A O no hydrogen 3.034 N/A ILE 278.A N TYR 274.A O no hydrogen 3.179 N/A LYS 279.A N THR 275.A O no hydrogen 3.113 N/A LYS 279.A NZ THR 275.A O no hydrogen 2.797 N/A ALA 280.A N GLY 276.A O no hydrogen 3.167 N/A ILE 281.A N ILE 278.A O no hydrogen 3.108 N/A GLN 282.A N ILE 278.A O no hydrogen 3.376 N/A ALA 288.A N GLU 284.A O no hydrogen 3.270 N/A ARG 289.A N TYR 285.A O no hydrogen 3.013 N/A THR 291.A N GLU 287.A O no hydrogen 3.367 N/A MET 292.A N ALA 288.A O no hydrogen 2.801 N/A THR 293.A N ARG 289.A O no hydrogen 2.888 N/A THR 293.A OG1 ARG 289.A O no hydrogen 2.438 N/A ASN 294.A N ARG 290.A O no hydrogen 3.084 N/A ALA 295.A N THR 291.A O no hydrogen 2.970 N/A LEU 296.A N MET 292.A O no hydrogen 2.977 N/A ARG 297.A N THR 293.A O no hydrogen 3.240 N/A HIS 302.A N PRO 300.A O no hydrogen 2.713 N/A THR 310.A N PHE 307.A O no hydrogen 2.958 N/A THR 310.A OG1 GLY 306.A O no hydrogen 2.787 N/A VAL 311.A N PHE 307.A O no hydrogen 2.950 N/A HIS 312.A N LYS 308.A O no hydrogen 3.205 N/A LYS 313.A N THR 310.A O no hydrogen 3.039 N/A LYS 313.A NZ ASP 372.A OD1 no hydrogen 3.199 N/A LYS 313.A NZ ASP 372.A OD2 no hydrogen 3.256 N/A LEU 314.A N THR 310.A O no hydrogen 3.149 N/A LEU 315.A N VAL 311.A O no hydrogen 3.224 N/A VAL 317.A N LEU 314.A O no hydrogen 3.047 N/A VAL 318.A N LEU 314.A O no hydrogen 3.209 N/A GLU 319.A N LEU 315.A O no hydrogen 3.320 N/A LEU 320.A N ILE 316.A O no hydrogen 3.069 N/A LEU 321.A N VAL 317.A O no hydrogen 2.813 N/A LEU 322.A N GLU 319.A O no hydrogen 2.858 N/A GLN 333.A NE2 PHE 331.A O no hydrogen 2.788 N/A ARG 338.A N SER 335.A O no hydrogen 3.381 N/A SER 339.A N LEU 336.A O no hydrogen 3.002 N/A SER 339.A OG GLN 309.A OE1 no hydrogen 3.208 N/A SER 339.A OG LEU 336.A O no hydrogen 3.283 N/A LEU 340.A N LEU 336.A O no hydrogen 2.719 N/A TYR 343.A OH ASP 372.A OD2 no hydrogen 2.852 N/A PHE 344.A N LEU 340.A O no hydrogen 2.920 N/A LEU 346.A N PRO 342.A O no hydrogen 2.700 N/A THR 347.A N TYR 343.A O no hydrogen 3.048 N/A GLN 348.A N PHE 344.A O no hydrogen 3.059 N/A ALA 349.A N LEU 346.A O no hydrogen 2.849 N/A VAL 350.A N LEU 346.A O no hydrogen 3.046 N/A ARG 351.A N THR 347.A O no hydrogen 3.136 N/A THR 352.A OG1 GLN 348.A O no hydrogen 3.414 N/A THR 352.A OG1 ALA 349.A O no hydrogen 2.818 N/A LYS 357.A N ASN 354.A OD1 no hydrogen 3.458 N/A ASN 359.A N LEU 355.A O no hydrogen 2.807 N/A GLN 360.A N ALA 356.A O no hydrogen 3.261 N/A VAL 361.A N LYS 357.A O no hydrogen 2.955 N/A LEU 362.A N PHE 358.A O no hydrogen 3.231 N/A ASP 363.A N ASN 359.A O no hydrogen 3.066 N/A GLN 364.A N GLN 360.A O no hydrogen 3.000 N/A PHE 365.A N VAL 361.A O no hydrogen 2.809 N/A PHE 369.A N PHE 365.A O no hydrogen 3.250 N/A GLN 370.A N GLY 366.A O no hydrogen 2.769 N/A ALA 371.A N GLU 367.A O no hydrogen 2.890 N/A ASP 372.A N LYS 368.A O no hydrogen 2.852 N/A THR 374.A N PHE 369.A O no hydrogen 3.282 N/A ARG 380.A N LEU 377.A O no hydrogen 3.069 N/A LEU 381.A N LEU 377.A O no hydrogen 2.588 N/A ASN 384.A ND2 ASN 384.A O no hydrogen 2.580 N/A THR 388.A N ASN 384.A O no hydrogen 2.956 N/A THR 388.A OG1 ASN 384.A O no hydrogen 2.523 N/A MET 392.A N THR 388.A O no hydrogen 2.926 N/A ILE 393.A N GLY 389.A O no hydrogen 2.651 N/A SER 394.A N VAL 390.A O no hydrogen 3.157 N/A SER 394.A OG VAL 390.A O no hydrogen 2.808 N/A SER 394.A OG ARG 391.A O no hydrogen 3.097 N/A LEU 395.A N ARG 391.A O no hydrogen 2.956 N/A SER 396.A N MET 392.A O no hydrogen 2.957 N/A TYR 397.A N ILE 393.A O no hydrogen 2.673 N/A SER 398.A OG SER 443.A OG no hydrogen 3.216 N/A ILE 400.A N VAL 441.A O no hydrogen 3.224 N/A LEU 402.A N GLY 439.A O no hydrogen 2.756 N/A ASP 404.A N SER 401.A O no hydrogen 3.044 N/A ILE 405.A N SER 401.A O no hydrogen 3.146 N/A LYS 408.A N ASP 404.A O no hydrogen 3.327 N/A LEU 409.A N ILE 405.A O no hydrogen 2.906 N/A GLN 410.A N GLN 407.A O no hydrogen 3.153 N/A GLN 410.A NE2 GLY 353.A O no hydrogen 2.931 N/A LEU 411.A N ALA 406.A O no hydrogen 2.542 N/A SER 413.A OG LEU 411.A O no hydrogen 3.478 N/A SER 413.A OG ASP 416.A OD1 no hydrogen 2.582 N/A GLU 415.A N GLU 415.A OE1 no hydrogen 2.668 N/A PHE 419.A N ASP 416.A O no hydrogen 2.692 N/A ILE 420.A N ASP 416.A O no hydrogen 3.141 N/A ALA 422.A N GLU 418.A O no hydrogen 2.782 N/A LYS 423.A N PHE 419.A O no hydrogen 2.781 N/A ALA 424.A N ILE 420.A O no hydrogen 2.740 N/A ILE 425.A N VAL 421.A O no hydrogen 3.032 N/A ARG 426.A N ALA 422.A O no hydrogen 3.009 N/A ASP 427.A N LYS 423.A O no hydrogen 3.189 N/A GLY 428.A N ILE 425.A O no hydrogen 3.053 N/A VAL 429.A N ALA 424.A O no hydrogen 2.442 N/A SER 433.A N GLN 442.A O no hydrogen 2.847 N/A SER 433.A OG ILE 434.A O no hydrogen 3.552 N/A ASN 435.A N TYR 440.A O no hydrogen 2.901 N/A VAL 441.A N ILE 400.A O no hydrogen 2.859 N/A GLN 442.A N SER 433.A O no hydrogen 2.818 N/A SER 443.A OG SER 398.A O no hydrogen 3.176 N/A SER 443.A OG SER 398.A OG no hydrogen 3.216 N/A THR 452.A OG1 ASP 448.A O no hydrogen 2.720 N/A GLU 454.A N THR 452.A O no hydrogen 2.661 N/A GLN 456.A N ARG 453.A O no hydrogen 3.112 N/A LEU 457.A N GLU 454.A O no hydrogen 3.197 N/A PHE 459.A N PRO 455.A O no hydrogen 3.189 N/A HIS 460.A N GLN 456.A O no hydrogen 2.923 N/A HIS 460.A N LEU 457.A O no hydrogen 3.260 N/A GLN 461.A N LEU 457.A O no hydrogen 3.237 N/A ARG 462.A N ALA 458.A O no hydrogen 3.249 N/A ARG 462.A NH1 ALA 458.A O no hydrogen 3.410 N/A ILE 463.A N PHE 459.A O no hydrogen 3.223 N/A SER 464.A N HIS 460.A O no hydrogen 3.047 N/A SER 464.A OG HIS 460.A O no hydrogen 2.996 N/A SER 464.A OG GLN 461.A O no hydrogen 2.921 N/A PHE 465.A N GLN 461.A O no hydrogen 3.209 N/A CYS 466.A N ARG 462.A O no hydrogen 3.251 N/A CYS 466.A SG ARG 462.A O no hydrogen 3.229 N/A LEU 467.A N ILE 463.A O no hydrogen 3.252 N/A ILE 469.A N PHE 465.A O no hydrogen 3.127 N/A HIS 470.A N CYS 466.A O no hydrogen 3.311 N/A ASN 471.A N LEU 467.A O no hydrogen 3.146 N/A MET 472.A N ASP 468.A O no hydrogen 3.194 N/A SER 473.A N ILE 469.A O no hydrogen 2.804 N/A SER 473.A OG ILE 469.A O no hydrogen 3.185 N/A SER 473.A OG HIS 470.A O no hydrogen 2.588 N/A VAL 474.A N HIS 470.A O no hydrogen 3.172 N/A LYS 475.A N ASN 471.A O no hydrogen 3.423 N/A ALA 476.A N MET 472.A O no hydrogen 3.267 N/A ARG 478.A NE PRO 480.A O no hydrogen 2.680 N/A ARG 478.A NH2 PRO 480.A O no hydrogen 2.777 N/A PHE 479.A N MET 477.A O no hydrogen 3.258 N/A