Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6krd_Q.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 5.A N GLN 1.A O no hydrogen 3.346 N/A ALA 7.A N ILE 3.A O no hydrogen 2.747 N/A ALA 8.A N LYS 4.A O no hydrogen 3.020 N/A ARG 10.A N ILE 6.A O no hydrogen 2.670 N/A GLU 11.A N ALA 7.A O no hydrogen 3.146 N/A HIS 13.A N ARG 10.A O no hydrogen 3.137 N/A CYS 16.A N HIS 13.A O no hydrogen 3.203 N/A LEU 17.A N HIS 13.A O no hydrogen 3.240 N/A THR 18.A OG1 MET 15.A O no hydrogen 3.163 N/A THR 18.A OG1 ARG 25.A O no hydrogen 3.508 N/A SER 19.A N CYS 16.A O no hydrogen 3.197 N/A SER 19.A OG MET 15.A O no hydrogen 3.430 N/A GLY 24.A N GLY 21.A O no hydrogen 3.450 N/A ARG 25.A N THR 18.A O no hydrogen 2.700 N/A LYS 27.A NZ MET 15.A O no hydrogen 3.190 N/A ILE 29.A N ILE 37.A O no hydrogen 3.377 N/A ASN 31.A N LYS 35.A O no hydrogen 2.976 N/A GLY 34.A N ASN 31.A O no hydrogen 3.092 N/A ILE 37.A N ILE 29.A O no hydrogen 3.160 N/A THR 44.A N ASP 41.A OD2 no hydrogen 3.077 N/A THR 44.A OG1 ASP 41.A OD2 no hydrogen 3.188 N/A LEU 46.A N ALA 42.A O no hydrogen 2.923 N/A ARG 47.A NE GLU 64.A OE1 no hydrogen 3.167 N/A ARG 47.A NE GLU 64.A OE2 no hydrogen 3.278 N/A ARG 47.A NH2 GLU 64.A OE1 no hydrogen 2.426 N/A LEU 49.A N MET 45.A O no hydrogen 3.093 N/A VAL 56.A N HIS 53.A O no hydrogen 3.278 N/A LYS 57.A N HIS 53.A O no hydrogen 3.301 N/A VAL 58.A N PRO 54.A O no hydrogen 3.286 N/A VAL 60.A N VAL 56.A O no hydrogen 3.042 N/A MET 61.A N LYS 57.A O no hydrogen 2.845 N/A ALA 62.A N VAL 58.A O no hydrogen 3.164 N/A THR 63.A N LEU 59.A O no hydrogen 2.895 N/A THR 63.A OG1 LEU 59.A O no hydrogen 2.568 N/A GLU 64.A N VAL 60.A O no hydrogen 3.082 N/A GLN 66.A N THR 63.A O no hydrogen 2.991 N/A GLN 66.A NE2 GLY 73.A O no hydrogen 3.114 N/A LYS 67.A N THR 63.A O no hydrogen 3.113 N/A LYS 67.A NZ ASP 377.A OD1 no hydrogen 2.343 N/A LYS 67.A NZ ASP 377.A OD2 no hydrogen 3.432 N/A ILE 68.A N GLU 64.A O no hydrogen 2.890 N/A ASP 69.A N GLN 65.A O no hydrogen 3.311 N/A GLY 73.A N ASP 72.A OD1 no hydrogen 2.434 N/A THR 74.A OG1 ASP 41.A OD1 no hydrogen 2.654 N/A ASN 75.A ND2 ASN 40.A O no hydrogen 3.655 N/A ASN 75.A ND2 ASN 40.A OD1 no hydrogen 3.223 N/A VAL 77.A N GLY 73.A O no hydrogen 3.287 N/A LEU 80.A N LEU 76.A O no hydrogen 3.053 N/A ALA 81.A N VAL 77.A O no hydrogen 3.061 N/A GLY 82.A N MET 78.A O no hydrogen 3.271 N/A GLU 83.A N ILE 79.A O no hydrogen 3.147 N/A LEU 84.A N LEU 80.A O no hydrogen 3.225 N/A ASN 86.A N GLU 83.A O no hydrogen 3.123 N/A VAL 87.A N GLU 83.A O no hydrogen 3.124 N/A SER 88.A OG LEU 84.A O no hydrogen 2.568 N/A SER 88.A OG TYR 105.A OH no hydrogen 2.858 N/A GLU 89.A N ASN 86.A O no hydrogen 3.276 N/A ILE 92.A N SER 88.A O no hydrogen 3.151 N/A SER 93.A N GLU 89.A O no hydrogen 3.048 N/A MET 94.A N LYS 90.A O no hydrogen 3.343 N/A GLY 95.A N ILE 92.A O no hydrogen 3.125 N/A LEU 96.A N LEU 91.A O no hydrogen 3.033 N/A ILE 102.A N ALA 98.A O no hydrogen 3.106 N/A GLN 103.A N VAL 99.A O no hydrogen 2.771 N/A GLN 103.A NE2 GLN 103.A O no hydrogen 3.351 N/A GLY 104.A N GLU 100.A O no hydrogen 2.817 N/A TYR 105.A N ILE 101.A O no hydrogen 3.322 N/A TYR 105.A OH SER 88.A OG no hydrogen 2.858 N/A ASN 106.A N ILE 102.A O no hydrogen 3.159 N/A MET 107.A N GLN 103.A O no hydrogen 3.113 N/A ALA 108.A N GLY 104.A O no hydrogen 3.073 N/A ARG 109.A N TYR 105.A O no hydrogen 2.825 N/A ARG 109.A NH1 GLU 507.A OE2 no hydrogen 2.945 N/A LYS 110.A N ASN 106.A O no hydrogen 3.500 N/A THR 112.A N ALA 108.A O no hydrogen 3.070 N/A THR 112.A OG1 ALA 108.A O no hydrogen 2.912 N/A LEU 113.A N ARG 109.A O no hydrogen 2.963 N/A LYS 114.A N LYS 110.A O no hydrogen 3.234 N/A GLU 118.A N GLU 115.A O no hydrogen 3.168 N/A MET 119.A N LEU 116.A O no hydrogen 3.278 N/A ILE 124.A N GLY 391.A O no hydrogen 2.735 N/A LEU 133.A N ASP 129.A O no hydrogen 2.927 N/A LYS 135.A N GLU 132.A O no hydrogen 3.397 N/A ILE 137.A N LEU 133.A O no hydrogen 3.249 N/A LYS 138.A NZ GLU 489.A O no hydrogen 2.831 N/A ILE 141.A N ILE 137.A O no hydrogen 3.020 N/A SER 142.A N LYS 138.A O no hydrogen 2.957 N/A SER 142.A OG LYS 138.A O no hydrogen 3.501 N/A SER 142.A OG PRO 139.A O no hydrogen 2.503 N/A LYS 144.A NZ ASP 370.A O no hydrogen 3.335 N/A LYS 145.A NZ ASN 367.A OD1 no hydrogen 2.492 N/A SER 148.A N LYS 145.A O no hydrogen 3.141 N/A SER 148.A OG LYS 145.A O no hydrogen 2.614 N/A LEU 152.A N SER 148.A O no hydrogen 3.155 N/A SER 153.A OG ASP 150.A O no hydrogen 2.756 N/A SER 157.A N SER 153.A O no hydrogen 3.173 N/A SER 157.A OG SER 153.A O no hydrogen 2.999 N/A SER 157.A OG GLU 154.A O no hydrogen 3.397 N/A GLU 158.A N GLU 154.A O no hydrogen 3.327 N/A ALA 159.A N LEU 155.A O no hydrogen 3.268 N/A VAL 160.A N VAL 156.A O no hydrogen 2.958 N/A SER 161.A N SER 157.A O no hydrogen 3.419 N/A SER 161.A OG SER 157.A O no hydrogen 3.451 N/A SER 161.A OG GLU 158.A O no hydrogen 2.801 N/A HIS 162.A N ALA 159.A O no hydrogen 3.252 N/A HIS 162.A NE2 GLU 158.A OE2 no hydrogen 2.583 N/A VAL 163.A N ALA 159.A O no hydrogen 3.275 N/A VAL 163.A N VAL 160.A O no hydrogen 3.121 N/A LEU 164.A N VAL 160.A O no hydrogen 3.186 N/A TYR 175.A OH ALA 170.A O no hydrogen 3.324 N/A ASP 179.A N ASN 177.A OD1 no hydrogen 3.069 N/A LYS 185.A NZ GLU 372.A OE1 no hydrogen 3.176 N/A GLY 188.A N GLY 362.A O no hydrogen 2.707 N/A SER 194.A N LEU 191.A O no hydrogen 3.308 N/A SER 194.A OG LEU 191.A O no hydrogen 3.313 N/A SER 194.A OG ILE 359.A O no hydrogen 3.080 N/A VAL 196.A N THR 195.A OG1 no hydrogen 2.736 N/A ILE 197.A N THR 357.A O no hydrogen 3.471 N/A ARG 204.A NH2 GLU 207.A OE2 no hydrogen 3.348 N/A HIS 209.A N ASN 288.A OD1 no hydrogen 3.317 N/A HIS 219.A N VAL 329.A O no hydrogen 2.426 N/A HIS 219.A ND1 GLU 271.A OE1 no hydrogen 2.964 N/A LYS 220.A NZ MET 268.A O no hydrogen 2.468 N/A VAL 221.A N GLY 327.A O no hydrogen 3.305 N/A ALA 222.A N CYS 272.A O no hydrogen 2.960 N/A PHE 224.A N VAL 274.A O no hydrogen 2.517 N/A THR 225.A N LEU 315.A O no hydrogen 3.216 N/A CYS 226.A SG PRO 227.A O no hydrogen 3.559 N/A ILE 230.A N ASP 229.A OD1 no hydrogen 2.436 N/A GLU 246.A N ASN 243.A O no hydrogen 3.204 N/A MET 247.A N ALA 244.A O no hydrogen 3.213 N/A PHE 250.A N GLU 246.A O no hydrogen 3.248 N/A PHE 250.A N MET 247.A O no hydrogen 3.240 N/A SER 251.A N MET 247.A O no hydrogen 3.453 N/A LYS 252.A N LEU 248.A O no hydrogen 3.151 N/A GLY 253.A N ASP 249.A O no hydrogen 2.965 N/A GLU 254.A N PHE 250.A O no hydrogen 3.434 N/A GLN 257.A N GLY 253.A O no hydrogen 3.183 N/A ILE 258.A N GLU 254.A O no hydrogen 3.298 N/A ASP 259.A N GLU 255.A O no hydrogen 3.402 N/A ALA 260.A N LYS 256.A O no hydrogen 3.067 N/A MET 261.A N GLN 257.A O no hydrogen 3.060 N/A MET 262.A N ILE 258.A O no hydrogen 3.059 N/A LYS 263.A N ASP 259.A O no hydrogen 3.209 N/A ALA 266.A N MET 262.A O no hydrogen 3.179 N/A ASP 267.A N LYS 263.A O no hydrogen 3.153 N/A MET 268.A N ILE 265.A O no hydrogen 3.323 N/A GLY 269.A N ALA 266.A O no hydrogen 3.283 N/A ILE 273.A N LEU 293.A O no hydrogen 3.486 N/A VAL 274.A N ALA 222.A O no hydrogen 2.462 N/A ALA 275.A N LEU 295.A O no hydrogen 3.204 N/A GLY 276.A N PHE 224.A O no hydrogen 3.216 N/A LEU 284.A N GLU 281.A O no hydrogen 3.387 N/A TYR 286.A OH GLU 255.A O no hydrogen 2.803 N/A TYR 290.A OH ASP 259.A OD1 no hydrogen 2.973 N/A ILE 292.A N LEU 287.A O no hydrogen 3.149 N/A LEU 293.A N GLU 271.A O no hydrogen 2.861 N/A VAL 297.A N ALA 275.A O no hydrogen 3.329 N/A ARG 305.A NH1 ASP 179.A O no hydrogen 2.688 N/A LEU 306.A N GLU 302.A O no hydrogen 3.193 N/A CYS 307.A SG LEU 303.A O no hydrogen 3.421 N/A CYS 307.A SG ALA 312.A O no hydrogen 3.240 N/A VAL 309.A N LEU 306.A O no hydrogen 3.145 N/A CYS 310.A N LEU 306.A O no hydrogen 3.337 N/A THR 313.A N GLU 325.A O no hydrogen 2.786 N/A LEU 315.A N VAL 223.A O no hydrogen 3.332 N/A THR 322.A N ALA 320.A O no hydrogen 2.859 N/A GLU 325.A N THR 322.A O no hydrogen 3.218 N/A LEU 326.A N PRO 323.A O no hydrogen 3.379 N/A GLY 327.A N VAL 221.A O no hydrogen 3.250 N/A LEU 328.A N CYS 310.A O no hydrogen 2.940 N/A VAL 329.A N HIS 219.A O no hydrogen 3.100 N/A THR 334.A OG1 LYS 211.A O no hydrogen 2.587 N/A MET 335.A N VAL 342.A O no hydrogen 2.908 N/A ILE 337.A N ASP 340.A O no hydrogen 3.060 N/A VAL 342.A N MET 335.A O no hydrogen 2.913 N/A VAL 344.A N LYS 333.A O no hydrogen 2.894 N/A LYS 346.A NZ GLU 348.A OE2 no hydrogen 3.368 N/A GLN 347.A NE2 GLU 351.A O no hydrogen 2.782 N/A GLU 348.A N GLU 330.A OE1 no hydrogen 3.049 N/A GLN 349.A N GLU 330.A OE1 no hydrogen 3.243 N/A THR 355.A N SER 353.A OG no hydrogen 3.293 N/A THR 357.A N ILE 197.A O no hydrogen 3.121 N/A THR 357.A OG1 ARG 182.A O no hydrogen 3.516 N/A THR 357.A OG1 GLY 199.A O no hydrogen 2.405 N/A GLN 365.A NE2 GLN 365.A O no hydrogen 3.352 N/A ASP 369.A N ASN 366.A O no hydrogen 3.253 N/A ILE 371.A N ASN 367.A O no hydrogen 3.436 N/A GLU 372.A N LEU 368.A O no hydrogen 3.157 N/A ARG 373.A N ASP 369.A O no hydrogen 3.039 N/A ALA 374.A N ASP 370.A O no hydrogen 2.801 N/A ILE 375.A N ILE 371.A O no hydrogen 3.162 N/A ASP 377.A N ARG 373.A O no hydrogen 3.219 N/A GLY 378.A N ALA 374.A O no hydrogen 2.799 N/A VAL 379.A N ILE 375.A O no hydrogen 2.860 N/A ALA 380.A N ASP 376.A O no hydrogen 3.201 N/A VAL 382.A N VAL 379.A O no hydrogen 3.119 N/A GLY 384.A N ALA 381.A O no hydrogen 3.252 N/A LEU 385.A N VAL 382.A O no hydrogen 3.059 N/A SER 389.A N LYS 387.A O no hydrogen 2.546 N/A LEU 394.A N ASP 493.A O no hydrogen 3.172 N/A ALA 399.A N GLY 396.A O no hydrogen 3.164 N/A THR 400.A OG1 PRO 395.A O no hydrogen 2.288 N/A GLU 401.A N GLU 401.A OE1 no hydrogen 2.652 N/A GLU 403.A N ALA 399.A O no hydrogen 3.371 N/A LEU 404.A N THR 400.A O no hydrogen 2.914 N/A ILE 405.A N ILE 402.A O no hydrogen 3.243 N/A ILE 408.A N LEU 404.A O no hydrogen 3.086 N/A THR 409.A N ILE 405.A O no hydrogen 3.127 N/A THR 409.A OG1 ILE 405.A O no hydrogen 3.116 N/A THR 409.A OG1 SER 406.A O no hydrogen 3.212 N/A TYR 411.A OH GLU 115.A OE2 no hydrogen 2.934 N/A GLY 412.A N THR 409.A O no hydrogen 3.398 N/A THR 415.A N TYR 411.A O no hydrogen 3.309 N/A THR 415.A OG1 TYR 411.A O no hydrogen 3.446 N/A GLN 420.A N GLY 417.A O no hydrogen 3.434 N/A GLN 420.A NE2 THR 415.A O no hydrogen 3.496 N/A ILE 423.A N LEU 419.A O no hydrogen 3.059 N/A LYS 424.A N GLN 420.A O no hydrogen 3.378 N/A LYS 424.A NZ GLU 413.A OE2 no hydrogen 3.092 N/A GLN 425.A N LEU 421.A O no hydrogen 3.405 N/A PHE 426.A N ILE 423.A O no hydrogen 3.148 N/A VAL 428.A N LYS 424.A O no hydrogen 3.444 N/A ALA 429.A N GLN 425.A O no hydrogen 3.355 N/A PHE 430.A N ALA 427.A O no hydrogen 3.230 N/A GLU 431.A N VAL 428.A O no hydrogen 3.073 N/A THR 436.A N VAL 432.A O no hydrogen 3.122 N/A THR 436.A OG1 VAL 432.A O no hydrogen 3.308 N/A THR 436.A OG1 VAL 433.A O no hydrogen 2.973 N/A ALA 438.A N PRO 434.A O no hydrogen 3.354 N/A GLU 439.A N ARG 435.A O no hydrogen 3.128 N/A THR 440.A N THR 436.A O no hydrogen 3.105 N/A THR 440.A OG1 THR 436.A O no hydrogen 2.936 N/A THR 440.A OG1 LEU 437.A O no hydrogen 3.395 N/A GLY 442.A N GLU 439.A O no hydrogen 3.324 N/A ASN 446.A N ASP 444.A OD1 no hydrogen 3.257 N/A GLU 447.A N ASP 444.A O no hydrogen 3.348 N/A LEU 452.A N VAL 448.A O no hydrogen 3.088 N/A ALA 454.A N PRO 450.A O no hydrogen 3.365 N/A ALA 455.A N ASN 451.A O no hydrogen 3.309 N/A HIS 456.A N LEU 452.A O no hydrogen 3.315 N/A ASN 457.A N TYR 453.A O no hydrogen 3.061 N/A GLY 462.A N GLU 460.A O no hydrogen 2.632 N/A LYS 471.A NZ ASP 485.A OD1 no hydrogen 2.666 N/A VAL 473.A N ALA 397.A O no hydrogen 2.546 N/A ASP 476.A N ASP 474.A OD1 no hydrogen 3.045 N/A LYS 484.A NZ GLU 489.A OE2 no hydrogen 2.893 N/A GLU 488.A N ASP 485.A O no hydrogen 3.400 N/A ASN 490.A N ARG 487.A O no hydrogen 3.276 N/A ASP 493.A N LEU 394.A O no hydrogen 3.043 N/A LEU 495.A N LYS 392.A O no hydrogen 3.515 N/A THR 497.A N MET 494.A O no hydrogen 3.035 N/A LYS 498.A N MET 494.A O no hydrogen 3.048 N/A LYS 499.A N LEU 495.A O no hydrogen 2.727 N/A ALA 501.A N THR 497.A O no hydrogen 3.184 N/A ALA 501.A N LYS 498.A O no hydrogen 3.196 N/A ILE 502.A N LYS 498.A O no hydrogen 3.255 N/A ALA 505.A N ALA 501.A O no hydrogen 2.930 N/A THR 506.A N ILE 502.A O no hydrogen 3.093 N/A THR 506.A OG1 ILE 502.A O no hydrogen 3.242 N/A THR 506.A OG1 ASN 503.A O no hydrogen 3.085 N/A GLU 507.A N ASN 503.A O no hydrogen 3.402 N/A ALA 508.A N VAL 504.A O no hydrogen 2.997 N/A ALA 509.A N ALA 505.A O no hydrogen 3.342 N/A THR 510.A N THR 506.A O no hydrogen 3.009 N/A THR 510.A OG1 THR 506.A O no hydrogen 2.474 N/A THR 511.A OG1 GLU 507.A O no hydrogen 3.344 N/A LEU 513.A N ALA 509.A O no hydrogen 3.171 N/A SER 514.A N THR 510.A O no hydrogen 2.941 N/A SER 514.A OG THR 510.A O no hydrogen 3.014 N/A SER 514.A OG THR 511.A O no hydrogen 2.860 N/A ILE 515.A N VAL 512.A O no hydrogen 3.404 N/A