Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6kre_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 1.A N THR 508.A O no hydrogen 2.918 N/A ILE 3.A N MET 506.A O no hydrogen 3.457 N/A ASN 10.A N ASP 6.A O no hydrogen 3.175 N/A GLN 11.A N ASP 7.A O no hydrogen 3.180 N/A ASN 12.A N ILE 8.A O no hydrogen 3.207 N/A LEU 14.A N ASN 10.A O no hydrogen 3.148 N/A ALA 15.A N GLN 11.A O no hydrogen 2.918 N/A THR 16.A N ASN 12.A O no hydrogen 3.247 N/A THR 16.A OG1 SER 89.A OG no hydrogen 2.779 N/A MET 17.A N VAL 13.A O no hydrogen 3.011 N/A VAL 19.A N ALA 15.A O no hydrogen 3.382 N/A ALA 20.A N THR 16.A O no hydrogen 2.939 N/A ASN 21.A N MET 17.A O no hydrogen 3.039 N/A VAL 22.A N VAL 19.A O no hydrogen 3.214 N/A GLY 31.A N GLY 28.A O no hydrogen 3.198 N/A LEU 32.A N SER 25.A O no hydrogen 3.228 N/A LYS 34.A N THR 46.A O no hydrogen 3.442 N/A LYS 34.A NZ VAL 22.A O no hydrogen 2.421 N/A GLY 41.A N ASP 38.A OD1 no hydrogen 2.988 N/A PHE 43.A N ASP 42.A OD1 no hydrogen 2.424 N/A ASP 48.A N THR 46.A OG1 no hydrogen 3.389 N/A ALA 50.A N ASP 48.A OD1 no hydrogen 2.989 N/A THR 51.A OG1 ASP 48.A O no hydrogen 2.981 N/A LEU 53.A N GLY 49.A O no hydrogen 3.350 N/A SER 54.A N ALA 50.A O no hydrogen 3.373 N/A SER 54.A OG ALA 50.A O no hydrogen 3.167 N/A GLN 59.A NE2 ASP 57.A OD1 no hydrogen 3.479 N/A ALA 62.A N HIS 60.A ND1 no hydrogen 2.941 N/A GLY 63.A N HIS 60.A ND1 no hydrogen 3.120 N/A LYS 64.A N HIS 60.A O no hydrogen 3.049 N/A LYS 64.A NZ GLN 59.A OE1 no hydrogen 3.165 N/A ILE 65.A N ALA 62.A O no hydrogen 3.259 N/A GLU 68.A N LYS 64.A O no hydrogen 3.351 N/A LEU 69.A N ILE 65.A O no hydrogen 2.981 N/A ALA 70.A N LEU 66.A O no hydrogen 2.945 N/A GLN 71.A N VAL 67.A O no hydrogen 3.260 N/A GLN 72.A N GLU 68.A O no hydrogen 3.153 N/A GLN 73.A NE2 LYS 488.A O no hydrogen 3.402 N/A ASP 74.A N ALA 70.A O no hydrogen 3.391 N/A ARG 75.A N GLN 71.A O no hydrogen 3.193 N/A GLY 78.A N GLN 73.A O no hydrogen 2.471 N/A THR 81.A OG1 ASP 74.A OD1 no hydrogen 2.736 N/A SER 83.A OG GLY 80.A O no hydrogen 2.793 N/A VAL 84.A N GLY 80.A O no hydrogen 3.325 N/A VAL 84.A N THR 81.A O no hydrogen 3.292 N/A VAL 85.A N THR 81.A O no hydrogen 3.422 N/A ILE 87.A N SER 83.A O no hydrogen 3.251 N/A ALA 88.A N VAL 84.A O no hydrogen 3.154 N/A SER 89.A N VAL 85.A O no hydrogen 2.997 N/A SER 89.A OG THR 16.A O no hydrogen 3.419 N/A SER 89.A OG THR 16.A OG1 no hydrogen 2.779 N/A SER 89.A OG VAL 85.A O no hydrogen 2.711 N/A GLU 90.A N ILE 86.A O no hydrogen 3.225 N/A LEU 91.A N ILE 87.A O no hydrogen 3.229 N/A LYS 93.A N SER 89.A O no hydrogen 3.388 N/A ARG 94.A N GLU 90.A O no hydrogen 3.120 N/A ARG 94.A NH1 GLU 412.A OE1 no hydrogen 3.126 N/A ALA 95.A N LEU 91.A O no hydrogen 3.064 N/A ASN 96.A N LEU 92.A O no hydrogen 3.238 N/A ASN 96.A ND2 ASN 10.A OD1 no hydrogen 3.025 N/A LEU 98.A N ALA 95.A O no hydrogen 3.280 N/A VAL 99.A N ASN 96.A O no hydrogen 3.260 N/A ASN 101.A N LEU 98.A O no hydrogen 3.205 N/A LYS 102.A N VAL 99.A O no hydrogen 3.107 N/A ILE 103.A N LEU 98.A O no hydrogen 3.109 N/A THR 106.A N HIS 104.A ND1 no hydrogen 2.954 N/A ILE 108.A N HIS 104.A O no hydrogen 3.135 N/A ILE 109.A N PRO 105.A O no hydrogen 2.775 N/A THR 110.A N THR 106.A O no hydrogen 2.534 N/A THR 110.A OG1 THR 106.A O no hydrogen 2.957 N/A GLY 111.A N THR 107.A O no hydrogen 2.652 N/A PHE 112.A N ILE 108.A O no hydrogen 3.170 N/A PHE 112.A N ILE 109.A O no hydrogen 3.139 N/A ARG 113.A N ILE 109.A O no hydrogen 3.018 N/A VAL 114.A N THR 110.A O no hydrogen 3.014 N/A ALA 115.A N GLY 111.A O no hydrogen 3.298 N/A LEU 116.A N PHE 112.A O no hydrogen 2.712 N/A ARG 117.A N ARG 113.A O no hydrogen 3.252 N/A GLU 118.A N VAL 114.A O no hydrogen 3.380 N/A ALA 119.A N ALA 115.A O no hydrogen 2.777 N/A ILE 120.A N LEU 116.A O no hydrogen 3.267 N/A ARG 121.A NE GLU 118.A OE1 no hydrogen 2.741 N/A ARG 121.A NH2 GLU 118.A OE1 no hydrogen 2.839 N/A PHE 122.A N GLU 118.A O no hydrogen 3.163 N/A ILE 123.A N ALA 119.A O no hydrogen 2.908 N/A ASN 124.A N ILE 120.A O no hydrogen 2.886 N/A GLU 125.A N PHE 122.A O no hydrogen 3.275 N/A VAL 126.A N ILE 123.A O no hydrogen 3.209 N/A SER 128.A OG THR 129.A O no hydrogen 3.363 N/A ASN 141.A N THR 138.A O no hydrogen 3.280 N/A ASN 141.A ND2 HIS 476.A O no hydrogen 2.340 N/A LYS 144.A N ILE 140.A O no hydrogen 3.202 N/A THR 145.A N ASN 141.A O no hydrogen 3.222 N/A THR 145.A OG1 ASN 141.A O no hydrogen 3.207 N/A THR 145.A OG1 ILE 142.A O no hydrogen 3.276 N/A SER 146.A N ILE 142.A O no hydrogen 3.305 N/A SER 146.A OG ILE 142.A O no hydrogen 3.235 N/A SER 146.A OG ALA 143.A O no hydrogen 3.203 N/A SER 146.A OG SER 367.A OG no hydrogen 2.815 N/A MET 147.A N ALA 143.A O no hydrogen 3.348 N/A SER 148.A N THR 145.A O no hydrogen 3.458 N/A SER 148.A OG LYS 144.A O no hydrogen 2.924 N/A SER 148.A OG THR 145.A O no hydrogen 3.434 N/A LYS 150.A N MET 147.A O no hydrogen 2.990 N/A GLY 153.A N LYS 150.A O no hydrogen 3.190 N/A ALA 154.A N ILE 151.A O no hydrogen 3.249 N/A SER 156.A OG GLY 153.A O no hydrogen 2.681 N/A PHE 158.A N ASP 155.A O no hydrogen 3.147 N/A PHE 159.A N ASP 155.A O no hydrogen 3.214 N/A SER 160.A N SER 156.A O no hydrogen 2.930 N/A SER 160.A OG SER 156.A O no hydrogen 2.665 N/A MET 162.A N PHE 159.A O no hydrogen 3.297 N/A VAL 163.A N PHE 159.A O no hydrogen 3.413 N/A VAL 164.A N SER 160.A O no hydrogen 3.036 N/A ASP 165.A N ASN 161.A O no hydrogen 3.409 N/A ALA 166.A N MET 162.A O no hydrogen 3.327 N/A LEU 167.A N VAL 163.A O no hydrogen 3.053 N/A LEU 168.A N VAL 164.A O no hydrogen 2.989 N/A ALA 169.A N ALA 166.A O no hydrogen 3.118 N/A VAL 170.A N LEU 167.A O no hydrogen 3.206 N/A ASN 174.A ND2 LYS 180.A O no hydrogen 2.800 N/A GLU 178.A N GLN 173.A O no hydrogen 2.408 N/A LEU 189.A N ILE 347.A O no hydrogen 3.186 N/A ALA 191.A N LEU 349.A O no hydrogen 2.985 N/A SER 195.A OG THR 197.A OG1 no hydrogen 3.264 N/A THR 197.A OG1 SER 195.A OG no hydrogen 3.264 N/A SER 199.A OG ALA 196.A O no hydrogen 3.429 N/A SER 199.A OG ARG 350.A O no hydrogen 3.212 N/A GLY 204.A N VAL 202.A O no hydrogen 2.706 N/A GLY 204.A N SER 345.A OG no hydrogen 3.241 N/A LEU 207.A N ILE 334.A O no hydrogen 3.169 N/A ARG 219.A NE GLU 322.A OE2 no hydrogen 2.429 N/A VAL 225.A N CYS 320.A O no hydrogen 3.340 N/A ALA 228.A N VAL 257.A O no hydrogen 2.791 N/A CYS 229.A SG LEU 288.A O no hydrogen 3.787 N/A LEU 230.A N LEU 259.A O no hydrogen 3.319 N/A ARG 246.A N ILE 242.A O no hydrogen 3.213 N/A ARG 246.A NH1 ASN 233.A O no hydrogen 3.344 N/A VAL 247.A N VAL 243.A O no hydrogen 3.402 N/A LYS 248.A N LEU 244.A O no hydrogen 3.035 N/A LYS 249.A N GLU 245.A O no hydrogen 3.319 N/A ILE 250.A N VAL 247.A O no hydrogen 2.953 N/A ILE 251.A N VAL 247.A O no hydrogen 3.273 N/A ASP 252.A N LYS 248.A O no hydrogen 3.409 N/A ALA 253.A N ILE 250.A O no hydrogen 2.820 N/A GLY 254.A N ILE 250.A O no hydrogen 3.229 N/A VAL 257.A N LYS 226.A O no hydrogen 3.401 N/A VAL 258.A N MET 278.A O no hydrogen 3.192 N/A LEU 259.A N ALA 228.A O no hydrogen 3.215 N/A THR 260.A OG1 VAL 280.A O no hydrogen 2.853 N/A THR 261.A OG1 ASP 231.A O no hydrogen 2.795 N/A THR 261.A OG1 ASP 231.A OD1 no hydrogen 3.513 N/A ASP 266.A N ASP 265.A OD1 no hydrogen 2.420 N/A CYS 268.A SG LEU 234.A O no hydrogen 3.320 N/A CYS 268.A SG VAL 243.A O no hydrogen 3.825 N/A LEU 269.A N ASP 266.A O no hydrogen 3.218 N/A PHE 272.A N LEU 269.A O no hydrogen 3.088 N/A VAL 273.A N LYS 270.A O no hydrogen 3.232 N/A LYS 276.A N VAL 273.A O no hydrogen 3.289 N/A ILE 277.A N PHE 272.A O no hydrogen 2.843 N/A MET 278.A N GLN 256.A O no hydrogen 2.802 N/A VAL 280.A N VAL 258.A O no hydrogen 3.250 N/A ARG 281.A NH2 ASP 265.A O no hydrogen 3.464 N/A ARG 281.A NH2 ASP 266.A OD1 no hydrogen 2.700 N/A CYS 283.A N THR 260.A O no hydrogen 3.041 N/A CYS 283.A SG THR 260.A O no hydrogen 3.163 N/A CYS 283.A SG VAL 280.A O no hydrogen 4.004 N/A ASP 287.A N LYS 284.A O no hydrogen 3.209 N/A LEU 288.A N LYS 284.A O no hydrogen 3.310 N/A ARG 289.A NE GLU 286.A O no hydrogen 3.455 N/A ARG 290.A NH2 ASP 287.A OD1 no hydrogen 2.945 N/A ILE 291.A N LEU 288.A O no hydrogen 3.234 N/A ALA 292.A N LEU 288.A O no hydrogen 3.417 N/A ALA 294.A N ARG 290.A O no hydrogen 3.048 N/A THR 295.A N ILE 291.A O no hydrogen 2.681 N/A THR 295.A OG1 ILE 291.A O no hydrogen 2.446 N/A SER 302.A OG SER 304.A OG no hydrogen 3.399 N/A SER 304.A OG SER 302.A OG no hydrogen 3.399 N/A THR 311.A OG1 LYS 249.A O no hydrogen 3.021 N/A GLU 313.A N GLU 313.A OE1 no hydrogen 2.574 N/A SER 315.A N PHE 312.A O no hydrogen 3.169 N/A CYS 333.A SG ASN 208.A OD1 no hydrogen 3.278 N/A ILE 334.A N LEU 207.A O no hydrogen 2.704 N/A LEU 335.A N VAL 324.A O no hydrogen 3.290 N/A ILE 336.A N TYR 205.A O no hydrogen 2.998 N/A THR 339.A OG1 ALA 294.A O no hydrogen 3.097 N/A SER 340.A OG THR 295.A O no hydrogen 3.461 N/A LYS 341.A N SER 340.A OG no hydrogen 2.626 N/A HIS 342.A ND1 SER 344.A O no hydrogen 3.234 N/A SER 345.A OG VAL 202.A O no hydrogen 2.282 N/A SER 345.A OG SER 346.A O no hydrogen 3.501 N/A SER 346.A N VAL 202.A O no hydrogen 3.417 N/A SER 346.A OG ASN 187.A O no hydrogen 2.905 N/A LEU 349.A N LEU 189.A O no hydrogen 3.330 N/A ARG 350.A N SER 199.A OG no hydrogen 2.917 N/A ARG 350.A NH2 GLU 198.A O no hydrogen 2.309 N/A GLY 351.A N ALA 191.A O no hydrogen 2.935 N/A SER 356.A N ASN 353.A OD1 no hydrogen 2.818 N/A SER 356.A OG ASN 353.A OD1 no hydrogen 3.205 N/A LEU 357.A N ASN 353.A O no hydrogen 3.436 N/A ASP 358.A N ASP 354.A O no hydrogen 2.888 N/A MET 360.A N SER 356.A O no hydrogen 2.980 N/A GLU 361.A N LEU 357.A O no hydrogen 2.725 N/A ARG 362.A N ASP 358.A O no hydrogen 3.368 N/A SER 363.A N GLU 359.A O no hydrogen 3.161 N/A SER 363.A OG GLU 359.A O no hydrogen 2.930 N/A SER 363.A OG MET 360.A O no hydrogen 2.975 N/A LEU 364.A N MET 360.A O no hydrogen 2.876 N/A HIS 365.A N GLU 361.A O no hydrogen 3.319 N/A ASP 366.A N ARG 362.A O no hydrogen 3.289 N/A SER 367.A N SER 363.A O no hydrogen 2.817 N/A SER 367.A OG SER 146.A OG no hydrogen 2.815 N/A SER 367.A OG SER 363.A O no hydrogen 2.982 N/A LEU 368.A N LEU 364.A O no hydrogen 2.729 N/A SER 369.A N HIS 365.A O no hydrogen 3.015 N/A SER 369.A OG ASP 366.A O no hydrogen 2.333 N/A LYS 372.A N LEU 368.A O no hydrogen 2.841 N/A LYS 372.A NZ VAL 183.A O no hydrogen 2.393 N/A ARG 373.A N SER 369.A O no hydrogen 3.098 N/A THR 374.A N VAL 370.A O no hydrogen 3.376 N/A THR 374.A OG1 VAL 370.A O no hydrogen 3.081 N/A LEU 375.A N VAL 371.A O no hydrogen 3.036 N/A SER 377.A OG ASN 379.A O no hydrogen 2.974 N/A VAL 381.A N GLU 481.A O no hydrogen 2.674 N/A CYS 386.A SG GLY 383.A O no hydrogen 3.300 N/A CYS 386.A SG TYR 462.A O no hydrogen 3.268 N/A GLU 388.A N GLU 388.A OE1 no hydrogen 2.675 N/A ALA 389.A N GLY 385.A O no hydrogen 3.121 N/A ALA 390.A N CYS 386.A O no hydrogen 3.343 N/A LEU 391.A N VAL 387.A O no hydrogen 3.400 N/A ASN 392.A N GLU 388.A O no hydrogen 3.169 N/A TYR 394.A N ALA 390.A O no hydrogen 3.463 N/A LEU 395.A N LEU 391.A O no hydrogen 3.094 N/A ASP 396.A N ILE 393.A O no hydrogen 3.143 N/A PHE 398.A N TYR 394.A O no hydrogen 3.135 N/A ALA 399.A N LEU 395.A O no hydrogen 3.050 N/A THR 400.A OG1 ASN 397.A O no hydrogen 2.703 N/A THR 401.A N PHE 398.A O no hydrogen 3.064 N/A THR 401.A OG1 PHE 398.A O no hydrogen 2.382 N/A GLU 406.A N GLY 403.A O no hydrogen 3.297 N/A ILE 410.A N GLU 406.A O no hydrogen 3.221 N/A ALA 411.A N GLN 407.A O no hydrogen 2.965 N/A GLU 412.A N LEU 408.A O no hydrogen 3.166 N/A PHE 413.A N ALA 409.A O no hydrogen 2.955 N/A ALA 414.A N ILE 410.A O no hydrogen 2.890 N/A ALA 415.A N ALA 411.A O no hydrogen 3.078 N/A ALA 416.A N GLU 412.A O no hydrogen 3.141 N/A LEU 417.A N ALA 414.A O no hydrogen 3.201 N/A LEU 418.A N ALA 415.A O no hydrogen 3.492 N/A LYS 422.A N LEU 418.A O no hydrogen 3.289 N/A THR 423.A N ILE 419.A O no hydrogen 3.045 N/A THR 423.A OG1 ILE 419.A O no hydrogen 2.965 N/A LEU 424.A N ILE 420.A O no hydrogen 3.219 N/A ALA 425.A N PRO 421.A O no hydrogen 3.236 N/A ALA 425.A N LYS 422.A O no hydrogen 3.188 N/A VAL 426.A N THR 423.A O no hydrogen 3.363 N/A ASN 427.A ND2 SER 25.A O no hydrogen 2.544 N/A ALA 429.A N VAL 426.A O no hydrogen 3.205 N/A SER 433.A N ASP 431.A OD1 no hydrogen 3.094 N/A LEU 435.A N ASP 431.A O no hydrogen 3.484 N/A VAL 436.A N SER 432.A O no hydrogen 3.430 N/A ALA 437.A N SER 433.A O no hydrogen 3.424 N/A LYS 438.A N GLU 434.A O no hydrogen 2.978 N/A LEU 439.A N LEU 435.A O no hydrogen 2.893 N/A ARG 440.A N VAL 436.A O no hydrogen 3.287 N/A ARG 440.A N ALA 437.A O no hydrogen 3.127 N/A SER 441.A N ALA 437.A O no hydrogen 3.252 N/A SER 441.A OG ALA 437.A O no hydrogen 3.474 N/A TYR 442.A N LYS 438.A O no hydrogen 3.245 N/A HIS 443.A N LEU 439.A O no hydrogen 3.381 N/A HIS 443.A NE2 TYR 462.A O no hydrogen 3.054 N/A ALA 444.A N ARG 440.A O no hydrogen 2.952 N/A SER 446.A OG TYR 442.A O no hydrogen 2.568 N/A SER 446.A OG TYR 459.A O no hydrogen 2.688 N/A GLN 447.A N HIS 443.A O no hydrogen 3.379 N/A GLN 447.A NE2 ALA 390.A O no hydrogen 3.406 N/A ASP 453.A N LYS 450.A O no hydrogen 3.233 N/A GLY 463.A N VAL 472.A O no hydrogen 2.965 N/A ASP 465.A N LYS 470.A O no hydrogen 3.229 N/A ILE 467.A N ASP 465.A OD1 no hydrogen 3.095 N/A ARG 468.A NE ASP 465.A OD2 no hydrogen 2.771 N/A ARG 468.A NH2 ASP 465.A OD2 no hydrogen 3.000 N/A LYS 470.A N ASP 465.A O no hydrogen 3.256 N/A ILE 475.A N ASP 473.A OD1 no hydrogen 2.914 N/A ALA 477.A N ASP 473.A O no hydrogen 3.083 N/A GLY 478.A N GLU 474.A O no hydrogen 3.074 N/A VAL 479.A N GLU 474.A O no hydrogen 2.986 N/A GLU 481.A N VAL 381.A O no hydrogen 2.964 N/A THR 483.A N ASN 379.A O no hydrogen 3.134 N/A THR 483.A OG1 ASN 379.A O no hydrogen 3.091 N/A THR 483.A OG1 ASN 379.A OD1 no hydrogen 2.752 N/A VAL 487.A N THR 483.A O no hydrogen 3.034 N/A LYS 488.A N ILE 484.A O no hydrogen 3.335 N/A LYS 488.A NZ GLU 76.A OE2 no hydrogen 3.249 N/A SER 489.A N SER 485.A O no hydrogen 3.269 N/A SER 489.A OG SER 485.A O no hydrogen 2.614 N/A LEU 490.A N LYS 486.A O no hydrogen 3.082 N/A LYS 491.A N VAL 487.A O no hydrogen 3.007 N/A SER 492.A N LYS 488.A O no hydrogen 3.118 N/A SER 492.A OG LYS 488.A O no hydrogen 3.064 N/A ALA 493.A N SER 489.A O no hydrogen 3.266 N/A GLU 495.A N LYS 491.A O no hydrogen 3.356 N/A ALA 496.A N SER 492.A O no hydrogen 3.460 N/A VAL 498.A N LEU 494.A O no hydrogen 3.000 N/A LEU 501.A N CYS 497.A O no hydrogen 3.294 N/A ARG 502.A N VAL 498.A O no hydrogen 3.081 N/A ILE 503.A N ILE 500.A O no hydrogen 3.409 N/A MET 506.A N ILE 3.A O no hydrogen 3.412 N/A THR 508.A N GLU 1.A O no hydrogen 3.298 N/A