Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4o44_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 7.A OG1 ASP 121.A OD1 no hydrogen 3.172 N/A THR 7.A OG1 GLU 122.A OE1 no hydrogen 3.239 N/A VAL 10.A N ASP 121.A OD2 no hydrogen 3.358 N/A LYS 13.A NZ ASP 86.A OD2 no hydrogen 3.322 N/A MET 16.A N LYS 13.A O no hydrogen 3.162 N/A VAL 21.A N ASN 57.A O no hydrogen 3.021 N/A GLN 23.A NE2 TRP 24.A O no hydrogen 2.877 N/A GLN 23.A NE2 VAL 60.A O no hydrogen 3.008 N/A ILE 31.A N THR 27.A O no hydrogen 3.268 N/A LYS 32.A N GLU 28.A O no hydrogen 2.958 N/A ALA 33.A N GLU 29.A O no hydrogen 3.194 N/A LEU 34.A N LYS 30.A O no hydrogen 2.744 N/A VAL 35.A N ILE 31.A O no hydrogen 2.821 N/A GLU 36.A N LYS 32.A O no hydrogen 3.071 N/A ILE 37.A N ALA 33.A O no hydrogen 3.084 N/A CYS 38.A N LEU 34.A O no hydrogen 2.998 N/A CYS 38.A SG LEU 34.A O no hydrogen 3.115 N/A THR 39.A N VAL 35.A O no hydrogen 2.985 N/A THR 39.A OG1 VAL 35.A O no hydrogen 3.491 N/A THR 39.A OG1 GLU 36.A O no hydrogen 3.190 N/A GLU 40.A N GLU 36.A O no hydrogen 3.038 N/A MET 41.A N ILE 37.A O no hydrogen 2.882 N/A GLU 42.A N CYS 38.A O no hydrogen 2.793 N/A LYS 43.A N THR 39.A O no hydrogen 3.090 N/A GLU 44.A N MET 41.A O no hydrogen 2.860 N/A GLY 45.A N GLU 42.A O no hydrogen 3.180 N/A LYS 46.A N MET 41.A O no hydrogen 3.109 N/A LYS 46.A NZ GLU 44.A OE1 no hydrogen 3.490 N/A SER 48.A N GLN 145.A O no hydrogen 2.954 N/A ILE 50.A N ARG 143.A O no hydrogen 3.121 N/A GLU 53.A N GLU 53.A OE1 no hydrogen 2.887 N/A ASN 54.A N GLY 51.A O no hydrogen 3.408 N/A ASN 54.A ND2 LYS 126.A O no hydrogen 3.087 N/A ASN 54.A ND2 GLN 145.A OE1 no hydrogen 3.181 N/A TYR 56.A N ASN 54.A OD1 no hydrogen 3.297 N/A TYR 56.A OH ASP 17.A OD1 no hydrogen 3.415 N/A TYR 56.A OH ASP 17.A OD2 no hydrogen 2.999 N/A ASN 57.A N PRO 19.A O no hydrogen 2.994 N/A ASN 57.A ND2 VAL 21.A O no hydrogen 2.486 N/A THR 58.A N ALA 129.A O no hydrogen 2.853 N/A VAL 60.A N GLN 23.A OE1 no hydrogen 2.840 N/A PHE 61.A N LEU 74.A O no hydrogen 3.037 N/A ILE 63.A N ARG 72.A O no hydrogen 2.978 N/A SER 68.A OG LYS 66.A O no hydrogen 3.077 N/A ARG 72.A N ILE 63.A O no hydrogen 2.959 N/A ARG 72.A NH2 GLN 151.A OE1 no hydrogen 3.557 N/A LYS 73.A NZ TYR 146.A OH no hydrogen 2.406 N/A LEU 74.A N PHE 61.A O no hydrogen 2.826 N/A ASP 76.A N PRO 59.A O no hydrogen 3.239 N/A ARG 78.A NE ASP 76.A OD2 no hydrogen 3.359 N/A ARG 78.A NH1 PRO 412.A O no hydrogen 2.919 N/A ASN 81.A N PHE 77.A O no hydrogen 2.835 N/A LYS 82.A N ARG 78.A O no hydrogen 3.249 N/A LYS 82.A NZ GLU 79.A OE1 no hydrogen 3.316 N/A ARG 83.A N LEU 80.A O no hydrogen 2.981 N/A ARG 83.A NE ASP 17.A O no hydrogen 2.878 N/A THR 84.A N ASN 81.A O no hydrogen 2.913 N/A THR 84.A OG1 LEU 80.A O no hydrogen 2.816 N/A GLN 85.A N ASN 81.A O no hydrogen 2.755 N/A PHE 87.A N THR 84.A O no hydrogen 2.754 N/A TRP 88.A N GLN 85.A O no hydrogen 2.641 N/A TRP 88.A NE1 LYS 11.A O no hydrogen 3.298 N/A HIS 96.A NE2 ILE 382.A O no hydrogen 3.189 N/A LEU 100.A N PRO 97.A O no hydrogen 3.444 N/A LYS 101.A NZ ALA 98.A O no hydrogen 3.241 N/A LYS 101.A NZ ILE 382.A O no hydrogen 3.272 N/A LYS 102.A N GLY 99.A O no hydrogen 2.932 N/A LYS 103.A N LEU 100.A O no hydrogen 3.477 N/A LYS 103.A NZ ASP 177.A O no hydrogen 2.891 N/A LYS 103.A NZ ASP 192.A OD2 no hydrogen 2.788 N/A LYS 104.A N ASP 192.A OD1 no hydrogen 3.231 N/A SER 105.A N SER 191.A O no hydrogen 3.223 N/A SER 105.A OG HIS 235.A ND1 no hydrogen 3.041 N/A VAL 106.A N LEU 234.A O no hydrogen 3.019 N/A THR 107.A N VAL 189.A O no hydrogen 2.734 N/A THR 107.A OG1 HIS 198.A NE2 no hydrogen 2.617 N/A LEU 109.A N LEU 187.A O no hydrogen 2.890 N/A VAL 111.A N ASP 185.A O no hydrogen 2.621 N/A GLY 112.A N ASP 110.A OD2 no hydrogen 3.185 N/A ALA 114.A N VAL 111.A O no hydrogen 3.166 N/A TYR 115.A OH MET 184.A O no hydrogen 2.410 N/A SER 117.A N ALA 114.A O no hydrogen 3.494 N/A SER 117.A OG ALA 114.A O no hydrogen 3.267 N/A LEU 120.A N ASN 147.A O no hydrogen 3.209 N/A GLU 122.A N GLU 122.A OE1 no hydrogen 2.959 N/A PHE 124.A N ASP 121.A O no hydrogen 2.827 N/A ARG 125.A N ASP 121.A O no hydrogen 3.074 N/A ARG 125.A N GLU 122.A O no hydrogen 3.403 N/A ARG 125.A NE ASN 147.A OD1 no hydrogen 3.183 N/A TYR 127.A N PHE 124.A O no hydrogen 3.109 N/A THR 128.A N ARG 125.A O no hydrogen 2.984 N/A THR 128.A OG1 ARG 125.A O no hydrogen 2.945 N/A PHE 130.A N TYR 144.A O no hydrogen 3.054 N/A THR 131.A OG1 ASN 57.A OD1 no hydrogen 2.635 N/A ILE 132.A N ILE 142.A O no hydrogen 2.837 N/A GLU 138.A N ILE 135.A O no hydrogen 3.252 N/A ILE 142.A N ILE 132.A O no hydrogen 2.948 N/A ARG 143.A NH1 TYR 56.A O no hydrogen 3.411 N/A ARG 143.A NH1 THR 131.A OG1 no hydrogen 2.985 N/A ARG 143.A NH2 ASN 54.A O no hydrogen 2.596 N/A ARG 143.A NH2 TYR 56.A O no hydrogen 2.828 N/A TYR 144.A N PHE 130.A O no hydrogen 3.211 N/A GLN 145.A N SER 48.A O no hydrogen 2.861 N/A TYR 146.A N THR 128.A OG1 no hydrogen 2.833 N/A ASN 147.A N LYS 46.A O no hydrogen 2.693 N/A ASN 147.A ND2 GLY 45.A O no hydrogen 2.913 N/A ASN 147.A ND2 SER 48.A OG no hydrogen 2.784 N/A LEU 149.A N VAL 118.A O no hydrogen 3.088 N/A TRP 153.A NE1 THR 84.A OG1 no hydrogen 3.115 N/A LYS 154.A N ASN 81.A OD1 no hydrogen 3.253 N/A SER 156.A OG PRO 150.A O no hydrogen 2.732 N/A ILE 159.A N GLY 155.A O no hydrogen 3.156 N/A PHE 160.A N SER 156.A O no hydrogen 2.929 N/A GLN 161.A NE2 PRO 157.A O no hydrogen 3.330 N/A GLN 161.A NE2 GLN 182.A OE1 no hydrogen 2.522 N/A MET 164.A N PHE 160.A O no hydrogen 2.947 N/A THR 165.A N GLN 161.A O no hydrogen 2.882 N/A THR 165.A OG1 GLN 161.A O no hydrogen 3.237 N/A THR 165.A OG1 SER 162.A O no hydrogen 2.818 N/A LYS 166.A N SER 162.A O no hydrogen 3.048 N/A ILE 167.A N SER 163.A O no hydrogen 3.181 N/A LEU 168.A N MET 164.A O no hydrogen 2.970 N/A GLU 169.A N THR 165.A O no hydrogen 3.141 N/A PHE 171.A N LEU 168.A O no hydrogen 2.801 N/A LYS 172.A N LEU 168.A O no hydrogen 3.010 N/A LYS 173.A N GLU 169.A O no hydrogen 3.155 N/A LYS 173.A NZ GLU 169.A OE2 no hydrogen 3.394 N/A GLN 174.A NE2 PRO 170.A O no hydrogen 3.627 N/A ASN 175.A N PHE 171.A O no hydrogen 2.965 N/A ASN 175.A ND2 PHE 171.A O no hydrogen 3.378 N/A VAL 179.A N GLY 190.A O no hydrogen 3.164 N/A TYR 181.A N TYR 188.A O no hydrogen 2.995 N/A TYR 183.A N ASP 186.A O no hydrogen 2.910 N/A ASP 186.A N TYR 183.A O no hydrogen 3.017 N/A LEU 187.A N LEU 109.A O no hydrogen 2.697 N/A TYR 188.A N TYR 181.A O no hydrogen 2.543 N/A VAL 189.A N THR 107.A O no hydrogen 2.826 N/A GLY 190.A N VAL 179.A O no hydrogen 2.991 N/A SER 191.A N SER 105.A O no hydrogen 2.954 N/A SER 191.A OG HIS 198.A ND1 no hydrogen 2.257 N/A HIS 198.A N GLU 194.A O no hydrogen 2.884 N/A HIS 198.A ND1 SER 191.A OG no hydrogen 2.257 N/A HIS 198.A NE2 THR 107.A OG1 no hydrogen 2.617 N/A ARG 199.A N ILE 195.A O no hydrogen 3.198 N/A ARG 199.A NE GLU 233.A OE1 no hydrogen 3.542 N/A ARG 199.A NE GLU 233.A OE2 no hydrogen 3.062 N/A ARG 199.A NH2 GLU 233.A OE1 no hydrogen 3.286 N/A THR 200.A N GLY 196.A O no hydrogen 3.258 N/A THR 200.A OG1 GLY 196.A O no hydrogen 2.912 N/A LYS 201.A N GLN 197.A O no hydrogen 2.786 N/A ILE 202.A N HIS 198.A O no hydrogen 3.028 N/A GLU 203.A N ARG 199.A O no hydrogen 3.066 N/A GLU 204.A N THR 200.A O no hydrogen 3.261 N/A LEU 205.A N LYS 201.A O no hydrogen 3.246 N/A ARG 206.A N ILE 202.A O no hydrogen 2.824 N/A ARG 206.A NE GLU 203.A OE2 no hydrogen 3.271 N/A ARG 206.A NH1 THR 216.A OG1 no hydrogen 2.322 N/A GLN 207.A N GLU 203.A O no hydrogen 3.028 N/A HIS 208.A N GLU 204.A O no hydrogen 2.897 N/A HIS 208.A NE2 ILE 167.A O no hydrogen 2.538 N/A LEU 209.A N LEU 205.A O no hydrogen 2.885 N/A LEU 210.A N GLN 207.A O no hydrogen 3.218 N/A ARG 211.A N GLN 207.A O no hydrogen 3.006 N/A GLY 213.A N LEU 210.A O no hydrogen 2.973 N/A LEU 214.A N LEU 209.A O no hydrogen 2.832 N/A THR 215.A OG1 ASP 113.A OD2 no hydrogen 3.145 N/A LEU 234.A N VAL 106.A O no hydrogen 2.820 N/A HIS 235.A ND1 LYS 104.A O no hydrogen 3.160 N/A LYS 238.A N HIS 235.A O no hydrogen 3.165 N/A TRP 239.A N PRO 236.A O no hydrogen 3.313 N/A GLN 242.A N THR 351.A OG1 no hydrogen 3.210 N/A LYS 249.A NZ ASP 256.A OD1 no hydrogen 3.316 N/A LYS 249.A NZ ASP 256.A OD2 no hydrogen 2.812 N/A THR 253.A N ASP 256.A OD2 no hydrogen 3.344 N/A VAL 254.A N GLU 291.A O no hydrogen 2.963 N/A ASN 255.A N LEU 289.A O no hydrogen 3.035 N/A ASP 256.A N THR 253.A OG1 no hydrogen 3.089 N/A ILE 257.A N THR 253.A O no hydrogen 2.909 N/A GLN 258.A N ASN 255.A O no hydrogen 3.083 N/A LYS 259.A N ASN 255.A O no hydrogen 2.801 N/A LEU 264.A N VAL 261.A O no hydrogen 2.483 N/A TRP 266.A N LYS 263.A O no hydrogen 3.018 N/A SER 268.A OG ASN 265.A O no hydrogen 2.603 N/A GLN 269.A N TRP 266.A O no hydrogen 3.084 N/A ILE 270.A N ALA 267.A O no hydrogen 2.730 N/A TYR 271.A N ALA 267.A O no hydrogen 2.530 N/A LEU 279.A N VAL 276.A O no hydrogen 3.020 N/A SER 280.A N VAL 276.A O no hydrogen 3.150 N/A SER 280.A N ARG 277.A O no hydrogen 3.040 N/A SER 280.A OG VAL 276.A O no hydrogen 2.860 N/A LEU 282.A N LEU 279.A O no hydrogen 3.273 N/A LYS 287.A NZ GLU 291.A OE2 no hydrogen 3.078 N/A GLU 291.A N ALA 288.A O no hydrogen 3.028 N/A ILE 293.A N TRP 252.A O no hydrogen 2.905 N/A GLU 300.A N THR 296.A O no hydrogen 3.345 N/A LEU 301.A N GLU 297.A O no hydrogen 3.355 N/A GLU 302.A N ALA 299.A O no hydrogen 3.351 N/A LEU 303.A N GLU 300.A O no hydrogen 3.125 N/A ALA 304.A N GLU 300.A O no hydrogen 2.972 N/A ASN 306.A ND2 LYS 275.A O no hydrogen 2.600 N/A ASN 306.A ND2 GLU 302.A O no hydrogen 2.650 N/A ARG 307.A NH2 PRO 247.A O no hydrogen 3.233 N/A GLU 308.A N ALA 304.A O no hydrogen 3.499 N/A LEU 310.A N ARG 307.A O no hydrogen 3.342 N/A ASP 320.A N GLN 343.A OE1 no hydrogen 2.860 N/A SER 322.A N ASP 320.A OD1 no hydrogen 3.220 N/A SER 322.A OG ASP 320.A OD1 no hydrogen 2.815 N/A LYS 323.A N ASP 320.A O no hydrogen 3.096 N/A ILE 326.A N TYR 342.A O no hydrogen 2.677 N/A ALA 327.A N LYS 388.A O no hydrogen 3.365 N/A GLU 328.A N GLN 340.A O no hydrogen 2.925 N/A GLN 330.A N THR 338.A O no hydrogen 2.536 N/A GLN 330.A NE2 GLN 340.A OE1 no hydrogen 3.053 N/A LYS 331.A NZ ASP 364.A OD2 no hydrogen 2.434 N/A GLN 332.A N GLN 336.A O no hydrogen 2.987 N/A GLN 332.A NE2 THR 338.A OG1 no hydrogen 3.031 N/A GLN 332.A NE2 LYS 424.A O no hydrogen 2.893 N/A GLN 336.A N GLY 333.A O no hydrogen 3.078 N/A TRP 337.A N TYR 354.A O no hydrogen 2.909 N/A TRP 337.A NE1 GLN 367.A OE1 no hydrogen 2.515 N/A THR 338.A N GLN 330.A O no hydrogen 2.917 N/A THR 338.A OG1 GLN 330.A O no hydrogen 3.442 N/A THR 338.A OG1 GLN 330.A OE1 no hydrogen 3.064 N/A TYR 339.A N GLY 352.A O no hydrogen 2.975 N/A TYR 339.A OH GLU 378.A OE1 no hydrogen 2.400 N/A GLN 340.A N GLU 328.A O no hydrogen 2.861 N/A GLN 340.A NE2 GLN 330.A OE1 no hydrogen 3.282 N/A ILE 341.A N LYS 350.A O no hydrogen 2.640 N/A TYR 342.A N ILE 326.A O no hydrogen 2.671 N/A GLN 343.A NE2 ASP 320.A O no hydrogen 2.639 N/A GLN 343.A NE2 LYS 323.A O no hydrogen 2.500 N/A GLN 343.A NE2 ASP 324.A O no hydrogen 3.700 N/A LYS 347.A N GLU 344.A O no hydrogen 3.044 N/A LYS 347.A NZ GLY 316.A O no hydrogen 3.439 N/A LEU 349.A N ILE 341.A O no hydrogen 3.046 N/A LYS 350.A N ILE 341.A O no hydrogen 3.273 N/A LYS 350.A NZ TYR 339.A OH no hydrogen 3.312 N/A LYS 350.A NZ GLU 378.A OE1 no hydrogen 3.435 N/A GLY 352.A N TYR 339.A O no hydrogen 3.284 N/A TYR 354.A N TRP 337.A O no hydrogen 2.662 N/A TYR 354.A OH GLU 370.A OE1 no hydrogen 2.680 N/A ARG 356.A N GLY 335.A O no hydrogen 3.250 N/A THR 362.A OG1 HIS 361.A ND1 no hydrogen 2.984 N/A LYS 366.A NZ THR 362.A OG1 no hydrogen 3.400 N/A GLN 367.A N ASN 363.A O no hydrogen 3.198 N/A GLN 367.A NE2 THR 362.A O no hydrogen 3.456 N/A LEU 368.A N ASP 364.A O no hydrogen 2.862 N/A THR 369.A N VAL 365.A O no hydrogen 2.958 N/A THR 369.A OG1 VAL 365.A O no hydrogen 3.168 N/A GLU 370.A N LYS 366.A O no hydrogen 2.984 N/A ALA 371.A N GLN 367.A O no hydrogen 2.840 N/A VAL 372.A N LEU 368.A O no hydrogen 2.759 N/A GLN 373.A N THR 369.A O no hydrogen 3.061 N/A LYS 374.A N GLU 370.A O no hydrogen 2.794 N/A ILE 375.A N ALA 371.A O no hydrogen 2.864 N/A THR 376.A N VAL 372.A O no hydrogen 3.019 N/A THR 376.A OG1 VAL 372.A O no hydrogen 2.587 N/A THR 377.A N GLN 373.A O no hydrogen 2.985 N/A THR 377.A OG1 GLN 373.A O no hydrogen 3.327 N/A GLU 378.A N LYS 374.A O no hydrogen 3.311 N/A SER 379.A N ILE 375.A O no hydrogen 2.909 N/A ILE 380.A N THR 376.A O no hydrogen 2.923 N/A VAL 381.A N THR 377.A O no hydrogen 3.059 N/A ILE 382.A N GLU 378.A O no hydrogen 2.957 N/A TRP 383.A N SER 379.A O no hydrogen 2.962 N/A GLY 384.A N ILE 380.A O no hydrogen 2.970 N/A LYS 385.A NZ GLU 89.A OE2 no hydrogen 3.250 N/A LYS 388.A N LEU 325.A O no hydrogen 2.919 N/A LYS 388.A NZ TRP 414.A O no hydrogen 3.484 N/A PHE 389.A N GLU 413.A O no hydrogen 3.066 N/A LYS 390.A N ALA 327.A O no hydrogen 2.925 N/A LYS 390.A NZ GLU 328.A OE2 no hydrogen 2.695 N/A LEU 391.A N GLU 415.A O no hydrogen 2.770 N/A ILE 393.A N LEU 391.A O no hydrogen 2.989 N/A GLN 394.A NE2 GLU 396.A OE1 no hydrogen 3.331 N/A LYS 395.A NZ GLU 399.A OE1 no hydrogen 2.896 N/A LYS 395.A NZ GLU 399.A OE2 no hydrogen 2.717 N/A GLU 396.A N GLU 396.A OE1 no hydrogen 2.646 N/A TRP 398.A N GLN 394.A O no hydrogen 3.286 N/A TRP 398.A N LYS 395.A O no hydrogen 3.157 N/A GLU 399.A N LYS 395.A O no hydrogen 2.908 N/A THR 400.A OG1 GLU 396.A O no hydrogen 2.875 N/A TRP 401.A N THR 397.A O no hydrogen 3.312 N/A TRP 402.A N TRP 398.A O no hydrogen 2.913 N/A GLU 404.A N TRP 401.A O no hydrogen 3.135 N/A GLN 407.A N GLN 373.A OE1 no hydrogen 2.728 N/A GLN 407.A NE2 LYS 65.A O no hydrogen 3.043 N/A ALA 408.A N GLN 373.A OE1 no hydrogen 3.385 N/A VAL 417.A N LEU 391.A O no hydrogen 3.008 N/A