Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ksw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 15.A NE2 ILE 41.A O no hydrogen 2.677 N/A PHE 19.A N HIS 15.A O no hydrogen 3.246 N/A GLY 20.A N ILE 16.A O no hydrogen 3.202 N/A LYS 21.A N VAL 17.A O no hydrogen 3.027 N/A GLU 25.A N ASN 22.A OD1 no hydrogen 3.055 N/A MET 27.A N PRO 23.A O no hydrogen 2.939 N/A GLN 28.A N LEU 24.A O no hydrogen 3.206 N/A ARG 29.A N GLU 25.A O no hydrogen 2.761 N/A CYS 30.A N PHE 26.A O no hydrogen 3.354 N/A CYS 30.A SG PHE 26.A O no hydrogen 3.156 N/A LYS 31.A N MET 27.A O no hydrogen 3.303 N/A ARG 32.A N GLN 28.A O no hydrogen 3.162 N/A ARG 32.A N ARG 29.A O no hydrogen 3.250 N/A ASP 33.A N ARG 29.A O no hydrogen 3.236 N/A ASP 33.A N CYS 30.A O no hydrogen 3.152 N/A LEU 34.A N CYS 30.A O no hydrogen 3.011 N/A SER 36.A OG VAL 38.A O no hydrogen 3.396 N/A VAL 38.A N SER 36.A OG no hydrogen 3.374 N/A PHE 39.A N ILE 50.A O no hydrogen 3.466 N/A THR 40.A N PRO 4.A O no hydrogen 3.143 N/A THR 40.A OG1 THR 49.A OG1 no hydrogen 2.444 N/A ILE 41.A N VAL 48.A O no hydrogen 2.582 N/A SER 42.A OG ILE 41.A O no hydrogen 2.407 N/A GLN 46.A N ILE 43.A O no hydrogen 2.793 N/A THR 49.A N ILE 346.A O no hydrogen 2.608 N/A THR 49.A OG1 THR 40.A OG1 no hydrogen 2.444 N/A ILE 50.A N PHE 39.A O no hydrogen 2.785 N/A VAL 51.A N ALA 348.A O no hydrogen 2.864 N/A GLY 52.A N GLY 37.A O no hydrogen 2.812 N/A HIS 55.A N ASP 53.A OD1 no hydrogen 2.903 N/A GLU 56.A N ASP 53.A O no hydrogen 2.725 N/A HIS 57.A N PRO 54.A O no hydrogen 3.484 N/A HIS 57.A NE2 SER 354.A OG no hydrogen 3.039 N/A ARG 59.A N GLU 56.A O no hydrogen 3.009 N/A PHE 60.A N HIS 57.A O no hydrogen 3.234 N/A PHE 61.A N HIS 57.A O no hydrogen 3.356 N/A SER 62.A N SER 58.A O no hydrogen 3.350 N/A SER 62.A OG SER 58.A O no hydrogen 2.517 N/A LEU 68.A N ARG 64.A O no hydrogen 3.029 N/A ARG 71.A NH1 ALA 89.A O no hydrogen 2.526 N/A THR 75.A OG1 THR 75.A O no hydrogen 2.430 N/A THR 78.A OG1 THR 75.A O no hydrogen 3.170 N/A VAL 80.A N ILE 76.A O no hydrogen 3.225 N/A PHE 81.A N MET 77.A O no hydrogen 2.864 N/A MET 94.A N PRO 90.A O no hydrogen 2.714 N/A ARG 95.A N TYR 91.A O no hydrogen 2.761 N/A LEU 98.A N MET 94.A O no hydrogen 3.321 N/A ASN 99.A N GLU 96.A O no hydrogen 3.206 N/A LEU 101.A N GLN 97.A O no hydrogen 3.458 N/A ALA 102.A N LEU 98.A O no hydrogen 3.035 N/A GLU 103.A N ASN 99.A O no hydrogen 3.128 N/A GLU 104.A N LEU 101.A O no hydrogen 3.161 N/A THR 106.A OG1 ALA 102.A O no hydrogen 3.420 N/A THR 106.A OG1 GLU 103.A O no hydrogen 3.397 N/A LYS 109.A N THR 106.A O no hydrogen 3.066 N/A PHE 110.A N ILE 107.A O no hydrogen 3.232 N/A PHE 113.A N PHE 110.A O no hydrogen 3.213 N/A ALA 116.A N PHE 113.A O no hydrogen 3.196 N/A ILE 117.A N PHE 113.A O no hydrogen 3.185 N/A ILE 117.A N VAL 114.A O no hydrogen 2.819 N/A GLN 118.A N VAL 114.A O no hydrogen 3.338 N/A GLN 118.A NE2 ALA 295.A O no hydrogen 3.410 N/A HIS 119.A N PRO 115.A O no hydrogen 3.475 N/A GLU 120.A N ALA 116.A O no hydrogen 3.474 N/A VAL 121.A N ILE 117.A O no hydrogen 3.242 N/A ARG 122.A N GLN 118.A O no hydrogen 3.015 N/A ARG 122.A NH1 ALA 295.A O no hydrogen 3.192 N/A ARG 122.A NH1 GLN 296.A OE1 no hydrogen 3.356 N/A ARG 122.A NH2 ALA 295.A O no hydrogen 3.039 N/A LYS 123.A N HIS 119.A O no hydrogen 2.842 N/A PHE 124.A N GLU 120.A O no hydrogen 3.104 N/A MET 125.A N VAL 121.A O no hydrogen 3.027 N/A ALA 126.A N ARG 122.A O no hydrogen 3.072 N/A GLU 127.A N PHE 124.A O no hydrogen 3.248 N/A ASN 128.A N PHE 124.A O no hydrogen 2.942 N/A TRP 129.A N MET 125.A O no hydrogen 3.329 N/A ILE 136.A N VAL 438.A O no hydrogen 3.155 N/A GLU 140.A N ASN 137.A O no hydrogen 3.196 N/A ASP 141.A N ASN 137.A O no hydrogen 3.136 N/A ASP 141.A N LEU 138.A O no hydrogen 2.864 N/A CYS 142.A N LEU 138.A O no hydrogen 2.925 N/A CYS 142.A SG LEU 138.A O no hydrogen 3.255 N/A ILE 146.A N CYS 142.A O no hydrogen 3.271 N/A ASN 148.A N ALA 144.A O no hydrogen 3.208 N/A ALA 150.A N ILE 146.A O no hydrogen 3.450 N/A CYS 151.A SG ILE 147.A O no hydrogen 3.493 N/A CYS 153.A N THR 149.A O no hydrogen 3.309 N/A CYS 153.A SG PHE 113.A O no hydrogen 3.975 N/A CYS 153.A SG THR 149.A O no hydrogen 3.719 N/A LEU 154.A N ALA 150.A O no hydrogen 2.876 N/A PHE 155.A N CYS 151.A O no hydrogen 3.152 N/A LEU 159.A N GLY 156.A O no hydrogen 2.871 N/A ARG 160.A N GLY 156.A O no hydrogen 3.136 N/A HIS 167.A N ASN 164.A OD1 no hydrogen 2.324 N/A ALA 169.A N ALA 165.A O no hydrogen 3.279 N/A LEU 171.A N HIS 167.A O no hydrogen 3.305 N/A LEU 172.A N PHE 168.A O no hydrogen 3.218 N/A SER 173.A N ALA 169.A O no hydrogen 3.307 N/A SER 173.A N GLN 170.A O no hydrogen 3.020 N/A GLU 176.A N LEU 172.A O no hydrogen 3.294 N/A SER 177.A N SER 173.A O no hydrogen 3.249 N/A SER 177.A OG GLU 176.A OE2 no hydrogen 2.298 N/A SER 178.A N MET 175.A O no hydrogen 3.100 N/A LEU 179.A N GLU 176.A O no hydrogen 2.498 N/A ALA 194.A N LEU 190.A O no hydrogen 2.742 N/A ALA 194.A N PRO 191.A O no hydrogen 2.872 N/A ARG 195.A N PRO 191.A O no hydrogen 3.288 N/A CYS 196.A N GLN 192.A O no hydrogen 3.415 N/A ARG 197.A N SER 193.A O no hydrogen 2.824 N/A GLU 198.A N ALA 194.A O no hydrogen 3.201 N/A ALA 199.A N ARG 195.A O no hydrogen 2.914 N/A GLU 202.A N GLU 198.A O no hydrogen 3.105 N/A LEU 203.A N ALA 199.A O no hydrogen 3.111 N/A GLN 204.A N ARG 200.A O no hydrogen 2.546 N/A LYS 205.A N ALA 201.A O no hydrogen 2.866 N/A LYS 205.A NZ GLU 209.A OE2 no hydrogen 3.147 N/A ILE 206.A N GLU 202.A O no hydrogen 3.473 N/A GLY 208.A N LYS 205.A O no hydrogen 3.030 N/A ILE 211.A N GLY 208.A O no hydrogen 3.160 N/A VAL 212.A N GLY 208.A O no hydrogen 3.396 N/A ARG 214.A N ILE 211.A O no hydrogen 3.014 N/A ARG 214.A NH2 ASP 158.A OD1 no hydrogen 2.427 N/A GLU 215.A N ILE 211.A O no hydrogen 2.859 N/A GLU 218.A N ARG 214.A O no hydrogen 2.317 N/A ALA 219.A N GLU 215.A O no hydrogen 2.300 N/A SER 220.A OG LYS 216.A O no hydrogen 3.497 N/A LYS 221.A NZ LYS 221.A O no hydrogen 3.311 N/A SER 226.A N THR 225.A OG1 no hydrogen 2.353 N/A SER 226.A OG ASN 224.A O no hydrogen 2.892 N/A LEU 229.A N ASP 227.A OD1 no hydrogen 2.400 N/A GLY 231.A N ASP 227.A O no hydrogen 2.807 N/A LEU 232.A N LEU 228.A O no hydrogen 2.727 N/A LEU 233.A N LEU 229.A O no hydrogen 2.773 N/A LEU 233.A N GLY 230.A O no hydrogen 2.711 N/A LYS 234.A N GLY 230.A O no hydrogen 3.281 N/A TYR 237.A N THR 241.A O no hydrogen 2.568 N/A TYR 237.A OH GLU 247.A OE1 no hydrogen 2.233 N/A THR 241.A OG1 ASP 239.A OD1 no hydrogen 2.917 N/A ARG 242.A NH1 LYS 234.A O no hydrogen 3.228 N/A VAL 248.A N SER 244.A O no hydrogen 3.197 N/A CYS 249.A N LEU 245.A O no hydrogen 2.923 N/A GLY 250.A N HIS 246.A O no hydrogen 3.144 N/A MET 251.A N GLU 247.A O no hydrogen 2.902 N/A ILE 252.A N VAL 248.A O no hydrogen 3.081 N/A VAL 253.A N CYS 249.A O no hydrogen 3.290 N/A ALA 254.A N GLY 250.A O no hydrogen 3.026 N/A ALA 255.A N MET 251.A O no hydrogen 3.073 N/A MET 256.A N ILE 252.A O no hydrogen 3.177 N/A PHE 257.A N VAL 253.A O no hydrogen 2.702 N/A ALA 258.A N ALA 254.A O no hydrogen 3.120 N/A GLN 260.A NE2 PHE 257.A O no hydrogen 2.404 N/A THR 262.A OG1 ALA 258.A O no hydrogen 3.152 N/A THR 262.A OG1 GLY 259.A O no hydrogen 3.336 N/A SER 263.A N GLY 259.A O no hydrogen 3.224 N/A SER 263.A OG GLY 259.A O no hydrogen 3.108 N/A THR 264.A N GLN 260.A O no hydrogen 3.182 N/A THR 264.A OG1 GLN 260.A O no hydrogen 2.338 N/A ILE 265.A N HIS 261.A O no hydrogen 3.161 N/A THR 266.A N THR 262.A O no hydrogen 3.178 N/A THR 266.A OG1 THR 262.A O no hydrogen 2.858 N/A THR 267.A N SER 263.A O no hydrogen 2.865 N/A THR 267.A OG1 SER 263.A O no hydrogen 2.736 N/A SER 268.A N THR 264.A O no hydrogen 2.854 N/A SER 268.A OG THR 264.A O no hydrogen 2.995 N/A TRP 269.A N ILE 265.A O no hydrogen 2.978 N/A SER 270.A N THR 266.A O no hydrogen 3.395 N/A SER 270.A OG THR 266.A O no hydrogen 3.217 N/A SER 270.A OG SER 316.A OG no hydrogen 3.303 N/A MET 271.A N THR 267.A O no hydrogen 3.308 N/A MET 271.A N SER 268.A O no hydrogen 3.255 N/A LEU 272.A N SER 268.A O no hydrogen 3.352 N/A HIS 273.A N TRP 269.A O no hydrogen 3.310 N/A MET 275.A N LEU 272.A O no hydrogen 2.952 N/A ASN 279.A ND2 HIS 273.A O no hydrogen 2.504 N/A LYS 280.A N LYS 278.A O no hydrogen 2.681 N/A LEU 283.A N LYS 280.A O no hydrogen 2.802 N/A LYS 288.A N ASP 284.A O no hydrogen 2.938 N/A GLU 289.A N LEU 286.A O no hydrogen 2.929 N/A ILE 290.A N HIS 287.A O no hydrogen 3.313 N/A LEU 297.A N GLN 118.A OE1 no hydrogen 2.991 N/A ASN 298.A N ASN 301.A OD1 no hydrogen 3.452 N/A MET 303.A N TYR 299.A O no hydrogen 3.244 N/A ASP 304.A N ASP 300.A O no hydrogen 3.029 N/A PHE 308.A N GLU 289.A OE2 no hydrogen 3.233 N/A GLU 310.A N PRO 307.A O no hydrogen 3.181 N/A ARG 311.A N PHE 308.A O no hydrogen 2.478 N/A ARG 311.A NH1 PRO 369.A O no hydrogen 2.912 N/A CYS 312.A N PHE 308.A O no hydrogen 3.271 N/A CYS 312.A N ALA 309.A O no hydrogen 3.151 N/A CYS 312.A SG PHE 308.A O no hydrogen 3.921 N/A VAL 313.A N ALA 309.A O no hydrogen 3.430 N/A SER 316.A N CYS 312.A O no hydrogen 3.321 N/A SER 316.A OG SER 270.A OG no hydrogen 3.303 N/A SER 316.A OG CYS 312.A O no hydrogen 3.072 N/A ILE 317.A N VAL 313.A O no hydrogen 3.360 N/A ARG 318.A N ARG 314.A O no hydrogen 2.936 N/A ARG 318.A NE GLU 315.A OE1 no hydrogen 3.163 N/A ARG 318.A NH1 GLU 315.A OE2 no hydrogen 2.811 N/A ARG 318.A NH1 PRO 364.A O no hydrogen 3.459 N/A ARG 318.A NH1 LEU 366.A O no hydrogen 3.347 N/A ARG 318.A NH2 HIS 355.A O no hydrogen 3.182 N/A ARG 318.A NH2 PRO 364.A O no hydrogen 3.015 N/A ARG 319.A N GLU 315.A O no hydrogen 2.995 N/A ARG 319.A NE ARG 365.A O no hydrogen 3.258 N/A ASP 320.A N SER 316.A O no hydrogen 3.117 N/A VAL 326.A N CYS 349.A O no hydrogen 3.318 N/A ARG 328.A N ILE 347.A O no hydrogen 3.232 N/A MET 329.A N SER 69.A O no hydrogen 3.289 N/A VAL 330.A N ASP 345.A O no hydrogen 3.276 N/A LYS 331.A N ILE 67.A O no hydrogen 2.951 N/A VAL 334.A N VAL 341.A O no hydrogen 3.409 N/A VAL 336.A N TYR 339.A O no hydrogen 2.981 N/A TYR 339.A N VAL 336.A O no hydrogen 2.724 N/A VAL 340.A N LYS 1.A O no hydrogen 2.494 N/A VAL 341.A N VAL 334.A O no hydrogen 3.166 N/A GLY 344.A N VAL 330.A O no hydrogen 3.050 N/A ILE 347.A N ARG 328.A O no hydrogen 3.301 N/A ALA 348.A N THR 49.A O no hydrogen 2.815 N/A CYS 349.A N VAL 326.A O no hydrogen 3.191 N/A CYS 349.A SG VAL 51.A O no hydrogen 3.469 N/A LEU 353.A N SER 350.A OG no hydrogen 2.972 N/A SER 354.A N SER 350.A O no hydrogen 3.124 N/A SER 354.A OG HIS 57.A NE2 no hydrogen 3.039 N/A SER 354.A OG SER 350.A O no hydrogen 3.373 N/A HIS 355.A N PRO 351.A O no hydrogen 3.077 N/A HIS 356.A N LEU 353.A O no hydrogen 3.093 N/A ASP 357.A N SER 354.A O no hydrogen 3.227 N/A GLU 359.A N ASP 357.A OD1 no hydrogen 2.441 N/A PHE 361.A N ASP 357.A O no hydrogen 3.214 N/A ARG 365.A N ASN 363.A OD1 no hydrogen 3.254 N/A ARG 365.A NH2 ASP 320.A OD2 no hydrogen 3.127 N/A LEU 366.A N ASN 363.A O no hydrogen 3.291 N/A ASP 368.A N GLU 315.A OE2 no hydrogen 3.363 N/A GLU 370.A N ASP 368.A OD1 no hydrogen 2.561 N/A ARG 371.A NE GLU 315.A OE2 no hydrogen 3.130 N/A LYS 374.A N ALA 360.A O no hydrogen 3.301 N/A GLY 377.A N GLU 373.A OE2 no hydrogen 3.176 N/A GLY 383.A N ILE 380.A O no hydrogen 3.249 N/A VAL 386.A N PHE 61.A O no hydrogen 3.476 N/A LYS 388.A NZ GLY 385.A O no hydrogen 3.281 N/A CYS 389.A N PHE 382.A O no hydrogen 3.377 N/A ALA 395.A N GLY 391.A O no hydrogen 2.802 N/A LEU 396.A N GLN 392.A O no hydrogen 3.201 N/A LEU 397.A N LYS 393.A O no hydrogen 3.331 N/A GLN 398.A N PHE 394.A O no hydrogen 3.183 N/A VAL 399.A N ALA 395.A O no hydrogen 2.954 N/A LYS 400.A N LEU 396.A O no hydrogen 2.867 N/A LYS 400.A NZ VAL 302.A O no hydrogen 2.923 N/A LYS 400.A NZ GLU 310.A OE2 no hydrogen 3.233 N/A THR 401.A N LEU 397.A O no hydrogen 3.285 N/A THR 401.A OG1 LEU 397.A O no hydrogen 3.069 N/A ILE 402.A N GLN 398.A O no hydrogen 3.296 N/A LEU 403.A N VAL 399.A O no hydrogen 3.370 N/A ALA 404.A N LYS 400.A O no hydrogen 3.194 N/A THR 405.A N THR 401.A O no hydrogen 3.171 N/A THR 405.A OG1 THR 401.A O no hydrogen 2.994 N/A ALA 406.A N ILE 402.A O no hydrogen 3.177 N/A ALA 406.A N LEU 403.A O no hydrogen 3.172 N/A PHE 407.A N LEU 403.A O no hydrogen 3.321 N/A GLU 409.A N ALA 406.A O no hydrogen 3.168 N/A TYR 410.A N ALA 406.A O no hydrogen 3.083 N/A GLN 413.A N LYS 439.A O no hydrogen 3.034 N/A ASP 421.A N GLN 435.A OE1 no hydrogen 2.766 N/A ASP 423.A N GLY 430.A O no hydrogen 3.229 N/A THR 426.A OG1 VAL 428.A O no hydrogen 3.420 N/A VAL 429.A N PRO 322.A O no hydrogen 2.986 N/A THR 432.A N ASP 421.A O no hydrogen 2.961 N/A CYS 436.A N LEU 433.A O no hydrogen 3.189 N/A CYS 436.A SG THR 432.A O no hydrogen 3.396 N/A VAL 438.A N ILE 136.A O no hydrogen 3.168 N/A LYS 439.A N GLN 413.A O no hydrogen 3.178 N/A TYR 440.A N GLY 134.A O no hydrogen 3.148 N/A THR 441.A N ASP 411.A O no hydrogen 2.901 N/A THR 441.A OG1 ASP 411.A O no hydrogen 3.320 N/A LYS 443.A N GLU 409.A O no hydrogen 3.341 N/A LYS 443.A NZ PHE 407.A O no hydrogen 3.022 N/A LYS 443.A NZ ASP 411.A OD1 no hydrogen 3.253 N/A