Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 9l1s_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 4.A SG VAL 33.A O no hydrogen 3.800 N/A THR 7.A N TYR 28.A OH no hydrogen 3.275 N/A THR 7.A N ASN 37.A O no hydrogen 3.302 N/A THR 7.A OG1 TYR 28.A OH no hydrogen 3.390 N/A THR 7.A OG1 GLU 39.A OE1 no hydrogen 2.701 N/A ASP 8.A N ASN 405.A O no hydrogen 3.157 N/A MET 9.A N GLU 39.A OE1 no hydrogen 2.788 N/A MET 9.A N GLU 39.A OE2 no hydrogen 2.998 N/A SER 16.A OG THR 19.A OG1 no hydrogen 2.521 N/A THR 19.A OG1 SER 16.A OG no hydrogen 2.521 N/A HIS 20.A NE2 THR 41.A O no hydrogen 2.903 N/A MET 23.A N HIS 20.A O no hydrogen 2.899 N/A LEU 24.A N HIS 20.A O no hydrogen 3.113 N/A ARG 25.A N LEU 21.A O no hydrogen 3.355 N/A ARG 25.A NH2 ASP 22.A OD1 no hydrogen 2.390 N/A ARG 25.A NH2 HIS 26.A NE2 no hydrogen 2.967 N/A LEU 27.A N LEU 24.A O no hydrogen 3.351 N/A TYR 28.A N LEU 24.A O no hydrogen 3.168 N/A TYR 28.A OH THR 7.A OG1 no hydrogen 3.390 N/A CYS 31.A SG GLN 2.A O no hydrogen 3.309 N/A CYS 31.A SG VAL 33.A O no hydrogen 3.175 N/A GLN 32.A N GLN 2.A O no hydrogen 3.426 N/A VAL 33.A N GLN 2.A O no hydrogen 3.178 N/A VAL 34.A N GLU 57.A O no hydrogen 2.678 N/A GLN 35.A N CYS 4.A O no hydrogen 3.209 N/A ASN 37.A ND2 THR 7.A O no hydrogen 3.511 N/A ASN 37.A ND2 GLN 84.A OE1 no hydrogen 3.058 N/A LEU 38.A N TYR 61.A O no hydrogen 2.930 N/A LEU 40.A N LEU 63.A O no hydrogen 2.638 N/A TYR 42.A N HIS 66.A O no hydrogen 2.981 N/A TYR 42.A OH LEU 11.A O no hydrogen 2.828 N/A ALA 47.A N PRO 44.A O no hydrogen 3.235 N/A LEU 52.A N LEU 49.A O no hydrogen 3.184 N/A GLN 56.A N GLN 32.A O no hydrogen 2.819 N/A GLU 57.A N GLN 32.A O no hydrogen 3.065 N/A VAL 58.A N ILE 79.A O no hydrogen 3.273 N/A GLN 59.A N VAL 34.A O no hydrogen 2.825 N/A GLY 60.A N GLY 36.A O no hydrogen 2.719 N/A TYR 61.A N ASN 37.A OD1 no hydrogen 3.355 N/A TYR 61.A OH GLU 39.A OE2 no hydrogen 3.133 N/A VAL 62.A N ALA 91.A O no hydrogen 2.897 N/A LEU 63.A N LEU 38.A O no hydrogen 2.698 N/A ILE 64.A N ALA 93.A O no hydrogen 2.816 N/A ALA 65.A N LEU 40.A O no hydrogen 3.321 N/A HIS 66.A N LEU 95.A O no hydrogen 3.417 N/A HIS 66.A N ASP 96.A O no hydrogen 3.188 N/A ASN 67.A N ASN 97.A OD1 no hydrogen 3.193 N/A ASN 67.A ND2 LEU 40.A O no hydrogen 2.579 N/A GLN 68.A N LEU 43.A O no hydrogen 3.374 N/A LEU 74.A N VAL 72.A O no hydrogen 2.970 N/A ARG 78.A N GLN 56.A O no hydrogen 2.927 N/A VAL 80.A N GLU 114.A O no hydrogen 3.201 N/A ARG 81.A N VAL 58.A O no hydrogen 2.828 N/A GLY 82.A N GLN 59.A O no hydrogen 2.820 N/A THR 83.A N GLN 59.A O no hydrogen 3.038 N/A PHE 86.A N TYR 90.A O no hydrogen 2.829 N/A ASN 89.A N PHE 86.A O no hydrogen 3.228 N/A TYR 90.A N PHE 86.A O no hydrogen 3.095 N/A ALA 91.A N GLY 119.A O no hydrogen 2.403 N/A LEU 92.A N GLY 119.A O no hydrogen 2.966 N/A ALA 93.A N VAL 62.A O no hydrogen 2.806 N/A VAL 94.A N LEU 121.A O no hydrogen 2.669 N/A LEU 95.A N ILE 64.A O no hydrogen 3.075 N/A ASP 96.A N GLN 123.A O no hydrogen 3.226 N/A ASN 97.A N ARG 124.A O no hydrogen 3.350 N/A ASN 97.A N ASN 125.A OD1 no hydrogen 2.970 N/A GLY 103.A N GLN 68.A O no hydrogen 3.091 N/A ARG 105.A N ARG 70.A O no hydrogen 3.206 N/A ARG 105.A NH2 PRO 101.A O no hydrogen 3.401 N/A ARG 110.A NH2 GLN 108.A OE1 no hydrogen 3.026 N/A SER 111.A OG GLN 75.A O no hydrogen 3.374 N/A SER 111.A OG LEU 77.A O no hydrogen 2.646 N/A THR 113.A N ARG 78.A O no hydrogen 3.030 N/A THR 113.A OG1 SER 111.A O no hydrogen 3.027 N/A ILE 115.A N ILE 139.A O no hydrogen 2.765 N/A LEU 116.A N VAL 80.A O no hydrogen 3.364 N/A LYS 117.A N ARG 81.A O no hydrogen 3.081 N/A LYS 117.A NZ THR 83.A O no hydrogen 3.503 N/A LEU 121.A N LEU 92.A O no hydrogen 2.611 N/A ILE 122.A N LEU 150.A O no hydrogen 3.095 N/A GLN 123.A N VAL 94.A O no hydrogen 3.081 N/A ARG 124.A N ASP 152.A OD2 no hydrogen 2.991 N/A ARG 124.A NE ASP 96.A OD1 no hydrogen 2.341 N/A ARG 124.A NH2 ASP 96.A OD2 no hydrogen 3.054 N/A ASN 125.A ND2 VAL 94.A O no hydrogen 3.365 N/A TYR 130.A OH HIS 160.A O no hydrogen 2.406 N/A TYR 130.A OH PRO 161.A O no hydrogen 3.295 N/A GLN 131.A NE2 LEU 128.A O no hydrogen 2.877 N/A THR 133.A OG1 SER 169.A O no hydrogen 2.558 N/A ASP 138.A N LEU 135.A O no hydrogen 3.397 N/A PHE 140.A N LYS 137.A O no hydrogen 3.161 N/A HIS 141.A N ILE 115.A O no hydrogen 3.159 N/A ASN 144.A N HIS 141.A O no hydrogen 3.333 N/A ASN 144.A ND2 GLY 118.A O no hydrogen 3.418 N/A ASP 152.A N ILE 122.A O no hydrogen 2.834 N/A ASN 154.A N ASP 152.A OD1 no hydrogen 2.627 N/A SER 156.A N PRO 126.A O no hydrogen 2.851 N/A ARG 157.A NE GLN 127.A O no hydrogen 3.085 N/A ARG 157.A NH2 ARG 105.A O no hydrogen 3.230 N/A ARG 157.A NH2 GLN 127.A O no hydrogen 3.265 N/A CYS 162.A SG SER 169.A O no hydrogen 3.470 N/A CYS 166.A N SER 163.A O no hydrogen 3.181 N/A CYS 166.A SG SER 163.A OG no hydrogen 2.753 N/A CYS 171.A SG GLY 173.A O no hydrogen 3.266 N/A TRP 172.A N ASP 178.A O no hydrogen 2.952 N/A SER 175.A N ASP 178.A OD2 no hydrogen 2.786 N/A CYS 179.A SG SER 176.A O no hydrogen 3.656 N/A THR 183.A N ASP 138.A OD2 no hydrogen 2.709 N/A THR 183.A OG1 SER 181.A O no hydrogen 3.110 N/A ARG 184.A N ASP 138.A OD1 no hydrogen 3.059 N/A ARG 184.A N ASP 138.A OD2 no hydrogen 3.346 N/A ARG 184.A NH2 LYS 137.A O no hydrogen 3.362 N/A THR 185.A OG1 THR 185.A O no hydrogen 2.560 N/A CYS 187.A SG THR 183.A O no hydrogen 3.178 N/A CYS 187.A SG CYS 191.A O no hydrogen 3.458 N/A CYS 191.A SG ALA 188.A O no hydrogen 3.417 N/A ARG 193.A NE GLU 114.A OE1 no hydrogen 2.807 N/A ARG 193.A NH1 ASP 138.A O no hydrogen 3.341 N/A ARG 193.A NH1 ASP 138.A OD1 no hydrogen 2.934 N/A ARG 193.A NH2 GLU 114.A OE1 no hydrogen 2.406 N/A ARG 193.A NH2 ASP 138.A O no hydrogen 3.209 N/A CYS 194.A SG THR 183.A O no hydrogen 3.253 N/A CYS 194.A SG GLY 196.A O no hydrogen 3.469 N/A LYS 195.A N ASP 201.A O no hydrogen 3.251 N/A LYS 195.A NZ ASP 201.A O no hydrogen 3.560 N/A ASP 201.A N LEU 198.A O no hydrogen 2.985 N/A CYS 202.A N PRO 199.A O no hydrogen 3.199 N/A CYS 202.A SG ALA 188.A O no hydrogen 3.925 N/A CYS 202.A SG PRO 199.A O no hydrogen 3.393 N/A CYS 203.A N ARG 193.A O no hydrogen 2.865 N/A GLU 205.A N GLU 205.A OE1 no hydrogen 2.719 N/A GLN 206.A N HIS 204.A ND1 no hydrogen 3.070 N/A CYS 207.A N HIS 204.A O no hydrogen 3.061 N/A CYS 207.A SG GLY 210.A O no hydrogen 3.483 N/A ALA 208.A N ALA 221.A O no hydrogen 2.859 N/A CYS 211.A SG ASP 201.A O no hydrogen 3.901 N/A CYS 211.A SG GLY 213.A O no hydrogen 3.472 N/A THR 212.A N ASP 218.A O no hydrogen 3.404 N/A THR 212.A OG1 ASP 218.A O no hydrogen 3.151 N/A LEU 220.A N GLY 210.A O no hydrogen 2.857 N/A CYS 222.A SG PHE 225.A O no hydrogen 3.252 N/A LEU 223.A N GLN 206.A O no hydrogen 2.999 N/A HIS 227.A N ILE 230.A O no hydrogen 2.670 N/A HIS 227.A ND1 GLU 232.A OE2 no hydrogen 2.991 N/A ILE 230.A N HIS 227.A O no hydrogen 3.079 N/A CYS 231.A N HIS 216.A O no hydrogen 3.326 N/A GLU 232.A N PHE 225.A O no hydrogen 3.123 N/A CYS 235.A SG TYR 256.A O no hydrogen 3.935 N/A THR 240.A N MET 249.A O no hydrogen 2.797 N/A MET 249.A N THR 240.A O no hydrogen 3.124 N/A ASN 251.A N LEU 238.A O no hydrogen 3.455 N/A ASN 251.A ND2 ALA 237.A O no hydrogen 3.176 N/A GLU 253.A N ASN 251.A OD1 no hydrogen 3.386 N/A GLY 254.A N ASN 251.A O no hydrogen 3.036 N/A ARG 255.A N PRO 236.A O no hydrogen 3.442 N/A TYR 256.A N VAL 263.A O no hydrogen 2.556 N/A THR 257.A N GLY 276.A O no hydrogen 3.257 N/A THR 257.A OG1 GLY 276.A O no hydrogen 2.226 N/A PHE 258.A N SER 261.A O no hydrogen 3.127 N/A SER 261.A OG PHE 258.A O no hydrogen 3.291 N/A CYS 262.A N ASN 226.A O no hydrogen 2.920 N/A VAL 263.A N TYR 256.A O no hydrogen 2.844 N/A CYS 266.A SG LEU 271.A O no hydrogen 3.488 N/A TYR 268.A OH GLU 427.A OE2 no hydrogen 2.191 N/A ASN 269.A ND2 ARG 399.A O no hydrogen 3.052 N/A TYR 270.A N PRO 267.A O no hydrogen 3.376 N/A LEU 271.A N THR 279.A O no hydrogen 2.509 N/A THR 273.A N PHE 277.A O no hydrogen 3.251 N/A THR 273.A OG1 PHE 277.A O no hydrogen 2.811 N/A GLY 276.A N THR 273.A O no hydrogen 2.903 N/A PHE 277.A N THR 273.A OG1 no hydrogen 2.881 N/A CYS 278.A N THR 257.A O no hydrogen 2.912 N/A THR 279.A N LEU 271.A O no hydrogen 2.566 N/A THR 279.A OG1 LEU 271.A O no hydrogen 3.181 N/A ASN 286.A N PRO 283.A O no hydrogen 3.223 N/A VAL 289.A N ARG 297.A O no hydrogen 2.926 N/A ALA 291.A N THR 295.A O no hydrogen 3.145 N/A THR 295.A N ASP 293.A OD1 no hydrogen 2.947 N/A ARG 297.A N VAL 289.A O no hydrogen 3.194 N/A CYS 298.A N SER 272.A O no hydrogen 2.877 N/A GLU 299.A N GLN 287.A O no hydrogen 2.577 N/A CYS 301.A SG HIS 285.A O no hydrogen 3.414 N/A CYS 301.A SG LYS 303.A O no hydrogen 3.610 N/A CYS 305.A SG ASN 286.A O no hydrogen 3.211 N/A GLY 311.A N PHE 338.A O no hydrogen 2.760 N/A GLY 313.A N LEU 317.A O no hydrogen 2.652 N/A MET 314.A N GLY 311.A O no hydrogen 3.306 N/A LEU 317.A N MET 314.A O no hydrogen 2.738 N/A ARG 321.A NH2 ARG 318.A O no hydrogen 3.475 N/A VAL 323.A N ALA 342.A O no hydrogen 3.123 N/A THR 324.A N ASN 327.A OD1 no hydrogen 3.038 N/A SER 325.A OG ALA 357.A O no hydrogen 2.603 N/A ALA 326.A N THR 324.A OG1 no hydrogen 3.360 N/A GLU 330.A N ASN 327.A O no hydrogen 3.246 N/A CYS 334.A SG GLU 330.A O no hydrogen 3.743 N/A ILE 337.A N GLU 372.A O no hydrogen 3.013 N/A PHE 338.A N CYS 309.A O no hydrogen 2.892 N/A GLY 339.A N THR 374.A OG1 no hydrogen 2.922 N/A LEU 341.A N TYR 376.A O no hydrogen 3.199 N/A PHE 343.A N TYR 378.A O no hydrogen 2.681 N/A SER 347.A N LEU 344.A O no hydrogen 3.055 N/A SER 347.A OG VAL 323.A O no hydrogen 3.347 N/A SER 347.A OG LEU 344.A O no hydrogen 3.114 N/A ASP 351.A N THR 356.A OG1 no hydrogen 2.742 N/A GLN 360.A NE2 PRO 358.A O no hydrogen 2.929 N/A GLN 363.A N GLN 360.A O no hydrogen 2.997 N/A GLU 368.A N GLN 365.A O no hydrogen 3.293 N/A LEU 370.A N PHE 367.A O no hydrogen 3.382 N/A GLU 371.A N LYS 335.A O no hydrogen 3.203 N/A ILE 373.A N VAL 397.A O no hydrogen 3.209 N/A THR 374.A N ILE 337.A O no hydrogen 3.265 N/A THR 374.A OG1 ILE 337.A O no hydrogen 3.560 N/A LEU 377.A N SER 409.A O no hydrogen 2.979 N/A TYR 378.A N LEU 341.A O no hydrogen 2.992 N/A ILE 379.A N THR 411.A O no hydrogen 2.980 N/A SER 380.A N PHE 343.A O no hydrogen 2.955 N/A SER 380.A OG PHE 343.A O no hydrogen 3.120 N/A LEU 386.A N PRO 383.A O no hydrogen 3.441 N/A PHE 392.A N LEU 389.A O no hydrogen 2.979 N/A LEU 395.A N PHE 392.A O no hydrogen 3.297 N/A GLN 396.A N GLU 371.A O no hydrogen 3.221 N/A ILE 398.A N GLU 427.A O no hydrogen 3.054 N/A ARG 399.A N ILE 373.A O no hydrogen 2.769 N/A ARG 399.A NE GLU 372.A OE2 no hydrogen 2.335 N/A ARG 401.A N THR 374.A O no hydrogen 2.943 N/A ARG 401.A NE ASN 269.A O no hydrogen 3.199 N/A ARG 401.A NH1 GLU 288.A OE2 no hydrogen 3.304 N/A ARG 401.A NH2 GLU 288.A OE2 no hydrogen 2.778 N/A GLY 406.A N LEU 403.A O no hydrogen 2.913 N/A ALA 407.A N HIS 404.A O no hydrogen 3.321 N/A TYR 408.A N HIS 404.A O no hydrogen 3.057 N/A SER 409.A N LEU 432.A O no hydrogen 2.949 N/A THR 411.A N LEU 377.A O no hydrogen 2.984 N/A LEU 412.A N LEU 434.A O no hydrogen 2.940 N/A GLN 413.A N ILE 379.A O no hydrogen 3.070 N/A GLN 413.A NE2 HIS 436.A NE2 no hydrogen 2.946 N/A LEU 415.A N ASN 438.A OD1 no hydrogen 2.542 N/A SER 418.A N PRO 387.A O no hydrogen 2.272 N/A SER 418.A OG PRO 387.A O no hydrogen 3.182 N/A ARG 423.A NH2 GLN 505.A OE1 no hydrogen 3.378 N/A SER 424.A OG GLN 393.A O no hydrogen 3.205 N/A ARG 426.A N GLN 396.A O no hydrogen 2.740 N/A ARG 426.A NH1 GLU 427.A OE1 no hydrogen 3.224 N/A LEU 428.A N LEU 452.A O no hydrogen 2.645 N/A GLY 429.A N ILE 398.A O no hydrogen 2.905 N/A LEU 432.A N ALA 407.A O no hydrogen 2.972 N/A ALA 433.A N ALA 459.A O no hydrogen 3.245 N/A LEU 434.A N LEU 410.A O no hydrogen 2.874 N/A ILE 435.A N LEU 461.A O no hydrogen 3.160 N/A HIS 436.A N LEU 412.A O no hydrogen 3.235 N/A HIS 436.A ND1 HIS 437.A ND1 no hydrogen 2.803 N/A HIS 437.A N THR 463.A O no hydrogen 2.999 N/A HIS 437.A ND1 HIS 436.A ND1 no hydrogen 2.803 N/A ASN 438.A N ASN 465.A OD1 no hydrogen 3.365 N/A CYS 442.A N SER 418.A O no hydrogen 3.446 N/A THR 446.A OG1 THR 446.A O no hydrogen 2.537 N/A THR 446.A OG1 GLY 485.A O no hydrogen 3.306 N/A TRP 449.A N VAL 447.A O no hydrogen 2.605 N/A TRP 449.A NE1 VAL 444.A O no hydrogen 3.209 N/A GLN 451.A N PRO 448.A O no hydrogen 3.199 N/A GLN 451.A NE2 ASP 450.A OD1 no hydrogen 3.501 N/A GLN 451.A NE2 HIS 486.A NE2 no hydrogen 3.666 N/A ARG 454.A N GLN 458.A OE1 no hydrogen 2.926 N/A ARG 454.A NH1 GLN 451.A O no hydrogen 3.521 N/A ARG 454.A NH1 PHE 453.A O no hydrogen 3.059 N/A HIS 457.A NE2 GLN 29.A O no hydrogen 2.960 N/A GLN 458.A N ASN 455.A O no hydrogen 3.324 N/A GLN 458.A NE2 LEU 428.A O no hydrogen 2.629 N/A GLN 458.A NE2 GLY 431.A O no hydrogen 3.273 N/A LEU 461.A N ALA 433.A O no hydrogen 2.909 N/A ASN 465.A ND2 ILE 435.A O no hydrogen 3.124 N/A ARG 466.A NE GLU 470.A OE2 no hydrogen 3.402 N/A CYS 471.A N PRO 467.A O no hydrogen 3.223 N/A CYS 471.A SG PRO 467.A O no hydrogen 3.370 N/A VAL 472.A N GLU 468.A O no hydrogen 3.129 N/A CYS 478.A SG THR 446.A OG1 no hydrogen 2.594 N/A CYS 482.A N HIS 479.A O no hydrogen 3.033 N/A CYS 482.A SG HIS 479.A O no hydrogen 3.546 N/A ALA 483.A N ASN 497.A O no hydrogen 2.975 N/A HIS 486.A N ALA 483.A O no hydrogen 3.416 N/A CYS 487.A N THR 446.A O no hydrogen 3.341 N/A TRP 488.A N GLN 494.A O no hydrogen 2.359 N/A CYS 495.A SG PRO 492.A O no hydrogen 3.960 N/A VAL 496.A N HIS 486.A O no hydrogen 3.192 N/A CYS 498.A SG PHE 501.A O no hydrogen 3.027 N/A SER 499.A OG GLN 500.A OE1 no hydrogen 2.405 N/A LEU 502.A N ARG 525.A O no hydrogen 2.757 N/A ARG 503.A N GLU 506.A O no hydrogen 3.245 N/A CYS 507.A N PRO 492.A O no hydrogen 2.642 N/A CYS 507.A SG LEU 481.A O no hydrogen 3.298 N/A VAL 508.A N PHE 501.A O no hydrogen 3.078 N/A GLN 515.A NE2 GLU 510.A OE2 no hydrogen 3.550 N/A ARG 519.A NH1 VAL 513.A O no hydrogen 2.811 N/A HIS 526.A ND1 ARG 525.A O no hydrogen 2.615 N/A CYS 527.A N LEU 502.A O no hydrogen 2.423 N/A CYS 530.A N ARG 519.A O no hydrogen 3.144 N/A GLN 535.A NE2 CYS 534.A O no hydrogen 2.691 N/A THR 542.A OG1 GLN 537.A OE1 no hydrogen 2.963 N/A PHE 544.A N GLN 550.A O no hydrogen 3.439 N/A GLU 547.A N GLN 550.A OE1 no hydrogen 3.405 N/A CYS 551.A N ALA 548.A O no hydrogen 3.217 N/A CYS 551.A SG GLU 547.A O no hydrogen 3.278 N/A