Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 9ci1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A OH SER 41.A OG no hydrogen 3.311 N/A TYR 3.A OH THR 42.A OG1 no hydrogen 2.732 N/A THR 5.A N CYS 59.A O no hydrogen 2.781 N/A THR 5.A OG1 THR 2.A O no hydrogen 2.687 N/A THR 5.A OG1 CYS 59.A O no hydrogen 3.438 N/A TYR 8.A N THR 5.A O no hydrogen 2.988 N/A THR 10.A OG1 GLU 9.A OE2 no hydrogen 3.049 N/A ILE 15.A N TYR 78.A O no hydrogen 3.259 N/A ALA 17.A N VAL 76.A O no hydrogen 3.104 N/A ARG 20.A N ARG 109.A O no hydrogen 3.089 N/A ARG 20.A NE GLU 111.A OE2 no hydrogen 3.304 N/A ARG 20.A NH1 GLN 71.A OE1 no hydrogen 3.052 N/A ARG 20.A NH2 GLU 111.A OE2 no hydrogen 3.342 N/A MET 21.A N TYR 72.A O no hydrogen 3.246 N/A THR 22.A N ALA 107.A O no hydrogen 3.256 N/A THR 22.A OG1 ALA 107.A O no hydrogen 3.562 N/A GLN 24.A NE2 LYS 103.A O no hydrogen 2.898 N/A VAL 27.A N GLN 24.A O no hydrogen 3.310 N/A ALA 32.A N PRO 28.A O no hydrogen 3.187 N/A GLY 33.A N PRO 29.A O no hydrogen 2.952 N/A ALA 34.A N GLU 30.A O no hydrogen 3.444 N/A ALA 35.A N GLU 31.A O no hydrogen 3.244 N/A ALA 35.A N ALA 32.A O no hydrogen 3.134 N/A VAL 36.A N ALA 32.A O no hydrogen 3.318 N/A VAL 36.A N GLY 33.A O no hydrogen 3.188 N/A ALA 37.A N GLY 33.A O no hydrogen 3.376 N/A ALA 38.A N ALA 35.A O no hydrogen 3.274 N/A GLU 39.A N ALA 35.A O no hydrogen 3.031 N/A SER 40.A N VAL 36.A O no hydrogen 3.162 N/A SER 40.A OG TYR 78.A OH no hydrogen 2.823 N/A SER 40.A OG ILE 95.A O no hydrogen 2.743 N/A SER 41.A N ALA 38.A O no hydrogen 2.989 N/A SER 41.A OG TYR 3.A OH no hydrogen 3.311 N/A SER 41.A OG ALA 37.A O no hydrogen 2.566 N/A SER 41.A OG ALA 38.A O no hydrogen 3.362 N/A THR 42.A OG1 TYR 3.A OH no hydrogen 2.732 N/A THR 42.A OG1 THR 44.A O no hydrogen 3.448 N/A THR 44.A N THR 42.A OG1 no hydrogen 3.285 N/A THR 44.A OG1 THR 46.A O no hydrogen 3.558 N/A THR 46.A N THR 44.A OG1 no hydrogen 3.033 N/A VAL 48.A N THR 46.A OG1 no hydrogen 3.293 N/A TYR 55.A N LEU 52.A O no hydrogen 2.939 N/A LYS 56.A NZ THR 2.A OG1 no hydrogen 2.974 N/A LYS 56.A NZ GLY 57.A O no hydrogen 2.924 N/A ARG 58.A N ALA 77.A O no hydrogen 3.385 N/A ARG 58.A NH1 ASP 14.A OD2 no hydrogen 3.479 N/A ARG 58.A NH2 LYS 56.A O no hydrogen 2.827 N/A CYS 59.A N TYR 3.A O no hydrogen 2.551 N/A CYS 59.A SG ASP 61.A O no hydrogen 3.643 N/A CYS 59.A SG TYR 75.A O no hydrogen 3.507 N/A TYR 60.A N TYR 75.A O no hydrogen 3.252 N/A GLU 63.A N ILE 73.A O no hydrogen 3.036 N/A VAL 65.A N GLN 71.A O no hydrogen 3.293 N/A GLU 69.A N GLU 69.A OE1 no hydrogen 2.503 N/A ASN 70.A ND2 PRO 23.A O no hydrogen 3.667 N/A GLN 71.A NE2 ASN 70.A O no hydrogen 2.328 N/A ILE 73.A N GLU 63.A O no hydrogen 2.952 N/A ALA 74.A N PHE 19.A O no hydrogen 3.161 N/A TYR 75.A N ASP 61.A O no hydrogen 3.195 N/A TYR 75.A OH GLU 63.A OE1 no hydrogen 2.884 N/A VAL 76.A N ALA 17.A O no hydrogen 3.306 N/A ALA 77.A N ARG 58.A O no hydrogen 3.215 N/A TYR 78.A N ILE 15.A O no hydrogen 2.921 N/A TYR 78.A OH SER 40.A OG no hydrogen 2.823 N/A GLU 85.A N GLU 85.A OE1 no hydrogen 3.076 N/A PHE 92.A N VAL 88.A O no hydrogen 3.462 N/A THR 93.A N THR 89.A O no hydrogen 2.925 N/A THR 93.A OG1 THR 89.A O no hydrogen 2.814 N/A SER 94.A N ASN 90.A O no hydrogen 2.889 N/A SER 94.A OG ASN 90.A O no hydrogen 2.717 N/A ILE 95.A N MET 91.A O no hydrogen 2.926 N/A VAL 96.A N PHE 92.A O no hydrogen 3.343 N/A ARG 106.A N THR 22.A O no hydrogen 2.979 N/A GLU 111.A N ALA 18.A O no hydrogen 3.055 N/A LEU 113.A N ASP 112.A OD1 no hydrogen 2.782 N/A ARG 114.A N LEU 16.A O no hydrogen 3.183 N/A TYR 119.A N PRO 116.A O no hydrogen 3.052 N/A TYR 119.A OH GLU 84.A O no hydrogen 3.274 N/A SER 120.A N PRO 116.A O no hydrogen 3.318 N/A THR 122.A OG1 TYR 119.A O no hydrogen 3.493 N/A GLN 124.A NE2 GLY 125.A O no hydrogen 3.080 N/A ARG 134.A N ILE 130.A O no hydrogen 3.324 N/A ARG 134.A NH1 LYS 139.A O no hydrogen 2.908 N/A ARG 134.A NH2 ASP 371.A OD1 no hydrogen 3.128 N/A ASP 135.A N GLN 131.A O no hydrogen 3.383 N/A LYS 136.A N VAL 132.A O no hydrogen 3.127 N/A LEU 137.A N GLU 133.A O no hydrogen 2.925 N/A ASN 138.A N ARG 134.A O no hydrogen 2.830 N/A LYS 139.A NZ ILE 209.A O no hydrogen 3.250 N/A TYR 140.A OH ASP 135.A OD1 no hydrogen 3.050 N/A ARG 142.A NH1 PRO 143.A O no hydrogen 2.771 N/A ARG 142.A NH1 ASP 173.A OD2 no hydrogen 3.021 N/A ARG 142.A NH2 ASP 173.A OD2 no hydrogen 2.968 N/A LEU 144.A N SER 372.A O no hydrogen 3.350 N/A GLY 146.A N LEU 374.A O no hydrogen 3.086 N/A CYS 147.A SG THR 148.A O no hydrogen 3.619 N/A LYS 150.A NZ ASP 177.A OD1 no hydrogen 2.737 N/A LYS 150.A NZ ASP 177.A OD2 no hydrogen 3.341 N/A LYS 150.A NZ GLU 178.A OE2 no hydrogen 2.821 N/A ASN 159.A N SER 156.A OG no hydrogen 3.386 N/A TYR 160.A N SER 156.A O no hydrogen 2.894 N/A TYR 160.A OH ASP 176.A OD1 no hydrogen 2.943 N/A GLY 161.A N ALA 157.A O no hydrogen 2.909 N/A ARG 162.A N LYS 158.A O no hydrogen 2.937 N/A ALA 163.A N ASN 159.A O no hydrogen 3.321 N/A VAL 164.A N TYR 160.A O no hydrogen 3.429 N/A TYR 165.A N GLY 161.A O no hydrogen 2.936 N/A GLU 166.A N ARG 162.A O no hydrogen 2.921 N/A CYS 167.A N ALA 163.A O no hydrogen 2.911 N/A CYS 167.A SG ALA 163.A O no hydrogen 3.524 N/A LEU 168.A N VAL 164.A O no hydrogen 2.920 N/A ARG 169.A N TYR 165.A O no hydrogen 3.363 N/A ARG 169.A NE GLU 205.A OE1 no hydrogen 2.495 N/A GLY 170.A N CYS 167.A O no hydrogen 3.330 N/A PHE 174.A N LEU 145.A O no hydrogen 3.270 N/A THR 175.A OG1 GLY 211.A O no hydrogen 3.013 N/A THR 175.A OG1 HIS 212.A ND1 no hydrogen 3.037 N/A GLU 178.A N GLU 178.A OE1 no hydrogen 2.829 N/A GLN 183.A N MET 186.A O no hydrogen 3.195 N/A GLN 183.A NE2 ASN 179.A O no hydrogen 3.582 N/A MET 186.A N GLN 183.A O no hydrogen 3.023 N/A ARG 187.A NH1 SER 182.A OG no hydrogen 3.353 N/A ARG 191.A N ASP 190.A OD1 no hydrogen 2.824 N/A PHE 192.A N TRP 188.A O no hydrogen 2.932 N/A PHE 194.A N ASP 190.A O no hydrogen 2.937 N/A VAL 195.A N ARG 191.A O no hydrogen 2.938 N/A ALA 196.A N PHE 192.A O no hydrogen 2.933 N/A GLU 197.A N LEU 193.A O no hydrogen 2.903 N/A ALA 198.A N PHE 194.A O no hydrogen 2.943 N/A ILE 199.A N VAL 195.A O no hydrogen 2.947 N/A PHE 200.A N ALA 196.A O no hydrogen 3.449 N/A LYS 201.A N GLU 197.A O no hydrogen 3.518 N/A LYS 201.A NZ GLU 197.A OE2 no hydrogen 3.520 N/A SER 202.A N ALA 198.A O no hydrogen 2.957 N/A SER 202.A OG ILE 199.A O no hydrogen 2.797 N/A GLN 203.A N ILE 199.A O no hydrogen 2.893 N/A ALA 204.A N PHE 200.A O no hydrogen 2.924 N/A GLY 207.A N GLN 203.A O no hydrogen 3.333 N/A LYS 210.A NZ LEU 172.A O no hydrogen 3.111 N/A HIS 212.A ND1 THR 175.A OG1 no hydrogen 3.037 N/A HIS 212.A NE2 ASP 176.A OD1 no hydrogen 2.743 N/A HIS 212.A NE2 ASP 176.A OD2 no hydrogen 3.013 N/A TYR 213.A N THR 175.A O no hydrogen 2.997 N/A ASN 215.A ND2 GLU 178.A O no hydrogen 3.636 N/A ASN 215.A ND2 VAL 180.A O no hydrogen 3.196 N/A ALA 216.A N MET 240.A O no hydrogen 3.094 N/A THR 217.A OG1 ASN 215.A OD1 no hydrogen 3.051 N/A THR 217.A OG1 ASP 242.A OD2 no hydrogen 3.510 N/A MET 224.A N THR 220.A O no hydrogen 2.986 N/A MET 225.A N CYS 221.A O no hydrogen 3.227 N/A LYS 226.A N GLU 223.A O no hydrogen 3.269 N/A ARG 232.A N ALA 228.A O no hydrogen 3.324 N/A ARG 232.A NE ASN 261.A OD1 no hydrogen 3.251 N/A GLU 233.A N GLN 229.A O no hydrogen 2.917 N/A LEU 234.A N PHE 230.A O no hydrogen 3.252 N/A GLY 235.A N ARG 232.A O no hydrogen 3.206 N/A MET 236.A N ALA 231.A O no hydrogen 2.988 N/A VAL 239.A N LEU 264.A O no hydrogen 3.001 N/A HIS 241.A N HIS 266.A O no hydrogen 3.058 N/A ASN 251.A ND2 HIS 241.A ND1 no hydrogen 3.178 N/A THR 252.A N PHE 248.A O no hydrogen 2.938 N/A THR 252.A OG1 PHE 248.A O no hydrogen 2.713 N/A THR 253.A OG1 THR 249.A O no hydrogen 3.195 N/A LEU 254.A N ALA 250.A O no hydrogen 3.339 N/A ALA 255.A N ASN 251.A O no hydrogen 2.939 N/A HIS 256.A N THR 252.A O no hydrogen 2.921 N/A TYR 257.A N THR 253.A O no hydrogen 2.922 N/A CYS 258.A N LEU 254.A O no hydrogen 2.889 N/A CYS 258.A SG LEU 254.A O no hydrogen 3.329 N/A ARG 259.A N ALA 255.A O no hydrogen 2.956 N/A ARG 259.A NE PRO 127.A O no hydrogen 2.950 N/A ASP 260.A N TYR 257.A O no hydrogen 3.255 N/A ASN 261.A N CYS 258.A O no hydrogen 3.498 N/A ASN 261.A ND2 TYR 257.A O no hydrogen 3.390 N/A GLY 262.A N CYS 258.A O no hydrogen 3.257 N/A LEU 263.A N CYS 258.A O no hydrogen 3.367 N/A LEU 264.A N PRO 237.A O no hydrogen 3.172 N/A LEU 265.A N ASP 298.A OD2 no hydrogen 3.237 N/A HIS 266.A N VAL 239.A O no hydrogen 3.098 N/A ILE 267.A N HIS 299.A O no hydrogen 3.263 N/A HIS 268.A N HIS 241.A O no hydrogen 3.228 N/A HIS 268.A ND1 ASP 242.A OD1 no hydrogen 3.030 N/A ILE 275.A N HIS 272.A O no hydrogen 3.020 N/A ASP 276.A N HIS 272.A O no hydrogen 3.193 N/A HIS 284.A N LEU 110.A O no hydrogen 3.323 N/A ARG 286.A N HIS 284.A ND1 no hydrogen 3.395 N/A ARG 286.A NH1 GLU 111.A O no hydrogen 3.274 N/A VAL 287.A N HIS 284.A O no hydrogen 3.327 N/A ALA 289.A N PHE 285.A O no hydrogen 2.911 N/A LYS 290.A N ARG 286.A O no hydrogen 3.330 N/A LYS 290.A NZ ASP 112.A OD1 no hydrogen 3.463 N/A LYS 290.A NZ LEU 113.A O no hydrogen 2.686 N/A LYS 290.A NZ GLN 340.A OE1 no hydrogen 2.805 N/A ALA 291.A N VAL 287.A O no hydrogen 2.941 N/A LEU 292.A N LEU 288.A O no hydrogen 3.301 N/A ARG 293.A N ALA 289.A O no hydrogen 3.479 N/A ARG 293.A NE PRO 346.A O no hydrogen 2.949 N/A ARG 293.A NH1 ASP 325.A O no hydrogen 3.506 N/A ARG 293.A NH2 MET 345.A O no hydrogen 3.018 N/A ARG 293.A NH2 PRO 346.A O no hydrogen 2.927 N/A MET 294.A N LYS 290.A O no hydrogen 3.466 N/A SER 295.A N ALA 291.A O no hydrogen 2.926 N/A SER 295.A OG ASN 251.A OD1 no hydrogen 2.976 N/A GLY 296.A N LEU 292.A O no hydrogen 2.632 N/A ILE 300.A N LEU 349.A O no hydrogen 3.324 N/A HIS 301.A ND1 ILE 267.A O no hydrogen 3.141 N/A SER 302.A N VAL 351.A O no hydrogen 3.155 N/A SER 302.A OG VAL 351.A O no hydrogen 3.261 N/A LYS 308.A N VAL 305.A O no hydrogen 2.704 N/A GLY 318.A N GLU 314.A O no hydrogen 2.897 N/A PHE 319.A N VAL 315.A O no hydrogen 2.941 N/A VAL 320.A N THR 316.A O no hydrogen 2.919 N/A ASP 321.A N LEU 317.A O no hydrogen 3.349 N/A LEU 322.A N GLY 318.A O no hydrogen 2.938 N/A LEU 323.A N PHE 319.A O no hydrogen 2.887 N/A ARG 324.A N VAL 320.A O no hydrogen 2.928 N/A ARG 324.A NH1 PHE 368.A O no hydrogen 3.398 N/A ARG 324.A NH1 ASP 371.A O no hydrogen 3.487 N/A ASP 325.A N ASP 321.A O no hydrogen 2.764 N/A ILE 328.A N GLN 340.A O no hydrogen 3.353 N/A SER 333.A OG ASP 331.A OD1 no hydrogen 3.113 N/A SER 333.A OG ASP 331.A OD2 no hydrogen 3.520 N/A ARG 334.A N ASP 331.A O no hydrogen 3.333 N/A ARG 334.A NH2 ASP 321.A OD2 no hydrogen 3.328 N/A ILE 336.A N ASP 331.A O no hydrogen 3.117 N/A TYR 337.A N ASP 112.A OD2 no hydrogen 3.362 N/A GLN 340.A N ILE 328.A O no hydrogen 3.321 N/A GLN 340.A NE2 ILE 115.A O no hydrogen 3.407 N/A TRP 342.A N ASP 326.A O no hydrogen 3.452 N/A VAL 343.A N ASP 341.A OD1 no hydrogen 3.305 N/A LEU 349.A N ASP 298.A O no hydrogen 3.059 N/A VAL 351.A N ILE 300.A O no hydrogen 2.916 N/A ALA 352.A N VAL 373.A O no hydrogen 3.149 N/A HIS 357.A N HIS 360.A ND1 no hydrogen 3.238 N/A TRP 359.A N HIS 357.A ND1 no hydrogen 3.073 N/A TRP 359.A NE1 TRP 436.A O no hydrogen 3.157 N/A HIS 360.A N HIS 357.A O no hydrogen 3.338 N/A MET 361.A N VAL 358.A O no hydrogen 3.297 N/A LEU 364.A N HIS 360.A O no hydrogen 3.211 N/A THR 365.A N MET 361.A O no hydrogen 2.912 N/A THR 365.A OG1 MET 361.A O no hydrogen 2.847 N/A GLU 366.A N PRO 362.A O no hydrogen 2.920 N/A ILE 367.A N ALA 363.A O no hydrogen 3.217 N/A PHE 368.A N LEU 364.A O no hydrogen 3.213 N/A GLY 369.A N THR 365.A O no hydrogen 3.298 N/A VAL 373.A N PRO 350.A O no hydrogen 3.310 N/A LEU 374.A N LEU 144.A O no hydrogen 3.278 N/A GLN 375.A N ALA 352.A O no hydrogen 3.297 N/A PHE 376.A N GLY 146.A O no hydrogen 3.286 N/A TRP 385.A N HIS 383.A ND1 no hydrogen 3.023 N/A ALA 391.A N ASN 387.A O no hydrogen 2.959 N/A ARG 395.A N ALA 391.A O no hydrogen 2.983 N/A ARG 395.A NE GLU 399.A OE2 no hydrogen 2.793 N/A ARG 395.A NH1 GLY 171.A O no hydrogen 2.792 N/A VAL 396.A N VAL 392.A O no hydrogen 2.818 N/A ALA 397.A N ALA 393.A O no hydrogen 2.945 N/A LEU 398.A N ASN 394.A O no hydrogen 2.971 N/A GLU 399.A N ARG 395.A O no hydrogen 3.282 N/A ALA 400.A N VAL 396.A O no hydrogen 3.339 N/A CYS 401.A N ALA 397.A O no hydrogen 3.219 N/A CYS 401.A SG ALA 397.A O no hydrogen 3.716 N/A VAL 402.A N LEU 398.A O no hydrogen 3.254 N/A VAL 402.A N GLU 399.A O no hydrogen 3.103 N/A GLN 403.A N GLU 399.A O no hydrogen 3.003 N/A ALA 404.A N ALA 400.A O no hydrogen 3.191 N/A ARG 405.A N CYS 401.A O no hydrogen 3.438 N/A ARG 405.A NH1 ASN 406.A OD1 no hydrogen 3.273 N/A ASN 406.A N VAL 402.A O no hydrogen 3.066 N/A GLU 407.A N ALA 404.A O no hydrogen 2.672 N/A GLY 408.A N ARG 405.A O no hydrogen 3.235 N/A ARG 409.A NE GLU 414.A OE2 no hydrogen 2.887 N/A ARG 409.A NH2 GLU 414.A OE2 no hydrogen 2.871 N/A ASP 410.A N GLU 414.A OE1 no hydrogen 2.746 N/A ARG 413.A N ASP 410.A OD1 no hydrogen 2.712 N/A ASN 416.A ND2 ILE 439.A O no hydrogen 3.001 N/A ILE 418.A N ASP 417.A OD1 no hydrogen 2.637 N/A ILE 419.A N GLY 415.A O no hydrogen 3.381 N/A ARG 420.A N ASN 416.A O no hydrogen 3.074 N/A ARG 420.A NH1 GLU 438.A OE1 no hydrogen 2.880 N/A ARG 420.A NH2 GLU 438.A OE2 no hydrogen 2.728 N/A GLU 421.A N ASP 417.A O no hydrogen 3.040 N/A ALA 422.A N ILE 419.A O no hydrogen 3.277 N/A SER 423.A N ILE 419.A O no hydrogen 3.235 N/A SER 423.A OG ARG 420.A O no hydrogen 2.597 N/A LYS 424.A N ARG 420.A O no hydrogen 3.420 N/A TRP 425.A N ALA 422.A O no hydrogen 3.133 N/A SER 426.A N SER 423.A O no hydrogen 2.950 N/A LEU 429.A N SER 426.A OG no hydrogen 3.195 N/A ALA 430.A N SER 426.A O no hydrogen 3.087 N/A ALA 432.A N ALA 430.A O no hydrogen 2.570 N/A CYS 433.A SG LEU 429.A O no hydrogen 3.426 N/A GLU 434.A N ALA 431.A O no hydrogen 2.945 N/A VAL 435.A N ALA 432.A O no hydrogen 3.358 N/A TRP 436.A N ALA 432.A O no hydrogen 3.058 N/A LYS 437.A NZ GLU 434.A O no hydrogen 2.900 N/A