Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4hea_1.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A OG1 ASP 9.A OD1 no hydrogen 3.067 N/A SER 6.A OG ILE 4.A O no hydrogen 3.237 N/A ARG 11.A NE ASP 9.A OD2 no hydrogen 2.818 N/A ARG 11.A NH2 GLY 2.A O no hydrogen 3.232 N/A THR 15.A N GLU 264.A OE2 no hydrogen 3.216 N/A THR 15.A OG1 GLU 13.A O no hydrogen 3.474 N/A LEU 16.A N GLU 264.A OE2 no hydrogen 3.140 N/A TYR 17.A N GLU 264.A OE1 no hydrogen 2.911 N/A TYR 17.A OH LYS 101.A O no hydrogen 2.295 N/A VAL 20.A N TYR 17.A O no hydrogen 3.285 N/A GLY 21.A N ASP 108.A OD2 no hydrogen 3.228 N/A LYS 22.A N HIS 19.A O no hydrogen 3.290 N/A SER 25.A N LYS 22.A O no hydrogen 3.151 N/A SER 25.A OG HIS 19.A O no hydrogen 3.185 N/A SER 25.A OG LYS 22.A O no hydrogen 2.531 N/A SER 25.A OG ASP 108.A O no hydrogen 2.685 N/A THR 27.A N GLY 24.A O no hydrogen 3.296 N/A THR 27.A OG1 GLY 24.A O no hydrogen 2.618 N/A TYR 30.A N THR 27.A OG1 no hydrogen 3.015 N/A TYR 31.A N THR 27.A O no hydrogen 3.448 N/A TYR 31.A OH GLU 115.A OE1 no hydrogen 2.156 N/A LEU 32.A N LEU 28.A O no hydrogen 2.952 N/A ARG 33.A N ASP 29.A O no hydrogen 2.882 N/A HIS 34.A ND1 TYR 30.A O no hydrogen 3.142 N/A GLY 35.A N LEU 32.A O no hydrogen 2.606 N/A GLY 36.A N TYR 31.A O no hydrogen 2.811 N/A TYR 37.A N GLU 115.A OE1 no hydrogen 2.802 N/A TYR 37.A OH HIS 111.A ND1 no hydrogen 3.144 N/A GLU 38.A N GLY 35.A O no hydrogen 3.370 N/A ALA 40.A N GLU 115.A OE2 no hydrogen 3.034 N/A ARG 42.A N GLU 38.A O no hydrogen 3.008 N/A VAL 43.A N THR 39.A O no hydrogen 2.965 N/A LEU 44.A N ALA 40.A O no hydrogen 2.939 N/A GLU 46.A N ARG 42.A O no hydrogen 3.025 N/A THR 48.A OG1 GLU 51.A OE2 no hydrogen 3.368 N/A VAL 52.A N THR 48.A O no hydrogen 3.321 N/A ILE 53.A N PRO 49.A O no hydrogen 2.893 N/A GLU 54.A N ASP 50.A O no hydrogen 2.856 N/A GLU 55.A N GLU 51.A O no hydrogen 2.916 N/A VAL 56.A N ILE 53.A O no hydrogen 3.065 N/A LYS 57.A N ILE 53.A O no hydrogen 2.872 N/A ARG 58.A N GLU 54.A O no hydrogen 2.880 N/A SER 59.A N GLU 55.A O no hydrogen 2.933 N/A SER 59.A OG VAL 56.A O no hydrogen 2.466 N/A LEU 61.A N SER 59.A OG no hydrogen 3.107 N/A ARG 62.A NE GLY 68.A O no hydrogen 2.963 N/A ARG 62.A NH1 GLN 244.A O no hydrogen 3.276 N/A GLY 63.A N PHE 69.A O no hydrogen 2.932 N/A ARG 64.A N THR 222.A OG1 no hydrogen 3.037 N/A ARG 64.A NE ARG 62.A O no hydrogen 2.998 N/A ARG 64.A NH1 GLU 221.A OE2 no hydrogen 3.543 N/A THR 71.A N LEU 61.A O no hydrogen 3.006 N/A THR 71.A OG1 LEU 61.A O no hydrogen 3.546 N/A LYS 74.A N PRO 70.A O no hydrogen 2.786 N/A LYS 74.A NZ ILE 217.A O no hydrogen 2.845 N/A TRP 75.A N THR 71.A O no hydrogen 3.089 N/A TRP 75.A NE1 ASN 218.A OD1 no hydrogen 2.895 N/A SER 76.A N GLY 72.A O no hydrogen 2.892 N/A SER 76.A OG LEU 73.A O no hydrogen 2.413 N/A PHE 77.A N LYS 74.A O no hydrogen 3.128 N/A MET 78.A N TRP 75.A O no hydrogen 3.031 N/A LYS 84.A N ASP 82.A OD1 no hydrogen 3.360 N/A HIS 86.A ND1 ILE 124.A O no hydrogen 2.801 N/A HIS 86.A NE2 ASP 82.A OD1 no hydrogen 2.802 N/A LEU 88.A N VAL 128.A O no hydrogen 3.284 N/A CYS 90.A N TYR 130.A O no hydrogen 3.224 N/A ALA 92.A N TYR 132.A O no hydrogen 3.066 N/A ASP 93.A N ASN 91.A OD1 no hydrogen 3.454 N/A SER 95.A OG ASP 93.A OD1 no hydrogen 3.303 N/A SER 95.A OG ASP 93.A OD2 no hydrogen 3.236 N/A SER 99.A N GLU 96.A O no hydrogen 3.196 N/A SER 99.A OG GLU 94.A OE2 no hydrogen 3.304 N/A LYS 101.A NZ ASP 102.A OD1 no hydrogen 2.795 N/A LYS 101.A NZ ASN 219.A OD1 no hydrogen 3.428 N/A ASP 102.A N GLU 94.A OE2 no hydrogen 3.079 N/A ARG 103.A NH1 GLU 107.A OE2 no hydrogen 3.097 N/A LEU 106.A N ASP 102.A O no hydrogen 2.990 N/A GLU 107.A N ARG 103.A O no hydrogen 2.901 N/A ASP 108.A N TYR 104.A O no hydrogen 2.928 N/A VAL 109.A N ILE 105.A O no hydrogen 3.241 N/A HIS 111.A ND1 TYR 37.A OH no hydrogen 3.144 N/A ILE 114.A N PRO 110.A O no hydrogen 2.991 N/A GLU 115.A N HIS 111.A O no hydrogen 2.944 N/A GLY 116.A N LEU 112.A O no hydrogen 2.937 N/A MET 117.A N LEU 113.A O no hydrogen 2.862 N/A ILE 118.A N ILE 114.A O no hydrogen 2.941 N/A LEU 119.A N GLU 115.A O no hydrogen 2.940 N/A ALA 120.A N GLY 116.A O no hydrogen 2.903 N/A GLY 121.A N MET 117.A O no hydrogen 2.868 N/A TYR 122.A N ILE 118.A O no hydrogen 2.943 N/A TYR 122.A OH LYS 47.A O no hydrogen 3.111 N/A ALA 123.A N LEU 119.A O no hydrogen 2.983 N/A ILE 124.A N ALA 120.A O no hydrogen 2.959 N/A ARG 125.A N TYR 122.A O no hydrogen 3.465 N/A ARG 125.A NH1 ALA 123.A O no hydrogen 2.705 N/A ARG 125.A NH2 ASP 50.A OD2 no hydrogen 3.406 N/A ALA 126.A N GLY 121.A O no hydrogen 3.057 N/A THR 127.A N GLN 85.A OE1 no hydrogen 3.353 N/A THR 127.A OG1 GLN 85.A OE1 no hydrogen 2.666 N/A GLY 129.A N ASP 169.A O no hydrogen 2.894 N/A TYR 130.A N LEU 88.A O no hydrogen 3.109 N/A ILE 131.A N HIS 171.A O no hydrogen 2.867 N/A TYR 132.A N CYS 90.A O no hydrogen 3.379 N/A TYR 132.A OH SER 190.A OG no hydrogen 2.229 N/A VAL 133.A N HIS 173.A O no hydrogen 2.977 N/A ARG 134.A N ALA 92.A O no hydrogen 3.451 N/A ARG 134.A NE GLU 136.A OE1 no hydrogen 3.460 N/A ARG 134.A NH1 GLU 94.A O no hydrogen 2.513 N/A ARG 134.A NH2 GLU 136.A OE1 no hydrogen 3.301 N/A TYR 137.A N ARG 134.A O no hydrogen 3.382 N/A TYR 137.A OH GLU 94.A OE1 no hydrogen 2.594 N/A ASP 142.A N ARG 138.A O no hydrogen 2.830 N/A ARG 143.A N ARG 139.A O no hydrogen 2.900 N/A ARG 143.A NE GLU 107.A O no hydrogen 3.100 N/A LEU 144.A N ALA 140.A O no hydrogen 2.870 N/A GLU 145.A N ALA 141.A O no hydrogen 2.881 N/A GLN 146.A N ASP 142.A O no hydrogen 2.919 N/A ALA 147.A N ARG 143.A O no hydrogen 2.892 N/A ILE 148.A N LEU 144.A O no hydrogen 2.829 N/A LYS 149.A N GLU 145.A O no hydrogen 2.875 N/A GLU 150.A N GLN 146.A O no hydrogen 2.836 N/A ALA 151.A N ALA 147.A O no hydrogen 2.830 N/A ARG 152.A N ILE 148.A O no hydrogen 2.891 N/A ALA 153.A N LYS 149.A O no hydrogen 2.841 N/A ARG 154.A N GLU 150.A O no hydrogen 3.051 N/A ARG 154.A NH1 ASP 29.A OD2 no hydrogen 2.860 N/A ARG 154.A NH2 ASP 29.A OD2 no hydrogen 3.226 N/A TYR 156.A N ALA 151.A O no hydrogen 2.998 N/A LEU 161.A N PHE 166.A O no hydrogen 3.007 N/A THR 164.A N LEU 161.A O no hydrogen 2.967 N/A SER 167.A OG LYS 159.A O no hydrogen 2.307 N/A HIS 171.A N GLY 129.A O no hydrogen 2.949 N/A HIS 173.A N ILE 131.A O no hydrogen 2.854 N/A GLY 175.A N VAL 133.A O no hydrogen 2.939 N/A TYR 179.A N GLU 350.A OE1 no hydrogen 3.165 N/A CYS 181.A N ALA 178.A O no hydrogen 3.086 N/A GLY 182.A N TYR 179.A O no hydrogen 2.820 N/A GLU 183.A N ILE 180.A O no hydrogen 2.899 N/A THR 185.A N GLU 183.A OE1 no hydrogen 2.862 N/A THR 185.A OG1 GLU 183.A OE1 no hydrogen 2.345 N/A ALA 186.A N GLU 183.A O no hydrogen 2.801 N/A LEU 187.A N GLU 183.A O no hydrogen 3.077 N/A ASN 189.A ND2 ASN 197.A O no hydrogen 2.292 N/A SER 190.A N ALA 186.A O no hydrogen 2.932 N/A SER 190.A OG TYR 132.A OH no hydrogen 2.229 N/A LEU 191.A N LEU 187.A O no hydrogen 2.902 N/A GLU 192.A N MET 188.A O no hydrogen 3.054 N/A LEU 194.A N ASN 189.A O no hydrogen 3.084 N/A ASN 197.A N ARG 195.A O no hydrogen 3.045 N/A ARG 199.A NE ASN 189.A OD1 no hydrogen 3.110 N/A ARG 199.A NH2 ASN 189.A OD1 no hydrogen 3.260 N/A ARG 199.A NH2 GLU 192.A OE1 no hydrogen 3.218 N/A LYS 201.A NZ GLU 183.A OE2 no hydrogen 3.478 N/A PHE 204.A N GLN 207.A OE1 no hydrogen 3.238 N/A GLN 207.A N PHE 204.A O no hydrogen 3.020 N/A SER 208.A N PHE 204.A O no hydrogen 2.833 N/A SER 208.A OG GLY 212.A O no hydrogen 3.300 N/A GLY 209.A N LYS 213.A O no hydrogen 2.635 N/A TRP 211.A N GLU 192.A OE1 no hydrogen 3.186 N/A GLY 212.A N GLY 209.A O no hydrogen 2.851 N/A LYS 213.A N LEU 210.A O no hydrogen 2.897 N/A THR 215.A N PRO 205.A O no hydrogen 3.329 N/A GLU 221.A N ASN 219.A OD1 no hydrogen 2.996 N/A LEU 223.A N ASN 219.A O no hydrogen 3.030 N/A ALA 224.A N VAL 220.A O no hydrogen 2.918 N/A SER 225.A N GLU 221.A O no hydrogen 2.866 N/A SER 225.A OG GLU 221.A O no hydrogen 2.637 N/A VAL 226.A N LEU 223.A O no hydrogen 2.867 N/A VAL 227.A N ALA 224.A O no hydrogen 3.228 N/A ILE 229.A N SER 225.A O no hydrogen 3.251 N/A MET 230.A N VAL 226.A O no hydrogen 2.765 N/A GLU 231.A N VAL 227.A O no hydrogen 2.585 N/A ARG 232.A N PRO 228.A O no hydrogen 2.992 N/A ALA 238.A N ALA 234.A O no hydrogen 2.704 N/A SER 245.A OG GLU 313.A OE2 no hydrogen 3.332 N/A LYS 246.A NZ THR 242.A O no hydrogen 3.338 N/A LYS 249.A N LEU 265.A O no hydrogen 2.925 N/A LYS 249.A NZ LEU 250.A O no hydrogen 3.075 N/A LYS 249.A NZ THR 324.A O no hydrogen 2.475 N/A TYR 251.A N TYR 263.A O no hydrogen 2.985 N/A GLN 252.A NE2 THR 324.A O no hydrogen 3.673 N/A ILE 253.A N GLY 261.A O no hydrogen 2.947 N/A SER 254.A N VAL 327.A O no hydrogen 3.132 N/A SER 254.A OG VAL 327.A O no hydrogen 3.280 N/A LYS 258.A N GLY 281.A O no hydrogen 2.793 N/A ARG 259.A N ALA 279.A O no hydrogen 2.345 N/A ARG 259.A NH1 GLU 277.A O no hydrogen 3.490 N/A ARG 259.A NH1 TRP 278.A O no hydrogen 2.694 N/A GLY 261.A N ILE 253.A O no hydrogen 2.921 N/A TYR 263.A N TYR 251.A O no hydrogen 2.827 N/A TYR 263.A OH ARG 259.A O no hydrogen 2.293 N/A LEU 265.A N LYS 249.A O no hydrogen 2.905 N/A MET 267.A N GLY 247.A O no hydrogen 3.453 N/A ARG 272.A N LEU 306.A O no hydrogen 3.314 N/A ARG 272.A NH2 GLU 303.A OE1 no hydrogen 2.818 N/A ARG 272.A NH2 GLU 303.A OE2 no hydrogen 3.100 N/A ARG 272.A NH2 ASP 307.A OD2 no hydrogen 3.469 N/A LEU 274.A N THR 270.A O no hydrogen 3.327 N/A ILE 275.A N PHE 271.A O no hydrogen 2.917 N/A TYR 276.A N ARG 272.A O no hydrogen 2.938 N/A TRP 278.A N GLU 273.A O no hydrogen 3.392 N/A TRP 278.A NE1 GLU 273.A OE2 no hydrogen 2.980 N/A ALA 279.A N LEU 274.A O no hydrogen 2.957 N/A GLY 281.A N ILE 275.A O no hydrogen 2.762 N/A LEU 283.A N PRO 256.A O no hydrogen 2.873 N/A GLN 287.A N ILE 330.A O no hydrogen 2.601 N/A GLN 287.A NE2 VAL 334.A O no hydrogen 2.575 N/A ALA 288.A N ILE 330.A O no hydrogen 3.040 N/A ILE 289.A N LEU 299.A O no hydrogen 2.903 N/A ILE 290.A N ILE 328.A O no hydrogen 2.898 N/A SER 294.A OG TYR 347.A OH no hydrogen 3.370 N/A SER 295.A N GLU 96.A OE2 no hydrogen 3.110 N/A SER 295.A OG GLU 96.A OE2 no hydrogen 3.457 N/A SER 295.A OG TYR 347.A OH no hydrogen 2.444 N/A THR 296.A OG1 GLY 293.A O no hydrogen 3.021 N/A LEU 299.A N ILE 289.A O no hydrogen 2.945 N/A LEU 306.A N THR 302.A O no hydrogen 2.620 N/A ASP 307.A N GLU 303.A O no hydrogen 3.012 N/A THR 308.A N VAL 305.A O no hydrogen 2.698 N/A THR 308.A OG1 GLU 304.A O no hydrogen 2.780 N/A THR 308.A OG1 VAL 305.A O no hydrogen 3.281 N/A MET 310.A N THR 269.A O no hydrogen 3.411 N/A SER 311.A OG HIS 314.A ND1 no hydrogen 2.577 N/A TYR 312.A N SER 245.A OG no hydrogen 3.385 N/A TYR 312.A OH GLY 63.A O no hydrogen 3.217 N/A GLU 313.A N SER 311.A OG no hydrogen 3.292 N/A HIS 314.A N SER 311.A OG no hydrogen 2.804 N/A HIS 314.A ND1 SER 311.A OG no hydrogen 2.577 N/A ALA 317.A N GLU 313.A O no hydrogen 2.810 N/A LYS 318.A N LEU 315.A O no hydrogen 2.904 N/A GLY 319.A N GLN 316.A O no hydrogen 3.458 N/A SER 320.A OG PRO 297.A O no hydrogen 3.302 N/A SER 320.A OG MET 321.A O no hydrogen 3.532 N/A THR 324.A OG1 GLY 292.A O no hydrogen 2.841 N/A VAL 327.A N GLN 252.A O no hydrogen 2.726 N/A ILE 328.A N ILE 290.A O no hydrogen 2.981 N/A LEU 329.A N SER 254.A O no hydrogen 3.029 N/A ILE 330.A N ALA 288.A O no hydrogen 2.818 N/A ARG 333.A NE GLU 284.A OE1 no hydrogen 3.448 N/A ARG 333.A NH1 SER 434.A O no hydrogen 2.453 N/A VAL 334.A N PRO 331.A O no hydrogen 3.066 N/A ALA 339.A N SER 335.A O no hydrogen 2.400 N/A MET 340.A N MET 336.A O no hydrogen 2.869 N/A TRP 341.A N VAL 337.A O no hydrogen 2.785 N/A ASN 342.A N ASP 338.A O no hydrogen 2.928 N/A LEU 343.A N ALA 339.A O no hydrogen 2.890 N/A THR 344.A N MET 340.A O no hydrogen 2.792 N/A THR 344.A OG1 MET 340.A O no hydrogen 2.729 N/A THR 344.A OG1 TRP 341.A O no hydrogen 3.521 N/A ARG 345.A N TRP 341.A O no hydrogen 2.926 N/A PHE 346.A N ASN 342.A O no hydrogen 2.886 N/A TYR 347.A N LEU 343.A O no hydrogen 2.939 N/A TYR 347.A OH SER 295.A OG no hydrogen 2.444 N/A ALA 348.A N THR 344.A O no hydrogen 2.894 N/A HIS 349.A N ARG 345.A O no hydrogen 2.985 N/A GLU 350.A N TYR 347.A O no hydrogen 3.364 N/A CYS 352.A SG ASN 197.A OD1 no hydrogen 3.834 N/A GLY 353.A N SER 351.A OG no hydrogen 3.340 N/A LYS 354.A NZ PRO 198.A O no hydrogen 3.434 N/A CYS 358.A SG SER 351.A OG no hydrogen 3.294 N/A ARG 359.A N CYS 355.A O no hydrogen 3.123 N/A ARG 359.A NE GLU 360.A OE2 no hydrogen 2.654 N/A ARG 359.A NH1 GLY 353.A O no hydrogen 2.341 N/A GLU 360.A N THR 356.A O no hydrogen 2.918 N/A GLY 361.A N THR 356.A O no hydrogen 3.303 N/A VAL 362.A N CYS 358.A O no hydrogen 2.945 N/A ALA 363.A N CYS 358.A O no hydrogen 3.247 N/A PHE 365.A N GLY 361.A O no hydrogen 2.865 N/A ASN 368.A N PHE 365.A O no hydrogen 2.747 N/A ASN 368.A ND2 GLY 364.A O no hydrogen 3.240 N/A LEU 369.A N PHE 365.A O no hydrogen 2.922 N/A PHE 370.A N MET 366.A O no hydrogen 2.943 N/A ALA 371.A N VAL 367.A O no hydrogen 2.853 N/A LYS 372.A N ASN 368.A O no hydrogen 2.910 N/A LYS 372.A NZ GLU 379.A OE2 no hydrogen 2.839 N/A LYS 372.A NZ ASP 382.A OD1 no hydrogen 3.216 N/A LYS 372.A NZ ASP 382.A OD2 no hydrogen 3.128 N/A ILE 373.A N LEU 369.A O no hydrogen 2.828 N/A GLY 374.A N PHE 370.A O no hydrogen 2.540 N/A THR 375.A N LYS 372.A O no hydrogen 3.257 N/A THR 375.A OG1 ALA 371.A O no hydrogen 2.258 N/A GLY 376.A N ILE 373.A O no hydrogen 3.050 N/A GLN 377.A N LYS 372.A O no hydrogen 2.636 N/A GLU 379.A N ASP 382.A OD2 no hydrogen 2.385 N/A ASP 382.A N GLU 379.A O no hydrogen 2.859 N/A VAL 383.A N GLU 379.A O no hydrogen 3.343 N/A GLU 384.A N GLU 380.A O no hydrogen 2.932 N/A ASN 385.A N LYS 381.A O no hydrogen 2.897 N/A LEU 386.A N ASP 382.A O no hydrogen 2.853 N/A GLU 387.A N VAL 383.A O no hydrogen 2.914 N/A ALA 388.A N GLU 384.A O no hydrogen 2.950 N/A LEU 389.A N ASN 385.A O no hydrogen 2.874 N/A LEU 389.A N LEU 386.A O no hydrogen 3.321 N/A LEU 392.A N LEU 389.A O no hydrogen 3.040 N/A ILE 393.A N LEU 390.A O no hydrogen 3.263 N/A GLU 394.A N LEU 390.A O no hydrogen 3.075 N/A ALA 404.A N PRO 400.A O no hydrogen 2.930 N/A ALA 405.A N LEU 401.A O no hydrogen 2.925 N/A ALA 405.A N ALA 402.A O no hydrogen 2.950 N/A VAL 406.A N ALA 402.A O no hydrogen 2.929 N/A TRP 407.A N ASP 403.A O no hydrogen 2.922 N/A TRP 407.A NE1 GLU 394.A OE2 no hydrogen 2.621 N/A LYS 410.A N VAL 406.A O no hydrogen 2.493 N/A GLY 411.A N TRP 407.A O no hydrogen 2.578 N/A SER 412.A OG VAL 409.A O no hydrogen 3.132 N/A SER 412.A OG TYR 420.A OH no hydrogen 2.477 N/A LEU 413.A N VAL 409.A O no hydrogen 2.632 N/A ARG 414.A N LYS 410.A O no hydrogen 2.856 N/A PHE 416.A N SER 412.A O no hydrogen 2.637 N/A LYS 417.A NZ GLU 387.A OE2 no hydrogen 2.564 N/A TYR 420.A OH SER 412.A OG no hydrogen 2.477 N/A LEU 421.A N LYS 417.A O no hydrogen 2.993 N/A ALA 422.A N ASP 418.A O no hydrogen 2.829 N/A LEU 423.A N GLN 419.A O no hydrogen 2.925 N/A ALA 424.A N TYR 420.A O no hydrogen 2.964 N/A ARG 425.A N LEU 421.A O no hydrogen 2.921 N/A ARG 425.A NE GLU 380.A OE1 no hydrogen 2.995 N/A GLU 426.A N ALA 422.A O no hydrogen 3.426 N/A LYS 427.A N ALA 424.A O no hydrogen 3.119 N/A LYS 427.A NZ GLY 378.A O no hydrogen 2.709 N/A LYS 427.A NZ ALA 424.A O no hydrogen 2.930 N/A ARG 428.A N LEU 423.A O no hydrogen 3.331 N/A VAL 430.A N GLY 374.A O no hydrogen 2.732 N/A SER 434.A OG TRP 436.A O no hydrogen 3.365 N/A