Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3amu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 1.A N ASP 61.A OD2 no hydrogen 2.961 N/A MET 2.A N VAL 60.A O no hydrogen 2.821 N/A ARG 3.A NE GLU 59.A OE1 no hydrogen 2.727 N/A VAL 4.A N VAL 58.A O no hydrogen 3.204 N/A TRP 5.A N VAL 92.A O no hydrogen 2.746 N/A VAL 6.A N PHE 56.A O no hydrogen 2.940 N/A GLY 7.A N VAL 90.A O no hydrogen 2.921 N/A ILE 8.A N VAL 54.A O no hydrogen 2.698 N/A CYS 18.A SG THR 19.A OG1 no hydrogen 3.525 N/A THR 19.A OG1 TYR 158.A OH no hydrogen 2.597 N/A TYR 20.A N CYS 18.A O no hydrogen 2.836 N/A VAL 23.A N THR 19.A O no hydrogen 3.217 N/A VAL 23.A N TYR 20.A O no hydrogen 2.749 N/A LEU 24.A N TYR 20.A O no hydrogen 2.859 N/A ALA 25.A N LEU 21.A O no hydrogen 2.736 N/A MET 26.A N ALA 22.A O no hydrogen 3.068 N/A GLU 27.A N VAL 23.A O no hydrogen 2.704 N/A ARG 28.A N LEU 24.A O no hydrogen 3.347 N/A ARG 28.A NE GLU 32.A OE1 no hydrogen 3.169 N/A ARG 28.A NH2 GLU 72.A OE2 no hydrogen 2.646 N/A VAL 29.A N ALA 25.A O no hydrogen 3.093 N/A GLU 30.A N MET 26.A O no hydrogen 2.787 N/A ARG 31.A N GLU 27.A O no hydrogen 3.208 N/A ARG 31.A N ARG 28.A O no hydrogen 3.153 N/A LEU 33.A N VAL 29.A O no hydrogen 3.114 N/A GLY 34.A N VAL 29.A O no hydrogen 3.004 N/A VAL 36.A N GLU 30.A OE1 no hydrogen 2.851 N/A ILE 37.A N LEU 57.A O no hydrogen 2.818 N/A ARG 41.A N SER 55.A O no hydrogen 2.722 N/A ARG 41.A NH1 ALA 146.A O no hydrogen 2.562 N/A ARG 41.A NH2 ALA 146.A O no hydrogen 3.461 N/A LEU 42.A N VAL 238.A O no hydrogen 2.905 N/A ILE 43.A N ALA 53.A O no hydrogen 3.215 N/A ARG 44.A NE HIS 241.A NE2 no hydrogen 2.850 N/A ARG 44.A NH2 HIS 241.A NE2 no hydrogen 3.535 N/A LEU 45.A N ASN 51.A O no hydrogen 3.158 N/A ASN 46.A N ALA 107.A O no hydrogen 3.061 N/A ASN 46.A ND2 ASP 110.A O no hydrogen 2.936 N/A ASN 46.A ND2 TYR 259.A O no hydrogen 3.215 N/A THR 48.A N ASN 46.A OD1 no hydrogen 2.491 N/A THR 48.A OG1 ASN 46.A OD1 no hydrogen 2.902 N/A ASN 51.A ND2 ASN 46.A O no hydrogen 3.115 N/A ALA 53.A N ILE 43.A O no hydrogen 3.039 N/A VAL 54.A N ILE 8.A O no hydrogen 2.747 N/A SER 55.A N ARG 41.A O no hydrogen 2.988 N/A SER 55.A OG ALA 143.A O no hydrogen 3.059 N/A PHE 56.A N VAL 6.A O no hydrogen 2.804 N/A VAL 58.A N VAL 4.A O no hydrogen 3.025 N/A GLY 64.A N ASP 62.A OD1 no hydrogen 3.138 N/A GLU 65.A N ASP 62.A OD2 no hydrogen 3.037 N/A LEU 66.A N ASP 62.A O no hydrogen 3.172 N/A VAL 67.A N VAL 63.A O no hydrogen 3.085 N/A ASP 68.A N GLY 64.A O no hydrogen 3.410 N/A VAL 69.A N GLU 65.A O no hydrogen 2.915 N/A VAL 70.A N LEU 66.A O no hydrogen 3.167 N/A ASN 71.A N VAL 67.A O no hydrogen 2.811 N/A ASN 71.A N ASP 68.A O no hydrogen 2.961 N/A GLU 72.A N ASP 68.A O no hydrogen 2.981 N/A VAL 73.A N VAL 69.A O no hydrogen 3.414 N/A ILE 75.A N GLU 72.A O no hydrogen 2.294 N/A GLU 76.A N VAL 73.A O no hydrogen 3.337 N/A HIS 77.A N VAL 73.A O no hydrogen 2.843 N/A HIS 77.A NE2 GLU 76.A OE2 no hydrogen 3.008 N/A MET 79.A N THR 11.A O no hydrogen 3.301 N/A LEU 80.A N ALA 78.A O no hydrogen 2.661 N/A LYS 84.A N ASP 82.A OD2 no hydrogen 2.607 N/A THR 85.A OG1 ASP 12.A O no hydrogen 2.362 N/A ASN 86.A N ASP 10.A OD2 no hydrogen 2.712 N/A ASN 86.A ND2 GLU 83.A O no hydrogen 3.617 N/A ALA 89.A N LEU 129.A O no hydrogen 2.727 N/A VAL 90.A N GLY 7.A O no hydrogen 3.081 N/A PHE 91.A N PRO 127.A O no hydrogen 3.174 N/A VAL 92.A N TRP 5.A O no hydrogen 2.995 N/A GLU 94.A N ARG 3.A O no hydrogen 2.986 N/A ALA 97.A N GLU 94.A O no hydrogen 2.940 N/A LEU 100.A N ALA 97.A O no hydrogen 2.654 N/A LYS 101.A N VAL 98.A O no hydrogen 2.815 N/A LYS 101.A NZ ASP 105.A OD2 no hydrogen 3.483 N/A ALA 104.A N LEU 100.A O no hydrogen 2.981 N/A ASP 105.A N LYS 101.A O no hydrogen 2.835 N/A LYS 106.A N PRO 102.A O no hydrogen 2.771 N/A LYS 106.A NZ ASP 110.A OD2 no hydrogen 2.917 N/A ALA 107.A N ALA 104.A O no hydrogen 2.956 N/A ILE 108.A N ASP 105.A O no hydrogen 3.206 N/A LYS 109.A N ASP 105.A O no hydrogen 3.229 N/A LYS 109.A NZ MET 245.A O no hydrogen 3.234 N/A ALA 117.A N ILE 114.A O no hydrogen 2.984 N/A LEU 118.A N ILE 114.A O no hydrogen 3.059 N/A PHE 119.A N ASP 115.A O no hydrogen 2.619 N/A VAL 120.A N ALA 117.A O no hydrogen 3.213 N/A ILE 121.A N ALA 117.A O no hydrogen 3.053 N/A GLY 122.A N LEU 118.A O no hydrogen 2.833 N/A LYS 123.A N PHE 119.A O no hydrogen 3.045 N/A TYR 124.A N VAL 120.A O no hydrogen 3.220 N/A PHE 125.A N GLY 122.A O no hydrogen 3.072 N/A ILE 126.A N ILE 121.A O no hydrogen 2.859 N/A LEU 129.A N ALA 89.A O no hydrogen 2.610 N/A LYS 132.A NZ THR 85.A O no hydrogen 2.678 N/A LYS 133.A N ASN 86.A OD1 no hydrogen 3.407 N/A ALA 140.A N GLY 136.A O no hydrogen 3.111 N/A LEU 141.A N LEU 137.A O no hydrogen 3.429 N/A ALA 142.A N ILE 138.A O no hydrogen 3.117 N/A ALA 143.A N GLY 139.A O no hydrogen 2.609 N/A VAL 144.A N ALA 140.A O no hydrogen 3.259 N/A VAL 144.A N LEU 141.A O no hydrogen 2.528 N/A GLY 145.A N ALA 142.A O no hydrogen 3.102 N/A THR 152.A N THR 239.A O no hydrogen 2.861 N/A THR 152.A OG1 THR 239.A O no hydrogen 3.392 N/A THR 152.A OG1 THR 239.A OG1 no hydrogen 3.264 N/A THR 152.A OG1 HIS 241.A O no hydrogen 2.622 N/A LEU 153.A N GLY 213.A O no hydrogen 3.198 N/A GLU 154.A N PHE 237.A O no hydrogen 2.915 N/A LEU 155.A N ILE 211.A O no hydrogen 2.703 N/A ILE 156.A N MET 235.A O no hydrogen 2.893 N/A ALA 157.A N TYR 209.A O no hydrogen 3.199 N/A TYR 158.A N ARG 233.A O no hydrogen 2.978 N/A TYR 158.A OH THR 19.A OG1 no hydrogen 2.597 N/A ARG 159.A N PRO 206.A O no hydrogen 3.051 N/A ARG 159.A NE GLU 229.A OE2 no hydrogen 2.953 N/A ARG 159.A NH1 THR 166.A O no hydrogen 2.828 N/A ARG 159.A NH2 THR 166.A O no hydrogen 2.629 N/A ARG 159.A NH2 GLU 229.A OE2 no hydrogen 3.138 N/A ARG 163.A N TYR 160.A O no hydrogen 2.831 N/A PHE 164.A N PRO 161.A O no hydrogen 3.208 N/A THR 166.A OG1 GLU 167.A O no hydrogen 2.924 N/A THR 166.A OG1 GLU 169.A OE1 no hydrogen 3.040 N/A ARG 168.A NE VAL 207.A O no hydrogen 2.840 N/A ARG 168.A NH1 THR 203.A O no hydrogen 3.408 N/A ARG 168.A NH2 THR 203.A O no hydrogen 2.980 N/A ARG 168.A NH2 VAL 207.A O no hydrogen 3.310 N/A GLU 172.A N TYR 170.A O no hydrogen 2.636 N/A SER 174.A N ASP 171.A O no hydrogen 2.507 N/A SER 174.A OG ASP 171.A O no hydrogen 2.321 N/A SER 174.A OG ASP 171.A OD2 no hydrogen 3.471 N/A SER 174.A OG GLU 172.A O no hydrogen 3.354 N/A SER 174.A OG LYS 227.A O no hydrogen 3.359 N/A PHE 175.A N GLU 172.A O no hydrogen 2.617 N/A PHE 176.A N GLU 173.A O no hydrogen 3.065 N/A ASP 177.A N GLU 173.A O no hydrogen 3.206 N/A ASP 179.A N PHE 175.A O no hydrogen 2.702 N/A TYR 180.A N PHE 176.A O no hydrogen 2.742 N/A GLU 181.A N ASP 177.A O no hydrogen 3.264 N/A GLU 181.A N MET 178.A O no hydrogen 3.050 N/A LEU 182.A N MET 178.A O no hydrogen 3.364 N/A TYR 183.A N ASP 179.A O no hydrogen 3.285 N/A PHE 187.A N ARG 212.A O no hydrogen 3.079 N/A ASN 189.A ND2 ARG 212.A O no hydrogen 3.080 N/A ASP 191.A N VAL 196.A O no hydrogen 2.930 N/A TRP 192.A N ARG 401.A OXT no hydrogen 2.853 N/A TRP 192.A NE1 ASP 179.A OD1 no hydrogen 2.735 N/A CYS 193.A SG ARG 401.A O no hydrogen 3.412 N/A ASN 194.A N ASP 191.A OD1 no hydrogen 3.353 N/A VAL 196.A N ASP 191.A O no hydrogen 3.436 N/A CYS 199.A SG ASN 189.A O no hydrogen 3.519 N/A CYS 205.A SG THR 203.A OG1 no hydrogen 2.718 N/A LEU 208.A N ALA 157.A O no hydrogen 2.526 N/A ILE 211.A N LEU 155.A O no hydrogen 2.831 N/A ARG 212.A N ASN 189.A OD1 no hydrogen 2.990 N/A ARG 212.A NE GLU 154.A OE1 no hydrogen 2.930 N/A ARG 212.A NH2 HIS 384.A ND1 no hydrogen 2.764 N/A GLY 213.A N LEU 153.A O no hydrogen 3.215 N/A GLU 214.A N GLN 185.A O no hydrogen 3.012 N/A ALA 218.A N SER 215.A OG no hydrogen 3.016 N/A LEU 219.A N SER 215.A O no hydrogen 3.118 N/A TYR 220.A N VAL 216.A O no hydrogen 2.771 N/A LYS 221.A N GLU 217.A O no hydrogen 3.064 N/A ALA 222.A N ALA 218.A O no hydrogen 2.799 N/A MET 223.A N LEU 219.A O no hydrogen 2.968 N/A GLU 224.A N TYR 220.A O no hydrogen 3.374 N/A GLU 224.A N LYS 221.A O no hydrogen 3.210 N/A SER 225.A N LYS 221.A O no hydrogen 2.936 N/A SER 225.A OG LYS 221.A O no hydrogen 2.475 N/A THR 228.A OG1 GLU 229.A O no hydrogen 2.785 N/A ASP 232.A N TYR 158.A O no hydrogen 2.997 N/A MET 235.A N ILE 156.A O no hydrogen 3.075 N/A PHE 237.A N GLU 154.A O no hydrogen 2.987 N/A VAL 238.A N PRO 40.A O no hydrogen 3.192 N/A THR 239.A N THR 152.A O no hydrogen 2.830 N/A THR 239.A OG1 THR 152.A OG1 no hydrogen 3.264 N/A ASN 240.A ND2 ARG 44.A O no hydrogen 3.567 N/A HIS 241.A N THR 239.A OG1 no hydrogen 3.158 N/A ALA 242.A N HIS 384.A O no hydrogen 3.056 N/A THR 243.A N LEU 385.A O no hydrogen 2.802 N/A THR 243.A OG1 ASN 240.A O no hydrogen 2.494 N/A ASP 244.A N LEU 385.A O no hydrogen 3.058 N/A HIS 246.A ND1 SER 261.A OG no hydrogen 2.834 N/A LEU 247.A N ASP 244.A O no hydrogen 3.311 N/A GLY 249.A N GLU 252.A OE2 no hydrogen 3.315 N/A TYR 259.A N MET 321.A O no hydrogen 2.690 N/A SER 261.A OG HIS 246.A ND1 no hydrogen 2.834 N/A SER 261.A OG SER 320.A OG no hydrogen 2.712 N/A TYR 262.A N GLY 319.A O no hydrogen 2.726 N/A TYR 262.A OH GLU 257.A O no hydrogen 3.321 N/A ARG 263.A NH2 GLU 251.A OE1 no hydrogen 2.628 N/A LEU 264.A N VAL 317.A O no hydrogen 3.049 N/A ARG 265.A N GLU 250.A OE2 no hydrogen 2.562 N/A GLY 266.A N VAL 315.A O no hydrogen 2.739 N/A ARG 267.A N ASP 285.A O no hydrogen 3.082 N/A VAL 268.A N ASP 313.A O no hydrogen 3.052 N/A THR 269.A N GLU 283.A O no hydrogen 2.843 N/A THR 269.A OG1 GLU 283.A O no hydrogen 3.246 N/A LEU 270.A N GLU 283.A O no hydrogen 3.168 N/A TYR 273.A N PHE 281.A O no hydrogen 3.070 N/A GLY 278.A N ILE 275.A O no hydrogen 3.168 N/A PHE 281.A N TYR 273.A O no hydrogen 2.912 N/A PHE 282.A N CYS 293.A O no hydrogen 3.048 N/A ILE 284.A N VAL 291.A O no hydrogen 2.768 N/A ASP 285.A N ARG 267.A O no hydrogen 2.557 N/A THR 286.A N GLY 289.A O no hydrogen 2.812 N/A THR 286.A OG1 GLY 289.A O no hydrogen 3.148 N/A LYS 287.A NZ GLU 250.A O no hydrogen 3.323 N/A GLY 289.A N THR 286.A OG1 no hydrogen 3.273 N/A VAL 291.A N ILE 284.A O no hydrogen 3.156 N/A CYS 293.A N PHE 282.A O no hydrogen 2.791 N/A ALA 294.A N ILE 326.A O no hydrogen 3.154 N/A ALA 295.A N VAL 280.A O no hydrogen 2.968 N/A GLU 297.A N HIS 279.A ND1 no hydrogen 3.217 N/A THR 299.A N PHE 296.A O no hydrogen 3.181 N/A THR 299.A OG1 PHE 296.A O no hydrogen 2.691 N/A LYS 300.A N GLU 297.A O no hydrogen 2.552 N/A LYS 300.A NZ GLU 297.A OE1 no hydrogen 3.223 N/A PHE 302.A N THR 299.A O no hydrogen 3.370 N/A ARG 303.A N LYS 300.A O no hydrogen 2.792 N/A ARG 303.A NE GLY 278.A O no hydrogen 2.793 N/A ARG 303.A NH1 LYS 300.A O no hydrogen 3.296 N/A ARG 303.A NH2 GLY 278.A O no hydrogen 3.471 N/A VAL 305.A N PHE 302.A O no hydrogen 2.625 N/A ILE 306.A N PHE 302.A O no hydrogen 2.971 N/A ARG 307.A N ARG 303.A O no hydrogen 2.872 N/A ARG 307.A NE ASP 274.A OD2 no hydrogen 2.886 N/A ARG 307.A NH2 ASP 274.A OD2 no hydrogen 3.121 N/A LEU 308.A N VAL 305.A O no hydrogen 3.167 N/A LEU 309.A N ILE 306.A O no hydrogen 3.264 N/A ARG 310.A N ASP 313.A OD2 no hydrogen 2.693 N/A ARG 310.A NE LEU 308.A O no hydrogen 3.530 N/A ARG 310.A NH1 GLU 271.A OE1 no hydrogen 2.944 N/A LYS 311.A N GLU 271.A OE2 no hydrogen 2.348 N/A GLY 312.A N VAL 268.A O no hydrogen 2.800 N/A ASP 313.A N ARG 310.A O no hydrogen 3.004 N/A VAL 314.A N GLU 335.A O no hydrogen 3.365 N/A VAL 315.A N GLY 266.A O no hydrogen 2.766 N/A GLU 316.A N GLN 332.A O no hydrogen 2.689 N/A VAL 317.A N LEU 264.A O no hydrogen 2.669 N/A TYR 318.A N LYS 330.A O no hydrogen 2.957 N/A GLY 319.A N TYR 262.A O no hydrogen 3.204 N/A SER 320.A OG SER 261.A OG no hydrogen 2.712 N/A MET 321.A N ARG 260.A O no hydrogen 2.878 N/A LYS 322.A N THR 325.A O no hydrogen 2.991 N/A ASP 324.A N ASN 258.A OD1 no hydrogen 3.216 N/A THR 325.A N LYS 322.A O no hydrogen 2.835 N/A THR 325.A OG1 LYS 323.A O no hydrogen 3.506 N/A ILE 326.A N LYS 292.A O no hydrogen 3.038 N/A ASN 327.A N SER 320.A O no hydrogen 2.895 N/A LEU 328.A N ALA 294.A O no hydrogen 3.154 N/A GLU 329.A N TYR 318.A O no hydrogen 2.651 N/A LYS 330.A N TYR 318.A O no hydrogen 3.399 N/A LYS 330.A NZ ASP 244.A OD2 no hydrogen 3.497 N/A LYS 330.A NZ LYS 387.A O no hydrogen 3.004 N/A ILE 331.A N TYR 375.A O no hydrogen 3.006 N/A GLN 332.A N GLU 316.A O no hydrogen 2.650 N/A ILE 333.A N GLY 373.A O no hydrogen 2.890 N/A VAL 334.A N VAL 314.A O no hydrogen 2.749 N/A GLU 335.A N VAL 314.A O no hydrogen 3.349 N/A ALA 337.A N ASP 313.A OD1 no hydrogen 2.645 N/A VAL 341.A N GLU 364.A O no hydrogen 2.862 N/A ALA 351.A N GLY 356.A O no hydrogen 3.347 N/A GLY 354.A N GLY 352.A O no hydrogen 3.018 N/A PHE 357.A N ALA 358.A O no hydrogen 2.741 N/A LEU 362.A N LYS 343.A O no hydrogen 2.523 N/A GLU 364.A N VAL 341.A O no hydrogen 3.237 N/A VAL 366.A N ILE 339.A O no hydrogen 3.272 N/A ARG 368.A NH1 ASP 313.A OD2 no hydrogen 2.536 N/A ARG 368.A NH1 ALA 337.A O no hydrogen 2.998 N/A ARG 368.A NH2 LEU 308.A O no hydrogen 2.467 N/A ARG 368.A NH2 ASP 313.A OD2 no hydrogen 2.725 N/A GLN 371.A N TYR 375.A OH no hydrogen 3.341 N/A GLY 373.A N ILE 333.A O no hydrogen 3.178 N/A PHE 374.A N GLY 396.A O no hydrogen 2.377 N/A TYR 375.A N ILE 331.A O no hydrogen 3.072 N/A TYR 375.A OH GLN 371.A O no hydrogen 2.840 N/A SER 380.A N ASP 191.A OD2 no hydrogen 2.642 N/A SER 380.A OG ASP 191.A OD2 no hydrogen 2.471 N/A ALA 381.A N PRO 378.A O no hydrogen 2.669 N/A ARG 382.A N PRO 379.A O no hydrogen 2.814 N/A ARG 382.A NH2 VAL 377.A O no hydrogen 2.670 N/A ARG 383.A NH1 SER 320.A OG no hydrogen 2.830 N/A SER 386.A OG GLU 329.A OE1 no hydrogen 2.435 N/A LYS 387.A N ASP 244.A OD1 no hydrogen 2.517 N/A LEU 389.A N GLU 376.A OE1 no hydrogen 2.504 N/A ARG 391.A N PRO 388.A O no hydrogen 3.031 N/A ARG 391.A NE GLU 214.A OE2 no hydrogen 2.172 N/A ARG 391.A NH1 ASP 150.A OD1 no hydrogen 3.304 N/A ARG 391.A NH2 ASP 150.A OD2 no hydrogen 2.930 N/A MET 392.A N LEU 389.A O no hydrogen 2.837 N/A ARG 397.A NH1 LEU 389.A O no hydrogen 2.515 N/A HIS 398.A N PHE 374.A O no hydrogen 3.022 N/A ARG 401.A NH2 ASP 179.A OD1 no hydrogen 3.054 N/A