Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4w8i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 11.A N SER 8.A O no hydrogen 3.311 N/A ILE 12.A N PRO 9.A O no hydrogen 2.894 N/A LEU 13.A N PRO 9.A O no hydrogen 3.045 N/A SER 14.A N GLN 10.A O no hydrogen 3.253 N/A PHE 16.A N ILE 12.A O no hydrogen 3.343 N/A PHE 16.A N LEU 13.A O no hydrogen 2.790 N/A ASP 17.A N SER 14.A O no hydrogen 3.105 N/A LEU 28.A N PRO 25.A O no hydrogen 2.538 N/A THR 29.A N PRO 25.A O no hydrogen 3.206 N/A THR 29.A OG1 LYS 26.A O no hydrogen 2.817 N/A GLU 30.A N LYS 26.A O no hydrogen 2.769 N/A LEU 32.A N LEU 28.A O no hydrogen 2.759 N/A LYS 33.A N THR 29.A O no hydrogen 3.125 N/A GLU 34.A N GLU 30.A O no hydrogen 3.410 N/A VAL 35.A N LEU 31.A O no hydrogen 2.946 N/A TYR 36.A N LEU 32.A O no hydrogen 2.788 N/A GLY 37.A N LYS 33.A O no hydrogen 3.412 N/A ALA 38.A N VAL 35.A O no hydrogen 3.331 N/A THR 39.A N TYR 36.A O no hydrogen 2.817 N/A THR 39.A OG1 VAL 35.A O no hydrogen 2.707 N/A THR 39.A OG1 TYR 36.A O no hydrogen 3.273 N/A ALA 40.A N TYR 36.A O no hydrogen 2.817 N/A ALA 43.A N ASN 42.A OD1 no hydrogen 2.278 N/A GLU 46.A N ALA 43.A O no hydrogen 3.424 N/A ILE 48.A N GLN 44.A O no hydrogen 2.891 N/A ARG 49.A N ALA 45.A O no hydrogen 2.792 N/A TRP 50.A N GLU 46.A O no hydrogen 2.785 N/A CYS 51.A N VAL 47.A O no hydrogen 2.842 N/A CYS 51.A SG VAL 47.A O no hydrogen 3.001 N/A GLN 52.A N ILE 48.A O no hydrogen 2.743 N/A GLN 52.A NE2 GLY 61.A O no hydrogen 2.970 N/A ASN 53.A N ARG 49.A O no hydrogen 3.106 N/A LEU 54.A N TRP 50.A O no hydrogen 2.799 N/A PHE 55.A N CYS 51.A O no hydrogen 3.158 N/A PHE 55.A N GLN 52.A O no hydrogen 3.205 N/A HIS 56.A N ASN 53.A O no hydrogen 3.152 N/A HIS 56.A ND1 ASP 189.A OD2 no hydrogen 2.974 N/A GLY 57.A N GLN 52.A O no hydrogen 2.799 N/A GLU 60.A N SER 58.A OG no hydrogen 3.331 N/A GLY 61.A N SER 58.A O no hydrogen 3.404 N/A TYR 62.A N PHE 217.A O no hydrogen 2.837 N/A LEU 64.A N CYS 215.A O no hydrogen 2.688 N/A THR 66.A N SER 213.A O no hydrogen 2.550 N/A THR 66.A OG1 SER 213.A O no hydrogen 3.258 N/A GLY 69.A N ASP 201.A OD1 no hydrogen 2.293 N/A THR 71.A OG1 HIS 67.A O no hydrogen 3.555 N/A SER 72.A OG VAL 214.A O no hydrogen 3.082 N/A ILE 73.A N GLY 69.A O no hydrogen 3.006 N/A ILE 74.A N THR 70.A O no hydrogen 2.784 N/A GLU 75.A N THR 71.A O no hydrogen 3.176 N/A ALA 78.A N GLU 75.A O no hydrogen 3.361 N/A TYR 79.A N ALA 76.A O no hydrogen 2.905 N/A TYR 79.A OH SER 197.A OG no hydrogen 2.761 N/A ILE 81.A N ALA 77.A O no hydrogen 2.765 N/A ARG 82.A N ALA 78.A O no hydrogen 3.119 N/A ARG 82.A NH1 ALA 139.A O no hydrogen 2.754 N/A ARG 82.A NH2 ALA 139.A O no hydrogen 3.377 N/A ALA 83.A N TYR 79.A O no hydrogen 3.078 N/A ARG 84.A N VAL 80.A O no hydrogen 3.101 N/A ARG 84.A NH2 THR 110.A O no hydrogen 3.128 N/A ALA 85.A N ILE 81.A O no hydrogen 2.773 N/A LYS 86.A N ARG 82.A O no hydrogen 2.945 N/A GLY 87.A N ALA 83.A O no hydrogen 3.254 N/A ILE 88.A N ALA 83.A O no hydrogen 3.165 N/A GLU 92.A N ASN 137.A O no hydrogen 2.574 N/A ILE 93.A N ILE 113.A O no hydrogen 2.900 N/A VAL 94.A N VAL 140.A O no hydrogen 2.994 N/A VAL 95.A N ILE 115.A O no hydrogen 3.018 N/A GLU 97.A N VAL 117.A O no hydrogen 2.880 N/A ALA 99.A N PRO 96.A O no hydrogen 2.851 N/A PHE 103.A N HIS 100.A O no hydrogen 3.253 N/A LYS 104.A N ALA 101.A O no hydrogen 2.953 N/A LYS 105.A N ALA 101.A O no hydrogen 3.060 N/A ALA 106.A N ALA 102.A O no hydrogen 2.869 N/A ALA 107.A N PHE 103.A O no hydrogen 3.102 N/A GLU 108.A N LYS 104.A O no hydrogen 3.307 N/A LEU 109.A N ALA 106.A O no hydrogen 3.237 N/A THR 110.A N ALA 106.A O no hydrogen 2.717 N/A THR 110.A OG1 ALA 106.A O no hydrogen 2.744 N/A ILE 113.A N PRO 91.A O no hydrogen 2.913 N/A ILE 115.A N ILE 93.A O no hydrogen 2.783 N/A VAL 117.A N VAL 95.A O no hydrogen 2.617 N/A ASP 120.A N ALA 125.A O no hydrogen 3.047 N/A GLY 124.A N ASP 120.A O no hydrogen 3.185 N/A VAL 126.A N ASP 152.A OD2 no hydrogen 3.215 N/A ASN 129.A N ASN 127.A OD1 no hydrogen 3.448 N/A VAL 130.A N ASN 127.A O no hydrogen 2.868 N/A THR 135.A N THR 138.A OG1 no hydrogen 2.726 N/A THR 135.A OG1 GLU 92.A OE1 no hydrogen 2.336 N/A THR 135.A OG1 THR 138.A OG1 no hydrogen 3.399 N/A ASN 137.A N THR 135.A OG1 no hydrogen 3.172 N/A THR 138.A OG1 THR 135.A O no hydrogen 3.082 N/A THR 138.A OG1 THR 135.A OG1 no hydrogen 3.399 N/A ALA 139.A N GLU 92.A O no hydrogen 2.691 N/A GLY 142.A N HIS 169.A O no hydrogen 3.010 N/A SER 143.A N ASP 152.A OD1 no hydrogen 2.815 N/A SER 143.A OG ASP 152.A OD1 no hydrogen 2.814 N/A ALA 144.A N ASP 171.A O no hydrogen 2.923 N/A SER 146.A N ILE 150.A O no hydrogen 2.866 N/A SER 146.A OG ASN 148.A OD1 no hydrogen 2.231 N/A SER 146.A OG ILE 150.A O no hydrogen 3.287 N/A ASN 148.A ND2 GLY 124.A O no hydrogen 3.514 N/A GLY 149.A N SER 146.A O no hydrogen 3.095 N/A ILE 150.A N ASN 148.A OD1 no hydrogen 3.014 N/A ASP 152.A N SER 143.A O no hydrogen 2.968 N/A GLU 156.A N PRO 153.A O no hydrogen 2.966 N/A LEU 157.A N PRO 153.A O no hydrogen 2.584 N/A GLY 158.A N ILE 154.A O no hydrogen 2.732 N/A LEU 160.A N GLU 156.A O no hydrogen 3.049 N/A ALA 161.A N GLY 158.A O no hydrogen 2.864 N/A LYS 162.A N GLY 158.A O no hydrogen 2.942 N/A LYS 164.A NZ SER 131.A O no hydrogen 2.518 N/A VAL 166.A N ALA 161.A O no hydrogen 3.381 N/A HIS 169.A ND1 SER 197.A OG no hydrogen 2.442 N/A HIS 169.A NE2 SER 199.A OG no hydrogen 3.000 N/A VAL 170.A N SER 197.A O no hydrogen 2.691 N/A ASP 171.A N GLY 142.A O no hydrogen 3.034 N/A ALA 172.A N SER 199.A O no hydrogen 2.852 N/A CYS 173.A N ASP 171.A OD1 no hydrogen 3.347 N/A CYS 173.A SG ASP 171.A OD1 no hydrogen 3.453 N/A CYS 173.A SG SER 199.A OG no hydrogen 3.733 N/A GLY 176.A N ALA 172.A O no hydrogen 2.795 N/A LEU 178.A N GLY 175.A O no hydrogen 3.006 N/A THR 179.A N GLY 175.A O no hydrogen 2.852 N/A THR 179.A OG1 GLY 175.A O no hydrogen 2.917 N/A THR 179.A OG1 GLY 176.A O no hydrogen 3.289 N/A ALA 180.A N GLY 176.A O no hydrogen 3.182 N/A PHE 181.A N LEU 178.A O no hydrogen 3.266 N/A LEU 182.A N THR 179.A O no hydrogen 3.112 N/A SER 185.A N ASP 183.A OD1 no hydrogen 3.319 N/A SER 185.A OG ASP 183.A OD1 no hydrogen 3.524 N/A PHE 190.A N PHE 55.A O no hydrogen 3.185 N/A ARG 191.A N ASP 189.A OD1 no hydrogen 3.405 N/A ARG 191.A NE ASP 189.A OD1 no hydrogen 2.759 N/A ARG 191.A NH2 THR 184.A OG1 no hydrogen 2.635 N/A ARG 191.A NH2 ASP 189.A OD1 no hydrogen 3.311 N/A VAL 192.A N ASP 189.A O no hydrogen 3.118 N/A VAL 195.A N VAL 192.A O no hydrogen 3.367 N/A THR 196.A N PHE 168.A O no hydrogen 2.723 N/A THR 196.A OG1 TYR 79.A OH no hydrogen 2.804 N/A THR 196.A OG1 PHE 168.A O no hydrogen 2.867 N/A SER 197.A N PHE 168.A O no hydrogen 3.330 N/A SER 197.A OG TYR 79.A OH no hydrogen 2.761 N/A SER 197.A OG HIS 169.A ND1 no hydrogen 2.442 N/A ILE 198.A N LEU 216.A O no hydrogen 2.959 N/A SER 199.A N VAL 170.A O no hydrogen 3.191 N/A SER 199.A OG HIS 169.A NE2 no hydrogen 3.000 N/A SER 199.A OG ASP 171.A OD1 no hydrogen 3.419 N/A ALA 200.A N VAL 214.A O no hydrogen 2.801 N/A ASP 201.A N CYS 173.A O no hydrogen 3.215 N/A LEU 202.A N THR 212.A O no hydrogen 3.360 N/A TYR 205.A OH LEU 331.A O no hydrogen 2.362 N/A CYS 207.A SG TYR 205.A O no hydrogen 3.383 N/A CYS 208.A N LEU 202.A O no hydrogen 2.960 N/A CYS 208.A SG GLY 206.A O no hydrogen 3.777 N/A SER 213.A N THR 66.A O no hydrogen 2.608 N/A SER 213.A OG ALA 200.A O no hydrogen 2.573 N/A SER 213.A OG ASP 201.A OD1 no hydrogen 2.815 N/A VAL 214.A N ALA 200.A O no hydrogen 2.769 N/A CYS 215.A N LEU 64.A O no hydrogen 3.053 N/A CYS 215.A SG SER 72.A O no hydrogen 3.529 N/A LEU 216.A N ILE 198.A O no hydrogen 2.790 N/A PHE 217.A N TYR 62.A O no hydrogen 2.682 N/A SER 218.A N THR 196.A O no hydrogen 3.060 N/A SER 218.A OG VAL 195.A O no hydrogen 3.383 N/A SER 218.A OG THR 196.A O no hydrogen 3.487 N/A SER 218.A OG ASP 220.A OD1 no hydrogen 2.718 N/A ASP 220.A N ASP 220.A OD1 no hydrogen 2.590 N/A SER 221.A N SER 218.A O no hydrogen 3.386 N/A SER 221.A OG THR 196.A O no hydrogen 3.465 N/A SER 225.A N PRO 222.A O no hydrogen 3.216 N/A SER 225.A OG PRO 222.A O no hydrogen 2.595 N/A VAL 226.A N ALA 223.A O no hydrogen 3.039 N/A TYR 227.A N ALA 223.A O no hydrogen 3.501 N/A TYR 227.A OH GLU 75.A OE2 no hydrogen 2.282 N/A ALA 228.A N LEU 224.A O no hydrogen 2.708 N/A ALA 229.A N SER 225.A O no hydrogen 3.116 N/A ALA 229.A N VAL 226.A O no hydrogen 3.091 N/A LEU 230.A N VAL 226.A O no hydrogen 3.065 N/A ASP 233.A N GLU 75.A OE1 no hydrogen 2.939 N/A ARG 237.A NE GLU 240.A OE2 no hydrogen 3.100 N/A ALA 239.A N GLY 235.A O no hydrogen 2.792 N/A GLU 240.A N ALA 236.A O no hydrogen 2.842 N/A VAL 241.A N ARG 237.A O no hydrogen 3.396 N/A TYR 242.A N VAL 238.A O no hydrogen 2.950 N/A ALA 243.A N ALA 239.A O no hydrogen 2.723 N/A THR 244.A N GLU 240.A O no hydrogen 3.145 N/A THR 244.A OG1 GLU 240.A O no hydrogen 2.274 N/A LEU 245.A N VAL 241.A O no hydrogen 2.853 N/A SER 246.A N TYR 242.A O no hydrogen 3.170 N/A SER 246.A OG TYR 242.A O no hydrogen 2.591 N/A TYR 247.A N ALA 243.A O no hydrogen 2.917 N/A TYR 247.A OH GLU 27.A OE1 no hydrogen 2.799 N/A TYR 248.A N THR 244.A O no hydrogen 3.101 N/A GLY 249.A N LEU 245.A O no hydrogen 2.953 N/A LYS 252.A NZ GLU 255.A OE1 no hydrogen 3.359 N/A TYR 253.A N GLY 249.A O no hydrogen 3.140 N/A TYR 253.A OH GLY 206.A O no hydrogen 2.340 N/A GLN 254.A N LYS 250.A O no hydrogen 2.604 N/A GLU 255.A N ASN 251.A O no hydrogen 2.971 N/A ILE 256.A N LYS 252.A O no hydrogen 3.031 N/A ALA 257.A N TYR 253.A O no hydrogen 3.013 N/A LYS 258.A N GLN 254.A O no hydrogen 3.006 N/A SER 259.A N GLU 255.A O no hydrogen 3.102 N/A SER 259.A OG GLU 255.A O no hydrogen 2.457 N/A ILE 260.A N ILE 256.A O no hydrogen 2.915 N/A ILE 261.A N ALA 257.A O no hydrogen 3.165 N/A ARG 262.A N LYS 258.A O no hydrogen 2.902 N/A LEU 263.A N SER 259.A O no hydrogen 3.056 N/A ARG 264.A N ILE 260.A O no hydrogen 3.049 N/A ARG 264.A NE GLN 268.A OE1 no hydrogen 3.102 N/A ARG 264.A NH2 GLN 268.A OE1 no hydrogen 3.111 N/A ASN 265.A N ILE 261.A O no hydrogen 3.193 N/A ASN 265.A ND2 ILE 261.A O no hydrogen 3.196 N/A ALA 266.A N ARG 262.A O no hydrogen 2.869 N/A ILE 267.A N LEU 263.A O no hydrogen 3.005 N/A GLN 268.A N ARG 264.A O no hydrogen 3.137 N/A LYS 269.A N ASN 265.A O no hydrogen 2.952 N/A LYS 269.A N ALA 266.A O no hydrogen 3.321 N/A GLU 270.A N ALA 266.A O no hydrogen 3.019 N/A LEU 271.A N ILE 267.A O no hydrogen 3.054 N/A THR 272.A N GLN 268.A O no hydrogen 2.895 N/A THR 272.A OG1 GLN 268.A O no hydrogen 2.786 N/A ALA 273.A N LYS 269.A O no hydrogen 3.067 N/A GLU 284.A N THR 282.A OG1 no hydrogen 3.391 N/A ASP 285.A N THR 282.A O no hydrogen 3.270 N/A TYR 287.A N ARG 300.A O no hydrogen 3.129 N/A TYR 287.A OH ASN 302.A OD1 no hydrogen 2.965 N/A TYR 289.A N GLY 298.A O no hydrogen 3.003 N/A TYR 289.A OH LYS 121.A O no hydrogen 2.312 N/A TRP 294.A NE1 HIS 151.A ND1 no hydrogen 3.211 N/A SER 295.A OG TYR 205.A OH no hydrogen 2.625 N/A LEU 297.A N LEU 329.A O no hydrogen 3.004 N/A PHE 299.A N PHE 327.A O no hydrogen 2.881 N/A ARG 300.A N TYR 287.A O no hydrogen 2.987 N/A SER 301.A OG ASP 285.A O no hydrogen 2.719 N/A ASN 302.A N GLU 284.A O no hydrogen 2.519 N/A CYS 304.A N SER 301.A OG no hydrogen 2.981 N/A CYS 304.A SG ASP 285.A O no hydrogen 3.978 N/A CYS 304.A SG ASP 285.A OD1 no hydrogen 3.860 N/A HIS 307.A N ASN 305.A OD1 no hydrogen 3.197 N/A ILE 309.A N ASN 305.A O no hydrogen 3.250 N/A ALA 310.A N ALA 306.A O no hydrogen 3.175 N/A ASP 311.A N HIS 307.A O no hydrogen 2.967 N/A LYS 315.A NZ GLU 351.A OE1 no hydrogen 2.444 N/A LYS 315.A NZ GLU 351.A OE2 no hydrogen 3.071 N/A TRP 316.A NE1 ASP 348.A OD2 no hydrogen 2.781 N/A ASN 319.A N HIS 328.A O no hydrogen 3.056 N/A LEU 321.A N GLY 326.A O no hydrogen 2.721 N/A HIS 328.A N ASN 319.A O no hydrogen 3.030 N/A LEU 329.A N LEU 297.A O no hydrogen 3.069 N/A CYS 330.A SG TYR 205.A OH no hydrogen 3.536 N/A LEU 331.A N SER 295.A O no hydrogen 2.784 N/A HIS 335.A N THR 332.A O no hydrogen 3.186 N/A THR 336.A N HIS 333.A O no hydrogen 3.140 N/A THR 336.A OG1 HIS 333.A O no hydrogen 2.409 N/A LEU 337.A N VAL 334.A O no hydrogen 3.217 N/A GLU 342.A N GLU 342.A OE1 no hydrogen 2.710 N/A THR 343.A N SER 340.A O no hydrogen 3.338 N/A THR 343.A OG1 SER 340.A O no hydrogen 2.755 N/A GLN 344.A N PHE 341.A O no hydrogen 3.285 N/A PHE 345.A N PHE 341.A O no hydrogen 2.978 N/A ILE 346.A N GLU 342.A O no hydrogen 3.316 N/A ASP 348.A N GLN 344.A O no hydrogen 3.201 N/A LEU 349.A N ILE 346.A O no hydrogen 2.678 N/A ARG 350.A N ILE 346.A O no hydrogen 2.760 N/A ALA 352.A N ASP 348.A O no hydrogen 3.054 N/A ILE 354.A N ARG 350.A O no hydrogen 2.792 N/A ASP 355.A N GLU 351.A O no hydrogen 3.192 N/A LYS 357.A N VAL 353.A O no hydrogen 2.855 N/A LYS 357.A NZ ASP 285.A OD2 no hydrogen 3.087 N/A