Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5he1_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG ASP 4.A OD2 no hydrogen 2.736 N/A GLN 5.A N SER 1.A O no hydrogen 3.319 N/A LEU 6.A N GLU 2.A O no hydrogen 3.331 N/A ARG 7.A N LEU 3.A O no hydrogen 2.584 N/A GLN 8.A N ASP 4.A O no hydrogen 2.984 N/A GLN 8.A NE2 GLN 12.A OE1 no hydrogen 3.520 N/A GLU 9.A N GLN 5.A O no hydrogen 2.757 N/A ALA 10.A N LEU 6.A O no hydrogen 3.109 N/A GLU 11.A N ARG 7.A O no hydrogen 3.074 N/A GLN 12.A N GLN 8.A O no hydrogen 3.029 N/A LEU 13.A N ALA 10.A O no hydrogen 3.251 N/A LYS 14.A N ALA 10.A O no hydrogen 2.941 N/A ASN 15.A N GLU 11.A O no hydrogen 3.063 N/A ILE 17.A N LEU 13.A O no hydrogen 2.824 N/A ARG 18.A N LYS 14.A O no hydrogen 2.689 N/A ARG 18.A NH2 ASN 15.A OD1 no hydrogen 2.923 N/A ASP 19.A N ASN 15.A O no hydrogen 3.323 N/A ALA 20.A N GLN 16.A O no hydrogen 3.003 N/A ARG 21.A N ARG 18.A O no hydrogen 3.141 N/A ARG 21.A NE ASP 257.A O no hydrogen 2.652 N/A ARG 21.A NE ASP 257.A OD2 no hydrogen 2.610 N/A ARG 21.A NH2 THR 220.A O no hydrogen 2.996 N/A ARG 21.A NH2 ASP 257.A OD2 no hydrogen 2.710 N/A LYS 22.A N ARG 18.A O no hydrogen 3.096 N/A ALA 23.A N ASP 19.A O no hydrogen 2.921 N/A CYS 24.A N ARG 21.A O no hydrogen 2.801 N/A CYS 24.A SG ALA 20.A O no hydrogen 3.541 N/A ALA 25.A N LYS 22.A O no hydrogen 3.254 N/A THR 28.A N GLN 31.A OE1 no hydrogen 2.903 N/A GLN 31.A N THR 28.A OG1 no hydrogen 2.731 N/A ILE 32.A N THR 28.A O no hydrogen 3.129 N/A THR 33.A N LEU 29.A O no hydrogen 2.972 N/A THR 33.A OG1 LEU 29.A O no hydrogen 3.442 N/A THR 33.A OG1 SER 30.A O no hydrogen 3.192 N/A THR 33.A OG1 LEU 299.A O no hydrogen 3.003 N/A ASN 34.A N GLN 31.A O no hydrogen 2.818 N/A ILE 36.A N THR 33.A O no hydrogen 3.327 N/A ILE 42.A N ALA 304.A O no hydrogen 3.094 N/A ARG 45.A N ASN 339.A O no hydrogen 2.490 N/A ARG 47.A NH1 ARG 45.A O no hydrogen 3.406 N/A ARG 48.A NE TYR 84.A O no hydrogen 2.615 N/A ARG 48.A NH1 ARG 47.A O no hydrogen 2.775 N/A ARG 48.A NH2 TYR 84.A O no hydrogen 2.848 N/A LEU 50.A N LEU 335.A O no hydrogen 2.890 N/A HIS 53.A ND1 ASP 75.A OD1 no hydrogen 3.115 N/A HIS 53.A ND1 ASP 75.A OD2 no hydrogen 3.330 N/A HIS 53.A NE2 SER 71.A OG no hydrogen 2.506 N/A LEU 54.A N ASP 75.A OD2 no hydrogen 3.186 N/A LYS 56.A N GLN 74.A OE1 no hydrogen 3.004 N/A ILE 57.A N SER 330.A O no hydrogen 2.863 N/A TYR 58.A N ALA 72.A O no hydrogen 2.810 N/A ALA 59.A N ALA 72.A O no hydrogen 3.371 N/A HIS 61.A N VAL 70.A O no hydrogen 2.893 N/A TRP 62.A NE1 GLY 318.A O no hydrogen 2.915 N/A GLY 63.A N LEU 68.A O no hydrogen 2.567 N/A THR 64.A OG1 PRO 106.A O no hydrogen 2.678 N/A SER 66.A N GLY 63.A O no hydrogen 3.030 N/A ARG 67.A N ASP 65.A OD1 no hydrogen 3.151 N/A ARG 67.A NE ASP 82.A OD1 no hydrogen 3.039 N/A LEU 68.A N ASP 65.A OD1 no hydrogen 3.102 N/A LEU 69.A N TRP 81.A O no hydrogen 3.232 N/A VAL 70.A N HIS 61.A O no hydrogen 2.966 N/A SER 71.A N ILE 79.A O no hydrogen 2.938 N/A SER 71.A OG HIS 53.A NE2 no hydrogen 2.506 N/A ALA 72.A N ALA 59.A O no hydrogen 2.963 N/A SER 73.A N LYS 77.A O no hydrogen 3.385 N/A SER 73.A OG ALA 55.A O no hydrogen 3.238 N/A SER 73.A OG LYS 56.A O no hydrogen 2.715 N/A GLN 74.A N LYS 56.A O no hydrogen 2.750 N/A ASP 75.A N SER 73.A OG no hydrogen 2.978 N/A GLY 76.A N SER 73.A O no hydrogen 2.878 N/A LEU 78.A N ILE 92.A O no hydrogen 3.052 N/A ILE 79.A N SER 71.A O no hydrogen 3.310 N/A ILE 80.A N HIS 90.A O no hydrogen 2.938 N/A TRP 81.A N LEU 69.A O no hydrogen 2.883 N/A TRP 81.A NE1 SER 71.A OG no hydrogen 2.958 N/A ASP 82.A N ASN 87.A O no hydrogen 3.225 N/A SER 83.A N ARG 67.A O no hydrogen 2.956 N/A SER 83.A OG ARG 67.A O no hydrogen 2.446 N/A TYR 84.A N ASP 82.A OD1 no hydrogen 3.059 N/A THR 85.A N ASP 82.A O no hydrogen 3.138 N/A THR 86.A OG1 THR 85.A O no hydrogen 2.413 N/A LYS 88.A NZ ARG 51.A O no hydrogen 2.817 N/A ILE 92.A N LEU 78.A O no hydrogen 2.645 N/A LEU 94.A N GLY 76.A O no hydrogen 3.048 N/A TRP 98.A N SER 96.A OG no hydrogen 3.033 N/A VAL 99.A N SER 97.A O no hydrogen 2.934 N/A MET 100.A N GLY 114.A O no hydrogen 2.799 N/A THR 101.A N GLY 114.A O no hydrogen 3.213 N/A CYS 102.A SG ALA 59.A O no hydrogen 3.406 N/A CYS 102.A SG VAL 70.A O no hydrogen 3.630 N/A ALA 103.A N ALA 112.A O no hydrogen 3.023 N/A TYR 104.A N HIS 61.A ND1 no hydrogen 3.085 N/A ALA 105.A N TYR 110.A O no hydrogen 3.213 N/A SER 107.A OG ASP 153.A OD1 no hydrogen 3.192 N/A SER 107.A OG ASP 153.A OD2 no hydrogen 2.838 N/A GLY 108.A N ALA 105.A O no hydrogen 3.002 N/A ASN 109.A N SER 107.A OG no hydrogen 2.852 N/A VAL 111.A N TYR 123.A O no hydrogen 2.992 N/A ALA 112.A N ALA 103.A O no hydrogen 3.181 N/A CYS 113.A N SER 121.A O no hydrogen 3.038 N/A LEU 116.A N TRP 98.A O no hydrogen 2.823 N/A ASN 118.A N GLY 115.A O no hydrogen 2.986 N/A ILE 119.A N ASP 117.A OD2 no hydrogen 3.136 N/A CYS 120.A N LEU 138.A O no hydrogen 3.124 N/A CYS 120.A SG CYS 113.A O no hydrogen 3.900 N/A SER 121.A N CYS 113.A O no hydrogen 2.878 N/A ILE 122.A N ARG 136.A O no hydrogen 2.983 N/A TYR 123.A N VAL 111.A O no hydrogen 2.552 N/A ASN 124.A N ARG 133.A O no hydrogen 2.748 N/A LEU 125.A N ASN 109.A O no hydrogen 2.885 N/A THR 127.A OG1 ASN 131.A O no hydrogen 3.092 N/A GLY 130.A N THR 127.A O no hydrogen 3.144 N/A ASN 131.A N THR 127.A OG1 no hydrogen 3.204 N/A SER 135.A N ILE 122.A O no hydrogen 2.687 N/A LEU 138.A N CYS 120.A O no hydrogen 2.696 N/A HIS 141.A ND1 ASP 162.A OD2 no hydrogen 2.570 N/A HIS 141.A NE2 THR 158.A OG1 no hydrogen 2.827 N/A THR 142.A N ASP 162.A OD2 no hydrogen 3.269 N/A TYR 144.A OH ASP 185.A OD2 no hydrogen 2.683 N/A LEU 145.A N GLY 115.A O no hydrogen 3.013 N/A SER 146.A N SER 159.A O no hydrogen 2.917 N/A SER 146.A OG SER 159.A OG no hydrogen 2.896 N/A SER 146.A OG VAL 186.A O no hydrogen 2.493 N/A SER 146.A OG MET 187.A O no hydrogen 3.381 N/A CYS 147.A SG LEU 189.A O no hydrogen 4.004 N/A ARG 149.A N VAL 157.A O no hydrogen 2.870 N/A ARG 149.A NH1 CYS 102.A O no hydrogen 3.208 N/A ARG 149.A NH1 CYS 148.A O no hydrogen 2.999 N/A LEU 151.A N GLN 155.A O no hydrogen 2.863 N/A ASN 154.A N ASP 152.A OD1 no hydrogen 2.476 N/A GLN 155.A N ASP 152.A OD1 no hydrogen 2.841 N/A ILE 156.A N TRP 168.A O no hydrogen 3.268 N/A VAL 157.A N ARG 149.A O no hydrogen 2.888 N/A THR 158.A N ALA 166.A O no hydrogen 2.852 N/A THR 158.A OG1 HIS 141.A NE2 no hydrogen 2.827 N/A SER 159.A N CYS 147.A O no hydrogen 2.987 N/A SER 159.A OG SER 146.A OG no hydrogen 2.896 N/A SER 159.A OG CYS 147.A O no hydrogen 3.058 N/A SER 160.A OG TYR 144.A O no hydrogen 2.879 N/A GLY 161.A N TYR 144.A O no hydrogen 2.772 N/A ASP 162.A N SER 160.A OG no hydrogen 3.008 N/A THR 163.A N SER 160.A O no hydrogen 3.103 N/A THR 163.A OG1 ASP 162.A O no hydrogen 2.627 N/A THR 163.A OG1 HIS 182.A O no hydrogen 3.428 N/A THR 164.A N ASP 162.A OD1 no hydrogen 2.772 N/A THR 164.A OG1 ASP 162.A OD1 no hydrogen 2.663 N/A THR 164.A OG1 ASP 162.A OD2 no hydrogen 3.437 N/A CYS 165.A N PHE 179.A O no hydrogen 3.503 N/A ALA 166.A N THR 158.A O no hydrogen 2.791 N/A LEU 167.A N THR 177.A O no hydrogen 2.840 N/A TRP 168.A NE1 THR 158.A OG1 no hydrogen 3.040 N/A ASP 169.A N GLN 174.A O no hydrogen 2.866 N/A ILE 170.A N ASN 154.A O no hydrogen 2.615 N/A GLU 171.A N ASN 154.A OD1 no hydrogen 3.464 N/A THR 172.A N ASP 169.A OD2 no hydrogen 3.353 N/A THR 172.A OG1 ASP 169.A OD2 no hydrogen 2.998 N/A GLY 173.A N ILE 170.A O no hydrogen 2.882 N/A THR 176.A N GLN 174.A O no hydrogen 2.933 N/A THR 177.A N LEU 167.A O no hydrogen 3.379 N/A PHE 179.A N CYS 165.A O no hydrogen 3.100 N/A HIS 182.A ND1 ASP 204.A OD2 no hydrogen 2.881 N/A HIS 182.A NE2 SER 200.A OG no hydrogen 2.644 N/A THR 183.A N ASP 204.A OD2 no hydrogen 2.850 N/A THR 183.A OG1 ASP 204.A OD2 no hydrogen 3.554 N/A VAL 186.A N SER 160.A O no hydrogen 3.161 N/A MET 187.A N GLY 201.A O no hydrogen 2.926 N/A SER 188.A N GLY 201.A O no hydrogen 3.298 N/A SER 190.A N VAL 199.A O no hydrogen 2.729 N/A ALA 192.A N LEU 197.A O no hydrogen 2.940 N/A THR 195.A OG1 ASP 194.A O no hydrogen 2.627 N/A ARG 196.A N ASP 194.A OD1 no hydrogen 2.724 N/A PHE 198.A N TRP 210.A O no hydrogen 3.185 N/A VAL 199.A N SER 190.A O no hydrogen 2.902 N/A SER 200.A N LYS 208.A O no hydrogen 2.911 N/A SER 200.A OG HIS 182.A NE2 no hydrogen 2.644 N/A GLY 201.A N SER 188.A O no hydrogen 3.064 N/A ALA 202.A N SER 206.A O no hydrogen 3.214 N/A CYS 203.A N ASP 185.A O no hydrogen 2.911 N/A CYS 203.A SG ASP 185.A O no hydrogen 3.720 N/A ALA 205.A N ALA 202.A O no hydrogen 3.348 N/A SER 206.A N ASP 204.A OD1 no hydrogen 2.954 N/A SER 206.A OG ASP 204.A OD1 no hydrogen 2.611 N/A ALA 207.A N PHE 221.A O no hydrogen 3.067 N/A LYS 208.A N SER 200.A O no hydrogen 2.771 N/A LEU 209.A N GLN 219.A O no hydrogen 2.850 N/A TRP 210.A N PHE 198.A O no hydrogen 2.782 N/A TRP 210.A NE1 SER 200.A OG no hydrogen 3.137 N/A ASP 211.A N MET 216.A O no hydrogen 2.812 N/A VAL 212.A N ARG 196.A O no hydrogen 3.089 N/A ARG 213.A N ASP 211.A OD1 no hydrogen 3.260 N/A GLY 215.A N ASP 211.A O no hydrogen 2.599 N/A CYS 217.A SG LEU 209.A O no hydrogen 3.517 N/A CYS 217.A SG GLN 219.A O no hydrogen 3.404 N/A CYS 217.A SG THR 220.A OG1 no hydrogen 3.663 N/A ARG 218.A N LEU 209.A O no hydrogen 2.718 N/A GLN 219.A NE2 LEU 254.A O no hydrogen 2.870 N/A GLN 219.A NE2 ASP 257.A OD1 no hydrogen 2.741 N/A PHE 221.A N ALA 207.A O no hydrogen 3.117 N/A HIS 224.A ND1 ASP 246.A OD2 no hydrogen 3.341 N/A HIS 224.A NE2 THR 242.A OG1 no hydrogen 2.294 N/A GLU 225.A N ASP 246.A OD2 no hydrogen 2.997 N/A ILE 228.A N ALA 202.A O no hydrogen 2.867 N/A ASN 229.A ND2 ILE 272.A O no hydrogen 2.930 N/A ALA 230.A N GLY 243.A O no hydrogen 3.187 N/A CYS 232.A N.A ALA 241.A O no hydrogen 3.052 N/A CYS 232.A N.B ALA 241.A O no hydrogen 3.034 N/A CYS 232.A SG.A PHE 233.A O no hydrogen 3.490 N/A CYS 232.A SG.B ALA 241.A O no hydrogen 3.912 N/A PHE 234.A N ALA 239.A O no hydrogen 2.547 N/A GLY 237.A N PHE 234.A O no hydrogen 2.913 N/A PHE 240.A N PHE 252.A O no hydrogen 3.008 N/A ALA 241.A N CYS 232.A O.A no hydrogen 2.958 N/A ALA 241.A N CYS 232.A O.B no hydrogen 2.906 N/A THR 242.A N ARG 250.A O no hydrogen 2.972 N/A THR 242.A OG1 HIS 224.A NE2 no hydrogen 2.294 N/A GLY 243.A N ALA 230.A O no hydrogen 2.899 N/A SER 244.A N THR 248.A O no hydrogen 3.227 N/A SER 244.A OG SER 226.A O no hydrogen 3.540 N/A SER 244.A OG ASP 227.A O no hydrogen 2.714 N/A ASP 245.A N ASP 227.A O no hydrogen 2.974 N/A ASP 246.A N SER 244.A OG no hydrogen 2.634 N/A THR 248.A N ASP 246.A OD1 no hydrogen 3.160 N/A THR 248.A OG1 ASP 246.A OD1 no hydrogen 2.797 N/A CYS 249.A N TYR 263.A O no hydrogen 3.002 N/A ARG 250.A N THR 242.A O no hydrogen 3.011 N/A ARG 250.A NE THR 248.A OG1 no hydrogen 3.317 N/A ARG 250.A NH1 GLU 259.A OE1 no hydrogen 3.156 N/A LEU 251.A N MET 261.A O no hydrogen 3.063 N/A PHE 252.A N PHE 240.A O no hydrogen 2.848 N/A ASP 253.A N GLN 258.A O no hydrogen 2.813 N/A LEU 254.A N ASN 238.A O no hydrogen 2.776 N/A ALA 256.A N ASP 253.A OD2 no hydrogen 2.601 N/A ASP 257.A N LEU 254.A O no hydrogen 2.737 N/A GLN 258.A N ASP 253.A O no hydrogen 3.127 N/A GLN 258.A NE2 ARG 21.A O no hydrogen 3.298 N/A GLN 258.A NE2 ALA 256.A O no hydrogen 2.802 N/A LEU 260.A N LEU 251.A O no hydrogen 2.902 N/A THR 262.A OG1 GLU 259.A OE2 no hydrogen 2.963 N/A TYR 263.A N CYS 249.A O no hydrogen 3.001 N/A TYR 263.A OH ALA 298.A O no hydrogen 2.534 N/A CYS 270.A SG.A GLY 271.A O no hydrogen 3.465 N/A CYS 270.A SG.B ASP 289.A O no hydrogen 3.837 N/A ILE 272.A N SER 244.A O no hydrogen 2.884 N/A THR 273.A N GLY 287.A O no hydrogen 2.705 N/A THR 273.A OG1 GLY 287.A O no hydrogen 3.051 N/A THR 273.A OG1 VAL 314.A O no hydrogen 2.362 N/A SER 274.A N GLY 287.A O no hydrogen 3.465 N/A SER 276.A N LEU 285.A O no hydrogen 3.056 N/A SER 278.A N LEU 283.A O no hydrogen 2.812 N/A LYS 279.A NZ ASP 321.A O no hydrogen 3.087 N/A GLY 281.A N SER 278.A O no hydrogen 3.325 N/A ARG 282.A N SER 280.A OG no hydrogen 3.123 N/A ARG 282.A NE ASP 297.A OD1 no hydrogen 3.004 N/A ARG 282.A NH2 ASP 37.A O no hydrogen 3.328 N/A ARG 282.A NH2 ASP 297.A OD2 no hydrogen 2.992 N/A LEU 283.A N SER 278.A OG no hydrogen 3.242 N/A LEU 284.A N TRP 296.A O no hydrogen 2.677 N/A LEU 285.A N SER 276.A O no hydrogen 2.998 N/A ALA 286.A N ASN 294.A O no hydrogen 2.916 N/A GLY 287.A N SER 274.A O no hydrogen 2.743 N/A TYR 288.A N ASN 292.A O no hydrogen 2.913 N/A ASN 292.A N ASP 290.A OD1 no hydrogen 2.867 N/A ASN 292.A ND2 ASP 290.A OD2 no hydrogen 3.459 N/A CYS 293.A N LEU 307.A O no hydrogen 3.212 N/A CYS 293.A SG ALA 286.A O no hydrogen 3.302 N/A CYS 293.A SG ASN 294.A O no hydrogen 3.778 N/A ASN 294.A N ALA 286.A O no hydrogen 2.801 N/A VAL 295.A N GLY 305.A O no hydrogen 2.570 N/A TRP 296.A N LEU 284.A O no hydrogen 3.007 N/A ASP 297.A N ASP 302.A O no hydrogen 3.218 N/A ALA 298.A N ARG 282.A O no hydrogen 2.651 N/A LYS 300.A N ASP 297.A OD1 no hydrogen 2.773 N/A LYS 300.A NZ THR 33.A O no hydrogen 2.838 N/A LYS 300.A NZ ASN 34.A O no hydrogen 3.287 N/A LYS 300.A NZ ILE 36.A O no hydrogen 3.087 N/A ALA 301.A N ASP 297.A O no hydrogen 2.799 N/A ALA 304.A N VAL 295.A O no hydrogen 2.938 N/A GLY 305.A N VAL 295.A O no hydrogen 3.212 N/A LEU 307.A N CYS 293.A O no hydrogen 2.735 N/A HIS 310.A NE2 THR 328.A OG1 no hydrogen 3.008 N/A ASP 311.A N ASP 332.A OD2 no hydrogen 3.113 N/A ARG 313.A N ASN 312.A OD1 no hydrogen 2.675 N/A VAL 314.A N TYR 288.A O no hydrogen 3.312 N/A SER 315.A N GLY 329.A O no hydrogen 2.939 N/A SER 315.A OG ILE 57.A O no hydrogen 2.767 N/A CYS 316.A SG SER 315.A OG no hydrogen 3.479 N/A GLY 318.A N ALA 327.A O no hydrogen 3.235 N/A VAL 319.A N SER 276.A OG no hydrogen 3.324 N/A THR 320.A N ALA 325.A O no hydrogen 3.031 N/A THR 320.A OG1 ASP 322.A OD1 no hydrogen 2.690 N/A THR 320.A OG1 ALA 325.A O no hydrogen 3.512 N/A ASP 322.A N SER 66.A OG no hydrogen 3.027 N/A GLY 323.A N THR 320.A O no hydrogen 2.648 N/A GLY 323.A N THR 320.A OG1 no hydrogen 3.315 N/A MET 324.A N ASP 322.A OD1 no hydrogen 2.473 N/A ALA 325.A N THR 320.A OG1 no hydrogen 3.144 N/A VAL 326.A N TRP 338.A O no hydrogen 2.993 N/A ALA 327.A N GLY 318.A O no hydrogen 2.711 N/A THR 328.A N LYS 336.A O no hydrogen 2.815 N/A THR 328.A OG1 HIS 310.A NE2 no hydrogen 3.008 N/A THR 328.A OG1 THR 328.A O no hydrogen 2.591 N/A THR 328.A OG1 LYS 336.A O no hydrogen 2.876 N/A GLY 329.A N CYS 316.A O no hydrogen 2.931 N/A SER 330.A OG ASN 312.A O no hydrogen 2.981 N/A SER 330.A OG ARG 313.A O no hydrogen 2.544 N/A TRP 331.A N ARG 313.A O no hydrogen 3.006 N/A ASP 332.A N SER 330.A OG no hydrogen 2.911 N/A SER 333.A N SER 330.A O no hydrogen 3.380 N/A SER 333.A OG HIS 53.A O no hydrogen 3.078 N/A SER 333.A OG ASP 332.A O no hydrogen 2.984 N/A PHE 334.A N ASP 332.A OD1 no hydrogen 2.933 N/A LEU 335.A N LEU 50.A O no hydrogen 3.441 N/A LYS 336.A N THR 328.A O no hydrogen 3.046 N/A ILE 337.A N ARG 48.A O no hydrogen 3.148 N/A TRP 338.A N VAL 326.A O no hydrogen 2.999 N/A TRP 338.A NE1 THR 328.A OG1 no hydrogen 2.939 N/A