Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3be9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A N ASP 202.A OD2 no hydrogen 2.885 N/A SER 2.A OG HIS 303.A NE2 no hydrogen 2.780 N/A SER 2.A OG GLN 304.A OE1 no hydrogen 2.916 N/A ALA 4.A N TYR 176.A OH no hydrogen 2.996 N/A ARG 5.A NH1 GLN 304.A O no hydrogen 2.983 N/A TYR 7.A OH ASP 139.A OD1 no hydrogen 2.692 N/A ASN 11.A ND2 GLY 145.A O no hydrogen 3.130 N/A ASN 11.A ND2 TYR 176.A O no hydrogen 2.757 N/A LEU 13.A N ASP 9.A O no hydrogen 3.006 N/A ARG 14.A N VAL 10.A O no hydrogen 3.282 N/A ARG 14.A NH1 GLN 144.A OE1 no hydrogen 2.973 N/A ARG 14.A NH2 GLN 144.A OE1 no hydrogen 2.698 N/A TYR 18.A N PRO 15.A O no hydrogen 2.920 N/A TYR 18.A OH GLN 144.A O no hydrogen 2.706 N/A ASP 20.A N LYS 16.A O no hydrogen 2.858 N/A TYR 21.A N TRP 19.A O no hydrogen 2.722 N/A ALA 23.A N ASP 20.A O no hydrogen 2.902 N/A LEU 24.A N TYR 21.A O no hydrogen 3.048 N/A GLN 27.A NE2 THR 25.A O no hydrogen 2.738 N/A GLY 29.A N ILE 94.A O no hydrogen 2.826 N/A ASP 32.A N GLU 30.A OE2 no hydrogen 3.058 N/A ASP 33.A N GLU 30.A O no hydrogen 3.099 N/A TYR 34.A OH ASP 93.A OD2 no hydrogen 2.503 N/A GLU 35.A N ILE 52.A O no hydrogen 2.970 N/A VAL 37.A N GLU 50.A O no hydrogen 2.755 N/A ARG 38.A N GLU 50.A O no hydrogen 3.273 N/A ARG 38.A NE GLU 50.A OE1 no hydrogen 3.042 N/A LYS 39.A NZ GLU 47.A OE1 no hydrogen 2.859 N/A VAL 40.A N VAL 48.A O no hydrogen 2.755 N/A GLY 41.A N VAL 48.A O no hydrogen 3.155 N/A GLY 43.A N SER 46.A O no hydrogen 2.945 N/A SER 46.A N GLY 43.A O no hydrogen 3.301 N/A GLU 47.A N ILE 64.A O no hydrogen 2.901 N/A VAL 48.A N GLY 41.A O no hydrogen 3.046 N/A PHE 49.A N ILE 62.A O no hydrogen 2.807 N/A GLU 50.A N ARG 38.A O no hydrogen 2.606 N/A GLY 51.A N CYS 60.A O no hydrogen 2.827 N/A ILE 52.A N GLU 35.A O no hydrogen 2.833 N/A ASN 53.A N GLU 58.A O no hydrogen 2.938 N/A VAL 54.A N ASP 33.A O no hydrogen 2.771 N/A ASN 55.A N ASN 53.A OD1 no hydrogen 2.797 N/A ASN 55.A ND2 ASP 33.A OD1 no hydrogen 2.942 N/A ASN 55.A ND2 ASN 53.A OD1 no hydrogen 2.920 N/A ASN 57.A N ASN 53.A O no hydrogen 2.720 N/A GLU 58.A N ASN 56.A OD1 no hydrogen 2.911 N/A CYS 60.A N GLY 51.A O no hydrogen 3.072 N/A ILE 61.A N PHE 107.A O no hydrogen 2.756 N/A ILE 62.A N PHE 49.A O no hydrogen 2.830 N/A LYS 63.A N LEU 105.A O no hydrogen 2.967 N/A LYS 63.A NZ GLU 76.A OE2 no hydrogen 2.549 N/A LYS 63.A NZ ASP 169.A OD2 no hydrogen 3.062 N/A ILE 64.A N GLU 47.A O no hydrogen 2.820 N/A LEU 65.A N PRO 103.A O no hydrogen 2.900 N/A LYS 66.A N TYR 45.A O no hydrogen 3.000 N/A LYS 66.A NZ GLY 43.A O no hydrogen 3.165 N/A LYS 72.A NZ GLY 171.A O no hydrogen 3.041 N/A ILE 73.A N LYS 69.A O no hydrogen 3.147 N/A LYS 74.A N LYS 70.A O no hydrogen 3.093 N/A LYS 74.A NZ GLU 22.A O no hydrogen 3.533 N/A LYS 74.A NZ LEU 24.A O no hydrogen 2.754 N/A ARG 75.A N LYS 71.A O no hydrogen 3.181 N/A ARG 75.A NH1 GLU 174.A OE1 no hydrogen 3.401 N/A ARG 75.A NH2 GLY 171.A O no hydrogen 3.301 N/A GLU 76.A N LYS 72.A O no hydrogen 3.351 N/A ILE 77.A N ILE 73.A O no hydrogen 3.175 N/A LYS 78.A N LYS 74.A O no hydrogen 2.843 N/A ILE 79.A N ARG 75.A O no hydrogen 2.941 N/A LEU 80.A N GLU 76.A O no hydrogen 2.872 N/A GLN 81.A N ILE 77.A O no hydrogen 2.864 N/A ASN 82.A N LYS 78.A O no hydrogen 2.790 N/A ASN 82.A ND2 TYR 18.A O no hydrogen 2.940 N/A LEU 83.A N ILE 79.A O no hydrogen 2.959 N/A GLY 85.A N LEU 83.A O no hydrogen 2.906 N/A ASN 87.A ND2 GLU 133.A O no hydrogen 2.990 N/A ASN 87.A ND2 GLU 133.A OE1 no hydrogen 2.906 N/A ILE 88.A N GLY 85.A O no hydrogen 3.138 N/A VAL 89.A N LEU 167.A O no hydrogen 3.338 N/A LYS 90.A N GLU 108.A OE1 no hydrogen 2.791 N/A LEU 92.A N ILE 106.A O no hydrogen 2.674 N/A ASP 93.A N ILE 106.A O no hydrogen 3.286 N/A ILE 94.A N ASP 93.A OD1 no hydrogen 2.693 N/A VAL 95.A N SER 104.A O no hydrogen 3.009 N/A ASP 97.A N THR 102.A O no hydrogen 2.848 N/A SER 100.A N ASP 97.A OD2 no hydrogen 2.916 N/A SER 100.A OG ASP 97.A OD2 no hydrogen 2.493 N/A SER 100.A OG THR 102.A OG1 no hydrogen 2.758 N/A LYS 101.A N ASP 97.A O no hydrogen 2.573 N/A LYS 101.A NZ GLN 98.A O no hydrogen 2.679 N/A THR 102.A N SER 100.A OG no hydrogen 3.177 N/A THR 102.A OG1 SER 100.A OG no hydrogen 2.758 N/A SER 104.A N VAL 95.A O no hydrogen 2.781 N/A LEU 105.A N LYS 63.A O no hydrogen 2.921 N/A ILE 106.A N ASP 93.A O no hydrogen 2.847 N/A PHE 107.A N ILE 61.A O no hydrogen 2.831 N/A GLU 108.A N LYS 90.A O no hydrogen 3.178 N/A ASN 112.A N VAL 110.A O no hydrogen 2.690 N/A LYS 116.A N ASP 114.A OD1 no hydrogen 3.375 N/A VAL 117.A N ASP 114.A O no hydrogen 2.758 N/A LEU 118.A N ASP 114.A O no hydrogen 2.773 N/A TYR 119.A N PHE 115.A O no hydrogen 3.018 N/A THR 121.A N LEU 118.A O no hydrogen 2.817 N/A THR 121.A OG1 LEU 118.A O no hydrogen 2.690 N/A LEU 122.A N TYR 119.A O no hydrogen 2.996 N/A THR 123.A N ASP 126.A OD2 no hydrogen 2.843 N/A THR 123.A OG1 ASP 126.A OD2 no hydrogen 2.713 N/A ASP 126.A N THR 123.A OG1 no hydrogen 3.069 N/A ILE 127.A N THR 123.A O no hydrogen 3.055 N/A ARG 128.A N ASP 124.A O no hydrogen 3.267 N/A ARG 128.A NE ASP 124.A OD1 no hydrogen 2.691 N/A ARG 128.A NH1 TYR 317.A O no hydrogen 3.083 N/A ARG 128.A NH2 ASP 124.A OD2 no hydrogen 3.349 N/A TYR 129.A N TYR 125.A O no hydrogen 2.767 N/A TYR 129.A OH ARG 163.A O no hydrogen 2.881 N/A TYR 130.A N ASP 126.A O no hydrogen 2.878 N/A TYR 130.A OH HIS 160.A ND1 no hydrogen 2.689 N/A ILE 131.A N ILE 127.A O no hydrogen 2.957 N/A TYR 132.A N ARG 128.A O no hydrogen 3.065 N/A GLU 133.A N TYR 129.A O no hydrogen 3.073 N/A LEU 134.A N TYR 130.A O no hydrogen 2.895 N/A LEU 135.A N ILE 131.A O no hydrogen 2.829 N/A LYS 136.A N TYR 132.A O no hydrogen 3.051 N/A LYS 136.A NZ GLU 133.A OE2 no hydrogen 2.917 N/A LYS 136.A NZ GLU 325.A OE1 no hydrogen 2.671 N/A ALA 137.A N GLU 133.A O no hydrogen 3.427 N/A LEU 138.A N LEU 134.A O no hydrogen 3.031 N/A ASP 139.A N LEU 135.A O no hydrogen 2.827 N/A TYR 140.A N LYS 136.A O no hydrogen 3.085 N/A CYS 141.A N ALA 137.A O no hydrogen 2.977 N/A CYS 141.A SG ALA 137.A O no hydrogen 3.670 N/A CYS 141.A SG LEU 138.A O no hydrogen 3.409 N/A CYS 141.A SG ILE 146.A O no hydrogen 3.496 N/A HIS 142.A N LEU 138.A O no hydrogen 2.894 N/A HIS 142.A NE2 ASP 208.A OD2 no hydrogen 2.810 N/A SER 143.A N ASP 139.A O no hydrogen 2.814 N/A SER 143.A OG TYR 140.A O no hydrogen 2.617 N/A GLN 144.A N CYS 141.A O no hydrogen 2.900 N/A GLN 144.A NE2 SER 143.A OG no hydrogen 2.840 N/A GLY 145.A N HIS 142.A O no hydrogen 2.889 N/A ILE 146.A N CYS 141.A O no hydrogen 2.865 N/A MET 147.A N GLU 174.A O no hydrogen 2.875 N/A HIS 148.A N ASP 208.A OD2 no hydrogen 3.021 N/A HIS 148.A NE2 ILE 168.A O no hydrogen 2.917 N/A ARG 149.A N ASP 208.A OD1 no hydrogen 2.859 N/A ARG 149.A NE LEU 172.A O no hydrogen 2.606 N/A ARG 149.A NH1 TYR 203.A OH no hydrogen 2.867 N/A ARG 149.A NH2 LEU 172.A O no hydrogen 2.856 N/A ASP 150.A N HIS 148.A ND1 no hydrogen 3.115 N/A LYS 152.A NZ SER 188.A OG no hydrogen 2.870 N/A ASN 155.A N LYS 152.A O no hydrogen 2.823 N/A ASN 155.A ND2 ASP 150.A O no hydrogen 2.780 N/A ASN 155.A ND2 ASP 150.A OD2 no hydrogen 3.048 N/A VAL 156.A N PRO 153.A O no hydrogen 3.009 N/A MET 157.A N ARG 166.A O no hydrogen 2.947 N/A ILE 158.A N ASN 112.A OD1 no hydrogen 2.753 N/A ASP 159.A N LYS 164.A O no hydrogen 3.005 N/A HIS 160.A ND1 TYR 130.A OH no hydrogen 2.689 N/A LEU 162.A N ASP 159.A OD1 no hydrogen 3.092 N/A ARG 163.A N HIS 160.A O no hydrogen 3.301 N/A ARG 163.A NH1 ASP 126.A OD1 no hydrogen 2.925 N/A ARG 163.A NH2 ASP 126.A OD1 no hydrogen 2.777 N/A LYS 164.A N ASP 159.A O no hydrogen 3.197 N/A ARG 166.A N MET 157.A O no hydrogen 3.014 N/A ARG 166.A NE GLU 108.A OE1 no hydrogen 3.347 N/A ARG 166.A NE GLU 108.A OE2 no hydrogen 3.015 N/A ARG 166.A NH1 LEU 165.A O no hydrogen 2.847 N/A LEU 167.A N ASN 87.A O no hydrogen 2.902 N/A ILE 168.A N ASN 155.A O no hydrogen 2.810 N/A TRP 170.A NE1 LEU 167.A O no hydrogen 3.055 N/A GLY 171.A N ASP 169.A OD2 no hydrogen 3.212 N/A ALA 173.A N TRP 170.A O no hydrogen 3.338 N/A GLU 174.A N MET 147.A O no hydrogen 2.976 N/A PHE 175.A N GLU 174.A OE2 no hydrogen 2.685 N/A TYR 176.A N GLY 145.A O no hydrogen 2.891 N/A HIS 177.A N TYR 182.A OH no hydrogen 2.873 N/A LYS 180.A N HIS 177.A O no hydrogen 2.957 N/A TYR 182.A N GLN 201.A O no hydrogen 2.797 N/A TYR 182.A OH PHE 175.A O no hydrogen 2.617 N/A ARG 185.A N ASN 183.A OD1 no hydrogen 2.763 N/A SER 188.A OG ASP 150.A OD1 no hydrogen 2.893 N/A ARG 189.A NE GLY 229.A O no hydrogen 3.024 N/A PHE 191.A N SER 188.A O no hydrogen 2.899 N/A LYS 192.A NZ VAL 186.A O no hydrogen 2.944 N/A GLU 195.A N GLU 195.A OE1 no hydrogen 2.683 N/A LEU 196.A N GLY 193.A O no hydrogen 2.952 N/A LEU 197.A N GLY 193.A O no hydrogen 3.270 N/A VAL 198.A N PRO 194.A O no hydrogen 2.883 N/A ASP 199.A N LEU 196.A O no hydrogen 3.365 N/A LEU 200.A N GLU 195.A O no hydrogen 2.727 N/A GLN 201.A NE2 TYR 182.A O no hydrogen 3.175 N/A ASP 202.A N ASP 202.A OD1 no hydrogen 2.614 N/A TYR 203.A OH ASN 183.A O no hydrogen 2.665 N/A TYR 205.A OH TYR 7.A O no hydrogen 2.722 N/A SER 206.A N ASP 204.A OD1 no hydrogen 2.873 N/A SER 206.A OG ASP 204.A OD1 no hydrogen 2.715 N/A LEU 207.A N ASP 204.A O no hydrogen 3.013 N/A ASP 208.A N TYR 205.A O no hydrogen 3.036 N/A MET 209.A N SER 206.A O no hydrogen 3.036 N/A TRP 210.A N SER 206.A O no hydrogen 3.368 N/A TRP 210.A N LEU 207.A O no hydrogen 3.115 N/A SER 211.A N LEU 207.A O no hydrogen 3.318 N/A SER 211.A OG PHE 191.A O no hydrogen 2.847 N/A LEU 212.A N ASP 208.A O no hydrogen 2.848 N/A GLY 213.A N MET 209.A O no hydrogen 3.017 N/A CYS 214.A N TRP 210.A O no hydrogen 2.880 N/A CYS 214.A SG TYR 190.A O no hydrogen 3.657 N/A CYS 214.A SG TRP 210.A O no hydrogen 3.509 N/A MET 215.A N SER 211.A O no hydrogen 2.972 N/A PHE 216.A N LEU 212.A O no hydrogen 2.785 N/A ALA 217.A N GLY 213.A O no hydrogen 2.772 N/A GLY 218.A N CYS 214.A O no hydrogen 3.046 N/A MET 219.A N MET 215.A O no hydrogen 3.066 N/A ILE 220.A N PHE 216.A O no hydrogen 3.027 N/A PHE 221.A N ALA 217.A O no hydrogen 2.936 N/A ARG 222.A N MET 219.A O no hydrogen 3.403 N/A ARG 222.A NH2 HIS 285.A NE2 no hydrogen 3.238 N/A LYS 223.A N GLY 218.A O no hydrogen 3.064 N/A LYS 223.A NZ PRO 225.A O no hydrogen 3.077 N/A LYS 223.A NZ PHE 226.A O no hydrogen 3.004 N/A HIS 230.A N ASP 234.A OD2 no hydrogen 2.778 N/A ASP 234.A N ASP 231.A OD1 no hydrogen 2.579 N/A GLN 235.A N ASP 231.A O no hydrogen 2.783 N/A LEU 236.A N ASN 232.A O no hydrogen 3.201 N/A VAL 237.A N HIS 233.A O no hydrogen 3.105 N/A LYS 238.A N ASP 234.A O no hydrogen 2.913 N/A LYS 238.A NZ ASP 234.A OD1 no hydrogen 2.606 N/A LYS 238.A NZ ASP 234.A OD2 no hydrogen 3.259 N/A ILE 239.A N GLN 235.A O no hydrogen 3.309 N/A ALA 240.A N LEU 236.A O no hydrogen 2.998 N/A LYS 241.A N VAL 237.A O no hydrogen 3.055 N/A VAL 242.A N ILE 239.A O no hydrogen 2.999 N/A LEU 243.A N ILE 239.A O no hydrogen 2.921 N/A GLY 244.A N ALA 240.A O no hydrogen 2.733 N/A THR 245.A N HIS 270.A O no hydrogen 2.902 N/A THR 245.A OG1 HIS 270.A O no hydrogen 3.015 N/A ASN 249.A N THR 245.A O no hydrogen 2.827 N/A ALA 250.A N ASP 246.A O no hydrogen 2.921 N/A TYR 251.A N GLY 247.A O no hydrogen 2.850 N/A LEU 252.A N LEU 248.A O no hydrogen 2.802 N/A ASN 253.A N ASN 249.A O no hydrogen 2.893 N/A LYS 254.A N ALA 250.A O no hydrogen 2.921 N/A LYS 254.A NZ TYR 255.A OH no hydrogen 3.547 N/A LYS 254.A NZ ASP 302.A OD2 no hydrogen 2.658 N/A TYR 255.A N TYR 251.A O no hydrogen 3.285 N/A TYR 255.A OH ASP 302.A OD1 no hydrogen 2.603 N/A ARG 256.A N ASN 253.A O no hydrogen 3.113 N/A ILE 257.A N LEU 252.A O no hydrogen 2.777 N/A GLU 264.A N ASP 260.A O no hydrogen 2.889 N/A ALA 265.A N PRO 261.A O no hydrogen 3.027 N/A LEU 266.A N GLN 262.A O no hydrogen 3.028 N/A VAL 267.A N LEU 263.A O no hydrogen 2.863 N/A GLY 268.A N GLU 264.A O no hydrogen 3.169 N/A ARG 269.A NH1 ASP 246.A OD2 no hydrogen 3.506 N/A HIS 270.A N THR 245.A OG1 no hydrogen 2.915 N/A LYS 273.A N VAL 242.A O no hydrogen 2.788 N/A LYS 273.A NZ LYS 241.A O no hydrogen 3.084 N/A LYS 273.A NZ SER 271.A O no hydrogen 2.577 N/A TRP 275.A NE1 ASP 296.A OD1 no hydrogen 2.815 N/A LYS 277.A N PRO 274.A O no hydrogen 3.088 N/A PHE 278.A N TRP 275.A O no hydrogen 3.175 N/A MET 279.A N LEU 276.A O no hydrogen 3.053 N/A ASN 280.A N ASN 283.A OD1 no hydrogen 2.756 N/A ASP 282.A N ASN 280.A OD1 no hydrogen 2.813 N/A ASN 283.A N ASN 280.A O no hydrogen 2.726 N/A ASN 283.A N ASN 280.A OD1 no hydrogen 3.024 N/A ASN 283.A ND2 PHE 221.A O no hydrogen 2.779 N/A ASN 283.A ND2 PHE 278.A O no hydrogen 3.076 N/A GLN 284.A N ASN 280.A O no hydrogen 2.701 N/A LEU 286.A N ASN 283.A O no hydrogen 2.669 N/A ALA 291.A N SER 288.A OG no hydrogen 3.391 N/A ILE 292.A N SER 288.A O no hydrogen 2.971 N/A ASP 293.A N PRO 289.A O no hydrogen 2.845 N/A PHE 294.A N GLU 290.A O no hydrogen 2.906 N/A LEU 295.A N ALA 291.A O no hydrogen 2.920 N/A ASP 296.A N ILE 292.A O no hydrogen 2.922 N/A LYS 297.A N ASP 293.A O no hydrogen 3.211 N/A LYS 297.A N PHE 294.A O no hydrogen 3.088 N/A LYS 297.A NZ ASP 293.A OD2 no hydrogen 2.984 N/A LEU 298.A N LEU 295.A O no hydrogen 2.824 N/A LEU 299.A N LEU 295.A O no hydrogen 2.982 N/A ARG 300.A N LEU 298.A O no hydrogen 3.027 N/A ARG 300.A NE ASP 296.A O no hydrogen 2.856 N/A ARG 300.A NH1 GLU 305.A OE1 no hydrogen 3.340 N/A ARG 300.A NH2 ASP 296.A OD2 no hydrogen 3.358 N/A TYR 301.A OH GLY 244.A O no hydrogen 2.705 N/A HIS 303.A NE2 SER 2.A OG no hydrogen 2.780 N/A GLN 304.A N ASP 302.A OD1 no hydrogen 3.001 N/A GLU 305.A N ASP 302.A O no hydrogen 2.872 N/A ARG 306.A N HIS 303.A O no hydrogen 3.333 N/A ARG 306.A NE ARG 300.A O no hydrogen 2.887 N/A ARG 306.A NH1 GLU 195.A OE1 no hydrogen 3.476 N/A ARG 306.A NH1 GLU 195.A OE2 no hydrogen 2.799 N/A ARG 306.A NH1 SER 206.A O no hydrogen 2.917 N/A ARG 306.A NH2 GLU 195.A OE1 no hydrogen 2.685 N/A ARG 306.A NH2 GLU 195.A OE2 no hydrogen 3.505 N/A ARG 306.A NH2 ARG 300.A O no hydrogen 3.313 N/A ARG 306.A NH2 TYR 301.A O no hydrogen 3.004 N/A LEU 307.A N LYS 297.A O no hydrogen 3.159 N/A THR 308.A N GLU 311.A OE1 no hydrogen 3.037 N/A THR 308.A OG1 GLU 311.A OE1 no hydrogen 3.409 N/A GLU 311.A N THR 308.A OG1 no hydrogen 3.071 N/A ALA 312.A N THR 308.A O no hydrogen 2.860 N/A MET 313.A N ALA 309.A O no hydrogen 3.068 N/A THR 314.A N GLU 311.A O no hydrogen 2.980 N/A THR 314.A OG1 GLU 311.A O no hydrogen 2.793 N/A HIS 315.A N ALA 312.A O no hydrogen 3.102 N/A HIS 315.A NE2 ASP 293.A OD2 no hydrogen 2.612 N/A TYR 317.A N HIS 315.A ND1 no hydrogen 2.898 N/A PHE 318.A N HIS 315.A O no hydrogen 2.854 N/A GLN 319.A N PRO 316.A O no hydrogen 3.052 N/A ARG 322.A N PHE 318.A O no hydrogen 2.978 N/A ARG 322.A NH1 MET 313.A O no hydrogen 2.717 N/A ARG 322.A NH1 HIS 315.A O no hydrogen 2.889 N/A ALA 323.A N GLN 319.A O no hydrogen 2.986 N/A ALA 324.A N GLN 320.A O no hydrogen 2.908 N/A GLU 325.A N VAL 321.A O no hydrogen 3.041 N/A ASN 326.A N ARG 322.A O no hydrogen 2.729 N/A SER 327.A OG ALA 323.A O no hydrogen 2.937 N/A