Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4we4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 9.A ND1 HIS 10.A O no hydrogen 3.200 N/A VAL 12.A N ASN 314.A OD1 no hydrogen 2.912 N/A THR 16.A N VAL 28.A O no hydrogen 2.994 N/A VAL 18.A N ILE 26.A O no hydrogen 2.781 N/A THR 20.A N ASP 23.A O no hydrogen 2.908 N/A ASP 23.A N THR 20.A OG1 no hydrogen 2.919 N/A ILE 26.A N VAL 18.A O no hydrogen 2.937 N/A VAL 28.A N THR 16.A O no hydrogen 2.855 N/A THR 29.A N MET 312.A O no hydrogen 2.883 N/A THR 32.A N LEU 308.A O no hydrogen 2.843 N/A LEU 34.A N LEU 306.A O no hydrogen 2.937 N/A VAL 35.A N GLU 33.A OE2 no hydrogen 2.833 N/A GLN 36.A N PHE 286.A O no hydrogen 2.681 N/A GLN 36.A NE2 SER 38.A O no hydrogen 3.185 N/A SER 39.A OG SER 279.A O no hydrogen 2.952 N/A GLY 41.A N SER 39.A OG no hydrogen 3.251 N/A LYS 42.A N THR 40.A OG1 no hydrogen 3.296 N/A ILE 43.A N PRO 265.A O no hydrogen 2.960 N/A CYS 44.A N SER 279.A OG no hydrogen 2.755 N/A ASN 45.A N ASP 267.A O no hydrogen 3.097 N/A ASN 46.A N CYS 269.A O no hydrogen 3.294 N/A HIS 48.A NE2 GLU 272.A O no hydrogen 2.797 N/A ARG 49.A N ASP 77.A OD2 no hydrogen 2.778 N/A ARG 49.A NE THR 75.A O no hydrogen 2.940 N/A ARG 49.A NH2 GLU 74.A OE2 no hydrogen 2.791 N/A LEU 51.A N LEU 78.A O no hydrogen 3.023 N/A GLY 53.A N VAL 80.A O no hydrogen 2.942 N/A ILE 54.A N ASP 52.A OD1 no hydrogen 2.913 N/A CYS 56.A N GLY 53.A O no hydrogen 2.748 N/A CYS 56.A SG HIS 67.A O no hydrogen 3.453 N/A LEU 58.A N GLU 81.A OE2 no hydrogen 2.916 N/A ASP 60.A N THR 57.A OG1 no hydrogen 3.170 N/A ALA 61.A N THR 57.A O no hydrogen 3.098 N/A LEU 62.A N LEU 58.A O no hydrogen 2.891 N/A LEU 63.A N ILE 59.A O no hydrogen 3.000 N/A GLY 64.A N ASP 60.A O no hydrogen 3.220 N/A ASP 65.A N ASP 60.A O no hydrogen 3.219 N/A HIS 67.A NE2 ASP 55.A O no hydrogen 3.286 N/A CYS 68.A N ASP 65.A O no hydrogen 2.631 N/A ASP 69.A N PRO 66.A O no hydrogen 2.914 N/A PHE 71.A N CYS 68.A O no hydrogen 3.067 N/A GLN 72.A N ASP 69.A O no hydrogen 3.229 N/A THR 75.A N GLU 74.A OE2 no hydrogen 3.440 N/A TRP 76.A N GLY 108.A O no hydrogen 3.126 N/A TRP 76.A NE1 ALA 105.A O no hydrogen 3.128 N/A ASP 77.A N ARG 49.A O no hydrogen 2.918 N/A LEU 78.A N ARG 49.A O no hydrogen 3.211 N/A PHE 79.A N SER 258.A O no hydrogen 3.044 N/A VAL 80.A N LEU 51.A O no hydrogen 2.873 N/A GLU 81.A N MET 260.A O no hydrogen 2.896 N/A ARG 82.A NE ASP 52.A OD1 no hydrogen 2.783 N/A ARG 82.A NH1 SER 262.A O no hydrogen 2.772 N/A ARG 82.A NH1 ALA 264.A O no hydrogen 2.713 N/A ARG 82.A NH2 ASP 52.A OD2 no hydrogen 3.084 N/A ARG 82.A NH2 ALA 264.A O no hydrogen 3.077 N/A SER 83.A N ASP 263.A OD1 no hydrogen 2.978 N/A SER 83.A OG ASP 263.A OD1 no hydrogen 3.150 N/A SER 83.A OG ASP 263.A OD2 no hydrogen 2.451 N/A ALA 85.A N ARG 82.A O no hydrogen 3.430 N/A PHE 86.A N ASP 55.A O no hydrogen 3.031 N/A SER 87.A OG ASP 60.A OD1 no hydrogen 3.530 N/A SER 87.A OG ASP 60.A OD2 no hydrogen 2.532 N/A ASN 88.A N ASP 65.A OD2 no hydrogen 2.743 N/A TYR 90.A OH HIS 175.A NE2 no hydrogen 2.905 N/A TYR 92.A OH ASP 60.A OD1 no hydrogen 2.461 N/A ASP 93.A N ILE 222.A O no hydrogen 3.027 N/A SER 99.A N ASP 96.A O no hydrogen 3.073 N/A SER 99.A OG ASP 96.A OD1 no hydrogen 2.995 N/A SER 99.A OG ASP 96.A OD2 no hydrogen 2.913 N/A LEU 100.A N ASP 96.A O no hydrogen 3.340 N/A ARG 101.A N TYR 97.A O no hydrogen 2.932 N/A ARG 101.A NE GLU 81.A OE1 no hydrogen 2.869 N/A ARG 101.A NE GLU 81.A OE2 no hydrogen 3.444 N/A ARG 101.A NH2 GLU 81.A OE1 no hydrogen 2.659 N/A SER 102.A N ALA 98.A O no hydrogen 2.939 N/A LEU 103.A N SER 99.A O no hydrogen 2.976 N/A VAL 104.A N LEU 100.A O no hydrogen 3.136 N/A ALA 105.A N ARG 101.A O no hydrogen 2.949 N/A SER 106.A N SER 102.A O no hydrogen 2.869 N/A SER 107.A N LEU 103.A O no hydrogen 2.960 N/A GLY 108.A N VAL 104.A O no hydrogen 2.961 N/A THR 109.A OG1 GLY 108.A O no hydrogen 3.227 N/A LEU 110.A N GLU 74.A O no hydrogen 2.745 N/A PHE 112.A N ASN 73.A OD1 no hydrogen 3.184 N/A ILE 113.A N TYR 249.A O no hydrogen 2.918 N/A GLU 115.A N ARG 247.A O no hydrogen 2.832 N/A PHE 117.A N GLU 115.A O no hydrogen 2.717 N/A THR 123.A N THR 147.A O no hydrogen 2.835 N/A THR 123.A OG1 LYS 148.A O no hydrogen 2.647 N/A ASN 125.A N ASN 144.A OD1 no hydrogen 2.797 N/A GLY 126.A N TRP 145.A O no hydrogen 3.137 N/A SER 128.A N GLY 138.A O no hydrogen 2.730 N/A ALA 130.A N SER 128.A OG no hydrogen 3.210 N/A CYS 131.A N SER 128.A O no hydrogen 3.173 N/A LYS 132.A NZ ASN 129.A O no hydrogen 2.723 N/A ARG 133.A NE ASP 69.A OD2 no hydrogen 2.830 N/A ARG 133.A NH1 PHE 139.A O no hydrogen 2.790 N/A ARG 133.A NH2 ASP 69.A OD1 no hydrogen 3.474 N/A ARG 133.A NH2 PHE 139.A O no hydrogen 3.062 N/A GLY 138.A N SER 128.A O no hydrogen 3.043 N/A SER 141.A N GLY 64.A O no hydrogen 3.118 N/A ARG 142.A N LEU 63.A O no hydrogen 3.013 N/A LEU 143.A N PHE 140.A O no hydrogen 3.197 N/A ASN 144.A N ALA 245.A O no hydrogen 2.654 N/A ASN 144.A ND2 GLN 124.A OE1 no hydrogen 2.766 N/A TRP 145.A NE1 TYR 187.A OH no hydrogen 2.909 N/A THR 147.A N THR 123.A O no hydrogen 3.026 N/A LYS 148.A N LEU 186.A O no hydrogen 2.563 N/A LYS 148.A NZ SER 185.A O no hydrogen 3.178 N/A SER 149.A N THR 152.A O no hydrogen 2.978 N/A THR 152.A N SER 149.A O no hydrogen 3.080 N/A LEU 156.A N SER 239.A O no hydrogen 2.695 N/A VAL 158.A N ILE 237.A O no hydrogen 3.001 N/A MET 160.A N LEU 235.A O no hydrogen 2.898 N/A ASN 162.A N ASP 233.A O no hydrogen 3.063 N/A ASN 162.A ND2 PHE 166.A O no hydrogen 2.890 N/A ASN 162.A ND2 VAL 229.A O no hydrogen 2.927 N/A ASP 164.A N ASN 162.A OD1 no hydrogen 2.949 N/A LYS 168.A N VAL 229.A O no hydrogen 2.938 N/A LYS 168.A NZ GLU 115.A OE2 no hydrogen 2.450 N/A LYS 168.A NZ PRO 161.A O no hydrogen 3.249 N/A LEU 169.A N PHE 250.A O no hydrogen 2.923 N/A TYR 170.A N THR 227.A O no hydrogen 2.703 N/A TYR 170.A OH GLU 115.A OE1 no hydrogen 2.733 N/A TYR 170.A OH GLU 115.A OE2 no hydrogen 3.238 N/A TRP 172.A N TYR 225.A O no hydrogen 3.022 N/A TRP 172.A NE1 THR 227.A OG1 no hydrogen 2.687 N/A GLY 173.A N ILE 244.A O no hydrogen 2.868 N/A ILE 174.A N SER 223.A O no hydrogen 2.896 N/A HIS 175.A N ASN 242.A O no hydrogen 2.934 N/A HIS 175.A ND1 TYR 187.A OH no hydrogen 2.374 N/A HIS 175.A NE2 TYR 90.A OH no hydrogen 2.905 N/A HIS 176.A N ARG 221.A O no hydrogen 2.629 N/A HIS 176.A NE2 SER 223.A OG no hydrogen 2.795 N/A SER 178.A N GLU 182.A OE1 no hydrogen 2.706 N/A SER 178.A OG GLU 182.A OE1 no hydrogen 2.927 N/A SER 178.A OG SER 219.A OG no hydrogen 3.180 N/A SER 178.A OG SER 220.A OG no hydrogen 3.419 N/A GLU 182.A N THR 179.A OG1 no hydrogen 2.962 N/A GLN 183.A N THR 179.A O no hydrogen 2.800 N/A GLN 183.A NE2 GLN 189.A O no hydrogen 3.293 N/A GLN 183.A NE2 ASN 242.A OD1 no hydrogen 3.215 N/A THR 184.A N ASN 180.A O no hydrogen 3.003 N/A THR 184.A OG1 ASN 180.A O no hydrogen 3.347 N/A THR 184.A OG1 GLN 181.A O no hydrogen 3.478 N/A SER 185.A N GLN 181.A O no hydrogen 3.035 N/A SER 185.A OG GLN 181.A O no hydrogen 2.194 N/A TYR 187.A OH HIS 175.A ND1 no hydrogen 2.374 N/A VAL 188.A N THR 184.A O no hydrogen 3.160 N/A GLN 189.A N TYR 187.A O no hydrogen 2.557 N/A GLN 189.A NE2 TYR 153.A O no hydrogen 3.017 N/A GLN 189.A NE2 ASN 240.A O no hydrogen 2.776 N/A VAL 194.A N ILE 205.A O no hydrogen 3.013 N/A THR 195.A N ASN 238.A O no hydrogen 2.638 N/A THR 195.A OG1 THR 204.A OG1 no hydrogen 2.626 N/A VAL 196.A N GLN 203.A O no hydrogen 3.091 N/A SER 197.A N VAL 236.A O no hydrogen 2.876 N/A SER 197.A OG VAL 236.A O no hydrogen 3.458 N/A THR 198.A N SER 201.A O no hydrogen 2.805 N/A THR 198.A OG1 SER 201.A O no hydrogen 3.502 N/A THR 198.A OG1 SER 201.A OG no hydrogen 2.886 N/A ARG 199.A N ASP 233.A OD1 no hydrogen 3.172 N/A SER 201.A OG THR 198.A OG1 no hydrogen 2.886 N/A GLN 203.A N VAL 196.A O no hydrogen 2.969 N/A GLN 203.A NE2 TRP 226.A O no hydrogen 3.075 N/A THR 204.A OG1 THR 195.A OG1 no hydrogen 2.626 N/A ILE 205.A N VAL 194.A O no hydrogen 2.929 N/A ASN 208.A N HIS 176.A ND1 no hydrogen 2.975 N/A GLY 210.A N PRO 177.A O no hydrogen 3.314 N/A ARG 212.A N SER 219.A O no hydrogen 3.077 N/A ARG 212.A NH1 PRO 177.A O no hydrogen 3.338 N/A ARG 212.A NH1 ASN 208.A O no hydrogen 3.148 N/A ARG 212.A NH1 GLY 210.A O no hydrogen 2.844 N/A ARG 212.A NH2 ASN 208.A O no hydrogen 3.161 N/A VAL 215.A N LEU 218.A O no hydrogen 2.654 N/A ARG 216.A NE CYS 89.A O no hydrogen 2.783 N/A ARG 216.A NH2 CYS 89.A O no hydrogen 3.264 N/A LEU 218.A N VAL 215.A O no hydrogen 2.996 N/A SER 220.A OG SER 178.A OG no hydrogen 3.419 N/A SER 220.A OG GLU 182.A OE2 no hydrogen 2.898 N/A ARG 221.A N HIS 176.A O no hydrogen 2.961 N/A ILE 222.A N PRO 91.A O no hydrogen 3.057 N/A SER 223.A N ILE 174.A O no hydrogen 2.854 N/A SER 223.A OG ASP 93.A OD1 no hydrogen 2.985 N/A SER 223.A OG ASP 93.A OD2 no hydrogen 3.256 N/A SER 223.A OG HIS 176.A NE2 no hydrogen 2.795 N/A ILE 224.A N ASP 93.A O no hydrogen 2.908 N/A TYR 225.A N TRP 172.A O no hydrogen 2.801 N/A THR 227.A N TYR 170.A O no hydrogen 2.878 N/A THR 227.A OG1 GLN 203.A OE1 no hydrogen 2.722 N/A VAL 229.A N LYS 168.A O no hydrogen 2.804 N/A LYS 230.A NZ ASP 167.A OD1 no hydrogen 3.263 N/A LYS 230.A NZ ASP 167.A OD2 no hydrogen 3.069 N/A GLY 232.A N ASN 162.A O no hydrogen 3.025 N/A ASP 233.A N LYS 230.A O no hydrogen 3.111 N/A VAL 234.A N ASP 233.A OD1 no hydrogen 2.539 N/A LEU 235.A N MET 160.A O no hydrogen 2.794 N/A VAL 236.A N SER 197.A O no hydrogen 2.826 N/A ILE 237.A N VAL 158.A O no hydrogen 3.050 N/A ASN 238.A N THR 195.A O no hydrogen 2.675 N/A ASN 238.A ND2 ASN 157.A OD1 no hydrogen 3.431 N/A SER 239.A N LEU 156.A O no hydrogen 3.045 N/A SER 239.A OG ARG 193.A O no hydrogen 2.763 N/A GLY 241.A N SER 239.A OG no hydrogen 3.110 N/A ASN 242.A ND2 HIS 175.A O no hydrogen 2.951 N/A ASN 242.A ND2 GLN 183.A OE1 no hydrogen 2.964 N/A ILE 244.A N GLY 173.A O no hydrogen 2.792 N/A ALA 245.A N ASN 144.A O no hydrogen 2.945 N/A ARG 247.A NE LEU 143.A O no hydrogen 2.824 N/A ARG 247.A NH2 ASN 125.A OD1 no hydrogen 2.996 N/A ARG 247.A NH2 LEU 143.A O no hydrogen 3.390 N/A TYR 249.A N ILE 113.A O no hydrogen 3.088 N/A PHE 250.A N LEU 169.A O no hydrogen 2.756 N/A LYS 251.A N GLU 111.A O no hydrogen 3.004 N/A MET 252.A N ASP 167.A O no hydrogen 3.306 N/A ARG 253.A N SER 107.A OG no hydrogen 3.046 N/A ARG 253.A NH1 GLU 111.A OE2 no hydrogen 2.792 N/A ARG 253.A NH2 GLU 111.A OE2 no hydrogen 3.038 N/A SER 257.A OG TRP 76.A O no hydrogen 2.549 N/A SER 258.A N ASP 77.A O no hydrogen 2.936 N/A ILE 259.A N SER 258.A OG no hydrogen 2.689 N/A MET 260.A N PHE 79.A O no hydrogen 2.799 N/A SER 262.A N GLU 81.A O no hydrogen 3.124 N/A SER 262.A OG PRO 276.A O no hydrogen 2.730 N/A ALA 264.A N SER 262.A OG no hydrogen 3.067 N/A ASP 267.A N ILE 43.A O no hydrogen 2.754 N/A THR 268.A N ASP 267.A OD1 no hydrogen 2.835 N/A CYS 269.A SG ASP 267.A O no hydrogen 3.676 N/A SER 271.A N ASN 46.A O no hydrogen 2.825 N/A SER 271.A OG CYS 273.A O no hydrogen 3.222 N/A ILE 274.A N TYR 294.A O no hydrogen 2.981 N/A THR 275.A N GLY 278.A O no hydrogen 3.120 N/A THR 275.A OG1 GLY 278.A O no hydrogen 2.574 N/A GLY 278.A N THR 275.A O no hydrogen 2.955 N/A SER 279.A N LYS 42.A O no hydrogen 2.765 N/A SER 279.A OG LYS 42.A O no hydrogen 3.186 N/A ILE 280.A N CYS 273.A O no hydrogen 3.321 N/A ASN 282.A ND2 ALA 296.A O no hydrogen 3.232 N/A LYS 284.A NZ GLN 36.A OE1 no hydrogen 3.556 N/A LYS 284.A NZ ASP 283.A OD2 no hydrogen 2.949 N/A PHE 286.A N LEU 34.A O no hydrogen 3.085 N/A GLN 287.A N LYS 299.A O no hydrogen 2.964 N/A GLN 287.A NE2 ASN 290.A O no hydrogen 2.792 N/A GLN 287.A NE2 PRO 298.A O no hydrogen 3.649 N/A ASN 288.A N GLN 36.A O no hydrogen 2.942 N/A VAL 289.A N GLN 287.A OE1 no hydrogen 2.901 N/A ASN 290.A N GLN 287.A OE1 no hydrogen 3.135 N/A ASN 290.A ND2 ASN 277.A OD1 no hydrogen 2.939 N/A ILE 292.A N ASN 290.A OD1 no hydrogen 2.743 N/A TYR 294.A N ILE 274.A O no hydrogen 2.885 N/A TYR 294.A OH LYS 256.A O no hydrogen 2.609 N/A CYS 297.A SG TYR 294.A O no hydrogen 3.420 N/A CYS 297.A SG GLY 295.A O no hydrogen 3.507 N/A LYS 299.A N PRO 285.A O no hydrogen 3.081 N/A VAL 301.A N GLN 287.A O no hydrogen 2.943 N/A GLN 303.A N GLN 303.A OE1 no hydrogen 2.819 N/A THR 305.A OG1 GLU 33.A OE1 no hydrogen 2.299 N/A THR 305.A OG1 GLU 33.A OE2 no hydrogen 3.338 N/A LEU 306.A N GLU 33.A OE2 no hydrogen 2.791 N/A LEU 308.A N THR 32.A O no hydrogen 2.898 N/A THR 310.A N ASN 30.A O no hydrogen 2.921 N/A ASN 314.A N GLU 27.A O no hydrogen 2.947 N/A ASN 314.A ND2 VAL 12.A O no hydrogen 3.035 N/A ASN 314.A ND2 GLU 27.A OE1 no hydrogen 2.861 N/A