Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4tqu_S.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A N ASP 64.A OD1 no hydrogen 3.099 N/A SER 6.A N ARG 62.A O no hydrogen 2.883 N/A ILE 7.A N LEU 25.A O no hydrogen 2.838 N/A GLN 8.A N THR 60.A O no hydrogen 2.769 N/A GLN 8.A NE2 SER 6.A OG no hydrogen 3.193 N/A ASN 9.A N SER 24.A OG no hydrogen 2.541 N/A VAL 10.A N VAL 23.A O no hydrogen 2.913 N/A VAL 11.A N GLY 58.A O no hydrogen 2.912 N/A LYS 12.A N VAL 20.A O no hydrogen 3.305 N/A LYS 12.A NZ GLU 55.A O no hydrogen 2.256 N/A ARG 13.A N SER 57.A OG no hydrogen 2.979 N/A TYR 14.A OH GLU 54.A OE1 no hydrogen 3.239 N/A TYR 14.A OH GLU 54.A OE2 no hydrogen 2.734 N/A THR 18.A OG1 THR 17.A O no hydrogen 2.499 N/A THR 18.A OG1 THR 18.A O no hydrogen 2.473 N/A VAL 20.A N LYS 12.A O no hydrogen 3.412 N/A HIS 21.A N GLY 211.A O no hydrogen 3.020 N/A LEU 25.A N ILE 7.A O no hydrogen 2.882 N/A ILE 27.A N VAL 5.A O no hydrogen 2.857 N/A GLU 28.A N GLU 31.A OE1 no hydrogen 2.829 N/A GLY 30.A N THR 187.A OG1 no hydrogen 2.839 N/A PHE 32.A N ASP 203.A OD2 no hydrogen 2.884 N/A VAL 33.A N VAL 188.A O no hydrogen 2.940 N/A VAL 34.A N ARG 204.A O no hydrogen 3.132 N/A LEU 35.A N TYR 190.A O no hydrogen 2.837 N/A VAL 36.A N VAL 206.A O no hydrogen 3.108 N/A CYS 41.A SG PRO 38.A O no hydrogen 3.211 N/A CYS 41.A SG MET 208.A O no hydrogen 3.592 N/A SER 44.A OG ASP 159.A OD1 no hydrogen 2.751 N/A SER 44.A OG ASP 159.A OD2 no hydrogen 2.929 N/A THR 46.A N GLY 42.A O no hydrogen 2.599 N/A THR 46.A OG1 GLY 42.A O no hydrogen 2.620 N/A LEU 47.A N LYS 43.A O no hydrogen 2.976 N/A ARG 48.A N SER 44.A O no hydrogen 2.827 N/A ARG 48.A NE GLU 54.A OE1 no hydrogen 2.876 N/A MET 49.A N THR 45.A O no hydrogen 2.947 N/A VAL 50.A N THR 46.A O no hydrogen 2.934 N/A ALA 51.A N LEU 47.A O no hydrogen 2.930 N/A GLY 52.A N ARG 48.A O no hydrogen 2.828 N/A LEU 53.A N ARG 48.A O no hydrogen 3.094 N/A SER 57.A OG ARG 13.A O no hydrogen 3.259 N/A THR 60.A N GLN 8.A O no hydrogen 3.067 N/A ILE 61.A N ASN 69.A OD1 no hydrogen 3.099 N/A ARG 62.A N SER 6.A O no hydrogen 2.876 N/A ILE 63.A N ARG 66.A O no hydrogen 3.021 N/A ASP 64.A N SER 4.A O no hydrogen 2.639 N/A ARG 66.A NH2 ASP 75.A O no hydrogen 2.391 N/A ILE 68.A N ILE 61.A O no hydrogen 3.417 N/A ASN 69.A ND2 GLY 59.A O no hydrogen 3.327 N/A LEU 71.A N ILE 68.A O no hydrogen 3.208 N/A ASP 75.A N ALA 72.A O no hydrogen 2.842 N/A ARG 76.A N PRO 73.A O no hydrogen 3.239 N/A ARG 76.A NE VAL 50.A O no hydrogen 2.978 N/A ALA 79.A N VAL 155.A O no hydrogen 3.228 N/A VAL 81.A N LEU 157.A O no hydrogen 2.791 N/A GLN 83.A NE2 ASN 164.A OD1 no hydrogen 3.350 N/A TYR 88.A N ASN 96.A OD1 no hydrogen 2.677 N/A LEU 91.A N TYR 88.A O no hydrogen 3.277 N/A ASN 92.A ND2 ASP 95.A OD2 no hydrogen 2.440 N/A VAL 93.A N ARG 130.A O no hydrogen 3.129 N/A ARG 94.A N LEU 128.A O no hydrogen 3.034 N/A ARG 94.A NE GLU 129.A OE1 no hydrogen 3.188 N/A ARG 94.A NH1 GLU 129.A OE1 no hydrogen 3.201 N/A ASP 95.A N ASN 92.A OD1 no hydrogen 3.059 N/A ASN 96.A N ASN 92.A O no hydrogen 2.712 N/A ASN 96.A ND2 TYR 88.A O no hydrogen 3.304 N/A ASN 96.A ND2 ASN 92.A O no hydrogen 3.212 N/A ILE 97.A N VAL 93.A O no hydrogen 2.912 N/A SER 98.A N ARG 94.A O no hydrogen 2.897 N/A SER 98.A OG ARG 94.A O no hydrogen 3.263 N/A SER 98.A OG ASP 95.A O no hydrogen 3.487 N/A ARG 102.A N SER 98.A O no hydrogen 2.866 N/A ARG 102.A N PHE 99.A O no hydrogen 2.952 N/A ARG 102.A NH1 ASP 95.A O no hydrogen 2.505 N/A ARG 102.A NH1 SER 98.A OG no hydrogen 2.483 N/A LEU 103.A N PHE 99.A O no hydrogen 3.011 N/A LEU 103.A N GLY 100.A O no hydrogen 3.240 N/A ARG 105.A NE ARG 102.A O no hydrogen 3.010 N/A THR 106.A OG1 ARG 105.A O no hydrogen 2.292 N/A ASP 112.A N LYS 108.A O no hydrogen 2.948 N/A ALA 113.A N SER 109.A O no hydrogen 2.935 N/A ALA 114.A N VAL 110.A O no hydrogen 2.977 N/A VAL 115.A N ILE 111.A O no hydrogen 2.928 N/A LYS 116.A N ASP 112.A O no hydrogen 2.920 N/A LYS 116.A NZ ASP 120.A OD2 no hydrogen 2.539 N/A THR 117.A N ALA 113.A O no hydrogen 2.999 N/A THR 117.A OG1 ALA 114.A O no hydrogen 2.377 N/A ALA 118.A N ALA 114.A O no hydrogen 3.021 N/A ALA 119.A N VAL 115.A O no hydrogen 2.902 N/A ASP 120.A N LYS 116.A O no hydrogen 2.972 N/A ILE 121.A N THR 117.A O no hydrogen 2.964 N/A LEU 122.A N ALA 118.A O no hydrogen 2.992 N/A LEU 124.A N ALA 119.A O no hydrogen 2.814 N/A LEU 127.A N LEU 124.A O no hydrogen 2.955 N/A LEU 128.A N GLN 125.A O no hydrogen 3.372 N/A ARG 130.A N LEU 127.A O no hydrogen 3.240 N/A LYS 131.A NZ HIS 90.A O no hydrogen 2.896 N/A SER 136.A N GLN 139.A OE1 no hydrogen 2.585 N/A ARG 140.A N SER 136.A O no hydrogen 2.692 N/A ARG 140.A NE PRO 132.A O no hydrogen 3.288 N/A ARG 140.A NH1 PRO 132.A O no hydrogen 3.301 N/A ARG 140.A NH1 SER 133.A O no hydrogen 3.518 N/A GLN 141.A N GLY 137.A O no hydrogen 2.930 N/A GLN 141.A NE2 PHE 82.A O no hydrogen 2.890 N/A ARG 142.A N GLY 138.A O no hydrogen 2.874 N/A VAL 143.A N GLN 139.A O no hydrogen 2.930 N/A ALA 144.A N ARG 140.A O no hydrogen 2.931 N/A MET 145.A N GLN 141.A O no hydrogen 2.921 N/A GLY 146.A N ARG 142.A O no hydrogen 2.896 N/A ARG 147.A N VAL 143.A O no hydrogen 2.935 N/A ARG 147.A NH2 ALA 86.A O no hydrogen 3.345 N/A ALA 148.A N MET 145.A O no hydrogen 2.805 N/A ILE 149.A N MET 145.A O no hydrogen 2.926 N/A VAL 150.A N GLY 146.A O no hydrogen 3.211 N/A ARG 151.A N ALA 148.A O no hydrogen 3.080 N/A LYS 154.A N ASP 77.A O no hydrogen 2.831 N/A LYS 154.A NZ ASP 64.A OD2 no hydrogen 3.421 N/A PHE 156.A N THR 187.A O no hydrogen 2.823 N/A LEU 157.A N ALA 79.A O no hydrogen 2.793 N/A PHE 158.A N ILE 189.A O no hydrogen 2.942 N/A ASP 159.A N VAL 81.A O no hydrogen 3.157 N/A GLN 160.A N VAL 191.A O no hydrogen 2.865 N/A GLN 160.A NE2 SER 163.A OG no hydrogen 2.883 N/A SER 163.A N GLN 160.A O no hydrogen 3.077 N/A ASN 164.A ND2 ASN 84.A OD1 no hydrogen 2.566 N/A LEU 165.A N LEU 162.A O no hydrogen 3.036 N/A LEU 169.A N ASP 166.A OD1 no hydrogen 3.143 N/A ARG 170.A N ASP 166.A O no hydrogen 2.823 N/A ARG 170.A NH1 LEU 165.A O no hydrogen 3.037 N/A THR 171.A N ALA 167.A O no hydrogen 2.974 N/A MET 173.A N LEU 169.A O no hydrogen 2.860 N/A ARG 174.A N ARG 170.A O no hydrogen 2.900 N/A ALA 175.A N THR 171.A O no hydrogen 3.011 N/A GLU 176.A N GLN 172.A O no hydrogen 2.901 N/A ILE 177.A N MET 173.A O no hydrogen 2.841 N/A LYS 178.A N ARG 174.A O no hydrogen 3.009 N/A LYS 178.A NZ THR 200.A O no hydrogen 3.416 N/A ARG 179.A N ALA 175.A O no hydrogen 2.941 N/A LEU 180.A N GLU 176.A O no hydrogen 2.870 N/A HIS 181.A N ILE 177.A O no hydrogen 2.898 N/A GLN 182.A N LYS 178.A O no hydrogen 2.986 N/A ARG 183.A N ARG 179.A O no hydrogen 2.970 N/A LEU 184.A N LEU 180.A O no hydrogen 2.867 N/A THR 187.A OG1 ALA 3.A O no hydrogen 2.538 N/A VAL 188.A N GLU 31.A O no hydrogen 3.130 N/A ILE 189.A N PHE 156.A O no hydrogen 3.000 N/A TYR 190.A N VAL 33.A O no hydrogen 2.922 N/A TYR 190.A OH GLU 197.A OE1 no hydrogen 2.519 N/A VAL 191.A N PHE 158.A O no hydrogen 2.752 N/A THR 192.A N LEU 35.A O no hydrogen 2.961 N/A VAL 196.A N ASP 194.A OD1 no hydrogen 3.312 N/A ALA 198.A N ASP 194.A O no hydrogen 3.473 N/A MET 199.A N GLN 195.A O no hydrogen 2.893 N/A THR 200.A N VAL 196.A O no hydrogen 2.916 N/A THR 200.A OG1 VAL 196.A O no hydrogen 3.167 N/A THR 200.A OG1 GLU 197.A O no hydrogen 3.174 N/A LEU 201.A N GLU 197.A O no hydrogen 2.942 N/A ALA 202.A N ALA 198.A O no hydrogen 3.162 N/A ASP 203.A N PHE 32.A O no hydrogen 2.737 N/A ARG 204.A N PHE 32.A O no hydrogen 3.417 N/A ARG 204.A NH2 ASP 26.A O no hydrogen 2.545 N/A ILE 205.A N GLY 217.A O no hydrogen 2.865 N/A VAL 206.A N VAL 34.A O no hydrogen 2.926 N/A VAL 207.A N GLN 215.A O no hydrogen 2.962 N/A MET 208.A N VAL 36.A O no hydrogen 2.799 N/A ARG 209.A N LEU 212.A O no hydrogen 2.935 N/A LEU 212.A N ARG 209.A O no hydrogen 2.939 N/A GLU 214.A N VAL 207.A O no hydrogen 2.856 N/A GLN 215.A N VAL 207.A O no hydrogen 3.429 N/A GLN 215.A NE2 HIS 225.A O no hydrogen 3.511 N/A GLY 217.A N ILE 205.A O no hydrogen 3.059 N/A LYS 218.A N ASP 221.A OD2 no hydrogen 3.206 N/A ASP 221.A N LYS 218.A O no hydrogen 2.880 N/A LEU 222.A N LYS 218.A O no hydrogen 3.184 N/A PHE 223.A N PRO 219.A O no hydrogen 2.932 N/A LEU 224.A N MET 220.A O no hydrogen 2.893 N/A HIS 225.A N ASP 221.A O no hydrogen 2.742 N/A ALA 227.A N GLN 215.A OE1 no hydrogen 2.847 N/A VAL 231.A N ASN 228.A OD1 no hydrogen 2.837 N/A ALA 232.A N ASN 228.A O no hydrogen 3.281 N/A SER 233.A N THR 229.A O no hydrogen 2.935 N/A PHE 234.A N VAL 231.A O no hydrogen 3.361 N/A ILE 235.A N VAL 231.A O no hydrogen 3.343 N/A ASN 241.A N ILE 283.A O no hydrogen 2.877 N/A ASN 241.A ND2 ILE 283.A O no hydrogen 2.556 N/A ASN 241.A ND2 VAL 327.A O no hydrogen 3.187 N/A MET 243.A N PHE 281.A O no hydrogen 2.913 N/A ALA 245.A N VAL 279.A O no hydrogen 2.662 N/A ARG 246.A N GLU 256.A O no hydrogen 2.680 N/A ARG 246.A NH1 GLU 278.A OE1 no hydrogen 3.194 N/A SER 251.A OG THR 252.A OG1 no hydrogen 3.220 N/A THR 252.A N SER 251.A OG no hydrogen 2.585 N/A THR 252.A OG1 SER 251.A OG no hydrogen 3.220 N/A VAL 255.A N ILE 263.A O no hydrogen 2.891 N/A GLU 256.A N ARG 246.A O no hydrogen 3.072 N/A LEU 257.A N ASN 261.A O no hydrogen 3.324 N/A ASN 261.A ND2 LYS 302.A O no hydrogen 3.359 N/A ILE 263.A N VAL 255.A O no hydrogen 2.848 N/A LEU 265.A N GLN 253.A O no hydrogen 2.319 N/A ARG 268.A NH2 VAL 351.A O no hydrogen 2.679 N/A THR 271.A OG1 PRO 267.A O no hydrogen 3.441 N/A THR 271.A OG1 ARG 268.A O no hydrogen 2.980 N/A ALA 274.A N GLN 277.A OE1 no hydrogen 3.020 N/A GLN 277.A N ALA 274.A O no hydrogen 3.321 N/A GLN 277.A NE2 ASP 355.A OD1 no hydrogen 3.160 N/A VAL 279.A N ALA 245.A O no hydrogen 3.407 N/A VAL 280.A N PHE 354.A O no hydrogen 2.833 N/A PHE 281.A N MET 243.A O no hydrogen 2.831 N/A GLY 282.A N HIS 352.A O no hydrogen 2.601 N/A ARG 284.A NH1 PHE 223.A O no hydrogen 3.006 N/A ARG 284.A NH2 ILE 235.A O no hydrogen 3.441 N/A ASP 287.A N ARG 284.A O no hydrogen 2.717 N/A THR 289.A N HIS 345.A O no hydrogen 3.158 N/A GLU 294.A N ASP 291.A O no hydrogen 3.320 N/A SER 296.A OG GLY 295.A O no hydrogen 2.596 N/A SER 296.A OG SER 296.A O no hydrogen 2.513 N/A ALA 299.A N SER 296.A O no hydrogen 2.680 N/A ALA 303.A N VAL 342.A O no hydrogen 2.928 N/A THR 304.A N THR 320.A O no hydrogen 2.970 N/A VAL 305.A N ASP 340.A O no hydrogen 3.352 N/A ASP 306.A N HIS 318.A O no hydrogen 2.853 N/A GLU 309.A N ILE 316.A O no hydrogen 2.926 N/A LEU 311.A N GLU 314.A O no hydrogen 3.383 N/A SER 315.A N VAL 330.A O no hydrogen 2.977 N/A SER 315.A OG GLU 314.A O no hydrogen 2.813 N/A ILE 316.A N GLU 309.A O no hydrogen 2.920 N/A LEU 317.A N VAL 328.A O no hydrogen 2.873 N/A HIS 318.A N ILE 307.A O no hydrogen 2.965 N/A ALA 319.A N LEU 326.A O no hydrogen 2.957 N/A THR 320.A N THR 304.A O no hydrogen 2.848 N/A THR 320.A OG1 THR 304.A O no hydrogen 3.238 N/A VAL 321.A N HIS 324.A O no hydrogen 2.611 N/A HIS 324.A N VAL 321.A O no hydrogen 3.215 N/A VAL 327.A N ASN 241.A OD1 no hydrogen 2.544 N/A VAL 328.A N LEU 317.A O no hydrogen 2.890 N/A LYS 329.A N PRO 285.A O no hydrogen 2.756 N/A VAL 330.A N SER 315.A O no hydrogen 2.911 N/A HIS 337.A ND1 GLU 335.A O no hydrogen 2.319 N/A GLY 339.A N VAL 305.A O no hydrogen 2.985 N/A VAL 342.A N ALA 303.A O no hydrogen 2.865 N/A LEU 344.A N ILE 301.A O no hydrogen 3.326 N/A HIS 345.A N THR 289.A O no hydrogen 3.013 N/A ASP 347.A N ASP 287.A O no hydrogen 3.053 N/A THR 349.A N ASP 347.A OD1 no hydrogen 3.195 N/A HIS 352.A N GLY 282.A O no hydrogen 3.098 N/A HIS 352.A NE2 LEU 224.A O no hydrogen 2.727 N/A PHE 354.A N VAL 280.A O no hydrogen 2.922 N/A ASP 355.A N ALA 360.A O no hydrogen 3.437 N/A ALA 356.A N GLU 278.A O no hydrogen 3.462 N/A SER 358.A OG ASP 355.A OD2 no hydrogen 3.257 N/A TYR 363.A OH LEU 266.A O no hydrogen 2.364 N/A