Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5tw3_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 6.A N ASP 114.A OD2 no hydrogen 3.053 N/A MET 12.A N LYS 9.A O no hydrogen 2.964 N/A LYS 16.A NZ ASP 13.A OD1 no hydrogen 3.307 N/A VAL 17.A N ASN 53.A O no hydrogen 3.163 N/A GLN 19.A NE2 TRP 20.A O no hydrogen 2.715 N/A GLN 19.A NE2 VAL 56.A O no hydrogen 3.157 N/A LYS 26.A NZ GLU 385.A OE2 no hydrogen 3.102 N/A ILE 27.A N THR 23.A O no hydrogen 2.968 N/A LYS 28.A N GLU 24.A O no hydrogen 2.924 N/A ALA 29.A N GLU 25.A O no hydrogen 2.962 N/A LEU 30.A N LYS 26.A O no hydrogen 2.917 N/A VAL 31.A N ILE 27.A O no hydrogen 2.898 N/A GLU 32.A N LYS 28.A O no hydrogen 2.943 N/A ILE 33.A N ALA 29.A O no hydrogen 2.944 N/A CYS 34.A N LEU 30.A O no hydrogen 2.883 N/A CYS 34.A SG LEU 30.A O no hydrogen 3.120 N/A THR 35.A N VAL 31.A O no hydrogen 2.916 N/A THR 35.A OG1 VAL 31.A O no hydrogen 2.650 N/A GLU 36.A N GLU 32.A O no hydrogen 2.988 N/A MET 37.A N ILE 33.A O no hydrogen 2.908 N/A GLU 38.A N CYS 34.A O no hydrogen 2.876 N/A LYS 39.A N THR 35.A O no hydrogen 2.953 N/A GLU 40.A N GLU 36.A O no hydrogen 3.062 N/A GLU 40.A N MET 37.A O no hydrogen 3.254 N/A GLY 41.A N GLU 38.A O no hydrogen 3.179 N/A LYS 42.A N MET 37.A O no hydrogen 3.000 N/A LYS 42.A NZ GLU 40.A OE1 no hydrogen 3.022 N/A SER 44.A N GLN 138.A O no hydrogen 2.916 N/A SER 44.A OG ASN 140.A OD1 no hydrogen 2.520 N/A ILE 46.A N ARG 136.A O no hydrogen 3.194 N/A GLU 49.A N GLU 49.A OE1 no hydrogen 2.756 N/A ASN 50.A N GLY 47.A O no hydrogen 3.355 N/A ASN 50.A ND2 LYS 119.A O no hydrogen 3.233 N/A TYR 52.A N ASN 50.A OD1 no hydrogen 3.275 N/A TYR 52.A OH ASP 13.A OD2 no hydrogen 3.180 N/A ASN 53.A N PRO 15.A O no hydrogen 2.905 N/A ASN 53.A ND2 VAL 17.A O no hydrogen 2.257 N/A THR 54.A OG1 ALA 122.A O no hydrogen 3.380 N/A VAL 56.A N GLN 19.A OE1 no hydrogen 2.847 N/A PHE 57.A N LEU 67.A O no hydrogen 2.894 N/A ILE 59.A N ARG 65.A O no hydrogen 2.877 N/A LYS 60.A NZ SER 61.A O no hydrogen 3.496 N/A ARG 65.A N ILE 59.A O no hydrogen 2.890 N/A LYS 66.A NZ TYR 139.A OH no hydrogen 2.689 N/A LEU 67.A N PHE 57.A O no hydrogen 2.903 N/A ASP 69.A N PRO 55.A O no hydrogen 3.179 N/A ARG 71.A NE ASP 69.A OD1 no hydrogen 2.749 N/A ARG 71.A NE ASP 69.A OD2 no hydrogen 3.322 N/A ARG 71.A NH1 PRO 393.A O no hydrogen 2.808 N/A ARG 71.A NH2 ASP 69.A OD2 no hydrogen 3.040 N/A ASN 74.A N PHE 70.A O no hydrogen 2.858 N/A ASN 74.A ND2 GLY 145.A O no hydrogen 3.550 N/A LYS 75.A N ARG 71.A O no hydrogen 2.956 N/A LYS 75.A NZ GLU 72.A OE1 no hydrogen 3.231 N/A ARG 76.A N GLU 72.A O no hydrogen 3.091 N/A ARG 76.A N LEU 73.A O no hydrogen 3.152 N/A ARG 76.A NE ASP 13.A O no hydrogen 2.951 N/A THR 77.A N ASN 74.A O no hydrogen 3.122 N/A THR 77.A OG1 LEU 73.A O no hydrogen 2.618 N/A THR 77.A OG1 ASN 74.A O no hydrogen 3.550 N/A GLN 78.A N ASN 74.A O no hydrogen 2.798 N/A PHE 80.A N THR 77.A O no hydrogen 2.897 N/A TRP 81.A N GLN 78.A O no hydrogen 2.643 N/A GLN 84.A N PHE 80.A O no hydrogen 3.343 N/A HIS 89.A NE2 ILE 363.A O no hydrogen 2.945 N/A LYS 94.A NZ ALA 91.A O no hydrogen 2.787 N/A LYS 95.A N GLY 92.A O no hydrogen 3.330 N/A LYS 95.A NZ ALA 91.A O no hydrogen 3.539 N/A LYS 96.A NZ ASP 170.A O no hydrogen 3.400 N/A LYS 96.A NZ ASP 185.A OD2 no hydrogen 3.442 N/A LYS 97.A N SER 184.A O no hydrogen 3.135 N/A LYS 97.A N ASP 185.A OD1 no hydrogen 3.179 N/A SER 98.A N SER 184.A O no hydrogen 2.922 N/A SER 98.A OG HIS 216.A ND1 no hydrogen 3.216 N/A VAL 99.A N LEU 215.A O no hydrogen 2.850 N/A THR 100.A N VAL 182.A O no hydrogen 2.900 N/A THR 100.A OG1 HIS 191.A NE2 no hydrogen 2.918 N/A VAL 101.A N TYR 213.A O no hydrogen 3.357 N/A LEU 102.A N LEU 180.A O no hydrogen 2.887 N/A ASP 103.A N ASP 211.A OD2 no hydrogen 3.405 N/A VAL 104.A N ASP 178.A O no hydrogen 2.851 N/A ALA 107.A N VAL 104.A O no hydrogen 3.469 N/A TYR 108.A N GLY 105.A O no hydrogen 2.953 N/A TYR 108.A OH MET 177.A O no hydrogen 2.273 N/A SER 110.A N ALA 107.A O no hydrogen 2.948 N/A SER 110.A OG ALA 107.A O no hydrogen 2.783 N/A VAL 111.A N TYR 108.A O no hydrogen 3.099 N/A LEU 113.A N ASN 140.A O no hydrogen 2.981 N/A PHE 117.A N ASP 114.A O no hydrogen 2.898 N/A ARG 118.A NE LEU 113.A O no hydrogen 3.087 N/A ARG 118.A NH2 LEU 113.A O no hydrogen 3.172 N/A TYR 120.A N PHE 117.A O no hydrogen 3.011 N/A THR 121.A N ARG 118.A O no hydrogen 2.911 N/A THR 121.A OG1 ARG 118.A O no hydrogen 2.728 N/A PHE 123.A N TYR 137.A O no hydrogen 2.896 N/A THR 124.A OG1 ASN 53.A OD1 no hydrogen 2.839 N/A ILE 125.A N ILE 135.A O no hydrogen 2.883 N/A SER 127.A OG THR 132.A O no hydrogen 2.231 N/A GLU 131.A N ILE 128.A O no hydrogen 3.150 N/A THR 132.A N SER 127.A OG no hydrogen 3.185 N/A ILE 135.A N ILE 125.A O no hydrogen 2.918 N/A ARG 136.A NH2 TYR 52.A O no hydrogen 2.406 N/A TYR 137.A N PHE 123.A O no hydrogen 2.944 N/A TYR 137.A OH GLU 38.A OE1 no hydrogen 3.422 N/A GLN 138.A N SER 44.A O no hydrogen 2.891 N/A TYR 139.A N THR 121.A OG1 no hydrogen 2.725 N/A ASN 140.A N LYS 42.A O no hydrogen 2.756 N/A LEU 142.A N VAL 111.A O no hydrogen 2.987 N/A TRP 146.A NE1 THR 77.A OG1 no hydrogen 3.038 N/A LYS 147.A N ASN 74.A OD1 no hydrogen 3.175 N/A SER 149.A N TRP 146.A O no hydrogen 3.261 N/A SER 149.A OG PRO 143.A O no hydrogen 2.589 N/A SER 149.A OG TRP 146.A O no hydrogen 3.502 N/A ILE 152.A N GLY 148.A O no hydrogen 2.916 N/A PHE 153.A N SER 149.A O no hydrogen 2.993 N/A GLN 154.A NE2 GLY 86.A O no hydrogen 3.313 N/A MET 157.A N PHE 153.A O no hydrogen 2.923 N/A THR 158.A N GLN 154.A O no hydrogen 2.901 N/A THR 158.A OG1 GLN 154.A O no hydrogen 3.196 N/A LYS 159.A N SER 155.A O no hydrogen 2.936 N/A ILE 160.A N SER 156.A O no hydrogen 2.935 N/A LEU 161.A N MET 157.A O no hydrogen 2.915 N/A GLU 162.A N THR 158.A O no hydrogen 2.927 N/A LYS 165.A N LEU 161.A O no hydrogen 2.863 N/A LYS 166.A N GLU 162.A O no hydrogen 2.903 N/A GLN 167.A N PRO 163.A O no hydrogen 2.944 N/A ASN 168.A N LYS 165.A O no hydrogen 3.122 N/A ASN 168.A ND2 PHE 164.A O no hydrogen 2.873 N/A ILE 171.A N ASN 168.A O no hydrogen 3.205 N/A VAL 172.A N GLY 183.A O no hydrogen 2.917 N/A TYR 174.A N TYR 181.A O no hydrogen 2.936 N/A TYR 174.A OH GLY 365.A O no hydrogen 3.369 N/A GLN 175.A NE2 MET 177.A O no hydrogen 3.619 N/A TYR 176.A N ASP 179.A O no hydrogen 2.905 N/A ASP 179.A N TYR 176.A O no hydrogen 2.919 N/A LEU 180.A N LEU 102.A O no hydrogen 2.865 N/A TYR 181.A N TYR 174.A O no hydrogen 2.850 N/A VAL 182.A N THR 100.A O no hydrogen 2.906 N/A GLY 183.A N VAL 172.A O no hydrogen 2.885 N/A SER 184.A N SER 98.A O no hydrogen 2.907 N/A SER 184.A OG HIS 191.A ND1 no hydrogen 2.702 N/A LEU 186.A N SER 184.A OG no hydrogen 3.300 N/A HIS 191.A N GLU 187.A O no hydrogen 2.588 N/A HIS 191.A ND1 SER 184.A OG no hydrogen 2.702 N/A HIS 191.A NE2 THR 100.A OG1 no hydrogen 2.918 N/A ARG 192.A N ILE 188.A O no hydrogen 2.901 N/A ARG 192.A NE GLU 214.A OE2 no hydrogen 2.628 N/A ARG 192.A NH2 GLU 214.A OE1 no hydrogen 3.228 N/A THR 193.A N GLY 189.A O no hydrogen 2.924 N/A THR 193.A OG1 GLY 189.A O no hydrogen 3.136 N/A THR 193.A OG1 GLN 190.A O no hydrogen 2.649 N/A LYS 194.A N GLN 190.A O no hydrogen 2.904 N/A LYS 194.A NZ GLU 197.A OE2 no hydrogen 3.441 N/A ILE 195.A N HIS 191.A O no hydrogen 2.867 N/A GLU 196.A N ARG 192.A O no hydrogen 2.931 N/A GLU 197.A N THR 193.A O no hydrogen 2.888 N/A LEU 198.A N LYS 194.A O no hydrogen 2.919 N/A ARG 199.A N ILE 195.A O no hydrogen 2.882 N/A ARG 199.A NH1 THR 209.A O no hydrogen 2.881 N/A ARG 199.A NH2 THR 209.A O no hydrogen 3.496 N/A GLN 200.A N GLU 196.A O no hydrogen 2.909 N/A HIS 201.A N GLU 197.A O no hydrogen 2.900 N/A HIS 201.A NE2 ILE 160.A O no hydrogen 2.655 N/A LEU 202.A N LEU 198.A O no hydrogen 2.893 N/A LEU 203.A N ARG 199.A O no hydrogen 2.900 N/A ARG 204.A N GLN 200.A O no hydrogen 2.909 N/A TRP 205.A N LEU 202.A O no hydrogen 3.222 N/A GLY 206.A N LEU 203.A O no hydrogen 3.027 N/A LEU 207.A N LEU 202.A O no hydrogen 2.831 N/A THR 208.A OG1 ASP 106.A OD2 no hydrogen 2.423 N/A ASP 211.A N THR 209.A O no hydrogen 2.599 N/A LEU 215.A N VAL 99.A O no hydrogen 2.730 N/A HIS 216.A ND1 LYS 97.A O no hydrogen 2.904 N/A LYS 219.A N HIS 216.A O no hydrogen 3.455 N/A TRP 220.A N PRO 217.A O no hydrogen 3.371 N/A GLN 223.A N THR 332.A OG1 no hydrogen 3.093 N/A THR 234.A N ASP 237.A OD2 no hydrogen 3.082 N/A THR 234.A OG1 ASP 237.A OD2 no hydrogen 2.954 N/A VAL 235.A N GLU 272.A O no hydrogen 2.966 N/A ASN 236.A N LEU 270.A O no hydrogen 3.133 N/A ASP 237.A N THR 234.A OG1 no hydrogen 3.292 N/A ILE 238.A N THR 234.A O no hydrogen 3.097 N/A GLN 239.A N VAL 235.A O no hydrogen 2.906 N/A LYS 240.A N ASN 236.A O no hydrogen 2.905 N/A LEU 241.A N ASP 237.A O no hydrogen 2.901 N/A VAL 242.A N ILE 238.A O no hydrogen 2.885 N/A GLY 243.A N GLN 239.A O no hydrogen 2.918 N/A LYS 244.A N LYS 240.A O no hydrogen 2.902 N/A LYS 244.A NZ VAL 226.A O no hydrogen 2.360 N/A LEU 245.A N LEU 241.A O no hydrogen 2.909 N/A ASN 246.A N VAL 242.A O no hydrogen 2.889 N/A TRP 247.A N GLY 243.A O no hydrogen 2.934 N/A ALA 248.A N LYS 244.A O no hydrogen 2.899 N/A SER 249.A N LEU 245.A O no hydrogen 2.925 N/A SER 249.A OG ASN 246.A O no hydrogen 2.359 N/A GLN 250.A N TRP 247.A O no hydrogen 3.124 N/A ILE 251.A N ALA 248.A O no hydrogen 2.874 N/A TYR 252.A N ALA 248.A O no hydrogen 2.864 N/A TYR 252.A OH GLU 293.A O no hydrogen 3.109 N/A SER 261.A N VAL 257.A O no hydrogen 2.784 N/A SER 261.A OG VAL 257.A O no hydrogen 2.597 N/A LYS 262.A N ARG 258.A O no hydrogen 2.916 N/A LEU 264.A N SER 261.A O no hydrogen 3.285 N/A THR 267.A OG1 THR 267.A O no hydrogen 2.326 N/A GLU 272.A N ALA 269.A O no hydrogen 3.262 N/A ILE 274.A N TRP 233.A O no hydrogen 2.773 N/A ALA 280.A N THR 277.A OG1 no hydrogen 3.332 N/A GLU 281.A N THR 277.A O no hydrogen 3.118 N/A LEU 282.A N GLU 278.A O no hydrogen 2.927 N/A GLU 283.A N GLU 279.A O no hydrogen 2.907 N/A LEU 284.A N ALA 280.A O no hydrogen 2.914 N/A ALA 285.A N GLU 281.A O no hydrogen 2.908 N/A GLU 286.A N LEU 282.A O no hydrogen 2.926 N/A ASN 287.A N GLU 283.A O no hydrogen 2.919 N/A ASN 287.A ND2 LYS 256.A O no hydrogen 3.009 N/A ARG 288.A N LEU 284.A O no hydrogen 2.903 N/A ARG 288.A NH1 LEU 227.A O no hydrogen 3.177 N/A ARG 288.A NH2 PRO 228.A O no hydrogen 2.813 N/A GLU 289.A N ALA 285.A O no hydrogen 2.930 N/A ILE 290.A N GLU 286.A O no hydrogen 2.925 N/A LEU 291.A N ASN 287.A O no hydrogen 2.920 N/A LEU 291.A N ARG 288.A O no hydrogen 3.155 N/A LYS 292.A N ARG 288.A O no hydrogen 2.931 N/A ASP 301.A N GLN 324.A OE1 no hydrogen 2.741 N/A SER 303.A N ASP 301.A OD1 no hydrogen 2.906 N/A SER 303.A OG ASP 301.A OD1 no hydrogen 2.620 N/A SER 303.A OG ASP 301.A OD2 no hydrogen 3.403 N/A LYS 304.A N ASP 301.A O no hydrogen 3.293 N/A LYS 304.A NZ GLU 325.A OE1 no hydrogen 2.856 N/A ILE 307.A N TYR 323.A O no hydrogen 2.870 N/A ALA 308.A N LYS 369.A O no hydrogen 2.936 N/A GLU 309.A N GLN 321.A O no hydrogen 2.906 N/A GLN 311.A N THR 319.A O no hydrogen 2.875 N/A GLN 311.A NE2 GLN 321.A OE1 no hydrogen 3.320 N/A LYS 312.A NZ ASP 345.A OD2 no hydrogen 2.572 N/A GLN 313.A N GLN 317.A O no hydrogen 2.904 N/A GLN 313.A NE2 THR 319.A OG1 no hydrogen 2.978 N/A GLN 313.A NE2 LYS 405.A O no hydrogen 2.970 N/A GLN 317.A N GLY 314.A O no hydrogen 3.198 N/A TRP 318.A N TYR 335.A O no hydrogen 2.894 N/A TRP 318.A NE1 GLN 348.A OE1 no hydrogen 2.754 N/A THR 319.A N GLN 311.A O no hydrogen 2.961 N/A THR 319.A OG1 GLN 311.A O no hydrogen 3.551 N/A THR 319.A OG1 GLN 311.A OE1 no hydrogen 2.668 N/A TYR 320.A N GLY 333.A O no hydrogen 2.907 N/A TYR 320.A OH GLU 359.A OE1 no hydrogen 2.617 N/A GLN 321.A N GLU 309.A O no hydrogen 2.899 N/A GLN 321.A NE2 GLN 311.A OE1 no hydrogen 2.347 N/A ILE 322.A N LYS 331.A O no hydrogen 2.862 N/A TYR 323.A N ILE 307.A O no hydrogen 2.930 N/A TYR 323.A OH GLU 309.A OE2 no hydrogen 2.768 N/A GLN 324.A NE2 ASP 301.A O no hydrogen 2.498 N/A GLN 324.A NE2 LYS 304.A O no hydrogen 2.768 N/A LYS 328.A N GLU 325.A O no hydrogen 3.079 N/A LEU 330.A N ILE 322.A O no hydrogen 2.793 N/A LYS 331.A N ILE 322.A O no hydrogen 2.975 N/A LYS 331.A NZ THR 332.A O no hydrogen 3.488 N/A LYS 331.A NZ GLU 359.A OE1 no hydrogen 2.908 N/A GLY 333.A N TYR 320.A O no hydrogen 2.916 N/A LYS 334.A NZ GLN 409.A OE1 no hydrogen 3.566 N/A TYR 335.A OH GLU 351.A OE1 no hydrogen 2.990 N/A ARG 337.A N GLY 316.A O no hydrogen 3.164 N/A LYS 347.A NZ GLU 351.A OE2 no hydrogen 3.019 N/A GLN 348.A N ASN 344.A O no hydrogen 3.123 N/A GLN 348.A NE2 THR 343.A OG1 no hydrogen 2.904 N/A LEU 349.A N ASP 345.A O no hydrogen 2.902 N/A THR 350.A N VAL 346.A O no hydrogen 2.910 N/A THR 350.A OG1 VAL 346.A O no hydrogen 2.959 N/A GLU 351.A N LYS 347.A O no hydrogen 2.957 N/A ALA 352.A N GLN 348.A O no hydrogen 2.901 N/A VAL 353.A N LEU 349.A O no hydrogen 2.880 N/A GLN 354.A N THR 350.A O no hydrogen 2.954 N/A GLN 354.A NE2 THR 350.A O no hydrogen 3.167 N/A GLN 354.A NE2 TYR 386.A O no hydrogen 3.459 N/A LYS 355.A N GLU 351.A O no hydrogen 2.925 N/A LYS 355.A NZ GLU 359.A OE2 no hydrogen 3.237 N/A ILE 356.A N ALA 352.A O no hydrogen 2.896 N/A THR 357.A N VAL 353.A O no hydrogen 2.914 N/A THR 357.A OG1 VAL 353.A O no hydrogen 2.721 N/A THR 358.A N GLN 354.A O no hydrogen 2.924 N/A THR 358.A OG1 GLN 354.A O no hydrogen 2.910 N/A GLU 359.A N LYS 355.A O no hydrogen 2.939 N/A SER 360.A N ILE 356.A O no hydrogen 2.892 N/A SER 360.A OG LYS 366.A O no hydrogen 2.554 N/A ILE 361.A N THR 357.A O no hydrogen 2.925 N/A VAL 362.A N THR 358.A O no hydrogen 2.917 N/A ILE 363.A N GLU 359.A O no hydrogen 2.923 N/A TRP 364.A N SER 360.A O no hydrogen 2.927 N/A GLY 365.A N ILE 361.A O no hydrogen 2.842 N/A LYS 369.A N LEU 306.A O no hydrogen 2.680 N/A PHE 370.A N GLU 394.A O no hydrogen 3.061 N/A LYS 371.A N ALA 308.A O no hydrogen 2.895 N/A LYS 371.A NZ GLU 396.A OE2 no hydrogen 2.405 N/A LEU 372.A N GLU 396.A O no hydrogen 2.892 N/A ILE 374.A N LEU 372.A O no hydrogen 3.037 N/A GLN 375.A NE2 GLU 377.A OE1 no hydrogen 3.506 N/A GLU 377.A N GLU 377.A OE1 no hydrogen 2.697 N/A TRP 379.A N GLN 375.A O no hydrogen 3.063 N/A GLU 380.A N LYS 376.A O no hydrogen 2.901 N/A THR 381.A N GLU 377.A O no hydrogen 2.914 N/A THR 381.A N THR 378.A O no hydrogen 3.092 N/A THR 381.A OG1 GLU 377.A O no hydrogen 2.621 N/A TRP 382.A N THR 378.A O no hydrogen 2.952 N/A TRP 383.A N TRP 379.A O no hydrogen 2.909 N/A GLU 385.A N TRP 382.A O no hydrogen 3.420 N/A TRP 387.A NE1 TRP 391.A O no hydrogen 3.122 N/A GLN 388.A N GLN 354.A OE1 no hydrogen 2.640 N/A ALA 389.A N GLN 354.A OE1 no hydrogen 3.185 N/A GLU 396.A N PHE 370.A O no hydrogen 2.886 N/A VAL 398.A N LEU 372.A O no hydrogen 3.074 N/A THR 400.A N ASN 399.A OD1 no hydrogen 2.988 N/A THR 400.A OG1 ASN 399.A OD1 no hydrogen 3.511 N/A TRP 407.A N VAL 404.A O no hydrogen 3.216 N/A TYR 408.A N LYS 405.A O no hydrogen 3.447 N/A