Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4pl5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N PHE 10.A O no hydrogen 3.078 N/A CYS 11.A SG ASP 14.A OD2 no hydrogen 3.149 N/A CYS 11.A SG LYS 27.A O no hydrogen 3.542 N/A LEU 16.A N VAL 25.A O no hydrogen 2.597 N/A GLY 17.A N VAL 25.A O no hydrogen 2.988 N/A GLY 19.A N THR 23.A O no hydrogen 2.962 N/A THR 23.A N ALA 20.A O no hydrogen 3.056 N/A THR 23.A OG1 ARG 39.A O no hydrogen 2.796 N/A ILE 24.A N ARG 39.A O no hydrogen 2.984 N/A VAL 25.A N GLY 17.A O no hydrogen 2.904 N/A TYR 26.A N VAL 37.A O no hydrogen 2.923 N/A LYS 27.A N ASP 14.A O no hydrogen 2.903 N/A MET 29.A N SER 9.A O no hydrogen 3.045 N/A ASN 32.A ND2 ASP 31.A O no hydrogen 3.359 N/A VAL 35.A N GLY 28.A O no hydrogen 2.922 N/A ALA 36.A N ILE 81.A O no hydrogen 2.819 N/A VAL 37.A N TYR 26.A O no hydrogen 2.878 N/A LYS 38.A N ILE 79.A O no hydrogen 2.873 N/A LYS 38.A NZ ASP 150.A OD2 no hydrogen 2.721 N/A ARG 39.A N ILE 24.A O no hydrogen 2.660 N/A ILE 40.A N GLN 77.A O no hydrogen 2.902 N/A CYS 44.A N LEU 41.A O no hydrogen 3.039 N/A CYS 44.A SG GLU 21.A O no hydrogen 3.764 N/A PHE 45.A N LEU 41.A O no hydrogen 3.073 N/A SER 46.A N CYS 154.A O no hydrogen 3.368 N/A ALA 48.A N GLY 152.A O no hydrogen 3.036 N/A GLN 53.A N ASP 49.A O no hydrogen 2.910 N/A LEU 54.A N ARG 50.A O no hydrogen 2.967 N/A LEU 55.A N GLU 51.A O no hydrogen 2.913 N/A ARG 56.A N VAL 52.A O no hydrogen 2.952 N/A ARG 56.A NH2 TYR 67.A O no hydrogen 2.175 N/A GLU 57.A N GLN 53.A O no hydrogen 2.742 N/A SER 58.A N LEU 54.A O no hydrogen 3.116 N/A SER 58.A OG LEU 54.A O no hydrogen 2.985 N/A ASN 63.A N HIS 61.A ND1 no hydrogen 2.858 N/A ASN 63.A ND2 GLN 110.A O no hydrogen 3.604 N/A ASN 63.A ND2 SER 113.A OG no hydrogen 3.080 N/A VAL 64.A N HIS 61.A O no hydrogen 3.373 N/A ILE 65.A N ILE 148.A O no hydrogen 3.107 N/A ARG 66.A N GLU 82.A OE2 no hydrogen 2.552 N/A TYR 67.A OH PHE 151.A O no hydrogen 3.368 N/A PHE 68.A N ALA 80.A O no hydrogen 2.960 N/A CYS 69.A SG LYS 7.A O no hydrogen 3.579 N/A LYS 72.A NZ ARG 74.A O no hydrogen 3.427 N/A ARG 74.A N ASP 73.A OD1 no hydrogen 2.447 N/A GLN 75.A NE2 ASP 73.A OD2 no hydrogen 2.846 N/A TYR 78.A N GLU 71.A O no hydrogen 3.254 N/A ILE 79.A N LYS 38.A O no hydrogen 2.906 N/A ILE 81.A N ALA 36.A O no hydrogen 2.882 N/A GLU 82.A N GLU 82.A OE1 no hydrogen 2.284 N/A CYS 84.A SG GLU 82.A O no hydrogen 3.299 N/A ALA 85.A N LEU 135.A O no hydrogen 2.792 N/A ALA 86.A N LEU 135.A O no hydrogen 3.481 N/A THR 87.A N GLU 90.A OE2 no hydrogen 2.641 N/A THR 87.A OG1 GLU 90.A OE1 no hydrogen 3.541 N/A THR 87.A OG1 GLU 90.A OE2 no hydrogen 3.144 N/A THR 87.A OG1 HIS 131.A ND1 no hydrogen 3.395 N/A LEU 88.A N PRO 130.A O no hydrogen 3.056 N/A GLN 89.A N THR 87.A OG1 no hydrogen 3.202 N/A GLN 89.A NE2 GLU 93.A OE2 no hydrogen 2.937 N/A GLU 90.A N THR 87.A O no hydrogen 3.178 N/A VAL 92.A N LEU 88.A O no hydrogen 2.964 N/A GLU 93.A N GLN 89.A O no hydrogen 2.834 N/A GLN 94.A N GLU 90.A O no hydrogen 2.966 N/A LYS 95.A NZ LYS 95.A O no hydrogen 3.385 N/A ASP 96.A N GLN 94.A O no hydrogen 2.513 N/A THR 106.A OG1 GLU 103.A O no hydrogen 2.966 N/A LEU 107.A N GLU 103.A O no hydrogen 2.964 N/A LEU 108.A N PRO 104.A O no hydrogen 2.945 N/A HIS 109.A N ILE 105.A O no hydrogen 2.938 N/A GLN 110.A N THR 106.A O no hydrogen 2.822 N/A THR 111.A N LEU 107.A O no hydrogen 2.958 N/A THR 111.A OG1 LEU 107.A O no hydrogen 3.438 N/A THR 112.A N LEU 108.A O no hydrogen 2.911 N/A THR 112.A OG1 LEU 108.A O no hydrogen 3.094 N/A SER 113.A N HIS 109.A O no hydrogen 2.844 N/A SER 113.A OG HIS 109.A O no hydrogen 3.242 N/A SER 113.A OG GLN 110.A O no hydrogen 2.507 N/A GLY 114.A N GLN 110.A O no hydrogen 2.903 N/A LEU 115.A N THR 111.A O no hydrogen 2.917 N/A ALA 116.A N THR 112.A O no hydrogen 2.891 N/A HIS 117.A N SER 113.A O no hydrogen 2.850 N/A HIS 117.A NE2 ASP 59.A O no hydrogen 3.086 N/A LEU 118.A N GLY 114.A O no hydrogen 2.955 N/A HIS 119.A N LEU 115.A O no hydrogen 2.905 N/A SER 120.A N ALA 116.A O no hydrogen 2.873 N/A SER 120.A OG HIS 117.A O no hydrogen 2.697 N/A ASN 122.A N HIS 119.A O no hydrogen 2.977 N/A ILE 123.A N LEU 118.A O no hydrogen 3.197 N/A HIS 125.A N ASP 178.A OD2 no hydrogen 2.748 N/A ARG 126.A N ASP 178.A OD1 no hydrogen 3.028 N/A LYS 129.A NZ ASP 127.A OD2 no hydrogen 2.771 N/A LYS 129.A NZ THR 161.A OG1 no hydrogen 2.347 N/A ASN 132.A N LYS 129.A O no hydrogen 3.301 N/A ASN 132.A ND2 ASP 127.A O no hydrogen 2.961 N/A LEU 134.A N MET 147.A O no hydrogen 2.872 N/A LEU 135.A N ALA 86.A O no hydrogen 2.757 N/A SER 136.A N LYS 145.A O no hydrogen 2.894 N/A SER 136.A OG MET 137.A O no hydrogen 3.382 N/A SER 136.A OG LYS 145.A O no hydrogen 3.169 N/A ASN 139.A N ARG 143.A O no hydrogen 3.030 N/A GLY 142.A N ASN 139.A O no hydrogen 3.122 N/A ARG 143.A N ASN 139.A OD1 no hydrogen 2.504 N/A LYS 145.A N SER 136.A OG no hydrogen 2.697 N/A LYS 145.A NZ PRO 62.A O no hydrogen 2.414 N/A ALA 146.A N GLN 110.A OE1 no hydrogen 2.472 N/A MET 147.A N LEU 134.A O no hydrogen 2.940 N/A ILE 148.A N ASN 63.A O no hydrogen 3.280 N/A SER 149.A N ASN 132.A O no hydrogen 3.036 N/A SER 149.A OG ASP 150.A OD1 no hydrogen 2.716 N/A CYS 154.A SG LYS 155.A O no hydrogen 3.550 N/A LYS 155.A NZ VAL 158.A O no hydrogen 2.755 N/A LYS 156.A N CYS 44.A O no hydrogen 3.365 N/A LYS 156.A NZ PRO 42.A O no hydrogen 2.841 N/A LYS 156.A NZ GLU 43.A O no hydrogen 2.736 N/A GLY 163.A N GLN 204.A OE1 no hydrogen 3.053 N/A TRP 164.A N THR 161.A O no hydrogen 3.051 N/A ILE 165.A N GLN 204.A OE1 no hydrogen 3.387 N/A GLU 168.A N GLU 168.A OE1 no hydrogen 2.865 N/A MET 169.A N ALA 166.A O no hydrogen 3.410 N/A LEU 170.A N PRO 167.A O no hydrogen 2.983 N/A THR 174.A OG1 THR 176.A OG1 no hydrogen 3.263 N/A THR 176.A OG1 THR 174.A OG1 no hydrogen 3.263 N/A ILE 179.A N TYR 175.A O no hydrogen 3.005 N/A PHE 180.A N THR 176.A O no hydrogen 2.884 N/A SER 181.A N VAL 177.A O no hydrogen 2.989 N/A SER 181.A OG TRP 164.A O no hydrogen 3.144 N/A SER 181.A OG VAL 177.A O no hydrogen 2.786 N/A ALA 182.A N ASP 178.A O no hydrogen 2.888 N/A GLY 183.A N ILE 179.A O no hydrogen 2.931 N/A CYS 184.A N PHE 180.A O no hydrogen 3.028 N/A VAL 185.A N SER 181.A O no hydrogen 2.951 N/A PHE 186.A N ALA 182.A O no hydrogen 2.832 N/A TYR 187.A N GLY 183.A O no hydrogen 2.956 N/A TYR 188.A N CYS 184.A O no hydrogen 2.877 N/A VAL 189.A N VAL 185.A O no hydrogen 2.932 N/A VAL 189.A N PHE 186.A O no hydrogen 3.179 N/A ILE 190.A N PHE 186.A O no hydrogen 2.915 N/A SER 191.A N TYR 187.A O no hydrogen 2.878 N/A SER 191.A OG TYR 187.A O no hydrogen 2.162 N/A SER 191.A OG TYR 194.A O no hydrogen 2.764 N/A GLU 192.A N VAL 189.A O no hydrogen 3.263 N/A GLN 202.A N LYS 199.A O no hydrogen 3.165 N/A ARG 203.A N LYS 199.A O no hydrogen 2.679 N/A GLN 204.A NE2 ILE 165.A O no hydrogen 3.051 N/A ASN 206.A N GLN 202.A O no hydrogen 2.816 N/A ILE 207.A N ARG 203.A O no hydrogen 2.971 N/A LEU 208.A N GLN 204.A O no hydrogen 3.006 N/A LEU 209.A N ALA 205.A O no hydrogen 2.888 N/A GLY 210.A N ASN 206.A O no hydrogen 2.510 N/A ALA 211.A N ASN 206.A O no hydrogen 2.932 N/A CYS 212.A SG GLY 210.A O no hydrogen 3.271 N/A ASN 213.A N PRO 196.A O no hydrogen 3.097 N/A CYS 216.A N TYR 187.A OH no hydrogen 3.468 N/A CYS 216.A SG TYR 187.A OH no hydrogen 2.691 N/A CYS 216.A SG ASP 215.A OD1 no hydrogen 3.493 N/A PHE 217.A N LEU 214.A O no hydrogen 3.071 N/A LYS 221.A NZ GLU 223.A OE2 no hydrogen 3.349 N/A LYS 221.A NZ ASP 224.A OD2 no hydrogen 3.333 N/A GLU 223.A N GLU 223.A OE2 no hydrogen 2.471 N/A VAL 225.A N LYS 221.A O no hydrogen 2.969 N/A ILE 226.A N HIS 222.A O no hydrogen 2.977 N/A ALA 227.A N GLU 223.A O no hydrogen 2.950 N/A ARG 228.A N ASP 224.A O no hydrogen 2.886 N/A GLU 229.A N VAL 225.A O no hydrogen 2.944 N/A LEU 230.A N ILE 226.A O no hydrogen 2.961 N/A ILE 231.A N ALA 227.A O no hydrogen 2.889 N/A GLU 232.A N ARG 228.A O no hydrogen 2.887 N/A LYS 233.A NZ GLU 229.A OE1 no hydrogen 2.589 N/A MET 234.A N LEU 230.A O no hydrogen 2.954 N/A ILE 235.A N ILE 231.A O no hydrogen 2.949 N/A ALA 236.A N LYS 233.A O no hydrogen 3.325 N/A GLN 240.A N ASP 238.A OD1 no hydrogen 3.047 N/A GLN 241.A N ASP 238.A O no hydrogen 2.796 N/A ARG 242.A N PRO 239.A O no hydrogen 3.466 N/A ARG 242.A NE THR 176.A O no hydrogen 3.165 N/A VAL 248.A N SER 244.A O no hydrogen 3.115 N/A LYS 250.A N LYS 246.A O no hydrogen 3.003 N/A LYS 250.A N HIS 247.A O no hydrogen 3.003 N/A LYS 250.A NZ TYR 383.A O no hydrogen 2.657 N/A HIS 251.A N VAL 248.A O no hydrogen 3.232 N/A HIS 251.A NE2 GLU 229.A OE2 no hydrogen 3.149 N/A PHE 253.A N HIS 251.A ND1 no hydrogen 2.760 N/A PHE 254.A N HIS 251.A O no hydrogen 3.158 N/A TRP 255.A N PRO 252.A O no hydrogen 3.020 N/A LYS 259.A N SER 256.A OG no hydrogen 3.146 N/A LYS 259.A NZ THR 381.A O no hydrogen 3.350 N/A GLN 260.A N SER 256.A O no hydrogen 3.112 N/A GLN 260.A NE2 TRP 255.A O no hydrogen 3.576 N/A GLN 260.A NE2 SER 256.A O no hydrogen 3.310 N/A LEU 261.A N LEU 257.A O no hydrogen 2.926 N/A GLN 262.A N GLU 258.A O no hydrogen 2.852 N/A GLN 262.A NE2 GLN 265.A OE1 no hydrogen 2.922 N/A PHE 263.A N LYS 259.A O no hydrogen 2.880 N/A PHE 264.A N GLN 260.A O no hydrogen 2.959 N/A GLN 265.A N LEU 261.A O no hydrogen 2.907 N/A ASP 266.A N GLN 262.A O no hydrogen 2.863 N/A VAL 267.A N PHE 263.A O no hydrogen 2.914 N/A SER 268.A N PHE 264.A O no hydrogen 2.972 N/A ASP 269.A N GLN 265.A O no hydrogen 2.912 N/A ARG 270.A N ASP 266.A O no hydrogen 2.913 N/A ARG 270.A NH1 ARG 270.A O no hydrogen 3.096 N/A ILE 271.A N VAL 267.A O no hydrogen 2.938 N/A GLU 272.A N ASP 269.A O no hydrogen 3.055 N/A GLY 278.A N ALA 275.A O no hydrogen 3.089 N/A VAL 281.A N GLU 274.A OE2 no hydrogen 3.459 N/A ARG 282.A N GLY 278.A O no hydrogen 3.214 N/A GLN 283.A N PRO 279.A O no hydrogen 2.905 N/A LEU 284.A N ILE 280.A O no hydrogen 2.887 N/A GLU 285.A N VAL 281.A O no hydrogen 3.311 N/A GLU 285.A N ARG 282.A O no hydrogen 3.304 N/A ARG 286.A N GLN 283.A O no hydrogen 2.981 N/A ALA 290.A N GLY 287.A O no hydrogen 3.230 N/A VAL 291.A N GLY 288.A O no hydrogen 3.130 N/A LYS 293.A N ALA 290.A O no hydrogen 3.376 N/A LYS 293.A NZ ARG 358.A O no hydrogen 3.143 N/A MET 294.A N ARG 289.A O no hydrogen 2.774 N/A ASP 295.A N LYS 293.A O no hydrogen 2.806 N/A TRP 296.A N GLY 316.A O no hydrogen 3.069 N/A ARG 297.A N ASP 295.A OD1 no hydrogen 3.213 N/A GLU 298.A N GLU 298.A OE1 no hydrogen 2.714 N/A ASN 299.A N TRP 296.A O no hydrogen 3.121 N/A THR 301.A N TYR 354.A OH no hydrogen 3.184 N/A GLN 305.A N THR 301.A O no hydrogen 3.272 N/A THR 306.A N VAL 302.A O no hydrogen 2.919 N/A THR 306.A OG1 VAL 302.A O no hydrogen 3.186 N/A THR 306.A OG1 PRO 303.A O no hydrogen 2.483 N/A ASP 307.A N PRO 303.A O no hydrogen 2.948 N/A LEU 308.A N LEU 304.A O no hydrogen 2.946 N/A ARG 309.A N GLN 305.A O no hydrogen 2.843 N/A LYS 310.A N THR 306.A O no hydrogen 2.951 N/A PHE 311.A N ASP 307.A O no hydrogen 3.007 N/A PHE 311.A N LEU 308.A O no hydrogen 3.085 N/A ARG 312.A N LEU 308.A O no hydrogen 2.585 N/A ARG 312.A NE LEU 308.A O no hydrogen 3.505 N/A THR 313.A OG1 THR 313.A O no hydrogen 2.661 N/A LYS 315.A N ASP 321.A OD2 no hydrogen 2.444 N/A SER 318.A OG ASP 321.A OD1 no hydrogen 3.435 N/A VAL 319.A N GLU 285.A OE1 no hydrogen 2.867 N/A ARG 320.A N SER 318.A OG no hydrogen 2.881 N/A ASP 321.A N SER 318.A OG no hydrogen 3.421 N/A LEU 323.A N VAL 319.A O no hydrogen 2.852 N/A ARG 324.A N ARG 320.A O no hydrogen 2.893 N/A ALA 325.A N ASP 321.A O no hydrogen 2.896 N/A MET 326.A N LEU 322.A O no hydrogen 2.853 N/A ARG 327.A N LEU 323.A O no hydrogen 2.869 N/A ARG 327.A NH1 HIS 331.A ND1 no hydrogen 3.060 N/A ASN 328.A N ARG 324.A O no hydrogen 2.925 N/A ASN 328.A ND2 TYR 314.A OH no hydrogen 2.543 N/A LYS 329.A N ALA 325.A O no hydrogen 2.914 N/A LYS 330.A N MET 326.A O no hydrogen 2.837 N/A LYS 330.A NZ GLN 262.A OE1 no hydrogen 3.517 N/A LYS 330.A NZ GLN 265.A OE1 no hydrogen 2.481 N/A HIS 331.A N ARG 327.A O no hydrogen 2.920 N/A HIS 332.A N ASN 328.A O no hydrogen 2.913 N/A TYR 333.A N LYS 330.A O no hydrogen 3.348 N/A TYR 333.A OH GLN 341.A O no hydrogen 3.205 N/A ARG 334.A NH1 ARG 334.A O no hydrogen 2.758 N/A GLU 335.A N HIS 332.A O no hydrogen 3.225 N/A GLN 341.A N PRO 337.A O no hydrogen 3.208 N/A GLN 341.A NE2 LEU 336.A O no hydrogen 2.606 N/A GLU 342.A N VAL 338.A O no hydrogen 2.924 N/A THR 343.A N GLU 339.A O no hydrogen 2.969 N/A LEU 344.A N VAL 340.A O no hydrogen 2.886 N/A GLY 345.A N GLN 341.A O no hydrogen 2.894 N/A PHE 351.A N SER 346.A O no hydrogen 2.780 N/A VAL 352.A N PRO 348.A O no hydrogen 2.945 N/A ARG 353.A N ASP 349.A O no hydrogen 2.961 N/A TYR 354.A N ASP 350.A O no hydrogen 2.902 N/A TYR 354.A N PHE 351.A O no hydrogen 2.970 N/A PHE 355.A N VAL 352.A O no hydrogen 3.208 N/A THR 356.A N VAL 352.A O no hydrogen 2.979 N/A THR 356.A OG1 VAL 352.A O no hydrogen 2.916 N/A SER 357.A N ARG 353.A O no hydrogen 2.921 N/A ARG 358.A N PHE 355.A O no hydrogen 3.037 N/A ARG 358.A NH1 TYR 354.A O no hydrogen 3.538 N/A PHE 359.A N PHE 355.A O no hydrogen 2.933 N/A LEU 362.A N PHE 359.A O no hydrogen 2.976 N/A HIS 365.A N HIS 361.A O no hydrogen 2.843 N/A THR 366.A N LEU 362.A O no hydrogen 2.904 N/A THR 366.A OG1 LEU 362.A O no hydrogen 2.603 N/A TYR 367.A N LEU 363.A O no hydrogen 2.878 N/A TYR 367.A OH TYR 382.A O no hydrogen 3.179 N/A GLN 368.A N SER 364.A O no hydrogen 2.945 N/A ALA 369.A N HIS 365.A O no hydrogen 2.902 N/A MET 370.A N THR 366.A O no hydrogen 2.875 N/A GLU 371.A N GLN 368.A O no hydrogen 3.028 N/A CYS 373.A N MET 370.A O no hydrogen 3.230 N/A ARG 374.A N GLU 371.A O no hydrogen 2.856 N/A GLU 376.A N CYS 373.A O no hydrogen 3.273 N/A LEU 378.A N GLU 376.A OE1 no hydrogen 2.597 N/A PHE 379.A N GLU 376.A O no hydrogen 3.279 N/A GLN 380.A NE2 HIS 375.A O no hydrogen 2.659 N/A GLN 380.A NE2 GLU 376.A O no hydrogen 2.563 N/A TYR 382.A N PHE 379.A O no hydrogen 3.078 N/A TYR 382.A OH ASP 266.A OD2 no hydrogen 2.816 N/A TYR 383.A N PHE 379.A O no hydrogen 2.793 N/A GLU 386.A N HIS 385.A ND1 no hydrogen 2.970 N/A