Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4kr7_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 2.A N LEU 73.A O no hydrogen 2.950 N/A ARG 3.A NH1 GLU 51.A OE1 no hydrogen 3.051 N/A ARG 3.A NH1 GLU 91.A OE1 no hydrogen 3.419 N/A ARG 3.A NH2 GLU 91.A OE1 no hydrogen 2.808 N/A VAL 4.A N GLY 71.A O no hydrogen 2.874 N/A TYR 5.A N ILE 47.A O no hydrogen 2.893 N/A TYR 5.A OH ASP 56.A OD1 no hydrogen 2.894 N/A ILE 6.A N SER 69.A O no hydrogen 2.869 N/A VAL 7.A N PHE 45.A O no hydrogen 2.870 N/A ARG 8.A N ASN 67.A O no hydrogen 3.050 N/A ARG 8.A NE ASN 67.A OD1 no hydrogen 3.116 N/A ARG 8.A NH2 SER 69.A OG no hydrogen 2.591 N/A LYS 17.A NZ ASP 21.A OD2 no hydrogen 3.200 N/A ARG 19.A NE LEU 14.A O no hydrogen 3.033 N/A LYS 20.A N GLY 16.A O no hydrogen 3.082 N/A LYS 20.A N LYS 17.A O no hydrogen 2.731 N/A ASP 21.A N LYS 17.A O no hydrogen 2.862 N/A PHE 22.A N ASN 18.A O no hydrogen 2.940 N/A GLU 24.A N LYS 20.A O no hydrogen 2.917 N/A ALA 25.A N ASP 21.A O no hydrogen 2.910 N/A LEU 26.A N PHE 22.A O no hydrogen 2.868 N/A ARG 27.A N GLU 23.A O no hydrogen 2.918 N/A ARG 27.A NH1 GLU 24.A OE2 no hydrogen 3.149 N/A ARG 28.A N GLU 24.A O no hydrogen 2.920 N/A ASN 29.A N ALA 25.A O no hydrogen 2.881 N/A ASN 29.A ND2 VAL 169.A O no hydrogen 3.300 N/A ILE 30.A N LEU 26.A O no hydrogen 2.907 N/A GLU 31.A N ARG 27.A O no hydrogen 2.915 N/A ARG 32.A N ARG 28.A O no hydrogen 2.884 N/A ARG 32.A NH2 ASN 29.A OD1 no hydrogen 3.158 N/A VAL 33.A N ASN 29.A O no hydrogen 2.915 N/A THR 34.A N ILE 30.A O no hydrogen 2.954 N/A THR 34.A OG1 ILE 30.A O no hydrogen 2.161 N/A GLY 35.A N GLU 31.A O no hydrogen 2.686 N/A LYS 39.A N LEU 46.A O no hydrogen 2.911 N/A ARG 40.A NH1 GLU 23.A OE1 no hydrogen 3.370 N/A GLN 41.A N ARG 44.A O no hydrogen 2.974 N/A ARG 44.A N GLN 41.A O no hydrogen 2.635 N/A ARG 44.A NH2 GLU 148.A OE1 no hydrogen 2.744 N/A PHE 45.A N VAL 7.A O no hydrogen 2.902 N/A LEU 46.A N LYS 39.A O no hydrogen 2.879 N/A ILE 47.A N TYR 5.A O no hydrogen 2.912 N/A ILE 49.A N ARG 3.A O no hydrogen 2.887 N/A THR 54.A OG1 ASP 56.A OD1 no hydrogen 3.296 N/A LEU 55.A N TYR 5.A OH no hydrogen 3.117 N/A LYS 58.A N ASP 57.A OD2 no hydrogen 3.052 N/A LEU 59.A N LEU 55.A O no hydrogen 2.648 N/A LYS 60.A N ASP 56.A O no hydrogen 2.937 N/A ILE 62.A N LEU 59.A O no hydrogen 3.015 N/A GLY 64.A N GLY 165.A O no hydrogen 2.791 N/A ILE 65.A N ILE 62.A O no hydrogen 3.227 N/A GLN 66.A N ARG 8.A O no hydrogen 2.970 N/A ASN 67.A N ARG 8.A O no hydrogen 3.482 N/A PHE 68.A N VAL 161.A O no hydrogen 2.929 N/A SER 69.A N ILE 6.A O no hydrogen 2.897 N/A SER 69.A OG ASP 159.A O no hydrogen 3.179 N/A LYS 70.A NZ VAL 53.A O no hydrogen 2.826 N/A GLY 71.A N VAL 4.A O no hydrogen 2.936 N/A PHE 72.A N ILE 156.A O no hydrogen 2.895 N/A LEU 73.A N LEU 2.A O no hydrogen 2.897 N/A VAL 74.A N VAL 154.A O no hydrogen 2.879 N/A SER 75.A OG GLU 80.A OE2 no hydrogen 3.296 N/A GLU 80.A N ASP 77.A O no hydrogen 2.787 N/A VAL 81.A N ASP 77.A O no hydrogen 3.167 N/A LYS 82.A N PHE 78.A O no hydrogen 2.888 N/A LYS 83.A N GLU 79.A O no hydrogen 2.922 N/A TYR 84.A N GLU 80.A O no hydrogen 2.910 N/A SER 85.A N VAL 81.A O no hydrogen 2.896 N/A SER 85.A OG VAL 81.A O no hydrogen 2.359 N/A LEU 86.A N LYS 82.A O no hydrogen 2.919 N/A LEU 86.A N LYS 83.A O no hydrogen 3.049 N/A ILE 87.A N LYS 83.A O no hydrogen 2.956 N/A ALA 88.A N TYR 84.A O no hydrogen 2.902 N/A VAL 89.A N LEU 86.A O no hydrogen 3.033 N/A LYS 90.A N LEU 86.A O no hydrogen 2.941 N/A GLU 91.A N ILE 87.A O no hydrogen 2.950 N/A LYS 92.A N ALA 88.A O no hydrogen 2.893 N/A LYS 92.A NZ TYR 98.A OH no hydrogen 2.811 N/A LYS 92.A NZ ASP 159.A OD1 no hydrogen 2.921 N/A LEU 93.A N VAL 89.A O no hydrogen 2.874 N/A GLU 94.A N GLU 91.A O no hydrogen 2.941 N/A LYS 95.A N GLU 91.A O no hydrogen 2.916 N/A ARG 99.A N ASP 142.A OD1 no hydrogen 3.445 N/A THR 100.A OG1 SER 135.A O no hydrogen 3.263 N/A PHE 101.A N SER 135.A O no hydrogen 2.982 N/A LYS 102.A NZ VAL 138.A O no hydrogen 3.051 N/A GLN 104.A N LEU 145.A O no hydrogen 3.253 N/A ALA 105.A N ASN 120.A OD1 no hydrogen 2.996 N/A LYS 106.A N VAL 147.A O no hydrogen 2.847 N/A ALA 108.A N VAL 149.A O no hydrogen 2.998 N/A TYR 112.A N TYR 109.A O no hydrogen 3.155 N/A TYR 112.A OH HIS 76.A O no hydrogen 3.042 N/A LYS 114.A NZ GLU 122.A OE1 no hydrogen 3.414 N/A LYS 114.A NZ GLU 122.A OE2 no hydrogen 3.261 N/A ILE 119.A N GLY 115.A O no hydrogen 3.116 N/A ASN 120.A N VAL 116.A O no hydrogen 2.926 N/A SER 121.A N TYR 117.A O no hydrogen 2.904 N/A SER 121.A OG TYR 117.A O no hydrogen 3.357 N/A GLU 122.A N GLU 118.A O no hydrogen 2.903 N/A LEU 123.A N ILE 119.A O no hydrogen 2.942 N/A GLY 124.A N ASN 120.A O no hydrogen 2.907 N/A ALA 125.A N SER 121.A O no hydrogen 2.901 N/A LEU 126.A N GLU 122.A O no hydrogen 2.922 N/A ILE 127.A N LEU 123.A O no hydrogen 2.899 N/A LEU 128.A N GLY 124.A O no hydrogen 2.926 N/A LYS 129.A N ALA 125.A O no hydrogen 2.902 N/A ASN 130.A N LEU 126.A O no hydrogen 2.928 N/A ASN 130.A ND2 LEU 126.A O no hydrogen 3.117 N/A PHE 131.A N LEU 128.A O no hydrogen 3.386 N/A LEU 134.A N PHE 131.A O no hydrogen 3.076 N/A SER 135.A N ARG 99.A O no hydrogen 3.075 N/A ASP 137.A N THR 100.A OG1 no hydrogen 2.632 N/A ARG 139.A N ASP 137.A OD1 no hydrogen 3.273 N/A ASN 140.A N ASP 137.A OD2 no hydrogen 3.081 N/A ASP 142.A N THR 100.A O no hydrogen 3.103 N/A LEU 145.A N LYS 102.A O no hydrogen 2.861 N/A GLY 146.A N PHE 157.A O no hydrogen 2.856 N/A GLU 148.A N LEU 155.A O no hydrogen 2.872 N/A VAL 149.A N LYS 106.A O no hydrogen 2.983 N/A ARG 150.A N GLY 153.A O no hydrogen 2.901 N/A GLY 153.A N ARG 150.A O no hydrogen 2.905 N/A VAL 154.A N VAL 74.A O no hydrogen 2.878 N/A LEU 155.A N GLU 148.A O no hydrogen 2.882 N/A ILE 156.A N PHE 72.A O no hydrogen 2.888 N/A PHE 157.A N GLY 146.A O no hydrogen 2.914 N/A THR 158.A OG1 ASP 159.A OD2 no hydrogen 3.227 N/A VAL 161.A N PHE 68.A O no hydrogen 2.859 N/A CYS 163.A N GLN 66.A O no hydrogen 3.329 N/A CYS 163.A SG VAL 161.A O no hydrogen 3.899 N/A LEU 167.A N LYS 194.A O no hydrogen 2.849 N/A GLY 170.A N GLY 196.A O no hydrogen 2.871 N/A THR 171.A N PRO 168.A O no hydrogen 3.319 N/A THR 171.A OG1 PRO 168.A O no hydrogen 3.170 N/A LYS 174.A NZ THR 276.A O no hydrogen 2.900 N/A ALA 175.A N LEU 198.A O no hydrogen 2.929 N/A VAL 176.A N ALA 280.A O no hydrogen 2.770 N/A LEU 177.A N GLU 200.A O no hydrogen 2.894 N/A LEU 178.A N TYR 282.A O no hydrogen 3.190 N/A LEU 179.A N VAL 202.A O no hydrogen 3.135 N/A SER 180.A OG SER 185.A OG no hydrogen 3.283 N/A GLY 182.A N SER 180.A OG no hydrogen 2.863 N/A SER 185.A OG SER 180.A OG no hydrogen 3.283 N/A ALA 188.A N ASP 184.A O no hydrogen 2.974 N/A GLY 189.A N SER 185.A O no hydrogen 2.952 N/A TRP 190.A N PRO 186.A O no hydrogen 2.892 N/A TYR 191.A N VAL 187.A O no hydrogen 2.885 N/A ALA 192.A N ALA 188.A O no hydrogen 2.921 N/A LEU 193.A N GLY 189.A O no hydrogen 2.923 N/A LYS 194.A N TRP 190.A O no hydrogen 2.885 N/A ARG 195.A N TYR 191.A O no hydrogen 3.469 N/A GLY 196.A N LEU 193.A O no hydrogen 3.422 N/A VAL 197.A N ALA 192.A O no hydrogen 2.924 N/A LEU 198.A N GLY 173.A O no hydrogen 2.940 N/A GLU 200.A N ALA 175.A O no hydrogen 2.893 N/A SER 201.A N ARG 235.A O no hydrogen 2.886 N/A VAL 202.A N LEU 177.A O no hydrogen 2.900 N/A THR 203.A N HIS 237.A O no hydrogen 2.869 N/A THR 203.A OG1 LEU 179.A O no hydrogen 3.524 N/A VAL 205.A N VAL 239.A O no hydrogen 2.875 N/A SER 206.A N THR 210.A OG1 no hydrogen 2.872 N/A SER 206.A OG GLN 245.A OE1 no hydrogen 2.365 N/A PHE 209.A N SER 206.A O no hydrogen 2.814 N/A THR 210.A N SER 206.A O no hydrogen 3.049 N/A LYS 217.A N GLY 213.A O no hydrogen 2.566 N/A LYS 217.A NZ GLY 181.A O no hydrogen 2.984 N/A ARG 219.A N VAL 215.A O no hydrogen 2.901 N/A ARG 219.A NE GLU 383.A OE1 no hydrogen 2.494 N/A ARG 219.A NE GLU 383.A OE2 no hydrogen 3.135 N/A ARG 219.A NH1 GLU 216.A OE2 no hydrogen 2.407 N/A ARG 219.A NH2 GLU 383.A OE2 no hydrogen 2.558 N/A ASP 220.A N GLU 216.A O no hydrogen 2.874 N/A ILE 221.A N LYS 217.A O no hydrogen 2.913 N/A LEU 222.A N VAL 218.A O no hydrogen 2.920 N/A ARG 223.A N ARG 219.A O no hydrogen 2.883 N/A ARG 223.A NH2 GLU 216.A OE1 no hydrogen 3.385 N/A VAL 224.A N ASP 220.A O no hydrogen 2.903 N/A LEU 225.A N ILE 221.A O no hydrogen 2.907 N/A ARG 226.A N LEU 222.A O no hydrogen 2.915 N/A ARG 226.A NH1 GLU 386.A O no hydrogen 3.147 N/A ARG 226.A NH2 ARG 226.A O no hydrogen 2.861 N/A GLU 227.A N VAL 224.A O no hydrogen 3.224 N/A PHE 228.A N LEU 225.A O no hydrogen 2.787 N/A SER 229.A N ARG 226.A O no hydrogen 3.076 N/A SER 229.A OG LEU 225.A O no hydrogen 3.428 N/A LEU 234.A N ILE 385.A O no hydrogen 2.911 N/A ARG 235.A NE GLU 200.A OE1 no hydrogen 2.515 N/A LEU 236.A N GLU 383.A O no hydrogen 2.861 N/A HIS 237.A N SER 201.A O no hydrogen 2.890 N/A ILE 238.A N LYS 381.A O no hydrogen 2.759 N/A VAL 239.A N THR 203.A O no hydrogen 2.921 N/A LEU 241.A N VAL 205.A O no hydrogen 2.946 N/A THR 242.A OG1 PRO 207.A O no hydrogen 3.301 N/A THR 242.A OG1 ASN 240.A OD1 no hydrogen 2.517 N/A GLN 245.A N LEU 241.A O no hydrogen 2.599 N/A LEU 246.A N THR 242.A O no hydrogen 2.906 N/A GLU 247.A N LYS 243.A O no hydrogen 2.921 N/A VAL 248.A N LEU 244.A O no hydrogen 2.867 N/A LYS 249.A N GLN 245.A O no hydrogen 2.882 N/A LYS 249.A NZ ASP 254.A OD1 no hydrogen 3.323 N/A LYS 249.A NZ PHE 344.A O no hydrogen 3.358 N/A LYS 250.A N LEU 246.A O no hydrogen 2.971 N/A VAL 252.A N VAL 248.A O no hydrogen 3.287 N/A SER 257.A N ASP 254.A O no hydrogen 2.944 N/A SER 257.A OG ASP 254.A O no hydrogen 2.593 N/A MET 260.A N TYR 256.A O no hydrogen 3.223 N/A TYR 261.A N SER 257.A O no hydrogen 2.907 N/A ARG 262.A N LEU 258.A O no hydrogen 2.924 N/A ARG 263.A N ILE 259.A O no hydrogen 2.908 N/A ARG 263.A NH1 SER 300.A O no hydrogen 3.093 N/A SER 264.A N MET 260.A O no hydrogen 2.960 N/A SER 264.A OG MET 260.A O no hydrogen 3.375 N/A SER 264.A OG GLU 373.A OE1 no hydrogen 3.506 N/A MET 265.A N TYR 261.A O no hydrogen 2.908 N/A PHE 266.A N ARG 262.A O no hydrogen 2.894 N/A ARG 267.A N ARG 263.A O no hydrogen 2.931 N/A ARG 267.A NE GLU 373.A OE1 no hydrogen 2.631 N/A ARG 267.A NH2 GLU 363.A OE1 no hydrogen 2.473 N/A ARG 267.A NH2 GLU 373.A OE1 no hydrogen 3.338 N/A ILE 268.A N SER 264.A O no hydrogen 2.939 N/A ALA 269.A N MET 265.A O no hydrogen 2.901 N/A GLU 270.A N PHE 266.A O no hydrogen 2.872 N/A LYS 271.A N ARG 267.A O no hydrogen 2.951 N/A LYS 271.A NZ GLU 374.A OE1 no hydrogen 3.376 N/A ILE 272.A N ILE 268.A O no hydrogen 2.938 N/A ALA 273.A N ALA 269.A O no hydrogen 2.871 N/A GLU 274.A N GLU 270.A O no hydrogen 2.913 N/A GLU 275.A N LYS 271.A O no hydrogen 2.945 N/A THR 276.A N ALA 273.A O no hydrogen 3.296 N/A THR 276.A OG1 ILE 272.A O no hydrogen 2.246 N/A GLY 277.A N ALA 273.A O no hydrogen 2.867 N/A ALA 278.A N ALA 273.A O no hydrogen 2.975 N/A VAL 279.A N LYS 174.A O no hydrogen 2.866 N/A PHE 281.A N PRO 308.A O no hydrogen 3.090 N/A TYR 282.A N VAL 176.A O no hydrogen 2.929 N/A THR 283.A N ILE 310.A O no hydrogen 2.971 N/A THR 283.A OG1 GLU 285.A OE2 no hydrogen 2.718 N/A ASN 286.A ND2 GLN 289.A OE1 no hydrogen 2.223 N/A GLN 293.A N VAL 290.A O no hydrogen 2.869 N/A THR 294.A OG1 ALA 291.A O no hydrogen 3.385 N/A THR 294.A OG1 THR 352.A O no hydrogen 2.922 N/A ASN 297.A ND2 SER 292.A O no hydrogen 3.243 N/A ASN 297.A ND2 ALA 351.A O no hydrogen 2.922 N/A LEU 298.A N THR 294.A O no hydrogen 2.811 N/A TRP 299.A N LEU 295.A O no hydrogen 2.883 N/A SER 300.A N GLU 296.A O no hydrogen 2.911 N/A SER 300.A OG GLU 296.A O no hydrogen 3.048 N/A SER 300.A OG SER 354.A OG no hydrogen 2.338 N/A ILE 301.A N ASN 297.A O no hydrogen 2.938 N/A ILE 301.A N LEU 298.A O no hydrogen 3.212 N/A GLU 302.A N LEU 298.A O no hydrogen 2.891 N/A SER 303.A N TRP 299.A O no hydrogen 3.213 N/A SER 303.A OG TRP 299.A O no hydrogen 2.459 N/A THR 305.A N GLU 302.A O no hydrogen 3.287 N/A THR 305.A OG1 GLU 270.A OE1 no hydrogen 3.444 N/A THR 305.A OG1 ARG 307.A O no hydrogen 3.496 N/A ARG 307.A NH1 GLU 270.A OE2 no hydrogen 3.564 N/A ILE 310.A N PHE 281.A O no hydrogen 2.530 N/A ARG 311.A NE GLU 285.A OE2 no hydrogen 2.924 N/A ARG 311.A NH2 GLU 302.A OE1 no hydrogen 3.026 N/A SER 314.A N ARG 311.A O no hydrogen 3.154 N/A SER 314.A OG ARG 311.A O no hydrogen 2.364 N/A PHE 316.A N LEU 313.A O no hydrogen 3.268 N/A ASP 317.A N GLU 320.A OE2 no hydrogen 2.722 N/A GLU 320.A N ASP 317.A O no hydrogen 3.086 N/A ILE 321.A N ASP 317.A O no hydrogen 3.269 N/A VAL 322.A N LYS 318.A O no hydrogen 2.922 N/A LYS 324.A N GLU 320.A O no hydrogen 2.954 N/A LYS 324.A NZ GLU 327.A OE1 no hydrogen 3.424 N/A ALA 325.A N ILE 321.A O no hydrogen 2.898 N/A LYS 326.A N VAL 322.A O no hydrogen 2.901 N/A GLU 327.A N GLU 323.A O no hydrogen 2.912 N/A ILE 328.A N LYS 324.A O no hydrogen 2.938 N/A GLY 329.A N LYS 326.A O no hydrogen 3.143 N/A THR 330.A N ALA 325.A O no hydrogen 2.807 N/A THR 330.A OG1 ALA 325.A O no hydrogen 3.306 N/A TYR 331.A N ALA 325.A O no hydrogen 3.009 N/A SER 334.A N THR 330.A O no hydrogen 3.011 N/A SER 334.A OG GLY 182.A O no hydrogen 2.705 N/A SER 334.A OG THR 330.A O no hydrogen 2.590 N/A ILE 335.A N TYR 331.A O no hydrogen 2.895 N/A LYS 336.A N GLU 332.A O no hydrogen 2.915 N/A SER 341.A N SER 211.A OG no hydrogen 2.961 N/A SER 341.A OG ASP 340.A O no hydrogen 2.599 N/A CYS 342.A SG PHE 209.A O no hydrogen 3.439 N/A LYS 348.A N ASP 254.A OD2 no hydrogen 3.286 N/A ALA 351.A N LYS 255.A O no hydrogen 3.148 N/A SER 354.A N GLU 296.A OE2 no hydrogen 3.435 N/A SER 354.A OG SER 300.A OG no hydrogen 2.338 N/A SER 354.A OG HIS 355.A O no hydrogen 3.382 N/A HIS 355.A N SER 300.A OG no hydrogen 3.008 N/A HIS 355.A N SER 354.A OG no hydrogen 2.331 N/A LYS 361.A N SER 357.A O no hydrogen 2.995 N/A LYS 361.A N ILE 358.A O no hydrogen 3.015 N/A LEU 362.A N ILE 358.A O no hydrogen 2.897 N/A GLN 364.A N LYS 361.A O no hydrogen 3.147 N/A GLN 365.A N LEU 362.A O no hydrogen 3.117 N/A VAL 366.A N GLU 363.A O no hydrogen 3.314 N/A ASP 368.A N ASP 368.A OD1 no hydrogen 2.364 N/A LEU 372.A N ASP 368.A O no hydrogen 3.037 N/A GLU 373.A N LEU 369.A O no hydrogen 2.886 N/A GLU 374.A N PRO 370.A O no hydrogen 2.914 N/A GLU 375.A N VAL 371.A O no hydrogen 2.871 N/A ALA 376.A N LEU 372.A O no hydrogen 2.884 N/A PHE 377.A N GLU 373.A O no hydrogen 2.891 N/A THR 378.A N GLU 374.A O no hydrogen 2.900 N/A THR 378.A OG1 GLU 374.A O no hydrogen 3.236 N/A THR 378.A OG1 GLU 375.A O no hydrogen 3.117 N/A SER 379.A N GLU 375.A O no hydrogen 2.832 N/A SER 379.A OG GLU 375.A O no hydrogen 2.513 N/A ARG 380.A N PHE 377.A O no hydrogen 3.316 N/A ARG 380.A NH2 PHE 377.A O no hydrogen 2.859 N/A LYS 381.A N ILE 238.A O no hydrogen 2.849 N/A GLU 383.A N LEU 236.A O no hydrogen 2.926 N/A ILE 385.A N LEU 234.A O no hydrogen 2.889 N/A