Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4c8r_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A N MET 1.A O no hydrogen 3.269 N/A ILE 5.A N ARG 71.A O no hydrogen 2.974 N/A GLN 6.A N LEU 20.A O no hydrogen 2.835 N/A LYS 7.A N LEU 20.A O no hydrogen 3.121 N/A LYS 7.A NZ GLU 9.A OE2 no hydrogen 3.327 N/A GLU 9.A N GLN 18.A O no hydrogen 2.915 N/A ALA 14.A N LEU 11.A O no hydrogen 2.779 N/A MET 17.A N TYR 29.A O no hydrogen 2.722 N/A GLN 18.A N GLU 9.A O no hydrogen 2.859 N/A ILE 19.A N SER 27.A O no hydrogen 2.996 N/A LEU 20.A N LYS 7.A O no hydrogen 2.768 N/A TRP 21.A N GLU 25.A O no hydrogen 3.124 N/A TRP 21.A NE1 SER 27.A OG no hydrogen 2.875 N/A TYR 22.A N THR 4.A O no hydrogen 2.956 N/A GLU 24.A N TRP 21.A O no hydrogen 2.931 N/A GLU 25.A N ASP 23.A OD1 no hydrogen 2.915 N/A SER 27.A N ILE 19.A O no hydrogen 2.792 N/A TYR 29.A N MET 17.A O no hydrogen 3.015 N/A TYR 29.A OH LEU 91.A O no hydrogen 2.312 N/A ALA 31.A N HIS 15.A O no hydrogen 3.018 N/A TRP 33.A N PRO 30.A O no hydrogen 3.126 N/A LEU 34.A N PRO 30.A O no hydrogen 3.210 N/A ARG 35.A N ALA 31.A O no hydrogen 2.888 N/A ASP 36.A N VAL 32.A O no hydrogen 2.999 N/A ASN 37.A N TRP 33.A O no hydrogen 3.004 N/A ASN 37.A N LEU 34.A O no hydrogen 3.255 N/A ASN 37.A ND2 TRP 33.A O no hydrogen 3.134 N/A CYS 38.A SG TYR 83.A O no hydrogen 3.973 N/A CYS 38.A SG SER 84.A OG no hydrogen 3.044 N/A CYS 40.A SG HIS 82.A NE2 no hydrogen 3.656 N/A CYS 43.A N CYS 40.A O no hydrogen 2.730 N/A CYS 43.A SG HIS 82.A NE2 no hydrogen 3.437 N/A TYR 44.A N CYS 40.A O no hydrogen 2.800 N/A LEU 45.A N ALA 50.A O no hydrogen 2.879 N/A ALA 48.A N LEU 45.A O no hydrogen 3.166 N/A LYS 49.A N LEU 45.A O no hydrogen 2.724 N/A LYS 49.A N ASP 46.A O no hydrogen 2.916 N/A ALA 50.A N LEU 45.A O no hydrogen 3.327 N/A ARG 51.A NE ASP 36.A O no hydrogen 3.211 N/A ARG 51.A NH2 ASN 37.A OD1 no hydrogen 2.447 N/A LYS 52.A N CYS 43.A O no hydrogen 2.828 N/A GLU 56.A N GLU 56.A OE1 no hydrogen 2.605 N/A ALA 57.A N LEU 54.A O no hydrogen 3.009 N/A LEU 58.A N VAL 55.A O no hydrogen 3.003 N/A ASN 61.A N ASP 59.A OD1 no hydrogen 3.005 N/A ILE 62.A N ASP 59.A O no hydrogen 3.117 N/A ILE 64.A N ALA 14.A O no hydrogen 2.664 N/A LYS 65.A N THR 77.A O no hydrogen 3.015 N/A GLY 66.A N THR 77.A O no hydrogen 3.493 N/A ILE 68.A N TYR 75.A O no hydrogen 3.106 N/A ASP 70.A N LYS 73.A O no hydrogen 3.140 N/A LYS 72.A N ASP 70.A OD1 no hydrogen 2.453 N/A VAL 74.A N PHE 86.A O no hydrogen 3.009 N/A TYR 75.A N ILE 68.A O no hydrogen 2.808 N/A TYR 75.A OH ASP 70.A OD2 no hydrogen 3.169 N/A ILE 76.A N SER 84.A O no hydrogen 2.979 N/A THR 77.A N GLY 66.A O no hydrogen 3.033 N/A THR 77.A OG1 GLY 66.A O no hydrogen 3.310 N/A TRP 78.A N HIS 82.A O no hydrogen 2.928 N/A TRP 78.A NE1 SER 84.A OG no hydrogen 3.093 N/A TYR 83.A OH GLU 85.A OE2 no hydrogen 2.831 N/A SER 84.A N ILE 76.A O no hydrogen 2.956 N/A PHE 86.A N VAL 74.A O no hydrogen 2.950 N/A ALA 88.A N LYS 72.A O no hydrogen 3.221 N/A TRP 90.A N GLN 87.A O no hydrogen 3.108 N/A LEU 91.A N GLN 87.A O no hydrogen 3.028 N/A LYS 92.A N ALA 88.A O no hydrogen 2.712 N/A LYS 92.A NZ ASP 23.A OD2 no hydrogen 3.415 N/A LYS 93.A N ASP 89.A O no hydrogen 3.306 N/A ARG 94.A NH1 TRP 90.A O no hydrogen 3.057 N/A CYS 95.A SG SER 27.A OG no hydrogen 3.376 N/A ALA 100.A N SER 97.A OG no hydrogen 2.940 N/A ARG 101.A N SER 97.A O no hydrogen 3.287 N/A ARG 101.A NH1 PHE 96.A O no hydrogen 2.588 N/A ALA 102.A N LYS 98.A O no hydrogen 3.029 N/A LYS 103.A N GLN 99.A O no hydrogen 2.719 N/A LEU 104.A N ALA 100.A O no hydrogen 2.836 N/A GLN 105.A N ARG 101.A O no hydrogen 2.958 N/A ARG 106.A N ALA 102.A O no hydrogen 3.207 N/A GLU 107.A N LYS 103.A O no hydrogen 3.143 N/A LEU 108.A N LEU 104.A O no hydrogen 3.084 N/A PHE 109.A N GLN 105.A O no hydrogen 2.925 N/A PHE 110.A N ARG 106.A O no hydrogen 3.154 N/A GLN 114.A N LYS 146.A O no hydrogen 3.148 N/A TRP 116.A N ASP 233.A OD2 no hydrogen 2.974 N/A TRP 116.A NE1 VAL 147.A O no hydrogen 2.745 N/A GLY 117.A N GLU 119.A OE2 no hydrogen 2.536 N/A SER 118.A N GLU 325.A O no hydrogen 3.158 N/A LEU 120.A N GLY 117.A O no hydrogen 3.091 N/A LEU 125.A N ARG 151.A O no hydrogen 3.096 N/A PHE 127.A N THR 153.A O no hydrogen 2.852 N/A ASP 129.A N ASP 126.A OD2 no hydrogen 3.196 N/A VAL 130.A N ASP 126.A O no hydrogen 3.125 N/A LEU 131.A N PHE 127.A O no hydrogen 3.132 N/A ARG 132.A N GLU 128.A O no hydrogen 3.070 N/A TYR 133.A N ASP 129.A O no hydrogen 2.845 N/A ALA 137.A N TYR 133.A O no hydrogen 3.047 N/A TYR 138.A N ASP 134.A O no hydrogen 2.830 N/A LYS 139.A N GLU 135.A O no hydrogen 2.972 N/A TRP 140.A N HIS 136.A O no hydrogen 2.898 N/A TRP 140.A NE1 THR 339.A OG1 no hydrogen 3.096 N/A LEU 141.A N ALA 137.A O no hydrogen 3.035 N/A SER 142.A N TYR 138.A O no hydrogen 2.952 N/A SER 142.A OG TYR 138.A O no hydrogen 2.648 N/A SER 142.A OG LYS 139.A O no hydrogen 3.459 N/A THR 143.A N LYS 139.A O no hydrogen 3.275 N/A THR 143.A OG1 LYS 139.A O no hydrogen 2.897 N/A LEU 144.A N TRP 140.A O no hydrogen 3.086 N/A LYS 145.A N LEU 141.A O no hydrogen 2.754 N/A LYS 145.A NZ PHE 110.A O no hydrogen 2.925 N/A LYS 146.A N SER 142.A O no hydrogen 2.831 N/A VAL 147.A N THR 143.A O no hydrogen 2.469 N/A GLY 148.A N LEU 144.A O no hydrogen 2.806 N/A VAL 150.A N THR 339.A O no hydrogen 2.902 N/A ARG 151.A N PRO 123.A O no hydrogen 2.891 N/A LEU 152.A N VAL 337.A O no hydrogen 2.731 N/A THR 153.A N LEU 125.A O no hydrogen 2.843 N/A THR 153.A OG1 LEU 125.A O no hydrogen 3.483 N/A SER 156.A N GLU 161.A OE1 no hydrogen 2.762 N/A LYS 158.A N SER 156.A OG no hydrogen 2.943 N/A GLY 160.A N GLU 363.A OE1 no hydrogen 2.744 N/A LYS 164.A N GLU 161.A O no hydrogen 2.761 N/A LYS 164.A NZ GLU 161.A OE2 no hydrogen 3.418 N/A LEU 165.A N GLU 161.A O no hydrogen 3.198 N/A GLY 166.A N VAL 162.A O no hydrogen 3.161 N/A LYS 167.A N SER 163.A O no hydrogen 3.041 N/A ARG 168.A N LEU 165.A O no hydrogen 2.873 N/A ARG 168.A NE VAL 130.A O no hydrogen 2.777 N/A ARG 168.A NH1 ASP 134.A OD1 no hydrogen 3.371 N/A ARG 168.A NH2 VAL 130.A O no hydrogen 2.977 N/A ARG 168.A NH2 ASP 134.A OD1 no hydrogen 3.025 N/A MET 169.A N LEU 165.A O no hydrogen 3.004 N/A GLY 170.A N GLY 166.A O no hydrogen 2.838 N/A TYR 173.A N TYR 366.A O no hydrogen 2.859 N/A TYR 173.A OH HIS 210.A O no hydrogen 3.112 N/A THR 175.A N GLY 178.A O no hydrogen 3.489 N/A TYR 177.A N THR 175.A OG1 no hydrogen 3.162 N/A TYR 177.A OH ASP 261.A OD2 no hydrogen 2.968 N/A THR 180.A OG1 GLU 363.A OE2 no hydrogen 3.411 N/A TRP 181.A N GLY 364.A O no hydrogen 3.174 N/A VAL 183.A N LEU 362.A O no hydrogen 2.852 N/A ASP 185.A N ARG 360.A O no hydrogen 3.131 N/A ILE 187.A N ILE 358.A O no hydrogen 2.684 N/A ALA 193.A N ASN 191.A OD1 no hydrogen 3.347 N/A LEU 199.A N ARG 349.A O no hydrogen 3.078 N/A HIS 202.A ND1 SER 200.A O no hydrogen 2.814 N/A THR 203.A N PHE 291.A O no hydrogen 2.582 N/A THR 203.A OG1 PHE 291.A O no hydrogen 3.075 N/A ASP 204.A N ASN 342.A OD1 no hydrogen 2.855 N/A LEU 208.A N TYR 205.A O no hydrogen 3.364 N/A HIS 210.A NE2 ASP 368.A OD2 no hydrogen 2.967 N/A VAL 214.A N ALA 367.A O no hydrogen 2.961 N/A GLN 215.A N PHE 340.A O no hydrogen 2.818 N/A LEU 216.A N ALA 365.A O no hydrogen 2.877 N/A LEU 217.A N ILE 338.A O no hydrogen 2.848 N/A HIS 218.A N GLU 363.A O no hydrogen 2.906 N/A CYS 219.A N ASP 336.A O no hydrogen 2.972 N/A CYS 219.A SG ASN 333.A O no hydrogen 3.511 N/A ILE 220.A N HIS 361.A O no hydrogen 2.979 N/A LYS 221.A N HIS 361.A O no hydrogen 3.104 N/A THR 223.A N SER 359.A O no hydrogen 2.576 N/A GLY 227.A N SER 351.A O no hydrogen 3.250 N/A SER 229.A N PHE 330.A O no hydrogen 2.978 N/A GLU 230.A N GLY 348.A O no hydrogen 3.088 N/A ILE 231.A N PHE 328.A O no hydrogen 3.136 N/A VAL 232.A N LEU 346.A O no hydrogen 3.022 N/A GLY 234.A N ARG 344.A O no hydrogen 3.232 N/A PHE 235.A N ASP 233.A OD1 no hydrogen 3.202 N/A ASN 236.A N ASP 233.A OD1 no hydrogen 3.496 N/A VAL 237.A N ASP 233.A O no hydrogen 2.938 N/A CYS 238.A N GLY 234.A O no hydrogen 2.736 N/A CYS 238.A SG GLY 234.A O no hydrogen 3.113 N/A GLN 239.A N PHE 235.A O no hydrogen 3.049 N/A LYS 240.A N ASN 236.A O no hydrogen 2.951 N/A LEU 241.A N VAL 237.A O no hydrogen 2.828 N/A LYS 242.A N CYS 238.A O no hydrogen 3.130 N/A LYS 243.A N GLN 239.A O no hydrogen 3.144 N/A ASN 244.A N LYS 240.A O no hydrogen 2.917 N/A ASN 245.A N LEU 241.A O no hydrogen 2.581 N/A ALA 248.A N ASN 245.A OD1 no hydrogen 2.692 N/A PHE 249.A N ASN 245.A O no hydrogen 3.007 N/A GLN 250.A N PRO 246.A O no hydrogen 2.808 N/A ILE 251.A N GLN 247.A O no hydrogen 2.856 N/A LEU 252.A N ALA 248.A O no hydrogen 2.845 N/A SER 253.A N PHE 249.A O no hydrogen 2.863 N/A SER 253.A OG PHE 249.A O no hydrogen 2.628 N/A SER 253.A OG GLN 250.A O no hydrogen 3.399 N/A SER 254.A N ILE 251.A O no hydrogen 3.040 N/A SER 254.A OG GLN 250.A O no hydrogen 2.458 N/A SER 254.A OG GLN 250.A OE1 no hydrogen 3.559 N/A SER 254.A OG ILE 251.A O no hydrogen 3.184 N/A THR 255.A OG1 ILE 251.A O no hydrogen 2.924 N/A VAL 257.A N HIS 275.A O no hydrogen 2.771 N/A PHE 259.A N SER 273.A O no hydrogen 2.835 N/A THR 260.A N THR 295.A O no hydrogen 2.715 N/A THR 260.A OG1 GLN 272.A OE1 no hydrogen 2.703 N/A ASP 261.A N VAL 271.A O no hydrogen 3.019 N/A GLY 263.A N PHE 269.A O no hydrogen 3.054 N/A ASP 265.A N CYS 267.A O no hydrogen 3.372 N/A TYR 266.A N PHE 176.A O no hydrogen 3.050 N/A CYS 267.A SG ASP 268.A O no hydrogen 3.681 N/A PHE 269.A N GLY 263.A O no hydrogen 2.868 N/A VAL 271.A N ASP 261.A O no hydrogen 2.941 N/A GLN 272.A NE2 ASP 258.A OD2 no hydrogen 3.351 N/A GLN 272.A NE2 ASP 297.A OD2 no hydrogen 2.711 N/A SER 273.A N PHE 259.A O no hydrogen 2.990 N/A SER 273.A OG PRO 206.A O no hydrogen 2.929 N/A LYS 274.A NZ ASP 258.A OD1 no hydrogen 2.751 N/A HIS 275.A N VAL 257.A O no hydrogen 2.930 N/A HIS 275.A NE2 LEU 208.A O no hydrogen 3.209 N/A ILE 278.A N LEU 252.A O no hydrogen 3.475 N/A GLU 279.A N ARG 288.A O no hydrogen 2.834 N/A ASP 281.A N GLN 285.A O no hydrogen 2.909 N/A LYS 283.A N ASP 281.A OD1 no hydrogen 2.607 N/A GLN 285.A N ASP 281.A OD1 no hydrogen 2.845 N/A VAL 287.A N GLU 279.A O no hydrogen 2.894 N/A ARG 288.A NH1 ASN 290.A OD1 no hydrogen 3.532 N/A ILE 289.A N TRP 343.A O no hydrogen 2.982 N/A ASN 290.A N ILE 277.A O no hydrogen 2.912 N/A ASN 290.A ND2 LYS 276.A O no hydrogen 3.274 N/A ASN 290.A ND2 GLU 279.A OE1 no hydrogen 3.064 N/A PHE 291.A N THR 203.A OG1 no hydrogen 2.969 N/A THR 295.A OG1 ASN 292.A O no hydrogen 3.470 N/A ARG 296.A NH1 TYR 311.A OH no hydrogen 3.164 N/A ARG 296.A NH2 ASN 293.A OD1 no hydrogen 2.499 N/A ASP 297.A N ASP 258.A O no hydrogen 2.807 N/A ILE 299.A N ASP 297.A OD1 no hydrogen 2.925 N/A ARG 306.A N PRO 303.A O no hydrogen 2.707 N/A VAL 307.A N VAL 304.A O no hydrogen 2.898 N/A PHE 310.A N ARG 306.A O no hydrogen 3.043 N/A TYR 311.A N VAL 307.A O no hydrogen 3.013 N/A ALA 312.A N GLN 308.A O no hydrogen 2.785 N/A ALA 313.A N PRO 309.A O no hydrogen 2.816 N/A LEU 314.A N PHE 310.A O no hydrogen 2.880 N/A LYS 315.A N TYR 311.A O no hydrogen 3.168 N/A GLU 316.A N ALA 312.A O no hydrogen 3.354 N/A PHE 317.A N ALA 313.A O no hydrogen 3.355 N/A VAL 318.A N LEU 314.A O no hydrogen 2.831 N/A ASP 319.A N LYS 315.A O no hydrogen 2.878 N/A LEU 320.A N GLU 316.A O no hydrogen 2.958 N/A MET 321.A N PHE 317.A O no hydrogen 3.107 N/A ASN 322.A N VAL 318.A O no hydrogen 3.042 N/A SER 323.A N LEU 320.A O no hydrogen 3.230 N/A SER 323.A OG GLU 325.A OE1 no hydrogen 3.471 N/A SER 326.A N SER 323.A O no hydrogen 2.886 N/A SER 326.A OG LEU 320.A O no hydrogen 2.950 N/A PHE 328.A N ILE 231.A O no hydrogen 3.008 N/A THR 329.A OG1 GLU 230.A OE2 no hydrogen 3.327 N/A PHE 330.A N SER 229.A O no hydrogen 3.209 N/A ASN 333.A N ASP 336.A OD2 no hydrogen 2.751 N/A GLY 335.A N CYS 219.A O no hydrogen 2.865 N/A ASP 336.A N ASN 333.A O no hydrogen 3.394 N/A VAL 337.A N LEU 152.A O no hydrogen 2.802 N/A ILE 338.A N LEU 217.A O no hydrogen 2.877 N/A THR 339.A N VAL 150.A O no hydrogen 2.839 N/A THR 339.A OG1 VAL 150.A O no hydrogen 2.676 N/A PHE 340.A N GLN 215.A O no hydrogen 3.063 N/A ASP 341.A N GLY 148.A O no hydrogen 2.870 N/A ASN 342.A N GLY 213.A O no hydrogen 2.846 N/A ASN 342.A ND2 ASP 204.A O no hydrogen 2.834 N/A ASN 342.A ND2 PRO 212.A O no hydrogen 3.024 N/A TRP 343.A N ASP 341.A OD1 no hydrogen 2.768 N/A TRP 343.A NE1 PRO 211.A O no hydrogen 2.984 N/A ARG 344.A N ASP 341.A O no hydrogen 3.034 N/A ARG 344.A NE ASP 233.A OD1 no hydrogen 2.904 N/A ARG 344.A NH1 LYS 146.A O no hydrogen 3.020 N/A ARG 344.A NH2 GLN 114.A O no hydrogen 2.756 N/A ARG 344.A NH2 ASP 233.A OD2 no hydrogen 2.930 N/A LEU 345.A N ASP 341.A O no hydrogen 2.931 N/A LEU 346.A N VAL 232.A O no hydrogen 3.170 N/A HIS 347.A N HIS 202.A O no hydrogen 2.766 N/A GLY 348.A N GLU 230.A O no hydrogen 2.819 N/A ARG 349.A N LEU 199.A O no hydrogen 3.164 N/A ARG 349.A NE ARG 350.A O no hydrogen 3.284 N/A ARG 349.A NH2 GLY 197.A O no hydrogen 2.819 N/A ARG 350.A N ASP 228.A O no hydrogen 2.695 N/A SER 351.A OG THR 196.A O no hydrogen 2.933 N/A GLU 353.A N THR 225.A O no hydrogen 3.047 N/A THR 356.A OG1 THR 225.A OG1 no hydrogen 3.012 N/A THR 356.A OG1 GLU 353.A O no hydrogen 2.685 N/A ILE 358.A N ILE 187.A O no hydrogen 3.047 N/A SER 359.A N THR 223.A O no hydrogen 3.039 N/A ARG 360.A N ASP 185.A O no hydrogen 2.820 N/A ARG 360.A NE ASP 185.A OD2 no hydrogen 3.366 N/A ARG 360.A NH2 ASP 185.A OD2 no hydrogen 2.757 N/A LEU 362.A N VAL 183.A O no hydrogen 2.860 N/A GLU 363.A N HIS 218.A O no hydrogen 3.024 N/A GLY 364.A N TRP 181.A O no hydrogen 2.929 N/A ALA 365.A N LEU 216.A O no hydrogen 2.998 N/A ALA 367.A N VAL 214.A O no hydrogen 2.902 N/A TRP 369.A NE1 ASP 341.A OD1 no hydrogen 3.162 N/A ASP 370.A N ASP 368.A OD1 no hydrogen 2.737 N/A VAL 372.A N ASP 368.A O no hydrogen 3.093 N/A MET 373.A N TRP 369.A O no hydrogen 2.806 N/A SER 374.A N ASP 370.A O no hydrogen 2.969 N/A ARG 375.A N VAL 371.A O no hydrogen 3.167 N/A ARG 375.A NE ARG 168.A O no hydrogen 3.022 N/A ARG 375.A NE MET 169.A O no hydrogen 3.026 N/A LEU 376.A N VAL 372.A O no hydrogen 2.766 N/A ARG 377.A N MET 373.A O no hydrogen 2.824 N/A ARG 377.A NE LEU 108.A O no hydrogen 2.991 N/A ILE 378.A N SER 374.A O no hydrogen 2.932 N/A LEU 379.A N ARG 375.A O no hydrogen 2.847 N/A ARG 380.A N LEU 376.A O no hydrogen 3.170 N/A GLN 381.A N ARG 377.A O no hydrogen 3.477 N/A GLN 381.A NE2 GLN 381.A O no hydrogen 3.263 N/A ARG 382.A N LEU 379.A O no hydrogen 2.927 N/A VAL 383.A N LEU 379.A O no hydrogen 3.049 N/A VAL 383.A N ARG 380.A O no hydrogen 3.345 N/A GLU 384.A N ARG 380.A O no hydrogen 2.991 N/A