Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bec_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 5.A N ILE 2.A O no hydrogen 3.122 N/A ASP 13.A N GLU 248.A OE2 no hydrogen 2.871 N/A ALA 14.A N ILE 12.A O no hydrogen 2.966 N/A GLU 15.A N GLY 238.A O no hydrogen 3.111 N/A SER 16.A N MET 237.A O no hydrogen 3.114 N/A TYR 17.A N GLN 31.A O no hydrogen 2.948 N/A ILE 18.A N ALA 235.A O no hydrogen 2.929 N/A LEU 19.A N ALA 29.A O no hydrogen 2.935 N/A ILE 20.A N ILE 233.A O no hydrogen 2.881 N/A ASP 21.A N LYS 26.A O no hydrogen 2.942 N/A TYR 22.A N ARG 231.A O no hydrogen 2.958 N/A ASN 23.A N ASP 21.A OD1 no hydrogen 2.802 N/A SER 24.A N ASP 21.A OD1 no hydrogen 3.081 N/A SER 24.A OG THR 296.A OG1 no hydrogen 2.629 N/A GLY 25.A N ASP 21.A O no hydrogen 2.838 N/A LYS 26.A N SER 24.A OG no hydrogen 3.032 N/A LYS 26.A NZ GLU 339.A OE2 no hydrogen 2.976 N/A LEU 28.A N LEU 19.A O no hydrogen 2.799 N/A GLN 31.A N TYR 17.A O no hydrogen 2.981 N/A ASN 32.A ND2 GLU 15.A O no hydrogen 2.953 N/A VAL 35.A N ASN 32.A O no hydrogen 3.282 N/A ARG 36.A NE ASN 141.A OD1 no hydrogen 2.942 N/A ARG 36.A NH2 LYS 140.A O no hydrogen 3.154 N/A ARG 36.A NH2 ASN 141.A OD1 no hydrogen 3.280 N/A ARG 37.A N SER 157.A O no hydrogen 2.802 N/A ARG 37.A NH1 ALA 217.A O no hydrogen 2.958 N/A ALA 40.A N ASP 38.A OD2 no hydrogen 2.900 N/A LEU 42.A N PRO 39.A O no hydrogen 3.046 N/A THR 43.A N ALA 40.A O no hydrogen 3.167 N/A THR 43.A OG1 ALA 40.A O no hydrogen 3.320 N/A THR 43.A OG1 GLN 155.A OE1 no hydrogen 2.955 N/A LYS 44.A N SER 41.A O no hydrogen 2.881 N/A LYS 44.A NZ ASN 109.A OD1 no hydrogen 2.643 N/A LYS 44.A NZ HIS 148.A O no hydrogen 2.866 N/A MET 45.A N LEU 42.A O no hydrogen 2.879 N/A MET 46.A N THR 43.A O no hydrogen 2.935 N/A THR 47.A N THR 43.A O no hydrogen 3.349 N/A THR 47.A OG1 VAL 147.A O no hydrogen 2.540 N/A SER 48.A N LYS 44.A O no hydrogen 2.926 N/A SER 48.A OG ASN 104.A OD1 no hydrogen 3.467 N/A SER 48.A OG GLU 176.A OE1 no hydrogen 2.613 N/A SER 48.A OG TYR 180.A OH no hydrogen 2.844 N/A TYR 49.A N MET 45.A O no hydrogen 2.966 N/A TYR 49.A OH ASP 172.A OD1 no hydrogen 2.569 N/A VAL 50.A N MET 46.A O no hydrogen 2.993 N/A ILE 51.A N THR 47.A O no hydrogen 3.128 N/A GLY 52.A N SER 48.A O no hydrogen 2.779 N/A GLN 53.A N TYR 49.A O no hydrogen 2.915 N/A GLN 53.A NE2 TYR 49.A OH no hydrogen 3.033 N/A ALA 54.A N VAL 50.A O no hydrogen 2.962 N/A MET 55.A N ILE 51.A O no hydrogen 2.953 N/A LYS 56.A N GLY 52.A O no hydrogen 2.875 N/A LYS 56.A NZ ASP 172.A O no hydrogen 2.744 N/A ALA 57.A N GLN 53.A O no hydrogen 2.984 N/A GLY 58.A N MET 55.A O no hydrogen 2.961 N/A LYS 59.A N ALA 54.A O no hydrogen 2.993 N/A LYS 61.A N ASP 64.A OD1 no hydrogen 2.887 N/A ASP 64.A N LYS 61.A O no hydrogen 3.082 N/A VAL 66.A N VAL 94.A O no hydrogen 2.813 N/A ILE 68.A N MET 92.A O no hydrogen 3.082 N/A ALA 72.A N GLY 69.A O no hydrogen 2.981 N/A TRP 73.A N ASN 70.A O no hydrogen 3.276 N/A TRP 73.A NE1 THR 75.A OG1 no hydrogen 3.098 N/A ALA 74.A N LEU 88.A O no hydrogen 3.071 N/A GLY 76.A N TRP 73.A O no hydrogen 3.051 N/A ASN 77.A ND2 ASN 70.A O no hydrogen 2.976 N/A ASN 77.A ND2 TRP 73.A O no hydrogen 2.727 N/A PHE 80.A N ASN 77.A O no hydrogen 2.880 N/A LYS 81.A N PRO 78.A O no hydrogen 2.938 N/A SER 83.A N PHE 80.A O no hydrogen 3.043 N/A SER 83.A OG PHE 80.A O no hydrogen 2.686 N/A SER 84.A OG GLN 106.A O no hydrogen 2.319 N/A MET 86.A N ASP 110.A OD2 no hydrogen 2.942 N/A LEU 88.A N ASP 110.A OD1 no hydrogen 3.043 N/A GLY 91.A N ILE 68.A O no hydrogen 2.928 N/A MET 92.A N LYS 89.A O no hydrogen 3.169 N/A VAL 94.A N VAL 66.A O no hydrogen 2.946 N/A VAL 96.A N ASP 64.A O no hydrogen 2.863 N/A SER 97.A N GLU 62.A O no hydrogen 2.828 N/A SER 97.A OG GLU 62.A O no hydrogen 3.427 N/A GLN 98.A N PRO 95.A O no hydrogen 2.950 N/A LEU 99.A N PRO 95.A O no hydrogen 3.167 N/A ILE 100.A N VAL 96.A O no hydrogen 2.823 N/A ARG 101.A N SER 97.A O no hydrogen 3.402 N/A ARG 101.A NE GLU 182.A OE1 no hydrogen 2.844 N/A ARG 101.A NH1 SER 97.A O no hydrogen 2.999 N/A ARG 101.A NH2 GLU 182.A OE2 no hydrogen 3.049 N/A GLY 102.A N GLN 98.A O no hydrogen 2.878 N/A ILE 103.A N LEU 99.A O no hydrogen 2.921 N/A ASN 104.A N ILE 100.A O no hydrogen 2.867 N/A ASN 104.A ND2 GLU 176.A OE1 no hydrogen 2.931 N/A LEU 105.A N ARG 101.A O no hydrogen 2.846 N/A GLY 108.A N GLY 102.A O no hydrogen 2.816 N/A ASN 109.A N SER 84.A O no hydrogen 3.019 N/A ASN 109.A ND2 SER 83.A OG no hydrogen 3.121 N/A ASN 109.A ND2 SER 84.A O no hydrogen 2.907 N/A ALA 111.A N ASP 110.A OD2 no hydrogen 2.919 N/A CYS 112.A N GLY 108.A O no hydrogen 3.222 N/A CYS 112.A SG GLY 108.A O no hydrogen 3.451 N/A CYS 112.A SG VAL 147.A O no hydrogen 3.813 N/A VAL 113.A N ASN 109.A O no hydrogen 3.385 N/A ALA 114.A N ASP 110.A O no hydrogen 3.054 N/A MET 115.A N ALA 111.A O no hydrogen 3.012 N/A ALA 116.A N CYS 112.A O no hydrogen 2.892 N/A ASP 117.A N VAL 113.A O no hydrogen 3.043 N/A PHE 118.A N ALA 114.A O no hydrogen 3.106 N/A ALA 119.A N MET 115.A O no hydrogen 2.802 N/A ALA 120.A N ALA 116.A O no hydrogen 2.926 N/A GLY 121.A N ASP 117.A O no hydrogen 2.833 N/A GLN 123.A NE2 ASP 71.A OD2 no hydrogen 3.469 N/A ALA 125.A N SER 122.A OG no hydrogen 3.006 N/A PHE 126.A N SER 122.A O no hydrogen 3.046 N/A VAL 127.A N GLN 123.A O no hydrogen 2.885 N/A GLY 128.A N ASP 124.A O no hydrogen 3.003 N/A LEU 129.A N ALA 125.A O no hydrogen 3.105 N/A MET 130.A N PHE 126.A O no hydrogen 2.942 N/A ASN 131.A N VAL 127.A O no hydrogen 2.937 N/A ASN 131.A ND2 PHE 144.A O no hydrogen 2.939 N/A SER 132.A N GLY 128.A O no hydrogen 2.914 N/A SER 132.A OG GLY 128.A O no hydrogen 2.831 N/A TYR 133.A N LEU 129.A O no hydrogen 2.948 N/A VAL 134.A N MET 130.A O no hydrogen 3.025 N/A ASN 135.A N ASN 131.A O no hydrogen 3.060 N/A ALA 136.A N SER 132.A O no hydrogen 2.895 N/A LEU 137.A N TYR 133.A O no hydrogen 2.854 N/A GLY 138.A N ASN 135.A O no hydrogen 3.041 N/A LEU 139.A N VAL 134.A O no hydrogen 3.181 N/A ASN 141.A N ASP 161.A OD1 no hydrogen 2.832 N/A THR 142.A OG1 SER 157.A OG no hydrogen 2.828 N/A THR 142.A OG1 ASP 161.A OD1 no hydrogen 2.724 N/A HIS 143.A N TYR 156.A O no hydrogen 2.928 N/A PHE 144.A N ASN 131.A OD1 no hydrogen 2.992 N/A THR 146.A OG1 HIS 148.A ND1 no hydrogen 3.409 N/A THR 146.A OG1 LEU 150.A O no hydrogen 2.842 N/A GLY 149.A N THR 146.A OG1 no hydrogen 3.003 N/A LEU 150.A N HIS 148.A ND1 no hydrogen 3.117 N/A GLY 154.A N GLN 145.A OE1 no hydrogen 2.810 N/A GLN 155.A N ALA 152.A O no hydrogen 3.154 N/A GLN 155.A NE2 GLY 149.A O no hydrogen 3.016 N/A TYR 156.A N HIS 143.A O no hydrogen 2.954 N/A SER 157.A N ARG 37.A O no hydrogen 3.026 N/A SER 157.A OG THR 142.A OG1 no hydrogen 2.828 N/A SER 158.A OG ALA 33.A O no hydrogen 3.435 N/A ARG 160.A N ALA 33.A O no hydrogen 2.906 N/A ARG 160.A NE ASP 34.A OD1 no hydrogen 2.774 N/A ARG 160.A NH2 GLU 30.A OE1 no hydrogen 3.010 N/A ARG 160.A NH2 ASP 34.A OD2 no hydrogen 3.022 N/A ASP 161.A N SER 158.A OG no hydrogen 3.095 N/A MET 162.A N SER 158.A O no hydrogen 2.909 N/A ALA 163.A N ALA 159.A O no hydrogen 2.977 N/A LEU 164.A N ARG 160.A O no hydrogen 2.902 N/A ILE 165.A N ASP 161.A O no hydrogen 2.827 N/A GLY 166.A N MET 162.A O no hydrogen 2.992 N/A GLN 167.A N ALA 163.A O no hydrogen 2.896 N/A GLN 167.A NE2 TYR 22.A O no hydrogen 2.869 N/A ALA 168.A N LEU 164.A O no hydrogen 2.954 N/A LEU 169.A N ILE 165.A O no hydrogen 2.840 N/A ILE 170.A N GLY 166.A O no hydrogen 3.084 N/A ARG 171.A N GLN 167.A O no hydrogen 2.956 N/A ARG 171.A NE ASP 172.A OD2 no hydrogen 2.807 N/A ARG 171.A NH2 ASP 172.A OD1 no hydrogen 3.001 N/A ASP 172.A N ALA 168.A O no hydrogen 2.802 N/A VAL 173.A N LEU 169.A O no hydrogen 3.119 N/A TYR 177.A N VAL 173.A O no hydrogen 2.924 N/A TYR 177.A OH ASP 207.A OD2 no hydrogen 2.693 N/A SER 178.A N PRO 174.A O no hydrogen 2.954 N/A SER 178.A OG ASN 175.A O no hydrogen 2.784 N/A ILE 179.A N GLU 176.A O no hydrogen 3.176 N/A TYR 180.A N TYR 177.A O no hydrogen 3.046 N/A TYR 180.A OH SER 48.A OG no hydrogen 2.844 N/A GLU 182.A N ILE 179.A O no hydrogen 3.099 N/A PHE 185.A N GLN 192.A O no hydrogen 2.995 N/A PHE 187.A N ILE 190.A O no hydrogen 3.067 N/A ILE 190.A N PHE 187.A O no hydrogen 3.205 N/A GLN 192.A N PHE 185.A O no hydrogen 2.846 N/A ASN 194.A N LYS 183.A O no hydrogen 2.915 N/A ASN 194.A ND2 TYR 180.A O no hydrogen 3.074 N/A ASN 194.A ND2 GLU 182.A O no hydrogen 2.960 N/A ASN 196.A N ASN 194.A OD1 no hydrogen 2.880 N/A LEU 198.A N ASN 196.A OD1 no hydrogen 3.227 N/A LEU 199.A N ASN 196.A O no hydrogen 3.138 N/A TRP 200.A N GLY 197.A O no hydrogen 3.141 N/A ASP 201.A N LEU 198.A O no hydrogen 3.091 N/A SER 203.A N ASP 201.A OD1 no hydrogen 3.005 N/A SER 203.A OG ASP 201.A OD1 no hydrogen 2.547 N/A LEU 204.A N ASP 201.A O no hydrogen 3.366 N/A ASN 205.A ND2 THR 226.A O no hydrogen 3.104 N/A ASP 207.A N SER 224.A O no hydrogen 3.015 N/A ILE 209.A N VAL 222.A O no hydrogen 2.745 N/A LYS 210.A N VAL 222.A O no hydrogen 2.967 N/A LYS 210.A NZ ASN 104.A O no hydrogen 3.242 N/A LYS 210.A NZ SER 107.A OG no hydrogen 2.756 N/A GLY 212.A N ASN 220.A O no hydrogen 2.986 N/A THR 214.A N GLY 218.A O no hydrogen 3.380 N/A THR 214.A OG1 ASP 38.A OD1 no hydrogen 3.147 N/A ALA 217.A N THR 214.A OG1 no hydrogen 2.866 N/A GLY 218.A N THR 214.A O no hydrogen 2.742 N/A TYR 219.A N GLY 239.A O no hydrogen 3.034 N/A ASN 220.A N GLY 212.A O no hydrogen 2.715 N/A ASN 220.A ND2 ASP 38.A O no hydrogen 3.267 N/A ASN 220.A ND2 PRO 39.A O no hydrogen 3.086 N/A LEU 221.A N VAL 236.A O no hydrogen 2.916 N/A VAL 222.A N LYS 210.A O no hydrogen 2.843 N/A ALA 223.A N SER 234.A O no hydrogen 2.872 N/A SER 224.A N GLY 208.A O no hydrogen 3.036 N/A SER 224.A OG LEU 232.A O no hydrogen 2.788 N/A ALA 225.A N LEU 232.A O no hydrogen 3.162 N/A THR 226.A N ASN 205.A O no hydrogen 3.080 N/A GLU 227.A N MET 230.A O no hydrogen 2.900 N/A MET 230.A N GLU 227.A O no hydrogen 3.190 N/A ARG 231.A NH1 ASP 207.A OD1 no hydrogen 2.892 N/A ARG 231.A NH2 ASP 207.A OD1 no hydrogen 3.513 N/A ARG 231.A NH2 ASP 207.A OD2 no hydrogen 2.888 N/A ARG 231.A NH2 SER 224.A OG no hydrogen 2.892 N/A LEU 232.A N ALA 225.A O no hydrogen 3.010 N/A ILE 233.A N ILE 20.A O no hydrogen 2.850 N/A SER 234.A N ALA 223.A O no hydrogen 2.864 N/A ALA 235.A N ILE 18.A O no hydrogen 2.964 N/A VAL 236.A N LEU 221.A O no hydrogen 2.925 N/A MET 237.A N SER 16.A O no hydrogen 2.955 N/A GLY 238.A N ASN 220.A OD1 no hydrogen 2.949 N/A GLY 239.A N TYR 219.A O no hydrogen 2.705 N/A ARG 240.A NH1 ASP 13.A OD2 no hydrogen 3.152 N/A ARG 240.A NH2 GLU 15.A OE1 no hydrogen 2.938 N/A GLY 244.A N THR 241.A OG1 no hydrogen 2.775 N/A ARG 245.A N THR 241.A O no hydrogen 3.038 N/A ALA 247.A N LYS 243.A O no hydrogen 2.935 N/A GLU 248.A N GLY 244.A O no hydrogen 2.852 N/A SER 249.A N ARG 245.A O no hydrogen 3.096 N/A SER 249.A OG ARG 245.A O no hydrogen 2.847 N/A LYS 250.A N GLU 246.A O no hydrogen 2.853 N/A LYS 250.A NZ ASP 201.A OD2 no hydrogen 2.888 N/A LYS 250.A NZ SER 203.A OG no hydrogen 3.351 N/A LYS 251.A N ALA 247.A O no hydrogen 2.971 N/A LYS 251.A NZ GLN 11.A O no hydrogen 3.057 N/A LYS 251.A NZ GLU 248.A OE1 no hydrogen 3.461 N/A LYS 251.A NZ GLU 248.A OE2 no hydrogen 3.015 N/A LEU 252.A N GLU 248.A O no hydrogen 3.178 N/A LEU 253.A N SER 249.A O no hydrogen 2.966 N/A THR 254.A N LYS 250.A O no hydrogen 2.916 N/A THR 254.A OG1 LYS 250.A O no hydrogen 2.792 N/A THR 254.A OG1 LYS 251.A O no hydrogen 3.000 N/A TRP 255.A N LYS 251.A O no hydrogen 3.039 N/A TRP 255.A NE1 GLY 8.A O no hydrogen 2.788 N/A GLY 256.A N LEU 252.A O no hydrogen 2.882 N/A PHE 257.A N LEU 253.A O no hydrogen 3.061 N/A ARG 258.A N THR 254.A O no hydrogen 3.015 N/A PHE 259.A N TRP 255.A O no hydrogen 3.089 N/A PHE 260.A N GLY 256.A O no hydrogen 3.021 N/A GLU 261.A N ILE 297.A O no hydrogen 2.878 N/A THR 262.A OG1 ASP 21.A OD2 no hydrogen 2.299 N/A VAL 263.A N LEU 295.A O no hydrogen 2.819 N/A ASN 264.A ND2 LEU 266.A O no hydrogen 3.357 N/A ASN 264.A ND2 VAL 293.A O no hydrogen 2.688 N/A VAL 268.A N ASP 292.A OD2 no hydrogen 2.731 N/A LYS 270.A N LYS 267.A O no hydrogen 3.194 N/A PHE 272.A N LEU 287.A O no hydrogen 2.775 N/A ALA 273.A N LEU 287.A O no hydrogen 3.171 N/A GLU 275.A N ALA 285.A O no hydrogen 3.217 N/A VAL 277.A N ASP 283.A O no hydrogen 2.945 N/A TRP 278.A N LEU 316.A O no hydrogen 2.868 N/A ASP 281.A N PRO 350.A O no hydrogen 2.915 N/A SER 282.A OG ASP 281.A OD2 no hydrogen 3.400 N/A ARG 284.A NE SER 274.A OG.A no hydrogen 3.350 N/A ARG 284.A NE SER 274.A OG.B no hydrogen 3.348 N/A ARG 284.A NH2 SER 274.A O no hydrogen 3.210 N/A ARG 284.A NH2 SER 274.A OG.A no hydrogen 3.220 N/A ARG 284.A NH2 SER 274.A OG.B no hydrogen 3.219 N/A ALA 285.A N GLU 275.A O no hydrogen 2.869 N/A SER 286.A OG GLU 271.A OE2 no hydrogen 2.607 N/A LEU 287.A N ALA 273.A O no hydrogen 2.841 N/A GLY 288.A N VAL 344.A O no hydrogen 2.859 N/A VAL 293.A N LEU 266.A O no hydrogen 2.843 N/A LEU 295.A N VAL 263.A O no hydrogen 2.900 N/A THR 296.A OG1 ASP 21.A OD2 no hydrogen 2.517 N/A THR 296.A OG1 SER 24.A OG no hydrogen 2.629 N/A ILE 297.A N GLU 261.A O no hydrogen 2.942 N/A ARG 299.A N PHE 259.A O no hydrogen 2.873 N/A ARG 299.A NE PHE 257.A O no hydrogen 2.815 N/A ARG 299.A NE PHE 260.A O no hydrogen 3.180 N/A ARG 299.A NH1 PHE 257.A O no hydrogen 3.428 N/A ARG 299.A NH1 PHE 260.A O no hydrogen 2.987 N/A GLY 300.A N GLU 261.A OE2 no hydrogen 2.625 N/A ARG 301.A N PRO 298.A O no hydrogen 3.208 N/A ARG 301.A NE ASP 304.A OD1 no hydrogen 2.963 N/A ARG 301.A NH1 ASP 304.A OD1 no hydrogen 3.000 N/A ARG 301.A NH1 ASP 334.A OD1 no hydrogen 2.923 N/A ARG 301.A NH2 ASP 334.A OD2 no hydrogen 3.322 N/A LYS 303.A NZ ASP 304.A OD1 no hydrogen 3.034 N/A LYS 303.A NZ ASP 304.A OD2 no hydrogen 3.297 N/A ASP 304.A N ARG 301.A O no hydrogen 2.896 N/A LEU 305.A N MET 302.A O no hydrogen 3.134 N/A LYS 306.A N GLN 332.A O no hydrogen 2.919 N/A SER 308.A N ASN 330.A O no hydrogen 2.969 N/A TYR 309.A OH GLU 275.A OE2 no hydrogen 2.553 N/A VAL 310.A N THR 328.A O no hydrogen 2.913 N/A ASN 312.A N VAL 326.A O no hydrogen 2.894 N/A HIS 317.A NE2 GLU 315.A OE1 no hydrogen 2.710 N/A ALA 318.A N TRP 278.A O no hydrogen 2.810 N/A LEU 320.A N ILE 349.A O no hydrogen 2.802 N/A GLN 321.A N GLN 324.A OE1 no hydrogen 2.966 N/A ASN 323.A N VAL 345.A O no hydrogen 2.627 N/A GLN 324.A N GLN 321.A O no hydrogen 3.144 N/A VAL 326.A N LEU 343.A O no hydrogen 2.870 N/A THR 328.A N VAL 310.A O no hydrogen 2.956 N/A ILE 329.A N ARG 341.A O no hydrogen 2.705 N/A ASN 330.A N SER 308.A O no hydrogen 2.833 N/A PHE 331.A N GLU 339.A O no hydrogen 2.838 N/A GLN 332.A N LYS 306.A O no hydrogen 2.714 N/A GLN 332.A NE2 THR 337.A OG1 no hydrogen 2.805 N/A LEU 333.A N LYS 336.A O no hydrogen 2.985 N/A LYS 336.A N LEU 333.A O no hydrogen 3.143 N/A ILE 338.A N PHE 331.A O no hydrogen 2.806 N/A GLU 339.A N PHE 331.A O no hydrogen 3.404 N/A GLN 340.A NE2 ASN 330.A OD1 no hydrogen 2.687 N/A ARG 341.A N ILE 329.A O no hydrogen 2.962 N/A ARG 341.A NH1 TYR 294.A O no hydrogen 3.152 N/A ARG 341.A NH2 GLU 339.A OE1 no hydrogen 3.084 N/A ARG 341.A NH2 GLN 340.A O no hydrogen 3.128 N/A LEU 343.A N GLY 327.A O no hydrogen 2.966 N/A VAL 344.A N GLY 288.A O no hydrogen 2.755 N/A VAL 345.A N GLN 324.A O no hydrogen 2.854 N/A LEU 346.A N SER 286.A O no hydrogen 2.906 N/A ILE 349.A N LEU 320.A O no hydrogen 2.784 N/A GLY 352.A N PHE 279.A O no hydrogen 2.812 N/A