Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3flk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG ALA 34.A O no hydrogen 3.344 N/A PHE 2.A N ALA 34.A O no hydrogen 2.933 N/A ARG 3.A N ASP 65.A OD2 no hydrogen 2.749 N/A ARG 3.A NH2 ASP 38.A OD2 no hydrogen 3.457 N/A ILE 4.A N GLU 36.A O no hydrogen 2.648 N/A ALA 5.A N ALA 66.A O no hydrogen 3.028 N/A ALA 6.A N ASP 38.A O no hydrogen 2.753 N/A ILE 7.A N TYR 68.A O no hydrogen 2.834 N/A ASP 10.A N ALA 71.A O no hydrogen 2.713 N/A ILE 12.A N SER 276.A O no hydrogen 2.917 N/A GLY 13.A N ASP 10.A O no hydrogen 3.040 N/A LEU 14.A N GLY 11.A O no hydrogen 2.924 N/A GLU 15.A N ILE 12.A O no hydrogen 2.938 N/A VAL 16.A N ILE 12.A O no hydrogen 2.827 N/A LEU 17.A N GLY 13.A O no hydrogen 3.258 N/A GLY 20.A N VAL 16.A O no hydrogen 3.087 N/A ILE 21.A N LEU 17.A O no hydrogen 2.945 N/A ARG 22.A N PRO 18.A O no hydrogen 2.941 N/A ARG 22.A NH1 GLU 19.A OE2 no hydrogen 3.256 N/A VAL 23.A N GLU 19.A O no hydrogen 3.157 N/A LEU 24.A N GLY 20.A O no hydrogen 2.991 N/A GLU 25.A N ILE 21.A O no hydrogen 2.816 N/A ALA 26.A N ARG 22.A O no hydrogen 3.086 N/A ALA 27.A N VAL 23.A O no hydrogen 2.866 N/A ALA 28.A N LEU 24.A O no hydrogen 2.772 N/A LEU 29.A N GLU 25.A O no hydrogen 3.057 N/A LYS 30.A N ALA 26.A O no hydrogen 3.146 N/A LYS 30.A NZ LEU 346.A O no hydrogen 2.997 N/A LYS 30.A NZ LEU 349.A O no hydrogen 2.782 N/A HIS 31.A N ALA 27.A O no hydrogen 3.105 N/A HIS 31.A NE2 ASP 313.A OD2 no hydrogen 2.678 N/A LEU 33.A N ALA 28.A O no hydrogen 2.866 N/A GLU 36.A N PHE 2.A O no hydrogen 2.880 N/A ASP 38.A N ILE 4.A O no hydrogen 2.909 N/A PHE 40.A N ALA 6.A O no hydrogen 2.915 N/A SER 44.A OG GLU 41.A O no hydrogen 2.891 N/A CYS 45.A N ASP 10.A OD1 no hydrogen 2.775 N/A CYS 45.A SG ASP 10.A OD2 no hydrogen 3.237 N/A TYR 47.A N SER 44.A OG no hydrogen 3.342 N/A TYR 48.A N SER 44.A O no hydrogen 3.190 N/A LEU 49.A N CYS 45.A O no hydrogen 2.968 N/A HIS 51.A N TYR 47.A O no hydrogen 2.958 N/A GLY 52.A N TYR 48.A O no hydrogen 2.772 N/A LYS 53.A NZ ASP 55.A OD1 no hydrogen 3.012 N/A TRP 57.A N PRO 54.A O no hydrogen 3.203 N/A GLN 60.A N ASP 56.A O no hydrogen 3.126 N/A GLN 60.A NE2 ASP 56.A OD1 no hydrogen 2.962 N/A GLN 60.A NE2 ASP 56.A OD2 no hydrogen 3.499 N/A LEU 61.A N TRP 57.A O no hydrogen 2.965 N/A LYS 62.A N ALA 58.A O no hydrogen 3.086 N/A GLN 63.A N GLN 60.A O no hydrogen 3.455 N/A TYR 64.A N LEU 61.A O no hydrogen 3.071 N/A TYR 64.A OH ASP 38.A OD2 no hydrogen 2.777 N/A ASP 65.A N ARG 3.A O no hydrogen 2.869 N/A ILE 67.A N SER 268.A O no hydrogen 2.868 N/A TYR 68.A N ALA 5.A O no hydrogen 2.782 N/A PHE 69.A N PHE 270.A O no hydrogen 2.829 N/A GLY 70.A N ILE 7.A O no hydrogen 2.878 N/A ALA 71.A N PRO 8.A O no hydrogen 3.117 N/A GLY 73.A N ASP 10.A OD2 no hydrogen 2.722 N/A LYS 77.A N TRP 74.A O no hydrogen 2.950 N/A VAL 78.A N TRP 74.A O no hydrogen 2.909 N/A SER 83.A N PRO 79.A O no hydrogen 3.094 N/A SER 83.A OG PRO 79.A O no hydrogen 3.465 N/A SER 83.A OG ASP 80.A O no hydrogen 3.204 N/A LEU 84.A N ASP 80.A O no hydrogen 3.133 N/A TRP 85.A N HIS 81.A O no hydrogen 3.292 N/A GLY 86.A N ILE 82.A O no hydrogen 3.001 N/A SER 87.A N LEU 84.A O no hydrogen 3.308 N/A SER 87.A OG SER 83.A O no hydrogen 2.661 N/A LEU 88.A N SER 87.A OG no hydrogen 2.716 N/A LEU 89.A N LEU 84.A O no hydrogen 3.069 N/A PHE 91.A N SER 87.A O no hydrogen 3.126 N/A ARG 92.A N LEU 88.A O no hydrogen 2.962 N/A ARG 92.A NE ASN 259.A OD1 no hydrogen 2.821 N/A ARG 92.A NH2 GLU 271.A OE2 no hydrogen 2.803 N/A ARG 93.A N LEU 89.A O no hydrogen 3.042 N/A ARG 93.A NH2 TYR 135.A O no hydrogen 2.638 N/A GLU 94.A N LYS 90.A O no hydrogen 2.897 N/A PHE 95.A N PHE 91.A O no hydrogen 3.131 N/A ASP 96.A N ARG 93.A O no hydrogen 3.165 N/A GLN 97.A N ARG 92.A O no hydrogen 2.831 N/A GLN 97.A NE2 PRO 267.A O no hydrogen 2.813 N/A TYR 98.A OH GLU 263.A OE2 no hydrogen 2.691 N/A VAL 99.A N LEU 260.A O no hydrogen 3.365 N/A ASN 100.A N ARG 128.A O no hydrogen 2.933 N/A ASN 100.A ND2 ASN 130.A OD1 no hydrogen 3.148 N/A ILE 101.A N ALA 258.A O no hydrogen 2.877 N/A ARG 102.A N VAL 126.A O no hydrogen 2.950 N/A ARG 102.A NE ASN 100.A OD1 no hydrogen 3.222 N/A ARG 102.A NH1 SER 242.A OG no hydrogen 2.737 N/A VAL 104.A N PHE 124.A O no hydrogen 2.744 N/A ARG 105.A NE ASP 123.A OD1 no hydrogen 3.321 N/A LEU 106.A N ILE 122.A O no hydrogen 3.000 N/A VAL 110.A N PHE 107.A O no hydrogen 3.359 N/A CYS 112.A SG LEU 114.A O no hydrogen 3.507 N/A CYS 112.A SG CYS 248.A O no hydrogen 3.390 N/A ARG 117.A NH2 GLU 226.A OE1 no hydrogen 2.742 N/A LYS 118.A N ASP 121.A OD2 no hydrogen 3.230 N/A ASP 121.A N LYS 118.A O no hydrogen 3.090 N/A PHE 124.A N VAL 104.A O no hydrogen 2.973 N/A VAL 125.A N ASP 229.A O no hydrogen 2.807 N/A VAL 126.A N ARG 102.A O no hydrogen 3.019 N/A VAL 127.A N VAL 231.A O no hydrogen 2.683 N/A ARG 128.A N ASN 100.A O no hydrogen 2.889 N/A ARG 128.A NE ASN 235.A O no hydrogen 2.840 N/A ARG 128.A NE ASN 235.A OD1 no hydrogen 3.190 N/A ARG 128.A NH2 ASN 235.A O no hydrogen 3.396 N/A ARG 128.A NH2 ASN 235.A OD1 no hydrogen 2.857 N/A GLU 129.A N ALA 233.A O no hydrogen 2.979 N/A ASN 130.A N TYR 98.A O no hydrogen 3.038 N/A ASN 130.A ND2 GLN 97.A O no hydrogen 2.888 N/A ASN 130.A ND2 ASN 259.A OD1 no hydrogen 2.831 N/A THR 131.A N GLU 129.A OE1 no hydrogen 3.110 N/A THR 131.A N GLU 129.A OE2 no hydrogen 2.950 N/A THR 131.A OG1 GLU 129.A OE2 no hydrogen 2.691 N/A GLU 132.A N GLU 129.A OE1 no hydrogen 2.829 N/A GLY 133.A N ILE 155.A O no hydrogen 2.792 N/A GLU 134.A N GLU 134.A OE1 no hydrogen 2.723 N/A TYR 135.A OH ASP 239.A OD2 no hydrogen 2.520 N/A SER 136.A OG GLN 152.A OE1 no hydrogen 3.321 N/A SER 136.A OG GLU 153.A O no hydrogen 2.724 N/A LEU 138.A N SER 136.A OG no hydrogen 2.881 N/A GLY 140.A N ILE 151.A O no hydrogen 2.941 N/A ASN 144.A N GLU 148.A OE2 no hydrogen 2.878 N/A THR 145.A N PHE 142.A O no hydrogen 3.264 N/A THR 145.A OG1 PHE 142.A O no hydrogen 2.729 N/A ASN 147.A N THR 145.A OG1 no hydrogen 3.260 N/A GLU 148.A N THR 145.A O no hydrogen 3.108 N/A ILE 151.A N GLY 140.A O no hydrogen 2.875 N/A GLU 153.A N LEU 138.A O no hydrogen 2.929 N/A ILE 155.A N GLY 133.A O no hydrogen 3.359 N/A THR 157.A N GLU 132.A OE1 no hydrogen 2.940 N/A THR 157.A OG1 GLU 132.A OE2 no hydrogen 2.675 N/A GLY 160.A N THR 157.A OG1 no hydrogen 3.016 N/A VAL 161.A N THR 157.A O no hydrogen 2.909 N/A ASP 162.A N ARG 158.A O no hydrogen 2.839 N/A ARG 163.A N ARG 159.A O no hydrogen 3.184 N/A ARG 163.A NH1 ASP 96.A OD1 no hydrogen 3.474 N/A ARG 163.A NH1 ASP 96.A OD2 no hydrogen 2.850 N/A ARG 163.A NH2 ASP 96.A OD1 no hydrogen 3.018 N/A ARG 163.A NH2 THR 131.A OG1 no hydrogen 3.154 N/A ILE 164.A N GLY 160.A O no hydrogen 3.425 N/A LEU 165.A N VAL 161.A O no hydrogen 3.151 N/A LYS 166.A N ASP 162.A O no hydrogen 2.835 N/A LYS 166.A NZ ASP 170.A OD2 no hydrogen 3.183 N/A TYR 167.A N ARG 163.A O no hydrogen 3.146 N/A ALA 168.A N ILE 164.A O no hydrogen 3.103 N/A PHE 169.A N LEU 165.A O no hydrogen 2.976 N/A ASP 170.A N LYS 166.A O no hydrogen 2.837 N/A LEU 171.A N TYR 167.A O no hydrogen 2.889 N/A ALA 172.A N ALA 168.A O no hydrogen 2.980 N/A GLU 173.A N PHE 169.A O no hydrogen 2.973 N/A LYS 174.A N ASP 170.A O no hydrogen 3.331 N/A ARG 175.A N LEU 171.A O no hydrogen 3.237 N/A ARG 175.A N ALA 172.A O no hydrogen 3.111 N/A ARG 175.A NE ASP 229.A OD1 no hydrogen 3.401 N/A ARG 175.A NE ASP 229.A OD2 no hydrogen 2.704 N/A ARG 175.A NH2 ASP 229.A OD1 no hydrogen 3.026 N/A ARG 177.A NH1 GLU 226.A O no hydrogen 2.879 N/A ARG 177.A NH2 GLU 226.A O no hydrogen 2.766 N/A LYS 178.A NZ GLU 173.A O no hydrogen 2.764 N/A LYS 178.A NZ ARG 175.A O no hydrogen 3.086 N/A HIS 179.A ND1 SER 208.A O no hydrogen 3.197 N/A VAL 180.A N SER 208.A O no hydrogen 2.849 N/A THR 181.A N VAL 230.A O no hydrogen 2.759 N/A THR 181.A OG1 HIS 179.A NE2 no hydrogen 3.302 N/A THR 181.A OG1 ASP 210.A OD2 no hydrogen 2.919 N/A SER 182.A N ASP 210.A O no hydrogen 2.850 N/A ALA 183.A N VAL 232.A O no hydrogen 2.875 N/A THR 184.A N GLN 212.A O no hydrogen 2.921 N/A THR 184.A OG1 ASP 195.A OD1 no hydrogen 2.710 N/A THR 184.A OG1 ASP 195.A OD2 no hydrogen 3.403 N/A LYS 185.A NZ ASN 187.A OD1 no hydrogen 2.868 N/A SER 186.A OG ASP 195.A OD2 no hydrogen 2.655 N/A GLY 188.A N ASN 187.A OD1 no hydrogen 2.710 N/A TRP 194.A N SER 191.A O no hydrogen 3.014 N/A TRP 194.A NE1 SER 182.A OG no hydrogen 2.796 N/A LYS 196.A N PRO 192.A O no hydrogen 2.964 N/A ARG 197.A N TYR 193.A O no hydrogen 2.964 N/A ARG 197.A NE ASP 162.A OD1 no hydrogen 2.957 N/A ARG 197.A NH2 ASP 162.A OD1 no hydrogen 3.351 N/A ARG 197.A NH2 ASP 162.A OD2 no hydrogen 2.896 N/A THR 198.A N TRP 194.A O no hydrogen 2.920 N/A THR 198.A OG1 TRP 194.A O no hydrogen 2.644 N/A GLU 199.A N ASP 195.A O no hydrogen 2.944 N/A ALA 200.A N LYS 196.A O no hydrogen 3.076 N/A TYR 204.A N ALA 201.A O no hydrogen 3.225 N/A TYR 204.A OH ASP 170.A OD1 no hydrogen 2.561 N/A HIS 206.A ND1 GLU 173.A OE2 no hydrogen 2.897 N/A VAL 207.A N TYR 204.A O no hydrogen 3.176 N/A SER 208.A N LYS 178.A O no hydrogen 2.863 N/A ASP 210.A N VAL 180.A O no hydrogen 3.027 N/A LYS 211.A NZ ASP 195.A OD2 no hydrogen 3.064 N/A GLN 212.A N SER 182.A O no hydrogen 3.037 N/A ILE 214.A N THR 184.A O no hydrogen 2.673 N/A ILE 216.A N ASP 215.A OD1 no hydrogen 2.749 N/A LEU 217.A N HIS 213.A O no hydrogen 2.946 N/A CYS 218.A N ILE 214.A O no hydrogen 3.028 N/A CYS 218.A SG ILE 214.A O no hydrogen 3.400 N/A ALA 219.A N ASP 215.A O no hydrogen 3.272 N/A ARG 220.A N ILE 216.A O no hydrogen 2.889 N/A PHE 221.A N LEU 217.A O no hydrogen 3.005 N/A VAL 222.A N ALA 219.A O no hydrogen 3.223 N/A LEU 223.A N ALA 219.A O no hydrogen 2.983 N/A GLN 224.A N ARG 220.A O no hydrogen 2.760 N/A GLU 226.A N GLU 226.A OE1 no hydrogen 2.783 N/A ARG 227.A N GLN 224.A O no hydrogen 3.400 N/A PHE 228.A N PRO 225.A O no hydrogen 3.351 N/A VAL 230.A N HIS 179.A O no hydrogen 3.258 N/A VAL 231.A N VAL 125.A O no hydrogen 2.829 N/A VAL 232.A N THR 181.A O no hydrogen 2.799 N/A ALA 233.A N VAL 127.A O no hydrogen 3.020 N/A SER 234.A OG GLU 134.A OE1 no hydrogen 3.180 N/A SER 234.A OG GLU 134.A OE2 no hydrogen 2.505 N/A ASN 235.A ND2 GLU 132.A O no hydrogen 2.917 N/A LEU 236.A N GLU 134.A OE1 no hydrogen 3.124 N/A GLY 238.A N SER 234.A O no hydrogen 2.816 N/A ASP 239.A N ASN 235.A O no hydrogen 3.187 N/A ILE 240.A N LEU 236.A O no hydrogen 3.051 N/A LEU 241.A N PHE 237.A O no hydrogen 3.018 N/A SER 242.A N GLY 238.A O no hydrogen 3.124 N/A SER 242.A OG GLY 238.A O no hydrogen 2.871 N/A SER 242.A OG ASP 239.A O no hydrogen 3.043 N/A ASP 243.A N ILE 240.A O no hydrogen 3.187 N/A LEU 244.A N ILE 240.A O no hydrogen 3.089 N/A GLY 245.A N LEU 241.A O no hydrogen 2.893 N/A ALA 247.A N ASP 243.A O no hydrogen 3.182 N/A CYS 248.A N LEU 244.A O no hydrogen 2.998 N/A CYS 248.A SG PHE 221.A O no hydrogen 3.594 N/A CYS 248.A SG LEU 244.A O no hydrogen 3.395 N/A ALA 249.A N GLY 245.A O no hydrogen 3.204 N/A GLY 250.A N ALA 247.A O no hydrogen 2.964 N/A THR 251.A N PRO 246.A O no hydrogen 3.132 N/A THR 251.A OG1 ASP 329.A OD1 no hydrogen 2.592 N/A GLY 253.A N THR 251.A OG1 no hydrogen 2.983 N/A SER 257.A N GLU 271.A O no hydrogen 2.814 N/A SER 257.A OG GLU 271.A O no hydrogen 2.882 N/A ALA 258.A N ILE 101.A O no hydrogen 2.912 N/A ASN 259.A N LEU 269.A O no hydrogen 2.709 N/A ASN 259.A ND2 LEU 269.A O no hydrogen 3.391 N/A ASN 259.A ND2 GLU 271.A OE2 no hydrogen 3.331 N/A LEU 260.A N VAL 99.A O no hydrogen 2.782 N/A ASN 261.A N SER 268.A OG no hydrogen 3.008 N/A ASN 261.A ND2 ASP 96.A O no hydrogen 2.854 N/A ARG 264.A N ASN 261.A O no hydrogen 2.874 N/A ARG 264.A NH1 PHE 299.A O no hydrogen 2.941 N/A ARG 264.A NH2 PHE 299.A O no hydrogen 2.954 N/A ASN 265.A N ASN 261.A OD1 no hydrogen 2.778 N/A PHE 266.A N ASN 261.A OD1 no hydrogen 2.998 N/A LEU 269.A N ASN 259.A O no hydrogen 2.911 N/A PHE 270.A N ILE 67.A O no hydrogen 2.752 N/A GLU 271.A N SER 257.A O no hydrogen 3.127 N/A VAL 273.A N ALA 255.A O no hydrogen 2.924 N/A HIS 274.A ND1 GLY 275.A O no hydrogen 2.876 N/A SER 276.A OG GLY 73.A O no hydrogen 2.580 N/A ILE 280.A N ALA 277.A O no hydrogen 3.178 N/A PHE 281.A N ALA 277.A O no hydrogen 3.158 N/A GLY 282.A N GLU 15.A OE2 no hydrogen 2.812 N/A LYS 283.A N ILE 280.A O no hydrogen 3.383 N/A ASN 287.A ND2 ASP 329.A OD1 no hydrogen 2.956 N/A ILE 289.A N ASN 287.A OD1 no hydrogen 3.032 N/A ALA 290.A N GLY 253.A O no hydrogen 3.113 N/A TRP 292.A N ILE 289.A O no hydrogen 2.761 N/A SER 293.A N ALA 290.A O no hydrogen 3.007 N/A SER 293.A OG GLU 271.A O no hydrogen 2.733 N/A SER 293.A OG ALA 290.A O no hydrogen 2.901 N/A ALA 295.A N ILE 291.A O no hydrogen 3.060 N/A LEU 296.A N TRP 292.A O no hydrogen 2.978 N/A GLU 298.A N ALA 295.A O no hydrogen 3.033 N/A PHE 299.A N LEU 296.A O no hydrogen 2.976 N/A GLY 301.A N LEU 297.A O no hydrogen 2.887 N/A ASP 304.A N GLY 301.A O no hydrogen 3.004 N/A GLU 305.A N GLU 305.A OE1 no hydrogen 2.891 N/A ARG 306.A N ASP 304.A OD1 no hydrogen 3.061 N/A ARG 306.A NH1 HIS 31.A O no hydrogen 2.784 N/A GLN 308.A NE2 GLU 298.A OE2 no hydrogen 3.206 N/A GLN 308.A NE2 ASP 312.A OD1 no hydrogen 3.053 N/A ARG 309.A N GLU 305.A O no hydrogen 3.035 N/A ALA 310.A N ARG 306.A O no hydrogen 3.006 N/A HIS 311.A N TYR 307.A O no hydrogen 3.010 N/A HIS 311.A ND1 ASP 312.A OD1 no hydrogen 2.821 N/A ASP 312.A N GLN 308.A O no hydrogen 2.990 N/A ASP 313.A N ARG 309.A O no hydrogen 2.853 N/A ASN 315.A N ASP 312.A O no hydrogen 2.941 N/A ALA 316.A N ASP 313.A O no hydrogen 2.866 N/A GLU 318.A N LEU 314.A O no hydrogen 2.909 N/A ARG 319.A N ASN 315.A O no hydrogen 3.023 N/A ARG 319.A NE ASN 315.A OD1 no hydrogen 2.977 N/A VAL 320.A N ALA 316.A O no hydrogen 3.115 N/A ILE 321.A N ILE 317.A O no hydrogen 3.104 N/A ALA 322.A N GLU 318.A O no hydrogen 2.995 N/A ASP 323.A N ARG 319.A O no hydrogen 2.887 N/A GLY 324.A N ILE 321.A O no hydrogen 3.135 N/A SER 325.A N VAL 320.A O no hydrogen 3.002 N/A THR 327.A OG1 ASP 329.A OD2 no hydrogen 2.583 N/A GLY 331.A N THR 327.A O no hydrogen 3.113 N/A LEU 333.A N VAL 326.A O no hydrogen 3.105 N/A SER 334.A N GLN 337.A OE1 no hydrogen 3.003 N/A THR 335.A N ASN 284.A O no hydrogen 3.005 N/A THR 335.A OG1 ALA 286.A O no hydrogen 2.669 N/A GLN 336.A NE2 ASN 284.A OD1 no hydrogen 2.698 N/A GLN 337.A N SER 334.A OG no hydrogen 3.249 N/A VAL 338.A N SER 334.A O no hydrogen 3.044 N/A GLY 339.A N THR 335.A O no hydrogen 3.106 N/A ALA 340.A N GLN 336.A O no hydrogen 2.950 N/A ALA 341.A N GLN 337.A O no hydrogen 2.927 N/A ILE 342.A N VAL 338.A O no hydrogen 2.963 N/A SER 343.A N GLY 339.A O no hydrogen 3.010 N/A ASP 344.A N ALA 340.A O no hydrogen 2.891 N/A THR 345.A N ALA 341.A O no hydrogen 3.005 N/A THR 345.A OG1 ALA 341.A O no hydrogen 2.673 N/A LEU 346.A N ILE 342.A O no hydrogen 2.923 N/A ALA 347.A N SER 343.A O no hydrogen 3.116 N/A ARG 348.A N ASP 344.A O no hydrogen 3.114 N/A ARG 348.A N THR 345.A O no hydrogen 3.202 N/A ARG 348.A NE ASP 344.A OD1 no hydrogen 2.934 N/A ARG 348.A NE ASP 344.A OD2 no hydrogen 3.184 N/A LEU 349.A N LEU 346.A O no hydrogen 3.223 N/A