Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3fly_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NH2 PRO 89.A O no hydrogen 2.706 N/A TYR 6.A N VAL 17.A O no hydrogen 2.927 N/A TYR 6.A OH TYR 21.A O no hydrogen 2.634 N/A GLN 8.A N TRP 15.A O no hydrogen 2.840 N/A LEU 10.A N THR 13.A O no hydrogen 2.984 N/A THR 13.A OG1 ASN 11.A O no hydrogen 2.740 N/A TRP 15.A N GLN 8.A O no hydrogen 2.625 N/A GLU 16.A N TYR 100.A OH no hydrogen 2.993 N/A VAL 17.A N TYR 6.A O no hydrogen 3.071 N/A GLU 19.A N THR 4.A O no hydrogen 2.940 N/A ARG 20.A NE ASP 40.A OD1 no hydrogen 2.857 N/A ARG 20.A NH2 ASP 40.A OD1 no hydrogen 3.308 N/A ARG 20.A NH2 ASP 40.A OD2 no hydrogen 2.789 N/A TYR 21.A N PRO 18.A O no hydrogen 3.073 N/A TYR 21.A OH ASP 85.A OD1 no hydrogen 2.662 N/A GLN 22.A N PHE 39.A O no hydrogen 2.913 N/A GLN 22.A NE2 GLU 19.A O no hydrogen 2.724 N/A SER 25.A N ALA 37.A O no hydrogen 2.795 N/A VAL 27.A N VAL 35.A O no hydrogen 2.938 N/A GLY 30.A N GLY 33.A O no hydrogen 2.847 N/A VAL 35.A N GLY 28.A O no hydrogen 2.946 N/A CYS 36.A N VAL 49.A O no hydrogen 2.756 N/A ALA 37.A N SER 25.A O no hydrogen 2.654 N/A ALA 38.A N VAL 47.A O no hydrogen 2.846 N/A PHE 39.A N GLN 22.A O no hydrogen 2.785 N/A ASP 40.A N LEU 45.A O no hydrogen 2.950 N/A THR 41.A N ARG 20.A O no hydrogen 2.800 N/A THR 41.A OG1 ARG 20.A O no hydrogen 2.773 N/A LYS 42.A N ASP 40.A OD1 no hydrogen 3.010 N/A THR 43.A N ASP 40.A O no hydrogen 3.343 N/A THR 43.A OG1 ASP 40.A OD2 no hydrogen 2.687 N/A GLY 44.A N ASP 40.A O no hydrogen 2.770 N/A LEU 45.A N THR 43.A OG1 no hydrogen 3.280 N/A VAL 47.A N ALA 38.A O no hydrogen 2.865 N/A ALA 48.A N THR 103.A O no hydrogen 2.666 N/A VAL 49.A N CYS 36.A O no hydrogen 2.654 N/A LYS 50.A N LEU 101.A O no hydrogen 2.711 N/A LYS 50.A NZ ALA 31.A O no hydrogen 2.771 N/A LYS 50.A NZ GLU 68.A OE2 no hydrogen 2.466 N/A LYS 51.A N SER 34.A O no hydrogen 3.215 N/A LYS 51.A NZ ILE 14.A O no hydrogen 2.746 N/A LEU 52.A N VAL 99.A O no hydrogen 3.124 N/A SER 53.A N TYR 32.A O no hydrogen 3.354 N/A SER 53.A OG TYR 32.A O no hydrogen 3.422 N/A SER 58.A OG HIS 61.A ND1 no hydrogen 2.742 N/A HIS 61.A N SER 58.A OG no hydrogen 3.051 N/A HIS 61.A ND1 SER 58.A OG no hydrogen 2.742 N/A ALA 62.A N SER 58.A O no hydrogen 2.752 N/A LYS 63.A N ILE 59.A O no hydrogen 2.873 N/A LYS 63.A NZ GLU 323.A O no hydrogen 2.769 N/A ARG 64.A N ILE 60.A O no hydrogen 3.008 N/A THR 65.A N HIS 61.A O no hydrogen 2.897 N/A THR 65.A OG1 PRO 55.A O no hydrogen 2.879 N/A THR 65.A OG1 HIS 61.A O no hydrogen 3.008 N/A TYR 66.A N ALA 62.A O no hydrogen 3.072 N/A ARG 67.A N LYS 63.A O no hydrogen 2.780 N/A ARG 67.A NE GLU 323.A OE1 no hydrogen 3.391 N/A ARG 67.A NE GLU 323.A OE2 no hydrogen 2.780 N/A ARG 67.A NH1 GLU 323.A OE1 no hydrogen 2.960 N/A GLU 68.A N ARG 64.A O no hydrogen 2.973 N/A LEU 69.A N THR 65.A O no hydrogen 3.083 N/A ARG 70.A N TYR 66.A O no hydrogen 2.911 N/A ARG 70.A NH1 TYR 66.A OH no hydrogen 3.073 N/A ARG 70.A NH1 ASP 319.A O no hydrogen 3.482 N/A ARG 70.A NH2 ASP 319.A O no hydrogen 2.803 N/A LEU 71.A N ARG 67.A O no hydrogen 2.943 N/A LEU 72.A N GLU 68.A O no hydrogen 2.991 N/A LYS 73.A N LEU 69.A O no hydrogen 2.885 N/A LYS 73.A NZ GLU 339.A O no hydrogen 2.770 N/A LYS 73.A NZ GLU 339.A OE1 no hydrogen 2.719 N/A HIS 74.A N ARG 70.A O no hydrogen 3.132 N/A HIS 74.A N LEU 71.A O no hydrogen 3.168 N/A HIS 74.A NE2 PRO 317.A O no hydrogen 2.959 N/A MET 75.A N LEU 71.A O no hydrogen 3.296 N/A LYS 76.A N TYR 137.A OH no hydrogen 2.882 N/A ASN 79.A ND2 GLN 130.A OE1 no hydrogen 3.313 N/A ASN 79.A ND2 LEU 161.A O no hydrogen 2.947 N/A VAL 80.A N HIS 77.A O no hydrogen 3.139 N/A ILE 81.A N ILE 163.A O no hydrogen 2.945 N/A LEU 84.A N VAL 102.A O no hydrogen 2.817 N/A ASP 85.A N VAL 102.A O no hydrogen 3.369 N/A PHE 87.A N TYR 100.A O no hydrogen 3.073 N/A THR 88.A OG1 ASP 98.A O no hydrogen 2.893 N/A ALA 90.A N THR 88.A OG1 no hydrogen 3.287 N/A SER 92.A OG GLU 94.A OE1 no hydrogen 3.498 N/A PHE 96.A N LEU 93.A O no hydrogen 3.199 N/A TYR 100.A N PHE 87.A O no hydrogen 3.016 N/A LEU 101.A N LYS 50.A O no hydrogen 2.784 N/A VAL 102.A N ASP 85.A O no hydrogen 2.830 N/A THR 103.A N ALA 48.A O no hydrogen 2.911 N/A THR 103.A OG1 GLY 82.A O no hydrogen 2.657 N/A LEU 105.A N ARG 46.A O no hydrogen 2.961 N/A ALA 108.A N VAL 155.A O no hydrogen 3.388 N/A ASP 109.A N ASN 112.A OD1 no hydrogen 3.390 N/A LEU 110.A N PRO 150.A O no hydrogen 3.154 N/A LEU 110.A N LEU 153.A O no hydrogen 2.785 N/A ASN 112.A N ASP 109.A O no hydrogen 3.153 N/A ASN 112.A N ASP 109.A OD2 no hydrogen 3.161 N/A ILE 113.A N LEU 110.A O no hydrogen 3.229 N/A VAL 114.A N LEU 110.A O no hydrogen 3.013 N/A LYS 115.A N ASN 111.A O no hydrogen 3.227 N/A LYS 115.A NZ ASN 112.A O no hydrogen 3.537 N/A GLN 117.A N VAL 114.A O no hydrogen 2.784 N/A LEU 119.A N LEU 211.A O no hydrogen 3.075 N/A HIS 123.A N THR 120.A OG1 no hydrogen 3.416 N/A VAL 124.A N THR 120.A O no hydrogen 3.036 N/A GLN 125.A N ASP 121.A O no hydrogen 2.854 N/A GLN 125.A NE2 ASP 121.A OD2 no hydrogen 3.194 N/A PHE 126.A N ASP 122.A O no hydrogen 3.233 N/A LEU 127.A N HIS 123.A O no hydrogen 2.990 N/A ILE 128.A N VAL 124.A O no hydrogen 2.884 N/A TYR 129.A N GLN 125.A O no hydrogen 2.933 N/A TYR 129.A OH GLU 312.A OE2 no hydrogen 2.589 N/A GLN 130.A N PHE 126.A O no hydrogen 3.169 N/A GLN 130.A NE2 PHE 126.A O no hydrogen 3.295 N/A GLN 130.A NE2 CYS 159.A O no hydrogen 2.777 N/A ILE 131.A N LEU 127.A O no hydrogen 3.132 N/A LEU 132.A N ILE 128.A O no hydrogen 2.945 N/A ARG 133.A N TYR 129.A O no hydrogen 2.798 N/A ARG 133.A NE ASP 311.A O no hydrogen 2.799 N/A ARG 133.A NH1 GLU 78.A OE2 no hydrogen 3.527 N/A ARG 133.A NH1 ASP 311.A O no hydrogen 3.010 N/A ARG 133.A NH1 ASP 311.A OD1 no hydrogen 3.183 N/A ARG 133.A NH2 GLU 78.A OE2 no hydrogen 3.000 N/A ARG 133.A NH2 ASN 79.A OD1 no hydrogen 2.900 N/A GLY 134.A N GLN 130.A O no hydrogen 2.897 N/A LEU 135.A N ILE 131.A O no hydrogen 2.796 N/A LYS 136.A N LEU 132.A O no hydrogen 2.807 N/A LYS 136.A NZ GLU 312.A O no hydrogen 2.691 N/A TYR 137.A N ARG 133.A O no hydrogen 3.360 N/A ILE 138.A N GLY 134.A O no hydrogen 2.920 N/A HIS 139.A N LEU 135.A O no hydrogen 2.772 N/A HIS 139.A NE2 ASP 200.A OD2 no hydrogen 2.797 N/A SER 140.A N LYS 136.A O no hydrogen 2.969 N/A SER 140.A OG LYS 136.A O no hydrogen 3.455 N/A SER 140.A OG TYR 137.A O no hydrogen 2.565 N/A ALA 141.A N ILE 138.A O no hydrogen 3.169 N/A ASP 142.A N HIS 139.A O no hydrogen 2.837 N/A ILE 143.A N ILE 138.A O no hydrogen 3.258 N/A HIS 145.A N ASP 200.A OD2 no hydrogen 2.845 N/A HIS 145.A NE2 LEU 164.A O no hydrogen 2.641 N/A ARG 146.A N ASP 200.A OD1 no hydrogen 2.936 N/A ARG 146.A NE ILE 144.A O no hydrogen 3.276 N/A ASP 147.A N HIS 145.A ND1 no hydrogen 3.135 N/A LYS 149.A NZ HIS 169.A NE2 no hydrogen 3.381 N/A ASN 152.A N LYS 149.A O no hydrogen 2.831 N/A ASN 152.A ND2 ASP 147.A O no hydrogen 2.684 N/A LEU 153.A N PRO 150.A O no hydrogen 3.102 N/A ALA 154.A N LYS 162.A O no hydrogen 2.993 N/A VAL 155.A N ALA 108.A O no hydrogen 2.786 N/A ASN 156.A N GLU 160.A O no hydrogen 3.021 N/A ASN 156.A ND2 GLU 160.A OE1 no hydrogen 2.945 N/A ASP 158.A N ASN 156.A OD1 no hydrogen 2.920 N/A CYS 159.A N ASN 156.A O no hydrogen 2.953 N/A GLU 160.A N ASN 156.A OD1 no hydrogen 3.107 N/A LEU 161.A N GLN 130.A OE1 no hydrogen 2.791 N/A LYS 162.A N ALA 154.A O no hydrogen 2.819 N/A LYS 162.A NZ GLU 78.A O no hydrogen 2.743 N/A ILE 163.A N ASN 79.A O no hydrogen 2.852 N/A LEU 164.A N ASN 152.A O no hydrogen 2.865 N/A GLY 167.A N HIS 145.A O no hydrogen 3.205 N/A THR 170.A N GLU 173.A OE1 no hydrogen 3.017 N/A MET 174.A N ASP 171.A O no hydrogen 3.191 N/A THR 175.A N ASP 172.A O no hydrogen 3.231 N/A THR 175.A OG1 ASP 171.A O no hydrogen 2.698 N/A THR 175.A OG1 ASP 172.A O no hydrogen 3.447 N/A THR 180.A OG1 GLU 173.A O no hydrogen 2.418 N/A ARG 181.A N VAL 178.A O no hydrogen 3.129 N/A ARG 181.A NE GLN 226.A OE1 no hydrogen 2.808 N/A ARG 181.A NH1 MET 174.A O no hydrogen 2.860 N/A ARG 181.A NH1 GLY 176.A O no hydrogen 2.708 N/A ARG 181.A NH2 GLY 176.A O no hydrogen 3.080 N/A ARG 181.A NH2 GLY 220.A O no hydrogen 2.995 N/A ARG 181.A NH2 GLN 226.A OE1 no hydrogen 2.999 N/A TRP 182.A NE1 GLY 220.A O no hydrogen 3.006 N/A TYR 183.A OH GLU 210.A OE1 no hydrogen 2.523 N/A TYR 183.A OH GLU 210.A OE2 no hydrogen 3.301 N/A ARG 184.A N ARG 181.A O no hydrogen 3.146 N/A GLU 187.A N GLU 187.A OE2 no hydrogen 2.895 N/A ILE 188.A N ALA 185.A O no hydrogen 3.097 N/A MET 189.A N ALA 185.A O no hydrogen 2.966 N/A LEU 190.A N PRO 186.A O no hydrogen 3.049 N/A ASN 191.A N ILE 188.A O no hydrogen 3.390 N/A TRP 192.A N GLU 187.A O no hydrogen 2.856 N/A GLN 197.A NE2 HIS 139.A O no hydrogen 2.714 N/A THR 198.A N ASN 196.A OD1 no hydrogen 3.200 N/A THR 198.A OG1 ASN 196.A OD1 no hydrogen 2.403 N/A VAL 199.A N ASN 196.A O no hydrogen 3.184 N/A ASP 200.A N GLN 197.A O no hydrogen 3.054 N/A TRP 202.A N THR 198.A O no hydrogen 3.371 N/A SER 203.A N VAL 199.A O no hydrogen 3.327 N/A SER 203.A OG TYR 183.A O no hydrogen 2.720 N/A SER 203.A OG VAL 199.A O no hydrogen 3.348 N/A VAL 204.A N ASP 200.A O no hydrogen 3.024 N/A GLY 205.A N ILE 201.A O no hydrogen 3.004 N/A CYS 206.A N TRP 202.A O no hydrogen 3.088 N/A CYS 206.A SG TRP 182.A O no hydrogen 4.029 N/A CYS 206.A SG TRP 202.A O no hydrogen 3.508 N/A ILE 207.A N SER 203.A O no hydrogen 2.899 N/A MET 208.A N VAL 204.A O no hydrogen 2.709 N/A ALA 209.A N GLY 205.A O no hydrogen 2.943 N/A GLU 210.A N CYS 206.A O no hydrogen 3.178 N/A LEU 211.A N ILE 207.A O no hydrogen 2.941 N/A LEU 212.A N MET 208.A O no hydrogen 3.011 N/A THR 213.A N ALA 209.A O no hydrogen 2.962 N/A THR 213.A OG1 ALA 209.A O no hydrogen 3.080 N/A GLY 214.A N GLU 210.A O no hydrogen 2.678 N/A ARG 215.A N THR 213.A OG1 no hydrogen 3.118 N/A GLY 220.A N PHE 218.A O no hydrogen 2.783 N/A THR 221.A N ASP 225.A OD1 no hydrogen 2.839 N/A THR 221.A OG1 ASP 222.A OD2 no hydrogen 3.333 N/A ASP 225.A N ASP 222.A OD1 no hydrogen 2.838 N/A GLN 226.A N ASP 222.A O no hydrogen 2.872 N/A GLN 226.A NE2 ARG 181.A O no hydrogen 2.873 N/A LEU 227.A N HIS 223.A O no hydrogen 2.971 N/A LYS 228.A N ILE 224.A O no hydrogen 3.044 N/A LEU 229.A N ASP 225.A O no hydrogen 3.072 N/A ILE 230.A N GLN 226.A O no hydrogen 2.894 N/A LEU 231.A N LEU 227.A O no hydrogen 2.800 N/A ARG 232.A N LYS 228.A O no hydrogen 2.946 N/A LEU 233.A N LEU 229.A O no hydrogen 3.441 N/A LEU 233.A N ILE 230.A O no hydrogen 3.117 N/A VAL 234.A N ILE 230.A O no hydrogen 3.026 N/A GLY 235.A N LEU 231.A O no hydrogen 2.834 N/A THR 236.A N MET 260.A O no hydrogen 3.054 N/A THR 236.A OG1 MET 260.A O no hydrogen 3.306 N/A LEU 242.A N GLY 238.A O no hydrogen 3.035 N/A LYS 243.A N ALA 239.A O no hydrogen 3.161 N/A LYS 244.A N LEU 241.A O no hydrogen 2.813 N/A LYS 244.A NZ ASP 287.A OD1 no hydrogen 2.689 N/A LYS 244.A NZ ASP 287.A OD2 no hydrogen 3.245 N/A LYS 244.A NZ ASP 289.A OD1 no hydrogen 2.844 N/A ILE 245.A N LEU 242.A O no hydrogen 3.207 N/A SER 246.A OG TRP 192.A O no hydrogen 3.358 N/A SER 247.A N TRP 192.A O no hydrogen 3.346 N/A ARG 251.A N SER 247.A O no hydrogen 3.042 N/A ASN 252.A N GLU 248.A O no hydrogen 3.097 N/A TYR 253.A N SER 249.A O no hydrogen 3.114 N/A ILE 254.A N ALA 250.A O no hydrogen 3.032 N/A GLN 255.A N ARG 251.A O no hydrogen 3.401 N/A SER 256.A N TYR 253.A O no hydrogen 2.996 N/A SER 256.A OG TYR 253.A O no hydrogen 2.539 N/A LEU 257.A N ILE 254.A O no hydrogen 3.154 N/A MET 260.A N THR 236.A OG1 no hydrogen 2.961 N/A LYS 262.A NZ MET 263.A O no hydrogen 2.794 N/A LYS 262.A NZ GLU 281.A OE2 no hydrogen 3.107 N/A MET 263.A N LEU 233.A O no hydrogen 2.846 N/A ALA 266.A N ASN 264.A OD1 no hydrogen 2.958 N/A ASN 267.A N ASN 264.A O no hydrogen 2.993 N/A VAL 268.A N ASN 264.A O no hydrogen 3.210 N/A VAL 268.A N PHE 265.A O no hydrogen 3.108 N/A PHE 269.A N PHE 265.A O no hydrogen 2.841 N/A ALA 272.A N PHE 269.A O no hydrogen 3.204 N/A ASN 273.A ND2 ASP 121.A OD2 no hydrogen 2.779 N/A LEU 275.A N ASN 273.A OD1 no hydrogen 2.947 N/A VAL 277.A N ASN 273.A O no hydrogen 3.010 N/A ASP 278.A N PRO 274.A O no hydrogen 2.934 N/A LEU 279.A N LEU 275.A O no hydrogen 3.062 N/A LEU 280.A N ALA 276.A O no hydrogen 2.952 N/A GLU 281.A N VAL 277.A O no hydrogen 3.022 N/A LYS 282.A N ASP 278.A O no hydrogen 3.263 N/A LYS 282.A N LEU 279.A O no hydrogen 2.956 N/A LYS 282.A NZ ASP 278.A OD1 no hydrogen 3.554 N/A MET 283.A N LEU 279.A O no hydrogen 2.951 N/A MET 283.A N LEU 280.A O no hydrogen 3.237 N/A LEU 284.A N LEU 280.A O no hydrogen 2.845 N/A ASP 289.A N ASP 287.A OD2 no hydrogen 3.188 N/A LYS 290.A N ASP 287.A O no hydrogen 2.993 N/A LYS 290.A NZ GLU 240.A OE1 no hydrogen 3.275 N/A LYS 290.A NZ GLU 240.A OE2 no hydrogen 2.929 N/A ARG 291.A N SER 288.A O no hydrogen 3.182 N/A ARG 291.A NE VAL 285.A O no hydrogen 2.742 N/A ARG 291.A NH1 GLU 187.A OE1 no hydrogen 3.304 N/A ARG 291.A NH1 GLU 187.A OE2 no hydrogen 2.730 N/A ARG 291.A NH1 VAL 285.A O no hydrogen 3.437 N/A ARG 291.A NH1 LEU 286.A O no hydrogen 3.192 N/A ARG 291.A NH2 GLU 187.A OE1 no hydrogen 2.761 N/A ARG 291.A NH2 THR 198.A O no hydrogen 3.089 N/A ILE 292.A N LYS 282.A O no hydrogen 2.969 N/A THR 293.A N GLN 296.A OE1 no hydrogen 3.051 N/A GLN 296.A N THR 293.A OG1 no hydrogen 3.129 N/A ALA 297.A N THR 293.A O no hydrogen 2.919 N/A LEU 298.A N ALA 294.A O no hydrogen 3.056 N/A ALA 299.A N GLN 296.A O no hydrogen 3.121 N/A HIS 300.A N ALA 297.A O no hydrogen 2.983 N/A HIS 300.A NE2 ASP 278.A OD2 no hydrogen 2.652 N/A TYR 302.A N HIS 300.A ND1 no hydrogen 3.148 N/A TYR 302.A OH ASP 121.A OD1 no hydrogen 2.628 N/A PHE 303.A N HIS 300.A O no hydrogen 3.009 N/A ALA 304.A N ALA 301.A O no hydrogen 3.126 N/A GLN 305.A NE2 ASP 122.A OD2 no hydrogen 3.408 N/A GLN 305.A NE2 GLN 125.A OE1 no hydrogen 2.747 N/A TYR 306.A N PHE 303.A O no hydrogen 2.946 N/A HIS 307.A N PHE 303.A O no hydrogen 2.824 N/A ASP 308.A N GLU 312.A OE2 no hydrogen 3.150 N/A ASP 310.A N ASP 308.A OD2 no hydrogen 3.024 N/A ASP 311.A N ASP 308.A O no hydrogen 2.876 N/A ALA 315.A N SER 140.A OG no hydrogen 2.801 N/A SER 321.A N ASP 319.A OD1 no hydrogen 2.956 N/A SER 321.A OG ASP 319.A OD1 no hydrogen 2.712 N/A GLU 323.A N GLN 320.A O no hydrogen 2.949 N/A SER 324.A N SER 321.A O no hydrogen 3.228 N/A SER 324.A OG SER 321.A O no hydrogen 3.125 N/A ARG 325.A N PHE 322.A O no hydrogen 2.989 N/A LEU 328.A N GLU 331.A OE1 no hydrogen 2.946 N/A TRP 332.A N LEU 328.A O no hydrogen 3.079 N/A LYS 333.A N ILE 329.A O no hydrogen 2.869 N/A LYS 333.A NZ PHE 96.A O no hydrogen 2.798 N/A SER 334.A N ASP 330.A O no hydrogen 2.878 N/A LEU 335.A N GLU 331.A O no hydrogen 3.051 N/A THR 336.A N TRP 332.A O no hydrogen 2.927 N/A THR 336.A OG1 TRP 332.A O no hydrogen 2.904 N/A TYR 337.A N LYS 333.A O no hydrogen 2.866 N/A ASP 338.A N SER 334.A O no hydrogen 2.959 N/A GLU 339.A N LEU 335.A O no hydrogen 3.182 N/A VAL 340.A N THR 336.A O no hydrogen 2.971 N/A ILE 341.A N TYR 337.A O no hydrogen 3.022 N/A SER 342.A N ASP 338.A O no hydrogen 3.008 N/A SER 342.A OG ASP 338.A O no hydrogen 2.840 N/A SER 342.A OG GLU 339.A O no hydrogen 3.342 N/A PHE 343.A N VAL 340.A O no hydrogen 3.332 N/A