Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8fly_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 5.A N CYS 97.A O no hydrogen 3.087 N/A CYS 6.A SG ALA 25.A O no hydrogen 3.520 N/A ALA 7.A N HIS 95.A O no hydrogen 2.799 N/A SER 8.A N VAL 27.A O no hydrogen 3.041 N/A ALA 10.A N SER 8.A OG no hydrogen 3.088 N/A LYS 11.A N ASN 19.A OD1 no hydrogen 3.159 N/A VAL 17.A N SER 88.A O no hydrogen 3.075 N/A HIS 18.A N GLU 16.A OE2 no hydrogen 3.065 N/A HIS 18.A ND1 GLU 16.A OE2 no hydrogen 2.649 N/A ASN 19.A N GLU 16.A OE1 no hydrogen 2.825 N/A ASN 19.A ND2 GLU 16.A OE1 no hydrogen 2.836 N/A VAL 20.A N GLU 16.A O no hydrogen 3.074 N/A TRP 21.A N VAL 17.A O no hydrogen 2.944 N/A ALA 22.A N HIS 18.A O no hydrogen 2.908 N/A THR 23.A N ASN 19.A O no hydrogen 2.890 N/A THR 23.A OG1 ASN 19.A O no hydrogen 3.015 N/A THR 23.A OG1 VAL 20.A O no hydrogen 2.902 N/A HIS 24.A N VAL 20.A O no hydrogen 3.143 N/A ALA 25.A N TRP 21.A O no hydrogen 2.876 N/A ALA 25.A N ALA 22.A O no hydrogen 3.151 N/A CYS 26.A N ALA 22.A O no hydrogen 2.691 N/A VAL 27.A N CYS 6.A O no hydrogen 2.961 N/A THR 29.A OG1 ASP 9.A OD1 no hydrogen 2.838 N/A THR 29.A OG1 ASP 9.A OD2 no hydrogen 3.484 N/A ASN 32.A N ASP 30.A OD1 no hydrogen 3.089 N/A MET 36.A N THR 123.A O no hydrogen 3.006 N/A VAL 41.A N LEU 38.A O no hydrogen 3.262 N/A THR 42.A N ARG 119.A O no hydrogen 3.254 N/A GLU 43.A N CYS 118.A O no hydrogen 2.957 N/A PHE 45.A N GLY 116.A O no hydrogen 2.970 N/A MET 47.A N GLY 114.A O no hydrogen 2.842 N/A TRP 48.A N ASN 46.A OD1 no hydrogen 2.869 N/A LYS 49.A N ASN 46.A O no hydrogen 3.093 N/A ASN 50.A ND2 TYR 331.A O no hydrogen 2.987 N/A MET 52.A N ASN 50.A OD1 no hydrogen 2.895 N/A VAL 53.A N ASN 50.A O no hydrogen 3.005 N/A GLN 55.A N ASP 51.A O no hydrogen 3.034 N/A MET 56.A N MET 52.A O no hydrogen 2.881 N/A HIS 57.A N VAL 53.A O no hydrogen 2.886 N/A GLU 58.A N GLU 54.A O no hydrogen 2.978 N/A ASP 59.A N GLN 55.A O no hydrogen 2.978 N/A ILE 60.A N MET 56.A O no hydrogen 2.910 N/A ILE 61.A N HIS 57.A O no hydrogen 2.931 N/A SER 62.A N GLU 58.A O no hydrogen 2.992 N/A SER 62.A OG GLU 66.A OE1 no hydrogen 3.199 N/A LEU 63.A N ASP 59.A O no hydrogen 2.806 N/A TRP 64.A N ILE 60.A O no hydrogen 2.903 N/A ASP 65.A N ILE 61.A O no hydrogen 2.935 N/A GLU 66.A N SER 62.A O no hydrogen 2.988 N/A SER 67.A N LEU 63.A O no hydrogen 2.918 N/A SER 67.A OG LEU 63.A O no hydrogen 2.498 N/A LEU 68.A N TRP 64.A O no hydrogen 2.884 N/A VAL 72.A N ILE 285.A O no hydrogen 3.282 N/A LYS 73.A N ILE 80.A O no hydrogen 2.758 N/A LYS 73.A NZ GLU 280.A OE2 no hydrogen 3.147 N/A LEU 74.A N ARG 283.A O no hydrogen 2.756 N/A THR 75.A N SER 78.A O no hydrogen 3.303 N/A ILE 80.A N LYS 73.A O no hydrogen 2.717 N/A GLN 82.A N CYS 71.A O no hydrogen 3.140 N/A LYS 86.A NZ GLU 235.A OE2 no hydrogen 2.717 N/A LYS 86.A NZ ALA 287.A O no hydrogen 3.123 N/A LYS 86.A NZ PRO 288.A O no hydrogen 2.644 N/A ASP 90.A N GLU 16.A OE2 no hydrogen 2.671 N/A LEU 94.A N ILE 130.A O no hydrogen 2.876 N/A HIS 95.A N ALA 7.A O no hydrogen 2.730 N/A HIS 95.A ND1 THR 127.A O no hydrogen 2.921 N/A TYR 96.A N THR 127.A OG1 no hydrogen 3.067 N/A TYR 96.A OH ASP 59.A OD2 no hydrogen 2.605 N/A CYS 97.A N PHE 5.A O no hydrogen 2.646 N/A ALA 98.A N GLN 125.A O no hydrogen 2.861 N/A PHE 102.A N PRO 99.A O no hydrogen 2.947 N/A ALA 103.A N VAL 334.A O no hydrogen 3.430 N/A ILE 104.A N VAL 124.A O no hydrogen 3.045 N/A LEU 105.A N LYS 332.A O no hydrogen 2.658 N/A LYS 106.A N SER 122.A O no hydrogen 2.786 N/A CYS 107.A N LYS 330.A O no hydrogen 2.794 N/A ASN 108.A N ASN 120.A O no hydrogen 2.804 N/A THR 111.A N ASN 109.A OD1 no hydrogen 2.952 N/A THR 111.A OG1 ASN 109.A OD1 no hydrogen 2.964 N/A PHE 112.A N ASN 109.A O no hydrogen 3.133 N/A THR 115.A N ASN 113.A OD1 no hydrogen 2.971 N/A GLY 116.A N PHE 45.A O no hydrogen 2.959 N/A CYS 118.A N GLU 43.A O no hydrogen 2.640 N/A CYS 118.A SG ASN 120.A O no hydrogen 3.477 N/A SER 122.A N LYS 106.A O no hydrogen 2.883 N/A SER 122.A OG GLU 35.A OE2 no hydrogen 2.836 N/A SER 122.A OG ASN 108.A OD1 no hydrogen 2.607 N/A THR 123.A N MET 36.A O no hydrogen 2.985 N/A VAL 124.A N ILE 104.A O no hydrogen 2.793 N/A CYS 126.A SG GLN 125.A OE1 no hydrogen 3.890 N/A THR 127.A N TYR 96.A O no hydrogen 2.800 N/A THR 127.A OG1 HIS 128.A O no hydrogen 2.827 N/A HIS 128.A N TYR 331.A OH no hydrogen 2.979 N/A HIS 128.A ND1 TYR 331.A OH no hydrogen 2.416 N/A HIS 128.A NE2 GLU 327.A OE1 no hydrogen 2.976 N/A ILE 130.A N LEU 94.A O no hydrogen 2.835 N/A VAL 133.A N LYS 131.A O no hydrogen 2.853 N/A SER 135.A OG LEU 138.A O no hydrogen 2.591 N/A THR 136.A N SER 229.A O no hydrogen 3.097 N/A THR 136.A OG1 GLU 224.A O no hydrogen 2.750 N/A THR 136.A OG1 THR 227.A O no hydrogen 2.842 N/A GLN 137.A N GLY 316.A O no hydrogen 2.783 N/A GLN 137.A NE2 ILE 225.A O no hydrogen 2.772 N/A LEU 138.A N THR 136.A O no hydrogen 2.593 N/A LEU 139.A N GLY 302.A O no hydrogen 2.933 N/A ASN 141.A N ASN 299.A O no hydrogen 2.814 N/A GLY 142.A N THR 301.A OG1 no hydrogen 3.033 N/A SER 143.A N GLU 327.A OE2 no hydrogen 3.102 N/A SER 143.A OG GLU 327.A OE1 no hydrogen 2.778 N/A SER 143.A OG GLU 327.A OE2 no hydrogen 3.459 N/A ALA 145.A N LEU 167.A O no hydrogen 2.774 N/A ILE 150.A N HIS 166.A O no hydrogen 3.202 N/A ARG 152.A N ILE 164.A O no hydrogen 2.815 N/A ARG 152.A NH1 PHE 112.A O no hydrogen 2.910 N/A ARG 152.A NH2 HIS 166.A ND1 no hydrogen 2.975 N/A ASN 155.A N SER 153.A OG no hydrogen 2.971 N/A THR 157.A N ASN 155.A OD1 no hydrogen 3.274 N/A ASN 158.A N ASN 155.A O no hydrogen 2.988 N/A ALA 160.A N ASN 158.A OD1 no hydrogen 3.192 N/A LYS 161.A N ASN 158.A O no hydrogen 3.117 N/A LYS 161.A NZ GLU 154.A OE1 no hydrogen 2.540 N/A THR 162.A OG1 ASP 322.A OD2 no hydrogen 3.560 N/A ILE 163.A N LEU 305.A O no hydrogen 2.847 N/A ILE 164.A N ARG 152.A O no hydrogen 2.873 N/A VAL 165.A N LEU 303.A O no hydrogen 2.886 N/A HIS 166.A N ILE 150.A O no hydrogen 2.911 N/A HIS 166.A NE2 SER 143.A O no hydrogen 2.556 N/A LEU 167.A N THR 301.A O no hydrogen 3.111 N/A ASN 168.A ND2 GLU 147.A O no hydrogen 2.707 N/A VAL 171.A N ILE 300.A O no hydrogen 3.033 N/A ASN 172.A ND2 ASN 297.A OD1 no hydrogen 3.162 N/A ILE 173.A N SER 298.A O no hydrogen 2.887 N/A VAL 174.A N ASN 187.A O no hydrogen 3.213 N/A CYS 175.A N CYS 296.A O no hydrogen 2.939 N/A THR 176.A N HIS 185.A O no hydrogen 2.964 N/A THR 176.A OG1 ILE 294.A O no hydrogen 3.467 N/A THR 176.A OG1 THR 295.A OG1 no hydrogen 2.457 N/A ARG 177.A N ILE 294.A O no hydrogen 2.636 N/A ARG 177.A NH1 ILE 181.A O no hydrogen 2.575 N/A ARG 177.A NH2 ILE 290.A O no hydrogen 2.909 N/A ARG 177.A NH2 GLY 292.A O no hydrogen 2.592 N/A ALA 184.A N CYS 269.A O no hydrogen 3.031 N/A HIS 185.A N THR 176.A O no hydrogen 3.119 N/A CYS 186.A N LEU 267.A O no hydrogen 2.814 N/A ASN 187.A N VAL 174.A O no hydrogen 2.759 N/A ILE 188.A N ILE 265.A O no hydrogen 2.815 N/A ASN 189.A ND2 GLY 263.A O no hydrogen 3.091 N/A GLU 190.A N GLY 263.A O no hydrogen 3.137 N/A LYS 192.A N ASN 189.A OD1 no hydrogen 3.448 N/A LYS 192.A NZ LYS 192.A O no hydrogen 3.383 N/A TRP 193.A N ASN 189.A O no hydrogen 3.145 N/A TRP 193.A NE1 LEU 244.A O no hydrogen 2.919 N/A ASN 194.A N GLU 190.A O no hydrogen 2.883 N/A ASN 195.A N SER 191.A O no hydrogen 2.950 N/A THR 196.A N LYS 192.A O no hydrogen 3.016 N/A THR 196.A OG1 LYS 192.A O no hydrogen 3.189 N/A THR 196.A OG1 TRP 193.A O no hydrogen 2.786 N/A LEU 197.A N TRP 193.A O no hydrogen 2.909 N/A GLN 198.A N ASN 194.A O no hydrogen 3.073 N/A LYS 199.A N ASN 195.A O no hydrogen 2.999 N/A VAL 200.A N THR 196.A O no hydrogen 2.789 N/A GLY 201.A N LEU 197.A O no hydrogen 2.876 N/A GLU 202.A N GLN 198.A O no hydrogen 3.027 N/A GLU 203.A N LYS 199.A O no hydrogen 3.089 N/A LEU 204.A N VAL 200.A O no hydrogen 2.886 N/A ALA 205.A N GLY 201.A O no hydrogen 2.861 N/A LYS 206.A N GLU 202.A O no hydrogen 3.012 N/A HIS 207.A N GLU 203.A O no hydrogen 3.234 N/A HIS 207.A ND1 GLU 203.A O no hydrogen 2.976 N/A PHE 208.A N LEU 204.A O no hydrogen 2.867 N/A LYS 211.A NZ GLU 311.A OE2 no hydrogen 3.170 N/A THR 212.A N ASP 309.A O no hydrogen 3.164 N/A ILE 213.A N TYR 249.A O no hydrogen 3.156 N/A LYS 214.A N GLU 311.A O no hydrogen 2.858 N/A PHE 215.A N GLY 247.A O no hydrogen 2.891 N/A GLU 216.A N PHE 313.A O no hydrogen 3.085 N/A GLU 224.A N GLU 224.A OE1 no hydrogen 2.838 N/A ILE 225.A N ASP 222.A O no hydrogen 2.950 N/A THR 226.A N ASP 222.A O no hydrogen 3.118 N/A THR 227.A N LEU 223.A O no hydrogen 3.130 N/A THR 227.A OG1 LEU 223.A O no hydrogen 2.632 N/A HIS 228.A N CYS 239.A O no hydrogen 2.880 N/A HIS 228.A ND1 THR 136.A O no hydrogen 2.892 N/A SER 229.A N THR 136.A OG1 no hydrogen 3.198 N/A SER 229.A OG GLU 224.A O no hydrogen 2.831 N/A PHE 230.A N PHE 237.A O no hydrogen 3.084 N/A ASN 231.A ND2 GLY 234.A O no hydrogen 3.278 N/A CYS 232.A N GLU 235.A O no hydrogen 2.767 N/A ARG 233.A NE THR 295.A O no hydrogen 3.547 N/A GLY 234.A N ASN 231.A OD1 no hydrogen 2.949 N/A GLU 235.A N CYS 232.A O no hydrogen 2.899 N/A PHE 237.A N PHE 230.A O no hydrogen 2.837 N/A TYR 238.A N LYS 270.A O no hydrogen 2.793 N/A TYR 238.A OH GLU 224.A OE2 no hydrogen 2.603 N/A CYS 239.A N HIS 228.A O no hydrogen 2.932 N/A ASN 240.A N GLN 268.A O no hydrogen 2.948 N/A THR 241.A OG1 GLN 137.A OE1 no hydrogen 2.610 N/A SER 242.A N ASN 240.A OD1 no hydrogen 2.977 N/A SER 242.A OG ASN 240.A OD1 no hydrogen 2.933 N/A LEU 244.A N THR 241.A O no hydrogen 2.708 N/A PHE 245.A N THR 241.A O no hydrogen 3.004 N/A ASN 246.A ND2 SER 242.A O no hydrogen 2.976 N/A GLY 247.A N PHE 215.A O no hydrogen 3.088 N/A THR 248.A N ASN 255.A O no hydrogen 2.733 N/A TYR 249.A N ILE 213.A O no hydrogen 2.850 N/A ARG 250.A N THR 253.A O no hydrogen 2.904 N/A TYR 254.A OH HIS 256.A ND1 no hydrogen 2.641 N/A ASN 255.A N THR 248.A O no hydrogen 2.539 N/A HIS 256.A ND1 TYR 254.A OH no hydrogen 2.641 N/A HIS 256.A NE2 ASP 243.A O no hydrogen 3.019 N/A THR 257.A N ASN 246.A O no hydrogen 2.885 N/A GLY 258.A N ASN 246.A O no hydrogen 3.196 N/A ARG 259.A N ASP 243.A OD1 no hydrogen 3.182 N/A SER 260.A OG GLU 190.A OE2 no hydrogen 2.815 N/A SER 261.A N THR 264.A O no hydrogen 2.971 N/A THR 264.A N SER 261.A O no hydrogen 3.181 N/A ILE 265.A N ILE 188.A O no hydrogen 2.779 N/A THR 266.A OG1 ASN 187.A OD1 no hydrogen 2.505 N/A LEU 267.A N CYS 186.A O no hydrogen 2.733 N/A CYS 269.A N ALA 184.A O no hydrogen 2.699 N/A CYS 269.A SG LEU 267.A O no hydrogen 3.864 N/A LYS 270.A N TYR 238.A O no hydrogen 2.883 N/A ILE 271.A N ARG 182.A O no hydrogen 2.800 N/A LYS 272.A N PHE 236.A O no hydrogen 3.111 N/A ILE 275.A N ALA 284.A O no hydrogen 2.796 N/A ASN 276.A N GLU 224.A OE2 no hydrogen 3.031 N/A ASN 276.A ND2 GLU 224.A OE1 no hydrogen 2.677 N/A ASN 276.A ND2 GLU 224.A OE2 no hydrogen 3.279 N/A MET 277.A N GLY 282.A O no hydrogen 2.952 N/A GLN 279.A N GLN 279.A OE1 no hydrogen 2.748 N/A ARG 283.A N LEU 74.A O no hydrogen 2.886 N/A ALA 284.A N ILE 275.A O no hydrogen 2.787 N/A ILE 285.A N VAL 72.A O no hydrogen 2.805 N/A TYR 286.A N GLN 273.A O no hydrogen 2.893 N/A TYR 286.A OH LEU 68.A O no hydrogen 2.643 N/A ILE 290.A N GLU 235.A OE2 no hydrogen 3.317 N/A ILE 294.A N ARG 177.A O no hydrogen 2.852 N/A THR 295.A OG1 THR 176.A OG1 no hydrogen 2.457 N/A CYS 296.A N CYS 175.A O no hydrogen 2.835 N/A SER 298.A N ILE 173.A O no hydrogen 2.893 N/A ASN 299.A N ASN 141.A OD1 no hydrogen 3.116 N/A ILE 300.A N VAL 171.A O no hydrogen 2.626 N/A THR 301.A N LEU 139.A O no hydrogen 2.902 N/A THR 301.A OG1 LEU 139.A O no hydrogen 3.448 N/A LEU 303.A N VAL 165.A O no hydrogen 2.951 N/A LEU 304.A N GLN 137.A O no hydrogen 3.079 N/A LEU 305.A N ILE 163.A O no hydrogen 2.834 N/A LEU 306.A N ARG 314.A O no hydrogen 2.783 N/A ARG 307.A NH1 GLU 311.A OE1 no hydrogen 3.031 N/A ARG 307.A NH2 LEU 156.A O no hydrogen 3.038 N/A ASP 308.A N THR 312.A O no hydrogen 2.934 N/A GLU 311.A N THR 212.A O no hydrogen 2.810 N/A PHE 313.A N LYS 214.A O no hydrogen 2.744 N/A ARG 314.A N LEU 306.A O no hydrogen 2.924 N/A ARG 314.A NE ASP 308.A OD1 no hydrogen 3.313 N/A ARG 314.A NH1 ASP 308.A OD2 no hydrogen 3.353 N/A ARG 314.A NH2 PRO 217.A O no hydrogen 2.878 N/A GLY 316.A N LEU 304.A O no hydrogen 2.755 N/A ARG 321.A N ASP 319.A OD1 no hydrogen 3.065 N/A ASP 322.A N ASP 319.A O no hydrogen 2.921 N/A ASN 323.A ND2 VAL 133.A O no hydrogen 3.209 N/A ASN 323.A ND2 SER 135.A O no hydrogen 3.171 N/A TRP 324.A N MET 320.A O no hydrogen 3.126 N/A TRP 324.A NE1 HIS 57.A ND1 no hydrogen 3.065 N/A ARG 325.A N ARG 321.A O no hydrogen 2.809 N/A ARG 325.A NH1 ASP 322.A OD1 no hydrogen 3.200 N/A SER 326.A N ASP 322.A O no hydrogen 2.948 N/A SER 326.A N ASN 323.A O no hydrogen 3.261 N/A SER 326.A OG ASN 323.A O no hydrogen 2.625 N/A GLU 327.A N TRP 324.A O no hydrogen 2.896 N/A LEU 328.A N TRP 324.A O no hydrogen 2.956 N/A TYR 331.A N LEU 328.A O no hydrogen 3.122 N/A TYR 331.A OH HIS 128.A ND1 no hydrogen 2.416 N/A LYS 332.A N LEU 105.A O no hydrogen 2.974 N/A LYS 332.A NZ GLU 43.A OE1 no hydrogen 3.231 N/A LYS 332.A NZ ASN 44.A O no hydrogen 2.686 N/A VAL 334.A N ALA 103.A O no hydrogen 2.954 N/A