Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3r5f_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ PRO 31.A O no hydrogen 3.283 N/A LYS 1.A NZ GLU 35.A OE2 no hydrogen 3.189 N/A ILE 2.A N ARG 33.A O no hydrogen 2.800 N/A ARG 3.A N ASP 95.A OD2 no hydrogen 2.723 N/A ARG 3.A NH1 GLN 93.A O no hydrogen 3.402 N/A VAL 4.A N GLU 35.A O no hydrogen 2.821 N/A GLY 5.A N VAL 96.A O no hydrogen 2.754 N/A LEU 6.A N VAL 37.A O no hydrogen 2.839 N/A ILE 7.A N PHE 98.A O no hydrogen 3.260 N/A PHE 8.A N ILE 39.A O no hydrogen 3.154 N/A GLY 9.A N SER 18.A OG no hydrogen 2.828 N/A GLY 10.A N ILE 41.A O no hydrogen 2.757 N/A GLU 14.A N SER 12.A OG no hydrogen 2.916 N/A HIS 15.A N SER 12.A O no hydrogen 3.038 N/A HIS 15.A ND1 GLY 10.A O no hydrogen 2.833 N/A GLU 16.A N GLU 16.A OE1 no hydrogen 2.779 N/A SER 18.A N GLU 14.A O no hydrogen 3.134 N/A SER 18.A OG ILE 100.A O no hydrogen 2.509 N/A LEU 19.A N HIS 15.A O no hydrogen 3.111 N/A GLN 20.A N GLU 16.A O no hydrogen 2.945 N/A SER 21.A N VAL 17.A O no hydrogen 2.815 N/A SER 21.A OG VAL 17.A O no hydrogen 3.159 N/A ALA 22.A N SER 18.A O no hydrogen 2.883 N/A ARG 23.A N LEU 19.A O no hydrogen 3.191 N/A ARG 23.A NH1 ASP 60.A OD1 no hydrogen 2.712 N/A ASN 24.A N GLN 20.A O no hydrogen 3.001 N/A ILE 25.A N SER 21.A O no hydrogen 2.826 N/A LEU 26.A N ALA 22.A O no hydrogen 2.898 N/A ASP 27.A N ARG 23.A O no hydrogen 3.112 N/A ASP 27.A N ASN 24.A O no hydrogen 3.151 N/A ALA 28.A N ASN 24.A O no hydrogen 3.031 N/A ALA 28.A N ILE 25.A O no hydrogen 3.165 N/A LEU 29.A N ILE 25.A O no hydrogen 2.920 N/A GLN 32.A N ASP 30.A OD1 no hydrogen 2.807 N/A ARG 33.A N ASP 30.A O no hydrogen 2.986 N/A ARG 33.A NH1 GLU 326.A OE2 no hydrogen 3.308 N/A ARG 33.A NH2 GLU 326.A OE2 no hydrogen 2.731 N/A PHE 34.A N ASP 30.A O no hydrogen 2.953 N/A GLU 35.A N ILE 2.A O no hydrogen 2.946 N/A VAL 37.A N VAL 4.A O no hydrogen 2.772 N/A ILE 39.A N LEU 6.A O no hydrogen 2.944 N/A GLY 40.A N HIS 48.A O no hydrogen 2.846 N/A ILE 41.A N PHE 8.A O no hydrogen 2.828 N/A ASP 42.A N GLN 46.A O no hydrogen 2.894 N/A LYS 43.A NZ GLU 16.A OE2 no hydrogen 2.810 N/A GLN 44.A N ASP 42.A OD2 no hydrogen 2.823 N/A GLY 45.A N ASP 42.A O no hydrogen 3.330 N/A GLN 46.A N ASP 42.A OD2 no hydrogen 2.991 N/A HIS 48.A N GLY 40.A O no hydrogen 2.806 N/A VAL 49.A N ARG 72.A O no hydrogen 2.748 N/A ASN 50.A N LEU 38.A O no hydrogen 3.080 N/A ASN 50.A ND2 HIS 68.A O no hydrogen 2.693 N/A SER 54.A N ASP 51.A O no hydrogen 2.918 N/A LEU 57.A N ALA 66.A O no hydrogen 2.686 N/A ASP 61.A N HIS 58.A O no hydrogen 3.018 N/A ALA 63.A N ASP 61.A OD1 no hydrogen 3.067 N/A ARG 64.A N ASP 61.A O no hydrogen 2.884 N/A ILE 65.A N ASP 61.A O no hydrogen 2.807 N/A ALA 66.A N LEU 57.A O no hydrogen 2.869 N/A HIS 68.A N PHE 55.A O no hydrogen 2.911 N/A SER 70.A OG VAL 49.A O no hydrogen 2.644 N/A ARG 72.A N SER 70.A OG no hydrogen 3.058 N/A ARG 72.A NH1 ASP 51.A OD1 no hydrogen 2.624 N/A ALA 75.A N ARG 86.A O no hydrogen 2.620 N/A LEU 77.A N GLN 84.A O no hydrogen 2.771 N/A GLY 79.A N MET 117.A O no hydrogen 2.808 N/A ALA 80.A N LEU 77.A O no hydrogen 2.916 N/A GLN 83.A N GLN 93.A OE1 no hydrogen 2.721 N/A GLN 83.A NE2 LEU 91.A O no hydrogen 3.248 N/A GLN 84.A N GLN 84.A OE1 no hydrogen 2.497 N/A GLN 84.A NE2 ALA 118.A O no hydrogen 3.332 N/A ARG 86.A N ALA 75.A O no hydrogen 2.615 N/A ARG 86.A NE GLN 83.A O no hydrogen 2.653 N/A ARG 86.A NH2 GLN 82.A O no hydrogen 3.407 N/A ARG 86.A NH2 GLN 83.A O no hydrogen 3.244 N/A ILE 88.A N GLY 73.A O no hydrogen 3.356 N/A GLN 93.A NE2 GLN 84.A OE1 no hydrogen 3.404 N/A GLN 93.A NE2 ILE 94.A O no hydrogen 2.935 N/A ASP 95.A N ARG 3.A O no hydrogen 2.947 N/A VAL 96.A N ARG 3.A O no hydrogen 3.166 N/A VAL 97.A N PRO 121.A O no hydrogen 2.882 N/A PHE 98.A N GLY 5.A O no hydrogen 2.741 N/A ILE 100.A N ILE 7.A O no hydrogen 2.835 N/A GLY 103.A N GLU 107.A OE2 no hydrogen 3.159 N/A GLU 107.A N THR 104.A O no hydrogen 3.263 N/A ASP 108.A N THR 104.A O no hydrogen 2.979 N/A SER 110.A N ASP 108.A OD1 no hydrogen 3.022 N/A SER 110.A OG ASP 108.A OD1 no hydrogen 2.617 N/A LEU 111.A N LEU 105.A O no hydrogen 3.037 N/A GLN 112.A NE2 GLY 106.A O no hydrogen 3.028 N/A GLY 113.A N GLY 109.A O no hydrogen 2.840 N/A LEU 114.A N SER 110.A O no hydrogen 3.082 N/A LEU 115.A N LEU 111.A O no hydrogen 2.941 N/A ARG 116.A N GLN 112.A O no hydrogen 2.799 N/A ARG 116.A NH1 ASP 335.A OD2 no hydrogen 3.028 N/A MET 117.A N GLY 113.A O no hydrogen 2.867 N/A ALA 118.A N LEU 114.A O no hydrogen 3.058 N/A ALA 118.A N LEU 115.A O no hydrogen 3.199 N/A ASN 119.A N ARG 116.A O no hydrogen 3.081 N/A ASN 119.A ND2 ALA 80.A O no hydrogen 3.057 N/A LEU 120.A N LEU 115.A O no hydrogen 2.889 N/A VAL 123.A N VAL 97.A O no hydrogen 2.820 N/A SER 125.A OG ALA 274.A O no hydrogen 3.221 N/A SER 130.A N GLY 126.A O no hydrogen 3.173 N/A SER 130.A OG SER 125.A O no hydrogen 3.270 N/A SER 130.A OG GLY 126.A O no hydrogen 2.895 N/A ALA 131.A N VAL 127.A O no hydrogen 2.920 N/A VAL 132.A N LEU 128.A O no hydrogen 2.789 N/A ALA 133.A N GLY 129.A O no hydrogen 2.980 N/A MET 134.A N SER 130.A O no hydrogen 2.983 N/A ASP 135.A N ALA 131.A O no hydrogen 3.285 N/A LYS 136.A N ALA 182.A O no hydrogen 2.920 N/A MET 138.A N ASP 135.A OD1 no hydrogen 2.954 N/A ALA 139.A N ASP 135.A O no hydrogen 2.900 N/A LYS 140.A N LYS 136.A O no hydrogen 3.084 N/A LYS 140.A NZ ALA 151.A O no hydrogen 2.493 N/A ARG 141.A N ASP 137.A O no hydrogen 3.171 N/A ARG 141.A NE ASP 137.A OD1 no hydrogen 3.142 N/A ARG 141.A NH2 ASP 137.A OD2 no hydrogen 2.924 N/A VAL 142.A N MET 138.A O no hydrogen 2.848 N/A LEU 143.A N ALA 139.A O no hydrogen 2.764 N/A ARG 144.A N LYS 140.A O no hydrogen 2.703 N/A ASP 145.A N ARG 141.A O no hydrogen 3.057 N/A ALA 146.A N VAL 142.A O no hydrogen 3.094 N/A ARG 147.A N ARG 144.A O no hydrogen 3.108 N/A ARG 147.A NE ASP 145.A O no hydrogen 3.116 N/A ARG 147.A NH2 ASP 145.A O no hydrogen 3.092 N/A LEU 148.A N LEU 143.A O no hydrogen 3.005 N/A VAL 154.A N VAL 215.A O no hydrogen 2.966 N/A CYS 155.A SG VAL 213.A O no hydrogen 3.721 N/A PHE 156.A N VAL 213.A O no hydrogen 2.924 N/A ARG 158.A NH1 LEU 207.A O no hydrogen 2.754 N/A ARG 158.A NH2 LEU 207.A O no hydrogen 3.123 N/A THR 160.A N ASP 157.A O no hydrogen 3.215 N/A ALA 161.A N ASP 157.A O no hydrogen 2.815 N/A HIS 163.A N THR 160.A O no hydrogen 3.106 N/A ALA 164.A N ALA 161.A O no hydrogen 3.127 N/A THR 168.A N ASP 165.A OD2 no hydrogen 2.924 N/A THR 168.A OG1 ASP 165.A OD2 no hydrogen 2.568 N/A LEU 169.A N ASP 165.A O no hydrogen 3.047 N/A ILE 170.A N VAL 166.A O no hydrogen 2.877 N/A ALA 171.A N ASP 167.A O no hydrogen 2.804 N/A GLN 172.A N THR 168.A O no hydrogen 2.841 N/A LEU 173.A N LEU 169.A O no hydrogen 2.572 N/A GLY 174.A N ILE 170.A O no hydrogen 2.845 N/A LEU 177.A N VAL 193.A O no hydrogen 2.893 N/A PHE 178.A N GLU 216.A O no hydrogen 2.833 N/A VAL 179.A N SER 191.A O no hydrogen 2.968 N/A LYS 180.A N LEU 214.A O no hydrogen 2.884 N/A LYS 180.A NZ GLU 216.A OE1 no hydrogen 3.013 N/A LYS 180.A NZ ASN 292.A OD1 no hydrogen 3.407 N/A ALA 182.A N LYS 212.A O no hydrogen 2.778 N/A GLN 184.A N MET 134.A O no hydrogen 2.856 N/A SER 191.A N VAL 179.A O no hydrogen 3.075 N/A VAL 193.A N LEU 177.A O no hydrogen 2.770 N/A THR 195.A OG1 ASP 197.A OD2 no hydrogen 2.904 N/A ALA 198.A N THR 195.A O no hydrogen 3.204 N/A PHE 199.A N ALA 196.A O no hydrogen 3.211 N/A ALA 202.A N ALA 198.A O no hydrogen 3.429 N/A LEU 203.A N PHE 199.A O no hydrogen 3.017 N/A ALA 204.A N ALA 200.A O no hydrogen 2.964 N/A LEU 205.A N ALA 201.A O no hydrogen 2.946 N/A ALA 206.A N ALA 202.A O no hydrogen 2.978 N/A LEU 207.A N LEU 203.A O no hydrogen 3.149 N/A ALA 208.A N LEU 205.A O no hydrogen 3.098 N/A TYR 209.A N ALA 206.A O no hydrogen 2.953 N/A ASP 210.A N ALA 206.A O no hydrogen 3.184 N/A LYS 212.A NZ ASP 135.A OD1 no hydrogen 3.369 N/A LYS 212.A NZ ASP 135.A OD2 no hydrogen 3.025 N/A LYS 212.A NZ ASP 137.A OD2 no hydrogen 2.751 N/A VAL 213.A N PHE 156.A O no hydrogen 2.723 N/A LEU 214.A N LYS 180.A O no hydrogen 2.596 N/A VAL 215.A N VAL 154.A O no hydrogen 2.785 N/A GLU 216.A N PHE 178.A O no hydrogen 2.678 N/A ALA 217.A N PRO 152.A O no hydrogen 2.917 N/A ARG 222.A N LEU 283.A O no hydrogen 2.905 N/A ARG 222.A NH1 GLU 241.A OE2 no hydrogen 2.934 N/A ARG 222.A NH2 ASP 251.A O no hydrogen 3.383 N/A ILE 224.A N VAL 281.A O no hydrogen 2.791 N/A GLU 225.A N GLY 240.A O no hydrogen 2.768 N/A CYS 226.A N VAL 279.A O no hydrogen 3.053 N/A CYS 226.A SG ALA 227.A O no hydrogen 3.954 N/A CYS 226.A SG SER 237.A O no hydrogen 3.645 N/A ALA 227.A N SER 237.A OG no hydrogen 2.930 N/A VAL 228.A N ALA 277.A O no hydrogen 2.753 N/A LEU 229.A N HIS 235.A O no hydrogen 2.943 N/A GLY 230.A N GLY 275.A O no hydrogen 2.926 N/A ASN 231.A ND2 LEU 327.A O no hydrogen 2.974 N/A HIS 235.A N LEU 229.A O no hydrogen 2.715 N/A SER 237.A N ALA 227.A O no hydrogen 2.812 N/A SER 237.A OG ALA 227.A O no hydrogen 3.377 N/A SER 237.A OG VAL 238.A O no hydrogen 2.654 N/A VAL 238.A N SER 313.A OG no hydrogen 2.805 N/A GLY 240.A N GLU 225.A O no hydrogen 2.843 N/A GLU 241.A N VAL 247.A O no hydrogen 2.990 N/A VAL 242.A N GLU 223.A O no hydrogen 2.889 N/A VAL 243.A N GLU 245.A O no hydrogen 2.639 N/A VAL 247.A N GLU 241.A O no hydrogen 2.704 N/A ALA 250.A N CYS 239.A O no hydrogen 2.740 N/A ILE 252.A N ALA 250.A O no hydrogen 3.103 N/A GLN 257.A N ASP 253.A O no hydrogen 2.892 N/A GLN 258.A N ALA 254.A O no hydrogen 2.866 N/A ARG 259.A N GLN 255.A O no hydrogen 3.028 N/A ARG 259.A NH1 GLY 287.A O no hydrogen 3.364 N/A ARG 259.A NH2 GLY 287.A O no hydrogen 2.835 N/A ILE 260.A N THR 256.A O no hydrogen 3.128 N/A GLN 261.A N GLN 257.A O no hydrogen 2.845 N/A GLN 261.A NE2 SER 237.A O no hydrogen 2.860 N/A GLN 262.A N GLN 258.A O no hydrogen 2.996 N/A ILE 263.A N ARG 259.A O no hydrogen 3.015 N/A ALA 264.A N ILE 260.A O no hydrogen 2.947 N/A VAL 265.A N GLN 261.A O no hydrogen 3.120 N/A GLN 266.A N GLN 262.A O no hydrogen 3.032 N/A ALA 267.A N ILE 263.A O no hydrogen 2.755 N/A TYR 268.A N ALA 264.A O no hydrogen 2.911 N/A TYR 268.A OH GLY 230.A O no hydrogen 2.748 N/A GLN 269.A N VAL 265.A O no hydrogen 2.892 N/A ALA 270.A N GLN 266.A O no hydrogen 2.864 N/A LEU 271.A N ALA 267.A O no hydrogen 3.227 N/A GLY 272.A N GLN 269.A O no hydrogen 3.116 N/A CYS 273.A N TYR 268.A O no hydrogen 3.139 N/A CYS 273.A SG TYR 268.A O no hydrogen 3.797 N/A ALA 274.A N SER 125.A OG no hydrogen 3.018 N/A GLY 275.A N ASN 231.A OD1 no hydrogen 3.079 N/A MET 276.A N ALA 274.A O no hydrogen 2.796 N/A ALA 277.A N VAL 228.A O no hydrogen 3.180 N/A ARG 278.A N ASN 295.A O no hydrogen 2.950 N/A ARG 278.A NE ASP 280.A OD1 no hydrogen 2.775 N/A ARG 278.A NE ASP 280.A OD2 no hydrogen 3.387 N/A ARG 278.A NH2 ASP 280.A OD2 no hydrogen 2.983 N/A VAL 279.A N CYS 226.A O no hydrogen 2.734 N/A ASP 280.A N GLU 293.A O no hydrogen 2.825 N/A VAL 281.A N ILE 224.A O no hydrogen 2.835 N/A PHE 282.A N VAL 290.A O no hydrogen 2.731 N/A LEU 283.A N ARG 222.A O no hydrogen 2.718 N/A CYS 284.A N ARG 288.A O no hydrogen 2.937 N/A CYS 284.A SG ALA 220.A O no hydrogen 3.708 N/A ARG 288.A N ASP 286.A OD1 no hydrogen 3.375 N/A VAL 290.A N PHE 282.A O no hydrogen 3.020 N/A ILE 291.A N ALA 149.A O no hydrogen 2.992 N/A ASN 292.A N ASP 280.A O no hydrogen 2.902 N/A GLU 293.A N ASP 280.A O no hydrogen 3.126 N/A ASN 295.A N ARG 278.A O no hydrogen 2.761 N/A ASN 295.A ND2 GLU 293.A OE1 no hydrogen 2.524 N/A LEU 297.A N ASN 295.A OD1 no hydrogen 3.210 N/A PHE 300.A N SER 21.A OG no hydrogen 3.096 N/A THR 301.A N SER 304.A OG no hydrogen 3.013 N/A THR 301.A OG1 SER 304.A OG no hydrogen 2.837 N/A ARG 302.A N ASN 24.A OD1 no hydrogen 3.020 N/A SER 304.A N THR 301.A O no hydrogen 3.242 N/A SER 304.A N THR 301.A OG1 no hydrogen 2.974 N/A SER 304.A OG THR 301.A O no hydrogen 3.516 N/A SER 304.A OG THR 301.A OG1 no hydrogen 2.837 N/A TYR 306.A OH VAL 228.A O no hydrogen 2.637 N/A LYS 308.A N SER 304.A O no hydrogen 3.187 N/A LEU 309.A N VAL 305.A O no hydrogen 2.787 N/A TRP 310.A N TYR 306.A O no hydrogen 3.095 N/A GLN 311.A N PRO 307.A O no hydrogen 2.871 N/A ALA 312.A N LYS 308.A O no hydrogen 2.970 N/A SER 313.A N TRP 310.A O no hydrogen 2.801 N/A SER 313.A OG LEU 309.A O no hydrogen 2.726 N/A GLY 314.A N GLN 311.A O no hydrogen 2.851 N/A LEU 315.A N TRP 310.A O no hydrogen 2.873 N/A TYR 317.A OH PHE 300.A O no hydrogen 2.400 N/A ARG 318.A NH1 ALA 28.A O no hydrogen 3.203 N/A GLY 319.A N ASP 316.A OD2 no hydrogen 2.770 N/A LEU 320.A N ASP 316.A O no hydrogen 2.684 N/A ILE 321.A N TYR 317.A O no hydrogen 3.105 N/A THR 322.A N ARG 318.A O no hydrogen 3.077 N/A THR 322.A OG1 ARG 318.A O no hydrogen 3.515 N/A ARG 323.A N GLY 319.A O no hydrogen 3.111 N/A ARG 323.A NH1 GLU 326.A OE1 no hydrogen 3.216 N/A ARG 323.A NH1 GLU 330.A OE2 no hydrogen 3.066 N/A LEU 324.A N LEU 320.A O no hydrogen 2.849 N/A ILE 325.A N ILE 321.A O no hydrogen 3.002 N/A GLU 326.A N THR 322.A O no hydrogen 3.039 N/A LEU 327.A N ARG 323.A O no hydrogen 2.994 N/A ALA 328.A N LEU 324.A O no hydrogen 3.078 N/A LEU 329.A N ILE 325.A O no hydrogen 2.972 N/A GLU 330.A N GLU 326.A O no hydrogen 2.856 N/A ARG 331.A N LEU 327.A O no hydrogen 2.983 N/A ARG 331.A NH1 PHE 122.A O no hydrogen 3.187 N/A ARG 331.A NH2 PHE 122.A O no hydrogen 3.488 N/A HIS 332.A N ALA 328.A O no hydrogen 2.988 N/A THR 333.A N LEU 329.A O no hydrogen 2.922 N/A THR 333.A OG1 LEU 329.A O no hydrogen 2.996 N/A ASP 334.A N GLU 330.A O no hydrogen 3.010 N/A ASP 335.A N ARG 331.A O no hydrogen 2.938 N/A GLN 336.A N HIS 332.A O no hydrogen 3.052 N/A GLN 336.A N THR 333.A O no hydrogen 3.181 N/A ARG 339.A N ASP 335.A O no hydrogen 2.826 N/A ARG 339.A NH1 ASN 119.A OD1 no hydrogen 3.046 N/A ARG 339.A NH2 ASN 119.A OD1 no hydrogen 3.094 N/A SER 340.A N GLN 336.A O no hydrogen 2.967 N/A ALA 341.A N LEU 337.A O no hydrogen 3.114 N/A