Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1f44_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 3.A N GLU 3.A OE1 no hydrogen 3.249 N/A VAL 4.A N SER 1.A OG no hydrogen 3.123 N/A ARG 5.A N SER 1.A O no hydrogen 2.262 N/A ASN 7.A N ASP 2.A O no hydrogen 2.937 N/A LEU 8.A N VAL 4.A O no hydrogen 2.466 N/A ARG 13.A NH1 MET 11.A O no hydrogen 3.408 N/A ALA 17.A N ASP 14.A O no hydrogen 2.731 N/A PHE 18.A N ARG 15.A O no hydrogen 2.948 N/A THR 22.A N SER 19.A OG no hydrogen 3.367 N/A TRP 23.A N SER 19.A O no hydrogen 2.880 N/A TRP 23.A NE1.A ARG 15.A O no hydrogen 3.274 N/A LYS 24.A N GLU 20.A O no hydrogen 2.973 N/A MET 25.A N HIS 21.A O no hydrogen 3.182 N/A LEU 26.A N THR 22.A O no hydrogen 3.080 N/A LEU 27.A N TRP 23.A O no hydrogen 3.112 N/A SER 28.A N LYS 24.A O no hydrogen 3.027 N/A VAL 29.A N MET 25.A O no hydrogen 2.876 N/A CYS 30.A N LEU 26.A O no hydrogen 2.916 N/A CYS 30.A SG LEU 26.A O no hydrogen 3.361 N/A ARG 31.A N LEU 27.A O no hydrogen 2.936 N/A SER 32.A N SER 28.A O no hydrogen 3.000 N/A SER 32.A OG TYR 55.A OH no hydrogen 2.285 N/A TRP 33.A N VAL 29.A O no hydrogen 2.752 N/A TRP 33.A NE1 TRP 44.A O no hydrogen 2.698 N/A ALA 34.A N CYS 30.A O no hydrogen 2.875 N/A ALA 35.A N ARG 31.A O no hydrogen 2.900 N/A TRP 36.A N SER 32.A O no hydrogen 3.036 N/A CYS 37.A N TRP 33.A O no hydrogen 2.916 N/A CYS 37.A SG TRP 33.A O no hydrogen 3.478 N/A LYS 38.A N ALA 34.A O no hydrogen 2.818 N/A LEU 39.A N ALA 35.A O no hydrogen 2.953 N/A ASN 40.A N TRP 36.A O no hydrogen 3.049 N/A ASN 40.A ND2 TRP 36.A O no hydrogen 2.978 N/A ASN 41.A N LYS 38.A O no hydrogen 3.204 N/A ARG 42.A N CYS 37.A O no hydrogen 2.772 N/A ARG 42.A NE ASN 40.A O no hydrogen 2.887 N/A ARG 42.A NH1 ASP 51.A OD1 no hydrogen 3.130 N/A ASP 51.A N GLU 48.A OE1 no hydrogen 2.706 N/A VAL 52.A N GLU 48.A O no hydrogen 2.887 N/A ARG 53.A N PRO 49.A O no hydrogen 2.740 N/A ARG 53.A NE ASP 54.A OD1 no hydrogen 3.110 N/A ARG 53.A NH2 ASP 54.A OD1 no hydrogen 2.905 N/A ARG 53.A NH2 ASP 54.A OD2 no hydrogen 3.552 N/A ASP 54.A N GLU 50.A O no hydrogen 3.073 N/A TYR 55.A N ASP 51.A O no hydrogen 2.905 N/A TYR 55.A OH SER 32.A OG no hydrogen 2.285 N/A TYR 55.A OH HIS 72.A ND1 no hydrogen 2.663 N/A LEU 56.A N VAL 52.A O no hydrogen 2.892 N/A LEU 57.A N ARG 53.A O no hydrogen 3.156 N/A TYR 58.A N ASP 54.A O no hydrogen 2.946 N/A LEU 59.A N TYR 55.A O no hydrogen 3.054 N/A GLN 60.A N LEU 56.A O no hydrogen 2.931 N/A ALA 61.A N LEU 57.A O no hydrogen 2.653 N/A ARG 62.A N TYR 58.A O no hydrogen 3.007 N/A ARG 62.A N LEU 59.A O no hydrogen 3.060 N/A GLY 63.A N GLN 60.A O no hydrogen 2.978 N/A LEU 64.A N LEU 59.A O no hydrogen 3.166 N/A ILE 69.A N ALA 65.A O no hydrogen 2.981 N/A GLN 70.A N VAL 66.A O no hydrogen 2.878 N/A GLN 71.A N LYS 67.A O no hydrogen 2.988 N/A HIS 72.A N THR 68.A O no hydrogen 3.122 N/A HIS 72.A ND1 TYR 55.A OH no hydrogen 2.663 N/A LEU 73.A N ILE 69.A O no hydrogen 2.943 N/A GLY 74.A N GLN 70.A O no hydrogen 2.660 N/A GLN 75.A N GLN 71.A O no hydrogen 2.910 N/A GLN 75.A NE2 GLN 71.A OE1 no hydrogen 2.949 N/A LEU 76.A N HIS 72.A O no hydrogen 3.172 N/A ASN 77.A N LEU 73.A O no hydrogen 2.901 N/A ASN 77.A ND2 SER 89.A OG no hydrogen 2.457 N/A MET 78.A N GLY 74.A O no hydrogen 2.961 N/A LEU 79.A N GLN 75.A O no hydrogen 2.805 N/A HIS 80.A N LEU 76.A O no hydrogen 3.183 N/A ARG 81.A N ASN 77.A O no hydrogen 2.554 N/A ARG 82.A N MET 78.A O no hydrogen 3.161 N/A SER 83.A N HIS 80.A O no hydrogen 3.151 N/A SER 83.A OG LEU 79.A O no hydrogen 3.357 N/A GLY 84.A N ARG 81.A O no hydrogen 3.101 N/A ARG 87.A NH1 ASP 90.A OD2 no hydrogen 2.878 N/A SER 89.A N ASN 77.A OD1 no hydrogen 2.805 N/A ASP 90.A N ARG 87.A O no hydrogen 2.696 N/A SER 91.A N PRO 88.A O no hydrogen 3.095 N/A SER 95.A N SER 91.A O no hydrogen 3.287 N/A SER 95.A OG SER 89.A O no hydrogen 3.092 N/A LEU 96.A N ASN 92.A O no hydrogen 3.024 N/A VAL 97.A N ALA 93.A O no hydrogen 3.209 N/A MET 98.A N VAL 94.A O no hydrogen 3.040 N/A ARG 99.A N SER 95.A O no hydrogen 3.245 N/A ARG 100.A N LEU 96.A O no hydrogen 2.783 N/A ILE 101.A N VAL 97.A O no hydrogen 2.753 N/A ARG 102.A N MET 98.A O no hydrogen 2.977 N/A ARG 102.A NE GLN 70.A OE1 no hydrogen 2.995 N/A ARG 102.A NH2 GLN 70.A OE1 no hydrogen 3.419 N/A LYS 103.A N ARG 99.A O no hydrogen 3.057 N/A LYS 103.A NZ ASP 107.A OD2 no hydrogen 2.475 N/A GLU 104.A N ARG 100.A O no hydrogen 2.978 N/A ASN 105.A N ILE 101.A O no hydrogen 3.114 N/A VAL 106.A N ARG 102.A O no hydrogen 3.066 N/A ASP 107.A N LYS 103.A O no hydrogen 2.784 N/A ALA 108.A N ASN 105.A O no hydrogen 2.980 N/A GLY 109.A N VAL 106.A O no hydrogen 2.374 N/A GLU 110.A N ASN 105.A O no hydrogen 2.974 N/A ARG 111.A NH1 GLU 110.A O no hydrogen 3.148 N/A LYS 113.A NZ GLU 110.A OE1 no hydrogen 3.352 N/A LYS 113.A NZ ARG 111.A O no hydrogen 2.644 N/A GLN 114.A NE2 PHE 297.A O no hydrogen 2.827 N/A PHE 118.A N SER 263.A O no hydrogen 2.806 N/A GLU 119.A N ASP 122.A OD2 no hydrogen 2.811 N/A ARG 120.A N ASP 271.A OD2 no hydrogen 2.795 N/A ARG 120.A NE ASP 124.A OD1 no hydrogen 3.191 N/A ARG 120.A NE ASP 124.A OD2 no hydrogen 3.046 N/A PHE 123.A N GLU 119.A O no hydrogen 2.810 N/A ASP 124.A N ARG 120.A O no hydrogen 2.878 N/A GLN 125.A N THR 121.A O no hydrogen 3.052 N/A VAL 126.A N ASP 122.A O no hydrogen 2.918 N/A ARG 127.A N PHE 123.A O no hydrogen 2.759 N/A SER 128.A N ASP 124.A O no hydrogen 2.863 N/A SER 128.A OG ASP 124.A O no hydrogen 3.526 N/A LEU 129.A N GLN 125.A O no hydrogen 3.070 N/A MET 130.A N VAL 126.A O no hydrogen 2.821 N/A GLU 131.A N ARG 127.A O no hydrogen 2.887 N/A SER 133.A N MET 130.A O no hydrogen 3.028 N/A SER 133.A OG ASP 138.A OD2 no hydrogen 2.588 N/A ARG 135.A N SER 133.A OG no hydrogen 3.181 N/A ARG 135.A NH1 GLN 137.A OE1 no hydrogen 3.154 N/A ARG 135.A NH1 ASP 138.A OD1 no hydrogen 3.329 N/A ARG 135.A NH2 GLN 137.A OE1 no hydrogen 2.805 N/A ILE 139.A N ARG 135.A O no hydrogen 2.953 N/A ARG 140.A N CYS 136.A O no hydrogen 2.905 N/A ARG 140.A NE ASN 141.A OD1 no hydrogen 2.921 N/A ARG 140.A NH1 CYS 213.A O no hydrogen 3.026 N/A ARG 140.A NH2 ASN 141.A OD1 no hydrogen 2.854 N/A ASN 141.A N GLN 137.A O no hydrogen 2.842 N/A LEU 142.A N ASP 138.A O no hydrogen 3.047 N/A ALA 143.A N ILE 139.A O no hydrogen 3.219 N/A PHE 144.A N ARG 140.A O no hydrogen 2.929 N/A LEU 145.A N ASN 141.A O no hydrogen 2.925 N/A GLY 146.A N LEU 142.A O no hydrogen 3.005 N/A ILE 147.A N ALA 143.A O no hydrogen 3.013 N/A ALA 148.A N PHE 144.A O no hydrogen 2.977 N/A TYR 149.A N LEU 145.A O no hydrogen 3.015 N/A TYR 149.A OH ASP 271.A OD2 no hydrogen 2.509 N/A ASN 150.A N GLY 146.A O no hydrogen 2.904 N/A ASN 150.A ND2 ALA 185.A O no hydrogen 3.133 N/A THR 151.A N ILE 147.A O no hydrogen 2.842 N/A THR 151.A OG1 ILE 147.A O no hydrogen 2.569 N/A LEU 152.A N ALA 148.A O no hydrogen 2.916 N/A LEU 153.A N THR 151.A OG1 no hydrogen 3.140 N/A ARG 154.A N GLU 157.A OE1 no hydrogen 3.048 N/A GLU 157.A N ARG 154.A O no hydrogen 3.005 N/A ILE 158.A N ARG 154.A O no hydrogen 3.018 N/A ALA 159.A N ILE 155.A O no hydrogen 2.866 N/A ARG 160.A N GLU 157.A O no hydrogen 3.243 N/A ILE 161.A N ILE 158.A O no hydrogen 3.273 N/A ARG 162.A N ASP 165.A OD2 no hydrogen 2.744 N/A ARG 162.A NH1 ASN 208.A O no hydrogen 2.701 N/A ARG 162.A NH1 ALA 225.A O no hydrogen 2.693 N/A VAL 163.A N ASN 209.A O no hydrogen 2.793 N/A LYS 164.A N PRO 207.A O no hydrogen 2.860 N/A LYS 164.A NZ ASN 208.A OD1 no hydrogen 3.027 N/A ASP 165.A N ARG 162.A O no hydrogen 2.846 N/A ILE 166.A N VAL 163.A O no hydrogen 2.968 N/A SER 167.A N LEU 175.A O no hydrogen 2.912 N/A ARG 168.A NH1 GLY 172.A O no hydrogen 2.871 N/A ARG 168.A NH1 GLU 195.A OE2 no hydrogen 2.272 N/A ARG 168.A NH2 GLU 195.A OE2 no hydrogen 2.811 N/A THR 169.A N ARG 173.A O no hydrogen 2.783 N/A ASP 170.A N THR 169.A OG1 no hydrogen 2.505 N/A GLY 172.A N THR 169.A O no hydrogen 2.854 N/A ARG 173.A NH1 ASP 170.A O no hydrogen 2.562 N/A MET 174.A N THR 191.A OG1 no hydrogen 2.910 N/A LEU 175.A N SER 167.A O no hydrogen 2.839 N/A ILE 176.A N LYS 184.A O no hydrogen 2.711 N/A HIS 177.A N ASP 165.A O no hydrogen 2.879 N/A HIS 177.A ND1 GLU 183.A OE2 no hydrogen 2.871 N/A ILE 178.A N VAL 182.A O no hydrogen 2.772 N/A VAL 182.A N ILE 178.A O no hydrogen 2.789 N/A LYS 184.A N ILE 176.A O no hydrogen 2.627 N/A LYS 184.A NZ THR 151.A O no hydrogen 3.372 N/A LYS 184.A NZ ALA 285.A O no hydrogen 2.871 N/A LEU 186.A N MET 174.A O no hydrogen 2.917 N/A SER 187.A N ASN 150.A OD1 no hydrogen 2.942 N/A VAL 190.A N SER 187.A OG no hydrogen 3.053 N/A THR 191.A N SER 187.A O no hydrogen 2.874 N/A THR 191.A OG1 SER 187.A O no hydrogen 2.696 N/A LYS 192.A N LEU 188.A O no hydrogen 2.874 N/A LEU 193.A N GLY 189.A O no hydrogen 3.107 N/A VAL 194.A N VAL 190.A O no hydrogen 2.953 N/A GLU 195.A N THR 191.A O no hydrogen 2.822 N/A ARG 196.A N LYS 192.A O no hydrogen 3.068 N/A ARG 196.A NH1 SER 133.A O no hydrogen 2.997 N/A ARG 196.A NH2 SER 133.A O no hydrogen 3.424 N/A ARG 196.A NH2 ASP 134.A OD1 no hydrogen 2.999 N/A TRP 197.A N LEU 193.A O no hydrogen 3.199 N/A TRP 197.A NE1 LEU 211.A O no hydrogen 2.789 N/A ILE 198.A N VAL 194.A O no hydrogen 2.872 N/A SER 199.A N GLU 195.A O no hydrogen 2.778 N/A SER 199.A OG GLU 195.A O no hydrogen 3.502 N/A SER 199.A OG ARG 196.A O no hydrogen 2.914 N/A VAL 200.A N ARG 196.A O no hydrogen 2.999 N/A SER 201.A N TRP 197.A O no hydrogen 2.983 N/A SER 201.A OG TRP 197.A O no hydrogen 2.837 N/A SER 201.A OG ILE 198.A O no hydrogen 3.533 N/A GLY 202.A N ILE 198.A O no hydrogen 3.202 N/A VAL 203.A N SER 201.A OG no hydrogen 3.288 N/A ASP 205.A N GLY 202.A O no hydrogen 2.929 N/A ASP 206.A N VAL 203.A O no hydrogen 3.449 N/A ASN 208.A N ASP 206.A OD1 no hydrogen 3.110 N/A ASN 209.A N ASP 206.A O no hydrogen 2.815 N/A ASN 209.A ND2 VAL 203.A O no hydrogen 2.696 N/A TYR 210.A N SER 224.A O no hydrogen 2.871 N/A LEU 211.A N ILE 161.A O no hydrogen 2.750 N/A CYS 213.A SG ARG 214.A O no hydrogen 3.607 N/A ARG 216.A N VAL 220.A O no hydrogen 3.121 N/A GLY 219.A N ARG 216.A O no hydrogen 2.753 N/A ALA 222.A N ARG 214.A O no hydrogen 3.074 N/A THR 226.A N SER 224.A OG no hydrogen 3.054 N/A THR 226.A OG1 SER 224.A OG no hydrogen 3.403 N/A SER 227.A N SER 224.A OG no hydrogen 2.833 N/A GLN 228.A NE2 TYR 210.A OH no hydrogen 3.066 N/A ARG 232.A NH1 ARG 232.A O no hydrogen 3.253 N/A ARG 232.A NH1 GLU 239.A OE2 no hydrogen 2.631 N/A ALA 233.A N SER 230.A OG no hydrogen 3.121 N/A LEU 234.A N SER 230.A O no hydrogen 3.354 N/A GLU 235.A N THR 231.A O no hydrogen 2.891 N/A GLY 236.A N ARG 232.A O no hydrogen 2.915 N/A ILE 237.A N ALA 233.A O no hydrogen 2.888 N/A PHE 238.A N LEU 234.A O no hydrogen 3.363 N/A GLU 239.A N GLU 235.A O no hydrogen 2.995 N/A ALA 240.A N GLY 236.A O no hydrogen 2.756 N/A THR 241.A N ILE 237.A O no hydrogen 2.940 N/A THR 241.A OG1 ILE 237.A O no hydrogen 2.613 N/A HIS 242.A N PHE 238.A O no hydrogen 2.969 N/A ARG 243.A N GLU 239.A O no hydrogen 2.900 N/A LEU 244.A N ALA 240.A O no hydrogen 2.849 N/A ILE 245.A N HIS 242.A O no hydrogen 2.940 N/A TYR 246.A N HIS 242.A O no hydrogen 2.801 N/A GLY 247.A N ARG 243.A O no hydrogen 2.679 N/A SER 252.A N ASP 250.A OD1 no hydrogen 2.443 N/A SER 252.A OG ASP 250.A OD1 no hydrogen 2.901 N/A SER 252.A OG ASP 250.A OD2 no hydrogen 3.381 N/A SER 252.A OG GLN 254.A OE1 no hydrogen 2.785 N/A GLN 254.A N SER 252.A OG no hydrogen 3.358 N/A TRP 259.A NE1 ALA 117.A O no hydrogen 2.892 N/A SER 260.A N SER 263.A OG no hydrogen 2.814 N/A SER 263.A N SER 260.A O no hydrogen 2.977 N/A SER 263.A OG LEU 116.A O no hydrogen 2.448 N/A SER 263.A OG SER 260.A O no hydrogen 3.168 N/A ARG 265.A NH1 LEU 152.A O no hydrogen 2.734 N/A ARG 265.A NH1 GLY 286.A O no hydrogen 3.027 N/A ARG 265.A NH2 GLY 286.A O no hydrogen 2.974 N/A VAL 266.A N HIS 262.A O no hydrogen 2.977 N/A GLY 267.A N SER 263.A O no hydrogen 2.846 N/A ALA 268.A N ALA 264.A O no hydrogen 2.743 N/A ALA 269.A N ARG 265.A O no hydrogen 3.056 N/A ARG 270.A N VAL 266.A O no hydrogen 3.101 N/A ARG 270.A NH1 ASP 302.A OD2 no hydrogen 2.854 N/A ARG 270.A NH2 GLN 114.A OE1 no hydrogen 3.174 N/A ASP 271.A N GLY 267.A O no hydrogen 2.949 N/A MET 272.A N ALA 268.A O no hydrogen 2.984 N/A ALA 273.A N ALA 269.A O no hydrogen 3.005 N/A ARG 274.A N ARG 270.A O no hydrogen 2.775 N/A ARG 274.A NE ASP 271.A OD1 no hydrogen 2.866 N/A ARG 274.A NH1 ASP 302.A OD1 no hydrogen 2.840 N/A ARG 274.A NH1 SER 303.A OG no hydrogen 2.886 N/A ARG 274.A NH2 ASP 271.A OD1 no hydrogen 2.854 N/A ARG 274.A NH2 ASP 302.A OD1 no hydrogen 2.920 N/A ALA 275.A N ASP 271.A O no hydrogen 2.986 N/A ALA 275.A N MET 272.A O no hydrogen 3.180 N/A GLY 276.A N ALA 273.A O no hydrogen 3.115 N/A VAL 277.A N MET 272.A O no hydrogen 3.152 N/A ILE 282.A N SER 278.A O no hydrogen 2.954 N/A MET 283.A N ILE 279.A O no hydrogen 2.675 N/A GLN 284.A N PRO 280.A O no hydrogen 2.874 N/A ALA 285.A N GLU 281.A O no hydrogen 3.020 N/A GLY 286.A N ILE 282.A O no hydrogen 3.243 N/A GLY 287.A N GLN 284.A O no hydrogen 3.389 N/A TRP 288.A N MET 283.A O no hydrogen 2.831 N/A ASN 292.A ND2 ASN 290.A OD1 no hydrogen 3.413 N/A ILE 293.A N ASN 290.A OD1 no hydrogen 2.845 N/A VAL 294.A N ASN 290.A O no hydrogen 3.026 N/A MET 295.A N VAL 291.A O no hydrogen 2.950 N/A ASN 296.A N ASN 292.A O no hydrogen 2.990 N/A PHE 297.A N ILE 293.A O no hydrogen 3.216 N/A ILE 298.A N VAL 294.A O no hydrogen 3.134 N/A ARG 299.A N ASN 296.A O no hydrogen 3.305 N/A ARG 299.A NH1 ASN 296.A O no hydrogen 2.909 N/A ARG 299.A NH2 ALA 112.A O no hydrogen 3.136 N/A ASN 300.A ND2 GLN 114.A OE1 no hydrogen 2.941 N/A GLY 306.A N GLU 304.A OE2 no hydrogen 2.622 N/A ARG 310.A N GLY 306.A O no hydrogen 2.976 N/A ARG 310.A NE THR 305.A O no hydrogen 3.009 N/A ARG 310.A NH2 THR 305.A O no hydrogen 3.069 N/A LEU 311.A N ALA 307.A O no hydrogen 3.012 N/A LEU 312.A N MET 308.A O no hydrogen 2.898 N/A GLU 313.A N VAL 309.A O no hydrogen 2.846 N/A ASP 314.A N LEU 311.A O no hydrogen 2.878 N/A GLY 315.A N ARG 310.A O no hydrogen 2.511 N/A