Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1re4_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 6.A N SER 4.A OG no hydrogen 3.135 N/A THR 7.A N SER 4.A O no hydrogen 3.261 N/A SER 10.A N THR 7.A O no hydrogen 2.704 N/A SER 10.A OG THR 7.A O no hydrogen 2.651 N/A SER 11.A N THR 7.A O no hydrogen 2.854 N/A ILE 12.A N HIS 8.A O no hydrogen 2.638 N/A ARG 13.A N ASP 9.A O no hydrogen 3.368 N/A TYR 14.A N SER 11.A O no hydrogen 2.982 N/A LEU 15.A N SER 11.A O no hydrogen 3.205 N/A ILE 18.A N TYR 14.A O no hydrogen 3.218 N/A TYR 19.A N GLN 16.A O no hydrogen 3.046 N/A ASN 20.A N GLN 16.A O no hydrogen 3.007 N/A SER 21.A N GLU 17.A O no hydrogen 3.321 N/A ASN 23.A N TYR 19.A O no hydrogen 3.039 N/A GLN 24.A N ASN 20.A O no hydrogen 2.802 N/A LYS 25.A N SER 21.A O no hydrogen 2.915 N/A ILE 26.A N ASN 22.A O no hydrogen 2.931 N/A VAL 27.A N ASN 23.A O no hydrogen 3.121 N/A VAL 27.A N GLN 24.A O no hydrogen 2.829 N/A ASN 28.A N GLN 24.A O no hydrogen 3.224 N/A LEU 29.A N LYS 25.A O no hydrogen 2.867 N/A LYS 30.A N ILE 26.A O no hydrogen 2.981 N/A GLU 31.A N VAL 27.A O no hydrogen 3.042 N/A LYS 32.A N ASN 28.A O no hydrogen 2.808 N/A VAL 33.A N LEU 29.A O no hydrogen 2.682 N/A ALA 34.A N LYS 30.A O no hydrogen 2.802 N/A GLN 35.A N GLU 31.A O no hydrogen 3.045 N/A LEU 36.A N LYS 32.A O no hydrogen 3.076 N/A GLU 37.A N VAL 33.A O no hydrogen 3.004 N/A ALA 38.A N ALA 34.A O no hydrogen 3.224 N/A GLN 39.A N GLN 35.A O no hydrogen 3.340 N/A GLN 39.A NE2 GLN 39.A O no hydrogen 2.658 N/A CYS 40.A N GLU 37.A O no hydrogen 3.087 N/A CYS 40.A SG LEU 36.A O no hydrogen 3.398 N/A VAL 48.A N ASP 46.A OD1 no hydrogen 3.295 N/A HIS 51.A N LEU 71.A O no hydrogen 3.379 N/A HIS 51.A ND1 LEU 71.A O no hydrogen 3.090 N/A HIS 51.A NE2 GLN 68.A OE1 no hydrogen 3.254 N/A THR 54.A OG1 PHE 73.A O no hydrogen 2.604 N/A LYS 56.A NZ ASP 60.A OD2 no hydrogen 2.752 N/A CYS 58.A N THR 97.A OG1 no hydrogen 3.303 N/A CYS 58.A SG TYR 86.A O no hydrogen 4.033 N/A CYS 58.A SG TRP 96.A O no hydrogen 3.633 N/A CYS 58.A SG THR 97.A OG1 no hydrogen 3.106 N/A GLN 59.A NE2 ASN 63.A OD1 no hydrogen 2.900 N/A GLN 59.A NE2 GLY 93.A O no hydrogen 3.234 N/A ASP 60.A N ASP 57.A OD1 no hydrogen 2.660 N/A ILE 61.A N ASP 57.A O no hydrogen 2.966 N/A ALA 62.A N CYS 58.A O no hydrogen 2.666 N/A ASN 63.A N GLN 59.A O no hydrogen 2.837 N/A LYS 64.A N ASP 60.A O no hydrogen 3.209 N/A LYS 64.A NZ THR 54.A O no hydrogen 3.179 N/A GLY 65.A N ALA 62.A O no hydrogen 3.050 N/A LYS 67.A NZ GLY 65.A O no hydrogen 3.275 N/A GLY 70.A N CYS 87.A O no hydrogen 3.159 N/A TYR 72.A N VAL 85.A O no hydrogen 3.086 N/A TYR 72.A OH GLN 68.A O no hydrogen 2.662 N/A ILE 74.A N PHE 83.A O no hydrogen 3.185 N/A LYS 75.A N GLY 55.A O no hydrogen 2.835 N/A LYS 78.A NZ THR 143.A O no hydrogen 2.831 N/A ALA 79.A N PRO 76.A O no hydrogen 3.079 N/A PHE 83.A N ILE 74.A O no hydrogen 3.031 N/A VAL 85.A N TYR 72.A O no hydrogen 2.884 N/A CYS 87.A N GLY 70.A O no hydrogen 3.146 N/A GLU 88.A N TRP 96.A O no hydrogen 2.976 N/A GLY 93.A N ASP 90.A O no hydrogen 3.140 N/A ASN 94.A N ASP 90.A OD1 no hydrogen 2.779 N/A ASN 94.A ND2 ASP 90.A OD2 no hydrogen 2.816 N/A GLY 95.A N GLN 59.A OE1 no hydrogen 2.675 N/A TRP 96.A N GLU 88.A O no hydrogen 2.914 N/A THR 97.A N ILE 291.A O no hydrogen 2.951 N/A VAL 98.A N TYR 86.A O no hydrogen 3.232 N/A PHE 99.A N MET 289.A O no hydrogen 2.868 N/A GLN 100.A N MET 289.A O no hydrogen 3.390 N/A GLN 100.A NE2 LEU 249.A O no hydrogen 3.103 N/A GLN 100.A NE2 ASN 250.A OD1 no hydrogen 2.841 N/A LYS 101.A N PHE 131.A O no hydrogen 3.020 N/A ARG 102.A N THR 287.A O no hydrogen 2.569 N/A ARG 102.A NH1 GLY 251.A O no hydrogen 3.183 N/A ARG 102.A NH2 GLY 251.A O no hydrogen 2.864 N/A LEU 103.A N GLU 130.A OE2 no hydrogen 2.847 N/A ASP 104.A N GLU 130.A OE2 no hydrogen 2.987 N/A GLY 105.A N GLU 130.A OE2 no hydrogen 2.784 N/A SER 106.A N ASP 104.A OD1 no hydrogen 2.359 N/A SER 106.A OG ASP 104.A OD1 no hydrogen 2.604 N/A SER 106.A OG ASP 104.A OD2 no hydrogen 3.347 N/A SER 106.A OG GLU 130.A OE1 no hydrogen 3.504 N/A VAL 107.A N GLU 130.A OE1 no hydrogen 2.827 N/A LYS 110.A N ASP 108.A OD1 no hydrogen 2.703 N/A LYS 110.A NZ LYS 110.A O no hydrogen 3.565 N/A ASN 112.A N GLN 115.A OE1 no hydrogen 3.137 N/A TRP 113.A N ASP 221.A OD1 no hydrogen 2.686 N/A TRP 113.A N ASP 221.A OD2 no hydrogen 3.272 N/A TRP 113.A NE1 GLU 175.A OE2 no hydrogen 3.227 N/A GLN 115.A N ASN 112.A OD1 no hydrogen 2.853 N/A TYR 116.A N ASN 112.A O no hydrogen 2.940 N/A TYR 116.A OH PHE 109.A O no hydrogen 2.686 N/A LYS 117.A N TRP 113.A O no hydrogen 2.820 N/A LYS 117.A NZ GLU 175.A OE1 no hydrogen 2.629 N/A GLU 118.A N ILE 114.A O no hydrogen 2.676 N/A GLY 119.A N GLN 115.A O no hydrogen 2.540 N/A PHE 120.A N TRP 132.A O no hydrogen 2.930 N/A HIS 122.A N GLU 130.A O no hydrogen 3.225 N/A SER 124.A OG THR 129.A OG1 no hydrogen 2.663 N/A THR 126.A OG1 THR 128.A OG1 no hydrogen 2.627 N/A GLY 127.A N SER 124.A O no hydrogen 2.918 N/A THR 128.A N SER 124.A OG no hydrogen 2.994 N/A THR 128.A OG1 THR 126.A O no hydrogen 3.564 N/A THR 128.A OG1 THR 126.A OG1 no hydrogen 2.627 N/A THR 129.A OG1 HIS 122.A O no hydrogen 2.649 N/A THR 129.A OG1 SER 124.A OG no hydrogen 2.663 N/A PHE 131.A N LYS 101.A O no hydrogen 3.279 N/A TRP 132.A N PHE 120.A O no hydrogen 3.042 N/A TRP 132.A NE1 TYR 116.A O no hydrogen 3.119 N/A LEU 133.A N PHE 99.A O no hydrogen 2.779 N/A ASN 135.A N TYR 116.A O no hydrogen 2.863 N/A GLU 136.A N LYS 117.A O no hydrogen 3.156 N/A LYS 137.A NZ GLU 118.A O no hydrogen 3.132 N/A LYS 137.A NZ LEU 133.A O no hydrogen 3.264 N/A ILE 138.A N GLY 134.A O no hydrogen 2.951 N/A HIS 139.A N ASN 135.A O no hydrogen 2.831 N/A HIS 139.A ND1 VAL 172.A O no hydrogen 2.617 N/A LEU 140.A N GLU 136.A O no hydrogen 3.006 N/A ILE 141.A N LYS 137.A O no hydrogen 2.950 N/A SER 142.A N ILE 138.A O no hydrogen 2.989 N/A SER 142.A OG ILE 138.A O no hydrogen 3.099 N/A SER 142.A OG HIS 139.A O no hydrogen 3.223 N/A THR 143.A N LEU 140.A O no hydrogen 3.271 N/A THR 143.A OG1 HIS 139.A O no hydrogen 2.787 N/A ALA 150.A N ILE 292.A O no hydrogen 2.752 N/A LEU 151.A N TYR 167.A O no hydrogen 2.911 N/A ARG 152.A N LYS 290.A O no hydrogen 2.794 N/A ARG 152.A NE ASP 166.A OD1 no hydrogen 3.297 N/A ARG 152.A NE ASP 166.A OD2 no hydrogen 2.702 N/A ARG 152.A NH2 ASP 166.A OD2 no hydrogen 2.848 N/A VAL 153.A N ALA 165.A O no hydrogen 2.653 N/A GLU 154.A N THR 288.A O no hydrogen 3.007 N/A LEU 155.A N SER 163.A O no hydrogen 2.924 N/A ASP 157.A N ARG 161.A O no hydrogen 3.097 N/A TRP 158.A N TYR 282.A OH no hydrogen 2.746 N/A TRP 158.A NE1 SER 283.A O no hydrogen 2.855 N/A ARG 161.A N ASP 157.A OD1 no hydrogen 2.991 N/A SER 163.A N LEU 155.A O no hydrogen 3.373 N/A THR 164.A N ASP 190.A OD1 no hydrogen 3.138 N/A ALA 165.A N VAL 153.A O no hydrogen 2.796 N/A ASP 166.A N GLY 188.A O no hydrogen 2.916 N/A TYR 167.A N LEU 151.A O no hydrogen 2.791 N/A TYR 167.A OH ASP 193.A OD1 no hydrogen 3.353 N/A ALA 168.A N TYR 185.A O no hydrogen 2.986 N/A PHE 170.A N TYR 149.A O no hydrogen 2.924 N/A LYS 171.A N THR 182.A O no hydrogen 2.798 N/A VAL 172.A N SER 142.A OG no hydrogen 3.192 N/A GLY 173.A N ARG 180.A O no hydrogen 2.855 N/A ASP 177.A N PRO 174.A O no hydrogen 2.683 N/A LYS 178.A N GLU 175.A O no hydrogen 2.845 N/A TYR 179.A N PRO 174.A O no hydrogen 3.143 N/A TYR 179.A OH GLU 136.A OE1 no hydrogen 2.678 N/A ARG 180.A NE ASP 177.A OD2 no hydrogen 2.536 N/A ARG 180.A NH1 GLY 214.A O no hydrogen 2.757 N/A ARG 180.A NH2 ASP 177.A OD1 no hydrogen 2.946 N/A LEU 181.A N MET 215.A O no hydrogen 2.908 N/A THR 182.A N LYS 171.A O no hydrogen 2.946 N/A TYR 183.A N ASN 213.A OD1 no hydrogen 2.990 N/A ALA 184.A N ALA 168.A O no hydrogen 2.964 N/A ALA 187.A N ASP 166.A O no hydrogen 2.713 N/A ALA 191.A N THR 164.A O no hydrogen 3.136 N/A GLY 192.A N GLY 189.A O no hydrogen 3.010 N/A ALA 194.A N GLY 192.A O no hydrogen 2.871 N/A PHE 195.A N TYR 167.A OH no hydrogen 3.349 N/A ASP 196.A N ASP 193.A OD1 no hydrogen 2.722 N/A GLY 197.A N ALA 194.A O no hydrogen 3.348 N/A PHE 198.A N THR 210.A OG1 no hydrogen 2.864 N/A PHE 200.A N ASP 206.A OD2 no hydrogen 2.522 N/A GLY 201.A N ASP 206.A OD2 no hydrogen 2.864 N/A ASP 203.A N ASP 206.A OD1 no hydrogen 2.891 N/A SER 205.A N ASP 203.A OD2 no hydrogen 3.287 N/A LYS 207.A NZ ASP 196.A O no hydrogen 3.258 N/A PHE 209.A N SER 205.A O no hydrogen 2.878 N/A THR 210.A N LYS 207.A O no hydrogen 3.362 N/A THR 210.A OG1 PHE 198.A O no hydrogen 3.348 N/A THR 210.A OG1 ASP 206.A O no hydrogen 3.041 N/A SER 211.A OG PHE 208.A O no hydrogen 3.421 N/A SER 211.A OG ASN 242.A OD1 no hydrogen 3.334 N/A HIS 212.A N PHE 195.A O no hydrogen 2.658 N/A ASN 213.A ND2 TYR 183.A O no hydrogen 3.209 N/A GLY 214.A N LEU 181.A O no hydrogen 2.851 N/A MET 215.A N HIS 212.A O no hydrogen 3.107 N/A PHE 217.A N LYS 178.A O no hydrogen 2.994 N/A SER 218.A N TRP 239.A O no hydrogen 2.721 N/A THR 219.A N ASN 222.A O no hydrogen 3.416 N/A THR 219.A OG1 ASP 221.A OD1 no hydrogen 2.857 N/A ASN 222.A N THR 219.A O no hydrogen 2.854 N/A ASN 224.A N SER 218.A OG no hydrogen 2.957 N/A ASP 225.A N ASP 223.A OD1 no hydrogen 3.232 N/A LYS 226.A N ASN 242.A O no hydrogen 2.716 N/A PHE 227.A N ASP 225.A OD1 no hydrogen 3.061 N/A GLU 228.A N GLU 228.A OE1 no hydrogen 2.720 N/A CYS 231.A N ASP 225.A OD2 no hydrogen 2.699 N/A GLN 234.A N ASN 230.A O no hydrogen 3.044 N/A ASP 235.A N CYS 231.A O no hydrogen 2.972 N/A SER 237.A N ALA 232.A O no hydrogen 2.771 N/A SER 237.A OG HIS 248.A NE2 no hydrogen 2.993 N/A GLY 238.A N TYR 116.A OH no hydrogen 3.059 N/A TRP 239.A N SER 218.A O no hydrogen 2.916 N/A TRP 240.A NE1 TYR 179.A O no hydrogen 3.005 N/A MET 241.A N TRP 239.A O no hydrogen 2.952 N/A ASN 242.A N CYS 244.A O no hydrogen 2.765 N/A HIS 245.A NE2 ASP 235.A OD2 no hydrogen 2.731 N/A HIS 248.A N ILE 273.A O no hydrogen 2.754 N/A HIS 248.A NE2 SER 237.A OG no hydrogen 2.993 N/A ASN 250.A ND2 GLY 238.A O no hydrogen 2.930 N/A VAL 252.A N ASN 270.A O no hydrogen 2.784 N/A TYR 253.A OH LYS 285.A O no hydrogen 2.551 N/A GLY 257.A N TYR 254.A O no hydrogen 2.831 N/A TYR 259.A N TRP 281.A O no hydrogen 3.170 N/A TYR 259.A OH ARG 280.A O no hydrogen 2.965 N/A SER 260.A N SER 263.A OG no hydrogen 3.021 N/A ALA 262.A N SER 260.A OG no hydrogen 2.902 N/A SER 263.A OG SER 260.A O no hydrogen 2.762 N/A GLY 267.A N THR 264.A O no hydrogen 3.264 N/A ASP 269.A N ASP 269.A OD1 no hydrogen 2.522 N/A ASN 270.A ND2 TYR 254.A OH no hydrogen 2.838 N/A ILE 272.A N SER 283.A OG no hydrogen 2.906 N/A ILE 273.A N HIS 248.A O no hydrogen 3.210 N/A TRP 274.A NE1 GLY 192.A O no hydrogen 2.789 N/A ALA 275.A N ALA 246.A O no hydrogen 2.878 N/A THR 276.A OG1 ALA 191.A O no hydrogen 2.590 N/A TRP 277.A N TRP 274.A O no hydrogen 2.804 N/A LYS 278.A NZ ASP 157.A OD2 no hydrogen 2.829 N/A ARG 280.A NH1 ASP 269.A OD2 no hydrogen 2.943 N/A TRP 281.A N THR 279.A OG1 no hydrogen 3.087 N/A TYR 282.A N THR 279.A O no hydrogen 3.246 N/A SER 283.A N GLY 257.A O no hydrogen 2.627 N/A SER 283.A OG VAL 252.A O no hydrogen 3.110 N/A MET 284.A N ILE 272.A O no hydrogen 2.815 N/A LYS 285.A N GLU 156.A O no hydrogen 2.898 N/A LYS 286.A N GLU 156.A O no hydrogen 3.174 N/A THR 287.A N ARG 102.A O no hydrogen 2.930 N/A THR 287.A OG1 LYS 286.A O no hydrogen 2.915 N/A THR 288.A N GLU 154.A O no hydrogen 3.106 N/A MET 289.A N GLN 100.A O no hydrogen 2.938 N/A LYS 290.A N ARG 152.A O no hydrogen 3.156 N/A LYS 290.A NZ GLU 88.A OE1 no hydrogen 2.874 N/A LYS 290.A NZ GLU 88.A OE2 no hydrogen 3.246 N/A LYS 290.A NZ GLU 154.A OE1 no hydrogen 2.858 N/A ILE 291.A N THR 97.A O no hydrogen 3.104 N/A ILE 292.A N ALA 150.A O no hydrogen 3.028 N/A PHE 294.A N PRO 148.A O no hydrogen 2.609 N/A ARG 296.A N PHE 294.A O no hydrogen 2.436 N/A ARG 296.A NE ASN 94.A OD1 no hydrogen 2.808 N/A ARG 296.A NH2 SER 92.A O no hydrogen 3.285 N/A LEU 297.A N PHE 294.A O no hydrogen 2.719 N/A THR 298.A N ARG 296.A O no hydrogen 2.589 N/A