Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2gsj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N VAL 271.A O no hydrogen 3.046 N/A GLY 1.A N VAL 271.A OXT no hydrogen 3.082 N/A GLY 2.A N GLY 248.A O no hydrogen 2.783 N/A VAL 4.A N VAL 250.A O no hydrogen 2.794 N/A VAL 5.A N ILE 27.A O no hydrogen 2.969 N/A TYR 6.A N LEU 252.A O no hydrogen 3.264 N/A TYR 6.A OH ASP 123.A OD2 no hydrogen 2.499 N/A TRP 7.A N ASN 29.A O no hydrogen 2.828 N/A TRP 7.A NE1 GLY 14.A O no hydrogen 2.807 N/A GLY 8.A N GLU 13.A OE2 no hydrogen 2.703 N/A GLN 9.A NE2 GLY 8.A O no hydrogen 3.594 N/A GLN 9.A NE2 ALA 31.A O no hydrogen 2.820 N/A GLN 9.A NE2 ASN 45.A OD1 no hydrogen 3.166 N/A ASN 10.A N GLU 13.A OE2 no hydrogen 3.178 N/A GLY 12.A N ASN 10.A OD1 no hydrogen 2.861 N/A GLU 13.A N ASN 10.A O no hydrogen 2.952 N/A SER 18.A N THR 15.A OG1 no hydrogen 2.749 N/A THR 19.A N THR 15.A O no hydrogen 2.971 N/A THR 19.A OG1 THR 15.A O no hydrogen 2.788 N/A CYS 20.A N LEU 16.A O no hydrogen 2.913 N/A GLU 21.A N THR 17.A O no hydrogen 2.770 N/A SER 22.A N SER 18.A O no hydrogen 2.985 N/A SER 22.A OG THR 19.A O no hydrogen 2.675 N/A GLY 23.A N CYS 20.A O no hydrogen 3.277 N/A LEU 24.A N SER 22.A OG no hydrogen 3.075 N/A TYR 25.A OH ASP 258.A OD2 no hydrogen 2.487 N/A GLN 26.A N ILE 3.A O no hydrogen 2.694 N/A ILE 27.A N ILE 3.A O no hydrogen 3.392 N/A VAL 28.A N LYS 73.A O no hydrogen 2.797 N/A ASN 29.A N VAL 5.A O no hydrogen 2.757 N/A ILE 30.A N MET 75.A O no hydrogen 2.701 N/A ALA 31.A N TRP 7.A O no hydrogen 2.786 N/A PHE 32.A N ASN 45.A O no hydrogen 2.955 N/A LEU 33.A N SER 77.A O no hydrogen 2.730 N/A SER 34.A N GLN 43.A O no hydrogen 2.993 N/A SER 34.A OG GLN 43.A O no hydrogen 3.439 N/A GLN 35.A N GLN 43.A O no hydrogen 3.092 N/A GLY 38.A N ASP 92.A OD2 no hydrogen 2.648 N/A ARG 40.A N GLY 37.A O no hydrogen 2.903 N/A ARG 40.A NE SER 84.A OG no hydrogen 2.927 N/A ARG 40.A NH1 SER 86.A OG no hydrogen 2.996 N/A ARG 40.A NH2 PHE 36.A O no hydrogen 3.402 N/A ARG 40.A NH2 GLY 37.A O no hydrogen 2.896 N/A ARG 40.A NH2 SER 86.A O no hydrogen 3.216 N/A ARG 40.A NH2 SER 86.A OG no hydrogen 3.005 N/A GLN 43.A N GLN 35.A O no hydrogen 2.868 N/A ASN 45.A N PHE 32.A O no hydrogen 2.781 N/A ALA 47.A N ASN 45.A OD1 no hydrogen 2.849 N/A HIS 49.A N LEU 46.A O no hydrogen 2.881 N/A HIS 49.A NE2 GLU 13.A OE2 no hydrogen 2.723 N/A ALA 53.A N ASP 51.A OD2 no hydrogen 2.905 N/A GLY 56.A N ALA 53.A O no hydrogen 3.209 N/A ARG 58.A N ASN 55.A O no hydrogen 3.244 N/A ARG 58.A NH2 ASN 54.A O no hydrogen 3.192 N/A VAL 60.A N CYS 57.A O no hydrogen 2.998 N/A SER 61.A N ARG 58.A O no hydrogen 3.258 N/A SER 61.A OG LEU 114.A O no hydrogen 2.423 N/A ASP 62.A N THR 59.A O no hydrogen 2.930 N/A ILE 64.A N VAL 60.A O no hydrogen 2.809 N/A ARG 65.A N SER 61.A O no hydrogen 2.857 N/A ARG 65.A NH2 ASP 62.A OD1 no hydrogen 2.794 N/A ALA 66.A N ASP 62.A O no hydrogen 2.849 N/A CYS 67.A N GLY 63.A O no hydrogen 2.870 N/A CYS 67.A SG LEU 16.A O no hydrogen 3.871 N/A CYS 67.A SG GLY 63.A O no hydrogen 2.819 N/A GLN 68.A N ILE 64.A O no hydrogen 2.826 N/A GLN 68.A NE2 VAL 118.A O no hydrogen 2.767 N/A GLN 68.A NE2 ASP 120.A OD2 no hydrogen 2.815 N/A ARG 69.A N ARG 65.A O no hydrogen 2.761 N/A ARG 70.A N CYS 67.A O no hydrogen 2.874 N/A GLY 71.A N GLN 68.A O no hydrogen 3.005 N/A ILE 72.A N CYS 67.A O no hydrogen 2.975 N/A LYS 73.A N GLN 26.A O no hydrogen 3.107 N/A VAL 74.A N ASP 120.A OD2 no hydrogen 2.857 N/A MET 75.A N VAL 28.A O no hydrogen 2.796 N/A LEU 76.A N GLY 121.A O no hydrogen 2.776 N/A SER 77.A N ILE 30.A O no hydrogen 2.716 N/A SER 77.A OG ASP 123.A O no hydrogen 3.547 N/A SER 77.A OG ASP 123.A OD2 no hydrogen 2.738 N/A ILE 78.A N ASP 123.A O no hydrogen 2.760 N/A GLY 79.A N LEU 33.A O no hydrogen 2.814 N/A GLY 80.A N ASP 125.A O no hydrogen 2.688 N/A TYR 85.A OH GLY 80.A O no hydrogen 2.633 N/A SER 86.A N PHE 36.A O no hydrogen 3.354 N/A SER 88.A N ASP 92.A OD2 no hydrogen 2.818 N/A ASP 92.A N SER 89.A OG no hydrogen 2.883 N/A ALA 93.A N SER 89.A O no hydrogen 2.841 N/A ARG 94.A N VAL 90.A O no hydrogen 2.808 N/A SER 95.A N GLN 91.A O no hydrogen 2.738 N/A VAL 96.A N ASP 92.A O no hydrogen 2.792 N/A ALA 97.A N ALA 93.A O no hydrogen 2.861 N/A ASP 98.A N ARG 94.A O no hydrogen 2.788 N/A TYR 99.A N SER 95.A O no hydrogen 2.798 N/A ILE 100.A N VAL 96.A O no hydrogen 2.792 N/A TRP 101.A N ALA 97.A O no hydrogen 2.816 N/A ASN 102.A N ASP 98.A O no hydrogen 2.882 N/A ASN 103.A N TYR 99.A O no hydrogen 2.912 N/A ASN 103.A N ILE 100.A O no hydrogen 3.222 N/A ASN 103.A ND2 TYR 99.A O no hydrogen 2.959 N/A PHE 104.A N ILE 100.A O no hydrogen 2.758 N/A LEU 105.A N ILE 100.A O no hydrogen 3.177 N/A LEU 105.A N TRP 101.A O no hydrogen 3.099 N/A GLY 107.A N TRP 101.A O no hydrogen 2.876 N/A ARG 108.A N ASN 102.A OD1 no hydrogen 3.109 N/A SER 109.A OG ASN 103.A OD1 no hydrogen 2.676 N/A SER 111.A N SER 109.A OG no hydrogen 3.206 N/A ARG 112.A NE GLY 115.A O no hydrogen 2.876 N/A ARG 112.A NH1 LEU 105.A O no hydrogen 3.102 N/A ARG 112.A NH2 LEU 105.A O no hydrogen 2.901 N/A ARG 112.A NH2 ALA 117.A O no hydrogen 2.816 N/A GLY 115.A N ARG 112.A O no hydrogen 2.982 N/A ALA 117.A N SER 61.A OG no hydrogen 2.927 N/A LEU 119.A N PHE 104.A O no hydrogen 2.837 N/A ASP 120.A N VAL 74.A O no hydrogen 2.772 N/A VAL 122.A N PHE 151.A O no hydrogen 2.875 N/A ASP 123.A N LEU 76.A O no hydrogen 2.622 N/A PHE 124.A N SER 153.A O no hydrogen 2.642 N/A ASP 125.A N ILE 78.A O no hydrogen 2.853 N/A GLU 127.A N TYR 85.A OH no hydrogen 2.859 N/A TYR 133.A N GLY 130.A O no hydrogen 3.363 N/A ALA 135.A N ASP 134.A OD1 no hydrogen 2.942 N/A LEU 136.A N TYR 132.A O no hydrogen 2.980 N/A ALA 137.A N TYR 133.A O no hydrogen 2.848 N/A ARG 138.A N ASP 134.A O no hydrogen 2.858 N/A ARG 139.A N ALA 135.A O no hydrogen 2.918 N/A LEU 140.A N LEU 136.A O no hydrogen 2.977 N/A SER 141.A N ALA 137.A O no hydrogen 2.707 N/A GLU 142.A N ARG 138.A O no hydrogen 2.962 N/A GLU 142.A N ARG 139.A O no hydrogen 3.248 N/A HIS 143.A N LEU 140.A O no hydrogen 3.166 N/A ASN 144.A N SER 141.A O no hydrogen 2.599 N/A ASN 144.A ND2 VAL 150.A O no hydrogen 3.499 N/A LYS 148.A NZ ASP 120.A OD1 no hydrogen 3.568 N/A PHE 151.A N ASP 120.A O no hydrogen 2.800 N/A LEU 152.A N ASP 175.A OD2 no hydrogen 2.728 N/A SER 153.A N VAL 122.A O no hydrogen 2.920 N/A SER 153.A OG ASP 123.A OD1 no hydrogen 2.645 N/A ALA 154.A N TYR 176.A O no hydrogen 2.993 N/A ALA 155.A N PHE 124.A O no hydrogen 2.977 N/A GLN 157.A N ASP 162.A OD2 no hydrogen 2.560 N/A CYS 158.A N GLN 180.A O no hydrogen 2.982 N/A CYS 158.A SG GLN 180.A O no hydrogen 3.344 N/A CYS 158.A SG ASN 184.A O no hydrogen 4.041 N/A SER 164.A N ASP 162.A OD1 no hydrogen 2.892 N/A LEU 165.A N ASP 162.A O no hydrogen 3.231 N/A LEU 165.A N ASP 162.A OD1 no hydrogen 2.906 N/A ASN 166.A N ASP 162.A O no hydrogen 2.775 N/A LEU 169.A N LEU 165.A O no hydrogen 2.779 N/A SER 170.A N ASN 166.A O no hydrogen 2.775 N/A SER 170.A OG LYS 167.A O no hydrogen 2.569 N/A THR 171.A N ALA 168.A O no hydrogen 3.178 N/A THR 171.A OG1 ALA 168.A O no hydrogen 2.731 N/A GLY 172.A N LEU 169.A O no hydrogen 3.033 N/A LEU 173.A N THR 171.A OG1 no hydrogen 3.147 N/A ASP 175.A N LEU 152.A O no hydrogen 2.708 N/A TYR 176.A N LEU 152.A O no hydrogen 3.094 N/A VAL 177.A N LYS 211.A O no hydrogen 2.832 N/A TRP 178.A N ALA 154.A O no hydrogen 2.928 N/A TRP 178.A NE1 ASP 123.A OD1 no hydrogen 2.685 N/A VAL 179.A N TYR 213.A O no hydrogen 3.079 N/A GLN 180.A N PRO 156.A O no hydrogen 2.746 N/A GLN 180.A NE2 TRP 178.A O no hydrogen 2.672 N/A PHE 181.A N GLY 215.A O no hydrogen 2.838 N/A TYR 182.A OH GLN 180.A OE1 no hydrogen 2.526 N/A ASN 183.A N SER 225.A O no hydrogen 2.858 N/A ASN 184.A N GLU 188.A OE2 no hydrogen 2.680 N/A ASN 184.A ND2 GLN 157.A OE1 no hydrogen 2.793 N/A ASN 184.A ND2 TYR 182.A O no hydrogen 2.834 N/A CYS 187.A N ASN 184.A O no hydrogen 3.045 N/A CYS 187.A SG ASN 184.A O no hydrogen 3.920 N/A GLU 188.A N ASN 184.A O no hydrogen 3.166 N/A SER 191.A OG GLN 236.A OE1 no hydrogen 2.685 N/A ASN 193.A N ASN 190.A O no hydrogen 3.004 N/A ARG 198.A N PRO 194.A O no hydrogen 2.889 N/A ASN 199.A N SER 195.A O no hydrogen 2.739 N/A SER 200.A N ASN 196.A O no hydrogen 2.998 N/A SER 200.A OG CYS 158.A O no hydrogen 3.341 N/A TRP 201.A N PHE 197.A O no hydrogen 2.768 N/A TRP 201.A NE1 SER 244.A OG no hydrogen 2.834 N/A ASN 202.A N ARG 198.A O no hydrogen 2.875 N/A LYS 203.A N ASN 199.A O no hydrogen 2.835 N/A TRP 204.A N SER 200.A O no hydrogen 2.881 N/A TRP 204.A NE1 CYS 158.A O no hydrogen 2.666 N/A THR 205.A N TRP 201.A O no hydrogen 2.941 N/A THR 205.A OG1 TRP 201.A O no hydrogen 2.820 N/A THR 205.A OG1 ASN 202.A O no hydrogen 3.008 N/A SER 206.A N ASN 202.A O no hydrogen 2.909 N/A SER 206.A OG ASN 202.A O no hydrogen 2.731 N/A SER 206.A OG ASN 202.A OD1 no hydrogen 3.452 N/A SER 207.A N TRP 204.A O no hydrogen 2.949 N/A SER 207.A OG LYS 203.A O no hydrogen 2.539 N/A LYS 211.A N ASP 175.A O no hydrogen 2.862 N/A LYS 211.A NZ PRO 245.A O no hydrogen 2.730 N/A PHE 212.A N LYS 246.A O no hydrogen 2.670 N/A TYR 213.A N VAL 177.A O no hydrogen 2.795 N/A VAL 214.A N GLY 249.A O no hydrogen 2.852 N/A GLY 215.A N VAL 179.A O no hydrogen 2.730 N/A LEU 216.A N MET 251.A O no hydrogen 2.780 N/A ALA 218.A N TRP 253.A O no hydrogen 2.713 N/A ALA 222.A N SER 219.A O no hydrogen 2.973 N/A GLY 224.A N ASN 183.A OD1 no hydrogen 2.716 N/A SER 225.A N ASN 183.A OD1 no hydrogen 3.375 N/A SER 225.A OG GLU 188.A OE1 no hydrogen 3.296 N/A SER 225.A OG GLU 188.A OE2 no hydrogen 2.438 N/A LEU 233.A N PRO 229.A O no hydrogen 2.885 N/A ILE 234.A N PRO 230.A O no hydrogen 2.779 N/A ASN 235.A N GLN 231.A O no hydrogen 2.806 N/A GLN 236.A N GLN 232.A O no hydrogen 2.740 N/A VAL 237.A N GLN 232.A O no hydrogen 3.383 N/A VAL 237.A N LEU 233.A O no hydrogen 3.037 N/A LEU 238.A N LEU 233.A O no hydrogen 2.880 N/A VAL 241.A N VAL 237.A O no hydrogen 2.888 N/A LYS 242.A N LEU 238.A O no hydrogen 2.859 N/A LYS 242.A NZ SER 270.A O no hydrogen 2.498 N/A ARG 243.A N PHE 240.A O no hydrogen 3.088 N/A SER 244.A N VAL 241.A O no hydrogen 2.986 N/A SER 244.A OG VAL 241.A O no hydrogen 3.516 N/A LYS 246.A NZ THR 205.A O no hydrogen 2.731 N/A LYS 246.A NZ PHE 208.A O no hydrogen 2.886 N/A TYR 247.A N SER 244.A O no hydrogen 3.008 N/A TYR 247.A OH VAL 271.A O no hydrogen 2.622 N/A GLY 248.A N PHE 212.A O no hydrogen 2.653 N/A VAL 250.A N GLY 2.A O no hydrogen 2.962 N/A MET 251.A N VAL 214.A O no hydrogen 2.795 N/A LEU 252.A N VAL 4.A O no hydrogen 2.679 N/A TRP 253.A N LEU 216.A O no hydrogen 2.867 N/A ARG 255.A N TYR 6.A O no hydrogen 2.728 N/A ARG 255.A NH1 TYR 25.A OH no hydrogen 2.781 N/A PHE 256.A N GLU 13.A OE1 no hydrogen 3.046 N/A ASN 257.A N ASP 254.A OD2 no hydrogen 2.893 N/A ASP 258.A N ASP 254.A O no hydrogen 2.851 N/A LEU 259.A N ARG 255.A O no hydrogen 2.794 N/A LYS 260.A N PHE 256.A O no hydrogen 3.085 N/A LYS 260.A NZ GLU 221.A OE2 no hydrogen 3.026 N/A THR 261.A N ASN 257.A O no hydrogen 2.965 N/A THR 261.A OG1 ALA 218.A O no hydrogen 2.590 N/A THR 261.A OG1 ASN 257.A O no hydrogen 3.134 N/A LYS 262.A N ASP 258.A O no hydrogen 2.672 N/A LYS 262.A NZ LEU 259.A O no hydrogen 2.836 N/A LYS 262.A NZ LYS 260.A O no hydrogen 2.964 N/A TYR 263.A N THR 261.A OG1 no hydrogen 3.229 N/A TYR 263.A OH VAL 228.A O no hydrogen 2.563 N/A SER 264.A N ASP 258.A OD1 no hydrogen 2.725 N/A SER 264.A OG ASP 258.A OD1 no hydrogen 3.204 N/A SER 264.A OG ASP 258.A OD2 no hydrogen 2.462 N/A SER 265.A OG LYS 262.A O no hydrogen 2.653 N/A LYS 266.A N LYS 262.A O no hydrogen 3.178 N/A LYS 266.A N TYR 263.A O no hydrogen 3.011 N/A ILE 267.A N TYR 263.A O no hydrogen 3.191 N/A ILE 267.A N SER 264.A O no hydrogen 3.104 N/A LYS 268.A N SER 264.A O no hydrogen 2.719 N/A LYS 268.A NZ GLY 23.A O no hydrogen 3.050 N/A SER 270.A N ILE 267.A O no hydrogen 2.812 N/A VAL 271.A N ILE 267.A O no hydrogen 2.892 N/A