Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4i77_L.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N SER 26.A OG no hydrogen 2.829 N/A THR 5.A N ARG 24.A O no hydrogen 2.791 N/A GLN 6.A NE2 TYR 90.A O no hydrogen 2.933 N/A SER 7.A N ASN 22.A O no hydrogen 3.143 N/A SER 7.A OG GLN 6.A O no hydrogen 3.305 N/A LEU 11.A N LYS 107.A O no hydrogen 2.865 N/A VAL 13.A N GLU 109.A O no hydrogen 3.055 N/A SER 14.A N GLU 17.A OE1 no hydrogen 3.138 N/A GLY 16.A N LEU 82.A O no hydrogen 2.798 N/A GLU 17.A N SER 14.A O no hydrogen 3.179 N/A ALA 19.A N ILE 79.A O no hydrogen 2.823 N/A ILE 21.A N LEU 77.A O no hydrogen 2.870 N/A ASN 22.A N SER 7.A O no hydrogen 2.915 N/A CYS 23.A N PHE 75.A O no hydrogen 2.883 N/A ARG 24.A N THR 5.A O no hydrogen 2.743 N/A ALA 25.A N THR 73.A O no hydrogen 2.798 N/A SER 26.A N VAL 3.A O no hydrogen 2.751 N/A LYS 27.A NZ GLU 97.A OE1 no hydrogen 2.789 N/A LYS 27.A NZ GLU 97.A OE2 no hydrogen 3.006 N/A ASN 34.A N SER 31D.A O no hydrogen 3.168 N/A SER 35.A OG ASP 30C.A OD1 no hydrogen 2.692 N/A PHE 36.A N VAL 29B.A O no hydrogen 2.880 N/A HIS 38.A N GLN 93.A O no hydrogen 2.700 N/A HIS 38.A NE2 ASN 95.A OD1 no hydrogen 2.667 N/A TRP 39.A N ILE 52.A O no hydrogen 2.790 N/A TYR 40.A N TYR 91.A O no hydrogen 2.752 N/A TYR 40.A OH GLN 93.A OE1 no hydrogen 2.733 N/A GLN 41.A N LYS 49.A O no hydrogen 2.825 N/A GLN 41.A NE2 TYR 90.A OH no hydrogen 2.898 N/A GLN 42.A N VAL 89.A O no hydrogen 2.797 N/A GLN 42.A NE2 GLN 46.A O no hydrogen 3.051 N/A LYS 43.A NZ GLU 85.A O no hydrogen 3.244 N/A GLN 46.A N LYS 43.A O no hydrogen 3.175 N/A LYS 49.A N GLN 41.A O no hydrogen 2.771 N/A LEU 51.A N TRP 39.A O no hydrogen 2.818 N/A ILE 52.A N TRP 39.A O no hydrogen 3.300 N/A TYR 53.A N ASN 57.A O no hydrogen 2.832 N/A LEU 54.A N HIS 38.A ND1 no hydrogen 3.043 N/A ALA 55.A N MET 37.A O no hydrogen 2.745 N/A SER 56.A N LEU 54.A O no hydrogen 2.778 N/A ASN 57.A N TYR 53.A O no hydrogen 2.928 N/A ASN 57.A ND2 TYR 53.A O no hydrogen 3.621 N/A GLU 59.A N LEU 51.A O no hydrogen 2.871 N/A VAL 62.A N GLU 59.A O no hydrogen 3.131 N/A ARG 65.A NE ASP 86.A OD1 no hydrogen 3.383 N/A ARG 65.A NE ASP 86.A OD2 no hydrogen 2.839 N/A ARG 65.A NH2 ASP 86.A OD1 no hydrogen 2.741 N/A PHE 66.A N PRO 63.A O no hydrogen 3.292 N/A SER 67.A N THR 78.A O no hydrogen 2.876 N/A SER 69.A N THR 76.A O no hydrogen 2.931 N/A SER 71.A N ASP 74.A O no hydrogen 3.156 N/A GLY 72.A N ASP 30C.A OD1 no hydrogen 3.019 N/A GLY 72.A N ASP 30C.A OD2 no hydrogen 3.193 N/A THR 73.A OG1 ALA 25.A O no hydrogen 3.348 N/A THR 73.A OG1 LYS 27.A O no hydrogen 3.471 N/A ASP 74.A N SER 71.A O no hydrogen 3.268 N/A PHE 75.A N CYS 23.A O no hydrogen 2.796 N/A THR 76.A N SER 69.A O no hydrogen 2.925 N/A LEU 77.A N ILE 21.A O no hydrogen 2.967 N/A THR 78.A N SER 67.A O no hydrogen 2.789 N/A ILE 79.A N ALA 19.A O no hydrogen 2.798 N/A SER 80.A N ARG 65.A O no hydrogen 2.946 N/A SER 81.A OG GLN 83.A OE1 no hydrogen 3.249 N/A LEU 82.A N GLU 17.A O no hydrogen 2.867 N/A GLN 83.A N ASP 86.A OD2 no hydrogen 2.876 N/A GLU 85.A N GLU 85.A OE1 no hydrogen 2.755 N/A ASP 86.A N GLN 83.A O no hydrogen 2.927 N/A ALA 88.A N VAL 108.A O no hydrogen 3.374 N/A VAL 89.A N GLN 42.A O no hydrogen 3.004 N/A TYR 90.A N THR 106.A O no hydrogen 2.817 N/A TYR 90.A OH ASP 86.A O no hydrogen 2.594 N/A TYR 91.A N TYR 40.A O no hydrogen 2.889 N/A CYS 92.A N GLN 6.A OE1 no hydrogen 3.284 N/A GLN 93.A N HIS 38.A O no hydrogen 2.914 N/A GLN 93.A NE2 GLN 94.A O no hydrogen 2.995 N/A GLN 94.A N THR 101.A O no hydrogen 2.976 N/A GLN 94.A NE2 GLU 97.A O no hydrogen 3.103 N/A GLN 94.A NE2 PRO 99.A O no hydrogen 3.155 N/A GLN 94.A NE2 THR 101.A OG1 no hydrogen 3.063 N/A ASN 95.A N PHE 36.A O no hydrogen 3.155 N/A ASN 96.A ND2 SER 31D.A OG no hydrogen 2.689 N/A GLU 97.A N GLN 94.A OE1 no hydrogen 3.172 N/A THR 101.A N GLN 94.A O no hydrogen 3.421 N/A THR 101.A OG1 ILE 2.A O no hydrogen 2.630 N/A GLY 103.A N CYS 92.A O no hydrogen 2.789 N/A GLY 105.A N GLN 6.A OE1 no hydrogen 2.873 N/A THR 106.A N TYR 90.A O no hydrogen 2.924 N/A THR 106.A OG1 PRO 8.A O no hydrogen 2.848 N/A LYS 107.A N ASP 9.A O no hydrogen 3.197 N/A LYS 107.A NZ ALA 88.A O no hydrogen 3.151 N/A LYS 107.A NZ VAL 108.A O no hydrogen 3.019 N/A VAL 108.A N ALA 88.A O no hydrogen 2.795 N/A GLU 109.A N LEU 11.A O no hydrogen 2.889 N/A ILE 110.A N GLN 170.A OE1 no hydrogen 2.929 N/A LYS 111.A N VAL 13.A O no hydrogen 2.805 N/A LYS 111.A NZ TYR 144.A OH no hydrogen 3.048 N/A ARG 112.A NE THR 113.A O no hydrogen 2.857 N/A ARG 112.A NH1 ASP 174.A O no hydrogen 2.764 N/A ARG 112.A NH2 THR 113.A O no hydrogen 3.395 N/A ARG 112.A NH2 THR 113.A OG1 no hydrogen 3.168 N/A ALA 115.A N TYR 144.A O no hydrogen 2.796 N/A SER 118.A N ASN 141.A O no hydrogen 3.063 N/A PHE 120.A N LEU 139.A O no hydrogen 2.978 N/A PHE 122.A N VAL 137.A O no hydrogen 2.828 N/A GLU 127.A N GLU 127.A OE1.A no hydrogen 2.847 N/A GLN 128.A N SER 125.A OG no hydrogen 3.055 N/A GLN 128.A NE2 SER 135.A OG no hydrogen 2.851 N/A LEU 129.A N SER 125.A O no hydrogen 3.099 N/A LYS 130.A N ASP 126.A O no hydrogen 3.153 N/A SER 131.A N GLN 128.A O no hydrogen 2.940 N/A SER 131.A OG GLN 128.A O no hydrogen 2.511 N/A GLY 132.A N LEU 129.A O no hydrogen 3.026 N/A ALA 134.A N LEU 185.A O no hydrogen 2.942 N/A SER 135.A N GLN 128.A OE1 no hydrogen 2.981 N/A VAL 136.A N LEU 183.A O no hydrogen 2.798 N/A VAL 137.A N PHE 122.A O no hydrogen 3.094 N/A CYS 138.A N SER 181.A O no hydrogen 2.815 N/A CYS 138.A SG PHE 120.A O no hydrogen 3.880 N/A LEU 139.A N PHE 120.A O no hydrogen 2.880 N/A LEU 140.A N LEU 179.A O no hydrogen 2.823 N/A ASN 141.A N SER 118.A O no hydrogen 2.770 N/A ASN 142.A N SER 178.A OG no hydrogen 3.015 N/A PHE 143.A N TYR 177.A O no hydrogen 2.813 N/A TYR 144.A N ALA 115.A O no hydrogen 2.884 N/A LYS 149.A N THR 201.A O no hydrogen 2.977 N/A GLN 151.A N GLU 199.A O no hydrogen 2.874 N/A GLN 151.A NE2.A TRP 152.A O no hydrogen 2.908 N/A GLN 151.A NE2.A GLN 159.A O no hydrogen 3.113 N/A TRP 152.A NE1 SER 181.A OG no hydrogen 2.865 N/A LYS 153.A N ALA 197.A O no hydrogen 2.827 N/A LYS 153.A NZ GLU 199.A OE2 no hydrogen 2.753 N/A VAL 154.A N ALA 157.A O no hydrogen 3.083 N/A ASP 155.A N VAL 195.A O no hydrogen 2.775 N/A ALA 157.A N VAL 154.A O no hydrogen 2.847 N/A GLN 159.A N TRP 152.A O no hydrogen 2.992 N/A GLN 159.A NE2 ALA 157.A O no hydrogen 2.882 N/A ASN 162.A ND2 GLN 159.A OE1 no hydrogen 3.025 N/A GLN 164.A N THR 182.A O no hydrogen 3.046 N/A SER 166.A N SER 180.A O no hydrogen 3.042 N/A THR 168.A N SER 178.A O no hydrogen 2.984 N/A THR 168.A OG1 GLU 169.A O no hydrogen 3.426 N/A THR 168.A OG1 SER 178.A O no hydrogen 3.335 N/A GLN 170.A NE2 ILE 110.A O no hydrogen 2.906 N/A GLN 170.A NE2 SER 175.A O no hydrogen 2.866 N/A ASP 171.A N THR 176.A O no hydrogen 2.821 N/A LYS 173.A N ASP 171.A OD2 no hydrogen 2.940 N/A ASP 174.A N ASP 171.A OD2 no hydrogen 2.886 N/A SER 175.A N ASP 171.A O no hydrogen 3.154 N/A THR 176.A N ASP 174.A OD1 no hydrogen 3.017 N/A THR 176.A OG1 ASP 174.A OD1 no hydrogen 2.665 N/A THR 176.A OG1 ASP 174.A OD2 no hydrogen 3.492 N/A TYR 177.A N PHE 143.A O no hydrogen 2.823 N/A TYR 177.A OH GLU 109.A OE1 no hydrogen 2.450 N/A SER 178.A N THR 168.A OG1 no hydrogen 2.954 N/A SER 178.A OG ASN 141.A OD1 no hydrogen 3.009 N/A LEU 179.A N LEU 140.A O no hydrogen 2.898 N/A SER 180.A N SER 166.A O no hydrogen 3.003 N/A SER 181.A N CYS 138.A O no hydrogen 2.823 N/A THR 182.A N GLN 164.A O no hydrogen 2.841 N/A LEU 183.A N VAL 136.A O no hydrogen 2.717 N/A THR 184.A N ASN 162.A O no hydrogen 2.945 N/A LEU 185.A N ALA 134.A O no hydrogen 2.942 N/A LYS 187.A N GLY 132.A O no hydrogen 2.945 N/A LYS 187.A NZ GLU 191.A OE1 no hydrogen 3.184 N/A LYS 187.A NZ GLU 191.A OE2 no hydrogen 2.883 N/A ASP 189.A N SER 186.A OG no hydrogen 3.175 N/A TYR 190.A N SER 186.A O no hydrogen 2.917 N/A GLU 191.A N LYS 187.A O no hydrogen 2.873 N/A LYS 192.A N ASP 189.A O no hydrogen 3.172 N/A LYS 192.A NZ ALA 188.A O no hydrogen 3.522 N/A HIS 193.A N TYR 190.A O no hydrogen 3.357 N/A HIS 193.A ND1 ASP 189.A O no hydrogen 2.776 N/A LYS 194.A N ASP 155.A OD1 no hydrogen 3.147 N/A LYS 194.A N ASP 155.A OD2 no hydrogen 3.303 N/A VAL 195.A N ASP 155.A OD1 no hydrogen 2.806 N/A TYR 196.A N PHE 213.A O no hydrogen 3.023 N/A TYR 196.A OH TYR 190.A O no hydrogen 2.682 N/A ALA 197.A N LYS 153.A O no hydrogen 2.845 N/A CYS 198.A N LYS 211.A O no hydrogen 2.943 N/A CYS 198.A SG.B LYS 211.A O no hydrogen 3.772 N/A GLU 199.A N GLN 151.A O no hydrogen 2.836 N/A VAL 200.A N VAL 209.A O no hydrogen 2.690 N/A THR 201.A N LYS 149.A O no hydrogen 2.956 N/A HIS 202.A NE2 PRO 145.A O no hydrogen 2.882 N/A GLY 204.A N HIS 202.A ND1 no hydrogen 2.896 N/A LEU 205.A N HIS 202.A O no hydrogen 2.914 N/A VAL 209.A N VAL 200.A O no hydrogen 2.959 N/A LYS 211.A N CYS 198.A O no hydrogen 3.075 N/A PHE 213.A N TYR 196.A O no hydrogen 3.010 N/A ASN 214.A N CYS 218.A O no hydrogen 3.075 N/A ARG 215.A N LYS 194.A O no hydrogen 2.839 N/A ARG 215.A NE HIS 193.A O no hydrogen 2.703 N/A ARG 215.A NH1 HIS 193.A O no hydrogen 3.256 N/A CYS 218.A SG GLU 217.A O no hydrogen 2.832 N/A VAL 29B.A N GLY 72.A O no hydrogen 2.891 N/A ASP 30C.A N SER 28A.A OG no hydrogen 3.188 N/A SER 31D.A N ASN 34.A O no hydrogen 2.972 N/A