Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5a2k_H.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N SER 25.A O no hydrogen 2.916 N/A GLN 5.A N VAL 23.A O no hydrogen 3.031 N/A GLU 6.A N GLU 6.A OE1 no hydrogen 2.688 N/A SER 7.A N SER 21.A O no hydrogen 2.876 N/A GLY 9.A N THR 111.A OG1 no hydrogen 2.941 N/A VAL 12.A N THR 114.A O no hydrogen 2.866 N/A GLY 15.A N LEU 88C.A O no hydrogen 2.753 N/A GLY 16.A N GLN 13.A O no hydrogen 3.089 N/A SER 17.A OG MET 85.A O no hydrogen 3.533 N/A SER 17.A OG ASN 86A.A OD1 no hydrogen 2.655 N/A MET 18.A N MET 85.A O no hydrogen 2.891 N/A LEU 20.A N LEU 83.A O no hydrogen 2.776 N/A SER 21.A N SER 7.A O no hydrogen 2.876 N/A CYS 22.A N VAL 81.A O no hydrogen 2.860 N/A VAL 23.A N GLN 5.A O no hydrogen 3.075 N/A ALA 24.A N SER 79.A O no hydrogen 2.817 N/A SER 25.A N GLN 3.A O no hydrogen 2.815 N/A ASN 31.A N THR 28.A O no hydrogen 2.952 N/A TYR 32.A N PHE 29.A O no hydrogen 3.182 N/A MET 34.A N ILE 51.A O no hydrogen 2.967 N/A ASN 35.A N THR 99.A O no hydrogen 2.906 N/A ASN 35.A ND2 THR 99.A O no hydrogen 3.114 N/A TRP 36.A N ALA 49.A O no hydrogen 2.938 N/A VAL 37.A N TYR 97.A O no hydrogen 2.894 N/A ARG 38.A N GLU 46.A O no hydrogen 2.920 N/A ARG 38.A NE GLU 46.A OE1 no hydrogen 2.875 N/A ARG 38.A NH1 ASP 92.A OD1 no hydrogen 2.875 N/A ARG 38.A NH1 TYR 96.A OH no hydrogen 2.901 N/A ARG 38.A NH2 GLU 46.A OE1 no hydrogen 2.994 N/A GLN 39.A N ILE 95.A O no hydrogen 2.766 N/A GLN 39.A NE2 GLU 155.A OE2 no hydrogen 3.054 N/A SER 40.A N GLY 44.A O no hydrogen 3.108 N/A LYS 43.A N SER 40.A OG no hydrogen 2.991 N/A LYS 43.A NZ GLU 91.A O no hydrogen 3.256 N/A LYS 43.A NZ GLU 91.A OE1 no hydrogen 3.399 N/A GLU 46.A N ARG 38.A O no hydrogen 2.789 N/A TRP 47.A NE1 ASN 35.A OD1 no hydrogen 2.972 N/A VAL 48.A N TRP 36.A O no hydrogen 2.886 N/A ALA 49.A N TRP 36.A O no hydrogen 3.350 N/A GLU 50.A N HIS 61.A O no hydrogen 2.952 N/A ILE 51.A N MET 34.A O no hydrogen 2.859 N/A ARG 52.A N ALA 59.A O no hydrogen 2.931 N/A ARG 52.A NH1 GLU 50.A OE2 no hydrogen 2.653 N/A ASN 56.A N LEU 53A.A O no hydrogen 2.915 N/A ASN 57.A N LYS 54B.A O no hydrogen 2.847 N/A TYR 58.A N LEU 53A.A O no hydrogen 2.831 N/A TYR 58.A OH ASP 76.A OD2 no hydrogen 3.228 N/A ALA 59.A N ASN 56.A O no hydrogen 3.185 N/A HIS 61.A N GLU 50.A O no hydrogen 3.165 N/A HIS 61.A ND1 GLU 50.A OE2 no hydrogen 2.712 N/A ALA 63.A N VAL 48.A O no hydrogen 2.908 N/A SER 65.A OG GLU 46.A OE2 no hydrogen 2.953 N/A VAL 66.A N ALA 63.A O no hydrogen 3.039 N/A LYS 67.A N ALA 63.A O no hydrogen 3.084 N/A ARG 69.A N VAL 66.A O no hydrogen 2.945 N/A ARG 69.A NH1 SER 65.A O no hydrogen 3.086 N/A ARG 69.A NH1 ASP 92.A OD1 no hydrogen 3.221 N/A ARG 69.A NH2 ASP 92.A OD1 no hydrogen 3.474 N/A ARG 69.A NH2 ASP 92.A OD2 no hydrogen 2.358 N/A ARG 69.A NH2 ASN 87B.A O no hydrogen 2.978 N/A PHE 70.A N VAL 66.A O no hydrogen 3.058 N/A THR 71.A N GLN 84.A O no hydrogen 2.825 N/A ILE 72.A N TYR 62.A OH no hydrogen 2.883 N/A SER 73.A N TYR 82.A O no hydrogen 3.174 N/A ARG 74.A NE ASP 76.A OD1 no hydrogen 2.793 N/A ARG 74.A NH1 TYR 32.A O no hydrogen 2.785 N/A ARG 74.A NH1 ARG 52.A O no hydrogen 2.950 N/A ARG 74.A NH2 TYR 32.A O no hydrogen 2.933 N/A ARG 74.A NH2 ASP 76.A OD1 no hydrogen 3.340 N/A ASP 75.A N SER 80.A O no hydrogen 2.860 N/A SER 77.A OG ASP 75.A OD1 no hydrogen 2.880 N/A LYS 78.A N ASP 75.A O no hydrogen 2.984 N/A SER 79.A N ASP 76.A O no hydrogen 3.178 N/A SER 80.A N ASP 75.A O no hydrogen 3.191 N/A SER 80.A OG LYS 78.A O no hydrogen 2.835 N/A VAL 81.A N CYS 22.A O no hydrogen 2.879 N/A TYR 82.A N SER 73.A O no hydrogen 2.759 N/A LEU 83.A N LEU 20.A O no hydrogen 2.938 N/A GLN 84.A N THR 71.A O no hydrogen 2.874 N/A GLN 84.A NE2 ASN 86A.A OD1 no hydrogen 3.050 N/A MET 85.A N MET 18.A O no hydrogen 2.826 N/A ARG 89.A N ASP 92.A OD2 no hydrogen 2.791 N/A ASP 92.A N ARG 89.A O no hydrogen 2.860 N/A THR 93.A N ALA 90.A O no hydrogen 2.973 N/A THR 93.A OG1 ALA 90.A O no hydrogen 2.887 N/A GLY 94.A N VAL 113.A O no hydrogen 2.862 N/A ILE 95.A N GLN 39.A O no hydrogen 2.883 N/A TYR 96.A N THR 111.A O no hydrogen 2.818 N/A TYR 96.A OH ASP 92.A O no hydrogen 2.642 N/A TYR 97.A N VAL 37.A O no hydrogen 2.823 N/A TYR 97.A OH GLN 39.A OE1 no hydrogen 2.761 N/A CYS 98.A N GLU 6.A OE2 no hydrogen 2.802 N/A CYS 98.A SG GLU 6.A OE2 no hydrogen 3.410 N/A THR 99.A N ASN 35.A O no hydrogen 2.980 N/A THR 99.A OG1 TYR 106.A O no hydrogen 2.813 N/A GLY 100.A N TYR 106.A O no hydrogen 3.182 N/A GLN 103.A N ASN 151.A OD1 no hydrogen 2.908 N/A PHE 104.A N ASN 151.A OD1 no hydrogen 3.213 N/A ALA 105.A N VAL 101.A O no hydrogen 2.758 N/A TYR 106.A N GLY 100.A O no hydrogen 3.124 N/A TRP 107.A NE1 PHE 104.A O no hydrogen 2.767 N/A GLY 108.A N CYS 98.A O no hydrogen 3.166 N/A GLN 109.A N GLN 109.A OE1 no hydrogen 3.018 N/A GLN 109.A NE2 GLU 6.A O no hydrogen 2.969 N/A GLN 109.A NE2 GLY 110.A O no hydrogen 3.123 N/A GLY 110.A N GLU 6.A OE1 no hydrogen 2.765 N/A THR 111.A N TYR 96.A O no hydrogen 2.894 N/A VAL 113.A N GLY 94.A O no hydrogen 2.840 N/A THR 114.A N GLY 10.A O no hydrogen 2.846 N/A VAL 115.A N THR 93.A OG1 no hydrogen 2.876 N/A SER 116.A N VAL 12.A O no hydrogen 2.947 N/A VAL 118.A N SER 140.A OG no hydrogen 3.045 N/A THR 120.A N ARG 138.A O no hydrogen 2.856 N/A GLN 121.A NE2 TYR 203.A O no hydrogen 2.924 N/A GLU 122.A N GLU 122.A OE1 no hydrogen 2.898 N/A LEU 125.A N LYS 220.A O no hydrogen 3.036 N/A THR 127.A N THR 222.A O no hydrogen 2.845 N/A SER 128.A OG LEU 224A.A O no hydrogen 2.869 N/A GLY 130.A N ALA 195.A O no hydrogen 2.784 N/A GLU 131.A N SER 128.A O no hydrogen 3.166 N/A VAL 133.A N ILE 192.A O no hydrogen 3.070 N/A THR 134.A OG1 THR 191.A OG1 no hydrogen 2.863 N/A LEU 135.A N LEU 190.A O no hydrogen 2.749 N/A THR 136.A N GLU 122.A OE1 no hydrogen 2.853 N/A THR 136.A OG1 GLU 122.A OE1 no hydrogen 3.401 N/A THR 136.A OG1 GLU 122.A OE2 no hydrogen 2.640 N/A ARG 138.A N THR 120.A O no hydrogen 2.860 N/A SER 139.A OG THR 141.A OG1 no hydrogen 2.704 N/A SER 139.A OG TYR 209.A OH no hydrogen 2.782 N/A SER 140.A N VAL 118.A O no hydrogen 2.944 N/A SER 140.A OG VAL 118.A O no hydrogen 3.419 N/A THR 141.A N SER 139.A OG no hydrogen 3.238 N/A THR 141.A OG1 SER 139.A OG no hydrogen 2.704 N/A THR 145.A N ASN 148.A OD1 no hydrogen 3.085 N/A SER 147.A N THR 145.A OG1 no hydrogen 3.103 N/A ASN 148.A N THR 145.A O no hydrogen 2.999 N/A ASN 148.A ND2 TRP 208.A O no hydrogen 2.959 N/A TYR 149.A N THR 146.A O no hydrogen 3.102 N/A ASN 151.A N ALA 206.A O no hydrogen 2.940 N/A ASN 151.A ND2 GLN 103.A OE1 no hydrogen 2.805 N/A ASN 151.A ND2 TYR 149.A O no hydrogen 2.874 N/A TRP 152.A N ILE 165.A O no hydrogen 2.892 N/A VAL 153.A N PHE 204.A O no hydrogen 2.772 N/A GLN 154.A N THR 162.A O no hydrogen 2.789 N/A GLN 154.A NE2 TYR 203.A OH no hydrogen 3.028 N/A GLU 155.A N ILE 202.A O no hydrogen 2.685 N/A LYS 156.A N LEU 160.A O no hydrogen 2.814 N/A LYS 156.A NZ GLU 198.A O no hydrogen 3.052 N/A HIS 159.A ND1 GLN 39.A OE1 no hydrogen 2.854 N/A LEU 160.A N LYS 156.A O no hydrogen 3.024 N/A THR 162.A N GLN 154.A O no hydrogen 2.904 N/A GLY 163.A N ALA 105.A O no hydrogen 3.028 N/A LEU 164.A N TRP 152.A O no hydrogen 2.798 N/A ILE 165.A N TRP 152.A O no hydrogen 3.356 N/A GLY 166.A N ASN 170.A O no hydrogen 2.953 N/A GLY 167.A N GLN 103.A OE1 no hydrogen 3.053 N/A THR 168.A N ALA 150.A O no hydrogen 2.880 N/A ASN 169.A N GLY 167.A O no hydrogen 2.843 N/A ASN 170.A N GLY 166.A O no hydrogen 2.903 N/A ARG 171.A NH1 VAL 175.A O no hydrogen 3.183 N/A ALA 172.A N LEU 164.A O no hydrogen 2.924 N/A VAL 175.A N ALA 172.A O no hydrogen 3.133 N/A ARG 178.A NE ASP 199.A OD1 no hydrogen 3.378 N/A ARG 178.A NE ASP 199.A OD2 no hydrogen 2.814 N/A ARG 178.A NH2 ASP 199.A OD1 no hydrogen 2.834 N/A PHE 179.A N PRO 176.A O no hydrogen 3.127 N/A SER 180.A N THR 191.A O no hydrogen 2.940 N/A SER 182.A N ALA 189.A O no hydrogen 2.882 N/A ILE 184.A N LYS 187.A O no hydrogen 2.913 N/A LYS 187.A N ILE 184.A O no hydrogen 3.059 N/A LYS 187.A NZ THR 136.A OG1 no hydrogen 2.907 N/A ALA 188.A N CYS 137.A O no hydrogen 2.974 N/A ALA 189.A N SER 182.A O no hydrogen 2.856 N/A LEU 190.A N LEU 135.A O no hydrogen 2.841 N/A THR 191.A N SER 180.A O no hydrogen 2.919 N/A THR 191.A OG1 THR 134.A OG1 no hydrogen 2.863 N/A ILE 192.A N VAL 133.A O no hydrogen 2.852 N/A THR 193.A N ARG 178.A O no hydrogen 2.904 N/A GLY 194.A N GLU 131.A O no hydrogen 2.986 N/A ALA 195.A N GLU 131.A O no hydrogen 2.795 N/A GLN 196.A N ASP 199.A OD2 no hydrogen 2.924 N/A GLN 196.A NE2 GLU 198.A OE2 no hydrogen 2.925 N/A THR 197.A OG1.A GLU 198.A OE1 no hydrogen 3.276 N/A GLU 198.A N GLU 198.A OE1 no hydrogen 2.805 N/A ASP 199.A N GLN 196.A O no hydrogen 2.856 N/A GLU 200.A N THR 197.A O no hydrogen 3.225 N/A ALA 201.A N LEU 221.A O no hydrogen 3.219 N/A ILE 202.A N GLU 155.A O no hydrogen 3.055 N/A TYR 203.A N THR 219.A O no hydrogen 2.874 N/A TYR 203.A OH ASP 199.A O no hydrogen 2.605 N/A PHE 204.A N VAL 153.A O no hydrogen 2.762 N/A CYS 205.A N GLN 121.A OE1 no hydrogen 3.091 N/A ALA 206.A N ASN 151.A O no hydrogen 2.975 N/A LEU 207.A N VAL 214.A O no hydrogen 2.989 N/A TRP 208.A N ASN 148.A O no hydrogen 2.847 N/A TYR 209.A N HIS 212.A O no hydrogen 2.855 N/A TYR 209.A OH SER 139.A OG no hydrogen 2.782 N/A ASN 211.A N TYR 209.A O no hydrogen 2.657 N/A VAL 214.A N LEU 207.A O no hydrogen 2.886 N/A GLY 216.A N CYS 205.A O no hydrogen 2.801 N/A GLY 218.A N GLN 121.A OE1 no hydrogen 2.939 N/A THR 219.A N TYR 203.A O no hydrogen 2.901 N/A THR 219.A OG1 GLU 122.A O no hydrogen 2.611 N/A LYS 220.A N SER 123.A O no hydrogen 2.939 N/A LYS 220.A NZ LEU 221.A O no hydrogen 3.123 N/A LEU 221.A N ALA 201.A O no hydrogen 2.955 N/A THR 222.A N LEU 125.A O no hydrogen 2.978 N/A VAL 223.A N GLU 200.A OE1 no hydrogen 2.801 N/A LEU 53A.A N ASN 56.A OD1 no hydrogen 2.947 N/A ASN 86A.A N ARG 69.A O no hydrogen 2.878 N/A GLY 142A.A N SER 139.A O no hydrogen 3.276 N/A LEU 224A.A N THR 127.A O no hydrogen 2.812 N/A LEU 88C.A N GLY 16.A O no hydrogen 2.957 N/A VAL 144C.A N ASP 186.A O no hydrogen 2.971 N/A