Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5fra_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG GLU 40.A OE2 no hydrogen 2.699 N/A ASN 5.A ND2 LEU 184.A O no hydrogen 3.460 N/A LEU 12.A N ILE 179.A O no hydrogen 2.819 N/A GLY 13.A N ILE 179.A O no hydrogen 3.154 N/A TYR 15.A N MET 177.A O no hydrogen 2.837 N/A TYR 15.A OH ASP 31.A OD2 no hydrogen 2.526 N/A TYR 15.A OH TYR 35.A OH no hydrogen 2.644 N/A ASP 17.A N GLY 175.A O no hydrogen 2.845 N/A ILE 18.A N ILE 174.A O no hydrogen 2.828 N/A LEU 20.A N GLY 172.A O no hydrogen 2.840 N/A GLU 21.A N ASN 19.A OD1 no hydrogen 2.897 N/A SER 23.A N LEU 20.A O no hydrogen 2.966 N/A SER 26.A N ILE 156.A O no hydrogen 2.796 N/A ILE 28.A N ALA 154.A O no hydrogen 2.869 N/A THR 29.A N ASN 27.A OD1 no hydrogen 2.872 N/A THR 29.A OG1 ASN 27.A OD1 no hydrogen 2.634 N/A THR 29.A OG1 ALA 154.A O no hydrogen 3.313 N/A ASP 31.A N ILE 28.A O no hydrogen 2.948 N/A LEU 32.A N THR 29.A O no hydrogen 2.875 N/A LYS 34.A N ASP 31.A O no hydrogen 2.939 N/A LYS 34.A NZ LEU 12.A O no hydrogen 2.854 N/A LYS 34.A NZ ASP 31.A OD1 no hydrogen 3.323 N/A TYR 35.A N LEU 32.A O no hydrogen 3.022 N/A TYR 35.A OH TYR 15.A OH no hydrogen 2.644 N/A LYS 36.A N LEU 32.A O no hydrogen 3.032 N/A LYS 36.A NZ GLU 33.A OE2 no hydrogen 3.114 N/A LEU 38.A N TYR 35.A O no hydrogen 3.022 N/A GLY 41.A N ILE 119.A O no hydrogen 3.141 N/A THR 42.A N TYR 180.A O no hydrogen 3.020 N/A THR 42.A OG1 GLU 182.A O no hydrogen 2.740 N/A ILE 43.A N LEU 117.A O no hydrogen 2.890 N/A VAL 44.A N ASN 178.A O no hydrogen 2.823 N/A VAL 45.A N VAL 115.A O no hydrogen 2.810 N/A ARG 46.A N PHE 176.A O no hydrogen 2.937 N/A ARG 46.A NH2 GLU 195.A OE1 no hydrogen 3.209 N/A PHE 47.A N ASN 113.A O no hydrogen 2.827 N/A ASN 48.A N ASN 173.A O no hydrogen 2.898 N/A SER 49.A OG ASP 51.A O no hydrogen 3.246 N/A SER 49.A OG GLN 55.A OE1 no hydrogen 2.740 N/A SER 49.A OG LYS 171.A O no hydrogen 3.261 N/A LYS 50.A N LYS 171.A O no hydrogen 2.859 N/A LYS 50.A NZ ASN 48.A OD1 no hydrogen 3.240 N/A ASP 51.A N SER 49.A OG no hydrogen 3.074 N/A LYS 53.A N ASP 51.A OD2 no hydrogen 3.372 N/A LYS 53.A NZ ASP 51.A OD2 no hydrogen 2.938 N/A GLN 55.A N VAL 74.A O no hydrogen 2.871 N/A GLN 55.A NE2 ASP 51.A O no hydrogen 3.023 N/A GLN 55.A NE2 LYS 53.A O no hydrogen 2.963 N/A SER 56.A N TYR 168.A O no hydrogen 2.749 N/A SER 56.A OG ASN 71.A OD1 no hydrogen 2.685 N/A SER 56.A OG THR 159.A OG1 no hydrogen 2.733 N/A LEU 57.A N PHE 72.A O no hydrogen 2.762 N/A LEU 58.A N PHE 72.A O no hydrogen 3.355 N/A GLY 59.A N PHE 155.A O no hydrogen 2.939 N/A ILE 60.A N PHE 70.A O no hydrogen 2.941 N/A SER 61.A N SER 153.A O no hydrogen 2.930 N/A SER 61.A OG ASN 160.A O no hydrogen 2.617 N/A ASN 62.A N GLY 68.A O no hydrogen 2.813 N/A ASN 62.A ND2 GLU 149.A O no hydrogen 3.218 N/A SER 63.A N ASP 152.A OD1 no hydrogen 2.846 N/A SER 63.A OG ASP 152.A OD1 no hydrogen 3.148 N/A SER 63.A OG ASP 152.A OD2 no hydrogen 2.824 N/A LYS 64.A N ASN 62.A OD1 no hydrogen 2.974 N/A LYS 64.A NZ ASN 62.A OD1 no hydrogen 2.872 N/A LYS 64.A NZ ASN 150.A O no hydrogen 3.124 N/A LYS 64.A NZ ASP 152.A OD2 no hydrogen 3.546 N/A THR 65.A N ASN 62.A O no hydrogen 2.960 N/A THR 65.A OG1 ASN 62.A O no hydrogen 2.765 N/A LYS 66.A NZ SER 165.A OG no hydrogen 3.175 N/A ASN 67.A N GLN 86.A OE1 no hydrogen 2.752 N/A ASN 67.A ND2 GLN 93.A OE1 no hydrogen 2.947 N/A ASN 67.A ND2 THR 96.A OG1 no hydrogen 2.952 N/A GLY 68.A N THR 65.A OG1 no hydrogen 2.956 N/A TYR 69.A N ARG 84.A O no hydrogen 2.853 N/A TYR 69.A OH GLU 82.A OE1 no hydrogen 3.200 N/A TYR 69.A OH GLU 82.A OE2 no hydrogen 2.707 N/A PHE 70.A N ILE 60.A O no hydrogen 2.706 N/A ASN 71.A N GLU 82.A O no hydrogen 2.924 N/A ASN 71.A ND2 GLU 82.A OE2 no hydrogen 3.127 N/A PHE 72.A N LEU 58.A O no hydrogen 2.945 N/A TYR 73.A N GLY 80.A O no hydrogen 2.797 N/A TYR 73.A OH HIS 101.A NE2 no hydrogen 2.681 N/A VAL 74.A N GLN 55.A O no hydrogen 2.883 N/A THR 75.A N ARG 78.A O no hydrogen 2.844 N/A SER 77.A N THR 75.A OG1 no hydrogen 3.031 N/A SER 77.A OG ASN 76.A OD1 no hydrogen 3.512 N/A ARG 78.A NE ASP 105.A OD1 no hydrogen 2.810 N/A ARG 78.A NH2 ASP 105.A OD1 no hydrogen 3.011 N/A ARG 78.A NH2 ASP 105.A OD2 no hydrogen 3.415 N/A VAL 79.A N LYS 104.A O no hydrogen 3.130 N/A GLY 80.A N TYR 73.A O no hydrogen 3.053 N/A PHE 81.A N MET 102.A O no hydrogen 2.824 N/A GLU 82.A N ASN 71.A O no hydrogen 2.859 N/A LEU 83.A N VAL 100.A O no hydrogen 2.821 N/A ARG 84.A N TYR 69.A O no hydrogen 2.899 N/A ARG 84.A NE ASN 98.A OD1 no hydrogen 2.736 N/A ARG 84.A NH1 TYR 69.A OH no hydrogen 3.013 N/A ARG 84.A NH2 ASN 98.A OD1 no hydrogen 3.137 N/A ASN 85.A N GLU 97.A O no hydrogen 2.905 N/A ASN 85.A ND2 GLU 97.A OE1 no hydrogen 2.807 N/A ASN 85.A ND2 GLU 149.A OE2 no hydrogen 3.413 N/A GLN 86.A NE2 THR 92.A O no hydrogen 2.912 N/A GLN 86.A NE2 ASN 94.A O no hydrogen 2.988 N/A LYS 87.A N GLY 95.A O no hydrogen 3.000 N/A LYS 87.A NZ GLU 97.A OE2 no hydrogen 3.370 N/A GLY 90.A N LYS 64.A O no hydrogen 2.984 N/A ASN 94.A N THR 92.A OG1 no hydrogen 2.903 N/A THR 96.A OG1 GLN 93.A O no hydrogen 2.716 N/A GLU 97.A N ASN 85.A O no hydrogen 2.748 N/A LEU 99.A N LEU 83.A O no hydrogen 2.996 N/A VAL 100.A N LEU 83.A O no hydrogen 3.068 N/A HIS 101.A NE2 TYR 73.A OH no hydrogen 2.681 N/A MET 102.A N PHE 81.A O no hydrogen 3.016 N/A LYS 104.A N VAL 79.A O no hydrogen 2.929 N/A LYS 104.A NZ ILE 134.A O no hydrogen 3.037 N/A VAL 106.A N SER 77.A O no hydrogen 2.887 N/A ASN 109.A N ASN 113.A OD1 no hydrogen 2.814 N/A ASN 109.A ND2 LYS 197.A OXT no hydrogen 3.314 N/A ASN 113.A N PHE 47.A O no hydrogen 2.779 N/A ASN 113.A ND2 ASN 109.A O no hydrogen 3.033 N/A THR 114.A N ASN 130.A OD1 no hydrogen 2.884 N/A THR 114.A OG1 THR 196.A OG1 no hydrogen 2.693 N/A VAL 115.A N VAL 45.A O no hydrogen 2.866 N/A ALA 116.A N PHE 128.A O no hydrogen 2.908 N/A LEU 117.A N ILE 43.A O no hydrogen 2.895 N/A LYS 118.A N LYS 126.A O no hydrogen 2.843 N/A LYS 118.A NZ LEU 184.A O no hydrogen 2.777 N/A LYS 118.A NZ ASP 186.A OD1 no hydrogen 2.638 N/A ILE 119.A N GLY 41.A O no hydrogen 2.819 N/A GLU 120.A N GLY 124.A O no hydrogen 2.943 N/A LYS 121.A N GLU 40.A OE1 no hydrogen 2.795 N/A LYS 121.A NZ ASP 39.A OD2.A no hydrogen 3.362 N/A LYS 121.A NZ ASP 39.A OD2.B no hydrogen 3.328 N/A ASN 122.A N THR 142.A OG1 no hydrogen 2.765 N/A LYS 123.A N GLU 120.A O no hydrogen 2.925 N/A GLY 124.A N GLU 120.A O no hydrogen 3.097 N/A TYR 125.A N VAL 137.A O no hydrogen 2.855 N/A TYR 125.A OH LYS 143.A O no hydrogen 2.770 N/A LYS 126.A N LYS 118.A O no hydrogen 2.914 N/A LYS 126.A NZ ASP 186.A OD1 no hydrogen 3.319 N/A LYS 126.A NZ ASP 186.A OD2 no hydrogen 2.700 N/A LEU 127.A N LYS 135.A O no hydrogen 2.882 N/A PHE 128.A N ALA 116.A O no hydrogen 2.801 N/A LEU 129.A N LYS 132.A O no hydrogen 2.886 N/A ASN 130.A N THR 114.A O no hydrogen 2.912 N/A ASN 130.A ND2 ASN 113.A OD1 no hydrogen 2.898 N/A GLY 131.A N THR 193.A OG1 no hydrogen 3.031 N/A LYS 132.A N LEU 129.A O no hydrogen 3.027 N/A ILE 134.A N LEU 127.A O no hydrogen 2.814 N/A VAL 137.A N TYR 125.A O no hydrogen 2.797 N/A LYS 138.A NZ GLU 136.A OE2 no hydrogen 3.251 N/A ASP 139.A N LYS 123.A O no hydrogen 2.826 N/A ASN 141.A N ASP 139.A OD1 no hydrogen 2.965 N/A THR 142.A N ASN 122.A OD1 no hydrogen 3.125 N/A LYS 143.A N TYR 125.A OH no hydrogen 2.849 N/A PHE 144.A N ASN 147.A OD1 no hydrogen 2.888 N/A ASN 146.A N LEU 38.A O no hydrogen 3.047 N/A ASN 146.A ND2.A ASP 39.A OD1.A no hydrogen 2.961 N/A ASN 147.A N PHE 144.A O no hydrogen 2.953 N/A ILE 148.A N LEU 145.A O no hydrogen 3.040 N/A GLU 149.A N ASN 85.A OD1 no hydrogen 2.925 N/A ASP 152.A N SER 61.A O no hydrogen 2.867 N/A SER 153.A N SER 61.A O no hydrogen 2.998 N/A SER 153.A OG ASP 152.A OD1 no hydrogen 2.680 N/A ALA 154.A N THR 29.A OG1 no hydrogen 3.040 N/A PHE 155.A N GLY 59.A O no hydrogen 2.886 N/A ILE 156.A N SER 26.A O no hydrogen 2.844 N/A GLY 157.A N LEU 57.A O no hydrogen 2.973 N/A LYS 158.A NZ GLU 167.A OE1 no hydrogen 3.086 N/A THR 159.A N GLU 167.A O no hydrogen 2.832 N/A THR 159.A OG1 SER 56.A OG no hydrogen 2.733 N/A ASN 160.A ND2 SER 153.A OG no hydrogen 3.050 N/A ARG 161.A N GLU 167.A OE2 no hydrogen 3.023 N/A ARG 161.A NE LYS 66.A O no hydrogen 2.665 N/A ARG 161.A NH1 ASN 166.A O no hydrogen 2.852 N/A ARG 161.A NH2 LYS 66.A O no hydrogen 2.861 N/A ARG 161.A NH2 ASN 67.A OD1 no hydrogen 3.057 N/A TYR 162.A N THR 65.A O no hydrogen 2.863 N/A SER 165.A N TYR 162.A O no hydrogen 3.318 N/A SER 165.A OG TYR 162.A O no hydrogen 2.719 N/A TYR 168.A N ASN 166.A OD1 no hydrogen 2.936 N/A TYR 168.A OH TYR 69.A OH no hydrogen 2.804 N/A PHE 170.A N GLY 157.A O no hydrogen 2.787 N/A LYS 171.A N GLN 55.A OE1 no hydrogen 2.960 N/A GLY 172.A N LEU 20.A O no hydrogen 3.014 N/A ASN 173.A N ASN 48.A O no hydrogen 2.985 N/A ILE 174.A N ILE 18.A O no hydrogen 2.898 N/A PHE 176.A N ARG 46.A O no hydrogen 3.471 N/A MET 177.A N TYR 15.A O no hydrogen 2.850 N/A ASN 178.A N VAL 44.A O no hydrogen 2.902 N/A ILE 179.A N GLY 13.A O no hydrogen 2.906 N/A TYR 180.A N THR 42.A O no hydrogen 2.766 N/A LEU 184.A N THR 42.A OG1 no hydrogen 2.963 N/A GLY 185.A N TRP 6.A O no hydrogen 3.025 N/A TYR 188.A N GLU 7.A OE1 no hydrogen 3.218 N/A LEU 189.A N GLY 185.A O no hydrogen 3.085 N/A LEU 190.A N ASP 186.A O no hydrogen 2.755 N/A SER 191.A N ASP 187.A O no hydrogen 3.006 N/A SER 191.A OG ASP 187.A O no hydrogen 2.967 N/A LYS 192.A N TYR 188.A O no hydrogen 2.736 N/A THR 193.A N LEU 189.A O no hydrogen 2.949 N/A THR 193.A OG1 LEU 189.A O no hydrogen 2.675 N/A THR 193.A OG1 LEU 190.A O no hydrogen 3.553 N/A GLY 194.A N LEU 190.A O no hydrogen 2.850 N/A GLU 195.A N LYS 192.A O no hydrogen 3.276 N/A THR 196.A N THR 193.A O no hydrogen 3.310 N/A THR 196.A OG1 THR 114.A OG1 no hydrogen 2.693 N/A THR 196.A OG1 ASN 130.A OD1 no hydrogen 2.717 N/A THR 196.A OG1 THR 193.A O no hydrogen 3.435 N/A LYS 197.A N GLY 194.A O no hydrogen 3.187 N/A