Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3f5a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 5.A N TYR 169.A O no hydrogen 2.911 N/A SER 5.A OG ASP 73.A OD2 no hydrogen 3.430 N/A ARG 7.A N SER 5.A OG no hydrogen 3.138 N/A ARG 7.A NH1 TYR 157.A OH no hydrogen 2.848 N/A TYR 8.A N ASP 73.A OD2 no hydrogen 2.950 N/A TYR 8.A OH ASP 213.A OD2 no hydrogen 2.553 N/A ILE 9.A N ASP 73.A OD1 no hydrogen 2.847 N/A GLN 10.A NE2 ASP 13.A OD1 no hydrogen 2.859 N/A GLN 10.A NE2 ALA 39.A O no hydrogen 2.848 N/A GLN 11.A N ARG 7.A O no hydrogen 3.133 N/A GLN 11.A NE2 GLY 6.A O no hydrogen 2.864 N/A ASP 13.A N GLN 10.A O no hydrogen 2.948 N/A GLN 14.A N GLN 11.A O no hydrogen 3.076 N/A CYS 16.A N LEU 12.A O no hydrogen 2.887 N/A GLN 17.A N ASP 13.A O no hydrogen 2.929 N/A GLN 17.A NE2 ILE 37.A O no hydrogen 3.110 N/A GLU 18.A N GLN 14.A O no hydrogen 3.119 N/A ILE 19.A N ARG 15.A O no hydrogen 2.916 N/A ALA 20.A N CYS 16.A O no hydrogen 2.842 N/A ALA 21.A N GLN 17.A O no hydrogen 3.079 N/A GLU 22.A N GLU 18.A O no hydrogen 2.914 N/A LEU 23.A N ILE 19.A O no hydrogen 2.917 N/A CYS 24.A N ALA 20.A O no hydrogen 2.900 N/A GLN 25.A N ALA 21.A O no hydrogen 3.134 N/A SER 26.A N GLU 22.A O no hydrogen 3.008 N/A SER 26.A OG GLU 22.A O no hydrogen 3.366 N/A GLY 27.A N CYS 24.A O no hydrogen 2.863 N/A LEU 28.A N LEU 23.A O no hydrogen 2.956 N/A LYS 30.A NZ ASN 90.A OD1 no hydrogen 2.839 N/A CYS 31.A SG LEU 28.A O no hydrogen 4.045 N/A ARG 36.A N PRO 33.A O no hydrogen 3.025 N/A ARG 36.A NE ASP 57.A OD1 no hydrogen 2.840 N/A ARG 36.A NH2 ASP 57.A OD1 no hydrogen 3.474 N/A ARG 36.A NH2 ASP 57.A OD2 no hydrogen 2.784 N/A ILE 37.A N SER 34.A O no hydrogen 3.119 N/A VAL 38.A N PHE 56.A O no hydrogen 3.069 N/A ALA 39.A N ASP 13.A OD1 no hydrogen 2.865 N/A ARG 40.A N ARG 54.A O no hydrogen 2.990 N/A ARG 40.A NH1 ALA 39.A O no hydrogen 2.848 N/A ASN 41.A N ASN 69.A O no hydrogen 2.844 N/A ALA 42.A N GLN 52.A O no hydrogen 2.950 N/A GLY 44.A N GLN 48.A O no hydrogen 2.923 N/A ILE 45.A N GLN 48.A OE1 no hydrogen 2.956 N/A THR 46.A N ARG 86.A O no hydrogen 2.914 N/A THR 46.A OG1 ARG 86.A O no hydrogen 3.278 N/A GLN 48.A N ILE 45.A O no hydrogen 2.875 N/A GLN 52.A N ALA 42.A O no hydrogen 3.032 N/A GLN 52.A NE2 LEU 51.A O no hydrogen 2.927 N/A TRP 53.A N HIS 95.A ND1 no hydrogen 2.942 N/A ARG 54.A N ARG 40.A O no hydrogen 2.961 N/A ARG 54.A NE ALA 42.A O no hydrogen 2.894 N/A ARG 54.A NH1 THR 93.A OG1 no hydrogen 2.837 N/A ARG 54.A NH2 ALA 42.A O no hydrogen 3.029 N/A CYS 55.A N ALA 92.A O no hydrogen 2.779 N/A PHE 56.A N VAL 38.A O no hydrogen 2.851 N/A ASP 57.A N ASN 90.A O no hydrogen 2.934 N/A THR 58.A N ARG 36.A O no hydrogen 2.730 N/A THR 58.A OG1 ARG 36.A O no hydrogen 3.395 N/A ALA 59.A N ASP 57.A OD1 no hydrogen 2.947 N/A SER 60.A N ASP 57.A O no hydrogen 2.938 N/A SER 60.A OG ASP 57.A O no hydrogen 2.802 N/A LEU 61.A N THR 58.A O no hydrogen 3.197 N/A LEU 62.A N GLY 83.A O no hydrogen 2.714 N/A ASN 66.A ND2 VAL 84.A O no hydrogen 2.806 N/A VAL 68.A N GLY 82.A O no hydrogen 3.385 N/A ASN 69.A N ASN 41.A O no hydrogen 2.842 N/A ASN 69.A ND2 ASN 41.A O no hydrogen 2.886 N/A CYS 70.A N ILE 78.A O no hydrogen 2.787 N/A VAL 71.A N GLN 10.A OE1 no hydrogen 2.879 N/A ASP 72.A N HIS 76.A O no hydrogen 2.901 N/A CYS 74.A N ASP 72.A OD1 no hydrogen 2.961 N/A GLY 75.A N ASP 72.A O no hydrogen 2.940 N/A HIS 76.A N ASP 72.A OD1 no hydrogen 2.902 N/A ILE 78.A N CYS 70.A O no hydrogen 2.854 N/A CYS 80.A N VAL 68.A O no hydrogen 2.950 N/A CYS 80.A SG.B VAL 68.A O no hydrogen 3.929 N/A GLY 83.A N LEU 62.A O no hydrogen 2.928 N/A VAL 84.A N ASN 66.A O no hydrogen 2.721 N/A ARG 86.A NE GLY 44.A O no hydrogen 2.621 N/A ARG 86.A NH2 ILE 45.A O no hydrogen 3.009 N/A ARG 86.A NH2 ASN 49.A OD1 no hydrogen 2.854 N/A GLN 87.A N HIS 85.A ND1 no hydrogen 3.309 N/A ASN 88.A N HIS 85.A ND1 no hydrogen 3.133 N/A SER 89.A N HIS 85.A O no hydrogen 2.921 N/A SER 89.A OG HIS 91.A ND1 no hydrogen 2.727 N/A ASN 90.A N SER 60.A OG no hydrogen 2.948 N/A ASN 90.A ND2 LYS 30.A O no hydrogen 3.005 N/A ASN 90.A ND2 ASP 57.A OD2 no hydrogen 2.940 N/A HIS 91.A ND1 SER 89.A OG no hydrogen 2.727 N/A HIS 91.A NE2 GLN 48.A OE1 no hydrogen 2.944 N/A ALA 92.A N CYS 55.A O no hydrogen 2.894 N/A ARG 94.A N TRP 53.A O no hydrogen 2.920 N/A ARG 94.A NH1 THR 93.A O no hydrogen 2.913 N/A LEU 98.A N ARG 94.A O no hydrogen 3.259 N/A SER 99.A N HIS 95.A O no hydrogen 2.903 N/A SER 99.A OG HIS 95.A O no hydrogen 2.645 N/A LYS 100.A N GLU 96.A O no hydrogen 2.958 N/A LYS 100.A NZ GLU 104.A OE2 no hydrogen 2.530 N/A LEU 101.A N ILE 97.A O no hydrogen 2.998 N/A VAL 102.A N LEU 98.A O no hydrogen 3.031 N/A GLU 103.A N SER 99.A O no hydrogen 3.038 N/A GLU 104.A N LYS 100.A O no hydrogen 2.998 N/A GLY 105.A N LEU 101.A O no hydrogen 2.871 N/A VAL 106.A N VAL 102.A O no hydrogen 2.857 N/A ARG 108.A NE GLU 214.A OE2 no hydrogen 2.842 N/A ARG 108.A NH2 GLU 214.A OE1 no hydrogen 3.344 N/A ARG 108.A NH2 GLU 214.A OE2 no hydrogen 3.147 N/A PHE 109.A N GLY 105.A O no hydrogen 2.785 N/A CYS 110.A N VAL 106.A O no hydrogen 2.944 N/A CYS 110.A SG SER 111.A O no hydrogen 3.716 N/A SER 111.A OG ALA 161.A O no hydrogen 3.202 N/A SER 111.A OG SER 162.A O no hydrogen 2.836 N/A TYR 113.A N SER 111.A OG no hydrogen 3.069 N/A GLN 114.A N SER 111.A OG no hydrogen 3.238 N/A GLN 114.A NE2 ASN 118.A OD1 no hydrogen 2.990 N/A GLN 114.A NE2 ALA 130.A O no hydrogen 2.790 N/A ALA 115.A N SER 111.A O no hydrogen 2.785 N/A SER 116.A N PRO 112.A O no hydrogen 3.064 N/A SER 116.A OG ALA 195.A O no hydrogen 2.675 N/A ALA 117.A N TYR 113.A O no hydrogen 3.203 N/A ASN 118.A N GLN 114.A O no hydrogen 2.800 N/A LYS 119.A N ALA 115.A O no hydrogen 2.858 N/A LYS 119.A NZ ASP 123.A OD2 no hydrogen 2.965 N/A TYR 120.A N SER 116.A O no hydrogen 2.961 N/A TYR 120.A OH GLU 188.A OE1 no hydrogen 2.968 N/A CYS 121.A N ALA 117.A O no hydrogen 3.183 N/A CYS 121.A SG ALA 117.A O no hydrogen 3.555 N/A ASN 122.A N ASN 118.A O no hydrogen 2.895 N/A ASP 123.A N LYS 119.A O no hydrogen 2.957 N/A LYS 124.A N TYR 120.A O no hydrogen 3.124 N/A LYS 124.A NZ GLU 188.A OE1 no hydrogen 3.073 N/A LYS 124.A NZ GLU 188.A OE2 no hydrogen 2.992 N/A PHE 125.A N CYS 121.A O no hydrogen 2.699 N/A GLY 127.A N ASN 122.A OD1 no hydrogen 2.743 N/A THR 128.A N PHE 125.A O no hydrogen 3.091 N/A THR 128.A OG1 PHE 125.A O no hydrogen 2.722 N/A ILE 129.A N TYR 147.A O no hydrogen 2.964 N/A ALA 130.A N ASN 118.A OD1 no hydrogen 2.997 N/A ARG 131.A N ARG 145.A O no hydrogen 3.245 N/A ARG 131.A NE GLY 172.A O no hydrogen 2.994 N/A ARG 131.A NH1 ALA 130.A O no hydrogen 2.986 N/A ARG 131.A NH2 ASP 72.A OD2 no hydrogen 2.788 N/A ARG 131.A NH2 PRO 171.A O no hydrogen 2.890 N/A ARG 132.A N GLU 159.A O no hydrogen 2.965 N/A ARG 132.A NH1 GLU 159.A OE1 no hydrogen 2.859 N/A SER 133.A N ALA 143.A O no hydrogen 3.063 N/A LYS 134.A N SER 133.A OG no hydrogen 2.766 N/A LYS 134.A NZ ASN 139.A O no hydrogen 2.843 N/A GLY 137.A N THR 177.A O no hydrogen 2.915 N/A VAL 140.A N ASN 138.A OD1 no hydrogen 2.906 N/A GLU 141.A N ASN 138.A OD1 no hydrogen 2.969 N/A ALA 143.A N SER 133.A O no hydrogen 3.160 N/A TRP 144.A N GLU 189.A OE1 no hydrogen 2.961 N/A ARG 145.A N ARG 131.A O no hydrogen 2.994 N/A ARG 145.A NE SER 133.A O no hydrogen 3.135 N/A ARG 145.A NH1 THR 187.A OG1 no hydrogen 2.867 N/A ARG 145.A NH2 SER 133.A O no hydrogen 3.062 N/A ARG 145.A NH2 GLU 141.A O no hydrogen 3.506 N/A CYS 146.A N TYR 186.A O no hydrogen 2.825 N/A TYR 147.A N ILE 129.A O no hydrogen 2.748 N/A TYR 147.A OH LYS 134.A O no hydrogen 2.703 N/A GLU 148.A N ARG 184.A O no hydrogen 3.006 N/A LYS 149.A NZ GLY 127.A O no hydrogen 2.791 N/A SER 151.A N GLU 148.A O no hydrogen 2.939 N/A SER 151.A OG GLU 148.A O no hydrogen 2.683 N/A SER 151.A OG ARG 184.A O no hydrogen 3.393 N/A LEU 152.A N LYS 149.A O no hydrogen 3.043 N/A LEU 153.A N GLY 173.A O no hydrogen 2.840 N/A TYR 154.A N PRO 79.A O no hydrogen 2.872 N/A TYR 154.A OH VAL 71.A O no hydrogen 2.766 N/A VAL 156.A N LEU 153.A O no hydrogen 3.021 N/A TYR 157.A OH SER 5.A O no hydrogen 2.891 N/A ALA 158.A N CYS 170.A O no hydrogen 2.870 N/A CYS 160.A N TRP 168.A O no hydrogen 2.802 N/A ALA 161.A N GLN 114.A OE1 no hydrogen 2.873 N/A SER 162.A N THR 166.A O no hydrogen 2.859 N/A SER 162.A OG THR 166.A O no hydrogen 3.202 N/A SER 162.A OG THR 166.A OG1 no hydrogen 2.658 N/A ASN 163.A ND2 GLU 214.A O no hydrogen 3.117 N/A ASN 163.A ND2 ASN 215.A OD1 no hydrogen 3.181 N/A CYS 164.A N SER 162.A OG no hydrogen 3.092 N/A GLY 165.A N SER 162.A O no hydrogen 2.970 N/A THR 166.A N SER 162.A OG no hydrogen 2.962 N/A THR 166.A OG1 SER 162.A OG no hydrogen 2.658 N/A TYR 169.A N PRO 3.A O no hydrogen 3.014 N/A CYS 170.A N ALA 158.A O no hydrogen 2.832 N/A GLY 172.A N VAL 156.A O no hydrogen 3.010 N/A GLY 173.A N LEU 153.A O no hydrogen 2.974 N/A ARG 174.A N SER 133.A OG no hydrogen 3.247 N/A ARG 174.A NE SER 151.A O no hydrogen 3.067 N/A ARG 174.A NE SER 151.A OG no hydrogen 3.038 N/A ARG 174.A NH1 ASP 182.A O no hydrogen 2.866 N/A ARG 174.A NH1 HIS 185.A ND1 no hydrogen 3.394 N/A ARG 174.A NH2 SER 151.A OG no hydrogen 3.015 N/A ARG 174.A NH2 HIS 185.A ND1 no hydrogen 3.069 N/A THR 177.A OG1 ASP 182.A OD1 no hydrogen 3.295 N/A THR 177.A OG1 ASP 182.A OD2 no hydrogen 2.697 N/A THR 179.A N ASP 182.A OD2 no hydrogen 2.928 N/A THR 179.A OG1 ASP 182.A OD2 no hydrogen 2.717 N/A ASP 182.A N THR 179.A O no hydrogen 3.023 N/A LYS 183.A N GLU 180.A O no hydrogen 3.067 N/A LYS 183.A NZ GLU 180.A OE1 no hydrogen 3.252 N/A ARG 184.A N LEU 181.A O no hydrogen 3.054 N/A ARG 184.A NE GLU 148.A OE1 no hydrogen 3.091 N/A ARG 184.A NH2 GLU 148.A OE2 no hydrogen 2.804 N/A HIS 185.A N LYS 183.A O no hydrogen 2.913 N/A TYR 186.A N CYS 146.A O no hydrogen 2.858 N/A TYR 186.A OH GLU 148.A OE2 no hydrogen 3.210 N/A GLU 188.A N TRP 144.A O no hydrogen 2.959 N/A ILE 192.A N GLU 188.A O no hydrogen 2.904 N/A ARG 193.A N GLU 189.A O no hydrogen 3.056 N/A ARG 193.A NH1 GLU 189.A OE1 no hydrogen 2.400 N/A GLN 194.A N GLU 190.A O no hydrogen 3.004 N/A ALA 195.A N GLY 191.A O no hydrogen 3.109 N/A ILE 196.A N ILE 192.A O no hydrogen 2.937 N/A GLY 197.A N ARG 193.A O no hydrogen 2.942 N/A SER 198.A OG ALA 195.A O no hydrogen 2.853 N/A VAL 199.A N ILE 196.A O no hydrogen 3.329 N/A SER 201.A OG CYS 203.A O no hydrogen 3.130 N/A CYS 203.A N SER 201.A OG no hydrogen 3.008 N/A CYS 203.A SG LEU 218.A O no hydrogen 4.008 N/A SER 204.A N GLU 207.A OE1 no hydrogen 2.917 N/A VAL 206.A N SER 204.A OG no hydrogen 3.100 N/A GLU 207.A N SER 204.A O no hydrogen 3.235 N/A VAL 208.A N LEU 220.A O no hydrogen 2.807 N/A CYS 209.A SG ASN 163.A O no hydrogen 4.020 N/A LEU 210.A N LEU 218.A O no hydrogen 2.762 N/A LYS 212.A N ASN 163.A OD1 no hydrogen 3.075 N/A ASN 215.A N ARG 108.A O no hydrogen 2.879 N/A ASN 215.A ND2 GLN 107.A O no hydrogen 3.467 N/A ASN 215.A ND2 CYS 110.A O no hydrogen 2.896 N/A LEU 218.A N LEU 210.A O no hydrogen 2.828 N/A LEU 220.A N VAL 208.A O no hydrogen 2.952 N/A GLU 222.A N VAL 206.A O no hydrogen 3.121 N/A