Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4tkg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A N ASP 1.A O no hydrogen 3.290 N/A SER 6.A N LYS 2.A O no hydrogen 2.930 N/A VAL 7.A N GLU 3.A O no hydrogen 3.121 N/A GLU 8.A N PHE 4.A O no hydrogen 2.855 N/A GLU 9.A N GLN 5.A O no hydrogen 2.870 N/A GLU 10.A N SER 6.A O no hydrogen 3.032 N/A MET 11.A N VAL 7.A O no hydrogen 2.967 N/A GLN 12.A N GLU 8.A O no hydrogen 2.849 N/A GLN 12.A NE2 GLU 8.A OE2 no hydrogen 3.466 N/A GLN 12.A NE2 TYR 31.A O no hydrogen 2.948 N/A SER 13.A N GLU 9.A O no hydrogen 2.851 N/A SER 13.A OG GLU 9.A O no hydrogen 2.694 N/A THR 14.A N GLU 10.A O no hydrogen 3.335 N/A THR 14.A OG1 GLU 10.A O no hydrogen 2.727 N/A THR 14.A OG1 SER 104.A OG no hydrogen 3.414 N/A VAL 15.A N GLN 12.A O no hydrogen 3.478 N/A ARG 16.A N SER 105.A OG no hydrogen 2.968 N/A ARG 16.A NH1 SER 13.A O no hydrogen 3.032 N/A ARG 16.A NH1 VAL 15.A O no hydrogen 2.698 N/A HIS 18.A NE2 SER 105.A OG no hydrogen 2.815 N/A ARG 19.A NH1 GLY 172.A O no hydrogen 3.058 N/A ARG 19.A NH2 GLY 172.A O no hydrogen 3.427 N/A GLY 21.A N HIS 18.A O no hydrogen 3.037 N/A GLY 22.A N ASP 20.A OD1 no hydrogen 3.074 N/A HIS 23.A N ASP 20.A O no hydrogen 3.195 N/A ALA 24.A N ASP 20.A OD2 no hydrogen 2.732 N/A GLY 26.A N GLY 22.A O no hydrogen 2.823 N/A ILE 27.A N SER 127.A OG no hydrogen 3.080 N/A ARG 30.A NE TYR 31.A O no hydrogen 3.024 N/A ARG 30.A NH2 TYR 31.A O no hydrogen 3.047 N/A TYR 31.A N GLN 12.A OE1 no hydrogen 3.068 N/A TYR 31.A OH SER 104.A OG no hydrogen 2.734 N/A ASN 32.A N GLN 195.A O no hydrogen 2.782 N/A LEU 34.A N THR 193.A O no hydrogen 2.797 N/A LYS 35.A N THR 193.A O no hydrogen 3.126 N/A GLN 37.A N LEU 191.A O no hydrogen 2.885 N/A LYS 38.A NZ GLU 3.A OE1 no hydrogen 2.866 N/A VAL 39.A N GLU 189.A O no hydrogen 2.789 N/A ASN 41.A N TYR 187.A OH no hydrogen 3.046 N/A ASN 41.A ND2 ILE 79.A O no hydrogen 2.985 N/A ASN 41.A ND2 HIS 80.A O no hydrogen 3.077 N/A LYS 42.A NZ GLU 46.A OE2 no hydrogen 3.401 N/A LEU 44.A N ASN 41.A OD1 no hydrogen 3.196 N/A TRP 45.A N ASN 41.A O no hydrogen 2.899 N/A GLU 46.A N LYS 42.A O no hydrogen 2.926 N/A ARG 47.A N LYS 43.A O no hydrogen 3.112 N/A ARG 47.A NH1 LYS 81.A O no hydrogen 3.377 N/A TYR 48.A N LEU 44.A O no hydrogen 2.974 N/A TYR 48.A OH GLU 65.A OE1 no hydrogen 2.596 N/A TYR 48.A OH THR 141.A OG1 no hydrogen 2.765 N/A THR 49.A N TRP 45.A O no hydrogen 2.886 N/A THR 49.A OG1 TRP 45.A O no hydrogen 3.155 N/A THR 49.A OG1 GLU 46.A O no hydrogen 3.375 N/A HIS 50.A N GLU 46.A O no hydrogen 2.955 N/A ARG 51.A N ARG 47.A O no hydrogen 3.167 N/A ARG 51.A NE GLN 185.A OE1 no hydrogen 3.031 N/A ARG 51.A NH1 GLU 54.A OE1 no hydrogen 3.050 N/A ARG 51.A NH2 GLN 185.A OE1 no hydrogen 3.088 N/A ARG 52.A N TYR 48.A O no hydrogen 2.804 N/A ARG 52.A NH1 GLU 65.A OE1 no hydrogen 2.823 N/A LYS 53.A N THR 49.A O no hydrogen 3.045 N/A LYS 53.A NZ GLU 57.A OE2 no hydrogen 2.795 N/A GLU 54.A N HIS 50.A O no hydrogen 3.301 N/A VAL 55.A N ARG 51.A O no hydrogen 2.909 N/A SER 56.A N ARG 52.A O no hydrogen 2.853 N/A SER 56.A OG ARG 52.A O no hydrogen 3.025 N/A GLU 57.A N LYS 53.A O no hydrogen 3.026 N/A GLU 58.A N GLU 54.A O no hydrogen 3.222 N/A GLU 58.A N VAL 55.A O no hydrogen 2.956 N/A ASN 59.A N SER 56.A O no hydrogen 2.983 N/A ASN 59.A ND2 HIS 62.A O no hydrogen 2.446 N/A HIS 62.A N ASN 59.A O no hydrogen 2.907 N/A ASN 64.A ND2 GLY 143.A O no hydrogen 2.895 N/A ARG 66.A N VAL 140.A O no hydrogen 2.861 N/A ARG 66.A NH1 GLU 102.A OE1 no hydrogen 3.351 N/A ARG 66.A NH1 TYR 178.A OH no hydrogen 2.752 N/A ARG 66.A NH2 GLU 102.A OE1 no hydrogen 2.877 N/A LEU 68.A N CYS 138.A O no hydrogen 2.789 N/A PHE 69.A N ALA 101.A O no hydrogen 2.843 N/A HIS 70.A N LEU 136.A O no hydrogen 2.951 N/A HIS 70.A ND1 TYR 99.A O no hydrogen 2.722 N/A PHE 74.A N SER 72.A OG no hydrogen 2.835 N/A ASN 76.A ND2 GLN 134.A OE1 no hydrogen 3.451 N/A ILE 78.A N PHE 74.A O no hydrogen 3.049 N/A ILE 79.A N VAL 75.A O no hydrogen 3.045 N/A HIS 80.A ND1 ASN 76.A O no hydrogen 2.645 N/A LYS 81.A N ALA 77.A O no hydrogen 2.808 N/A GLY 82.A N ILE 78.A O no hydrogen 2.653 N/A GLU 85.A N GLU 85.A OE2 no hydrogen 2.856 N/A ARG 86.A N ASP 84.A OD1 no hydrogen 2.975 N/A ARG 86.A NE ASP 84.A OD1 no hydrogen 2.942 N/A ARG 86.A NE ASP 84.A OD2 no hydrogen 3.367 N/A ARG 86.A NH2 ASP 84.A OD2 no hydrogen 3.169 N/A HIS 87.A N ASP 84.A O no hydrogen 3.023 N/A ALA 88.A N GLU 85.A O no hydrogen 3.010 N/A TYR 89.A N GLY 97.A O no hydrogen 3.009 N/A GLY 92.A N TYR 89.A O no hydrogen 3.012 N/A PHE 94.A N TYR 99.A OH no hydrogen 2.900 N/A GLY 95.A N GLY 92.A O no hydrogen 3.049 N/A ALA 96.A N MET 154.A O no hydrogen 2.967 N/A GLY 97.A N GLY 95.A O no hydrogen 2.913 N/A ILE 98.A N ILE 180.A O no hydrogen 2.798 N/A TYR 99.A OH GLY 95.A O no hydrogen 2.703 N/A PHE 100.A N TYR 178.A O no hydrogen 2.839 N/A ALA 101.A N PHE 69.A O no hydrogen 3.013 N/A ASN 103.A ND2 THR 14.A O no hydrogen 3.017 N/A SER 104.A N THR 14.A OG1 no hydrogen 3.012 N/A SER 104.A OG MET 11.A O no hydrogen 2.684 N/A SER 104.A OG THR 14.A OG1 no hydrogen 3.414 N/A SER 104.A OG TYR 31.A OH no hydrogen 2.734 N/A SER 105.A OG HIS 18.A NE2 no hydrogen 2.815 N/A LYS 106.A N ASN 103.A O no hydrogen 3.013 N/A LYS 106.A NZ LEU 175.A O no hydrogen 2.860 N/A LYS 106.A NZ ALA 176.A O no hydrogen 3.072 N/A LYS 106.A NZ GLU 177.A OE1 no hydrogen 2.818 N/A SER 107.A N ASN 103.A O no hydrogen 3.412 N/A ASN 108.A N SER 104.A O no hydrogen 2.878 N/A ASN 108.A ND2 GLY 25.A O no hydrogen 2.982 N/A GLN 109.A N LYS 106.A O no hydrogen 3.116 N/A TYR 110.A N SER 107.A O no hydrogen 3.041 N/A VAL 111.A N ASN 108.A O no hydrogen 3.433 N/A GLY 113.A N TYR 110.A O no hydrogen 3.096 N/A GLY 116.A N GLY 113.A O no hydrogen 2.983 N/A GLY 117.A N ILE 114.A O no hydrogen 3.076 N/A GLY 119.A N GLY 116.A O no hydrogen 3.013 N/A CYS 120.A N ASP 125.A O no hydrogen 3.123 N/A CYS 120.A SG HIS 123.A ND1 no hydrogen 3.689 N/A CYS 120.A SG ASP 125.A O no hydrogen 3.677 N/A LYS 124.A N CYS 120.A O no hydrogen 3.042 N/A LYS 124.A NZ PRO 121.A O no hydrogen 2.917 N/A ARG 126.A NE GLY 117.A O no hydrogen 3.094 N/A ARG 126.A NH2 HIS 23.A O no hydrogen 3.076 N/A SER 127.A N ASP 125.A OD1 no hydrogen 2.930 N/A SER 127.A OG TYR 129.A OH no hydrogen 3.253 N/A CYS 128.A N ASP 125.A O no hydrogen 3.410 N/A CYS 128.A SG HIS 123.A ND1 no hydrogen 3.252 N/A TYR 129.A OH ILE 27.A O no hydrogen 2.652 N/A CYS 131.A SG HIS 123.A ND1 no hydrogen 3.596 N/A ARG 133.A N TYR 194.A O no hydrogen 2.686 N/A ARG 133.A NH1 GLY 25.A O no hydrogen 3.029 N/A ARG 133.A NH1 ASN 108.A OD1 no hydrogen 3.041 N/A ARG 133.A NH2 ARG 126.A O no hydrogen 2.830 N/A ARG 133.A NH2 CYS 128.A O no hydrogen 3.214 N/A GLN 134.A NE2 THR 193.A OG1 no hydrogen 3.095 N/A LEU 135.A N ILE 192.A O no hydrogen 3.048 N/A LEU 136.A N HIS 70.A O no hydrogen 2.959 N/A PHE 137.A N TYR 190.A O no hydrogen 2.826 N/A CYS 138.A N LEU 68.A O no hydrogen 2.695 N/A ARG 139.A N TYR 187.A O no hydrogen 2.943 N/A ARG 139.A NE GLU 189.A OE1 no hydrogen 2.858 N/A ARG 139.A NH1 GLU 65.A OE2 no hydrogen 2.832 N/A ARG 139.A NH2 GLU 189.A OE2 no hydrogen 3.177 N/A VAL 140.A N ARG 66.A O no hydrogen 2.815 N/A THR 141.A N GLN 185.A O no hydrogen 2.804 N/A THR 141.A OG1 TYR 48.A OH no hydrogen 2.765 N/A LEU 142.A N ASN 64.A O no hydrogen 2.984 N/A GLY 143.A N ALA 63.A O no hydrogen 2.786 N/A LYS 144.A N HIS 162.A ND1 no hydrogen 2.843 N/A LYS 144.A NZ ASN 59.A OD1 no hydrogen 3.543 N/A SER 145.A OG SER 163.A OG no hydrogen 2.811 N/A SER 145.A OG THR 165.A OG1 no hydrogen 2.658 N/A PHE 146.A N SER 163.A O no hydrogen 2.802 N/A GLN 148.A N THR 165.A O no hydrogen 2.933 N/A GLN 148.A NE2 SER 150.A O no hydrogen 2.810 N/A MET 152.A N MET 93.A O no hydrogen 3.017 N/A MET 154.A N PHE 94.A O no hydrogen 3.406 N/A HIS 161.A N PRO 158.A O no hydrogen 2.933 N/A HIS 161.A ND1 PRO 159.A O no hydrogen 2.779 N/A HIS 162.A N LYS 144.A O no hydrogen 2.749 N/A HIS 162.A NE2 GLU 58.A OE1 no hydrogen 2.957 N/A SER 163.A OG LEU 142.A O no hydrogen 2.642 N/A SER 163.A OG SER 145.A OG no hydrogen 2.811 N/A VAL 164.A N VAL 179.A O no hydrogen 2.914 N/A THR 165.A N PHE 146.A O no hydrogen 2.832 N/A THR 165.A OG1 SER 145.A OG no hydrogen 2.658 N/A GLY 166.A N GLU 177.A O no hydrogen 2.755 N/A ARG 167.A N GLN 148.A O no hydrogen 3.031 N/A SER 169.A N LEU 173.A O no hydrogen 3.113 N/A GLY 172.A N SER 169.A O no hydrogen 3.225 N/A GLU 177.A N GLY 166.A O no hydrogen 3.055 N/A TYR 178.A N PHE 100.A O no hydrogen 2.910 N/A VAL 179.A N VAL 164.A O no hydrogen 2.792 N/A ILE 180.A N ILE 98.A O no hydrogen 3.058 N/A TYR 181.A OH PHE 94.A O no hydrogen 2.717 N/A ARG 182.A NH2 GLU 184.A OE2 no hydrogen 2.887 N/A GLY 183.A N GLU 85.A OE2 no hydrogen 2.856 N/A GLU 184.A N GLU 184.A OE1 no hydrogen 2.829 N/A GLN 185.A N ARG 182.A O no hydrogen 3.052 N/A GLN 185.A NE2 THR 141.A O no hydrogen 2.912 N/A GLN 185.A NE2 HIS 162.A O no hydrogen 2.875 N/A ALA 186.A N GLY 183.A O no hydrogen 3.453 N/A TYR 187.A N ARG 139.A O no hydrogen 2.783 N/A TYR 187.A OH VAL 39.A O no hydrogen 2.692 N/A TYR 190.A N PHE 137.A O no hydrogen 2.995 N/A TYR 190.A OH GLU 3.A OE1 no hydrogen 2.454 N/A LEU 191.A N GLN 37.A O no hydrogen 2.861 N/A ILE 192.A N LEU 135.A O no hydrogen 2.865 N/A THR 193.A N LYS 35.A O no hydrogen 2.786 N/A TYR 194.A N ARG 133.A O no hydrogen 2.944 N/A TYR 194.A OH ASN 108.A OD1 no hydrogen 2.644 N/A GLN 195.A N ASN 32.A O no hydrogen 2.981 N/A MET 197.A N ARG 30.A O no hydrogen 3.089 N/A