Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ioo_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N PRO 54.A O no hydrogen 3.260 N/A ASN 3.A ND2 ASP 47.A OD1 no hydrogen 2.898 N/A ASN 11.A ND2 GLU 8.A OE1 no hydrogen 2.980 N/A LYS 14.A N ASN 11.A O no hydrogen 2.962 N/A LYS 14.A NZ TYR 77.A O no hydrogen 2.859 N/A LYS 14.A NZ GLU 83.A OE2 no hydrogen 2.832 N/A LYS 16.A NZ.A ASN 11.A O no hydrogen 2.740 N/A LYS 16.A NZ.A LYS 14.A O no hydrogen 2.652 N/A LYS 16.A NZ.B ASN 11.A O no hydrogen 3.560 N/A LYS 16.A NZ.B LYS 14.A O no hydrogen 3.210 N/A LYS 16.A NZ.B TYR 77.A O no hydrogen 2.879 N/A ARG 17.A N TYR 78.A O no hydrogen 2.976 N/A ARG 17.A NE TRP 79.A O no hydrogen 2.765 N/A ARG 17.A NH2 TRP 79.A O no hydrogen 3.119 N/A ASN 20.A ND2 THR 125.A O no hydrogen 2.858 N/A GLN 21.A NE2 PRO 124.A O no hydrogen 2.780 N/A LEU 22.A N THR 19.A OG1 no hydrogen 3.081 N/A GLN 23.A N THR 19.A O no hydrogen 2.879 N/A GLN 23.A NE2.A GLN 18.A OE1.B no hydrogen 2.553 N/A TYR 24.A N ASN 20.A O no hydrogen 2.976 N/A TYR 24.A OH LYS 119.A O no hydrogen 2.655 N/A LEU 25.A N GLN 21.A O no hydrogen 2.954 N/A LEU 26.A N LEU 22.A O no hydrogen 3.122 N/A ARG 27.A N GLN 23.A O no hydrogen 2.821 N/A VAL 28.A N TYR 24.A O no hydrogen 2.869 N/A VAL 29.A N TYR 24.A O no hydrogen 3.110 N/A LEU 30.A N LEU 25.A O no hydrogen 2.804 N/A LYS 31.A N LEU 26.A O no hydrogen 3.247 N/A THR 32.A N VAL 28.A O no hydrogen 3.029 N/A THR 32.A OG1 VAL 28.A O no hydrogen 2.694 N/A LEU 33.A N VAL 29.A O no hydrogen 3.173 N/A TRP 34.A N LEU 30.A O no hydrogen 2.817 N/A LYS 35.A N LYS 31.A O no hydrogen 3.304 N/A HIS 36.A N LEU 33.A O no hydrogen 3.232 N/A PHE 38.A N HIS 36.A ND1 no hydrogen 2.866 N/A ALA 39.A N HIS 36.A O no hydrogen 3.016 N/A PHE 42.A N ALA 39.A O no hydrogen 2.796 N/A GLN 43.A N TRP 40.A O no hydrogen 3.382 N/A GLN 43.A NE2 TRP 34.A O no hydrogen 3.057 N/A GLN 44.A NE2 TRP 40.A O no hydrogen 2.898 N/A ALA 48.A N ASN 3.A OD1 no hydrogen 2.794 N/A VAL 49.A N ASP 47.A OD1 no hydrogen 3.034 N/A LYS 50.A N ASP 47.A OD1 no hydrogen 2.982 N/A LEU 51.A N ASP 47.A O no hydrogen 2.951 N/A ASN 52.A N VAL 49.A O no hydrogen 3.076 N/A LEU 53.A N ALA 48.A O no hydrogen 2.912 N/A TYR 56.A N LEU 53.A O no hydrogen 2.973 N/A TYR 57.A OH VAL 46.A O no hydrogen 2.693 N/A LYS 58.A N ASP 55.A O no hydrogen 3.066 N/A ILE 59.A N ASP 55.A O no hydrogen 3.217 N/A ILE 59.A N TYR 56.A O no hydrogen 3.147 N/A ILE 60.A N TYR 56.A O no hydrogen 2.815 N/A LYS 61.A NZ TYR 57.A O no hydrogen 2.788 N/A MET 66.A N PHE 42.A O no hydrogen 2.752 N/A THR 68.A N ASP 65.A OD2 no hydrogen 2.865 N/A THR 68.A OG1 ASP 65.A OD1 no hydrogen 2.636 N/A THR 68.A OG1 ASP 65.A OD2 no hydrogen 3.458 N/A ILE 69.A N ASP 65.A O no hydrogen 3.077 N/A LYS 70.A N MET 66.A O no hydrogen 2.784 N/A LYS 70.A NZ GLU 74.A OE2 no hydrogen 2.705 N/A LYS 71.A N GLY 67.A O no hydrogen 3.014 N/A ARG 72.A N THR 68.A O no hydrogen 2.843 N/A ARG 72.A NE GLU 8.A O no hydrogen 2.866 N/A ARG 72.A NH1 ASP 87.A OD2 no hydrogen 2.846 N/A ARG 72.A NH2 GLU 8.A O no hydrogen 2.809 N/A LEU 73.A N ILE 69.A O no hydrogen 2.842 N/A GLU 74.A N LYS 70.A O no hydrogen 2.881 N/A ASN 75.A N LYS 71.A O no hydrogen 2.860 N/A ASN 76.A N LEU 73.A O no hydrogen 3.138 N/A ASN 76.A ND2 GLN 18.A OE1.A no hydrogen 3.064 N/A TYR 77.A N ARG 72.A O no hydrogen 2.848 N/A TYR 77.A OH GLU 8.A OE1 no hydrogen 2.614 N/A TYR 78.A OH ASP 87.A OD2 no hydrogen 2.624 N/A TRP 79.A N GLU 83.A OE1 no hydrogen 2.639 N/A ASN 80.A N GLU 83.A OE1 no hydrogen 3.058 N/A GLU 83.A N ASN 80.A OD1 no hydrogen 2.943 N/A CYS 84.A SG TYR 78.A OH no hydrogen 3.900 N/A ILE 85.A N ALA 81.A O no hydrogen 2.869 N/A GLN 86.A N GLN 82.A O no hydrogen 2.853 N/A ASP 87.A N GLU 83.A O no hydrogen 3.183 N/A PHE 88.A N CYS 84.A O no hydrogen 3.092 N/A ASN 89.A N ILE 85.A O no hydrogen 2.974 N/A THR 90.A N GLN 86.A O no hydrogen 2.797 N/A THR 90.A OG1 GLN 86.A O no hydrogen 2.956 N/A THR 90.A OG1 GLN 86.A OE1.A no hydrogen 3.077 N/A MET 91.A N ASP 87.A O no hydrogen 2.992 N/A PHE 92.A N PHE 88.A O no hydrogen 3.013 N/A THR 93.A N ASN 89.A O no hydrogen 2.891 N/A THR 93.A OG1.A ASN 89.A O no hydrogen 2.919 N/A THR 93.A OG1.B ASN 89.A O no hydrogen 2.881 N/A THR 93.A OG1.B THR 90.A O no hydrogen 2.901 N/A ASN 94.A N THR 90.A O no hydrogen 2.838 N/A ASN 94.A ND2 THR 62.A O no hydrogen 2.834 N/A CYS 95.A N MET 91.A O no hydrogen 3.304 N/A CYS 95.A SG ILE 105.A O no hydrogen 3.653 N/A TYR 96.A N PHE 92.A O no hydrogen 3.081 N/A TYR 96.A OH GLU 113.A OE1 no hydrogen 2.677 N/A ILE 97.A N THR 93.A O no hydrogen 2.799 N/A TYR 98.A N ASN 94.A O no hydrogen 2.912 N/A TYR 98.A OH ASP 55.A OD1 no hydrogen 2.598 N/A ASN 99.A N CYS 95.A O no hydrogen 3.061 N/A ASN 99.A ND2 CYS 95.A O no hydrogen 2.910 N/A LYS 100.A N ASP 103.A OD2 no hydrogen 2.783 N/A LYS 100.A NZ ASP 103.A OD1 no hydrogen 2.756 N/A ASP 103.A N LYS 100.A O no hydrogen 3.045 N/A LEU 107.A N ASP 103.A O no hydrogen 3.169 N/A MET 108.A N ASP 104.A O no hydrogen 2.936 N/A ALA 109.A N ILE 105.A O no hydrogen 2.903 N/A GLU 110.A N VAL 106.A O no hydrogen 2.875 N/A ALA 111.A N LEU 107.A O no hydrogen 3.038 N/A LEU 112.A N MET 108.A O no hydrogen 3.087 N/A GLU 113.A N ALA 109.A O no hydrogen 2.799 N/A LYS 114.A N GLU 110.A O no hydrogen 2.938 N/A LEU 115.A N ALA 111.A O no hydrogen 3.389 N/A PHE 116.A N LEU 112.A O no hydrogen 2.887 N/A LEU 117.A N GLU 113.A O no hydrogen 2.863 N/A GLN 118.A N LYS 114.A O no hydrogen 3.009 N/A LYS 119.A N LEU 115.A O no hydrogen 2.893 N/A ILE 120.A N PHE 116.A O no hydrogen 2.849 N/A ASN 121.A N LEU 117.A O no hydrogen 3.028 N/A GLU 122.A N LYS 119.A O no hydrogen 3.025 N/A LEU 123.A N ILE 120.A O no hydrogen 3.079 N/A