Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3s1i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 2.A N GLU 5.A OE1 no hydrogen 3.158 N/A GLU 5.A N ASP 2.A OD1 no hydrogen 2.775 N/A LYS 6.A N ASP 2.A O no hydrogen 2.995 N/A LYS 6.A NZ ASP 65.A O no hydrogen 3.429 N/A GLU 7.A N GLN 3.A O no hydrogen 2.979 N/A LEU 8.A N LYS 4.A O no hydrogen 3.017 N/A ILE 9.A N GLU 5.A O no hydrogen 3.046 N/A LYS 10.A N LYS 6.A O no hydrogen 3.088 N/A LYS 10.A NZ ASP 65.A OD2 no hydrogen 2.965 N/A GLU 11.A N GLU 7.A O no hydrogen 2.822 N/A SER 12.A N LEU 8.A O no hydrogen 2.920 N/A SER 12.A OG LEU 8.A O no hydrogen 2.744 N/A SER 12.A OG ILE 9.A O no hydrogen 3.364 N/A TRP 13.A N ILE 9.A O no hydrogen 2.954 N/A LYS 14.A N GLU 11.A O no hydrogen 3.171 N/A ARG 15.A N SER 12.A O no hydrogen 2.990 N/A ARG 15.A NH1 GLY 109.A O no hydrogen 2.918 N/A ILE 16.A N SER 12.A O no hydrogen 2.952 N/A GLU 17.A N TRP 13.A O no hydrogen 2.782 N/A ASN 19.A N ILE 16.A O no hydrogen 2.887 N/A ASN 19.A ND2 ARG 15.A O no hydrogen 2.865 N/A LYS 20.A N GLU 17.A O no hydrogen 3.106 N/A LYS 20.A NZ GLU 17.A OE2 no hydrogen 3.208 N/A GLU 22.A N GLU 22.A OE1 no hydrogen 2.850 N/A ILE 23.A N ASN 19.A O no hydrogen 2.972 N/A GLY 24.A N LYS 20.A O no hydrogen 2.952 N/A LEU 25.A N ASN 21.A O no hydrogen 3.211 N/A LEU 26.A N GLU 22.A O no hydrogen 2.823 N/A PHE 27.A N ILE 23.A O no hydrogen 2.942 N/A TYR 28.A N GLY 24.A O no hydrogen 3.123 N/A ALA 29.A N LEU 25.A O no hydrogen 2.972 N/A ASN 30.A N LEU 26.A O no hydrogen 2.855 N/A ASN 30.A ND2 SER 101.A OG no hydrogen 3.020 N/A ASN 30.A ND2 GLU 104.A OE1 no hydrogen 3.115 N/A LEU 31.A N PHE 27.A O no hydrogen 2.738 N/A PHE 32.A N TYR 28.A O no hydrogen 2.916 N/A LYS 33.A N ALA 29.A O no hydrogen 3.061 N/A GLU 34.A N ASN 30.A O no hydrogen 2.852 N/A GLU 35.A N LEU 31.A O no hydrogen 2.796 N/A VAL 38.A N GLU 35.A O no hydrogen 3.034 N/A SER 39.A OG PRO 36.A O no hydrogen 3.340 N/A LEU 41.A N VAL 38.A O no hydrogen 2.921 N/A PHE 42.A N SER 39.A O no hydrogen 3.150 N/A SER 48.A OG PRO 45.A O no hydrogen 3.023 N/A GLN 49.A N PRO 45.A O no hydrogen 3.032 N/A GLN 49.A NE2.A TYR 28.A OH no hydrogen 2.716 N/A SER 50.A N ILE 46.A O no hydrogen 2.829 N/A ARG 51.A N SER 47.A O no hydrogen 3.307 N/A LYS 52.A N SER 48.A O no hydrogen 2.995 N/A LEU 53.A N GLN 49.A O no hydrogen 2.898 N/A MET 54.A N SER 50.A O no hydrogen 3.044 N/A GLN 55.A N ARG 51.A O no hydrogen 2.958 N/A VAL 56.A N LYS 52.A O no hydrogen 3.161 N/A LEU 57.A N LEU 53.A O no hydrogen 3.028 N/A GLY 58.A N MET 54.A O no hydrogen 3.056 N/A ILE 59.A N GLN 55.A O no hydrogen 3.050 N/A LEU 60.A N VAL 56.A O no hydrogen 2.970 N/A VAL 61.A N LEU 57.A O no hydrogen 3.017 N/A GLN 62.A N GLY 58.A O no hydrogen 2.896 N/A GLY 63.A N ILE 59.A O no hydrogen 2.979 N/A ILE 64.A N VAL 61.A O no hydrogen 3.182 N/A ASN 66.A N GLY 63.A O no hydrogen 2.915 N/A GLY 69.A N ASN 66.A O no hydrogen 3.101 N/A LEU 70.A N LEU 67.A O no hydrogen 2.562 N/A ILE 71.A N GLU 68.A O no hydrogen 3.195 N/A LEU 74.A N LEU 70.A O no hydrogen 2.928 N/A GLN 75.A N ILE 71.A O no hydrogen 2.799 N/A ASP 76.A N PRO 72.A O no hydrogen 2.956 N/A LEU 77.A N THR 73.A O no hydrogen 3.038 N/A GLY 78.A N LEU 74.A O no hydrogen 2.914 N/A ARG 79.A N GLN 75.A O no hydrogen 3.020 N/A ARG 80.A N ASP 76.A O no hydrogen 3.094 N/A HIS 81.A N LEU 77.A O no hydrogen 2.942 N/A HIS 81.A ND1 LEU 77.A O no hydrogen 2.747 N/A LYS 82.A N GLY 78.A O no hydrogen 3.149 N/A GLN 83.A N ARG 79.A O no hydrogen 3.447 N/A TYR 84.A N HIS 81.A O no hydrogen 2.953 N/A GLY 85.A N LYS 82.A O no hydrogen 3.144 N/A VAL 86.A N HIS 81.A O no hydrogen 3.077 N/A VAL 87.A N HIS 90.A ND1 no hydrogen 2.976 N/A HIS 90.A N VAL 87.A O no hydrogen 2.940 N/A TYR 91.A N ASP 88.A O no hydrogen 3.208 N/A VAL 94.A N HIS 90.A O no hydrogen 2.967 N/A GLY 95.A N TYR 91.A O no hydrogen 2.934 N/A ASP 96.A N PRO 92.A O no hydrogen 2.999 N/A CYS 97.A N LEU 93.A O no hydrogen 3.125 N/A CYS 97.A SG PHE 27.A O no hydrogen 3.746 N/A LEU 98.A N VAL 94.A O no hydrogen 2.907 N/A LEU 99.A N GLY 95.A O no hydrogen 2.992 N/A LYS 100.A N ASP 96.A O no hydrogen 2.903 N/A LYS 100.A NZ ASP 96.A OD2 no hydrogen 3.184 N/A SER 101.A N CYS 97.A O no hydrogen 2.898 N/A SER 101.A OG CYS 97.A O no hydrogen 2.736 N/A ILE 102.A N LEU 98.A O no hydrogen 2.936 N/A GLN 103.A N LEU 99.A O no hydrogen 3.035 N/A GLU 104.A N LYS 100.A O no hydrogen 2.856 N/A TYR 105.A N SER 101.A O no hydrogen 2.996 N/A LEU 106.A N ILE 102.A O no hydrogen 2.917 N/A GLY 107.A N GLN 103.A O no hydrogen 2.800 N/A GLY 109.A N LEU 106.A O no hydrogen 2.759 N/A PHE 110.A N GLY 107.A O no hydrogen 3.093 N/A ALA 114.A N THR 111.A OG1 no hydrogen 2.880 N/A LYS 115.A N THR 111.A O no hydrogen 2.973 N/A ALA 116.A N GLU 112.A O no hydrogen 2.949 N/A ALA 117.A N GLU 113.A O no hydrogen 3.144 N/A TRP 118.A N ALA 114.A O no hydrogen 2.904 N/A TRP 118.A NE1 SER 12.A OG no hydrogen 2.773 N/A THR 119.A N LYS 115.A O no hydrogen 2.932 N/A THR 119.A OG1 LYS 115.A O no hydrogen 2.813 N/A LYS 120.A N ALA 116.A O no hydrogen 3.108 N/A LYS 120.A NZ GLU 5.A OE2 no hydrogen 3.127 N/A VAL 121.A N ALA 117.A O no hydrogen 3.029 N/A TYR 122.A N TRP 118.A O no hydrogen 2.801 N/A TYR 122.A OH TYR 91.A O no hydrogen 2.647 N/A GLY 123.A N THR 119.A O no hydrogen 2.951 N/A ILE 124.A N LYS 120.A O no hydrogen 2.982 N/A ALA 125.A N VAL 121.A O no hydrogen 2.998 N/A ALA 126.A N TYR 122.A O no hydrogen 2.855 N/A GLN 127.A N GLY 123.A O no hydrogen 2.980 N/A VAL 128.A N ILE 124.A O no hydrogen 3.059 N/A MET 129.A N ALA 125.A O no hydrogen 3.015 N/A THR 130.A N ALA 126.A O no hydrogen 2.925 N/A THR 130.A OG1 ALA 126.A O no hydrogen 2.892 N/A THR 130.A OG1 GLN 127.A O no hydrogen 3.373 N/A