Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3a5l_S.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A NE2 ASP 24.A OD1 no hydrogen 2.678 N/A GLU 5.A N HIS 3.A ND1 no hydrogen 3.022 N/A PHE 6.A N HIS 3.A O no hydrogen 2.882 N/A LEU 7.A N HIS 3.A O no hydrogen 3.432 N/A LYS 8.A N PRO 4.A O no hydrogen 3.314 N/A LYS 8.A NZ GLU 5.A OE2 no hydrogen 3.339 N/A ALA 9.A N PHE 6.A O no hydrogen 3.157 N/A GLY 10.A N GLN 16.A OE1 no hydrogen 2.925 N/A GLY 14.A N THR 47.A O no hydrogen 2.865 N/A GLN 16.A N LEU 45.A O no hydrogen 2.818 N/A GLN 16.A NE2 LYS 8.A O no hydrogen 3.022 N/A ILE 17.A N TYR 33.A OH no hydrogen 3.295 N/A TRP 18.A N VAL 43.A O no hydrogen 2.865 N/A TRP 18.A NE1 GLU 5.A OE1 no hydrogen 2.971 N/A ARG 19.A N VAL 26.A O no hydrogen 2.810 N/A ARG 19.A NE GLU 21.A OE1 no hydrogen 2.667 N/A ARG 19.A NH1 ASP 40.A OD1 no hydrogen 2.820 N/A ARG 19.A NH2 GLU 21.A OE1 no hydrogen 2.848 N/A VAL 20.A N ALA 41.A O no hydrogen 2.936 N/A GLU 21.A N ASP 24.A O no hydrogen 3.026 N/A ASP 24.A N GLU 21.A O no hydrogen 3.065 N/A LEU 25.A N ASP 24.A OD1 no hydrogen 2.757 N/A VAL 26.A N ARG 19.A O no hydrogen 2.896 N/A VAL 28.A N ILE 17.A O no hydrogen 2.861 N/A LEU 32.A N PRO 29.A O no hydrogen 2.841 N/A ASP 35.A N LEU 32.A O no hydrogen 3.197 N/A PHE 36.A N LYS 113.A O no hydrogen 2.814 N/A PHE 37.A N TYR 42.A OH no hydrogen 3.251 N/A THR 38.A N LYS 115.A O no hydrogen 2.959 N/A THR 38.A OG1 GLU 66.A OE2 no hydrogen 2.710 N/A GLY 39.A N GLY 117.A O no hydrogen 2.907 N/A ASP 40.A N PHE 37.A O no hydrogen 3.081 N/A TYR 42.A N TRP 62.A O no hydrogen 2.925 N/A VAL 43.A N TRP 18.A O no hydrogen 2.774 N/A ILE 44.A N HIS 60.A O no hydrogen 2.779 N/A LEU 45.A N GLN 16.A O no hydrogen 2.845 N/A LYS 46.A N ASP 58.A O no hydrogen 2.850 N/A THR 47.A N GLY 14.A O no hydrogen 2.938 N/A VAL 48.A N GLN 56.A O no hydrogen 3.019 N/A GLN 49.A NE2 LEU 50.A O no hydrogen 3.630 N/A GLN 49.A NE2 GLY 53.A O no hydrogen 3.097 N/A LEU 50.A N ASN 54.A O no hydrogen 3.018 N/A GLY 53.A N LEU 50.A O no hydrogen 3.168 N/A LEU 55.A N ASN 54.A OD1 no hydrogen 3.132 N/A GLN 56.A N VAL 48.A O no hydrogen 2.736 N/A TYR 57.A OH GLY 10.A O no hydrogen 2.854 N/A ASP 58.A N LYS 46.A O no hydrogen 3.097 N/A LEU 59.A N VAL 91.A O no hydrogen 2.713 N/A HIS 60.A N ILE 44.A O no hydrogen 2.833 N/A HIS 60.A ND1 GLU 95.A OE2 no hydrogen 2.755 N/A HIS 60.A NE2 TYR 107.A OH no hydrogen 2.816 N/A TYR 61.A N HIS 93.A O no hydrogen 2.689 N/A TRP 62.A N TYR 42.A O no hydrogen 2.860 N/A TRP 62.A NE1 GLU 100.A OE2 no hydrogen 2.932 N/A LEU 63.A N GLU 95.A O no hydrogen 2.760 N/A GLY 64.A N ASP 40.A O no hydrogen 2.885 N/A ASN 65.A N GLN 97.A OE1 no hydrogen 2.829 N/A ASN 65.A ND2 GLU 66.A OE1 no hydrogen 2.765 N/A GLU 66.A N THR 38.A O no hydrogen 2.795 N/A CYS 67.A N GLY 64.A O no hydrogen 3.212 N/A CYS 67.A SG GLY 64.A O no hydrogen 3.513 N/A CYS 67.A SG SER 68.A O no hydrogen 3.995 N/A SER 68.A N GLU 71.A OE1 no hydrogen 3.097 N/A SER 68.A OG ASP 70.A OD1 no hydrogen 2.609 N/A SER 68.A OG GLU 71.A OE1 no hydrogen 3.066 N/A GLU 71.A N SER 68.A O no hydrogen 2.903 N/A SER 72.A N SER 68.A O no hydrogen 3.181 N/A SER 72.A OG SER 68.A O no hydrogen 3.554 N/A SER 72.A OG GLN 69.A O no hydrogen 3.290 N/A GLY 73.A N GLN 69.A O no hydrogen 2.958 N/A ALA 74.A N ASP 70.A O no hydrogen 2.957 N/A ALA 75.A N GLU 71.A O no hydrogen 2.980 N/A ALA 76.A N SER 72.A O no hydrogen 3.112 N/A ILE 77.A N GLY 73.A O no hydrogen 3.102 N/A PHE 78.A N ALA 74.A O no hydrogen 2.747 N/A THR 79.A N ALA 75.A O no hydrogen 3.052 N/A THR 79.A OG1 ALA 75.A O no hydrogen 2.678 N/A VAL 80.A N ALA 76.A O no hydrogen 3.177 N/A GLN 81.A N ILE 77.A O no hydrogen 2.947 N/A LEU 82.A N PHE 78.A O no hydrogen 2.809 N/A ASP 83.A N THR 79.A O no hydrogen 2.950 N/A ASP 84.A N VAL 80.A O no hydrogen 2.905 N/A TYR 85.A N GLN 81.A O no hydrogen 2.957 N/A LEU 86.A N LEU 82.A O no hydrogen 3.041 N/A LEU 86.A N ASP 83.A O no hydrogen 3.016 N/A ASN 87.A N ASP 84.A O no hydrogen 3.091 N/A GLY 88.A N ASP 83.A O no hydrogen 2.822 N/A ARG 89.A N LEU 86.A O no hydrogen 3.095 N/A ARG 89.A NH1 ASN 54.A OD1 no hydrogen 2.504 N/A ALA 90.A N ASP 83.A OD1 no hydrogen 3.003 N/A VAL 91.A N TYR 57.A O no hydrogen 3.003 N/A GLN 92.A NE2 ASP 83.A OD2 no hydrogen 2.784 N/A HIS 93.A N LEU 59.A O no hydrogen 2.660 N/A HIS 93.A NE2 ASP 58.A OD1 no hydrogen 2.874 N/A GLU 95.A N TYR 61.A O no hydrogen 2.704 N/A GLN 97.A N LEU 63.A O no hydrogen 3.091 N/A GLY 98.A N TYR 114.A OH no hydrogen 2.917 N/A PHE 99.A N VAL 96.A O no hydrogen 2.861 N/A GLU 100.A N GLU 100.A OE1 no hydrogen 2.511 N/A SER 101.A N GLU 95.A OE1 no hydrogen 2.934 N/A SER 101.A OG GLU 95.A OE2 no hydrogen 2.983 N/A PHE 104.A N SER 101.A OG no hydrogen 3.072 N/A LEU 105.A N SER 101.A O no hydrogen 2.979 N/A GLY 106.A N ALA 102.A O no hydrogen 2.685 N/A TYR 107.A N PHE 104.A O no hydrogen 3.009 N/A TYR 107.A OH HIS 60.A NE2 no hydrogen 2.816 N/A PHE 108.A N LEU 105.A O no hydrogen 3.113 N/A GLY 111.A N PHE 108.A O no hydrogen 3.030 N/A LYS 113.A N GLY 34.A O no hydrogen 2.854 N/A LYS 113.A NZ TYR 114.A O no hydrogen 3.270 N/A TYR 114.A OH GLU 100.A OE2 no hydrogen 2.618 N/A LYS 115.A N PHE 36.A O no hydrogen 2.813 N/A VAL 119.A N ASP 40.A OD1 no hydrogen 3.055 N/A SER 121.A OG ASP 70.A OD1 no hydrogen 2.850 N/A GLY 122.A N ASP 70.A OD2 no hydrogen 2.836 N/A PHE 123.A N SER 121.A OG no hydrogen 3.010 N/A