Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5a1n_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A OG1 LEU 2.A O no hydrogen 3.411 N/A LEU 2.A N SER 27.A O no hydrogen 3.256 N/A SER 3.A N HIS 39.A O no hydrogen 3.410 N/A LEU 4.A N SER 29.A O no hydrogen 2.785 N/A THR 5.A N ILE 37.A O no hydrogen 2.797 N/A THR 5.A OG1 HIS 39.A NE2 no hydrogen 3.231 N/A VAL 6.A N GLU 31.A O no hydrogen 3.103 N/A ASN 7.A N ASN 36.A OD1 no hydrogen 2.924 N/A SER 8.A N GLY 33.A O no hydrogen 2.930 N/A SER 8.A OG GLU 32.A OE1 no hydrogen 2.763 N/A SER 8.A OG GLY 33.A O no hydrogen 3.108 N/A ASP 10.A N ASN 7.A O no hydrogen 2.929 N/A ASP 10.A N ASN 7.A OD1 no hydrogen 3.316 N/A LEU 16.A N PRO 12.A O no hydrogen 2.984 N/A LEU 17.A N LEU 13.A O no hydrogen 2.727 N/A ALA 18.A N GLY 14.A O no hydrogen 2.985 N/A VAL 19.A N ALA 15.A O no hydrogen 2.904 N/A GLU 20.A N LEU 16.A O no hydrogen 2.966 N/A HIS 21.A N LEU 17.A O no hydrogen 3.104 N/A HIS 21.A N ALA 18.A O no hydrogen 3.007 N/A HIS 21.A ND1 LEU 17.A O no hydrogen 2.765 N/A VAL 22.A N VAL 19.A O no hydrogen 3.074 N/A LYS 23.A NZ GLU 20.A OE1 no hydrogen 3.387 N/A LYS 23.A NZ GLU 20.A OE2 no hydrogen 2.974 N/A ASP 25.A N VAL 22.A O no hydrogen 2.840 N/A VAL 26.A N VAL 22.A O no hydrogen 3.005 N/A SER 29.A N LEU 2.A O no hydrogen 2.972 N/A SER 29.A OG GLU 31.A OE2 no hydrogen 2.535 N/A GLU 31.A N LEU 4.A O no hydrogen 2.843 N/A GLY 33.A N SER 8.A OG no hydrogen 2.938 N/A ILE 37.A N THR 5.A O no hydrogen 2.894 N/A LEU 38.A N PHE 46.A O no hydrogen 2.818 N/A HIS 39.A N SER 3.A O no hydrogen 2.801 N/A HIS 39.A NE2 THR 5.A OG1 no hydrogen 3.231 N/A VAL 40.A N VAL 44.A O no hydrogen 2.932 N/A SER 41.A N VAL 44.A O no hydrogen 3.291 N/A VAL 44.A N SER 41.A O no hydrogen 3.037 N/A PHE 46.A N LEU 38.A O no hydrogen 3.069 N/A ASN 50.A ND2 LEU 80.A O no hydrogen 3.212 N/A SER 51.A N ASP 48.A OD2 no hydrogen 3.215 N/A SER 51.A OG ASP 48.A OD1 no hydrogen 2.847 N/A SER 51.A OG ASP 48.A OD2 no hydrogen 2.526 N/A ILE 52.A N ASP 48.A O no hydrogen 3.069 N/A LEU 53.A N VAL 49.A O no hydrogen 2.953 N/A ARG 54.A N ASN 50.A O no hydrogen 2.995 N/A ARG 54.A NE TYR 66.A OH no hydrogen 2.785 N/A ARG 54.A NH2 ASP 77.A OD1 no hydrogen 2.907 N/A TYR 55.A N SER 51.A O no hydrogen 2.896 N/A LEU 56.A N ILE 52.A O no hydrogen 3.100 N/A ALA 57.A N LEU 53.A O no hydrogen 2.952 N/A ARG 58.A N ARG 54.A O no hydrogen 2.908 N/A VAL 59.A N TYR 55.A O no hydrogen 2.958 N/A ALA 60.A N LEU 56.A O no hydrogen 3.062 N/A ALA 63.A N ALA 60.A O no hydrogen 3.095 N/A GLY 64.A N THR 61.A O no hydrogen 3.368 N/A TYR 66.A OH ASP 77.A OD1 no hydrogen 2.725 N/A SER 68.A N GLU 72.A OE1 no hydrogen 2.734 N/A SER 68.A OG GLU 72.A OE1 no hydrogen 2.978 N/A GLU 72.A N ASN 69.A OD1 no hydrogen 3.005 N/A HIS 73.A N ASN 69.A O no hydrogen 3.016 N/A THR 74.A N LEU 70.A O no hydrogen 2.987 N/A THR 74.A OG1 LEU 70.A O no hydrogen 2.808 N/A GLU 75.A N MET 71.A O no hydrogen 2.970 N/A ILE 76.A N GLU 72.A O no hydrogen 2.905 N/A ASP 77.A N HIS 73.A O no hydrogen 3.023 N/A HIS 78.A N THR 74.A O no hydrogen 3.037 N/A TRP 79.A N GLU 75.A O no hydrogen 3.104 N/A LEU 80.A N ILE 76.A O no hydrogen 2.927 N/A GLU 81.A N ASP 77.A O no hydrogen 3.159 N/A PHE 82.A N HIS 78.A O no hydrogen 3.023 N/A SER 83.A N TRP 79.A O no hydrogen 2.973 N/A SER 83.A OG LEU 80.A O no hydrogen 3.356 N/A SER 83.A OG SER 121.A OG no hydrogen 2.361 N/A ALA 84.A N LEU 80.A O no hydrogen 3.188 N/A THR 85.A N GLU 81.A O no hydrogen 2.811 N/A THR 85.A OG1 GLU 81.A O no hydrogen 3.027 N/A LYS 86.A N PHE 82.A O no hydrogen 3.014 N/A LYS 86.A NZ GLU 99.A OE1 no hydrogen 2.538 N/A LEU 87.A N PHE 82.A O no hydrogen 3.164 N/A SER 88.A OG SER 83.A O no hydrogen 2.930 N/A SER 89.A N LYS 86.A O no hydrogen 3.468 N/A SER 89.A OG ASP 91.A OD2 no hydrogen 3.520 N/A ASP 91.A N SER 89.A OG no hydrogen 2.910 N/A SER 92.A OG SER 95.A OG no hydrogen 3.096 N/A SER 95.A OG SER 92.A O no hydrogen 2.891 N/A SER 95.A OG SER 92.A OG no hydrogen 3.096 N/A THR 96.A N SER 92.A O no hydrogen 3.191 N/A THR 96.A OG1 SER 92.A O no hydrogen 3.161 N/A ILE 97.A N PHE 93.A O no hydrogen 2.742 N/A ASN 98.A N THR 94.A O no hydrogen 3.067 N/A GLU 99.A N SER 95.A O no hydrogen 2.977 N/A LEU 100.A N THR 96.A O no hydrogen 3.075 N/A ASN 101.A N ILE 97.A O no hydrogen 2.916 N/A HIS 102.A N ASN 98.A O no hydrogen 3.028 N/A SER 103.A N GLU 99.A O no hydrogen 3.130 N/A LEU 104.A N LEU 100.A O no hydrogen 3.026 N/A SER 105.A N HIS 102.A O no hydrogen 3.224 N/A SER 105.A OG HIS 102.A O no hydrogen 2.728 N/A ARG 107.A N LEU 104.A O no hydrogen 2.892 N/A LEU 110.A N ASP 119.A OD1 no hydrogen 2.840 N/A SER 116.A N ASP 119.A OD2 no hydrogen 2.924 N/A LEU 117.A N LEU 65.A O no hydrogen 2.832 N/A ALA 118.A N SER 116.A OG no hydrogen 3.021 N/A LEU 120.A N SER 116.A O no hydrogen 3.177 N/A SER 121.A N LEU 117.A O no hydrogen 2.882 N/A VAL 122.A N ALA 118.A O no hydrogen 2.986 N/A TRP 123.A N ASP 119.A O no hydrogen 2.845 N/A TRP 123.A NE1 PHE 149.A O no hydrogen 3.127 N/A ALA 124.A N LEU 120.A O no hydrogen 3.069 N/A THR 125.A N SER 121.A O no hydrogen 3.046 N/A THR 125.A OG1 SER 121.A O no hydrogen 2.829 N/A LEU 126.A N VAL 122.A O no hydrogen 2.859 N/A LYS 127.A N TRP 123.A O no hydrogen 2.901 N/A GLY 128.A N ALA 124.A O no hydrogen 3.234 N/A GLY 128.A N THR 125.A O no hydrogen 3.130 N/A ASN 129.A N LEU 126.A O no hydrogen 2.953 N/A ASN 129.A ND2 LEU 87.A O no hydrogen 2.868 N/A TRP 132.A N ASN 129.A O no hydrogen 3.134 N/A TRP 132.A N ASN 129.A OD1 no hydrogen 3.169 N/A GLN 133.A N ASN 129.A O no hydrogen 3.229 N/A GLN 133.A NE2 LYS 127.A O no hydrogen 3.018 N/A GLU 134.A N ALA 130.A O no hydrogen 2.954 N/A GLN 135.A N ALA 131.A O no hydrogen 3.031 N/A LEU 136.A N TRP 132.A O no hydrogen 2.922 N/A LYS 137.A N GLN 133.A O no hydrogen 2.961 N/A GLN 138.A N GLU 134.A O no hydrogen 2.873 N/A GLN 138.A NE2 GLU 134.A OE2 no hydrogen 2.785 N/A LYS 139.A N LEU 136.A O no hydrogen 3.043 N/A LYS 140.A N GLN 135.A O no hydrogen 2.731 N/A HIS 144.A N ASN 101.A OD1 no hydrogen 2.917 N/A VAL 145.A N ASN 101.A OD1 no hydrogen 3.374 N/A LYS 146.A N PRO 142.A O no hydrogen 2.996 N/A ARG 147.A N VAL 143.A O no hydrogen 2.953 N/A ARG 147.A NH1 ARG 107.A O no hydrogen 2.771 N/A ARG 147.A NH2 LEU 104.A O no hydrogen 2.920 N/A ARG 147.A NH2 ARG 107.A O no hydrogen 3.312 N/A ARG 147.A NH2 HIS 144.A ND1 no hydrogen 3.554 N/A TRP 148.A N HIS 144.A O no hydrogen 2.881 N/A TRP 148.A NE1 ASP 119.A OD1 no hydrogen 3.024 N/A PHE 149.A N VAL 145.A O no hydrogen 2.731 N/A GLY 150.A N LYS 146.A O no hydrogen 2.903 N/A PHE 151.A N ARG 147.A O no hydrogen 3.120 N/A LEU 152.A N TRP 148.A O no hydrogen 3.212 N/A GLU 153.A N PHE 149.A O no hydrogen 3.018 N/A ALA 154.A N GLY 150.A O no hydrogen 3.144 N/A GLN 155.A N LEU 152.A O no hydrogen 2.917 N/A GLN 155.A NE2 TYR 109.A OH no hydrogen 3.257 N/A GLN 159.A N GLN 155.A O no hydrogen 3.003 N/A GLN 159.A NE2 GLU 153.A O no hydrogen 2.935 N/A SER 160.A N GLN 156.A O no hydrogen 2.815 N/A SER 160.A OG GLU 20.A OE2 no hydrogen 2.887 N/A VAL 161.A N ALA 157.A O no hydrogen 3.080 N/A GLY 162.A N PHE 158.A O no hydrogen 2.960 N/A THR 163.A N GLN 159.A O no hydrogen 2.938 N/A THR 163.A OG1 GLN 159.A O no hydrogen 3.228 N/A LYS 164.A N SER 160.A O no hydrogen 3.083 N/A LYS 164.A NZ GLU 20.A OE1 no hydrogen 2.909 N/A TRP 165.A N VAL 161.A O no hydrogen 2.985 N/A ASP 166.A N GLY 162.A O no hydrogen 2.873 N/A