Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4xsh_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 2.A N GLN 50.A O no hydrogen 3.453 N/A LYS 4.A N GLU 52.A O no hydrogen 2.892 N/A LYS 4.A NZ ALA 176.A O no hydrogen 2.661 N/A LYS 5.A N ASP 76.A OD2 no hydrogen 2.569 N/A LYS 5.A NZ SER 71.A O no hydrogen 2.959 N/A LYS 5.A NZ PRO 73.A O no hydrogen 2.755 N/A LEU 6.A N ALA 54.A O no hydrogen 2.920 N/A VAL 7.A N VAL 77.A O no hydrogen 3.110 N/A ILE 8.A N TRP 56.A O no hydrogen 2.924 N/A VAL 9.A N LEU 79.A O no hydrogen 2.840 N/A CYS 14.A N ASP 11.A O no hydrogen 3.179 N/A CYS 14.A SG ASP 11.A O no hydrogen 2.969 N/A CYS 14.A SG CYS 81.A O no hydrogen 3.762 N/A LYS 16.A NZ GLY 10.A O no hydrogen 3.076 N/A LYS 16.A NZ ASP 11.A O no hydrogen 3.055 N/A THR 17.A OG1 THR 35.A O no hydrogen 2.867 N/A THR 17.A OG1 ASP 57.A OD2 no hydrogen 2.530 N/A LEU 19.A N GLY 15.A O no hydrogen 3.032 N/A LEU 20.A N LYS 16.A O no hydrogen 2.989 N/A ILE 21.A N THR 17.A O no hydrogen 2.770 N/A VAL 22.A N CYS 18.A O no hydrogen 3.021 N/A ASN 23.A N LEU 19.A O no hydrogen 3.068 N/A SER 24.A N LEU 20.A O no hydrogen 3.330 N/A SER 24.A N ILE 21.A O no hydrogen 2.913 N/A SER 24.A OG ILE 21.A O no hydrogen 3.105 N/A LYS 25.A N ILE 21.A O no hydrogen 2.909 N/A PHE 37.A N ASP 57.A OD2 no hydrogen 2.960 N/A ALA 42.A N LEU 53.A O no hydrogen 2.900 N/A ILE 44.A N VAL 51.A O no hydrogen 2.830 N/A VAL 46.A N LYS 49.A O no hydrogen 3.031 N/A LYS 49.A N VAL 46.A O no hydrogen 3.032 N/A VAL 51.A N ILE 44.A O no hydrogen 2.671 N/A GLU 52.A N ILE 2.A O no hydrogen 2.890 N/A LEU 53.A N ALA 42.A O no hydrogen 2.761 N/A ALA 54.A N LYS 4.A O no hydrogen 2.937 N/A LEU 55.A N TYR 40.A O no hydrogen 3.075 N/A TRP 56.A N LEU 6.A O no hydrogen 2.793 N/A THR 58.A OG1 ILE 8.A O no hydrogen 2.428 N/A TYR 64.A N GLN 61.A O no hydrogen 2.972 N/A ASP 65.A N GLU 62.A O no hydrogen 3.075 N/A LEU 67.A N TYR 64.A O no hydrogen 3.051 N/A ARG 68.A N TYR 64.A O no hydrogen 3.047 N/A ARG 68.A NE ALA 59.A O no hydrogen 2.697 N/A ARG 68.A NH1 ASP 65.A OD1 no hydrogen 2.394 N/A ARG 68.A NH1 GLU 100.A OE2 no hydrogen 2.905 N/A ARG 68.A NH2 ALA 59.A O no hydrogen 2.938 N/A ARG 68.A NH2 ASP 65.A OD1 no hydrogen 2.574 N/A LEU 70.A N LEU 67.A O no hydrogen 3.222 N/A SER 71.A N ARG 68.A O no hydrogen 2.798 N/A TYR 72.A N PRO 69.A O no hydrogen 2.999 N/A TYR 72.A OH GLU 100.A OE2 no hydrogen 2.823 N/A THR 75.A OG1 TYR 72.A O no hydrogen 2.913 N/A ASP 76.A N LYS 5.A O no hydrogen 2.795 N/A VAL 77.A N LYS 5.A O no hydrogen 3.129 N/A ILE 78.A N PRO 109.A O no hydrogen 3.082 N/A LEU 79.A N VAL 7.A O no hydrogen 2.953 N/A MET 80.A N ILE 111.A O no hydrogen 2.832 N/A CYS 81.A N VAL 9.A O no hydrogen 2.687 N/A CYS 81.A SG LEU 79.A O no hydrogen 3.776 N/A PHE 82.A N VAL 113.A O no hydrogen 3.059 N/A SER 83.A N SER 89.A OG no hydrogen 2.787 N/A ILE 84.A N ASN 115.A O no hydrogen 2.837 N/A ASP 85.A N SER 83.A OG no hydrogen 2.952 N/A SER 86.A N SER 83.A O no hydrogen 3.131 N/A SER 89.A N SER 86.A O no hydrogen 3.179 N/A SER 89.A N SER 86.A OG no hydrogen 3.023 N/A SER 89.A OG SER 86.A O no hydrogen 2.673 N/A SER 89.A OG SER 86.A OG no hydrogen 3.391 N/A GLU 91.A N PRO 87.A O no hydrogen 2.930 N/A ASN 92.A N SER 89.A O no hydrogen 3.313 N/A ASN 92.A ND2 ASP 11.A OD2 no hydrogen 2.879 N/A ILE 93.A N LEU 90.A O no hydrogen 2.652 N/A LYS 96.A N ASN 92.A O no hydrogen 3.209 N/A LYS 96.A NZ GLY 60.A O no hydrogen 3.383 N/A LYS 96.A NZ ASP 65.A OD1 no hydrogen 2.783 N/A LYS 96.A NZ ASP 65.A OD2 no hydrogen 3.229 N/A TRP 97.A N ASN 92.A O no hydrogen 3.132 N/A TRP 97.A NE1 ASP 11.A OD1 no hydrogen 2.872 N/A THR 98.A N ILE 93.A O no hydrogen 2.972 N/A THR 98.A OG1 ILE 93.A O no hydrogen 3.066 N/A GLU 100.A N LYS 96.A O no hydrogen 3.348 N/A VAL 101.A N TRP 97.A O no hydrogen 2.983 N/A LYS 102.A N THR 98.A O no hydrogen 2.807 N/A HIS 103.A N PRO 99.A O no hydrogen 3.132 N/A PHE 104.A N GLU 100.A O no hydrogen 2.961 N/A CYS 105.A N VAL 101.A O no hydrogen 2.622 N/A CYS 105.A SG TYR 72.A O no hydrogen 3.789 N/A VAL 108.A N CYS 105.A O no hydrogen 2.989 N/A ILE 111.A N ILE 78.A O no hydrogen 2.899 N/A LEU 112.A N GLY 153.A O no hydrogen 3.460 N/A VAL 113.A N MET 80.A O no hydrogen 2.749 N/A GLY 114.A N MET 155.A O no hydrogen 2.766 N/A ASN 115.A N PHE 82.A O no hydrogen 2.909 N/A ASN 115.A ND2 CYS 14.A O no hydrogen 2.797 N/A LYS 116.A NZ ALA 13.A O no hydrogen 2.942 N/A LYS 117.A N CYS 157.A O no hydrogen 2.914 N/A LYS 117.A NZ ASP 163.A OD2 no hydrogen 2.928 N/A LEU 119.A N LYS 116.A O no hydrogen 2.834 N/A ARG 120.A N LYS 117.A O no hydrogen 3.431 N/A ARG 120.A NE VAL 137.A O no hydrogen 3.119 N/A ARG 120.A NH1 GLU 156.A OE1 no hydrogen 2.426 N/A ARG 120.A NH2 VAL 137.A O no hydrogen 2.849 N/A ARG 120.A NH2 GLU 156.A OE1 no hydrogen 3.004 N/A ARG 120.A NH2 GLU 156.A OE2 no hydrogen 2.955 N/A THR 125.A OG1 ASP 85.A OD1 no hydrogen 3.539 N/A THR 125.A OG1 ASP 122.A OD2 no hydrogen 3.244 N/A ARG 126.A N ASP 122.A O no hydrogen 2.927 N/A ARG 127.A N GLU 123.A O no hydrogen 2.880 N/A ARG 127.A NE GLU 123.A OE2 no hydrogen 3.184 N/A GLU 128.A N HIS 124.A O no hydrogen 2.790 N/A LEU 129.A N THR 125.A O no hydrogen 2.673 N/A ALA 130.A N ARG 126.A O no hydrogen 2.972 N/A LYS 131.A N GLU 128.A O no hydrogen 3.360 N/A MET 132.A N LEU 129.A O no hydrogen 2.655 N/A LYS 133.A N ALA 130.A O no hydrogen 3.163 N/A GLN 134.A N LEU 129.A O no hydrogen 3.451 N/A GLN 134.A NE2 ASP 88.A OD1 no hydrogen 2.986 N/A LYS 138.A N GLU 141.A OE1 no hydrogen 3.221 N/A LYS 138.A NZ GLU 135.A OE2 no hydrogen 2.713 N/A GLU 141.A N LYS 138.A O no hydrogen 2.829 N/A GLY 142.A N LYS 138.A O no hydrogen 3.359 N/A GLY 142.A N PRO 139.A O no hydrogen 2.910 N/A ARG 143.A N PRO 139.A O no hydrogen 2.932 N/A ASP 144.A N GLU 140.A O no hydrogen 2.946 N/A MET 145.A N GLU 141.A O no hydrogen 3.035 N/A ALA 146.A N GLY 142.A O no hydrogen 2.645 N/A ASN 147.A N ARG 143.A O no hydrogen 2.850 N/A ARG 148.A N ASP 144.A O no hydrogen 2.903 N/A ILE 149.A N MET 145.A O no hydrogen 2.906 N/A GLY 150.A N ASN 147.A O no hydrogen 3.282 N/A ALA 151.A N ALA 146.A O no hydrogen 2.734 N/A PHE 152.A N ILE 110.A O no hydrogen 2.662 N/A TYR 154.A OH GLU 156.A OE2 no hydrogen 2.394 N/A MET 155.A N LEU 112.A O no hydrogen 2.931 N/A CYS 157.A N GLY 114.A O no hydrogen 2.893 N/A CYS 157.A SG ASN 115.A OD1 no hydrogen 3.144 N/A SER 158.A N ASP 163.A O no hydrogen 2.690 N/A SER 158.A OG ASP 118.A OD1 no hydrogen 2.731 N/A THR 161.A N SER 158.A OG no hydrogen 3.015 N/A LYS 162.A N ALA 159.A O no hydrogen 2.997 N/A LYS 162.A NZ ASP 26.A OD1 no hydrogen 2.460 N/A ASP 163.A N THR 161.A OG1 no hydrogen 3.234 N/A VAL 165.A N LYS 162.A O no hydrogen 3.309 N/A VAL 168.A N GLY 164.A O no hydrogen 3.136 N/A GLU 170.A N ARG 166.A O no hydrogen 3.112 N/A MET 171.A N GLU 167.A O no hydrogen 2.919 N/A ALA 172.A N VAL 168.A O no hydrogen 2.945 N/A THR 173.A N PHE 169.A O no hydrogen 3.057 N/A THR 173.A OG1 PHE 169.A O no hydrogen 2.736 N/A ARG 174.A N GLU 170.A O no hydrogen 3.062 N/A ARG 174.A NH1 ASP 47.A OD2 no hydrogen 3.141 N/A ALA 175.A N MET 171.A O no hydrogen 2.967 N/A ALA 176.A N THR 173.A O no hydrogen 3.282 N/A LEU 177.A N THR 173.A O no hydrogen 3.217 N/A