Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3apu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 5.A SG CYS 147.A O no hydrogen 3.824 N/A ALA 6.A N PRO 3.A O no hydrogen 2.993 N/A LEU 8.A N CYS 5.A O no hydrogen 2.921 N/A VAL 9.A N ALA 6.A O no hydrogen 3.401 N/A ILE 13.A N ARG 83.A O no hydrogen 2.827 N/A THR 14.A N THR 17.A OG1 no hydrogen 2.780 N/A THR 14.A OG1 THR 17.A OG1 no hydrogen 3.049 N/A THR 17.A N THR 14.A OG1 no hydrogen 3.023 N/A THR 17.A OG1 THR 14.A OG1 no hydrogen 3.049 N/A LEU 18.A N THR 14.A O no hydrogen 3.051 N/A ASP 19.A N ASN 15.A O no hydrogen 2.908 N/A ARG 20.A N ALA 16.A O no hydrogen 2.888 N/A ILE 21.A N THR 17.A O no hydrogen 3.155 N/A ILE 21.A N LEU 18.A O no hydrogen 3.269 N/A THR 22.A N ASP 19.A O no hydrogen 3.206 N/A THR 22.A OG1 LEU 18.A O no hydrogen 2.707 N/A THR 22.A OG1 ASP 19.A O no hydrogen 3.350 N/A GLY 23.A N PHE 51.A O no hydrogen 3.004 N/A LYS 24.A NZ GLU 169.A OE2 no hydrogen 2.957 N/A TRP 25.A N PHE 49.A O no hydrogen 2.827 N/A TRP 25.A NE1 ILE 21.A O no hydrogen 2.767 N/A PHE 26.A N ALA 128.A O no hydrogen 2.840 N/A TYR 27.A N THR 47.A O no hydrogen 2.884 N/A TYR 27.A OH SER 30.A OG no hydrogen 2.803 N/A ILE 28.A N PHE 126.A O no hydrogen 2.761 N/A ALA 29.A N PHE 126.A O no hydrogen 3.325 N/A SER 30.A N MET 156.A O no hydrogen 2.937 N/A SER 30.A OG TYR 27.A OH no hydrogen 2.803 N/A ALA 31.A N LEU 124.A O no hydrogen 3.009 N/A PHE 32.A N ASN 38.A OD1 no hydrogen 3.255 N/A ARG 33.A N TRP 122.A O no hydrogen 2.777 N/A ARG 33.A NH1 GLU 119.A O no hydrogen 2.759 N/A ARG 33.A NH2 ARG 149.A O no hydrogen 2.908 N/A ASN 34.A N ASN 121.A O no hydrogen 3.113 N/A ASN 34.A ND2 ASN 121.A OD1 no hydrogen 2.793 N/A TYR 37.A N ASN 34.A OD1 no hydrogen 2.899 N/A TYR 37.A OH HIS 97.A ND1 no hydrogen 3.036 N/A ASN 38.A N ASN 34.A O no hydrogen 3.116 N/A ASN 38.A ND2 PHE 32.A O no hydrogen 2.793 N/A ASN 38.A ND2 GLU 35.A OE2 no hydrogen 3.201 N/A LYS 39.A N GLU 35.A O no hydrogen 2.832 N/A SER 40.A N GLU 36.A O no hydrogen 2.983 N/A SER 40.A OG TYR 37.A O no hydrogen 3.128 N/A VAL 41.A N TYR 37.A O no hydrogen 2.958 N/A GLN 42.A N ASN 38.A O no hydrogen 2.884 N/A ILE 44.A N VAL 41.A O no hydrogen 3.084 N/A GLN 45.A N THR 67.A O no hydrogen 2.902 N/A ALA 46.A N THR 67.A O no hydrogen 3.476 N/A THR 47.A OG1 ALA 46.A O no hydrogen 2.644 N/A PHE 48.A N TYR 65.A O no hydrogen 3.085 N/A PHE 49.A N TRP 25.A O no hydrogen 2.926 N/A TYR 50.A N ARG 63.A O no hydrogen 2.793 N/A TYR 50.A OH GLU 169.A OE2 no hydrogen 2.593 N/A PHE 51.A N GLY 23.A O no hydrogen 2.730 N/A THR 52.A N PHE 61.A O no hydrogen 2.923 N/A ASN 54.A N THR 59.A O no hydrogen 2.806 N/A LYS 55.A NZ ASP 19.A OD2 no hydrogen 3.157 N/A THR 56.A OG1 ASN 54.A OD1 no hydrogen 3.155 N/A GLU 57.A N ASN 54.A O no hydrogen 3.014 N/A THR 59.A N ASN 54.A O no hydrogen 3.359 N/A ILE 60.A N LEU 79.A O no hydrogen 2.773 N/A PHE 61.A N THR 52.A O no hydrogen 2.851 N/A LEU 62.A N SER 77.A O no hydrogen 2.775 N/A ARG 63.A N TYR 50.A O no hydrogen 3.161 N/A ARG 63.A NH1 THR 52.A OG1 no hydrogen 3.401 N/A GLU 64.A N ASN 75.A O no hydrogen 2.865 N/A TYR 65.A N PHE 48.A O no hydrogen 2.745 N/A TYR 65.A OH HIS 172.A ND1 no hydrogen 2.709 N/A GLN 66.A N PHE 73.A O no hydrogen 2.965 N/A GLN 66.A NE2 THR 47.A OG1 no hydrogen 3.321 N/A THR 67.A N ALA 46.A O no hydrogen 2.761 N/A ARG 68.A N GLN 71.A O no hydrogen 3.066 N/A ARG 68.A NH1 GLN 66.A OE1 no hydrogen 2.437 N/A ASN 70.A N GLN 45.A OE1 no hydrogen 2.720 N/A GLN 71.A N ARG 68.A O no hydrogen 2.870 N/A PHE 73.A N GLN 66.A O no hydrogen 2.779 N/A ASN 75.A N GLU 64.A O no hydrogen 3.121 N/A SER 77.A N LEU 62.A O no hydrogen 3.058 N/A LEU 79.A N ILE 60.A O no hydrogen 2.759 N/A ASN 80.A N SER 89.A O no hydrogen 2.856 N/A VAL 81.A N ASP 58.A O no hydrogen 2.875 N/A GLN 82.A N THR 87.A O no hydrogen 2.863 N/A GLN 82.A NE2 SER 89.A OG no hydrogen 3.158 N/A ARG 83.A NE ASP 58.A OD1 no hydrogen 2.663 N/A ARG 83.A NH1 ASN 15.A OD1 no hydrogen 2.892 N/A ARG 83.A NH2 ASN 15.A OD1 no hydrogen 3.039 N/A ARG 83.A NH2 LYS 55.A O no hydrogen 3.100 N/A ARG 83.A NH2 ASP 58.A OD1 no hydrogen 3.031 N/A GLU 84.A N GLU 84.A OE2 no hydrogen 2.650 N/A GLY 86.A N ARG 83.A O no hydrogen 3.153 N/A THR 87.A N GLN 82.A O no hydrogen 3.122 N/A THR 87.A OG1 GLN 82.A OE1 no hydrogen 2.645 N/A VAL 88.A N ALA 99.A O no hydrogen 2.933 N/A SER 89.A N ASN 80.A O no hydrogen 2.833 N/A SER 89.A OG GLU 96.A OE2 no hydrogen 3.277 N/A ARG 90.A N HIS 97.A O no hydrogen 2.906 N/A ARG 90.A NH1 GLU 64.A OE1 no hydrogen 2.873 N/A ARG 90.A NH2 GLU 64.A OE1 no hydrogen 3.444 N/A ARG 90.A NH2 GLU 64.A OE2 no hydrogen 3.164 N/A GLU 92.A N ARG 95.A O no hydrogen 2.986 N/A HIS 97.A N ARG 90.A O no hydrogen 2.722 N/A HIS 97.A ND1 TYR 37.A OH no hydrogen 3.036 N/A ALA 99.A N VAL 88.A O no hydrogen 2.890 N/A HIS 100.A N GLY 113.A O no hydrogen 2.781 N/A LEU 101.A N GLY 86.A O no hydrogen 3.059 N/A LEU 102.A N MET 111.A O no hydrogen 2.875 N/A ASP 106.A N GLU 140.A OE1 no hydrogen 2.883 N/A LYS 108.A N ASP 106.A OD1 no hydrogen 2.647 N/A LYS 108.A NZ ASP 129.A OD2 no hydrogen 2.523 N/A THR 109.A OG1 ASP 106.A O no hydrogen 3.004 N/A LEU 110.A N TYR 127.A O no hydrogen 3.081 N/A MET 111.A N LEU 102.A O no hydrogen 2.883 N/A PHE 112.A N SER 125.A O no hydrogen 2.987 N/A GLY 113.A N HIS 100.A O no hydrogen 2.903 N/A SER 114.A N GLY 123.A O no hydrogen 2.974 N/A ASP 118.A N TYR 115.A O no hydrogen 2.848 N/A LYS 120.A N ASP 118.A OD2 no hydrogen 2.787 N/A ASN 121.A N ASP 118.A O no hydrogen 2.809 N/A ASN 121.A ND2 ASP 118.A OD1 no hydrogen 2.710 N/A TRP 122.A N ASP 118.A O no hydrogen 2.862 N/A TRP 122.A NE1 LEU 148.A O no hydrogen 2.923 N/A GLY 123.A N SER 114.A O no hydrogen 3.095 N/A LEU 124.A N ALA 31.A O no hydrogen 2.892 N/A SER 125.A N PHE 112.A O no hydrogen 2.846 N/A SER 125.A OG TYR 127.A OH no hydrogen 2.827 N/A PHE 126.A N ALA 29.A O no hydrogen 2.735 N/A TYR 127.A N LEU 110.A O no hydrogen 2.924 N/A TYR 127.A OH SER 125.A OG no hydrogen 2.827 N/A ALA 128.A N PHE 26.A O no hydrogen 2.973 N/A ASP 129.A N LYS 108.A O no hydrogen 2.974 N/A THR 134.A N GLN 137.A OE1 no hydrogen 3.082 N/A THR 134.A OG1 GLU 136.A OE1 no hydrogen 3.559 N/A LYS 135.A NZ GLU 136.A OE2 no hydrogen 2.757 N/A GLU 136.A N GLU 136.A OE1 no hydrogen 2.812 N/A GLN 137.A N THR 134.A OG1 no hydrogen 3.131 N/A GLN 137.A NE2 ASP 106.A OD2 no hydrogen 3.144 N/A LEU 138.A N THR 134.A O no hydrogen 3.116 N/A GLY 139.A N LYS 135.A O no hydrogen 3.010 N/A GLU 140.A N GLU 136.A O no hydrogen 3.193 N/A PHE 141.A N GLN 137.A O no hydrogen 3.255 N/A TYR 142.A N LEU 138.A O no hydrogen 2.962 N/A TYR 142.A OH TYR 157.A OH no hydrogen 2.574 N/A GLU 143.A N GLY 139.A O no hydrogen 2.936 N/A ALA 144.A N GLU 140.A O no hydrogen 3.078 N/A LEU 145.A N PHE 141.A O no hydrogen 2.894 N/A ASP 146.A N TYR 142.A O no hydrogen 2.608 N/A CYS 147.A N GLU 143.A O no hydrogen 2.994 N/A LEU 148.A N ALA 144.A O no hydrogen 3.362 N/A LEU 148.A N LEU 145.A O no hydrogen 2.867 N/A ARG 149.A N ASP 146.A O no hydrogen 2.933 N/A ILE 150.A N LEU 145.A O no hydrogen 3.127 N/A ARG 152.A NE ASP 146.A OD2 no hydrogen 3.390 N/A ARG 152.A NH2 ASP 146.A OD1 no hydrogen 2.951 N/A ASP 154.A N PRO 151.A O no hydrogen 3.008 N/A VAL 155.A N ARG 152.A O no hydrogen 3.299 N/A MET 156.A N SER 30.A O no hydrogen 2.695 N/A TYR 157.A OH TYR 142.A OH no hydrogen 2.574 N/A THR 158.A N ILE 28.A O no hydrogen 3.097 N/A THR 158.A OG1 TYR 27.A O no hydrogen 2.816 N/A THR 158.A OG1 ILE 28.A O no hydrogen 3.179 N/A ASP 159.A N GLN 45.A O no hydrogen 2.950 N/A LYS 161.A N ASP 159.A OD2 no hydrogen 3.265 N/A LYS 162.A N ASP 159.A O no hydrogen 2.857 N/A ASP 163.A N TRP 160.A O no hydrogen 3.168 N/A LYS 164.A N THR 67.A OG1 no hydrogen 2.858 N/A LYS 164.A NZ ASN 70.A O no hydrogen 3.365 N/A CYS 165.A N ASP 163.A OD1 no hydrogen 3.308 N/A CYS 165.A N ASP 163.A OD2 no hydrogen 3.219 N/A CYS 165.A SG THR 67.A OG1 no hydrogen 3.700 N/A GLU 166.A N ASP 163.A OD2 no hydrogen 2.881 N/A GLU 169.A N CYS 165.A O no hydrogen 3.035 N/A LYS 170.A N GLU 166.A O no hydrogen 3.120 N/A LYS 170.A NZ GLU 173.A OE1 no hydrogen 3.378 N/A LYS 170.A NZ GLU 173.A OE2 no hydrogen 3.385 N/A GLN 171.A N PRO 167.A O no hydrogen 3.016 N/A GLN 171.A NE2 GLN 171.A O no hydrogen 2.725 N/A HIS 172.A N LEU 168.A O no hydrogen 2.932 N/A HIS 172.A N GLU 169.A O no hydrogen 3.275 N/A HIS 172.A ND1 TYR 65.A OH no hydrogen 2.709 N/A GLU 173.A N GLU 169.A O no hydrogen 2.945 N/A LYS 174.A N LYS 170.A O no hydrogen 3.244 N/A