Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3s6a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 5.A N LYS 1.A O no hydrogen 3.168 N/A GLN 6.A N SER 2.A O no hydrogen 3.137 N/A SER 7.A N ILE 3.A O no hydrogen 3.036 N/A SER 7.A OG LEU 38.A O no hydrogen 2.966 N/A SER 7.A OG TYR 172.A OH no hydrogen 2.806 N/A LEU 8.A N ASP 4.A O no hydrogen 2.736 N/A HIS 9.A N GLU 5.A O no hydrogen 3.183 N/A ASN 10.A N GLN 6.A O no hydrogen 2.988 N/A ALA 11.A N SER 7.A O no hydrogen 2.920 N/A ARG 12.A N LEU 8.A O no hydrogen 2.958 N/A ARG 13.A N HIS 9.A O no hydrogen 2.862 N/A LEU 14.A N ASN 10.A O no hydrogen 2.951 N/A PHE 15.A N ARG 12.A O no hydrogen 3.247 N/A GLU 16.A N ARG 12.A O no hydrogen 2.988 N/A SER 17.A N ARG 13.A O no hydrogen 2.966 N/A SER 17.A OG ARG 13.A O no hydrogen 2.729 N/A SER 17.A OG LEU 14.A O no hydrogen 3.429 N/A GLY 18.A N PHE 15.A O no hydrogen 3.023 N/A ASP 19.A N SER 17.A OG no hydrogen 2.950 N/A ILE 20.A N LEU 14.A O no hydrogen 2.835 N/A ASP 21.A N GLY 18.A O no hydrogen 3.012 N/A ARG 22.A N ASP 19.A O no hydrogen 2.911 N/A ARG 22.A NH1 ASP 19.A OD1 no hydrogen 2.682 N/A ILE 23.A N ILE 20.A O no hydrogen 3.286 N/A GLU 24.A N GLN 33.A OE1 no hydrogen 3.002 N/A THR 27.A OG1 GLU 24.A OE1 no hydrogen 2.840 N/A THR 28.A N GLU 75.A OE1 no hydrogen 3.067 N/A THR 28.A OG1 LEU 71.A O no hydrogen 3.506 N/A THR 28.A OG1 GLU 75.A OE1 no hydrogen 3.427 N/A GLY 30.A N THR 27.A OG1 no hydrogen 2.842 N/A LEU 31.A N THR 27.A O no hydrogen 3.117 N/A GLN 32.A N THR 28.A O no hydrogen 2.966 N/A GLN 33.A N ALA 29.A O no hydrogen 2.898 N/A ILE 34.A N GLY 30.A O no hydrogen 3.098 N/A HIS 35.A N LEU 31.A O no hydrogen 2.940 N/A HIS 35.A NE2 GLU 100.A O no hydrogen 2.756 N/A ARG 36.A N GLN 32.A O no hydrogen 2.911 N/A TYR 37.A N GLN 33.A O no hydrogen 2.926 N/A TYR 37.A OH ASP 19.A OD2 no hydrogen 2.617 N/A LEU 38.A N ILE 34.A O no hydrogen 2.900 N/A PHE 39.A N HIS 35.A O no hydrogen 2.873 N/A GLY 40.A N ARG 36.A O no hydrogen 2.741 N/A LEU 42.A N PHE 39.A O no hydrogen 2.792 N/A TYR 43.A N PHE 39.A O no hydrogen 3.049 N/A ALA 46.A N TYR 43.A O no hydrogen 3.171 N/A GLY 47.A N HIS 35.A ND1 no hydrogen 2.912 N/A GLN 48.A N PHE 45.A O no hydrogen 2.912 N/A ARG 50.A N PRO 97.A O no hydrogen 2.771 N/A ARG 50.A NE HIS 96.A O no hydrogen 2.695 N/A ARG 50.A NH1 ASP 52.A O no hydrogen 2.874 N/A ARG 50.A NH1 ALA 62.A O no hydrogen 3.190 N/A ARG 50.A NH2 ALA 62.A O no hydrogen 2.787 N/A ARG 50.A NH2 ALA 95.A O no hydrogen 2.713 N/A ARG 50.A NH2 HIS 96.A O no hydrogen 3.338 N/A LYS 56.A N PHE 59.A O no hydrogen 2.908 N/A PHE 59.A N LYS 56.A O no hydrogen 3.020 N/A ARG 60.A NE PHE 61.A O no hydrogen 3.104 N/A PHE 61.A N ILE 54.A O no hydrogen 3.134 N/A ALA 62.A N ILE 94.A O no hydrogen 2.958 N/A TYR 66.A N ASN 63.A O no hydrogen 3.040 N/A LEU 67.A N ALA 64.A O no hydrogen 3.352 N/A GLU 69.A N GLU 69.A OE1 no hydrogen 2.662 N/A ALA 70.A N TYR 66.A O no hydrogen 2.961 N/A LEU 71.A N LEU 67.A O no hydrogen 2.869 N/A VAL 72.A N LYS 68.A O no hydrogen 3.122 N/A ILE 74.A N ALA 70.A O no hydrogen 2.843 N/A GLU 75.A N LEU 71.A O no hydrogen 2.971 N/A GLN 76.A N LYS 73.A O no hydrogen 3.200 N/A MET 77.A N ILE 74.A O no hydrogen 3.019 N/A ARG 80.A N GLU 84.A OE1 no hydrogen 3.019 N/A ARG 80.A NE GLU 84.A OE1 no hydrogen 3.161 N/A ARG 80.A NH2 GLU 84.A OE2 no hydrogen 2.923 N/A GLU 84.A N THR 81.A OG1 no hydrogen 3.018 N/A ILE 85.A N THR 81.A O no hydrogen 2.968 N/A ILE 86.A N PHE 82.A O no hydrogen 2.874 N/A ALA 87.A N GLU 83.A O no hydrogen 3.023 N/A LYS 88.A N GLU 84.A O no hydrogen 2.977 N/A LYS 88.A NZ GLY 26.A O no hydrogen 3.253 N/A LYS 88.A NZ GLU 75.A O no hydrogen 2.916 N/A LYS 88.A NZ MET 77.A O no hydrogen 2.852 N/A LYS 88.A NZ GLU 79.A OE2 no hydrogen 2.681 N/A TYR 89.A N ILE 85.A O no hydrogen 2.913 N/A VAL 90.A N ILE 86.A O no hydrogen 2.791 N/A GLU 91.A N ALA 87.A O no hydrogen 3.018 N/A MET 92.A N LYS 88.A O no hydrogen 3.021 N/A ASN 93.A N TYR 89.A O no hydrogen 2.817 N/A ILE 94.A N VAL 90.A O no hydrogen 2.971 N/A ALA 95.A N GLU 91.A O no hydrogen 2.911 N/A HIS 96.A N MET 92.A O no hydrogen 2.883 N/A HIS 96.A ND1 ASN 93.A O no hydrogen 2.665 N/A PHE 98.A N ASN 102.A OD1 no hydrogen 2.972 N/A ASN 102.A ND2 PHE 98.A O no hydrogen 2.675 N/A ARG 104.A NH1 ASP 4.A OD1 no hydrogen 3.090 N/A ARG 104.A NH2 ASP 4.A OD2 no hydrogen 3.114 N/A ARG 104.A NH2 TYR 172.A O no hydrogen 3.512 N/A SER 105.A N GLY 101.A O no hydrogen 3.395 N/A SER 105.A OG GLY 101.A O no hydrogen 2.681 N/A SER 105.A OG ASN 102.A O no hydrogen 3.325 N/A THR 106.A N ASN 102.A O no hydrogen 3.001 N/A THR 106.A OG1 ASN 102.A O no hydrogen 2.603 N/A ARG 107.A N GLY 103.A O no hydrogen 3.136 N/A ARG 107.A NE SER 171.A OG no hydrogen 2.898 N/A ARG 107.A NH1 TYR 132.A OH no hydrogen 2.856 N/A ARG 107.A NH2 SER 171.A O no hydrogen 3.097 N/A ARG 107.A NH2 SER 171.A OG no hydrogen 3.294 N/A ARG 107.A NH2 GLU 175.A OE1 no hydrogen 2.846 N/A ILE 108.A N ARG 104.A O no hydrogen 3.468 N/A TRP 109.A N SER 105.A O no hydrogen 3.097 N/A TRP 109.A NE1 THR 27.A O no hydrogen 2.835 N/A LEU 110.A N THR 106.A O no hydrogen 2.813 N/A ASP 111.A N ARG 107.A O no hydrogen 2.969 N/A LEU 112.A N ILE 108.A O no hydrogen 3.013 N/A VAL 113.A N TRP 109.A O no hydrogen 3.180 N/A LEU 114.A N LEU 110.A O no hydrogen 2.928 N/A LYS 115.A N ASP 111.A O no hydrogen 2.769 N/A LYS 115.A NZ ASP 159.A OD1 no hydrogen 2.834 N/A LYS 116.A N LEU 112.A O no hydrogen 2.880 N/A ASN 117.A N VAL 113.A O no hydrogen 3.178 N/A ASN 117.A ND2 GLU 79.A OE1 no hydrogen 3.056 N/A ASN 117.A ND2 VAL 113.A O no hydrogen 2.725 N/A LEU 118.A N LEU 114.A O no hydrogen 2.855 N/A LYS 119.A N LYS 115.A O no hydrogen 2.968 N/A LYS 120.A N LEU 114.A O no hydrogen 3.360 N/A VAL 121.A N THR 155.A O no hydrogen 3.062 N/A VAL 122.A N ASP 111.A OD1 no hydrogen 2.979 N/A ASN 123.A N ASN 153.A O no hydrogen 2.747 N/A TRP 124.A NE1 ASP 111.A OD2 no hydrogen 2.860 N/A GLN 125.A NE2 ASN 123.A OD1 no hydrogen 2.993 N/A ASN 126.A N ASN 123.A O no hydrogen 3.014 N/A VAL 127.A N TRP 124.A O no hydrogen 2.807 N/A LYS 129.A NZ TYR 173.A O no hydrogen 3.030 N/A LEU 131.A N SER 128.A OG no hydrogen 3.140 N/A TYR 132.A N SER 128.A O no hydrogen 2.935 N/A TYR 132.A OH TYR 89.A OH no hydrogen 2.541 N/A LEU 133.A N LYS 129.A O no hydrogen 2.882 N/A GLN 134.A N THR 130.A O no hydrogen 3.049 N/A ALA 135.A N LEU 131.A O no hydrogen 2.955 N/A MET 136.A N TYR 132.A O no hydrogen 3.002 N/A GLU 137.A N LEU 133.A O no hydrogen 3.054 N/A ARG 138.A N GLN 134.A O no hydrogen 3.108 N/A SER 139.A N MET 136.A O no hydrogen 3.087 N/A SER 139.A OG MET 136.A O no hydrogen 2.542 N/A VAL 141.A N ARG 138.A O no hydrogen 2.886 N/A ASN 142.A N ARG 138.A O no hydrogen 3.072 N/A LEU 144.A N ASN 142.A OD1 no hydrogen 3.021 N/A ARG 147.A N ASP 143.A O no hydrogen 2.817 N/A ARG 147.A NE ASP 143.A OD1 no hydrogen 2.716 N/A PHE 148.A N LEU 144.A O no hydrogen 2.933 N/A LEU 149.A N GLU 145.A O no hydrogen 2.948 N/A LEU 150.A N LEU 146.A O no hydrogen 2.854 N/A LYS 151.A N ARG 147.A O no hydrogen 2.940 N/A ASP 152.A N PHE 148.A O no hydrogen 3.430 N/A ASN 153.A N LEU 150.A O no hydrogen 2.958 N/A ASN 153.A ND2 LEU 149.A O no hydrogen 2.882 N/A THR 155.A N VAL 121.A O no hydrogen 2.896 N/A ASP 157.A N THR 155.A OG1 no hydrogen 3.177 N/A ASN 160.A N ASP 157.A O no hydrogen 3.369 N/A GLU 162.A N ASN 160.A OD1 no hydrogen 2.832 N/A ILE 163.A N ASN 160.A OD1 no hydrogen 3.064 N/A ILE 164.A N ASN 160.A O no hydrogen 3.003 N/A PHE 165.A N ARG 161.A O no hydrogen 2.872 N/A LYS 166.A N GLU 162.A O no hydrogen 2.913 N/A LYS 166.A NZ GLU 162.A OE1 no hydrogen 3.355 N/A GLY 167.A N ILE 163.A O no hydrogen 3.062 N/A ILE 168.A N ILE 164.A O no hydrogen 3.012 N/A GLU 169.A N PHE 165.A O no hydrogen 3.222 N/A GLN 170.A N LYS 166.A O no hydrogen 3.114 N/A GLN 170.A NE2 VAL 127.A O no hydrogen 2.852 N/A SER 171.A N GLY 167.A O no hydrogen 2.876 N/A TYR 172.A N ILE 168.A O no hydrogen 3.032 N/A TYR 172.A OH SER 7.A OG no hydrogen 2.806 N/A TYR 173.A N GLU 169.A O no hydrogen 2.983 N/A TYR 174.A N GLN 170.A O no hydrogen 2.966 N/A TYR 174.A N SER 171.A O no hydrogen 3.258 N/A TYR 174.A OH VAL 127.A O no hydrogen 2.538 N/A GLY 176.A N TYR 173.A O no hydrogen 2.934 N/A TYR 177.A N TYR 172.A O no hydrogen 3.257 N/A