Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2etj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N LYS 113.A O no hydrogen 3.417 N/A ILE 2.A N LYS 113.A O no hydrogen 3.319 N/A GLU 4.A N GLY 1.A O no hydrogen 3.113 N/A LEU 5.A N ILE 2.A O no hydrogen 2.996 N/A TYR 6.A N ASP 3.A O no hydrogen 3.042 N/A ILE 12.A N SER 89.A OG no hydrogen 3.137 N/A ALA 14.A N PHE 90.A O no hydrogen 3.098 N/A GLY 15.A N VAL 33.A O no hydrogen 2.867 N/A VAL 16.A N LEU 92.A O no hydrogen 2.863 N/A ASP 17.A N ALA 31.A O no hydrogen 3.181 N/A GLU 18.A N ASP 17.A OD1 no hydrogen 2.787 N/A ALA 19.A N VAL 29.A O no hydrogen 2.729 N/A ARG 21.A N GLU 18.A OE1 no hydrogen 2.949 N/A CYS 23.A N GLY 20.A O no hydrogen 3.198 N/A CYS 23.A SG.A LYS 146.A O no hydrogen 3.653 N/A CYS 23.A SG.B ALA 25.A O no hydrogen 2.787 N/A CYS 23.A SG.B LYS 146.A O no hydrogen 3.067 N/A LEU 24.A N GLY 147.A O no hydrogen 2.783 N/A GLY 26.A N ILE 165.A O no hydrogen 2.849 N/A VAL 28.A N ALA 60.A O no hydrogen 2.968 N/A VAL 29.A N ALA 19.A O no hydrogen 3.010 N/A ALA 30.A N GLY 58.A O no hydrogen 2.796 N/A ALA 31.A N ASP 17.A O no hydrogen 2.985 N/A ALA 32.A N GLY 56.A O no hydrogen 2.818 N/A VAL 33.A N GLY 15.A O no hydrogen 2.856 N/A VAL 34.A N ALA 54.A O no hydrogen 2.977 N/A GLU 36.A N LYS 52.A O no hydrogen 3.278 N/A ARG 45.A N ALA 41.A O no hydrogen 3.195 N/A LEU 46.A N LYS 42.A O no hydrogen 2.923 N/A LEU 47.A N ARG 43.A O no hydrogen 2.692 N/A ASP 48.A N GLU 44.A O no hydrogen 3.285 N/A GLU 49.A N ARG 45.A O no hydrogen 3.460 N/A ILE 50.A N LEU 46.A O no hydrogen 2.799 N/A LYS 52.A N GLU 49.A O no hydrogen 3.035 N/A LYS 52.A N ILE 50.A O no hydrogen 3.030 N/A LYS 52.A NZ GLU 38.A O no hydrogen 2.736 N/A LYS 52.A NZ GLU 49.A OE1 no hydrogen 2.972 N/A ALA 54.A N VAL 34.A O no hydrogen 2.835 N/A GLY 56.A N ALA 32.A O no hydrogen 2.877 N/A ILE 57.A N ASN 83.A OD1 no hydrogen 2.966 N/A GLY 58.A N ALA 30.A O no hydrogen 3.014 N/A ALA 60.A N VAL 28.A O no hydrogen 2.933 N/A SER 61.A N GLU 64.A OE1 no hydrogen 3.047 N/A GLU 64.A N SER 61.A OG no hydrogen 3.132 N/A ILE 65.A N SER 61.A O no hydrogen 2.955 N/A ASP 66.A N PRO 62.A O no hydrogen 2.904 N/A LEU 67.A N GLU 63.A O no hydrogen 2.885 N/A TYR 68.A N GLU 64.A O no hydrogen 2.848 N/A ASN 69.A N ILE 65.A O no hydrogen 2.858 N/A ASN 72.A N ASN 69.A OD1 no hydrogen 2.981 N/A ASN 72.A ND2 TYR 68.A O no hydrogen 2.902 N/A ALA 73.A N ASN 69.A O no hydrogen 2.906 N/A THR 74.A N ILE 70.A O no hydrogen 2.987 N/A THR 74.A OG1 ILE 70.A O no hydrogen 2.786 N/A LYS 75.A N PHE 71.A O no hydrogen 3.151 N/A LEU 76.A N ASN 72.A O no hydrogen 2.896 N/A ALA 77.A N ALA 73.A O no hydrogen 2.922 N/A ARG 79.A N LEU 76.A O no hydrogen 2.992 N/A ARG 79.A NH1 ILE 59.A O no hydrogen 2.820 N/A ARG 79.A NH1 GLU 64.A OE1 no hydrogen 2.828 N/A ARG 79.A NH1 GLU 64.A OE2 no hydrogen 3.282 N/A ARG 79.A NH2 GLU 64.A OE2 no hydrogen 2.901 N/A ALA 80.A N ALA 77.A O no hydrogen 2.893 N/A GLU 82.A N ASN 78.A O no hydrogen 2.937 N/A ASN 83.A N ARG 79.A O no hydrogen 2.903 N/A LEU 84.A N ALA 80.A O no hydrogen 3.092 N/A LEU 84.A N LEU 81.A O no hydrogen 3.307 N/A LYS 87.A NZ LEU 84.A O no hydrogen 3.214 N/A SER 89.A N ILE 12.A O no hydrogen 2.668 N/A PHE 90.A N ILE 12.A O no hydrogen 3.217 N/A VAL 91.A N PRO 103.A O no hydrogen 2.975 N/A LEU 92.A N ALA 14.A O no hydrogen 2.833 N/A VAL 93.A N THR 105.A O no hydrogen 2.938 N/A ASP 94.A N VAL 16.A O no hydrogen 3.029 N/A GLY 95.A N LEU 107.A O no hydrogen 2.861 N/A SER 101.A N ASN 78.A OD1 no hydrogen 2.831 N/A SER 101.A OG ASN 78.A OD1 no hydrogen 3.338 N/A THR 105.A N VAL 91.A O no hydrogen 2.988 N/A CYS 106.A SG ILE 98.A O no hydrogen 3.225 N/A LEU 107.A N VAL 93.A O no hydrogen 2.812 N/A GLY 110.A N ASP 94.A OD1 no hydrogen 2.777 N/A GLN 112.A N LYS 109.A O no hydrogen 3.062 N/A LYS 113.A N GLY 110.A O no hydrogen 3.132 N/A LYS 113.A NZ VAL 108.A O no hydrogen 2.514 N/A SER 114.A N GLY 110.A O no hydrogen 2.893 N/A SER 114.A OG ASP 3.A OD1 no hydrogen 2.436 N/A SER 114.A OG ASP 3.A OD2 no hydrogen 3.333 N/A LEU 116.A N ASP 3.A OD2 no hydrogen 2.837 N/A ILE 117.A N SER 114.A OG no hydrogen 3.162 N/A GLY 118.A N SER 114.A O no hydrogen 2.861 N/A ALA 119.A N LYS 115.A O no hydrogen 2.938 N/A ALA 120.A N LEU 116.A O no hydrogen 3.013 N/A SER 121.A N ILE 117.A O no hydrogen 2.847 N/A SER 121.A OG GLY 118.A O no hydrogen 2.619 N/A ILE 122.A N GLY 118.A O no hydrogen 3.121 N/A VAL 123.A N ALA 119.A O no hydrogen 3.038 N/A ALA 124.A N ALA 120.A O no hydrogen 2.981 N/A LYS 125.A N SER 121.A O no hydrogen 3.035 N/A LYS 125.A NZ.A ASP 129.A OD1 no hydrogen 2.761 N/A LYS 125.A NZ.A ASP 129.A OD2 no hydrogen 3.210 N/A LYS 125.A NZ.B ASP 129.A OD2 no hydrogen 3.022 N/A VAL 126.A N ILE 122.A O no hydrogen 2.960 N/A PHE 127.A N VAL 123.A O no hydrogen 2.962 N/A ARG 128.A N ALA 124.A O no hydrogen 2.909 N/A ARG 128.A NE PRO 27.A O no hydrogen 2.792 N/A ARG 128.A NH1 LYS 146.A O no hydrogen 2.859 N/A ARG 128.A NH2 ALA 25.A O no hydrogen 2.785 N/A ARG 128.A NH2 PRO 27.A O no hydrogen 3.167 N/A ASP 129.A N LYS 125.A O no hydrogen 2.886 N/A ARG 130.A N VAL 126.A O no hydrogen 3.107 N/A LEU 131.A N PHE 127.A O no hydrogen 3.103 N/A SER 132.A OG ASP 129.A O no hydrogen 3.255 N/A GLU 133.A N ARG 130.A O no hydrogen 3.080 N/A PHE 134.A N LEU 131.A O no hydrogen 3.067 N/A HIS 135.A N SER 132.A O no hydrogen 3.116 N/A HIS 135.A ND1 PHE 140.A O no hydrogen 2.785 N/A ARG 136.A N SER 132.A O no hydrogen 3.249 N/A ARG 136.A NH1 GLU 133.A OE1 no hydrogen 2.859 N/A PHE 140.A N TYR 137.A O no hydrogen 2.897 N/A SER 141.A N GLU 156.A OE1 no hydrogen 3.063 N/A SER 141.A N GLU 156.A OE2 no hydrogen 3.375 N/A SER 141.A OG GLU 156.A OE1 no hydrogen 3.371 N/A SER 141.A OG GLU 156.A OE2 no hydrogen 2.689 N/A LYS 144.A N SER 141.A O no hydrogen 2.988 N/A HIS 145.A N SER 141.A O no hydrogen 3.045 N/A HIS 145.A NE2 GLU 156.A OE1 no hydrogen 2.763 N/A LYS 146.A N PHE 142.A O no hydrogen 2.860 N/A LYS 146.A NZ ASP 129.A O no hydrogen 3.238 N/A LYS 146.A NZ HIS 143.A O no hydrogen 2.745 N/A GLY 147.A N HIS 145.A ND1 no hydrogen 3.127 N/A TYR 148.A N HIS 145.A O no hydrogen 3.078 N/A THR 150.A N TYR 148.A O no hydrogen 2.845 N/A HIS 153.A N THR 150.A OG1 no hydrogen 3.131 N/A HIS 153.A ND1 TYR 148.A O no hydrogen 2.821 N/A HIS 153.A NE2 HIS 166.A NE2 no hydrogen 2.961 N/A LEU 154.A N THR 150.A O no hydrogen 2.974 N/A ASN 155.A N LYS 151.A O no hydrogen 2.915 N/A GLU 156.A N GLU 152.A O no hydrogen 2.882 N/A ILE 157.A N HIS 153.A O no hydrogen 2.915 N/A ARG 158.A N LEU 154.A O no hydrogen 2.952 N/A LYS 159.A N ASN 155.A O no hydrogen 2.969 N/A ASN 160.A N GLU 156.A O no hydrogen 2.886 N/A GLY 161.A N ILE 157.A O no hydrogen 2.758 N/A LEU 163.A N HIS 166.A ND1 no hydrogen 2.967 N/A HIS 166.A N LEU 163.A O no hydrogen 3.013 N/A HIS 166.A NE2 HIS 153.A NE2 no hydrogen 2.961 N/A ARG 167.A N LEU 24.A O no hydrogen 2.865 N/A ARG 167.A NE GLY 26.A O no hydrogen 2.992 N/A ARG 167.A NH1 GLY 20.A O no hydrogen 2.972 N/A ARG 167.A NH1 ARG 21.A O no hydrogen 3.028 N/A ARG 167.A NH2 GLY 20.A O no hydrogen 2.773 N/A ARG 167.A NH2 GLY 26.A O no hydrogen 2.911 N/A LEU 168.A N ASP 66.A OD2 no hydrogen 3.006 N/A SER 169.A N ASP 66.A OD1 no hydrogen 3.036 N/A SER 169.A OG ASP 66.A OD1 no hydrogen 2.762 N/A PHE 170.A N ARG 167.A O no hydrogen 3.087 N/A VAL 173.A N PHE 170.A O no hydrogen 2.971 N/A LEU 174.A N PHE 170.A O no hydrogen 2.847 N/A GLU 175.A N GLU 171.A O no hydrogen 2.921 N/A LEU 176.A N VAL 173.A O no hydrogen 2.974 N/A LEU 177.A N VAL 173.A O no hydrogen 3.085 N/A LEU 181.A N THR 178.A OG1 no hydrogen 3.151 N/A LEU 182.A N THR 178.A O no hydrogen 2.984 N/A ARG 183.A N ASP 179.A O no hydrogen 2.913 N/A GLU 184.A N ASP 180.A O no hydrogen 2.897 N/A PHE 185.A N LEU 181.A O no hydrogen 3.023 N/A PHE 186.A N LEU 182.A O no hydrogen 3.177 N/A GLU 187.A N ARG 183.A O no hydrogen 2.876 N/A LYS 188.A N GLU 184.A O no hydrogen 2.961 N/A GLY 189.A N PHE 186.A O no hydrogen 2.961 N/A LEU 190.A N PHE 185.A O no hydrogen 2.881 N/A SER 192.A OG GLU 63.A OE2 no hydrogen 2.629 N/A ARG 195.A N SER 192.A OG no hydrogen 3.032 N/A ARG 195.A NE ASP 66.A OD2 no hydrogen 2.799 N/A ARG 195.A NH1 PRO 164.A O no hydrogen 3.017 N/A ARG 195.A NH2 ASP 66.A OD2 no hydrogen 2.940 N/A ARG 195.A NH2 PRO 164.A O no hydrogen 2.995 N/A PHE 196.A N SER 192.A O no hydrogen 2.856 N/A GLU 197.A N GLU 193.A O no hydrogen 2.886 N/A ARG 198.A N ASN 194.A O no hydrogen 3.030 N/A ARG 198.A NE ASP 66.A O no hydrogen 3.123 N/A ILE 199.A N ARG 195.A O no hydrogen 3.001 N/A LEU 200.A N PHE 196.A O no hydrogen 2.853 N/A ASN 201.A N GLU 197.A O no hydrogen 3.034 N/A LEU 202.A N ARG 198.A O no hydrogen 3.146 N/A LEU 203.A N ILE 199.A O no hydrogen 2.841 N/A GLY 204.A N LEU 200.A O no hydrogen 2.828 N/A ALA 205.A N ASN 201.A O no hydrogen 3.015 N/A ARG 206.A NH1 GLU 171.A OE1 no hydrogen 2.983 N/A ARG 206.A NH1 GLU 171.A OE2 no hydrogen 3.501 N/A ARG 206.A NH2 GLU 171.A OE2 no hydrogen 2.966 N/A