Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3cjy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 5.A N PHE 2.A O no hydrogen 2.978 N/A VAL 6.A N ALA 14.A O no hydrogen 2.734 N/A ARG 7.A NE GLU 45.A OE1 no hydrogen 2.651 N/A ARG 7.A NH2 ASP 10.A OD1 no hydrogen 2.695 N/A GLN 8.A N ARG 12.A O no hydrogen 2.596 N/A ASP 9.A N ARG 12.A O no hydrogen 3.135 N/A ARG 12.A N ASP 9.A O no hydrogen 3.211 N/A ARG 12.A N ASP 10.A O no hydrogen 2.976 N/A TYR 13.A N LEU 70.A O no hydrogen 2.857 N/A TYR 13.A OH GLU 45.A OE1 no hydrogen 2.918 N/A TYR 13.A OH THR 46.A OG1 no hydrogen 2.773 N/A ALA 14.A N VAL 6.A O no hydrogen 2.766 N/A ILE 15.A N LEU 68.A O no hydrogen 3.013 N/A VAL 17.A N SER 66.A O no hydrogen 2.811 N/A LEU 21.A N GLY 18.A O no hydrogen 3.056 N/A ALA 22.A N PRO 19.A O no hydrogen 3.090 N/A VAL 23.A N TYR 30.A O.A no hydrogen 2.804 N/A VAL 23.A N TYR 30.A O.B no hydrogen 2.828 N/A GLY 24.A N GLN 133.A OE1 no hydrogen 3.019 N/A GLY 27.A N ASP 134.A OD2 no hydrogen 2.704 N/A HIS 28.A N PRO 25.A O no hydrogen 2.785 N/A TYR 30.A N.A VAL 23.A O no hydrogen 2.849 N/A TYR 30.A N.B VAL 23.A O no hydrogen 2.881 N/A LEU 31.A N THR 62.A O no hydrogen 2.875 N/A PHE 32.A N LEU 21.A O no hydrogen 2.931 N/A GLY 34.A N ASP 179.A OD2 no hydrogen 2.862 N/A SER 36.A N PHE 32.A O no hydrogen 3.019 N/A LEU 38.A N ALA 35.A O no hydrogen 2.906 N/A ALA 39.A N SER 36.A O no hydrogen 2.924 N/A ASP 41.A N.A ALA 37.A O no hydrogen 2.876 N/A ASP 41.A N.B ALA 37.A O no hydrogen 2.877 N/A VAL 42.A N LEU 38.A O no hydrogen 3.016 N/A ALA 43.A N ALA 39.A O no hydrogen 3.099 N/A ALA 44.A N LEU 40.A O no hydrogen 3.032 N/A GLU 45.A N ASP 41.A O.A no hydrogen 2.907 N/A GLU 45.A N ASP 41.A O.B no hydrogen 3.012 N/A THR 46.A N VAL 42.A O no hydrogen 2.863 N/A THR 46.A OG1 TYR 13.A OH no hydrogen 2.773 N/A THR 46.A OG1 VAL 42.A O no hydrogen 2.812 N/A VAL 47.A N ALA 43.A O no hydrogen 2.838 N/A GLY 48.A N ALA 44.A O no hydrogen 2.652 N/A ARG 49.A NH1.A GLY 78.A O no hydrogen 3.014 N/A ARG 49.A NH1.B GLY 78.A O no hydrogen 2.652 N/A ARG 49.A NH2.A GLY 78.A O no hydrogen 3.175 N/A ARG 49.A NH2.A ARG 79.A O no hydrogen 3.327 N/A ARG 49.A NH2.B GLY 78.A O no hydrogen 2.643 N/A VAL 52.A N SER 101.A O no hydrogen 2.825 N/A GLN 53.A N SER 101.A O no hydrogen 3.316 N/A GLN 53.A NE2 SER 101.A OG no hydrogen 2.773 N/A GLY 54.A N LEU 200.A O no hydrogen 2.835 N/A SER 55.A N GLY 99.A O no hydrogen 2.870 N/A SER 55.A OG SER 199.A OG.B no hydrogen 3.164 N/A LEU 56.A N ASN 198.A O no hydrogen 2.730 N/A GLN 57.A N HIS 97.A O no hydrogen 2.851 N/A PHE 58.A N LEU 196.A O no hydrogen 2.986 N/A VAL 59.A N VAL 95.A O no hydrogen 2.836 N/A SER 60.A N.A VAL 95.A O no hydrogen 3.179 N/A SER 60.A N.B VAL 95.A O no hydrogen 3.201 N/A SER 60.A OG.B LEU 94.A O no hydrogen 2.981 N/A LEU 64.A N ALA 29.A O no hydrogen 2.887 N/A GLY 65.A N VAL 17.A O no hydrogen 2.631 N/A SER 66.A N PRO 63.A O no hydrogen 3.071 N/A SER 66.A OG PRO 63.A O no hydrogen 2.527 N/A LEU 68.A N ILE 15.A O no hydrogen 2.845 N/A ASP 69.A N THR 89.A O no hydrogen 2.808 N/A LEU 70.A N TYR 13.A O no hydrogen 2.785 N/A THR 71.A N ALA 87.A O no hydrogen 2.895 N/A VAL 72.A N ALA 11.A O no hydrogen 2.759 N/A GLU 73.A N ARG 85.A O no hydrogen 2.764 N/A LEU 75.A N GLN 83.A O no hydrogen 2.795 N/A GLN 76.A N GLN 83.A O no hydrogen 3.287 N/A GLN 76.A NE2 GLN 83.A OE1 no hydrogen 2.556 N/A GLY 78.A N LEU 81.A O no hydrogen 2.945 N/A ALA 82.A N LEU 102.A O no hydrogen 2.817 N/A GLN 83.A N GLN 76.A O no hydrogen 2.841 N/A ALA 84.A N ILE 100.A O no hydrogen 2.890 N/A ARG 85.A N GLU 73.A O no hydrogen 2.770 N/A ARG 85.A NE GLU 73.A OE1 no hydrogen 2.958 N/A ARG 85.A NH2 GLU 73.A OE1 no hydrogen 2.766 N/A VAL 86.A N SER 98.A O no hydrogen 3.139 N/A ALA 87.A N THR 71.A O no hydrogen 2.926 N/A GLY 88.A N PHE 96.A O no hydrogen 2.896 N/A THR 89.A N ASP 69.A O no hydrogen 2.945 N/A VAL 90.A N ARG 93.A O no hydrogen 2.878 N/A ARG 93.A N VAL 90.A O no hydrogen 2.831 N/A ARG 93.A NE SER 60.A OG.A no hydrogen 3.300 N/A ARG 93.A NE SER 60.A OG.B no hydrogen 3.208 N/A ARG 93.A NH2 PHE 61.A O no hydrogen 2.949 N/A VAL 95.A N GLY 88.A O no hydrogen 2.886 N/A PHE 96.A N GLY 88.A O no hydrogen 3.369 N/A HIS 97.A N GLN 57.A O no hydrogen 3.232 N/A SER 98.A OG VAL 86.A O no hydrogen 2.967 N/A GLY 99.A N SER 55.A O no hydrogen 2.929 N/A ILE 100.A N ALA 84.A O no hydrogen 2.946 N/A SER 101.A N GLN 53.A O no hydrogen 2.913 N/A LEU 102.A N ALA 82.A O no hydrogen 2.751 N/A GLY 103.A N PRO 50.A O no hydrogen 2.847 N/A GLN 111.A NE2 ALA 113.A O no hydrogen 2.848 N/A GLN 111.A NE2 GLY 235.A O no hydrogen 2.997 N/A VAL 118.A N PRO 116.A O no hydrogen 2.867 N/A GLN 120.A NE2 GLN 233.A O no hydrogen 3.069 N/A ASN 123.A N GLN 120.A O no hydrogen 2.891 N/A CYS 124.A N PRO 121.A O no hydrogen 3.057 N/A CYS 124.A SG PRO 119.A O no hydrogen 3.588 N/A CYS 124.A SG GLN 120.A O no hydrogen 3.422 N/A CYS 127.A N VAL 145.A O no hydrogen 2.919 N/A CYS 127.A SG THR 129.A OG1 no hydrogen 3.766 N/A CYS 127.A SG GLU 147.A OE2 no hydrogen 3.250 N/A GLN 133.A NE2 PRO 131.A O no hydrogen 3.674 N/A GLN 133.A NE2 ALA 132.A O no hydrogen 3.115 N/A ASP 134.A N GLY 24.A O no hydrogen 2.799 N/A ASN 136.A N ASP 134.A OD1 no hydrogen 2.899 N/A ALA 137.A N ASP 134.A O no hydrogen 2.956 N/A ARG 138.A N PRO 19.A O no hydrogen 2.859 N/A ARG 138.A NE GLU 141.A OE1 no hydrogen 2.855 N/A ARG 138.A NE GLU 141.A OE2 no hydrogen 3.238 N/A TYR 139.A N ALA 22.A O no hydrogen 2.972 N/A GLU 141.A N ARG 138.A O no hydrogen 3.168 N/A GLY 142.A N TYR 139.A O no hydrogen 2.980 N/A ILE 143.A N LEU 140.A O no hydrogen 3.059 N/A GLU 144.A N ARG 163.A O no hydrogen 2.750 N/A ARG 146.A N TRP 161.A O no hydrogen 2.867 N/A ARG 146.A NH1 PRO 121.A O no hydrogen 2.913 N/A ARG 146.A NH1 ASP 122.A OD1 no hydrogen 2.957 N/A ARG 146.A NH2 GLU 144.A OE2 no hydrogen 2.838 N/A GLU 147.A N PRO 125.A O no hydrogen 2.819 N/A ALA 148.A N ARG 159.A O no hydrogen 2.803 N/A ARG 157.A N PRO 154.A O no hydrogen 3.011 N/A ARG 159.A NE ASP 214.A OD1 no hydrogen 2.916 N/A LEU 160.A N CYS 213.A O no hydrogen 2.992 N/A TRP 161.A N ARG 146.A O no hydrogen 2.852 N/A TRP 161.A NE1 PRO 119.A O no hydrogen 2.943 N/A LEU 162.A N CYS 211.A O no hydrogen 2.845 N/A ARG 163.A N GLU 144.A O no hydrogen 2.962 N/A ARG 163.A NE GLU 144.A OE1 no hydrogen 3.298 N/A ARG 163.A NH2 GLU 144.A OE1 no hydrogen 2.741 N/A ARG 164.A NE ASP 166.A OD1 no hydrogen 2.985 N/A ARG 164.A NH1 SER 174.A OG no hydrogen 2.859 N/A ARG 164.A NH2 ASP 166.A OD1 no hydrogen 3.547 N/A ARG 164.A NH2 ASP 166.A OD2 no hydrogen 2.827 N/A LYS 165.A N GLY 142.A O no hydrogen 2.958 N/A LYS 165.A NZ GLU 141.A O no hydrogen 2.875 N/A GLY 167.A N ARG 164.A O no hydrogen 3.174 N/A ALA 168.A N ASP 166.A OD1 no hydrogen 3.163 N/A LEU 170.A N ALA 206.A O no hydrogen 2.886 N/A SER 174.A N ASP 171.A OD1 no hydrogen 3.022 N/A SER 174.A OG PRO 169.A O no hydrogen 2.923 N/A SER 174.A OG ASP 171.A OD1 no hydrogen 3.254 N/A LEU 175.A N ASP 171.A O no hydrogen 2.916 N/A ALA 176.A N ALA 172.A O no hydrogen 2.858 N/A ALA 178.A N LEU 175.A O no hydrogen 2.863 N/A PHE 180.A N PHE 177.A O no hydrogen 3.261 N/A ILE 183.A N PHE 180.A O no hydrogen 2.967 N/A ALA 184.A N PHE 180.A O no hydrogen 3.449 N/A LEU 185.A N LEU 181.A O no hydrogen 2.927 N/A GLY 186.A N PRO 182.A O no hydrogen 3.039 N/A ARG 187.A N ILE 183.A O no hydrogen 3.061 N/A ARG 187.A NH1 GLU 147.A OE1 no hydrogen 2.758 N/A ARG 187.A NH2 GLU 147.A OE1 no hydrogen 3.407 N/A ARG 187.A NH2 GLU 147.A OE2 no hydrogen 2.699 N/A ALA 188.A N ALA 184.A O no hydrogen 2.970 N/A THR 189.A N LEU 185.A O no hydrogen 2.882 N/A THR 189.A OG1 LEU 185.A O no hydrogen 3.036 N/A GLY 190.A N GLY 186.A O no hydrogen 2.855 N/A CYS 191.A N THR 189.A OG1 no hydrogen 3.162 N/A CYS 191.A SG THR 189.A OG1 no hydrogen 3.741 N/A ASN 194.A N LEU 246.A O no hydrogen 2.914 N/A SER 195.A OG ASP 179.A OD1 no hydrogen 3.562 N/A SER 195.A OG GLN 243.A OE1 no hydrogen 2.657 N/A LEU 196.A N SER 244.A O no hydrogen 2.820 N/A ASN 198.A N LEU 56.A O no hydrogen 2.869 N/A ASN 198.A ND2 ASP 179.A OD1 no hydrogen 3.110 N/A ASN 198.A ND2 ASP 197.A O no hydrogen 2.797 N/A SER 199.A N.A ALA 242.A O no hydrogen 2.962 N/A SER 199.A N.B ALA 242.A O no hydrogen 2.950 N/A SER 199.A OG.B SER 55.A OG no hydrogen 3.164 N/A LEU 200.A N GLY 54.A O no hydrogen 2.900 N/A ARG 201.A N THR 240.A O no hydrogen 2.786 N/A ILE 202.A N VAL 52.A O no hydrogen 2.934 N/A THR 203.A N LEU 238.A O no hydrogen 2.720 N/A GLY 204.A N LEU 238.A O no hydrogen 3.055 N/A ALA 206.A N LEU 170.A O no hydrogen 3.006 N/A CYS 211.A N LEU 162.A O no hydrogen 2.880 N/A CYS 211.A SG TRP 231.A O no hydrogen 3.506 N/A LEU 212.A N TRP 231.A O no hydrogen 2.812 N/A CYS 213.A N LEU 160.A O no hydrogen 2.745 N/A CYS 213.A SG PHE 177.A O no hydrogen 3.580 N/A ASP 214.A N THR 229.A O no hydrogen 2.884 N/A ILE 216.A N GLY 156.A O no hydrogen 2.850 N/A SER 219.A OG.B PHE 223.A O no hydrogen 2.838 N/A ALA 220.A N PHE 223.A O no hydrogen 2.877 N/A PHE 223.A N ALA 220.A O no hydrogen 2.991 N/A ALA 224.A N LEU 245.A O no hydrogen 2.943 N/A GLN 225.A N SER 218.A O no hydrogen 3.323 N/A GLY 226.A N GLN 243.A O no hydrogen 2.898 N/A GLN 227.A N ILE 215.A O no hydrogen 3.013 N/A GLN 227.A NE2 GLN 225.A OE1 no hydrogen 2.887 N/A VAL 228.A N GLY 241.A O no hydrogen 2.914 N/A THR 229.A N ASP 214.A O no hydrogen 2.895 N/A LEU 230.A N ALA 239.A O no hydrogen 2.836 N/A TRP 231.A N LEU 212.A O no hydrogen 2.944 N/A TRP 231.A NE1 ASP 214.A OD2 no hydrogen 3.007 N/A ASP 232.A N ARG 236.A O no hydrogen 2.877 N/A GLN 233.A NE2 GLN 120.A OE1 no hydrogen 2.747 N/A SER 234.A N ASP 232.A OD1 no hydrogen 2.916 N/A ARG 236.A N ASP 232.A OD1 no hydrogen 2.862 N/A ARG 236.A NH1 ALA 205.A O no hydrogen 2.958 N/A ARG 236.A NH2 ALA 205.A O no hydrogen 2.765 N/A LEU 237.A N GLN 111.A OE1 no hydrogen 2.882 N/A LEU 238.A N LEU 230.A O no hydrogen 2.819 N/A ALA 239.A N LEU 230.A O no hydrogen 3.253 N/A THR 240.A N ARG 201.A O no hydrogen 2.913 N/A GLY 241.A N VAL 228.A O no hydrogen 2.820 N/A ALA 242.A N SER 199.A O.A no hydrogen 3.111 N/A ALA 242.A N SER 199.A O.B no hydrogen 3.119 N/A GLN 243.A N GLY 226.A O no hydrogen 3.036 N/A GLN 243.A NE2 ASP 179.A OD1 no hydrogen 2.783 N/A SER 244.A N ASP 197.A OD1 no hydrogen 2.929 N/A LEU 245.A N ALA 224.A O no hydrogen 2.786 N/A LEU 246.A N ASN 194.A O no hydrogen 2.743 N/A LEU 247.A N GLY 222.A O no hydrogen 2.866 N/A