Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3nd1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N PRO 125.A O no hydrogen 2.702 N/A GLU 4.A N GLY 97.A O no hydrogen 2.925 N/A LEU 5.A N THR 127.A O no hydrogen 2.790 N/A SER 6.A N VAL 99.A O no hydrogen 2.855 N/A LEU 7.A N LYS 129.A O no hydrogen 2.826 N/A ILE 8.A N LEU 101.A O no hydrogen 2.860 N/A GLY 9.A N ILE 131.A O no hydrogen 2.883 N/A ILE 10.A N VAL 103.A O no hydrogen 2.892 N/A GLY 11.A N GLY 105.A O no hydrogen 3.299 N/A THR 12.A N HIS 17.A ND1 no hydrogen 3.050 N/A THR 12.A OG1 VAL 201.A O no hydrogen 3.325 N/A ARG 16.A N ASN 14.A OD1 no hydrogen 2.864 N/A HIS 17.A N ASN 14.A O no hydrogen 2.920 N/A ILE 18.A N PRO 15.A O no hydrogen 3.514 N/A ALA 22.A N THR 19.A OG1 no hydrogen 3.011 N/A VAL 23.A N THR 19.A O no hydrogen 3.039 N/A ASP 24.A N GLY 20.A O no hydrogen 2.931 N/A ALA 25.A N GLN 21.A O no hydrogen 3.042 N/A MET 26.A N ALA 22.A O no hydrogen 2.930 N/A ASN 27.A N VAL 23.A O no hydrogen 2.952 N/A ALA 28.A N ASP 24.A O no hydrogen 2.936 N/A ALA 29.A N MET 26.A O no hydrogen 3.088 N/A ASP 30.A N ARG 98.A O no hydrogen 2.769 N/A LEU 31.A N ARG 98.A O no hydrogen 3.142 N/A ILE 32.A N LYS 62.A O no hydrogen 2.881 N/A LEU 33.A N ALA 100.A O no hydrogen 2.956 N/A ILE 34.A N ILE 64.A O no hydrogen 2.986 N/A LEU 36.A N PHE 66.A O no hydrogen 2.836 N/A LYS 41.A NZ HIS 231.A O no hydrogen 2.924 N/A SER 42.A N ASP 40.A OD1 no hydrogen 3.189 N/A SER 42.A OG ASP 40.A OD1 no hydrogen 2.646 N/A SER 42.A OG ASP 40.A OD2 no hydrogen 3.359 N/A ASP 43.A N ASP 40.A O no hydrogen 3.395 N/A LEU 44.A N LYS 41.A O no hydrogen 3.240 N/A ARG 48.A N LEU 44.A O no hydrogen 3.043 N/A ARG 48.A NE LEU 102.A O no hydrogen 2.854 N/A ARG 48.A NH1 ASP 43.A OD1 no hydrogen 3.331 N/A ARG 48.A NH1 ASP 43.A OD2 no hydrogen 3.132 N/A ARG 48.A NH2 ASP 43.A OD1 no hydrogen 3.249 N/A ARG 48.A NH2 LEU 102.A O no hydrogen 3.423 N/A ARG 49.A N ALA 45.A O no hydrogen 3.269 N/A ARG 49.A NH1 ARG 49.A O no hydrogen 3.105 N/A GLN 50.A N GLY 46.A O no hydrogen 2.981 N/A ILE 51.A N LEU 47.A O no hydrogen 2.832 N/A CYS 52.A N ARG 48.A O no hydrogen 2.979 N/A ALA 53.A N ARG 49.A O no hydrogen 2.916 N/A ALA 54.A N GLN 50.A O no hydrogen 2.950 N/A HIS 55.A N CYS 52.A O no hydrogen 3.081 N/A HIS 55.A NE2 PRO 15.A O no hydrogen 2.838 N/A LEU 56.A N CYS 52.A O no hydrogen 2.854 N/A THR 57.A N ASN 27.A OD1 no hydrogen 2.776 N/A THR 57.A OG1 ASN 27.A OD1 no hydrogen 3.332 N/A ASN 58.A N ASN 27.A OD1 no hydrogen 3.135 N/A ASN 58.A ND2 ASN 27.A O no hydrogen 2.830 N/A ALA 60.A N ASN 58.A OD1 no hydrogen 2.943 N/A THR 61.A N ASN 58.A O no hydrogen 3.254 N/A THR 61.A OG1 ALA 29.A O no hydrogen 2.754 N/A LYS 62.A N ASP 30.A O no hydrogen 3.040 N/A LYS 62.A NZ ALA 60.A O no hydrogen 3.039 N/A ILE 64.A N ILE 32.A O no hydrogen 2.880 N/A PHE 66.A N ILE 34.A O no hydrogen 2.970 N/A TRP 76.A N GLY 72.A O no hydrogen 3.163 N/A TRP 76.A NE1 PRO 69.A O no hydrogen 2.747 N/A HIS 77.A N VAL 73.A O no hydrogen 2.920 N/A ASP 78.A N ASP 74.A O no hydrogen 2.953 N/A ALA 79.A N ASP 75.A O no hydrogen 2.851 N/A ILE 80.A N TRP 76.A O no hydrogen 2.876 N/A ALA 81.A N HIS 77.A O no hydrogen 3.028 N/A GLU 82.A N ASP 78.A O no hydrogen 2.922 N/A THR 83.A N ALA 79.A O no hydrogen 2.954 N/A THR 83.A OG1 ALA 79.A O no hydrogen 3.049 N/A TRP 84.A N ILE 80.A O no hydrogen 3.002 N/A LEU 85.A N ALA 81.A O no hydrogen 2.916 N/A SER 86.A N GLU 82.A O no hydrogen 2.907 N/A SER 86.A OG.A GLU 82.A O no hydrogen 3.034 N/A GLU 87.A N THR 83.A O no hydrogen 3.001 N/A ILE 88.A N TRP 84.A O no hydrogen 2.873 N/A THR 89.A N LEU 85.A O no hydrogen 2.799 N/A THR 89.A OG1 LEU 85.A O no hydrogen 3.027 N/A ALA 90.A N SER 86.A O no hydrogen 2.937 N/A HIS 91.A N GLU 87.A O no hydrogen 2.982 N/A VAL 92.A N ILE 88.A O no hydrogen 2.737 N/A LEU 95.A N VAL 92.A O no hydrogen 2.842 N/A GLY 97.A N MET 2.A O no hydrogen 3.036 N/A ARG 98.A N ASP 30.A OD2 no hydrogen 2.825 N/A VAL 99.A N GLU 4.A O no hydrogen 2.892 N/A ALA 100.A N LEU 31.A O no hydrogen 2.839 N/A LEU 101.A N SER 6.A O no hydrogen 2.999 N/A VAL 103.A N ILE 8.A O no hydrogen 2.795 N/A TRP 104.A NE1 ASP 43.A O no hydrogen 2.806 N/A GLY 105.A N GLY 11.A O no hydrogen 2.705 N/A SER 108.A N ASP 106.A OD2 no hydrogen 2.880 N/A SER 108.A OG ASP 106.A OD2 no hydrogen 2.681 N/A LEU 109.A N ASP 106.A O no hydrogen 3.262 N/A THR 113.A N ASP 111.A OD2 no hydrogen 2.896 N/A THR 113.A OG1 ASP 111.A OD2 no hydrogen 2.690 N/A ILE 116.A N SER 112.A O no hydrogen 2.963 N/A ALA 117.A N THR 113.A O no hydrogen 2.853 N/A GLU 118.A N LEU 114.A O no hydrogen 3.274 N/A ARG 119.A N ILE 116.A O no hydrogen 3.021 N/A LEU 120.A N ALA 117.A O no hydrogen 3.012 N/A LYS 121.A N GLU 118.A O no hydrogen 3.163 N/A ARG 123.A N LEU 120.A O no hydrogen 3.054 N/A ARG 123.A NH1 GLU 82.A OE1 no hydrogen 3.540 N/A ARG 123.A NH1 GLU 82.A OE2 no hydrogen 2.694 N/A ARG 123.A NH2 GLU 82.A OE1 no hydrogen 3.227 N/A LEU 124.A N LEU 120.A O no hydrogen 3.134 N/A THR 127.A N ILE 3.A O no hydrogen 2.969 N/A LYS 129.A N LEU 5.A O no hydrogen 2.852 N/A LYS 129.A NZ.A GLU 4.A OE1 no hydrogen 2.900 N/A ILE 131.A N LEU 7.A O no hydrogen 2.906 N/A GLY 133.A N ASP 106.A OD1 no hydrogen 2.944 N/A THR 135.A N GLN 138.A OE1.A no hydrogen 3.188 N/A THR 135.A OG1 GLN 138.A OE1.A no hydrogen 2.793 N/A GLN 138.A N THR 135.A OG1 no hydrogen 3.132 N/A ALA 139.A N THR 135.A O no hydrogen 2.964 N/A LEU 140.A N ALA 136.A O no hydrogen 2.921 N/A CYS 141.A N ILE 137.A O no hydrogen 3.029 N/A CYS 141.A SG ILE 137.A O no hydrogen 3.490 N/A ALA 142.A N GLN 138.A O no hydrogen 2.878 N/A ALA 143.A N ALA 139.A O no hydrogen 2.933 N/A HIS 144.A N LEU 140.A O no hydrogen 3.080 N/A HIS 144.A NE2 TRP 197.A O no hydrogen 2.914 N/A ALA 145.A N ALA 142.A O no hydrogen 2.991 N/A ILE 146.A N CYS 141.A O no hydrogen 2.973 N/A ASN 149.A ND2 ASP 150.A O no hydrogen 2.883 N/A ALA 153.A N ASP 150.A O no hydrogen 2.974 N/A VAL 156.A N THR 174.A O no hydrogen 3.096 N/A THR 158.A N VAL 176.A O no hydrogen 2.899 N/A THR 159.A N THR 158.A OG1 no hydrogen 2.850 N/A GLY 160.A N MET 178.A O no hydrogen 3.040 N/A ARG 161.A NE.A ASP 165.A OD1 no hydrogen 2.672 N/A ARG 161.A NE.A ASP 165.A OD2 no hydrogen 2.901 N/A GLN 162.A N THR 159.A OG1 no hydrogen 3.052 N/A LEU 163.A N THR 159.A O no hydrogen 3.053 N/A ARG 164.A N GLY 160.A O no hydrogen 2.981 N/A ARG 164.A NH1 SER 184.A OG no hydrogen 2.795 N/A ASP 165.A N ARG 161.A O no hydrogen 2.841 N/A HIS 166.A N GLN 162.A O no hydrogen 3.067 N/A GLY 167.A N LEU 163.A O no hydrogen 2.907 N/A TRP 168.A NE1 THR 172.A O no hydrogen 2.921 N/A THR 172.A OG1 PRO 154.A O no hydrogen 3.207 N/A THR 172.A OG1 THR 174.A O no hydrogen 2.794 N/A THR 174.A N THR 172.A OG1 no hydrogen 3.079 N/A VAL 175.A N LEU 240.A O no hydrogen 3.006 N/A VAL 176.A N VAL 156.A O no hydrogen 2.880 N/A ALA 177.A N TYR 238.A O no hydrogen 3.040 N/A MET 178.A N THR 158.A O no hydrogen 2.837 N/A GLU 182.A N ASP 180.A OD1 no hydrogen 3.052 N/A SER 184.A N ASP 180.A OD2 no hydrogen 2.718 N/A SER 184.A OG ASP 180.A OD1 no hydrogen 2.756 N/A SER 184.A OG ASP 180.A OD2 no hydrogen 3.326 N/A GLN 186.A N CYS 183.A O no hydrogen 3.076 N/A GLN 186.A NE2 GLU 182.A O no hydrogen 3.314 N/A GLN 186.A NE2 CYS 183.A O no hydrogen 3.019 N/A SER 187.A N SER 184.A O no hydrogen 2.931 N/A SER 187.A OG.A SER 184.A O no hydrogen 2.722 N/A SER 187.A OG.B SER 184.A O no hydrogen 3.417 N/A LEU 188.A N PHE 185.A O no hydrogen 3.291 N/A LEU 193.A N PRO 190.A O no hydrogen 2.994 N/A THR 194.A N ARG 241.A O no hydrogen 2.869 N/A ILE 195.A N GLY 211.A O no hydrogen 2.897 N/A PHE 196.A N LEU 239.A O no hydrogen 2.862 N/A TRP 197.A N ILE 209.A O no hydrogen 2.797 N/A TRP 197.A NE1 ASP 236.A OD2 no hydrogen 2.838 N/A GLY 198.A N ILE 237.A O no hydrogen 2.969 N/A ALA 199.A N VAL 207.A O no hydrogen 2.961 N/A CYS 200.A N MET 235.A O no hydrogen 2.919 N/A ALA 202.A N GLU 206.A OE1 no hydrogen 2.778 N/A MET 203.A N CYS 200.A O no hydrogen 3.183 N/A GLU 205.A N GLU 205.A OE1 no hydrogen 2.798 N/A GLU 206.A N MET 203.A O no hydrogen 3.008 N/A VAL 207.A N ALA 199.A O no hydrogen 3.105 N/A ILE 209.A N TRP 197.A O no hydrogen 3.063 N/A ARG 210.A NH2 HIS 144.A ND1 no hydrogen 3.151 N/A ARG 210.A NH2 HIS 144.A O no hydrogen 2.810 N/A GLY 211.A N ILE 195.A O no hydrogen 3.027 N/A VAL 213.A N LEU 193.A O no hydrogen 2.975 N/A GLU 215.A N PRO 212.A O no hydrogen 2.922 N/A VAL 216.A N PRO 212.A O no hydrogen 3.121 N/A THR 217.A N VAL 213.A O no hydrogen 3.020 N/A THR 217.A OG1 VAL 213.A O no hydrogen 2.663 N/A ILE 220.A N VAL 216.A O no hydrogen 2.990 N/A LEU 221.A N THR 217.A O no hydrogen 2.964 N/A GLN 222.A N ASP 218.A O no hydrogen 2.994 N/A GLN 222.A NE2 ASP 218.A OD2.B no hydrogen 2.815 N/A ALA 223.A N GLU 219.A O no hydrogen 2.962 N/A ARG 224.A N ILE 220.A O no hydrogen 2.915 N/A ARG 224.A NE ASP 236.A OD1 no hydrogen 3.260 N/A ARG 224.A NE ASP 236.A OD2 no hydrogen 2.906 N/A ARG 224.A NH2 ASP 236.A OD1 no hydrogen 2.880 N/A ALA 225.A N LEU 221.A O no hydrogen 3.039 N/A ASP 226.A N GLN 222.A O no hydrogen 2.907 N/A LEU 227.A N ALA 223.A O no hydrogen 3.087 N/A ARG 228.A N ARG 224.A O no hydrogen 3.036 N/A ALA 229.A N ALA 225.A O no hydrogen 2.891 N/A ARG 230.A N ASP 226.A O no hydrogen 3.054 N/A ARG 230.A NE ASP 226.A OD1 no hydrogen 3.027 N/A ARG 230.A NE ASP 226.A OD2 no hydrogen 3.172 N/A ARG 230.A NH2 ASP 226.A OD2 no hydrogen 3.159 N/A HIS 231.A N LEU 227.A O no hydrogen 2.956 N/A GLY 232.A N ARG 228.A O no hydrogen 2.824 N/A ILE 237.A N GLY 198.A O no hydrogen 2.952 N/A TYR 238.A OH ASP 180.A OD2 no hydrogen 2.614 N/A LEU 239.A N PHE 196.A O no hydrogen 2.889 N/A LEU 240.A N VAL 175.A O no hydrogen 2.739 N/A ARG 241.A N THR 194.A O no hydrogen 2.837 N/A ARG 241.A NH1 LEU 148.A O no hydrogen 2.849 N/A ARG 241.A NH1 THR 174.A OG1 no hydrogen 2.914 N/A ARG 241.A NH2 PRO 147.A O no hydrogen 2.802 N/A ARG 242.A N GLU 173.A O no hydrogen 2.813 N/A ARG 242.A NE GLU 173.A OE1 no hydrogen 2.806 N/A ARG 242.A NH2 GLU 173.A OE1 no hydrogen 3.466 N/A ARG 242.A NH2 GLU 173.A OE2 no hydrogen 3.145 N/A ASN 243.A N GLY 192.A O no hydrogen 2.893 N/A