Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6lit_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A NZ THR 8.A OG1 no hydrogen 3.075 N/A ALA 5.A N GLY 1.A O no hydrogen 3.094 N/A LEU 6.A N ASP 2.A O no hydrogen 2.934 N/A THR 7.A N ILE 3.A O no hydrogen 2.873 N/A THR 7.A OG1 ILE 3.A O no hydrogen 2.855 N/A THR 8.A N LYS 4.A O no hydrogen 2.797 N/A THR 8.A OG1 LYS 4.A O no hydrogen 3.146 N/A LEU 9.A N ALA 5.A O no hydrogen 2.865 N/A CYS 10.A N LEU 6.A O no hydrogen 2.903 N/A CYS 10.A SG LEU 6.A O no hydrogen 3.427 N/A ASP 11.A N THR 7.A O no hydrogen 2.938 N/A LEU 12.A N THR 8.A O no hydrogen 2.899 N/A ALA 13.A N LEU 9.A O no hydrogen 3.074 N/A ASP 14.A N CYS 10.A O no hydrogen 3.076 N/A ARG 15.A N ASP 11.A O no hydrogen 3.094 N/A ARG 15.A NH2 ASP 11.A OD2 no hydrogen 2.935 N/A GLU 16.A N LEU 12.A O no hydrogen 2.897 N/A LEU 17.A N ALA 13.A O no hydrogen 2.915 N/A ILE 20.A N GLU 16.A O no hydrogen 2.783 N/A ILE 21.A N LEU 17.A O no hydrogen 2.910 N/A GLY 22.A N VAL 18.A O no hydrogen 3.226 N/A TRP 23.A N VAL 19.A O no hydrogen 2.824 N/A ALA 24.A N ILE 20.A O no hydrogen 2.847 N/A LYS 25.A N ILE 21.A O no hydrogen 3.051 N/A HIS 26.A N TRP 23.A O no hydrogen 3.080 N/A HIS 26.A ND1 GLY 22.A O no hydrogen 3.013 N/A ILE 27.A N ALA 24.A O no hydrogen 2.958 N/A PHE 30.A N ILE 27.A O no hydrogen 2.899 N/A SER 31.A OG LYS 25.A O no hydrogen 2.848 N/A SER 32.A N GLY 29.A O no hydrogen 2.970 N/A LEU 33.A N PHE 30.A O no hydrogen 3.009 N/A SER 34.A OG GLU 124.A OE1 no hydrogen 2.583 N/A ASP 37.A N SER 34.A OG no hydrogen 3.165 N/A GLN 38.A N SER 34.A O no hydrogen 2.808 N/A GLN 38.A NE2 LEU 33.A O no hydrogen 3.024 N/A MET 39.A N LEU 35.A O no hydrogen 2.926 N/A SER 40.A N GLY 36.A O no hydrogen 2.890 N/A SER 40.A OG GLY 36.A O no hydrogen 3.007 N/A LEU 41.A N ASP 37.A O no hydrogen 3.076 N/A LEU 42.A N GLN 38.A O no hydrogen 3.128 N/A GLN 43.A N MET 39.A O no hydrogen 2.831 N/A SER 44.A N SER 40.A O no hydrogen 2.978 N/A ALA 45.A N LEU 41.A O no hydrogen 2.868 N/A ALA 45.A N LEU 42.A O no hydrogen 3.146 N/A ILE 49.A N ALA 45.A O no hydrogen 3.074 N/A LEU 50.A N TRP 46.A O no hydrogen 2.950 N/A ILE 51.A N MET 47.A O no hydrogen 2.884 N/A LEU 52.A N GLU 48.A O no hydrogen 3.050 N/A GLY 53.A N ILE 49.A O no hydrogen 3.187 N/A ILE 54.A N LEU 50.A O no hydrogen 3.121 N/A VAL 55.A N ILE 51.A O no hydrogen 2.876 N/A TYR 56.A N LEU 52.A O no hydrogen 3.078 N/A ARG 57.A N GLY 53.A O no hydrogen 3.055 N/A ARG 57.A NE VAL 66.A O no hydrogen 2.974 N/A SER 58.A N ILE 54.A O no hydrogen 2.924 N/A SER 58.A N VAL 55.A O no hydrogen 3.091 N/A SER 58.A OG ILE 54.A O no hydrogen 2.658 N/A LEU 59.A N TYR 56.A O no hydrogen 3.370 N/A TYR 61.A N SER 58.A O no hydrogen 2.972 N/A LEU 65.A N MET 73.A O no hydrogen 2.864 N/A VAL 66.A N SER 58.A OG no hydrogen 2.923 N/A TYR 67.A N TYR 71.A O no hydrogen 2.910 N/A ALA 68.A N TYR 71.A O no hydrogen 3.249 N/A TYR 71.A N ALA 68.A O no hydrogen 3.166 N/A MET 73.A N LEU 65.A O no hydrogen 2.838 N/A GLU 76.A N GLU 76.A OE1 no hydrogen 2.547 N/A HIS 77.A N ASP 74.A OD1 no hydrogen 2.957 N/A HIS 77.A ND1 ASP 74.A OD1 no hydrogen 2.697 N/A SER 78.A N ASP 74.A O no hydrogen 3.059 N/A SER 78.A OG ASP 74.A O no hydrogen 2.987 N/A ARG 79.A N GLU 75.A O no hydrogen 2.990 N/A LEU 80.A N GLU 76.A O no hydrogen 3.043 N/A ALA 81.A N SER 78.A O no hydrogen 3.159 N/A GLY 82.A N ARG 79.A O no hydrogen 3.240 N/A LEU 83.A N SER 78.A O no hydrogen 2.857 N/A TYR 87.A N LEU 83.A O no hydrogen 2.755 N/A TYR 87.A OH ASP 63.A O no hydrogen 2.560 N/A ARG 88.A N LEU 84.A O no hydrogen 2.957 N/A ARG 88.A NH1 GLU 75.A OE2 no hydrogen 3.019 N/A ALA 89.A N GLU 85.A O no hydrogen 3.017 N/A ILE 90.A N LEU 86.A O no hydrogen 2.996 N/A LEU 91.A N TYR 87.A O no hydrogen 2.976 N/A GLN 92.A N ARG 88.A O no hydrogen 3.028 N/A GLN 92.A N ALA 89.A O no hydrogen 3.157 N/A LEU 93.A N ALA 89.A O no hydrogen 3.414 N/A VAL 94.A N ILE 90.A O no hydrogen 2.917 N/A ARG 95.A N LEU 91.A O no hydrogen 2.895 N/A ARG 95.A NE GLN 92.A OE1 no hydrogen 3.319 N/A ARG 95.A NH1 ASP 63.A OD1 no hydrogen 3.200 N/A ARG 95.A NH2 GLN 92.A OE1 no hydrogen 2.751 N/A ARG 96.A N GLN 92.A O no hydrogen 3.398 N/A ARG 96.A NH2 LEU 160.A O no hydrogen 3.109 N/A TYR 97.A N LEU 93.A O no hydrogen 2.914 N/A TYR 97.A OH THR 161.A OG1 no hydrogen 2.816 N/A LYS 98.A N VAL 94.A O no hydrogen 2.781 N/A LYS 98.A NZ TYR 61.A O no hydrogen 2.738 N/A LYS 98.A NZ ASP 62.A OD1 no hydrogen 3.348 N/A LYS 99.A N ARG 95.A O no hydrogen 3.028 N/A LEU 100.A N ARG 96.A O no hydrogen 2.999 N/A LYS 101.A N LYS 98.A O no hydrogen 3.053 N/A VAL 102.A N TYR 97.A O no hydrogen 3.100 N/A GLU 103.A N GLU 106.A OE2 no hydrogen 2.603 N/A GLU 105.A N GLU 105.A OE1 no hydrogen 2.708 N/A PHE 107.A N GLU 103.A O no hydrogen 3.004 N/A VAL 108.A N LYS 104.A O no hydrogen 3.229 N/A THR 109.A N GLU 105.A O no hydrogen 3.279 N/A THR 109.A OG1 GLU 105.A O no hydrogen 3.521 N/A LEU 110.A N GLU 106.A O no hydrogen 2.825 N/A LYS 111.A N PHE 107.A O no hydrogen 2.811 N/A ALA 112.A N VAL 108.A O no hydrogen 3.119 N/A LEU 113.A N THR 109.A O no hydrogen 2.956 N/A ALA 114.A N LEU 110.A O no hydrogen 2.816 N/A LEU 115.A N LYS 111.A O no hydrogen 3.073 N/A ALA 116.A N ALA 112.A O no hydrogen 3.095 N/A ASN 117.A N LEU 113.A O no hydrogen 2.806 N/A SER 118.A OG LEU 115.A O no hydrogen 2.811 N/A HIS 122.A N SER 120.A OG no hydrogen 3.154 N/A GLU 124.A N ASP 37.A OD1 no hydrogen 2.668 N/A ASP 125.A N ASP 37.A OD2 no hydrogen 2.906 N/A ALA 128.A N ASP 125.A OD1 no hydrogen 2.976 N/A VAL 129.A N ASP 125.A O no hydrogen 3.168 N/A GLN 130.A N LEU 126.A O no hydrogen 2.875 N/A GLN 130.A NE2 GLN 133.A OE1 no hydrogen 3.409 N/A GLN 130.A NE2 ASP 134.A OD1 no hydrogen 2.969 N/A LYS 131.A N GLU 127.A O no hydrogen 2.893 N/A LYS 131.A NZ ALA 128.A O no hydrogen 3.214 N/A LEU 132.A N ALA 128.A O no hydrogen 3.088 N/A GLN 133.A N VAL 129.A O no hydrogen 2.919 N/A GLN 133.A NE2 ALA 116.A O no hydrogen 3.374 N/A ASP 134.A N GLN 130.A O no hydrogen 2.908 N/A LEU 135.A N LYS 131.A O no hydrogen 3.064 N/A LEU 136.A N LEU 132.A O no hydrogen 2.944 N/A HIS 137.A N GLN 133.A O no hydrogen 2.864 N/A GLU 138.A N ASP 134.A O no hydrogen 2.950 N/A ALA 139.A N LEU 135.A O no hydrogen 2.811 N/A LEU 140.A N LEU 136.A O no hydrogen 3.281 N/A GLN 141.A N HIS 137.A O no hydrogen 3.054 N/A GLN 141.A NE2 HIS 137.A NE2 no hydrogen 3.013 N/A ASP 142.A N GLU 138.A O no hydrogen 2.807 N/A TYR 143.A N ALA 139.A O no hydrogen 3.036 N/A TYR 143.A OH GLU 103.A OE2 no hydrogen 2.912 N/A GLU 144.A N LEU 140.A O no hydrogen 2.924 N/A LEU 145.A N GLN 141.A O no hydrogen 2.894 N/A SER 146.A N ASP 142.A O no hydrogen 3.079 N/A GLN 147.A N TYR 143.A O no hydrogen 2.823 N/A GLN 147.A NE2 SER 146.A OG no hydrogen 2.504 N/A HIS 148.A N GLU 144.A O no hydrogen 2.927 N/A HIS 148.A NE2 GLU 103.A OE2 no hydrogen 2.871 N/A GLU 150.A N GLU 150.A OE1 no hydrogen 2.634 N/A GLU 151.A N HIS 148.A O no hydrogen 2.964 N/A ARG 154.A N GLU 151.A O no hydrogen 3.116 N/A ARG 154.A NE GLU 106.A OE1 no hydrogen 2.889 N/A ARG 154.A NH1 LEU 100.A O no hydrogen 2.945 N/A ARG 154.A NH1 LYS 101.A O no hydrogen 3.329 N/A ARG 154.A NH1 GLU 106.A OE1 no hydrogen 3.158 N/A ARG 154.A NH1 GLU 106.A OE2 no hydrogen 2.999 N/A ARG 154.A NH2 LEU 100.A O no hydrogen 2.903 N/A ARG 154.A NH2 GLU 151.A OE2 no hydrogen 3.039 N/A THR 155.A OG1 GLN 141.A OE1 no hydrogen 3.370 N/A LYS 157.A N TRP 153.A O no hydrogen 3.125 N/A LYS 157.A NZ GLU 151.A OE1 no hydrogen 2.677 N/A LEU 158.A N ARG 154.A O no hydrogen 3.020 N/A LEU 159.A N THR 155.A O no hydrogen 2.839 N/A LEU 160.A N GLY 156.A O no hydrogen 2.895 N/A THR 161.A N LEU 158.A O no hydrogen 3.052 N/A THR 161.A OG1 TYR 97.A OH no hydrogen 2.816 N/A THR 161.A OG1 LEU 158.A O no hydrogen 2.800 N/A LEU 162.A N LEU 159.A O no hydrogen 3.017 N/A LEU 165.A N THR 161.A O no hydrogen 3.050 N/A ARG 166.A N LEU 162.A O no hydrogen 2.916 N/A ARG 166.A NE GLU 48.A OE2 no hydrogen 3.012 N/A ARG 166.A NH1 ASP 119.A OD2 no hydrogen 2.785 N/A ARG 166.A NH2 ASN 117.A O no hydrogen 2.736 N/A ARG 166.A NH2 ASP 119.A OD2 no hydrogen 3.131 N/A GLN 167.A N PRO 163.A O no hydrogen 2.891 N/A THR 168.A N LEU 164.A O no hydrogen 2.870 N/A THR 168.A OG1 LEU 164.A O no hydrogen 2.783 N/A ALA 169.A N LEU 165.A O no hydrogen 2.883 N/A ALA 170.A N ARG 166.A O no hydrogen 2.975 N/A LYS 171.A N GLN 167.A O no hydrogen 3.103 N/A ALA 172.A N THR 168.A O no hydrogen 2.976 N/A VAL 173.A N ALA 169.A O no hydrogen 2.941 N/A GLN 174.A N ALA 170.A O no hydrogen 3.126 N/A HIS 175.A N LYS 171.A O no hydrogen 2.994 N/A PHE 176.A N ALA 172.A O no hydrogen 3.036 N/A TYR 177.A N VAL 173.A O no hydrogen 2.842 N/A SER 178.A N GLN 174.A O no hydrogen 2.891 N/A SER 178.A OG GLN 174.A O no hydrogen 3.415 N/A SER 178.A OG GLN 174.A OE1 no hydrogen 3.080 N/A VAL 179.A N HIS 175.A O no hydrogen 2.974 N/A LYS 180.A N PHE 176.A O no hydrogen 2.825 N/A LYS 180.A NZ GLU 196.A OE2 no hydrogen 2.437 N/A LEU 181.A N TYR 177.A O no hydrogen 3.021 N/A GLN 182.A N SER 178.A O no hydrogen 3.104 N/A GLY 183.A N VAL 179.A O no hydrogen 3.310 N/A HIS 188.A NE2 ASP 11.A OD1 no hydrogen 2.807 N/A PHE 191.A N ASP 14.A OD1 no hydrogen 2.737 N/A LEU 192.A N HIS 188.A O no hydrogen 2.972 N/A GLU 193.A N LYS 189.A O no hydrogen 2.877 N/A MET 194.A N LEU 190.A O no hydrogen 3.068 N/A LEU 195.A N PHE 191.A O no hydrogen 2.830 N/A GLU 196.A N LEU 192.A O no hydrogen 2.894 N/A ALA 197.A N MET 194.A O no hydrogen 3.366 N/A