Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5aau_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 7.A N MET 4.A O no hydrogen 2.964 N/A SER 7.A OG MET 4.A O no hydrogen 2.677 N/A LEU 8.A N ALA 5.A O no hydrogen 3.196 N/A THR 9.A N GLN 12.A OE1 no hydrogen 2.859 N/A GLN 12.A N THR 9.A OG1 no hydrogen 3.182 N/A MET 13.A N THR 9.A O no hydrogen 2.880 N/A VAL 14.A N ALA 10.A O no hydrogen 2.879 N/A SER 15.A N ASP 11.A O no hydrogen 3.107 N/A SER 15.A OG ASP 11.A O no hydrogen 2.907 N/A ALA 16.A N GLN 12.A O no hydrogen 2.851 N/A LEU 17.A N MET 13.A O no hydrogen 2.905 N/A LEU 18.A N VAL 14.A O no hydrogen 2.983 N/A ASP 19.A N SER 15.A O no hydrogen 3.065 N/A ALA 20.A N ALA 16.A O no hydrogen 3.077 N/A GLU 21.A N LEU 18.A O no hydrogen 3.270 N/A SER 27.A N ASN 96.A OD1 no hydrogen 2.841 N/A TYR 29.A OH ASN 96.A O no hydrogen 2.752 N/A GLY 33.A N SER 30.A OG no hydrogen 3.239 N/A LEU 34.A N SER 30.A O no hydrogen 3.218 N/A LEU 35.A N MET 31.A O no hydrogen 3.080 N/A THR 36.A N MET 32.A O no hydrogen 2.916 N/A THR 36.A OG1 MET 32.A O no hydrogen 2.670 N/A ASN 37.A N GLY 33.A O no hydrogen 2.816 N/A ASN 37.A ND2 GLU 28.A OE2 no hydrogen 3.456 N/A LEU 38.A N LEU 34.A O no hydrogen 3.040 N/A ALA 39.A N LEU 35.A O no hydrogen 3.024 N/A ASP 40.A N THR 36.A O no hydrogen 2.844 N/A ARG 41.A N ASN 37.A O no hydrogen 3.064 N/A ARG 41.A NE ASN 37.A OD1 no hydrogen 2.969 N/A ARG 41.A NH1 TYR 26.A O no hydrogen 2.684 N/A ARG 41.A NH2 TYR 26.A O no hydrogen 2.940 N/A ARG 41.A NH2 ASN 37.A OD1 no hydrogen 2.601 N/A GLU 42.A N LEU 38.A O no hydrogen 2.844 N/A LEU 43.A N ALA 39.A O no hydrogen 2.955 N/A MET 46.A N GLU 42.A O no hydrogen 2.806 N/A ILE 47.A N LEU 43.A O no hydrogen 3.002 N/A ASN 48.A N.A VAL 44.A O no hydrogen 3.521 N/A TRP 49.A N HIS 45.A O no hydrogen 2.876 N/A ALA 50.A N MET 46.A O no hydrogen 2.730 N/A LYS 51.A N ILE 47.A O no hydrogen 3.191 N/A LYS 51.A NZ GLN 64.A OE1 no hydrogen 2.676 N/A ARG 52.A N TRP 49.A O no hydrogen 2.924 N/A ARG 52.A NH2 ASP 19.A OD2.B no hydrogen 2.954 N/A VAL 53.A N ALA 50.A O no hydrogen 2.962 N/A PHE 56.A N VAL 53.A O no hydrogen 3.064 N/A ASP 58.A N GLY 55.A O no hydrogen 2.946 N/A LEU 59.A N PHE 56.A O no hydrogen 3.059 N/A ASP 63.A N THR 60.A OG1 no hydrogen 3.173 N/A GLN 64.A N THR 60.A O no hydrogen 2.806 N/A GLN 64.A NE2 LEU 59.A O no hydrogen 2.930 N/A VAL 65.A N LEU 61.A O no hydrogen 3.073 N/A HIS 66.A N.A HIS 62.A O no hydrogen 3.086 N/A HIS 66.A N.B HIS 62.A O no hydrogen 3.103 N/A LEU 67.A N ASP 63.A O no hydrogen 3.114 N/A LEU 68.A N GLN 64.A O no hydrogen 3.006 N/A GLU 69.A N VAL 65.A O no hydrogen 2.866 N/A SER 70.A N.A HIS 66.A O.A no hydrogen 3.118 N/A SER 70.A N.A HIS 66.A O.B no hydrogen 3.139 N/A SER 70.A N.B HIS 66.A O.A no hydrogen 3.112 N/A SER 70.A N.B HIS 66.A O.B no hydrogen 3.133 N/A SER 70.A OG.A HIS 66.A O.A no hydrogen 3.049 N/A SER 70.A OG.A HIS 66.A O.B no hydrogen 2.999 N/A SER 70.A OG.B SER 145.A OG.A no hydrogen 2.589 N/A ALA 71.A N LEU 67.A O no hydrogen 2.979 N/A ALA 71.A N LEU 68.A O no hydrogen 3.190 N/A TRP 72.A N LEU 68.A O no hydrogen 2.930 N/A ILE 75.A N ALA 71.A O no hydrogen 2.954 N/A LEU 76.A N TRP 72.A O no hydrogen 2.929 N/A MET 77.A N LEU 73.A O no hydrogen 2.856 N/A ILE 78.A N GLU 74.A O no hydrogen 2.797 N/A GLY 79.A N ILE 75.A O no hydrogen 3.203 N/A LEU 80.A N LEU 76.A O no hydrogen 2.992 N/A VAL 81.A N MET 77.A O no hydrogen 2.949 N/A TRP 82.A N ILE 78.A O no hydrogen 2.906 N/A ARG 83.A N GLY 79.A O no hydrogen 3.077 N/A ARG 83.A NE LEU 92.A O no hydrogen 2.941 N/A ARG 83.A NH2 GLU 42.A OE2 no hydrogen 3.143 N/A ARG 83.A NH2 PHE 93.A O no hydrogen 2.946 N/A SER 84.A N LEU 80.A O no hydrogen 3.000 N/A SER 84.A OG LEU 80.A O no hydrogen 2.661 N/A MET 85.A N TRP 82.A O no hydrogen 3.337 N/A HIS 87.A N SER 84.A O no hydrogen 2.917 N/A LYS 90.A N HIS 87.A O no hydrogen 2.943 N/A LEU 91.A N LEU 99.A O no hydrogen 2.855 N/A LEU 92.A N SER 84.A OG no hydrogen 2.782 N/A ALA 94.A N LEU 97.A O no hydrogen 3.122 N/A ASN 96.A ND2 SER 27.A O no hydrogen 2.953 N/A LEU 97.A N ALA 94.A O no hydrogen 2.743 N/A LEU 99.A N LEU 91.A O no hydrogen 2.902 N/A ASP 100.A N GLN 103.A OE1 no hydrogen 2.618 N/A ARG 101.A NE ASP 115.A OD1 no hydrogen 2.718 N/A ARG 101.A NE ASP 115.A OD2 no hydrogen 3.135 N/A ARG 101.A NH2 ASP 115.A OD2 no hydrogen 2.694 N/A ASN 102.A N ASP 100.A OD1 no hydrogen 2.916 N/A GLN 103.A N ASP 100.A OD1 no hydrogen 3.180 N/A GLY 104.A N ASP 100.A O no hydrogen 3.141 N/A LYS 105.A N ASN 102.A O no hydrogen 3.044 N/A SER 106.A N GLN 103.A O no hydrogen 2.971 N/A SER 106.A OG GLN 103.A O no hydrogen 2.818 N/A VAL 107.A N GLY 104.A O no hydrogen 3.260 N/A MET 110.A N VAL 107.A O no hydrogen 2.977 N/A PHE 114.A N MET 110.A O no hydrogen 2.878 N/A ASP 115.A N VAL 111.A O no hydrogen 2.855 N/A MET 116.A N GLU 112.A O no hydrogen 3.085 N/A LEU 117.A N ILE 113.A O no hydrogen 2.946 N/A LEU 118.A N PHE 114.A O no hydrogen 2.840 N/A ALA 119.A N ASP 115.A O no hydrogen 3.023 N/A THR 120.A N MET 116.A O no hydrogen 2.963 N/A THR 120.A OG1 MET 116.A O no hydrogen 2.862 N/A SER 121.A N LEU 117.A O no hydrogen 2.941 N/A SER 121.A OG VAL 81.A O no hydrogen 3.096 N/A SER 122.A N LEU 118.A O no hydrogen 3.010 N/A SER 122.A OG ALA 119.A O no hydrogen 3.468 N/A ARG 123.A N ALA 119.A O no hydrogen 2.880 N/A PHE 124.A N THR 120.A O no hydrogen 2.963 N/A ARG 125.A N SER 121.A O no hydrogen 2.997 N/A ARG 125.A NH1 MET 85.A O no hydrogen 2.540 N/A MET 126.A N SER 122.A O no hydrogen 2.952 N/A MET 127.A N ARG 123.A O no hydrogen 2.915 N/A ASN 128.A N ARG 125.A O no hydrogen 2.942 N/A ASN 128.A ND2 ARG 125.A O no hydrogen 2.803 N/A LEU 129.A N PHE 124.A O no hydrogen 2.918 N/A GLN 130.A N GLU 133.A OE1 no hydrogen 2.893 N/A GLN 130.A NE2 ASN 128.A O no hydrogen 2.740 N/A GLU 132.A N GLU 132.A OE1 no hydrogen 3.043 N/A PHE 134.A N GLN 130.A O no hydrogen 2.835 N/A VAL 135.A N GLY 131.A O no hydrogen 3.076 N/A CYS 136.A N GLU 132.A O no hydrogen 3.452 N/A CYS 136.A SG GLU 132.A O no hydrogen 3.368 N/A LEU 137.A N GLU 133.A O no hydrogen 2.909 N/A LYS 138.A N PHE 134.A O no hydrogen 2.956 N/A LYS 138.A NZ GLU 21.A OE1 no hydrogen 2.766 N/A LYS 138.A NZ GLU 21.A OE2 no hydrogen 3.518 N/A SER 139.A N VAL 135.A O no hydrogen 3.163 N/A SER 139.A OG VAL 135.A O no hydrogen 3.460 N/A ILE 140.A N CYS 136.A O no hydrogen 2.957 N/A ILE 141.A N LEU 137.A O no hydrogen 3.027 N/A LEU 142.A N LYS 138.A O no hydrogen 3.283 N/A LEU 143.A N SER 139.A O no hydrogen 3.169 N/A ASN 144.A N ILE 140.A O no hydrogen 2.843 N/A SER 145.A N ILE 141.A O no hydrogen 2.914 N/A SER 145.A OG.A SER 70.A O.A no hydrogen 3.267 N/A SER 145.A OG.A SER 70.A O.B no hydrogen 3.110 N/A SER 145.A OG.A SER 70.A OG.B no hydrogen 2.589 N/A SER 145.A OG.A GLU 74.A OE2 no hydrogen 2.669 N/A SER 145.A OG.B GLU 74.A OE1 no hydrogen 2.804 N/A SER 145.A OG.B GLU 74.A OE2 no hydrogen 3.026 N/A SER 145.A OG.B ILE 141.A O no hydrogen 3.021 N/A VAL 147.A N ASN 144.A O no hydrogen 3.065 N/A TYR 148.A OH HIS 157.A NE2.A no hydrogen 2.974 N/A THR 149.A N GLY 146.A O no hydrogen 3.447 N/A THR 149.A OG1 HIS 66.A NE2.A no hydrogen 2.842 N/A THR 149.A OG1 GLY 146.A O no hydrogen 3.499 N/A HIS 155.A N GLU 152.A O no hydrogen 2.997 N/A ILE 156.A N GLU 152.A O no hydrogen 3.350 N/A HIS 157.A N LYS 153.A O no hydrogen 3.123 N/A ARG 158.A N ASP 154.A O no hydrogen 2.878 N/A VAL 159.A N HIS 155.A O no hydrogen 2.791 N/A LEU 160.A N ILE 156.A O no hydrogen 2.817 N/A ASP 161.A N HIS 157.A O no hydrogen 2.963 N/A LYS 162.A N ARG 158.A O no hydrogen 2.987 N/A ILE 163.A N VAL 159.A O no hydrogen 2.995 N/A THR 164.A N LEU 160.A O no hydrogen 2.967 N/A THR 164.A OG1 LEU 160.A O no hydrogen 3.096 N/A ASP 165.A N ASP 161.A O no hydrogen 2.895 N/A THR 166.A N LYS 162.A O no hydrogen 2.928 N/A THR 166.A OG1 LYS 162.A O no hydrogen 2.729 N/A LEU 167.A N ILE 163.A O no hydrogen 3.021 N/A ILE 168.A N THR 164.A O no hydrogen 2.931 N/A HIS 169.A N ASP 165.A O no hydrogen 2.957 N/A LEU 170.A N THR 166.A O no hydrogen 3.038 N/A MET 171.A N LEU 167.A O no hydrogen 2.934 N/A ALA 172.A N ILE 168.A O no hydrogen 2.760 N/A LYS 173.A N HIS 169.A O no hydrogen 2.710 N/A ALA 174.A N LEU 170.A O no hydrogen 2.940 N/A GLY 175.A N ALA 172.A O no hydrogen 2.921 N/A LEU 176.A N MET 171.A O no hydrogen 3.087 N/A THR 177.A N GLN 180.A OE1 no hydrogen 2.784 N/A GLN 180.A N THR 177.A OG1 no hydrogen 3.006 N/A GLN 181.A N THR 177.A O no hydrogen 2.662 N/A GLN 181.A NE2 LEU 176.A O no hydrogen 3.031 N/A HIS 182.A N LEU 178.A O no hydrogen 3.012 N/A GLN 183.A N GLN 179.A O no hydrogen 2.986 N/A ARG 184.A N GLN 180.A O no hydrogen 3.026 N/A ARG 184.A NE GLU 133.A OE2 no hydrogen 2.752 N/A ARG 184.A NH1 MET 127.A O no hydrogen 2.753 N/A ARG 184.A NH2 MET 127.A O no hydrogen 3.021 N/A ARG 184.A NH2 ASN 128.A O no hydrogen 3.305 N/A ARG 184.A NH2 GLU 133.A OE1 no hydrogen 2.793 N/A ARG 184.A NH2 GLU 133.A OE2 no hydrogen 3.372 N/A LEU 185.A N GLN 181.A O no hydrogen 2.790 N/A ALA 186.A N HIS 182.A O no hydrogen 2.949 N/A GLN 187.A N GLN 183.A O no hydrogen 2.987 N/A LEU 188.A N ARG 184.A O no hydrogen 3.013 N/A LEU 189.A N LEU 185.A O no hydrogen 2.933 N/A LEU 190.A N ALA 186.A O no hydrogen 2.916 N/A ILE 191.A N GLN 187.A O no hydrogen 3.129 N/A LEU 192.A N LEU 188.A O no hydrogen 3.367 N/A SER 193.A N LEU 190.A O no hydrogen 2.929 N/A SER 193.A OG.A LEU 190.A O no hydrogen 2.441 N/A HIS 194.A N LEU 190.A O no hydrogen 3.428 N/A ILE 195.A N ILE 191.A O no hydrogen 2.931 N/A ARG 196.A N LEU 192.A O no hydrogen 3.031 N/A HIS 197.A N SER 193.A O no hydrogen 3.045 N/A MET 198.A N HIS 194.A O no hydrogen 2.828 N/A SER 199.A N ILE 195.A O no hydrogen 2.938 N/A ASN 200.A N ARG 196.A O no hydrogen 2.858 N/A LYS 201.A N HIS 197.A O no hydrogen 2.963 N/A GLY 202.A N MET 198.A O no hydrogen 2.741 N/A MET 203.A N SER 199.A O no hydrogen 2.869 N/A GLU 204.A N ASN 200.A O no hydrogen 3.065 N/A HIS 205.A N LYS 201.A O no hydrogen 3.016 N/A HIS 205.A NE2 GLU 108.A O no hydrogen 2.901 N/A LEU 206.A N GLY 202.A O no hydrogen 2.806 N/A TYR 207.A N MET 203.A O no hydrogen 2.836 N/A SER 208.A N GLU 204.A O no hydrogen 2.900 N/A SER 208.A N HIS 205.A O no hydrogen 2.851 N/A SER 208.A OG HIS 205.A O no hydrogen 2.726 N/A MET 209.A N LEU 206.A O no hydrogen 3.248 N/A TYR 214.A OH HIS 66.A NE2.B no hydrogen 3.145 N/A LEU 216.A N SER 213.A OG no hydrogen 3.105 N/A LEU 217.A N SER 213.A O no hydrogen 3.097 N/A LEU 218.A N TYR 214.A O no hydrogen 2.985 N/A GLU 219.A N ASP 215.A O no hydrogen 3.111 N/A MET 220.A N LEU 216.A O no hydrogen 2.924 N/A LEU 221.A N LEU 217.A O no hydrogen 2.761 N/A ASP 222.A N LEU 218.A O no hydrogen 2.848 N/A ALA 223.A N GLU 219.A O no hydrogen 2.804 N/A HIS 224.A N MET 220.A O no hydrogen 3.111 N/A HIS 224.A NE2 ASN 48.A OD1.B no hydrogen 3.179 N/A ARG 225.A N ASP 222.A O no hydrogen 3.123 N/A ARG 225.A NE ASP 222.A OD1 no hydrogen 2.856 N/A ARG 225.A NH2 ASP 222.A OD1 no hydrogen 3.388 N/A ARG 225.A NH2 ASP 222.A OD2 no hydrogen 3.015 N/A LEU 226.A N ALA 223.A O no hydrogen 2.839 N/A HIS 227.A N HIS 224.A O no hydrogen 3.098 N/A