Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6atr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A N.A GLU 58.A O no hydrogen 3.028 N/A LYS 5.A N.B GLU 58.A O no hydrogen 3.018 N/A LYS 5.A NZ.B LYS 3.A O no hydrogen 2.867 N/A LEU 6.A N.A GLU 30.A O no hydrogen 2.806 N/A LEU 6.A N.B GLU 30.A O no hydrogen 2.849 N/A HIS 7.A N MET 56.A O no hydrogen 2.822 N/A HIS 7.A NE2 GLU 58.A OE2 no hydrogen 2.716 N/A ALA 11.A N PHE 9.A O no hydrogen 2.880 N/A ARG 12.A NE LYS 204.A O no hydrogen 2.940 N/A ARG 12.A NH1 GLU 168.A OE1 no hydrogen 2.875 N/A ARG 12.A NH2 GLU 168.A OE2 no hydrogen 2.849 N/A ARG 14.A N TYR 8.A OH no hydrogen 2.886 N/A ARG 14.A NH1 GLU 103.A OE1 no hydrogen 2.985 N/A ARG 14.A NH2 GLU 103.A OE2 no hydrogen 2.858 N/A MET 15.A N ARG 12.A O no hydrogen 3.185 N/A ARG 19.A N MET 15.A O no hydrogen 3.122 N/A ARG 19.A NE GLU 31.A OE1 no hydrogen 2.740 N/A ARG 19.A NH1 ALA 11.A O no hydrogen 2.954 N/A ARG 19.A NH1 ARG 12.A O no hydrogen 3.313 N/A ARG 19.A NH1 GLU 16.A OE1 no hydrogen 2.731 N/A ARG 19.A NH2 ALA 11.A O no hydrogen 3.100 N/A ARG 19.A NH2 GLU 31.A OE1 no hydrogen 3.252 N/A TRP 20.A N GLU 16.A O no hydrogen 2.949 N/A LEU 21.A N SER 17.A O no hydrogen 3.002 N/A LEU 22.A N THR 18.A O no hydrogen 2.922 N/A ALA 23.A N ARG 19.A O no hydrogen 2.968 N/A ALA 24.A N TRP 20.A O no hydrogen 2.856 N/A ALA 25.A N LEU 21.A O no hydrogen 2.988 N/A GLY 26.A N ALA 23.A O no hydrogen 2.946 N/A VAL 27.A N.A LEU 22.A O no hydrogen 3.058 N/A VAL 27.A N.B LEU 22.A O no hydrogen 3.077 N/A GLU 30.A N PRO 4.A O no hydrogen 2.894 N/A LYS 32.A N LEU 6.A O.A no hydrogen 2.773 N/A LYS 32.A N LEU 6.A O.B no hydrogen 2.995 N/A ILE 34.A N TYR 8.A O no hydrogen 2.840 N/A LYS 35.A N ASP 39.A OD2 no hydrogen 2.861 N/A SER 36.A OG GLU 38.A OE1.A no hydrogen 3.472 N/A ASP 39.A N SER 36.A OG no hydrogen 3.106 N/A LEU 40.A N SER 36.A O no hydrogen 3.285 N/A ASP 41.A N ALA 37.A O no hydrogen 2.820 N/A LYS 42.A N.A GLU 38.A O.A no hydrogen 2.876 N/A LYS 42.A N.A GLU 38.A O.B no hydrogen 2.849 N/A LYS 42.A N.B GLU 38.A O.A no hydrogen 2.898 N/A LYS 42.A N.B GLU 38.A O.B no hydrogen 2.870 N/A LYS 42.A NZ.A ASP 46.A OD2 no hydrogen 3.277 N/A LYS 42.A NZ.B ASP 46.A OD2 no hydrogen 2.450 N/A LEU 43.A N ASP 39.A O no hydrogen 3.238 N/A ARG 44.A N LEU 40.A O no hydrogen 3.012 N/A ARG 44.A NE GLN 52.A O.A no hydrogen 2.912 N/A ARG 44.A NE GLN 52.A O.B no hydrogen 2.782 N/A ARG 44.A NH1 ASP 41.A OD1 no hydrogen 3.347 N/A ARG 44.A NH2 GLN 52.A O.A no hydrogen 3.118 N/A ARG 44.A NH2 GLN 52.A O.B no hydrogen 3.208 N/A ASN 45.A N ASP 41.A O no hydrogen 2.782 N/A ASP 46.A N LYS 42.A O.A no hydrogen 2.867 N/A ASP 46.A N LYS 42.A O.B no hydrogen 3.013 N/A GLY 47.A N ARG 44.A O no hydrogen 3.033 N/A TYR 48.A N.A LEU 43.A O no hydrogen 3.075 N/A TYR 48.A N.B LEU 43.A O no hydrogen 3.083 N/A GLN 52.A N.A LEU 49.A O no hydrogen 3.008 N/A GLN 52.A N.B LEU 49.A O no hydrogen 3.033 N/A MET 56.A N HIS 7.A O no hydrogen 3.286 N/A VAL 57.A N LEU 64.A O.A no hydrogen 2.873 N/A VAL 57.A N LEU 64.A O.B no hydrogen 2.821 N/A VAL 57.A N LEU 64.A O.C no hydrogen 2.930 N/A GLU 58.A N LYS 5.A O.A no hydrogen 2.955 N/A GLU 58.A N LYS 5.A O.B no hydrogen 2.878 N/A ILE 59.A N MET 62.A O no hydrogen 3.041 N/A MET 62.A N ILE 59.A O no hydrogen 2.906 N/A LEU 64.A N.A VAL 57.A O no hydrogen 2.906 N/A LEU 64.A N.B VAL 57.A O no hydrogen 2.908 N/A LEU 64.A N.C VAL 57.A O no hydrogen 2.889 N/A ARG 68.A NE GLU 96.A OE2 no hydrogen 2.812 N/A ARG 68.A NH2 GLU 96.A OE1 no hydrogen 3.197 N/A ILE 70.A N GLN 66.A O no hydrogen 3.068 N/A LEU 71.A N THR 67.A O no hydrogen 2.915 N/A ASN 72.A N ARG 68.A O no hydrogen 2.889 N/A TYR 73.A N ALA 69.A O no hydrogen 3.105 N/A TYR 73.A OH ASP 60.A OD2 no hydrogen 2.527 N/A ILE 74.A N ILE 70.A O no hydrogen 3.071 N/A ALA 75.A N LEU 71.A O no hydrogen 2.835 N/A SER 76.A N ASN 72.A O no hydrogen 3.033 N/A SER 76.A OG ASN 72.A O no hydrogen 3.307 N/A LYS 77.A N TYR 73.A O no hydrogen 2.854 N/A LYS 77.A NZ ASP 60.A OD2 no hydrogen 2.872 N/A TYR 78.A N ILE 74.A O no hydrogen 3.078 N/A ASN 79.A N SER 76.A O no hydrogen 3.250 N/A LEU 80.A N ALA 75.A O no hydrogen 2.815 N/A TYR 81.A OH ASN 72.A OD1 no hydrogen 3.397 N/A TYR 81.A OH ASP 92.A OD1 no hydrogen 2.556 N/A LYS 83.A N GLU 87.A OE1 no hydrogen 2.859 N/A GLU 87.A N ASP 84.A OD1 no hydrogen 2.837 N/A ARG 88.A N.A ASP 84.A O no hydrogen 2.937 N/A ARG 88.A N.B ASP 84.A O no hydrogen 2.938 N/A ARG 88.A NE.B ASP 92.A OD2 no hydrogen 3.161 N/A ALA 89.A N ILE 85.A O.A no hydrogen 2.970 N/A ALA 89.A N ILE 85.A O.B no hydrogen 2.967 N/A LEU 90.A N LYS 86.A O no hydrogen 3.157 N/A ILE 91.A N GLU 87.A O no hydrogen 2.898 N/A ASP 92.A N ARG 88.A O.A no hydrogen 2.715 N/A ASP 92.A N ARG 88.A O.B no hydrogen 2.729 N/A MET 93.A N.A ALA 89.A O no hydrogen 2.953 N/A MET 93.A N.B ALA 89.A O no hydrogen 2.943 N/A TYR 94.A N LEU 90.A O no hydrogen 2.968 N/A ILE 95.A N ILE 91.A O no hydrogen 2.852 N/A GLU 96.A N ASP 92.A O no hydrogen 2.923 N/A GLY 97.A N MET 93.A O.A no hydrogen 3.263 N/A GLY 97.A N MET 93.A O.B no hydrogen 3.200 N/A ILE 98.A N TYR 94.A O no hydrogen 3.023 N/A ALA 99.A N ILE 95.A O no hydrogen 2.788 N/A ASP 100.A N GLU 96.A O no hydrogen 2.972 N/A LEU 101.A N GLY 97.A O no hydrogen 3.153 N/A GLY 102.A N ILE 98.A O no hydrogen 2.722 N/A GLU 103.A N ALA 99.A O no hydrogen 2.789 N/A MET 104.A N.A ASP 100.A O no hydrogen 3.349 N/A MET 104.A N.B ASP 100.A O no hydrogen 3.360 N/A MET 104.A N.B LEU 101.A O no hydrogen 3.125 N/A ILE 105.A N LEU 101.A O no hydrogen 3.163 N/A LEU 106.A N GLY 102.A O no hydrogen 2.805 N/A LEU 107.A N GLU 103.A O no hydrogen 3.101 N/A LEU 108.A N ILE 105.A O no hydrogen 3.216 N/A VAL 110.A N LEU 107.A O no hydrogen 2.995 N/A CYS 111.A N LEU 108.A O no hydrogen 3.034 N/A CYS 111.A SG PRO 112.A O no hydrogen 3.641 N/A GLU 115.A N PRO 112.A O no hydrogen 2.844 N/A LYS 116.A N PRO 113.A O no hydrogen 3.247 N/A LYS 116.A NZ LEU 108.A O no hydrogen 3.565 N/A LYS 119.A N GLU 115.A O no hydrogen 2.995 N/A LEU 120.A N LYS 116.A O no hydrogen 2.889 N/A ALA 121.A N ASP 117.A O no hydrogen 2.993 N/A LEU 122.A N ALA 118.A O no hydrogen 2.918 N/A ILE 123.A N LYS 119.A O no hydrogen 3.023 N/A LYS 124.A N LEU 120.A O no hydrogen 3.017 N/A GLU 125.A N.A ALA 121.A O no hydrogen 2.960 N/A GLU 125.A N.B ALA 121.A O no hydrogen 2.972 N/A LYS 126.A N LEU 122.A O no hydrogen 2.923 N/A ILE 127.A N ILE 123.A O no hydrogen 2.888 N/A LYS 128.A N.A LYS 124.A O no hydrogen 3.043 N/A LYS 128.A N.B LYS 124.A O no hydrogen 3.040 N/A LYS 128.A NZ.B SER 176.A OG no hydrogen 2.616 N/A ASN 129.A N GLU 125.A O.A no hydrogen 2.893 N/A ASN 129.A N GLU 125.A O.B no hydrogen 2.865 N/A ARG 130.A N LYS 126.A O no hydrogen 2.861 N/A TYR 131.A N LYS 126.A O no hydrogen 2.894 N/A PHE 132.A N ILE 127.A O no hydrogen 2.958 N/A ALA 134.A N ARG 130.A O no hydrogen 3.308 N/A PHE 135.A N TYR 131.A O no hydrogen 3.094 N/A GLU 136.A N PHE 132.A O no hydrogen 2.887 N/A LYS 137.A N PRO 133.A O no hydrogen 2.928 N/A VAL 138.A N ALA 134.A O no hydrogen 3.177 N/A LEU 139.A N PHE 135.A O no hydrogen 3.142 N/A LYS 140.A N GLU 136.A O no hydrogen 2.879 N/A SER 141.A N.A LYS 137.A O no hydrogen 2.875 N/A SER 141.A N.A VAL 138.A O no hydrogen 3.146 N/A SER 141.A N.B LYS 137.A O no hydrogen 2.895 N/A SER 141.A N.B VAL 138.A O no hydrogen 3.114 N/A SER 141.A N.C LYS 137.A O no hydrogen 2.889 N/A SER 141.A N.C VAL 138.A O no hydrogen 3.122 N/A SER 141.A OG.A VAL 138.A O no hydrogen 2.580 N/A SER 141.A OG.B LYS 137.A O no hydrogen 2.526 N/A HIS 142.A NE2 LEU 147.A O no hydrogen 2.985 N/A GLY 143.A N LEU 139.A O no hydrogen 2.932 N/A GLN 144.A N HIS 142.A ND1 no hydrogen 2.927 N/A LEU 147.A N ASP 156.A OD1 no hydrogen 2.792 N/A SER 153.A N ASP 156.A OD2 no hydrogen 2.937 N/A ARG 154.A N LEU 80.A O no hydrogen 2.805 N/A ARG 154.A NE HIS 158.A NE2 no hydrogen 3.004 N/A ARG 154.A NH1 ASN 72.A OD1 no hydrogen 2.775 N/A ARG 154.A NH2 HIS 158.A NE2 no hydrogen 3.307 N/A ALA 155.A N SER 153.A OG no hydrogen 3.038 N/A ASP 156.A N SER 153.A O no hydrogen 3.080 N/A ILE 157.A N.A SER 153.A O no hydrogen 3.462 N/A ILE 157.A N.B SER 153.A O no hydrogen 3.475 N/A HIS 158.A N ARG 154.A O no hydrogen 2.849 N/A LEU 159.A N ALA 155.A O no hydrogen 2.927 N/A VAL 160.A N ASP 156.A O no hydrogen 2.959 N/A GLU 161.A N ILE 157.A O.A no hydrogen 2.928 N/A GLU 161.A N ILE 157.A O.B no hydrogen 3.005 N/A LEU 162.A N.A HIS 158.A O no hydrogen 3.100 N/A LEU 162.A N.B HIS 158.A O no hydrogen 3.110 N/A LEU 163.A N LEU 159.A O no hydrogen 2.882 N/A TYR 164.A N VAL 160.A O no hydrogen 3.131 N/A TYR 164.A OH SER 188.A OG no hydrogen 2.666 N/A TYR 165.A N GLU 161.A O no hydrogen 3.321 N/A TYR 165.A OH GLU 161.A OE2 no hydrogen 2.574 N/A VAL 166.A N LEU 162.A O.A no hydrogen 2.850 N/A VAL 166.A N LEU 162.A O.B no hydrogen 2.874 N/A GLU 167.A N.A LEU 163.A O no hydrogen 2.944 N/A GLU 167.A N.B LEU 163.A O no hydrogen 2.950 N/A GLU 168.A N TYR 164.A O no hydrogen 3.160 N/A LEU 169.A N TYR 165.A O no hydrogen 3.169 N/A ASP 170.A N VAL 166.A O no hydrogen 2.909 N/A SER 172.A N ASP 170.A OD1 no hydrogen 2.899 N/A SER 172.A OG ASP 170.A OD1 no hydrogen 2.638 N/A LEU 173.A N ASP 170.A O no hydrogen 3.223 N/A SER 175.A N.A SER 172.A O no hydrogen 3.058 N/A SER 175.A N.B SER 172.A O no hydrogen 3.056 N/A SER 175.A OG.A SER 172.A O no hydrogen 2.746 N/A SER 175.A OG.B SER 172.A O no hydrogen 3.009 N/A PHE 177.A N ILE 174.A O no hydrogen 2.903 N/A LEU 179.A N GLU 136.A OE2 no hydrogen 2.891 N/A LEU 180.A N GLU 136.A OE1 no hydrogen 2.959 N/A LYS 181.A N.A PHE 177.A O no hydrogen 3.092 N/A LYS 181.A N.B PHE 177.A O no hydrogen 3.095 N/A LYS 181.A NZ.A SER 175.A O.A no hydrogen 2.800 N/A LYS 181.A NZ.A SER 175.A O.B no hydrogen 2.749 N/A ALA 182.A N PRO 178.A O no hydrogen 3.015 N/A LEU 183.A N LEU 179.A O no hydrogen 2.945 N/A LYS 184.A N LEU 180.A O no hydrogen 2.941 N/A LYS 184.A NZ GLU 167.A OE1.A no hydrogen 2.640 N/A THR 185.A N LYS 181.A O.A no hydrogen 3.109 N/A THR 185.A N LYS 181.A O.B no hydrogen 3.158 N/A THR 185.A OG1 LYS 181.A O.A no hydrogen 3.302 N/A THR 185.A OG1 LYS 181.A O.B no hydrogen 3.251 N/A ARG 186.A N.A ALA 182.A O no hydrogen 2.935 N/A ARG 186.A N.B ALA 182.A O no hydrogen 2.921 N/A ARG 186.A NH1.B ASP 145.A O no hydrogen 2.834 N/A ARG 186.A NH2.A ASP 145.A O no hydrogen 2.974 N/A ILE 187.A N LEU 183.A O no hydrogen 2.916 N/A SER 188.A N LYS 184.A O no hydrogen 3.013 N/A SER 188.A OG TYR 164.A OH no hydrogen 2.666 N/A SER 188.A OG LYS 184.A O no hydrogen 2.718 N/A ASN 189.A N.A THR 185.A O no hydrogen 3.126 N/A ASN 189.A N.A ARG 186.A O.A no hydrogen 3.140 N/A ASN 189.A N.A ARG 186.A O.B no hydrogen 3.236 N/A ASN 189.A N.B THR 185.A O no hydrogen 3.147 N/A ASN 189.A N.B ARG 186.A O.A no hydrogen 3.136 N/A ASN 189.A N.B ARG 186.A O.B no hydrogen 3.232 N/A LEU 190.A N ILE 187.A O no hydrogen 3.162 N/A THR 192.A OG1 ALA 24.A O no hydrogen 2.796 N/A LYS 194.A N LEU 190.A O no hydrogen 2.763 N/A LYS 194.A NZ ASN 189.A OD1.B no hydrogen 2.861 N/A LYS 195.A N.A PRO 191.A O no hydrogen 3.064 N/A LYS 195.A N.B PRO 191.A O no hydrogen 3.046 N/A LYS 195.A NZ.B GLN 198.A OE1.B no hydrogen 3.555 N/A PHE 196.A N THR 192.A O no hydrogen 3.081 N/A LEU 197.A N VAL 193.A O no hydrogen 2.886 N/A GLN 198.A N.A LYS 194.A O no hydrogen 3.210 N/A GLN 198.A N.A LYS 195.A O.B no hydrogen 2.954 N/A GLN 198.A N.B LYS 194.A O no hydrogen 3.209 N/A GLN 198.A N.B LYS 195.A O.B no hydrogen 2.954 N/A SER 201.A OG PHE 196.A O no hydrogen 2.647 N/A ARG 203.A N SER 201.A OG no hydrogen 3.024 N/A ARG 203.A NE PHE 196.A O no hydrogen 3.488 N/A ARG 203.A NH2 LEU 197.A O no hydrogen 2.896 N/A LYS 204.A N GLU 16.A OE2 no hydrogen 2.876 N/A LYS 204.A NZ GLU 31.A OE2 no hydrogen 2.827 N/A LYS 204.A NZ PRO 202.A O no hydrogen 2.735 N/A SER 211.A N ASP 208.A OD1 no hydrogen 2.892 N/A LEU 212.A N ASP 208.A O no hydrogen 2.929 N/A GLU 213.A N.A GLU 209.A O.A no hydrogen 2.935 N/A GLU 213.A N.A GLU 209.A O.B no hydrogen 2.926 N/A GLU 213.A N.B GLU 209.A O.A no hydrogen 2.933 N/A GLU 213.A N.B GLU 209.A O.B no hydrogen 2.924 N/A GLU 214.A N LYS 210.A O no hydrogen 3.042 N/A ALA 215.A N SER 211.A O no hydrogen 2.922 N/A ARG 216.A N LEU 212.A O no hydrogen 2.931 N/A ARG 216.A NH1 GLU 213.A OE1.A no hydrogen 2.743 N/A LYS 217.A N GLU 213.A O.A no hydrogen 3.097 N/A LYS 217.A N GLU 213.A O.B no hydrogen 3.087 N/A ILE 218.A N GLU 214.A O no hydrogen 2.885 N/A PHE 219.A N ALA 215.A O no hydrogen 2.888 N/A ARG 220.A NH1 ASP 41.A OD1 no hydrogen 3.209 N/A ARG 220.A NH1 ASP 41.A OD2 no hydrogen 3.316 N/A ARG 220.A NH2 ASP 41.A OD2 no hydrogen 3.085 N/A PHE 221.A N ARG 216.A O no hydrogen 3.166 N/A