Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6loc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A N GLU 5.A OE1 no hydrogen 2.956 N/A ILE 6.A N SER 2.A O no hydrogen 2.976 N/A GLU 7.A N LEU 3.A O no hydrogen 3.133 N/A HIS 8.A N THR 4.A O no hydrogen 2.768 N/A LEU 9.A N GLU 5.A O no hydrogen 2.842 N/A VAL 10.A N ILE 6.A O no hydrogen 2.886 N/A GLN 11.A N GLU 7.A O no hydrogen 3.051 N/A GLN 11.A NE2 GLU 7.A O no hydrogen 3.516 N/A SER 12.A N HIS 8.A O no hydrogen 2.929 N/A VAL 13.A N LEU 9.A O no hydrogen 2.915 N/A CYS 14.A N VAL 10.A O no hydrogen 3.057 N/A CYS 14.A SG VAL 10.A O no hydrogen 3.379 N/A CYS 14.A SG ASP 151.A O no hydrogen 3.947 N/A CYS 14.A SG ASP 151.A OD1 no hydrogen 3.318 N/A LYS 15.A N GLN 11.A O no hydrogen 2.974 N/A LYS 15.A NZ GLU 19.A OE2 no hydrogen 2.401 N/A SER 16.A N SER 12.A O no hydrogen 2.934 N/A SER 16.A OG SER 12.A O no hydrogen 2.833 N/A SER 16.A OG ARG 73.A O no hydrogen 2.803 N/A TYR 17.A N VAL 13.A O no hydrogen 2.913 N/A TYR 17.A OH GLU 150.A OE1 no hydrogen 2.910 N/A ARG 18.A N CYS 14.A O no hydrogen 2.925 N/A GLU 19.A N LYS 15.A O no hydrogen 3.114 N/A THR 20.A N TYR 17.A O no hydrogen 3.011 N/A THR 20.A OG1 SER 16.A O no hydrogen 3.037 N/A THR 20.A OG1 TYR 17.A O no hydrogen 3.543 N/A CYS 21.A SG ARG 18.A O no hydrogen 3.475 N/A LEU 23.A N CYS 21.A O no hydrogen 2.749 N/A ASP 27.A N ARG 24.A O no hydrogen 3.013 N/A LEU 28.A N ARG 24.A O no hydrogen 3.386 N/A LEU 29.A N LEU 25.A O no hydrogen 2.924 N/A ARG 30.A N GLU 26.A O no hydrogen 2.844 N/A ARG 30.A NH1 ASP 27.A OD1 no hydrogen 2.507 N/A GLN 31.A N LEU 28.A O no hydrogen 3.311 N/A ARG 32.A N LEU 29.A O no hydrogen 3.144 N/A ASN 34.A N GLN 31.A O no hydrogen 2.811 N/A ASN 34.A ND2 GLN 31.A OE1 no hydrogen 3.093 N/A PHE 36.A N TYR 118.A O no hydrogen 2.924 N/A SER 37.A N GLU 40.A OE1 no hydrogen 3.070 N/A SER 37.A OG GLU 40.A OE1 no hydrogen 3.400 N/A GLU 40.A N SER 37.A OG no hydrogen 3.251 N/A VAL 41.A N SER 37.A O no hydrogen 2.937 N/A THR 42.A N ARG 38.A O no hydrogen 3.022 N/A THR 42.A OG1 ARG 38.A O no hydrogen 3.097 N/A GLY 43.A N GLU 39.A O no hydrogen 3.009 N/A TYR 44.A N GLU 40.A O no hydrogen 3.008 N/A TYR 44.A OH GLU 115.A OE1 no hydrogen 2.335 N/A GLN 45.A N VAL 41.A O no hydrogen 2.861 N/A GLN 45.A NE2 GLU 122.A O.A no hydrogen 3.026 N/A GLN 45.A NE2 GLU 122.A O.B no hydrogen 3.084 N/A ARG 46.A N THR 42.A O no hydrogen 2.958 N/A LYS 47.A N GLY 43.A O no hydrogen 3.228 N/A LYS 47.A N TYR 44.A O no hydrogen 3.349 N/A LYS 47.A NZ GLY 43.A O no hydrogen 3.165 N/A GLU 51.A N SER 48.A OG no hydrogen 3.150 N/A MET 52.A N SER 48.A O no hydrogen 3.130 N/A TRP 53.A N MET 49.A O no hydrogen 3.055 N/A TRP 53.A NE1 LEU 127.A O no hydrogen 3.088 N/A GLU 54.A N.A TRP 50.A O no hydrogen 3.075 N/A GLU 54.A N.B TRP 50.A O no hydrogen 3.103 N/A ARG 55.A N GLU 51.A O no hydrogen 2.995 N/A ARG 55.A NE GLU 115.A OE2 no hydrogen 3.306 N/A ARG 55.A NH1 GLU 51.A OE1 no hydrogen 2.965 N/A ARG 55.A NH2 GLU 115.A OE1 no hydrogen 3.080 N/A CYS 56.A N MET 52.A O no hydrogen 2.850 N/A CYS 56.A SG MET 52.A O no hydrogen 3.354 N/A ALA 57.A N TRP 53.A O no hydrogen 2.691 N/A HIS 58.A N GLU 54.A O.A no hydrogen 2.849 N/A HIS 58.A N GLU 54.A O.B no hydrogen 2.899 N/A HIS 59.A N ARG 55.A O no hydrogen 2.989 N/A HIS 59.A NE2 GLU 115.A OE2 no hydrogen 2.684 N/A LEU 60.A N CYS 56.A O no hydrogen 2.903 N/A THR 61.A N ALA 57.A O no hydrogen 3.008 N/A THR 61.A OG1 ALA 57.A O no hydrogen 2.837 N/A GLU 62.A N HIS 58.A O no hydrogen 3.088 N/A ALA 63.A N HIS 59.A O no hydrogen 3.155 N/A ILE 64.A N LEU 60.A O no hydrogen 2.846 N/A GLN 65.A N THR 61.A O no hydrogen 2.886 N/A TYR 66.A N GLU 62.A O no hydrogen 3.384 N/A VAL 67.A N ALA 63.A O no hydrogen 3.185 N/A VAL 68.A N ILE 64.A O no hydrogen 2.933 N/A GLU 69.A N GLN 65.A O no hydrogen 3.224 N/A PHE 70.A N TYR 66.A O no hydrogen 2.902 N/A ALA 71.A N VAL 67.A O no hydrogen 2.942 N/A LYS 72.A N VAL 68.A O no hydrogen 2.968 N/A LYS 72.A NZ LEU 255.A O no hydrogen 3.065 N/A LYS 72.A NZ ASP 258.A O no hydrogen 3.408 N/A ARG 73.A N GLU 69.A O no hydrogen 3.005 N/A ARG 73.A NH1 GLU 19.A OE1 no hydrogen 3.449 N/A LEU 74.A N ALA 71.A O no hydrogen 2.839 N/A PHE 77.A N LEU 74.A O no hydrogen 2.829 N/A GLU 79.A N GLY 76.A O no hydrogen 3.307 N/A LEU 80.A N PHE 77.A O no hydrogen 3.043 N/A CYS 81.A SG GLN 170.A OE1 no hydrogen 4.012 N/A GLN 85.A N CYS 81.A O no hydrogen 3.008 N/A GLN 85.A NE2 PHE 77.A O no hydrogen 3.414 N/A ILE 86.A N GLN 82.A O no hydrogen 3.007 N/A VAL 87.A N ASN 83.A O no hydrogen 2.923 N/A LEU 88.A N ASP 84.A O no hydrogen 2.826 N/A LEU 89.A N GLN 85.A O no hydrogen 2.971 N/A LYS 90.A N ILE 86.A O no hydrogen 2.759 N/A ALA 91.A N VAL 87.A O no hydrogen 3.086 N/A GLY 92.A N LEU 88.A O no hydrogen 2.829 N/A ALA 93.A N LEU 89.A O no hydrogen 2.918 N/A VAL 96.A N GLY 92.A O no hydrogen 2.776 N/A VAL 97.A N ALA 93.A O no hydrogen 2.936 N/A LEU 98.A N MET 94.A O no hydrogen 2.911 N/A VAL 99.A N GLU 95.A O no hydrogen 3.103 N/A ARG 100.A N VAL 96.A O no hydrogen 2.881 N/A ARG 100.A NH1 THR 20.A O no hydrogen 2.864 N/A ARG 100.A NH2 THR 20.A O no hydrogen 2.963 N/A ARG 100.A NH2 THR 20.A OG1 no hydrogen 3.412 N/A MET 101.A N VAL 97.A O no hydrogen 2.832 N/A CYS 102.A N VAL 99.A O no hydrogen 3.148 N/A CYS 102.A SG VAL 99.A O no hydrogen 3.116 N/A ARG 103.A N ARG 100.A O no hydrogen 3.004 N/A ARG 103.A NE GLU 150.A OE1 no hydrogen 3.131 N/A ARG 103.A NE GLU 150.A OE2 no hydrogen 2.953 N/A ARG 103.A NH1 LEU 23.A O no hydrogen 2.941 N/A ARG 103.A NH2 LEU 23.A O no hydrogen 2.686 N/A ARG 103.A NH2 GLU 150.A OE1 no hydrogen 2.963 N/A ALA 104.A N MET 101.A O no hydrogen 2.845 N/A TYR 105.A N CYS 102.A O no hydrogen 3.290 N/A TYR 105.A OH HIS 141.A ND1 no hydrogen 2.805 N/A ASN 106.A N THR 111.A O no hydrogen 2.769 N/A ASP 108.A N ASN 106.A OD1 no hydrogen 3.032 N/A THR 111.A N ASN 106.A O no hydrogen 3.257 N/A THR 111.A OG1 ASN 109.A OD1 no hydrogen 2.604 N/A VAL 112.A N GLY 119.A O no hydrogen 2.850 N/A PHE 113.A N ALA 104.A O no hydrogen 2.833 N/A PHE 114.A N LYS 117.A O no hydrogen 2.778 N/A LYS 117.A N PHE 114.A O no hydrogen 3.470 N/A LYS 117.A NZ GLU 40.A OE1 no hydrogen 2.870 N/A LYS 117.A NZ GLU 40.A OE2 no hydrogen 2.832 N/A TYR 118.A N ASN 34.A O no hydrogen 2.817 N/A TYR 118.A OH LEU 28.A O no hydrogen 2.656 N/A GLY 119.A N VAL 112.A O no hydrogen 3.031 N/A GLU 122.A N.A GLU 122.A OE1.A no hydrogen 2.502 N/A LEU 123.A N GLY 120.A O no hydrogen 2.923 N/A PHE 124.A N MET 121.A O no hydrogen 2.991 N/A ARG 125.A N GLU 122.A O.A no hydrogen 3.446 N/A ARG 125.A N GLU 122.A O.B no hydrogen 3.375 N/A LEU 127.A N PHE 124.A O no hydrogen 2.995 N/A GLY 128.A N ARG 125.A O no hydrogen 3.156 N/A ILE 133.A N CYS 129.A O no hydrogen 3.040 N/A SER 134.A N SER 130.A O.A no hydrogen 2.867 N/A SER 134.A N SER 130.A O.B no hydrogen 3.161 N/A SER 134.A OG SER 130.A O.A no hydrogen 2.921 N/A SER 134.A OG SER 130.A O.B no hydrogen 2.806 N/A SER 134.A OG GLU 131.A O no hydrogen 3.077 N/A SER 135.A N GLU 131.A O no hydrogen 2.888 N/A SER 135.A OG GLU 131.A O no hydrogen 2.814 N/A ILE 136.A N LEU 132.A O no hydrogen 3.029 N/A PHE 137.A N ILE 133.A O no hydrogen 2.906 N/A ASP 138.A N.A SER 134.A O no hydrogen 2.740 N/A ASP 138.A N.B SER 134.A O no hydrogen 2.744 N/A PHE 139.A N SER 135.A O no hydrogen 2.815 N/A SER 140.A N ILE 136.A O no hydrogen 2.838 N/A SER 140.A OG ILE 136.A O no hydrogen 3.113 N/A HIS 141.A N PHE 137.A O no hydrogen 2.836 N/A HIS 141.A ND1 TYR 105.A OH no hydrogen 2.805 N/A SER 142.A N ASP 138.A O.A no hydrogen 2.908 N/A SER 142.A N ASP 138.A O.B no hydrogen 2.872 N/A SER 142.A OG ASP 138.A O.A no hydrogen 3.053 N/A SER 142.A OG ASP 138.A O.B no hydrogen 3.086 N/A LEU 143.A N PHE 139.A O no hydrogen 3.093 N/A SER 144.A N SER 140.A O no hydrogen 2.979 N/A SER 144.A OG CYS 102.A O no hydrogen 3.488 N/A SER 144.A OG SER 140.A O no hydrogen 3.035 N/A ALA 145.A N HIS 141.A O no hydrogen 3.054 N/A LEU 146.A N LEU 143.A O no hydrogen 3.087 N/A HIS 147.A N SER 144.A O no hydrogen 3.037 N/A SER 149.A N GLU 152.A OE1 no hydrogen 3.101 N/A GLU 152.A N SER 149.A OG no hydrogen 3.086 N/A ILE 153.A N SER 149.A O no hydrogen 2.995 N/A ALA 154.A N GLU 150.A O no hydrogen 2.967 N/A LEU 155.A N ASP 151.A O no hydrogen 3.010 N/A TYR 156.A N GLU 152.A O no hydrogen 2.816 N/A THR 157.A N ILE 153.A O no hydrogen 2.920 N/A THR 157.A OG1 ILE 153.A O no hydrogen 2.702 N/A THR 157.A OG1 ALA 154.A O no hydrogen 3.135 N/A ALA 158.A N ALA 154.A O no hydrogen 3.086 N/A LEU 159.A N LEU 155.A O no hydrogen 3.312 N/A VAL 160.A N TYR 156.A O no hydrogen 2.936 N/A LEU 161.A N THR 157.A O no hydrogen 2.922 N/A ILE 162.A N ALA 158.A O no hydrogen 2.920 N/A ALA 164.A N GLN 179.A OE1 no hydrogen 2.693 N/A HIS 165.A N ASN 163.A OD1 no hydrogen 2.860 N/A ARG 166.A N ASN 163.A O no hydrogen 3.508 N/A ARG 166.A NH1 GLU 95.A OE1 no hydrogen 3.406 N/A ARG 166.A NH2 GLU 95.A OE2 no hydrogen 2.776 N/A GLN 170.A N ASP 84.A OD1 no hydrogen 2.764 N/A GLU 171.A N ASP 84.A OD2 no hydrogen 2.848 N/A LYS 172.A NZ ALA 164.A O no hydrogen 3.196 N/A LYS 172.A NZ GLU 176.A OE2 no hydrogen 3.114 N/A LYS 174.A NZ GLU 79.A O no hydrogen 3.250 N/A VAL 175.A N GLU 171.A O no hydrogen 3.123 N/A GLU 176.A N LYS 172.A O no hydrogen 2.871 N/A GLN 177.A N ARG 173.A O no hydrogen 2.952 N/A LEU 178.A N LYS 174.A O no hydrogen 3.108 N/A GLN 179.A N VAL 175.A O no hydrogen 2.759 N/A GLN 179.A NE2 GLU 183.A OE2 no hydrogen 3.217 N/A TYR 180.A N GLU 176.A O no hydrogen 2.810 N/A ASN 181.A N GLN 177.A O no hydrogen 3.013 N/A LEU 182.A N LEU 178.A O no hydrogen 2.992 N/A GLU 183.A N GLN 179.A O no hydrogen 2.868 N/A LEU 184.A N TYR 180.A O no hydrogen 3.002 N/A ALA 185.A N ASN 181.A O no hydrogen 3.021 N/A PHE 186.A N LEU 182.A O no hydrogen 2.878 N/A HIS 187.A N GLU 183.A O no hydrogen 2.737 N/A HIS 187.A ND1 GLU 183.A O no hydrogen 2.774 N/A HIS 188.A N LEU 184.A O no hydrogen 2.669 N/A HIS 188.A NE2 GLU 7.A OE1 no hydrogen 2.809 N/A HIS 189.A N ALA 185.A O no hydrogen 2.924 N/A LEU 190.A N PHE 186.A O no hydrogen 2.942 N/A CYS 191.A N HIS 187.A O no hydrogen 2.950 N/A LYS 192.A N HIS 188.A O no hydrogen 2.897 N/A THR 193.A N HIS 189.A O no hydrogen 3.069 N/A THR 193.A OG1 HIS 189.A O no hydrogen 2.542 N/A THR 193.A OG1 LEU 190.A O no hydrogen 3.273 N/A HIS 194.A N CYS 191.A O no hydrogen 3.124 N/A ARG 195.A N LEU 190.A O no hydrogen 2.697 N/A ARG 195.A NE GLU 152.A OE2 no hydrogen 2.852 N/A ARG 195.A NH1 LEU 146.A O no hydrogen 2.858 N/A ARG 195.A NH1 GLU 152.A OE1 no hydrogen 2.836 N/A ARG 195.A NH2 LEU 146.A O no hydrogen 3.299 N/A ILE 198.A N ARG 195.A O no hydrogen 3.230 N/A LEU 199.A N GLN 196.A O no hydrogen 3.083 N/A LYS 201.A N ILE 198.A O no hydrogen 2.858 N/A LEU 202.A N LEU 199.A O no hydrogen 3.456 N/A LYS 207.A N PRO 204.A O no hydrogen 2.840 N/A ARG 209.A N LYS 205.A O no hydrogen 3.339 N/A SER 210.A N GLY 206.A O no hydrogen 2.968 N/A LEU 211.A N LYS 207.A O no hydrogen 2.952 N/A CYS 212.A N LEU 208.A O no hydrogen 3.153 N/A CYS 212.A SG LEU 208.A O no hydrogen 3.403 N/A SER 213.A N ARG 209.A O no hydrogen 2.917 N/A SER 213.A OG ARG 209.A O no hydrogen 3.121 N/A GLN 214.A N SER 210.A O no hydrogen 3.002 N/A HIS 215.A N LEU 211.A O no hydrogen 3.053 N/A HIS 215.A NE2 TYR 238.A OH no hydrogen 2.641 N/A VAL 216.A N CYS 212.A O no hydrogen 3.053 N/A GLU 217.A N SER 213.A O no hydrogen 2.806 N/A ARG 218.A N GLN 214.A O no hydrogen 2.868 N/A ARG 218.A NH2 GLY 128.A O no hydrogen 2.950 N/A LEU 219.A N HIS 215.A O no hydrogen 2.965 N/A GLN 220.A N VAL 216.A O no hydrogen 3.008 N/A ILE 221.A N GLU 217.A O no hydrogen 3.281 N/A PHE 222.A N ARG 218.A O no hydrogen 2.959 N/A GLN 223.A N LEU 219.A O no hydrogen 2.715 N/A HIS 224.A N GLN 220.A O no hydrogen 3.020 N/A LEU 225.A N ILE 221.A O no hydrogen 3.066 N/A HIS 226.A N PHE 222.A O no hydrogen 2.805 N/A VAL 230.A N HIS 226.A O no hydrogen 3.461 N/A GLN 231.A N PRO 227.A O no hydrogen 3.173 N/A ALA 232.A N ILE 228.A O no hydrogen 2.769 N/A ALA 233.A N VAL 229.A O no hydrogen 2.793 N/A PHE 234.A N VAL 230.A O no hydrogen 3.188 N/A TYR 238.A OH HIS 215.A NE2 no hydrogen 2.641 N/A LYS 239.A N PRO 235.A O no hydrogen 3.088 N/A LYS 239.A NZ VAL 230.A O no hydrogen 3.365 N/A LYS 239.A NZ GLN 231.A O no hydrogen 3.030 N/A GLU 240.A N PRO 236.A O no hydrogen 3.033 N/A LEU 241.A N LEU 237.A O no hydrogen 3.045 N/A PHE 242.A N TYR 238.A O no hydrogen 3.019 N/A SER 243.A N LYS 239.A O no hydrogen 2.875 N/A SER 243.A OG GLN 223.A OE1 no hydrogen 2.478 N/A HIS 249.A ND1 GLY 246.A O no hydrogen 2.899 N/A ILE 251.A N GLU 240.A OE2 no hydrogen 2.383 N/A LEU 252.A N GLU 240.A OE1 no hydrogen 2.899 N/A LEU 255.A N ILE 251.A O no hydrogen 2.849 N/A LEU 256.A N LEU 252.A O no hydrogen 2.825 N/A GLN 257.A N HIS 253.A O no hydrogen 2.838 N/A ASP 258.A N ARG 254.A O no hydrogen 3.082 N/A SER 259.A OG ASP 258.A OD1 no hydrogen 3.111 N/A