Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5e8h_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 1.A SG SER 274.A O no hydrogen 3.560 N/A SER 6.A OG ASP 3.A OD2 no hydrogen 2.959 N/A ALA 7.A N ASP 3.A O no hydrogen 3.308 N/A PHE 8.A N HIS 4.A O no hydrogen 2.835 N/A ASP 9.A N ASN 5.A O no hydrogen 2.922 N/A PHE 10.A N SER 6.A O no hydrogen 2.912 N/A LYS 11.A N ALA 7.A O no hydrogen 2.878 N/A LEU 12.A N PHE 8.A O no hydrogen 3.067 N/A TYR 13.A N ASP 9.A O no hydrogen 2.892 N/A TYR 13.A OH GLU 62.A OE1 no hydrogen 2.719 N/A MET 14.A N PHE 10.A O no hydrogen 2.865 N/A ILE 15.A N LYS 11.A O no hydrogen 3.127 N/A ARG 16.A N LEU 12.A O no hydrogen 2.975 N/A LYS 17.A N TYR 13.A O no hydrogen 2.920 N/A LYS 17.A NZ GLU 62.A OE2 no hydrogen 3.007 N/A LYS 17.A NZ GLU 68.A OE1 no hydrogen 2.650 N/A ALA 18.A N MET 14.A O no hydrogen 2.910 N/A GLU 19.A N ILE 15.A O no hydrogen 2.996 N/A SER 20.A N ARG 16.A O no hydrogen 3.034 N/A SER 20.A OG ARG 16.A O no hydrogen 3.225 N/A SER 20.A OG GLU 68.A OE2 no hydrogen 3.352 N/A VAL 21.A N LYS 17.A O no hydrogen 2.837 N/A ASN 22.A N ALA 18.A O no hydrogen 2.891 N/A ALA 23.A N GLU 19.A O no hydrogen 3.041 N/A ALA 24.A N SER 20.A O no hydrogen 3.016 N/A LEU 25.A N VAL 21.A O no hydrogen 2.834 N/A ASP 26.A N ASN 22.A O no hydrogen 2.951 N/A VAL 27.A N ALA 23.A O no hydrogen 2.995 N/A SER 28.A N ALA 24.A O no hydrogen 2.888 N/A SER 28.A N LEU 25.A O no hydrogen 2.991 N/A SER 28.A OG LEU 25.A O no hydrogen 2.754 N/A VAL 29.A N LEU 25.A O no hydrogen 3.379 N/A LEU 35.A N GLU 33.A OE2 no hydrogen 3.069 N/A VAL 37.A N PRO 34.A O no hydrogen 3.064 N/A GLU 39.A N LEU 35.A O no hydrogen 2.911 N/A VAL 41.A N VAL 37.A O no hydrogen 3.073 N/A ARG 42.A N GLN 38.A O no hydrogen 2.874 N/A ARG 42.A NH1 ASP 26.A O no hydrogen 3.151 N/A ARG 42.A NH1 ASP 26.A OD1 no hydrogen 2.896 N/A ARG 42.A NH1 VAL 29.A O no hydrogen 2.702 N/A ARG 42.A NH2 ASP 26.A OD1 no hydrogen 2.950 N/A TYR 43.A N GLU 39.A O no hydrogen 2.967 N/A TYR 43.A OH PRO 104.A O no hydrogen 2.641 N/A LEU 46.A N ARG 42.A O no hydrogen 2.892 N/A ARG 51.A NE ASN 22.A OD1 no hydrogen 2.840 N/A ARG 51.A NH1 LEU 45.A O no hydrogen 3.338 N/A ARG 51.A NH1 GLU 79.A OE2 no hydrogen 2.703 N/A ARG 51.A NH2 ASN 22.A OD1 no hydrogen 3.013 N/A ARG 51.A NH2 LEU 45.A O no hydrogen 3.052 N/A LEU 55.A N ARG 51.A O no hydrogen 2.993 N/A LEU 56.A N VAL 52.A O no hydrogen 2.863 N/A CYS 57.A N ARG 53.A O no hydrogen 2.987 N/A CYS 57.A SG ALA 71.A O no hydrogen 3.886 N/A ILE 58.A N PRO 54.A O no hydrogen 2.910 N/A ALA 59.A N LEU 55.A O no hydrogen 2.843 N/A VAL 60.A N LEU 56.A O no hydrogen 2.882 N/A CYS 61.A N CYS 57.A O no hydrogen 2.972 N/A CYS 61.A SG ASP 67.A O no hydrogen 3.238 N/A GLU 62.A N ILE 58.A O no hydrogen 2.932 N/A LEU 63.A N ALA 59.A O no hydrogen 2.870 N/A VAL 64.A N VAL 60.A O no hydrogen 3.198 N/A GLY 65.A N GLU 62.A O no hydrogen 2.985 N/A GLY 66.A N CYS 61.A O no hydrogen 2.684 N/A THR 70.A OG1 ASP 67.A OD2 no hydrogen 3.233 N/A MET 72.A N ALA 69.A O no hydrogen 3.344 N/A ALA 75.A N ALA 71.A O no hydrogen 2.931 N/A CYS 76.A N MET 72.A O no hydrogen 2.869 N/A CYS 76.A SG MET 72.A O no hydrogen 3.436 N/A ALA 77.A N SER 73.A O no hydrogen 2.859 N/A VAL 78.A N ALA 74.A O no hydrogen 2.948 N/A GLU 79.A N ALA 75.A O no hydrogen 3.063 N/A MET 80.A N CYS 76.A O no hydrogen 2.869 N/A ILE 81.A N ALA 77.A O no hydrogen 2.990 N/A HIS 82.A N VAL 78.A O no hydrogen 2.959 N/A THR 83.A N GLU 79.A O no hydrogen 2.897 N/A THR 83.A OG1 GLU 79.A O no hydrogen 2.687 N/A SER 84.A N MET 80.A O no hydrogen 2.912 N/A SER 84.A OG GLY 119.A O no hydrogen 2.756 N/A SER 85.A N ILE 81.A O no hydrogen 2.964 N/A SER 85.A OG HIS 82.A O no hydrogen 2.822 N/A LEU 86.A N HIS 82.A O no hydrogen 2.999 N/A ILE 87.A N THR 83.A O no hydrogen 2.934 N/A HIS 88.A N SER 84.A O no hydrogen 3.064 N/A HIS 88.A NE2 VAL 116.A O no hydrogen 2.957 N/A ASP 89.A N SER 85.A O no hydrogen 2.890 N/A ASP 90.A N LEU 86.A O no hydrogen 2.961 N/A LEU 91.A N HIS 88.A O no hydrogen 3.129 N/A MET 94.A N LEU 91.A O no hydrogen 2.953 N/A ASP 95.A N ASP 89.A O no hydrogen 3.009 N/A ASN 96.A N LEU 91.A O no hydrogen 2.776 N/A ALA 97.A N ASP 90.A O no hydrogen 2.999 N/A ARG 100.A N LYS 103.A O no hydrogen 2.860 N/A ARG 100.A NE ASP 90.A OD2 no hydrogen 3.088 N/A ARG 100.A NH1 ASP 90.A OD1 no hydrogen 2.686 N/A ARG 100.A NH1 ASP 90.A OD2 no hydrogen 3.134 N/A LYS 103.A N ARG 100.A O no hydrogen 2.850 N/A THR 105.A N ASP 98.A O no hydrogen 2.875 N/A THR 105.A OG1 ALA 97.A O no hydrogen 2.781 N/A THR 105.A OG1 ASP 98.A O no hydrogen 3.358 N/A THR 105.A OG1 HIS 107.A NE2 no hydrogen 2.735 N/A ASN 106.A ND2 ALA 40.A O no hydrogen 3.223 N/A ASN 106.A ND2 SER 44.A OG no hydrogen 2.862 N/A LYS 108.A N THR 105.A O no hydrogen 2.929 N/A LYS 108.A NZ ASP 98.A OD1 no hydrogen 3.177 N/A VAL 109.A N ASN 106.A O no hydrogen 2.987 N/A TYR 110.A N ASN 106.A O no hydrogen 2.950 N/A GLY 111.A N HIS 107.A O no hydrogen 2.840 N/A MET 114.A N ASP 113.A OD1 no hydrogen 2.517 N/A ALA 115.A N GLY 111.A O no hydrogen 3.102 N/A VAL 116.A N GLU 112.A O no hydrogen 2.930 N/A LEU 117.A N ASP 113.A O no hydrogen 3.025 N/A ALA 118.A N MET 114.A O no hydrogen 2.891 N/A GLY 119.A N ALA 115.A O no hydrogen 3.005 N/A ASP 120.A N VAL 116.A O no hydrogen 3.102 N/A ALA 121.A N LEU 117.A O no hydrogen 2.912 N/A LEU 122.A N ALA 118.A O no hydrogen 2.964 N/A LEU 123.A N GLY 119.A O no hydrogen 3.076 N/A ALA 124.A N ASP 120.A O no hydrogen 3.115 N/A LEU 125.A N ALA 121.A O no hydrogen 2.928 N/A ALA 126.A N LEU 122.A O no hydrogen 3.019 N/A GLU 128.A N ALA 124.A O no hydrogen 3.031 N/A HIS 129.A N LEU 125.A O no hydrogen 2.814 N/A MET 130.A N ALA 126.A O no hydrogen 2.940 N/A THR 131.A N PHE 127.A O no hydrogen 2.981 N/A THR 131.A OG1 PHE 127.A O no hydrogen 2.713 N/A VAL 132.A N GLU 128.A O no hydrogen 2.878 N/A VAL 133.A N HIS 129.A O no hydrogen 3.011 N/A SER 134.A N MET 130.A O no hydrogen 2.853 N/A SER 134.A OG SER 73.A OG no hydrogen 2.651 N/A SER 134.A OG MET 130.A O no hydrogen 2.906 N/A SER 135.A N THR 131.A O no hydrogen 2.973 N/A SER 135.A OG THR 131.A O no hydrogen 2.798 N/A GLY 136.A N VAL 133.A O no hydrogen 3.284 N/A LEU 137.A N SER 134.A O no hydrogen 2.960 N/A VAL 138.A N SER 134.A O no hydrogen 3.296 N/A GLU 141.A N GLU 141.A OE1 no hydrogen 2.811 N/A ARG 142.A NH1 GLY 197.A O no hydrogen 2.952 N/A ARG 142.A NH2 GLY 197.A O no hydrogen 2.712 N/A MET 143.A N ALA 139.A O no hydrogen 3.096 N/A ILE 144.A N PRO 140.A O no hydrogen 2.987 N/A ARG 145.A N GLU 141.A O no hydrogen 2.986 N/A ARG 145.A NH1 GLU 149.A OE2 no hydrogen 2.693 N/A ARG 145.A NH2 GLU 199.A OE2 no hydrogen 3.249 N/A ALA 146.A N ARG 142.A O no hydrogen 2.896 N/A VAL 147.A N MET 143.A O no hydrogen 2.983 N/A VAL 148.A N ILE 144.A O no hydrogen 3.026 N/A GLU 149.A N ARG 145.A O no hydrogen 2.963 N/A LEU 150.A N ALA 146.A O no hydrogen 3.015 N/A ALA 151.A N VAL 147.A O no hydrogen 3.016 N/A ARG 152.A N VAL 148.A O no hydrogen 2.900 N/A ALA 153.A N GLU 149.A O no hydrogen 2.995 N/A ILE 154.A N LEU 150.A O no hydrogen 3.094 N/A ILE 154.A N ALA 151.A O no hydrogen 3.196 N/A THR 157.A OG1 ARG 152.A O no hydrogen 3.116 N/A GLY 158.A N GLY 155.A O no hydrogen 2.817 N/A LEU 159.A N ALA 153.A O no hydrogen 2.855 N/A VAL 160.A N ILE 154.A O no hydrogen 2.954 N/A ALA 161.A N GLY 155.A O no hydrogen 3.450 N/A GLY 162.A N GLY 158.A O no hydrogen 3.225 N/A GLN 163.A N LEU 159.A O no hydrogen 2.933 N/A GLN 163.A NE2 ASP 89.A OD1 no hydrogen 2.545 N/A MET 164.A N VAL 160.A O no hydrogen 2.915 N/A ILE 165.A N ALA 161.A O no hydrogen 2.972 N/A ASP 166.A N GLY 162.A O no hydrogen 3.104 N/A LEU 167.A N MET 164.A O no hydrogen 3.109 N/A GLU 173.A N LEU 169.A O no hydrogen 2.889 N/A PHE 174.A N GLU 170.A O no hydrogen 2.971 N/A ILE 175.A N HIS 171.A O no hydrogen 2.918 N/A HIS 176.A N LEU 172.A O no hydrogen 2.977 N/A LEU 177.A N GLU 173.A O no hydrogen 2.785 N/A HIS 178.A N PHE 174.A O no hydrogen 2.991 N/A HIS 178.A N ILE 175.A O no hydrogen 3.175 N/A HIS 178.A ND1 PHE 174.A O no hydrogen 2.876 N/A LYS 179.A N ILE 175.A O no hydrogen 2.815 N/A LYS 179.A NZ ASP 89.A OD2 no hydrogen 3.047 N/A THR 180.A N HIS 176.A O no hydrogen 3.270 N/A ALA 181.A N HIS 176.A O no hydrogen 3.177 N/A GLU 185.A N ALA 181.A O no hydrogen 2.807 N/A ALA 186.A N ALA 182.A O no hydrogen 2.978 N/A ALA 187.A N LEU 183.A O no hydrogen 2.931 N/A ALA 188.A N LEU 184.A O no hydrogen 2.967 N/A VAL 189.A N GLU 185.A O no hydrogen 2.890 N/A LEU 190.A N ALA 186.A O no hydrogen 2.893 N/A GLY 191.A N ALA 187.A O no hydrogen 2.996 N/A VAL 192.A N ALA 188.A O no hydrogen 2.967 N/A ILE 193.A N VAL 189.A O no hydrogen 2.896 N/A MET 194.A N LEU 190.A O no hydrogen 2.881 N/A GLY 195.A N GLY 191.A O no hydrogen 3.046 N/A GLY 195.A N VAL 192.A O no hydrogen 3.021 N/A GLY 196.A N ILE 193.A O no hydrogen 3.289 N/A GLY 197.A N VAL 192.A O no hydrogen 3.059 N/A THR 198.A N GLU 201.A OE1 no hydrogen 2.945 N/A GLU 201.A N THR 198.A OG1 no hydrogen 3.167 N/A ILE 202.A N THR 198.A O no hydrogen 2.995 N/A GLU 203.A N GLU 199.A O no hydrogen 3.085 N/A LYS 204.A N GLU 200.A O no hydrogen 2.943 N/A LEU 205.A N GLU 201.A O no hydrogen 2.950 N/A ARG 206.A N ILE 202.A O no hydrogen 2.935 N/A ARG 206.A NE GLU 203.A OE1 no hydrogen 3.073 N/A ARG 206.A NE GLU 203.A OE2 no hydrogen 3.240 N/A ARG 206.A NH1 GLU 149.A OE1 no hydrogen 3.157 N/A ARG 206.A NH2 GLU 149.A OE2 no hydrogen 3.141 N/A ARG 206.A NH2 GLU 203.A OE2 no hydrogen 2.858 N/A LYS 207.A N GLU 203.A O no hydrogen 3.002 N/A TYR 208.A N LYS 204.A O no hydrogen 2.935 N/A TYR 208.A OH LEU 269.A O no hydrogen 2.795 N/A ALA 209.A N LEU 205.A O no hydrogen 2.881 N/A ARG 210.A N ARG 206.A O no hydrogen 2.978 N/A CYS 211.A N LYS 207.A O no hydrogen 3.007 N/A CYS 211.A SG LYS 207.A O no hydrogen 3.470 N/A ILE 212.A N TYR 208.A O no hydrogen 2.961 N/A GLY 213.A N ALA 209.A O no hydrogen 2.945 N/A LEU 214.A N ARG 210.A O no hydrogen 3.002 N/A LEU 215.A N CYS 211.A O no hydrogen 2.869 N/A PHE 216.A N ILE 212.A O no hydrogen 2.912 N/A GLN 217.A N GLY 213.A O no hydrogen 3.131 N/A GLN 217.A NE2 THR 180.A OG1 no hydrogen 2.754 N/A VAL 218.A N LEU 214.A O no hydrogen 2.961 N/A VAL 219.A N LEU 215.A O no hydrogen 2.929 N/A ASP 220.A N PHE 216.A O no hydrogen 2.930 N/A ASP 221.A N GLN 217.A O no hydrogen 3.086 N/A ILE 222.A N VAL 218.A O no hydrogen 2.978 N/A LEU 223.A N VAL 219.A O no hydrogen 2.893 N/A ASP 224.A N ASP 220.A O no hydrogen 2.988 N/A VAL 225.A N ASP 221.A O no hydrogen 3.022 N/A THR 226.A N ILE 222.A O no hydrogen 2.912 N/A THR 226.A OG1 ILE 222.A O no hydrogen 2.900 N/A LYS 227.A N ASP 224.A O no hydrogen 3.132 N/A SER 228.A N ASP 224.A O no hydrogen 2.761 N/A SER 228.A OG ASP 224.A O no hydrogen 3.398 N/A SER 228.A OG ASP 224.A OD1 no hydrogen 3.342 N/A GLU 231.A N SER 228.A O no hydrogen 2.974 N/A TYR 234.A N ASP 221.A OD2 no hydrogen 3.279 N/A ARG 236.A N THR 233.A O no hydrogen 3.206 N/A ARG 236.A N THR 233.A OG1 no hydrogen 3.295 N/A LEU 237.A N TYR 234.A O no hydrogen 3.050 N/A ILE 238.A N TYR 234.A O no hydrogen 2.930 N/A ARG 242.A NH1 GLU 245.A OE1 no hydrogen 3.360 N/A ARG 242.A NH1 GLU 245.A OE2 no hydrogen 2.506 N/A SER 243.A N GLY 239.A O no hydrogen 3.216 N/A SER 243.A OG GLY 239.A O no hydrogen 2.579 N/A LYS 244.A N LEU 240.A O no hydrogen 2.958 N/A GLU 245.A N GLU 241.A O no hydrogen 2.995 N/A VAL 246.A N ARG 242.A O no hydrogen 2.860 N/A ALA 247.A N SER 243.A O no hydrogen 2.967 N/A GLU 248.A N LYS 244.A O no hydrogen 2.940 N/A LYS 249.A N GLU 245.A O no hydrogen 2.924 N/A LEU 250.A N VAL 246.A O no hydrogen 2.937 N/A ARG 251.A N ALA 247.A O no hydrogen 2.949 N/A ARG 252.A N GLU 248.A O no hydrogen 2.994 N/A GLU 253.A N LYS 249.A O no hydrogen 2.915 N/A ALA 254.A N LEU 250.A O no hydrogen 2.903 N/A GLU 255.A N ARG 251.A O no hydrogen 3.021 N/A GLU 256.A N ARG 252.A O no hydrogen 2.935 N/A GLN 257.A N ALA 254.A O no hydrogen 3.150 N/A LEU 258.A N GLU 255.A O no hydrogen 3.003 N/A LEU 259.A N GLU 256.A O no hydrogen 3.114 N/A PHE 261.A N LEU 258.A O no hydrogen 3.300 N/A SER 264.A N ASP 262.A OD1 no hydrogen 3.241 N/A ALA 266.A N ASP 262.A O no hydrogen 2.656 N/A LEU 269.A N ALA 266.A O no hydrogen 2.936 N/A VAL 270.A N ALA 266.A O no hydrogen 3.142 N/A ALA 271.A N ALA 267.A O no hydrogen 2.923 N/A LEU 272.A N PRO 268.A O no hydrogen 2.855 N/A ALA 273.A N LEU 269.A O no hydrogen 3.041 N/A SER 274.A N VAL 270.A O no hydrogen 3.062 N/A SER 274.A OG VAL 270.A O no hydrogen 3.483 N/A TYR 275.A N ALA 271.A O no hydrogen 2.756 N/A ILE 276.A N LEU 272.A O no hydrogen 2.959 N/A ALA 277.A N ALA 273.A O no hydrogen 2.918 N/A CYS 278.A N TYR 275.A O no hydrogen 3.442 N/A