Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2r0s_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A OH ASN 82.A O no hydrogen 3.275 N/A TYR 3.A OH ASP 86.A OD1 no hydrogen 2.903 N/A ALA 5.A N ASP 2.A O no hydrogen 3.351 N/A ALA 5.A N ASP 2.A OD1 no hydrogen 3.257 N/A LEU 7.A N GLU 88.A OE1 no hydrogen 2.828 N/A SER 11.A N ASN 8.A O no hydrogen 3.114 N/A LEU 13.A N SER 11.A OG no hydrogen 2.991 N/A PHE 14.A N SER 11.A O no hydrogen 3.076 N/A LEU 15.A N SER 11.A O no hydrogen 3.051 N/A ASP 16.A N GLU 12.A O no hydrogen 2.999 N/A TRP 18.A NE1 LEU 13.A O no hydrogen 2.773 N/A HIS 19.A NE2 GLU 77.A O no hydrogen 2.746 N/A ASN 24.A N GLU 75.A OE2 no hydrogen 2.885 N/A ASN 24.A ND2 ASP 73.A OD1 no hydrogen 2.861 N/A ARG 25.A NE TYR 277.A O no hydrogen 3.197 N/A ARG 25.A NE LEU 278.A O no hydrogen 2.746 N/A ARG 25.A NH2 LEU 278.A O no hydrogen 2.896 N/A PHE 26.A N LYS 22.A O no hydrogen 3.053 N/A ILE 27.A N PHE 23.A O no hydrogen 2.816 N/A SER 28.A N ASN 24.A O no hydrogen 3.171 N/A PHE 29.A N ARG 25.A O no hydrogen 3.032 N/A THR 30.A N PHE 26.A O no hydrogen 2.934 N/A THR 30.A OG1 PHE 26.A O no hydrogen 2.838 N/A LEU 31.A N ILE 27.A O no hydrogen 2.911 N/A ASP 32.A N SER 28.A O no hydrogen 3.002 N/A VAL 33.A N PHE 29.A O no hydrogen 3.103 N/A LEU 34.A N THR 30.A O no hydrogen 3.052 N/A ILE 35.A N LEU 31.A O no hydrogen 2.839 N/A ASP 36.A N ASP 32.A O no hydrogen 3.061 N/A LYS 37.A N VAL 33.A O no hydrogen 2.942 N/A TYR 38.A N LEU 34.A O no hydrogen 2.824 N/A LYS 39.A NZ ASP 36.A O no hydrogen 2.788 N/A LYS 39.A NZ ASP 36.A OD1 no hydrogen 3.241 N/A PHE 42.A N TYR 38.A O no hydrogen 3.032 N/A LYS 43.A N LYS 39.A O no hydrogen 3.003 N/A LYS 43.A NZ ASP 40.A O no hydrogen 3.479 N/A LYS 43.A NZ ASP 40.A OD2 no hydrogen 2.964 N/A PHE 45.A N PHE 42.A O no hydrogen 2.857 N/A HIS 54.A N ARG 51.A O no hydrogen 3.268 N/A TYR 58.A N HIS 54.A O no hydrogen 3.368 N/A TYR 58.A OH PRO 49.A O no hydrogen 2.564 N/A TYR 59.A N PRO 55.A O no hydrogen 2.983 N/A LYS 60.A N GLN 56.A O no hydrogen 2.980 N/A ILE 61.A N TYR 57.A O no hydrogen 2.923 N/A GLN 62.A NE2 LYS 60.A O no hydrogen 3.401 N/A SER 65.A OG ILE 46.A O no hydrogen 3.500 N/A ILE 66.A N PHE 45.A O no hydrogen 2.795 N/A ASN 67.A N ILE 46.A O no hydrogen 2.967 N/A GLU 68.A N SER 65.A OG no hydrogen 2.961 N/A ILE 69.A N SER 65.A O no hydrogen 3.033 N/A LYS 70.A N ILE 66.A O no hydrogen 2.847 N/A LYS 70.A NZ ASP 32.A OD1 no hydrogen 2.732 N/A SER 71.A N ASN 67.A O no hydrogen 3.021 N/A SER 71.A N GLU 68.A O no hydrogen 3.042 N/A SER 71.A OG GLU 68.A O no hydrogen 2.641 N/A ARG 72.A N ILE 69.A O no hydrogen 3.178 N/A ARG 72.A NE GLU 68.A OE2 no hydrogen 2.902 N/A ARG 72.A NH1 ASP 86.A OD2 no hydrogen 2.988 N/A TYR 74.A N ASN 24.A OD1 no hydrogen 2.937 N/A TYR 74.A OH ASP 86.A OD2 no hydrogen 2.499 N/A GLU 75.A N ASP 73.A OD1 no hydrogen 3.061 N/A GLY 79.A N TYR 76.A O no hydrogen 2.997 N/A ASN 82.A N ASP 78.A O no hydrogen 2.965 N/A ASN 82.A ND2 TYR 76.A OH no hydrogen 2.787 N/A PHE 83.A N GLY 79.A O no hydrogen 2.806 N/A LEU 84.A N PRO 80.A O no hydrogen 3.009 N/A LEU 85.A N SER 81.A O no hydrogen 2.869 N/A ASP 86.A N ASN 82.A O no hydrogen 2.824 N/A VAL 87.A N PHE 83.A O no hydrogen 2.814 N/A GLU 88.A N LEU 84.A O no hydrogen 2.824 N/A LEU 89.A N LEU 85.A O no hydrogen 3.016 N/A LEU 90.A N VAL 87.A O no hydrogen 2.971 N/A THR 91.A N GLU 88.A O no hydrogen 3.089 N/A THR 91.A OG1 SER 108.A OG no hydrogen 2.734 N/A LYS 92.A N GLU 88.A O no hydrogen 2.854 N/A LYS 92.A NZ ASP 2.A O no hydrogen 3.081 N/A LYS 92.A NZ ALA 5.A O no hydrogen 2.708 N/A ASN 93.A N LEU 89.A O no hydrogen 2.823 N/A ASN 93.A ND2 GLN 63.A O no hydrogen 2.778 N/A CYS 94.A SG ILE 104.A O no hydrogen 3.680 N/A GLN 95.A N THR 91.A O no hydrogen 2.904 N/A GLN 95.A NE2 THR 91.A OG1 no hydrogen 2.824 N/A ALA 96.A N LYS 92.A O no hydrogen 3.025 N/A TYR 97.A N ASN 93.A O no hydrogen 3.091 N/A TYR 97.A N CYS 94.A O no hydrogen 3.201 N/A ASN 98.A N CYS 94.A O no hydrogen 2.825 N/A ASN 98.A ND2 CYS 94.A O no hydrogen 3.310 N/A SER 102.A N GLU 99.A O no hydrogen 3.098 N/A SER 102.A OG GLU 99.A O no hydrogen 2.781 N/A VAL 105.A N SER 102.A OG no hydrogen 3.237 N/A LYS 106.A N SER 102.A O no hydrogen 3.054 N/A LYS 106.A NZ ILE 225.A O no hydrogen 2.916 N/A ASN 107.A N LEU 103.A O no hydrogen 2.847 N/A SER 108.A N ILE 104.A O no hydrogen 2.870 N/A SER 108.A OG THR 91.A OG1 no hydrogen 2.734 N/A SER 108.A OG VAL 105.A O no hydrogen 2.568 N/A GLN 109.A NE2 LYS 106.A O no hydrogen 3.091 N/A GLN 109.A NE2 ILE 189.A O no hydrogen 2.901 N/A VAL 110.A N ASN 107.A O no hydrogen 2.889 N/A VAL 111.A N SER 108.A O no hydrogen 3.171 N/A ILE 113.A N VAL 110.A O no hydrogen 3.010 N/A GLU 114.A N VAL 111.A O no hydrogen 2.876 N/A GLU 116.A N LEU 112.A O no hydrogen 3.191 N/A VAL 117.A N ILE 113.A O no hydrogen 3.054 N/A LEU 118.A N GLU 114.A O no hydrogen 2.873 N/A LYS 119.A N PHE 115.A O no hydrogen 3.112 N/A LYS 119.A NZ GLU 116.A OE1 no hydrogen 3.432 N/A LYS 119.A NZ GLU 116.A OE2 no hydrogen 3.428 N/A ALA 120.A N GLU 116.A O no hydrogen 3.146 N/A LYS 121.A N VAL 117.A O no hydrogen 2.805 N/A LYS 121.A NZ GLU 12.A OE2 no hydrogen 2.799 N/A LYS 121.A NZ ASP 16.A OD2 no hydrogen 2.753 N/A ASN 122.A N LYS 119.A O no hydrogen 3.204 N/A ASN 122.A ND2 GLU 12.A OE2 no hydrogen 2.950 N/A ASN 122.A ND2 LEU 118.A O no hydrogen 2.825 N/A ARG 125.A N ASN 122.A O no hydrogen 2.989 N/A ARG 125.A NE ASN 122.A OD1 no hydrogen 2.796 N/A ARG 125.A NH1 GLN 249.A OE1 no hydrogen 2.916 N/A ARG 125.A NH2 GLU 12.A OE2 no hydrogen 3.284 N/A ARG 125.A NH2 ASN 122.A OD1 no hydrogen 3.064 N/A ASN 126.A N LEU 123.A O no hydrogen 3.419 N/A LEU 128.A N GLU 268.A O no hydrogen 2.834 N/A ILE 129.A N SER 208.A O no hydrogen 2.809 N/A ASN 130.A ND2 ASN 266.A O no hydrogen 2.871 N/A ASN 130.A ND2 GLU 268.A OE1 no hydrogen 3.188 N/A VAL 133.A N ASN 130.A OD1 no hydrogen 3.030 N/A LYS 134.A N ASN 130.A O no hydrogen 2.833 N/A LYS 134.A NZ GLU 203.A O no hydrogen 3.172 N/A ALA 135.A N SER 131.A O no hydrogen 3.094 N/A LYS 136.A N GLU 132.A O no hydrogen 3.102 N/A LYS 136.A NZ GLU 255.A OE2 no hydrogen 3.269 N/A LEU 137.A N VAL 133.A O no hydrogen 2.912 N/A LEU 138.A N LYS 134.A O no hydrogen 2.965 N/A HIS 139.A N ALA 135.A O no hydrogen 3.162 N/A TYR 140.A N LYS 136.A O no hydrogen 3.122 N/A TYR 140.A OH GLU 255.A OE1 no hydrogen 2.795 N/A LEU 141.A N LEU 137.A O no hydrogen 2.776 N/A ASN 142.A N LEU 138.A O no hydrogen 2.900 N/A LYS 143.A N HIS 139.A O no hydrogen 2.928 N/A LYS 143.A NZ GLU 251.A OE1 no hydrogen 2.757 N/A LEU 144.A N TYR 140.A O no hydrogen 2.961 N/A VAL 145.A N LEU 141.A O no hydrogen 2.874 N/A ASP 146.A N ASN 142.A O no hydrogen 2.871 N/A ALA 147.A N LEU 144.A O no hydrogen 3.264 N/A THR 148.A OG1 ASP 167.A OD1 no hydrogen 2.620 N/A LYS 150.A N ASP 166.A O no hydrogen 2.954 N/A LYS 151.A N THR 148.A OG1 no hydrogen 3.339 N/A LYS 151.A NZ ASP 167.A OD1 no hydrogen 2.679 N/A LYS 151.A NZ ASP 167.A OD2 no hydrogen 3.473 N/A ILE 152.A N THR 148.A O no hydrogen 2.946 N/A ASN 153.A N GLU 149.A O no hydrogen 3.049 N/A ASN 153.A ND2 GLU 149.A O no hydrogen 2.702 N/A ASN 153.A ND2 GLU 149.A OE2 no hydrogen 2.797 N/A GLN 154.A N LYS 150.A O no hydrogen 2.877 N/A ALA 155.A N LYS 151.A O no hydrogen 2.982 N/A LEU 156.A N ILE 152.A O no hydrogen 2.824 N/A LEU 157.A N ASN 153.A O no hydrogen 2.717 N/A GLY 158.A N GLN 154.A O no hydrogen 2.966 N/A SER 160.A N LEU 157.A O no hydrogen 2.971 N/A SER 161.A N GLY 158.A O no hydrogen 2.933 N/A SER 161.A OG PRO 162.A O no hydrogen 3.022 N/A LYS 168.A N ASP 166.A OD2 no hydrogen 2.917 N/A VAL 169.A N ASP 166.A OD2 no hydrogen 2.771 N/A LYS 170.A NZ ASP 146.A OD1 no hydrogen 2.986 N/A LEU 171.A N ALA 147.A O no hydrogen 3.266 N/A SER 172.A OG VAL 145.A O no hydrogen 2.598 N/A GLU 173.A N LYS 170.A O no hydrogen 3.082 N/A PHE 175.A N SER 172.A O no hydrogen 2.822 N/A LYS 180.A NZ ASP 181.A OD1 no hydrogen 3.112 N/A LYS 180.A NZ ASP 181.A OD2 no hydrogen 3.168 N/A ASP 181.A N ASP 179.A OD2 no hydrogen 2.729 N/A GLU 182.A N ASP 179.A OD2 no hydrogen 2.831 N/A LEU 183.A N ASP 179.A O no hydrogen 2.989 N/A GLU 185.A N GLU 185.A OE2 no hydrogen 2.805 N/A TYR 186.A N LEU 183.A O no hydrogen 3.013 N/A TYR 187.A N PRO 184.A O no hydrogen 3.083 N/A TYR 187.A OH VAL 178.A O no hydrogen 2.643 N/A GLU 188.A N PRO 184.A O no hydrogen 3.347 N/A GLU 188.A N GLU 185.A O no hydrogen 3.159 N/A ILE 189.A N GLU 185.A O no hydrogen 3.079 N/A ILE 189.A N TYR 186.A O no hydrogen 3.284 N/A VAL 190.A N TYR 186.A O no hydrogen 2.777 N/A HIS 191.A N GLN 109.A OE1 no hydrogen 3.016 N/A HIS 191.A NE2 ASN 107.A OD1 no hydrogen 2.597 N/A LEU 195.A N PHE 175.A O no hydrogen 2.810 N/A SER 196.A OG GLU 176.A OE1 no hydrogen 3.278 N/A SER 196.A OG GLU 176.A OE2 no hydrogen 3.291 N/A VAL 198.A N ALA 194.A O no hydrogen 3.089 N/A LYS 199.A N LEU 195.A O no hydrogen 3.021 N/A GLN 200.A N SER 196.A O no hydrogen 3.050 N/A ASN 201.A N ILE 197.A O no hydrogen 2.903 N/A ASN 201.A ND2 TYR 207.A OH no hydrogen 3.104 N/A LEU 202.A N VAL 198.A O no hydrogen 2.829 N/A GLU 203.A N LYS 199.A O no hydrogen 2.883 N/A ILE 204.A N GLN 200.A O no hydrogen 3.006 N/A GLY 205.A N LEU 202.A O no hydrogen 3.249 N/A GLN 206.A N ASN 201.A O no hydrogen 2.931 N/A TYR 207.A OH ASP 216.A OD2 no hydrogen 2.592 N/A LYS 209.A N ASP 212.A OD2 no hydrogen 2.966 N/A LYS 209.A NZ ASP 212.A OD2 no hydrogen 3.254 N/A ILE 210.A N TYR 127.A O no hydrogen 2.948 N/A TYR 211.A N ASN 126.A OD1 no hydrogen 2.837 N/A PHE 213.A N LYS 209.A O no hydrogen 3.468 N/A ILE 214.A N ILE 210.A O no hydrogen 2.946 N/A ILE 215.A N TYR 211.A O no hydrogen 2.916 N/A ASP 216.A N ASP 212.A O no hydrogen 3.425 N/A LEU 218.A N ILE 215.A O no hydrogen 2.789 N/A VAL 219.A N ASP 216.A O no hydrogen 3.188 N/A GLN 221.A N LEU 217.A O no hydrogen 2.757 N/A GLN 221.A NE2 THR 241.A OG1 no hydrogen 3.344 N/A ASN 222.A N LEU 218.A O no hydrogen 2.924 N/A ALA 223.A N PHE 220.A O no hydrogen 3.178 N/A HIS 224.A N PHE 220.A O no hydrogen 3.451 N/A ILE 225.A N GLN 221.A O no hydrogen 3.047 N/A ILE 225.A N ASN 222.A O no hydrogen 3.206 N/A PHE 226.A N ASN 222.A O no hydrogen 2.993 N/A ASN 227.A N ALA 223.A O no hydrogen 3.133 N/A ASN 227.A ND2 ALA 223.A O no hydrogen 3.033 N/A SER 230.A N ASP 228.A OD2 no hydrogen 2.888 N/A SER 230.A OG ASP 228.A OD2 no hydrogen 2.768 N/A ALA 231.A N ASP 228.A O no hydrogen 2.875 N/A TYR 234.A N ALA 231.A O no hydrogen 2.988 N/A LYS 235.A N ALA 231.A O no hydrogen 3.253 N/A ASP 236.A N LEU 232.A O no hydrogen 2.950 N/A ALA 237.A N ILE 233.A O no hydrogen 2.908 N/A THR 238.A N TYR 234.A O no hydrogen 3.100 N/A THR 238.A OG1 TYR 234.A O no hydrogen 3.314 N/A THR 239.A N LYS 235.A O no hydrogen 2.930 N/A THR 239.A OG1 LYS 235.A O no hydrogen 3.157 N/A LEU 240.A N ASP 236.A O no hydrogen 2.857 N/A THR 241.A N ALA 237.A O no hydrogen 2.918 N/A THR 241.A OG1 ALA 237.A O no hydrogen 2.920 N/A ASN 242.A N THR 238.A O no hydrogen 2.991 N/A TYR 243.A N THR 239.A O no hydrogen 2.882 N/A PHE 244.A N LEU 240.A O no hydrogen 2.765 N/A ASN 245.A N THR 241.A O no hydrogen 2.921 N/A TYR 246.A N ASN 242.A O no hydrogen 2.950 N/A LEU 247.A N TYR 243.A O no hydrogen 2.903 N/A ILE 248.A N PHE 244.A O no hydrogen 2.985 N/A GLN 249.A N ASN 245.A O no hydrogen 2.978 N/A LYS 250.A N TYR 246.A O no hydrogen 2.817 N/A GLU 251.A N LEU 247.A O no hydrogen 3.011 N/A PHE 252.A N LEU 247.A O no hydrogen 2.750 N/A PHE 253.A N ILE 248.A O no hydrogen 2.907 N/A GLU 255.A N GLU 251.A O no hydrogen 2.905 N/A LEU 256.A N PHE 252.A O no hydrogen 3.013 N/A GLN 257.A N PHE 253.A O no hydrogen 2.970 N/A GLN 257.A NE2 GLU 261.A OE2 no hydrogen 2.940 N/A ASP 258.A N PRO 254.A O no hydrogen 2.931 N/A LEU 259.A N GLU 255.A O no hydrogen 2.957 N/A ASN 260.A N LEU 256.A O no hydrogen 2.859 N/A GLU 261.A N GLN 257.A O no hydrogen 2.900 N/A ARG 262.A N ASP 258.A O no hydrogen 3.065 N/A ARG 262.A NE ASP 258.A OD1 no hydrogen 2.901 N/A ARG 262.A NE ASP 258.A OD2 no hydrogen 3.148 N/A ARG 262.A NH2 ASP 258.A OD2 no hydrogen 2.750 N/A GLY 263.A N ASN 260.A O no hydrogen 3.003 N/A GLU 264.A N LEU 259.A O no hydrogen 2.791 N/A PHE 272.A N ASP 270.A OD1 no hydrogen 3.294 N/A PHE 274.A N LYS 271.A O no hydrogen 2.811 N/A ASN 276.A N GLU 273.A O no hydrogen 3.273 N/A TYR 277.A OH PRO 21.A O no hydrogen 2.576 N/A LEU 278.A N GLU 275.A O no hydrogen 3.073 N/A