Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8x1f_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N SER 3.A OG no hydrogen 2.946 N/A SER 3.A OG ASP 304.A OD1 no hydrogen 2.662 N/A ASP 5.A N MET 1.A O no hydrogen 3.501 N/A LYS 6.A N ALA 2.A O no hydrogen 3.152 N/A VAL 7.A N SER 3.A O no hydrogen 3.138 N/A VAL 7.A N MET 4.A O no hydrogen 3.191 N/A PHE 8.A N MET 4.A O no hydrogen 2.945 N/A ALA 9.A N ASP 5.A O no hydrogen 2.983 N/A GLY 10.A N LYS 6.A O no hydrogen 3.473 N/A TYR 11.A N VAL 7.A O no hydrogen 3.162 N/A ALA 12.A N PHE 8.A O no hydrogen 3.250 N/A ALA 13.A N ALA 9.A O no hydrogen 3.069 N/A ARG 14.A N GLY 10.A O no hydrogen 2.958 N/A ARG 14.A NE ASP 113.A OD1 no hydrogen 3.119 N/A ARG 14.A NE ASP 113.A OD2 no hydrogen 2.841 N/A ARG 14.A NH2 ASP 113.A OD1 no hydrogen 2.872 N/A ARG 14.A NH2 ASP 113.A OD2 no hydrogen 3.426 N/A GLN 15.A N TYR 11.A O no hydrogen 2.767 N/A ALA 16.A N ALA 12.A O no hydrogen 3.003 N/A ILE 17.A N ALA 13.A O no hydrogen 3.334 N/A LEU 18.A N ARG 14.A O no hydrogen 3.008 N/A GLU 19.A N GLN 15.A O no hydrogen 2.796 N/A SER 20.A OG ILE 17.A O no hydrogen 2.717 N/A THR 21.A N LEU 18.A O no hydrogen 3.305 N/A THR 21.A OG1 LEU 18.A O no hydrogen 2.891 N/A GLU 22.A N GLU 19.A O no hydrogen 3.322 N/A THR 23.A OG1 SER 20.A O no hydrogen 3.335 N/A THR 24.A OG1 THR 21.A O no hydrogen 3.454 N/A ASN 25.A N THR 21.A O no hydrogen 2.767 N/A ASN 25.A ND2 LYS 108.A O no hydrogen 2.962 N/A PHE 27.A N ASN 25.A OD1 no hydrogen 3.400 N/A ALA 28.A N ASN 25.A O no hydrogen 3.136 N/A GLY 30.A N PHE 27.A O no hydrogen 3.068 N/A ILE 31.A N VAL 143.A O no hydrogen 3.059 N/A ALA 32.A N VAL 39.A O no hydrogen 2.874 N/A TRP 33.A N MET 141.A O no hydrogen 2.838 N/A VAL 34.A N GLU 37.A O no hydrogen 2.876 N/A GLU 37.A N VAL 34.A O no hydrogen 2.909 N/A VAL 39.A N ALA 32.A O no hydrogen 2.997 N/A LEU 41.A N GLY 30.A O no hydrogen 3.247 N/A GLU 43.A N PRO 40.A O no hydrogen 3.263 N/A ALA 44.A N LEU 41.A O no hydrogen 3.186 N/A ARG 45.A NH1 ALA 42.A O no hydrogen 3.412 N/A ARG 45.A NH1 ALA 44.A O no hydrogen 2.820 N/A ASP 50.A N PRO 47.A O no hydrogen 3.067 N/A GLN 51.A N GLY 123.A O no hydrogen 3.188 N/A GLY 52.A N ASP 50.A OD1 no hydrogen 2.891 N/A PHE 53.A N ASP 50.A O no hydrogen 3.010 N/A MET 54.A N ASP 50.A O no hydrogen 2.899 N/A HIS 55.A N GLN 51.A O no hydrogen 2.980 N/A HIS 55.A ND1 GLN 51.A OE1 no hydrogen 3.131 N/A ASP 57.A N GLN 51.A O no hydrogen 3.017 N/A LEU 58.A N SER 56.A O no hydrogen 3.013 N/A THR 59.A N VAL 120.A O no hydrogen 3.276 N/A THR 59.A OG1 LYS 180.A O no hydrogen 2.706 N/A TYR 60.A N LYS 180.A O no hydrogen 3.433 N/A ASP 61.A N LEU 118.A O no hydrogen 3.066 N/A VAL 62.A N ASP 61.A OD1 no hydrogen 2.921 N/A VAL 65.A N ALA 114.A O no hydrogen 3.083 N/A TRP 66.A N ARG 69.A O no hydrogen 2.938 N/A ASP 67.A N ASP 113.A OD1 no hydrogen 2.848 N/A GLY 68.A N ARG 112.A O no hydrogen 2.993 N/A ARG 69.A N TRP 66.A O no hydrogen 3.006 N/A ARG 69.A NE HIS 310.A O no hydrogen 2.855 N/A ARG 69.A NH2 SER 316.A OG no hydrogen 3.272 N/A PHE 71.A N SER 64.A O no hydrogen 2.928 N/A ARG 72.A N TYR 315.A O no hydrogen 2.769 N/A ARG 72.A NE ASP 75.A OD2 no hydrogen 2.935 N/A ARG 72.A NH1 SER 242.A OG no hydrogen 2.510 N/A ARG 72.A NH1 ASN 245.A OD1 no hydrogen 2.899 N/A ARG 72.A NH2 ASP 75.A OD2 no hydrogen 3.564 N/A ARG 72.A NH2 ASN 245.A OD1 no hydrogen 2.937 N/A ASP 75.A N ARG 72.A O no hydrogen 3.167 N/A HIS 76.A N ARG 72.A O no hydrogen 3.448 N/A HIS 76.A ND1 ASP 61.A OD1 no hydrogen 2.780 N/A LEU 77.A N LEU 73.A O no hydrogen 2.951 N/A THR 78.A N ASP 74.A O no hydrogen 3.059 N/A THR 78.A OG1 ASP 74.A O no hydrogen 2.958 N/A ARG 79.A N ASP 75.A O no hydrogen 2.975 N/A ARG 79.A NE ASP 61.A OD2 no hydrogen 2.754 N/A ARG 79.A NH1 GLN 236.A O no hydrogen 2.849 N/A ARG 79.A NH2 ASP 61.A OD1 no hydrogen 2.826 N/A ARG 79.A NH2 ASP 61.A OD2 no hydrogen 3.489 N/A LEU 80.A N HIS 76.A O no hydrogen 3.305 N/A GLU 81.A N LEU 77.A O no hydrogen 3.320 N/A ALA 82.A N THR 78.A O no hydrogen 3.111 N/A SER 83.A N ARG 79.A O no hydrogen 2.922 N/A SER 83.A OG ARG 79.A O no hydrogen 2.900 N/A CYS 84.A N LEU 80.A O no hydrogen 2.969 N/A CYS 84.A SG LEU 80.A O no hydrogen 3.177 N/A THR 85.A N GLU 81.A O no hydrogen 2.954 N/A THR 85.A OG1 GLU 81.A O no hydrogen 2.873 N/A LYS 86.A N ALA 82.A O no hydrogen 3.211 N/A LYS 86.A NZ THR 178.A OG1 no hydrogen 3.254 N/A LEU 87.A N CYS 84.A O no hydrogen 2.953 N/A ARG 88.A N THR 85.A O no hydrogen 3.011 N/A LEU 89.A N CYS 84.A O no hydrogen 2.964 N/A ARG 90.A N ASN 137.A OD1 no hydrogen 2.860 N/A ARG 95.A NH1 THR 78.A OG1 no hydrogen 2.993 N/A ARG 95.A NH1 GLU 81.A OE1 no hydrogen 2.928 N/A ARG 95.A NH2 ASP 74.A O no hydrogen 3.154 N/A ARG 95.A NH2 ASP 74.A OD1 no hydrogen 3.210 N/A ARG 95.A NH2 THR 78.A OG1 no hydrogen 3.119 N/A GLU 97.A N PRO 94.A O no hydrogen 3.212 N/A VAL 98.A N PRO 94.A O no hydrogen 3.049 N/A LYS 99.A N ARG 95.A O no hydrogen 2.887 N/A LYS 99.A NZ ASP 74.A OD1 no hydrogen 3.447 N/A GLN 100.A N ASP 96.A O no hydrogen 3.381 N/A ILE 101.A N GLU 97.A O no hydrogen 3.097 N/A LEU 102.A N VAL 98.A O no hydrogen 2.979 N/A VAL 103.A N LYS 99.A O no hydrogen 3.200 N/A GLU 104.A N GLN 100.A O no hydrogen 2.948 N/A MET 105.A N ILE 101.A O no hydrogen 2.869 N/A VAL 106.A N LEU 102.A O no hydrogen 2.913 N/A ALA 107.A N VAL 103.A O no hydrogen 3.155 N/A LYS 108.A N GLU 104.A O no hydrogen 3.149 N/A SER 109.A N MET 105.A O no hydrogen 3.326 N/A SER 109.A OG MET 105.A O no hydrogen 3.457 N/A SER 109.A OG VAL 106.A O no hydrogen 2.516 N/A GLY 110.A N VAL 106.A O no hydrogen 3.138 N/A ILE 111.A N SER 109.A OG no hydrogen 3.195 N/A ARG 112.A NH1 GLY 110.A O no hydrogen 2.816 N/A ALA 114.A N VAL 65.A O no hydrogen 2.712 N/A PHE 115.A N GLN 144.A O no hydrogen 2.910 N/A VAL 116.A N PRO 63.A O no hydrogen 3.190 N/A GLU 117.A N PHE 142.A O no hydrogen 2.909 N/A LEU 118.A N ASP 61.A O no hydrogen 3.031 N/A ILE 119.A N TYR 140.A O no hydrogen 2.857 N/A VAL 120.A N THR 59.A O no hydrogen 3.071 N/A THR 121.A N ASN 138.A O no hydrogen 2.861 N/A THR 121.A OG1 ASP 50.A OD1 no hydrogen 2.603 N/A THR 121.A OG1 ASP 50.A OD2 no hydrogen 3.284 N/A ARG 122.A N ASP 57.A O no hydrogen 3.137 N/A ARG 122.A NE ASP 57.A OD1 no hydrogen 3.269 N/A ARG 122.A NE ASP 57.A OD2 no hydrogen 2.603 N/A ARG 122.A NH1 LEU 87.A O no hydrogen 2.803 N/A ARG 122.A NH2 ASP 57.A OD1 no hydrogen 2.762 N/A ARG 122.A NH2 ASP 57.A OD2 no hydrogen 3.479 N/A ARG 122.A NH2 LEU 87.A O no hydrogen 3.005 N/A GLY 123.A N THR 121.A OG1 no hydrogen 3.267 N/A THR 130.A N VAL 127.A O no hydrogen 3.458 N/A THR 130.A OG1 GLY 126.A O no hydrogen 3.007 N/A ARG 131.A NH2 GLU 133.A OE2 no hydrogen 2.694 N/A ASP 134.A N ARG 131.A O no hydrogen 2.897 N/A ASN 137.A ND2 ARG 122.A O no hydrogen 3.238 N/A ASN 138.A N THR 121.A O no hydrogen 3.051 N/A ASN 138.A ND2 ASP 50.A OD2 no hydrogen 2.972 N/A TYR 140.A N ILE 119.A O no hydrogen 2.940 N/A TYR 140.A OH ASP 50.A OD2 no hydrogen 2.522 N/A PHE 142.A N GLU 117.A O no hydrogen 2.927 N/A VAL 143.A N ILE 31.A O no hydrogen 2.805 N/A GLN 144.A N PHE 115.A O no hydrogen 2.991 N/A TYR 146.A N ASP 113.A O no hydrogen 2.918 N/A TRP 148.A NE1 TYR 11.A OH no hydrogen 3.053 N/A VAL 149.A N ALA 276.A O no hydrogen 2.902 N/A GLN 155.A N GLU 151.A O no hydrogen 3.207 N/A GLN 155.A NE2 MET 150.A O no hydrogen 3.198 N/A GLN 155.A NE2 GLY 277.A O no hydrogen 2.945 N/A ARG 156.A N ASP 153.A O no hydrogen 3.218 N/A ARG 156.A NH1 ASP 5.A OD1 no hydrogen 3.026 N/A ARG 156.A NH2 ASP 5.A OD1 no hydrogen 2.540 N/A VAL 157.A N MET 154.A O no hydrogen 3.393 N/A GLY 158.A N MET 154.A O no hydrogen 2.722 N/A GLY 159.A N PRO 281.A O no hydrogen 3.114 N/A ALA 161.A N THR 284.A O no hydrogen 2.944 N/A VAL 162.A N TYR 201.A O no hydrogen 3.059 N/A VAL 163.A N ASP 286.A OD1 no hydrogen 2.939 N/A ALA 164.A N PHE 203.A O no hydrogen 2.878 N/A ARG 165.A N GLU 193.A OE1 no hydrogen 3.276 N/A ARG 165.A N GLU 193.A OE2 no hydrogen 2.827 N/A THR 166.A N GLU 193.A OE1 no hydrogen 2.837 N/A THR 166.A OG1 GLU 193.A OE1 no hydrogen 2.411 N/A ARG 168.A NE ARG 169.A O no hydrogen 3.233 N/A ARG 168.A NH2 ARG 169.A O no hydrogen 3.470 N/A ARG 169.A N THR 205.A O no hydrogen 2.777 N/A ARG 169.A NE GLU 213.A OE2 no hydrogen 2.864 N/A ARG 169.A NH1 ASP 186.A OD2 no hydrogen 2.579 N/A ARG 169.A NH2 GLU 213.A OE2 no hydrogen 2.775 N/A VAL 170.A N ASP 186.A OD2 no hydrogen 2.989 N/A ALA 174.A N PRO 171.A O no hydrogen 2.838 N/A ILE 175.A N PRO 171.A O no hydrogen 3.258 N/A THR 178.A N ASP 176.A OD1 no hydrogen 2.908 N/A THR 178.A OG1 ASP 176.A OD1 no hydrogen 2.720 N/A THR 178.A OG1 ASP 176.A OD2 no hydrogen 3.236 N/A VAL 179.A N ASP 176.A O no hydrogen 2.901 N/A LYS 180.A NZ TYR 60.A OH no hydrogen 3.337 N/A ASN 181.A ND2 VAL 179.A O no hydrogen 2.726 N/A GLN 183.A N ASN 181.A OD1 no hydrogen 3.135 N/A GLN 183.A NE2 SER 56.A O no hydrogen 2.816 N/A LEU 187.A N ASP 186.A OD1 no hydrogen 3.008 N/A VAL 188.A N TRP 184.A O no hydrogen 2.900 N/A ARG 189.A N GLY 185.A O no hydrogen 3.153 N/A ARG 189.A NH2 THR 166.A O no hydrogen 2.967 N/A GLY 190.A N ASP 186.A O no hydrogen 2.955 N/A MET 191.A N LEU 187.A O no hydrogen 2.951 N/A PHE 192.A N VAL 188.A O no hydrogen 3.126 N/A GLU 193.A N ARG 189.A O no hydrogen 3.081 N/A ALA 194.A N GLY 190.A O no hydrogen 2.901 N/A ALA 195.A N MET 191.A O no hydrogen 3.060 N/A ASP 196.A N PHE 192.A O no hydrogen 2.776 N/A ARG 197.A N GLU 193.A O no hydrogen 2.897 N/A ARG 197.A N ALA 194.A O no hydrogen 3.138 N/A ARG 197.A NH1 VAL 163.A O no hydrogen 2.891 N/A ARG 197.A NH1 GLU 193.A OE2 no hydrogen 2.839 N/A GLY 198.A N ALA 195.A O no hydrogen 3.072 N/A ALA 199.A N ALA 194.A O no hydrogen 2.800 N/A THR 200.A N SER 160.A O no hydrogen 3.143 N/A TYR 201.A N SER 160.A O no hydrogen 3.162 N/A TYR 201.A OH VAL 149.A O no hydrogen 2.735 N/A PHE 203.A N VAL 162.A O no hydrogen 2.880 N/A LEU 204.A N GLU 213.A O no hydrogen 3.207 N/A ASP 206.A N ASN 210.A O no hydrogen 3.250 N/A GLY 207.A N THR 205.A OG1 no hydrogen 3.262 N/A ASP 208.A N ASP 206.A OD1 no hydrogen 2.714 N/A ASN 210.A N ASP 206.A OD1 no hydrogen 3.235 N/A LEU 211.A N VAL 259.A O no hydrogen 2.840 N/A THR 212.A N LEU 204.A O no hydrogen 2.897 N/A THR 212.A OG1 LEU 204.A O no hydrogen 2.883 N/A GLY 214.A N PHE 217.A O no hydrogen 3.049 N/A GLY 216.A N GLY 214.A O no hydrogen 2.813 N/A ASN 218.A N CYS 273.A O no hydrogen 2.968 N/A ASN 218.A ND2 LEU 235.A O no hydrogen 3.113 N/A VAL 220.A N PHE 271.A O no hydrogen 3.038 N/A LEU 221.A N TYR 228.A O no hydrogen 2.957 N/A VAL 222.A N GLU 269.A O no hydrogen 2.862 N/A LYS 223.A N VAL 226.A O no hydrogen 2.998 N/A LYS 223.A NZ ARG 266.A O no hydrogen 2.935 N/A ASP 224.A N ASP 268.A OD2 no hydrogen 2.817 N/A VAL 226.A N LYS 223.A O no hydrogen 3.100 N/A LEU 227.A N GLU 253.A O no hydrogen 2.921 N/A TYR 228.A N LEU 221.A O no hydrogen 2.875 N/A THR 229.A N ARG 255.A O no hydrogen 2.902 N/A THR 229.A OG1 ILE 219.A O no hydrogen 2.778 N/A LEU 235.A N GLU 213.A OE1 no hydrogen 2.945 N/A LYS 241.A N GLY 237.A O no hydrogen 2.952 N/A SER 242.A N VAL 238.A O no hydrogen 3.298 N/A SER 242.A N THR 239.A O no hydrogen 3.151 N/A SER 242.A OG VAL 238.A O no hydrogen 3.008 N/A VAL 243.A N THR 239.A O no hydrogen 2.986 N/A ILE 244.A N ARG 240.A O no hydrogen 3.126 N/A ASN 245.A N LYS 241.A O no hydrogen 3.099 N/A ALA 246.A N SER 242.A O no hydrogen 2.786 N/A ALA 247.A N VAL 243.A O no hydrogen 2.968 N/A GLU 248.A N ILE 244.A O no hydrogen 3.057 N/A ALA 249.A N ASN 245.A O no hydrogen 3.372 N/A ALA 249.A N ALA 246.A O no hydrogen 3.258 N/A PHE 250.A N ALA 246.A O no hydrogen 3.160 N/A PHE 250.A N ALA 247.A O no hydrogen 3.030 N/A ILE 252.A N ALA 247.A O no hydrogen 2.922 N/A ARG 255.A N LEU 227.A O no hydrogen 2.824 N/A ARG 255.A NH1 GLU 257.A OE2 no hydrogen 3.317 N/A GLU 257.A N THR 229.A O no hydrogen 3.136 N/A VAL 261.A N ALA 209.A O no hydrogen 3.276 N/A LEU 263.A N PRO 260.A O no hydrogen 2.921 N/A ALA 264.A N VAL 261.A O no hydrogen 2.753 N/A TYR 265.A N GLU 262.A O no hydrogen 3.110 N/A TYR 265.A OH ASP 286.A OD2 no hydrogen 2.665 N/A ARG 266.A N LEU 263.A O no hydrogen 3.445 N/A CYS 267.A SG ALA 264.A O no hydrogen 3.482 N/A CYS 267.A SG GLU 269.A O no hydrogen 3.668 N/A ASP 268.A N VAL 222.A O no hydrogen 2.939 N/A GLU 269.A N VAL 222.A O no hydrogen 3.301 N/A PHE 271.A N VAL 220.A O no hydrogen 3.129 N/A MET 272.A N MET 280.A O no hydrogen 2.892 N/A CYS 273.A N ASN 218.A O no hydrogen 3.063 N/A THR 274.A N GLY 278.A O no hydrogen 3.066 N/A THR 274.A OG1 GLY 216.A O no hydrogen 2.794 N/A GLY 277.A N TYR 146.A OH no hydrogen 3.321 N/A GLY 278.A N THR 274.A O no hydrogen 2.854 N/A MET 280.A N MET 272.A O no hydrogen 2.888 N/A ILE 282.A N ILE 270.A O no hydrogen 2.879 N/A THR 283.A N GLY 159.A O no hydrogen 3.160 N/A THR 283.A OG1 VAL 157.A O no hydrogen 3.201 N/A THR 284.A N GLY 159.A O no hydrogen 3.339 N/A LEU 285.A N MET 288.A O no hydrogen 2.828 N/A ASP 286.A N ALA 161.A O no hydrogen 3.029 N/A MET 288.A N LEU 285.A O no hydrogen 3.096 N/A VAL 290.A N THR 283.A O no hydrogen 2.837 N/A ASN 291.A ND2 ASP 268.A O no hydrogen 3.172 N/A GLY 293.A N VAL 290.A O no hydrogen 2.892 N/A ILE 298.A N GLU 269.A OE2 no hydrogen 3.373 N/A THR 299.A N GLU 269.A OE1 no hydrogen 2.814 N/A THR 299.A OG1 GLU 269.A OE1 no hydrogen 2.675 N/A LYS 300.A N GLY 296.A O no hydrogen 3.304 N/A LYS 301.A N PRO 297.A O no hydrogen 3.266 N/A ILE 302.A N ILE 298.A O no hydrogen 2.908 N/A TRP 303.A N THR 299.A O no hydrogen 2.961 N/A TRP 303.A NE1 GLN 155.A OE1 no hydrogen 2.856 N/A ASP 304.A N LYS 300.A O no hydrogen 3.335 N/A GLY 305.A N LYS 301.A O no hydrogen 2.974 N/A TYR 306.A N ILE 302.A O no hydrogen 3.108 N/A TRP 307.A N TRP 303.A O no hydrogen 3.444 N/A ALA 308.A N ASP 304.A O no hydrogen 3.059 N/A MET 309.A N GLY 305.A O no hydrogen 3.196 N/A HIS 310.A N TRP 307.A O no hydrogen 2.993 N/A HIS 310.A ND1 TYR 306.A O no hydrogen 2.824 N/A TYR 311.A N ALA 308.A O no hydrogen 3.069 N/A TYR 311.A OH ASP 67.A OD2 no hydrogen 2.575 N/A ASP 312.A N MET 309.A O no hydrogen 3.477 N/A ALA 314.A N ASP 312.A OD1 no hydrogen 3.066 N/A TYR 315.A N ASP 312.A O no hydrogen 3.155 N/A SER 316.A OG HIS 310.A O no hydrogen 3.204 N/A SER 316.A OG ASP 312.A O no hydrogen 2.676 N/A PHE 317.A N PHE 70.A O no hydrogen 3.272 N/A ILE 319.A N GLY 68.A O no hydrogen 2.962 N/A TYR 321.A OH ILE 111.A O no hydrogen 2.772 N/A ASN 322.A N ASP 320.A OD1 no hydrogen 3.206 N/A ASN 322.A ND2 TYR 321.A O no hydrogen 3.050 N/A