Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7hku_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N ASN 1.A O no hydrogen 3.212 N/A GLY 6.A N LEU 2.A O no hydrogen 2.599 N/A LYS 7.A NZ GLU 155.A OE1 no hydrogen 2.968 N/A ARG 8.A NH1 CYS 157.A O no hydrogen 3.176 N/A ARG 8.A NH1 LEU 263.A O no hydrogen 2.949 N/A ARG 8.A NH2 ILE 4.A O no hydrogen 3.181 N/A ARG 8.A NH2 LEU 263.A O no hydrogen 2.736 N/A ILE 9.A N ILE 5.A O no hydrogen 2.924 N/A GLU 10.A N GLY 6.A O no hydrogen 2.507 N/A LYS 11.A N LYS 7.A O no hydrogen 2.835 N/A LYS 11.A NZ GLU 15.A OE1 no hydrogen 3.099 N/A ILE 12.A N ARG 8.A O no hydrogen 3.212 N/A LYS 13.A N ILE 9.A O no hydrogen 2.977 N/A GLN 14.A N GLU 10.A O no hydrogen 3.299 N/A GLU 15.A N ILE 12.A O no hydrogen 3.132 N/A HIS 16.A N LYS 13.A O no hydrogen 2.973 N/A SER 19.A OG THR 18.A O no hydrogen 2.777 N/A TRP 20.A N HIS 16.A O no hydrogen 3.198 N/A HIS 21.A N SER 36.A O no hydrogen 3.331 N/A HIS 21.A ND1 SER 19.A O no hydrogen 3.003 N/A ASP 25.A N ASP 23.A OD1 no hydrogen 2.676 N/A HIS 26.A ND1 ASP 23.A O no hydrogen 2.941 N/A THR 30.A N ASP 76.A OD1 no hydrogen 3.247 N/A THR 30.A OG1 ASP 76.A OD1 no hydrogen 2.399 N/A TRP 31.A NE1 VAL 75.A O no hydrogen 3.154 N/A TYR 33.A OH SER 36.A OG no hydrogen 2.537 N/A HIS 34.A N ILE 281.A O no hydrogen 3.009 N/A HIS 34.A NE2 SER 283.A OG no hydrogen 2.861 N/A SER 36.A OG TYR 33.A OH no hydrogen 2.537 N/A SER 36.A OG ASP 280.A OD1 no hydrogen 3.044 N/A TYR 37.A N MET 279.A O no hydrogen 3.291 N/A THR 39.A N THR 277.A O no hydrogen 3.311 N/A SER 45.A OG ALA 68.A O no hydrogen 3.185 N/A MET 46.A N SER 430.A O.A no hydrogen 3.217 N/A MET 46.A N SER 430.A O.B no hydrogen 3.230 N/A ASN 48.A N ARG 428.A O no hydrogen 2.841 N/A ASN 48.A ND2 THR 440.A O no hydrogen 3.096 N/A VAL 51.A N ASN 48.A OD1 no hydrogen 3.167 N/A ARG 52.A N ASN 48.A O no hydrogen 3.056 N/A LEU 53.A N GLY 49.A O no hydrogen 2.939 N/A LEU 54.A N VAL 50.A O no hydrogen 3.320 N/A LEU 54.A N VAL 51.A O no hydrogen 3.074 N/A THR 55.A N ARG 52.A O no hydrogen 3.007 N/A THR 55.A OG1 VAL 51.A O no hydrogen 2.780 N/A THR 55.A OG1 ARG 52.A O no hydrogen 3.417 N/A TRP 58.A N THR 55.A O no hydrogen 3.040 N/A ASP 59.A N LYS 56.A O no hydrogen 2.871 N/A ILE 61.A N TRP 58.A O no hydrogen 3.277 N/A VAL 64.A N ILE 61.A O no hydrogen 2.921 N/A THR 65.A N ILE 61.A O no hydrogen 3.093 N/A THR 65.A OG1 ILE 61.A O no hydrogen 3.489 N/A THR 65.A OG1 PRO 62.A O no hydrogen 3.493 N/A GLN 66.A N PRO 62.A O no hydrogen 2.886 N/A MET 67.A N VAL 64.A O no hydrogen 3.309 N/A ALA 68.A N THR 65.A O no hydrogen 3.232 N/A MET 69.A N GLN 66.A O no hydrogen 3.179 N/A LYS 74.A N PHE 71.A O no hydrogen 2.847 N/A THR 77.A OG1 LYS 74.A O no hydrogen 2.449 N/A LYS 83.A N ASP 372.A OD2 no hydrogen 2.908 N/A GLY 85.A N GLN 322.A O no hydrogen 3.420 N/A THR 86.A N ILE 321.A O no hydrogen 3.081 N/A THR 86.A OG1 ASP 372.A OD2 no hydrogen 2.405 N/A LYS 87.A N LYS 83.A O no hydrogen 3.097 N/A LYS 87.A NZ GLU 84.A OE2 no hydrogen 3.037 N/A LYS 88.A N GLU 84.A O no hydrogen 3.118 N/A LEU 89.A N GLY 85.A O no hydrogen 3.101 N/A MET 90.A N THR 86.A O no hydrogen 2.943 N/A LYS 91.A N LYS 87.A O no hydrogen 3.024 N/A LYS 91.A NZ GLU 237.A OE2 no hydrogen 3.492 N/A LYS 91.A NZ ASN 241.A OD1 no hydrogen 3.218 N/A ILE 92.A N LYS 88.A O no hydrogen 2.964 N/A THR 93.A N LEU 89.A O no hydrogen 3.004 N/A THR 93.A OG1 LEU 89.A O no hydrogen 2.703 N/A ALA 94.A N MET 90.A O no hydrogen 2.870 N/A GLU 95.A N LYS 91.A O no hydrogen 3.017 N/A TRP 96.A N ILE 92.A O no hydrogen 3.120 N/A LEU 97.A N THR 93.A O no hydrogen 2.845 N/A LEU 97.A N ALA 94.A O no hydrogen 3.013 N/A TRP 98.A N ALA 94.A O no hydrogen 2.969 N/A TRP 98.A NE1 ASN 241.A O no hydrogen 3.092 N/A LYS 99.A N GLU 95.A O no hydrogen 3.273 N/A GLU 100.A N TRP 96.A O no hydrogen 3.057 N/A LEU 101.A N LEU 97.A O no hydrogen 2.921 N/A GLY 102.A N TRP 98.A O no hydrogen 2.837 N/A LYS 103.A N GLU 100.A O no hydrogen 3.458 N/A LYS 103.A NZ GLU 100.A OE1 no hydrogen 3.049 N/A LYS 103.A NZ GLU 100.A OE2 no hydrogen 3.133 N/A LYS 105.A N GLY 102.A O no hydrogen 3.290 N/A LYS 105.A NZ ASP 187.A O no hydrogen 2.884 N/A ARG 108.A NE ASP 187.A OD2 no hydrogen 2.942 N/A ARG 108.A NH1 MET 109.A O no hydrogen 3.135 N/A ARG 108.A NH1 GLU 114.A OE1 no hydrogen 2.938 N/A ARG 108.A NH1 GLU 114.A OE2 no hydrogen 3.108 N/A ARG 108.A NH2 GLU 114.A OE2 no hydrogen 3.144 N/A ARG 108.A NH2 ASP 187.A OD1 no hydrogen 3.048 N/A CYS 110.A N GLU 179.A O no hydrogen 2.988 N/A THR 111.A N GLU 114.A OE1 no hydrogen 2.875 N/A THR 111.A OG1 GLU 114.A OE1 no hydrogen 3.489 N/A ARG 112.A NH2 ASP 143.A OD1 no hydrogen 2.505 N/A GLU 114.A N THR 111.A OG1 no hydrogen 3.073 N/A PHE 115.A N THR 111.A O no hydrogen 2.872 N/A THR 116.A N ARG 112.A O no hydrogen 2.701 N/A THR 116.A OG1 ARG 112.A O no hydrogen 2.873 N/A ARG 117.A N GLU 113.A O no hydrogen 3.015 N/A LYS 118.A N GLU 114.A O no hydrogen 3.213 N/A LYS 118.A NZ GLU 186.A OE2 no hydrogen 2.809 N/A VAL 119.A N PHE 115.A O no hydrogen 3.175 N/A ARG 120.A N THR 116.A O no hydrogen 3.261 N/A ARG 120.A NH1 GLU 134.A OE2 no hydrogen 2.875 N/A SER 121.A N ARG 117.A O no hydrogen 2.998 N/A SER 121.A OG ARG 117.A O no hydrogen 2.599 N/A SER 121.A OG LYS 118.A O no hydrogen 3.535 N/A LYS 127.A N GLU 131.A OE1 no hydrogen 2.932 N/A ARG 130.A NH1 ASN 122.A OD1 no hydrogen 2.520 N/A GLU 134.A N GLU 131.A O no hydrogen 2.949 N/A ASP 135.A N GLU 131.A O no hydrogen 3.421 N/A GLY 137.A N ASP 135.A OD1 no hydrogen 2.507 N/A TRP 139.A NE1 VAL 133.A O no hydrogen 3.088 N/A GLU 140.A N SER 136.A O no hydrogen 3.272 N/A LEU 141.A N GLY 137.A O no hydrogen 2.952 N/A VAL 142.A N PHE 138.A O no hydrogen 2.831 N/A ASP 143.A N TRP 139.A O no hydrogen 2.856 N/A LYS 144.A N GLU 140.A O no hydrogen 2.918 N/A GLU 145.A N LEU 141.A O no hydrogen 3.072 N/A ARG 146.A N VAL 142.A O no hydrogen 2.770 N/A ASN 147.A N ASP 143.A O no hydrogen 2.833 N/A ASN 147.A ND2 ASP 143.A O no hydrogen 3.359 N/A LEU 148.A N LYS 144.A O no hydrogen 2.960 N/A HIS 149.A N GLU 145.A O no hydrogen 2.725 N/A LEU 150.A N ARG 146.A O no hydrogen 2.999 N/A GLU 151.A N ASN 147.A O no hydrogen 3.095 N/A GLU 151.A N LEU 148.A O no hydrogen 2.840 N/A GLY 152.A N HIS 149.A O no hydrogen 3.018 N/A LYS 153.A N LEU 148.A O no hydrogen 3.111 N/A CYS 154.A SG GLU 145.A OE1 no hydrogen 3.750 N/A CYS 154.A SG HIS 149.A NE2 no hydrogen 3.581 N/A GLU 155.A N GLU 145.A OE1 no hydrogen 3.460 N/A GLU 155.A N GLU 145.A OE2 no hydrogen 3.056 N/A THR 156.A N GLU 145.A OE1 no hydrogen 2.640 N/A THR 156.A OG1 GLU 145.A OE1 no hydrogen 2.738 N/A CYS 157.A SG GLU 145.A OE1 no hydrogen 3.017 N/A CYS 157.A SG HIS 149.A NE2 no hydrogen 3.595 N/A TYR 159.A N VAL 269.A O no hydrogen 2.667 N/A ASN 160.A N TYR 168.A O no hydrogen 2.852 N/A MET 161.A N ARG 271.A O no hydrogen 3.177 N/A TRP 170.A NE1 THR 156.A OG1 no hydrogen 3.097 N/A ALA 173.A N TRP 170.A O no hydrogen 2.952 N/A ARG 174.A N TRP 170.A O no hydrogen 3.402 N/A ARG 174.A NH2 TRP 167.A O no hydrogen 3.190 N/A PHE 175.A N LEU 171.A O no hydrogen 2.967 N/A LEU 176.A N GLY 172.A O no hydrogen 3.219 N/A GLU 177.A N ALA 173.A O no hydrogen 2.949 N/A PHE 178.A N ARG 174.A O no hydrogen 2.865 N/A GLU 179.A N PHE 175.A O no hydrogen 2.699 N/A ALA 180.A N LEU 176.A O no hydrogen 3.278 N/A ALA 180.A N GLU 177.A O no hydrogen 3.197 N/A LEU 181.A N GLU 177.A O no hydrogen 2.922 N/A GLY 182.A N PHE 178.A O no hydrogen 2.840 N/A LEU 184.A N LEU 181.A O no hydrogen 3.064 N/A ASN 185.A ND2 GLU 200.A OE2 no hydrogen 3.472 N/A GLU 186.A N GLY 182.A O no hydrogen 2.784 N/A ASP 187.A N PHE 183.A O no hydrogen 2.892 N/A HIS 188.A N ASN 185.A O no hydrogen 3.093 N/A HIS 188.A ND1 GLU 200.A OE1 no hydrogen 2.880 N/A TRP 189.A N LEU 184.A O no hydrogen 2.936 N/A SER 191.A N HIS 188.A O no hydrogen 3.341 N/A SER 191.A OG HIS 188.A O no hydrogen 3.341 N/A ARG 192.A N GLU 202.A OE2 no hydrogen 3.208 N/A ARG 192.A NH1 SER 197.A O no hydrogen 3.038 N/A ARG 192.A NH1 GLY 198.A O no hydrogen 3.175 N/A ARG 192.A NH1 MET 347.A O no hydrogen 3.187 N/A ARG 192.A NH2 MET 347.A O no hydrogen 2.921 N/A ASN 194.A N SER 191.A OG no hydrogen 3.020 N/A ASN 194.A ND2 LEU 101.A O no hydrogen 3.061 N/A ASN 194.A ND2 TRP 189.A O no hydrogen 2.976 N/A SER 195.A N SER 191.A O no hydrogen 3.050 N/A SER 195.A OG SER 191.A O no hydrogen 2.883 N/A LEU 196.A N ARG 192.A O no hydrogen 2.841 N/A SER 197.A OG LEU 344.A O no hydrogen 2.608 N/A GLY 198.A N SER 195.A OG no hydrogen 2.941 N/A GLU 200.A N PHE 190.A O no hydrogen 3.063 N/A GLU 202.A N VAL 199.A O no hydrogen 2.940 N/A LYS 206.A N GLY 203.A O no hydrogen 2.977 N/A LEU 207.A N GLY 203.A O no hydrogen 3.263 N/A TYR 209.A OH VAL 412.A O no hydrogen 2.886 N/A ILE 210.A N LYS 206.A O no hydrogen 3.024 N/A LEU 211.A N LEU 207.A O no hydrogen 3.014 N/A ARG 212.A N GLY 208.A O no hydrogen 2.951 N/A ARG 212.A NH1 GLU 404.A OE1 no hydrogen 3.297 N/A ASP 213.A N TYR 209.A O no hydrogen 2.933 N/A VAL 214.A N ILE 210.A O no hydrogen 3.053 N/A SER 215.A N LEU 211.A O no hydrogen 2.950 N/A SER 215.A OG ARG 212.A O no hydrogen 2.605 N/A LYS 216.A N ASP 213.A O no hydrogen 3.200 N/A LYS 216.A NZ ASP 213.A OD1 no hydrogen 3.164 N/A LYS 217.A N VAL 214.A O no hydrogen 3.081 N/A LYS 217.A NZ GLU 342.A OE2 no hydrogen 3.175 N/A LYS 217.A NZ SER 345.A OG no hydrogen 2.829 N/A GLY 220.A N PRO 358.A O no hydrogen 3.162 N/A ALA 221.A N ASP 361.A OD1 no hydrogen 2.765 N/A MET 222.A N TRP 389.A O no hydrogen 2.811 N/A TYR 223.A N VAL 356.A O no hydrogen 2.840 N/A TYR 223.A OH ASP 361.A OD1 no hydrogen 2.475 N/A ALA 228.A N VAL 376.A O no hydrogen 3.069 N/A TRP 230.A NE1 ASN 299.A OD1 no hydrogen 2.877 N/A THR 232.A N GLY 229.A O no hydrogen 2.962 N/A THR 232.A OG1 GLY 229.A O no hydrogen 2.652 N/A ARG 233.A N TRP 230.A O no hydrogen 2.995 N/A ARG 233.A NE ALA 228.A O no hydrogen 2.781 N/A THR 235.A N ASP 238.A OD2 no hydrogen 3.021 N/A ASP 238.A N THR 235.A OG1 no hydrogen 2.948 N/A LEU 239.A N THR 235.A O no hydrogen 3.106 N/A LYS 240.A N LEU 236.A O no hydrogen 3.009 N/A ASN 241.A N GLU 237.A O no hydrogen 3.167 N/A GLU 242.A N ASP 238.A O no hydrogen 2.913 N/A GLU 243.A N.A LEU 239.A O no hydrogen 3.123 N/A GLU 243.A N.B LEU 239.A O no hydrogen 3.120 N/A MET 244.A N ASN 241.A O no hydrogen 3.370 N/A VAL 245.A N GLU 242.A O no hydrogen 3.169 N/A THR 246.A N GLU 243.A O.A no hydrogen 2.882 N/A THR 246.A N GLU 243.A O.B no hydrogen 2.869 N/A THR 246.A OG1 GLU 243.A O.A no hydrogen 2.725 N/A THR 246.A OG1 GLU 243.A O.B no hydrogen 2.739 N/A THR 246.A OG1 GLU 243.A OE2.B no hydrogen 2.942 N/A ASN 247.A N MET 244.A O no hydrogen 3.102 N/A HIS 248.A N VAL 245.A O no hydrogen 2.929 N/A MET 249.A N THR 246.A O no hydrogen 3.051 N/A HIS 253.A NE2 ALA 180.A O no hydrogen 2.670 N/A LYS 254.A N GLU 250.A O no hydrogen 3.235 N/A LYS 254.A NZ THR 246.A O no hydrogen 3.567 N/A LEU 256.A N GLU 252.A O no hydrogen 2.859 N/A ALA 257.A N HIS 253.A O no hydrogen 2.842 N/A GLU 258.A N LYS 254.A O no hydrogen 3.008 N/A ALA 259.A N LYS 255.A O no hydrogen 3.121 N/A ILE 260.A N LEU 256.A O no hydrogen 3.093 N/A PHE 261.A N ALA 257.A O no hydrogen 3.084 N/A LYS 262.A N GLU 258.A O no hydrogen 2.897 N/A LYS 262.A NZ GLU 243.A OE2.A no hydrogen 3.472 N/A LEU 263.A N ALA 259.A O no hydrogen 2.874 N/A THR 264.A N ILE 260.A O no hydrogen 2.997 N/A THR 264.A OG1 ILE 260.A O no hydrogen 2.558 N/A TYR 265.A N ILE 260.A O no hydrogen 3.183 N/A TYR 265.A N PHE 261.A O no hydrogen 3.304 N/A TYR 265.A OH GLU 177.A OE1 no hydrogen 2.503 N/A GLN 266.A N PHE 261.A O no hydrogen 2.780 N/A GLN 266.A NE2 GLU 243.A OE1.A no hydrogen 3.246 N/A ASN 267.A ND2 LYS 262.A O no hydrogen 2.900 N/A LYS 268.A NZ TYR 265.A O no hydrogen 2.689 N/A LYS 268.A NZ ASP 286.A O no hydrogen 2.768 N/A LYS 268.A NZ GLN 287.A O no hydrogen 3.203 N/A VAL 270.A N ILE 282.A O no hydrogen 3.086 N/A ARG 271.A N TYR 159.A O no hydrogen 2.762 N/A VAL 272.A N ASP 280.A O no hydrogen 3.037 N/A ARG 274.A N VAL 278.A O no hydrogen 3.051 N/A ARG 274.A NE ASP 280.A OD2 no hydrogen 2.743 N/A ARG 274.A NH1 ASP 25.A O no hydrogen 3.061 N/A ARG 274.A NH2 ASP 280.A OD1 no hydrogen 3.154 N/A THR 277.A OG1 PRO 275.A O no hydrogen 3.500 N/A VAL 278.A N ARG 274.A O no hydrogen 3.248 N/A MET 279.A N TYR 37.A O no hydrogen 2.792 N/A ASP 280.A N VAL 272.A O no hydrogen 2.851 N/A ILE 281.A N GLY 35.A O no hydrogen 3.033 N/A ILE 282.A N VAL 270.A O no hydrogen 3.130 N/A SER 283.A N ALA 32.A O no hydrogen 2.935 N/A SER 283.A OG HIS 34.A NE2 no hydrogen 2.861 N/A ARG 284.A NE ASP 286.A OD1 no hydrogen 2.745 N/A ARG 284.A NH2 THR 77.A O no hydrogen 3.485 N/A ARG 284.A NH2 ASP 286.A OD1 no hydrogen 2.779 N/A ARG 285.A NE GLN 266.A O no hydrogen 3.020 N/A ARG 285.A NE ASN 267.A OD1 no hydrogen 3.339 N/A ARG 285.A NH2 GLN 266.A O no hydrogen 3.422 N/A GLN 287.A N ILE 234.A O no hydrogen 2.806 N/A GLN 287.A NE2 VAL 75.A O no hydrogen 3.189 N/A ARG 288.A N ASP 231.A O no hydrogen 3.022 N/A ARG 288.A NE ASN 299.A OD1 no hydrogen 3.068 N/A ARG 288.A NH1 GLU 242.A OE1 no hydrogen 2.668 N/A ARG 288.A NH2 GLU 242.A OE1 no hydrogen 3.442 N/A ARG 288.A NH2 GLU 242.A OE2 no hydrogen 2.874 N/A ARG 288.A NH2 ASN 299.A OD1 no hydrogen 3.003 N/A GLY 291.A N GLU 177.A OE1 no hydrogen 2.989 N/A GLY 291.A N GLU 177.A OE2 no hydrogen 3.137 N/A THR 295.A N GLY 291.A O no hydrogen 2.862 N/A THR 295.A OG1 GLY 291.A O no hydrogen 2.671 N/A TYR 296.A N GLN 292.A O no hydrogen 3.161 N/A TYR 296.A OH SER 350.A OG no hydrogen 2.860 N/A GLY 297.A N VAL 293.A O no hydrogen 3.388 N/A LEU 298.A N VAL 294.A O no hydrogen 2.993 N/A ASN 299.A N THR 295.A O no hydrogen 2.879 N/A ASN 299.A ND2 ASP 231.A OD1 no hydrogen 3.160 N/A THR 300.A N TYR 296.A O no hydrogen 2.925 N/A THR 300.A OG1 TYR 296.A O no hydrogen 2.738 N/A PHE 301.A N GLY 297.A O no hydrogen 3.029 N/A THR 302.A N LEU 298.A O no hydrogen 3.015 N/A THR 302.A OG1 GLU 242.A OE2 no hydrogen 2.368 N/A THR 302.A OG1 LEU 298.A O no hydrogen 3.229 N/A ASN 303.A N ASN 299.A O no hydrogen 2.949 N/A ASN 303.A ND2 GLY 351.A O no hydrogen 2.977 N/A MET 304.A N THR 300.A O no hydrogen 2.885 N/A GLU 305.A N PHE 301.A O no hydrogen 3.083 N/A ALA 306.A N THR 302.A O no hydrogen 2.782 N/A GLN 307.A N ASN 303.A O no hydrogen 2.952 N/A GLN 307.A NE2 ASN 303.A OD1 no hydrogen 3.079 N/A LEU 308.A N MET 304.A O no hydrogen 2.979 N/A ILE 309.A N GLU 305.A O no hydrogen 3.086 N/A ARG 310.A N ALA 306.A O no hydrogen 2.884 N/A ARG 310.A NE PHE 363.A O no hydrogen 3.168 N/A ARG 310.A NH1 ASP 225.A OD2 no hydrogen 2.805 N/A ARG 310.A NH2 PHE 363.A O no hydrogen 2.926 N/A ARG 310.A NH2 SER 386.A OG no hydrogen 2.883 N/A GLN 311.A N GLN 307.A O no hydrogen 2.960 N/A GLN 311.A NE2 ARG 343.A O no hydrogen 3.133 N/A MET 312.A N LEU 308.A O no hydrogen 2.879 N/A GLU 313.A N ILE 309.A O no hydrogen 2.945 N/A GLY 314.A N ARG 310.A O no hydrogen 3.095 N/A GLU 315.A N GLN 311.A O no hydrogen 3.079 N/A GLY 316.A N GLU 313.A O no hydrogen 3.139 N/A VAL 317.A N MET 312.A O no hydrogen 3.057 N/A LYS 319.A N GLU 328.A OE1 no hydrogen 2.893 N/A GLN 322.A N SER 320.A OG no hydrogen 3.234 N/A THR 325.A N GLU 328.A OE2 no hydrogen 3.447 N/A THR 325.A OG1 THR 327.A OG1 no hydrogen 3.353 N/A THR 327.A OG1 THR 325.A OG1 no hydrogen 3.353 N/A GLU 328.A N THR 325.A OG1 no hydrogen 2.901 N/A GLU 329.A N THR 325.A O no hydrogen 3.249 N/A ILE 330.A N VAL 326.A O no hydrogen 3.053 N/A ALA 331.A N THR 327.A O no hydrogen 2.768 N/A VAL 332.A N GLU 328.A O no hydrogen 2.928 N/A LYS 333.A N GLU 329.A O no hydrogen 2.985 N/A ASN 334.A N ILE 330.A O no hydrogen 2.984 N/A TRP 335.A N ALA 331.A O no hydrogen 2.806 N/A TRP 335.A NE1 GLU 315.A OE1 no hydrogen 3.005 N/A LEU 336.A N VAL 332.A O no hydrogen 2.987 N/A VAL 337.A N LYS 333.A O no hydrogen 2.997 N/A ARG 338.A N ASN 334.A O no hydrogen 2.932 N/A VAL 339.A N TRP 335.A O no hydrogen 2.703 N/A GLY 340.A N LEU 336.A O no hydrogen 2.949 N/A ARG 341.A NH1 GLU 100.A OE1 no hydrogen 2.944 N/A ARG 343.A N VAL 339.A O no hydrogen 2.804 N/A ARG 343.A NE GLU 315.A OE1 no hydrogen 3.335 N/A ARG 343.A NE GLU 315.A OE2 no hydrogen 2.747 N/A ARG 343.A NH1 GLU 342.A OE1 no hydrogen 3.003 N/A ARG 343.A NH2 GLU 315.A OE1 no hydrogen 2.772 N/A LEU 344.A N GLY 340.A O no hydrogen 2.975 N/A SER 345.A N ARG 341.A O no hydrogen 3.139 N/A SER 345.A OG GLU 342.A O no hydrogen 2.559 N/A ARG 346.A N ARG 343.A O no hydrogen 3.437 N/A ARG 346.A NE GLU 342.A OE1 no hydrogen 2.989 N/A ARG 346.A NH1 GLU 218.A O no hydrogen 3.027 N/A ARG 346.A NH1 LYS 357.A O no hydrogen 2.651 N/A ARG 346.A NH2 GLU 218.A O no hydrogen 2.738 N/A ARG 346.A NH2 GLU 342.A OE2 no hydrogen 3.387 N/A MET 347.A N LEU 344.A O no hydrogen 2.996 N/A ALA 348.A N VAL 355.A O no hydrogen 3.010 N/A ILE 349.A N SER 197.A O no hydrogen 2.824 N/A SER 350.A N ASP 353.A O no hydrogen 2.852 N/A SER 350.A OG TYR 296.A OH no hydrogen 2.860 N/A GLY 351.A N THR 300.A OG1 no hydrogen 2.875 N/A ASP 353.A N SER 350.A O no hydrogen 2.954 N/A CYS 354.A SG ASP 225.A O no hydrogen 3.914 N/A VAL 355.A N ALA 348.A O no hydrogen 2.971 N/A VAL 356.A N TYR 223.A O no hydrogen 2.817 N/A LYS 357.A N ARG 346.A O no hydrogen 2.894 N/A LYS 357.A NZ SER 215.A O no hydrogen 2.821 N/A LYS 357.A NZ LYS 217.A O no hydrogen 2.788 N/A ARG 362.A N ASP 360.A OD1 no hydrogen 3.130 N/A ARG 362.A NE ASP 360.A OD1 no hydrogen 2.863 N/A ARG 362.A NE ASP 360.A OD2 no hydrogen 3.406 N/A ARG 362.A NH2 ASP 360.A OD2 no hydrogen 2.646 N/A ALA 364.A N ASP 361.A O no hydrogen 3.061 N/A SER 365.A N ARG 362.A O no hydrogen 3.253 N/A SER 365.A OG ARG 362.A O no hydrogen 3.523 N/A ALA 366.A N PHE 363.A O no hydrogen 3.124 N/A THR 368.A N GLU 313.A OE1 no hydrogen 3.072 N/A THR 368.A OG1 GLU 313.A OE1 no hydrogen 2.644 N/A THR 368.A OG1 GLU 313.A OE2 no hydrogen 3.375 N/A ALA 369.A N GLU 313.A OE2 no hydrogen 2.955 N/A ASN 371.A N LEU 367.A O no hydrogen 3.047 N/A ASN 371.A ND2 GLN 382.A O no hydrogen 2.978 N/A ASP 372.A N THR 368.A O no hydrogen 2.895 N/A MET 373.A N ALA 369.A O no hydrogen 2.754 N/A GLY 374.A N ASN 371.A O no hydrogen 2.908 N/A LYS 375.A N LEU 370.A O no hydrogen 3.100 N/A LYS 375.A NZ ARG 233.A O no hydrogen 3.107 N/A LYS 375.A NZ ASP 238.A OD2 no hydrogen 2.698 N/A LYS 375.A NZ MET 373.A O no hydrogen 3.027 N/A ARG 377.A NH1 GLU 384.A O no hydrogen 2.803 N/A ARG 377.A NH1 SER 386.A OG no hydrogen 2.986 N/A ARG 377.A NH2 GLN 382.A O no hydrogen 3.038 N/A ARG 377.A NH2 GLU 384.A O no hydrogen 2.744 N/A LYS 378.A N ASP 226.A O no hydrogen 2.951 N/A LYS 378.A NZ ASP 226.A OD2 no hydrogen 3.458 N/A GLU 384.A N GLN 381.A O no hydrogen 2.944 N/A SER 386.A N ALA 364.A O no hydrogen 2.908 N/A SER 386.A OG ASP 225.A OD2 no hydrogen 2.514 N/A TRP 389.A N MET 222.A O no hydrogen 2.691 N/A GLN 394.A N ASP 391.A O no hydrogen 3.023 N/A PHE 397.A N HIS 400.A O no hydrogen 2.937 N/A CYS 398.A N ASP 353.A OD2 no hydrogen 2.835 N/A HIS 400.A N PHE 397.A O no hydrogen 2.964 N/A HIS 400.A ND1 CYS 398.A O no hydrogen 2.814 N/A HIS 400.A NE2 TYR 455.A OH no hydrogen 2.727 N/A HIS 401.A N CYS 417.A O no hydrogen 2.912 N/A HIS 403.A N VAL 415.A O no hydrogen 2.991 N/A HIS 403.A NE2 HIS 401.A NE2 no hydrogen 3.179 N/A LEU 405.A N LEU 413.A O no hydrogen 2.750 N/A MET 407.A N ARG 411.A O no hydrogen 2.963 N/A LYS 408.A NZ.A GLU 519.A O no hydrogen 2.743 N/A GLY 410.A N MET 407.A O no hydrogen 2.670 N/A ARG 411.A N ASP 409.A OD1 no hydrogen 2.906 N/A ARG 411.A NE ASP 409.A OD1 no hydrogen 3.385 N/A ARG 411.A NE ASP 409.A OD2 no hydrogen 3.195 N/A ARG 411.A NH1 ASP 511.A O no hydrogen 3.028 N/A ARG 411.A NH1 THR 513.A O no hydrogen 2.699 N/A ARG 411.A NH2 ASP 409.A OD2 no hydrogen 3.033 N/A ARG 411.A NH2 THR 513.A O no hydrogen 3.003 N/A LEU 413.A N LEU 405.A O no hydrogen 2.838 N/A VAL 414.A N TYR 209.A OH no hydrogen 3.431 N/A VAL 415.A N HIS 403.A O no hydrogen 2.927 N/A CYS 417.A N HIS 401.A O no hydrogen 2.879 N/A CYS 417.A SG HIS 401.A NE2 no hydrogen 3.549 N/A CYS 417.A SG HIS 403.A NE2 no hydrogen 3.479 N/A CYS 417.A SG ARG 418.A O no hydrogen 3.983 N/A ARG 418.A NE GLU 422.A OE2 no hydrogen 2.831 N/A ARG 418.A NH2 GLU 422.A OE2 no hydrogen 3.061 N/A GLN 420.A N CYS 532.A O no hydrogen 3.037 N/A GLN 420.A NE2 ASP 460.A OD2 no hydrogen 2.868 N/A ASP 421.A N ASN 419.A OD1 no hydrogen 2.871 N/A GLU 422.A N ASN 419.A O no hydrogen 2.949 N/A ILE 424.A N GLN 420.A O no hydrogen 2.975 N/A GLY 425.A N ASP 421.A O no hydrogen 2.940 N/A ARG 426.A N GLU 422.A O no hydrogen 3.110 N/A ALA 427.A N LEU 423.A O no hydrogen 3.191 N/A ARG 428.A N ILE 424.A O no hydrogen 3.198 N/A ARG 428.A NH1 THR 55.A OG1 no hydrogen 3.008 N/A ARG 428.A NH1 ASP 59.A OD1 no hydrogen 3.032 N/A ARG 428.A NH2 ASP 59.A OD1 no hydrogen 2.801 N/A ILE 429.A N ARG 426.A O no hydrogen 3.060 N/A SER 430.A N.A MET 46.A O no hydrogen 2.766 N/A SER 430.A N.B MET 46.A O no hydrogen 2.782 N/A SER 430.A OG.B MET 46.A O no hydrogen 3.327 N/A TRP 435.A NE1 GLN 431.A O no hydrogen 2.977 N/A SER 436.A N GLU 439.A OE1 no hydrogen 2.884 N/A SER 436.A OG GLU 439.A OE1 no hydrogen 3.204 N/A GLU 439.A N SER 436.A OG no hydrogen 3.103 N/A THR 440.A N SER 436.A O no hydrogen 3.069 N/A THR 440.A OG1 SER 436.A O no hydrogen 2.830 N/A ALA 441.A N LEU 437.A O no hydrogen 2.853 N/A CYS 442.A N ARG 438.A O no hydrogen 3.041 N/A CYS 442.A SG ARG 438.A O no hydrogen 3.191 N/A CYS 442.A SG VAL 477.A O no hydrogen 3.163 N/A LEU 443.A N GLU 439.A O no hydrogen 2.919 N/A GLY 444.A N THR 440.A O no hydrogen 3.021 N/A LYS 445.A N ALA 441.A O no hydrogen 3.067 N/A LYS 445.A NZ PRO 473.A O no hydrogen 3.510 N/A LYS 445.A NZ SER 474.A O.A no hydrogen 2.891 N/A LYS 445.A NZ SER 474.A O.B no hydrogen 2.989 N/A LYS 445.A NZ TRP 476.A O no hydrogen 2.831 N/A SER 446.A N CYS 442.A O no hydrogen 3.042 N/A SER 446.A OG CYS 442.A O no hydrogen 2.970 N/A SER 446.A OG THR 479.A O no hydrogen 2.548 N/A TYR 447.A N LEU 443.A O no hydrogen 3.175 N/A ALA 448.A N GLY 444.A O no hydrogen 2.969 N/A GLN 449.A N LYS 445.A O no hydrogen 2.923 N/A GLN 449.A NE2 TRP 488.A O no hydrogen 2.816 N/A GLN 449.A NE2 THR 490.A O no hydrogen 2.854 N/A MET 450.A N SER 446.A O no hydrogen 2.987 N/A TRP 451.A N TYR 447.A O no hydrogen 2.835 N/A SER 452.A N.A ALA 448.A O no hydrogen 3.017 N/A SER 452.A N.B ALA 448.A O no hydrogen 3.032 N/A SER 452.A OG.A ALA 448.A O no hydrogen 2.948 N/A SER 452.A OG.B GLN 449.A O no hydrogen 3.060 N/A LEU 453.A N GLN 449.A O no hydrogen 3.049 N/A LEU 453.A N MET 450.A O no hydrogen 3.153 N/A MET 454.A N MET 450.A O no hydrogen 2.820 N/A TYR 455.A N TRP 451.A O no hydrogen 2.824 N/A TYR 455.A OH HIS 400.A NE2 no hydrogen 2.727 N/A HIS 457.A NE2 PRO 416.A O no hydrogen 2.887 N/A ARG 458.A N TYR 455.A O no hydrogen 3.053 N/A ARG 458.A NE ASP 529.A OD1 no hydrogen 2.750 N/A ARG 458.A NH1 ASP 529.A OD1 no hydrogen 3.038 N/A ARG 458.A NH1 CYS 532.A O no hydrogen 2.970 N/A ARG 458.A NH2 ARG 418.A O no hydrogen 3.243 N/A ARG 458.A NH2 CYS 532.A O no hydrogen 3.316 N/A ARG 459.A N ASP 529.A OD2 no hydrogen 2.963 N/A ARG 459.A NH1 LEU 524.A O no hydrogen 2.865 N/A ARG 459.A NH1 ASP 529.A OD2 no hydrogen 2.763 N/A ARG 459.A NH2 LEU 524.A O no hydrogen 2.983 N/A LEU 461.A N ARG 458.A O no hydrogen 3.074 N/A ARG 462.A N ARG 458.A O no hydrogen 3.059 N/A ARG 462.A NE PHE 456.A O no hydrogen 2.871 N/A ARG 462.A NH1 TRP 518.A O no hydrogen 3.078 N/A ARG 462.A NH1 ILE 521.A O no hydrogen 3.180 N/A ARG 462.A NH2 PHE 456.A O no hydrogen 3.129 N/A ARG 462.A NH2 ILE 521.A O no hydrogen 2.766 N/A LEU 463.A N ARG 459.A O no hydrogen 3.314 N/A ALA 464.A N ASP 460.A O no hydrogen 2.931 N/A ALA 465.A N LEU 461.A O no hydrogen 2.896 N/A ASN 466.A N ARG 462.A O no hydrogen 3.020 N/A ALA 467.A N LEU 463.A O no hydrogen 2.914 N/A ILE 468.A N ALA 464.A O no hydrogen 2.878 N/A CYS 469.A N ALA 465.A O no hydrogen 2.946 N/A CYS 469.A SG ALA 465.A O no hydrogen 3.476 N/A SER 470.A N ASN 466.A O no hydrogen 2.993 N/A SER 470.A N ALA 467.A O no hydrogen 3.207 N/A SER 470.A OG ASN 466.A O no hydrogen 2.930 N/A SER 470.A OG THR 565.A O no hydrogen 3.511 N/A ALA 471.A N ALA 467.A O no hydrogen 3.033 N/A ALA 471.A N ILE 468.A O no hydrogen 3.065 N/A VAL 472.A N ILE 468.A O no hydrogen 3.078 N/A SER 474.A N.A GLU 563.A O no hydrogen 3.066 N/A SER 474.A N.B GLU 563.A O no hydrogen 3.045 N/A SER 474.A OG.A GLU 563.A O no hydrogen 3.551 N/A SER 474.A OG.A GLU 563.A OE1 no hydrogen 3.511 N/A SER 474.A OG.B GLU 563.A O no hydrogen 3.176 N/A SER 474.A OG.B THR 565.A OG1 no hydrogen 2.640 N/A TRP 476.A N PRO 473.A O no hydrogen 3.043 N/A THR 479.A N CYS 442.A O no hydrogen 3.380 N/A THR 482.A OG1 THR 482.A O no hydrogen 2.665 N/A THR 485.A OG1 GLU 487.A OE1 no hydrogen 3.201 N/A THR 485.A OG1 GLU 487.A OE2 no hydrogen 3.271 N/A GLU 487.A N GLU 487.A OE2 no hydrogen 2.650 N/A MET 489.A N HIS 486.A O.A no hydrogen 3.176 N/A MET 489.A N HIS 486.A O.B no hydrogen 3.193 N/A GLU 492.A N THR 490.A OG1 no hydrogen 2.759 N/A THR 496.A N ASP 493.A OD1 no hydrogen 3.202 N/A VAL 497.A N ASP 493.A O no hydrogen 3.284 N/A TRP 498.A N MET 494.A O no hydrogen 2.822 N/A ASN 499.A N LEU 495.A O no hydrogen 3.121 N/A ASN 499.A ND2 LEU 495.A O no hydrogen 3.199 N/A ASN 499.A ND2 VAL 515.A O no hydrogen 2.802 N/A ARG 500.A N THR 496.A O no hydrogen 3.044 N/A ARG 500.A NH1 GLU 492.A OE2 no hydrogen 2.866 N/A ARG 500.A NH2 GLU 492.A OE1 no hydrogen 2.817 N/A ARG 500.A NH2 GLU 492.A OE2 no hydrogen 3.374 N/A VAL 501.A N VAL 497.A O no hydrogen 2.939 N/A TRP 502.A N TRP 498.A O no hydrogen 2.889 N/A TRP 502.A NE1 LEU 453.A O no hydrogen 2.818 N/A ILE 503.A N ASN 499.A O no hydrogen 3.140 N/A GLN 504.A N ASN 499.A O no hydrogen 2.966 N/A GLU 505.A N ARG 500.A O no hydrogen 2.752 N/A ASN 506.A N ILE 503.A O no hydrogen 3.361 N/A ASN 506.A ND2 TYR 209.A OH no hydrogen 3.167 N/A ASN 506.A ND2 TRP 502.A O no hydrogen 2.815 N/A TRP 508.A N ASN 506.A OD1 no hydrogen 2.916 N/A TRP 508.A NE1 ASP 213.A OD2 no hydrogen 2.902 N/A MET 509.A N ASN 506.A O no hydrogen 3.174 N/A LYS 512.A NZ ILE 503.A O no hydrogen 2.929 N/A LYS 512.A NZ GLN 504.A O no hydrogen 2.993 N/A LYS 512.A NZ MET 509.A O no hydrogen 3.031 N/A THR 513.A N ASP 511.A OD1 no hydrogen 2.869 N/A THR 513.A OG1 ASP 511.A OD1 no hydrogen 2.606 N/A VAL 515.A N ASN 499.A OD1 no hydrogen 2.629 N/A GLU 516.A N GLU 520.A OE2 no hydrogen 2.717 N/A GLU 519.A N SER 517.A OG no hydrogen 3.255 N/A GLU 520.A N SER 517.A O no hydrogen 3.256 N/A ILE 521.A N TRP 518.A O no hydrogen 2.903 N/A LEU 524.A N HIS 457.A O no hydrogen 3.075 N/A GLY 525.A N GLU 528.A OE1 no hydrogen 2.916 N/A ASP 529.A N GLY 525.A O no hydrogen 2.905 N/A GLN 530.A N LYS 526.A O no hydrogen 3.123 N/A GLN 530.A NE2 ILE 536.A O no hydrogen 3.123 N/A TRP 531.A N ARG 527.A O no hydrogen 2.823 N/A CYS 532.A N GLU 528.A O no hydrogen 2.966 N/A CYS 532.A SG HIS 401.A NE2 no hydrogen 3.561 N/A CYS 532.A SG HIS 403.A NE2 no hydrogen 3.725 N/A CYS 532.A SG GLU 528.A O no hydrogen 3.741 N/A GLY 533.A N GLN 530.A O no hydrogen 2.953 N/A SER 534.A N ASP 529.A O no hydrogen 2.865 N/A SER 534.A OG ASP 460.A OD1 no hydrogen 3.522 N/A SER 534.A OG ASP 460.A OD2 no hydrogen 3.392 N/A LEU 535.A N ASP 460.A OD2 no hydrogen 2.880 N/A ILE 536.A N SER 534.A OG no hydrogen 2.946 N/A LEU 538.A N LEU 535.A O no hydrogen 3.055 N/A ARG 541.A NE ASP 460.A OD1 no hydrogen 2.678 N/A ARG 541.A NH2 ASP 460.A OD1 no hydrogen 2.904 N/A ALA 542.A N LEU 538.A O no hydrogen 3.093 N/A THR 543.A N THR 539.A O no hydrogen 3.038 N/A THR 543.A OG1 THR 539.A O no hydrogen 2.939 N/A TRP 544.A N SER 540.A O no hydrogen 3.283 N/A TRP 544.A NE1 LEU 54.A O no hydrogen 3.082 N/A ALA 545.A N ARG 541.A O no hydrogen 2.886 N/A LYS 546.A N ALA 542.A O no hydrogen 3.040 N/A ASN 547.A N THR 543.A O no hydrogen 2.960 N/A ASN 547.A ND2 THR 543.A O no hydrogen 2.917 N/A ILE 548.A N ALA 545.A O no hydrogen 3.241 N/A GLN 549.A NE2.A ASP 566.A OD1 no hydrogen 2.979 N/A GLN 549.A NE2.B ASN 553.A OD1 no hydrogen 2.725 N/A THR 550.A N ASN 547.A O no hydrogen 3.173 N/A ILE 552.A N ILE 548.A O no hydrogen 2.919 N/A ASN 553.A N GLN 549.A O.A no hydrogen 2.924 N/A ASN 553.A N GLN 549.A O.B no hydrogen 2.895 N/A GLN 554.A N THR 550.A O no hydrogen 3.118 N/A VAL 555.A N ALA 551.A O no hydrogen 3.207 N/A ARG 556.A N ILE 552.A O no hydrogen 2.951 N/A ARG 556.A NE SER 470.A O no hydrogen 2.913 N/A ARG 556.A NH2 SER 470.A O no hydrogen 2.790 N/A SER 557.A N ASN 553.A O no hydrogen 3.007 N/A SER 557.A OG ASN 553.A O no hydrogen 2.793 N/A LEU 558.A N VAL 555.A O no hydrogen 2.995 N/A ILE 559.A N VAL 555.A O no hydrogen 2.999 N/A GLY 560.A N ARG 556.A O no hydrogen 2.844 N/A TYR 564.A OH GLY 560.A O no hydrogen 2.747 N/A THR 565.A OG1 SER 474.A OG.B no hydrogen 2.640 N/A TYR 567.A N SER 470.A OG no hydrogen 2.732 N/A MET 568.A N ASP 566.A OD1 no hydrogen 3.231 N/A SER 570.A N TYR 567.A O no hydrogen 2.982 N/A SER 570.A OG TYR 567.A O no hydrogen 2.806 N/A MET 571.A N MET 568.A O no hydrogen 3.039 N/A PHE 574.A N MET 571.A O no hydrogen 3.192 N/A ARG 575.A N MET 571.A O no hydrogen 2.986 N/A ARG 575.A N LYS 572.A O no hydrogen 3.145 N/A ARG 575.A NE GLU 519.A OE2 no hydrogen 2.418 N/A ARG 575.A NH2 GLU 519.A OE1 no hydrogen 2.905 N/A ARG 575.A NH2 GLU 519.A OE2 no hydrogen 3.151 N/A