Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5js2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 6.A N THR 703.A O no hydrogen 2.721 N/A ARG 6.A NH1 ASP 706.A O no hydrogen 2.870 N/A ARG 6.A NH2 HIS 701.A O no hydrogen 2.965 N/A ARG 6.A NH2 ASP 706.A O no hydrogen 3.461 N/A ARG 6.A NH2 ASP 706.A OD1 no hydrogen 2.639 N/A GLY 10.A N ASP 696.A OD2 no hydrogen 3.220 N/A THR 11.A N ASP 736.A OD1 no hydrogen 2.557 N/A THR 11.A N ASP 736.A OD2 no hydrogen 3.168 N/A THR 11.A OG1 ASP 736.A OD2 no hydrogen 3.529 N/A SER 12.A N ASP 736.A OD1 no hydrogen 2.494 N/A ARG 14.A N VAL 375.A O no hydrogen 2.880 N/A ARG 14.A NH1 GLU 681.A OE2 no hydrogen 2.986 N/A ILE 16.A N GLY 373.A O no hydrogen 2.870 N/A LEU 18.A N VAL 371.A O no hydrogen 2.877 N/A GLN 19.A N PHE 675.A O no hydrogen 2.888 N/A ALA 20.A N THR 369.A O no hydrogen 2.894 N/A ASN 21.A N ARG 673.A O no hydrogen 3.244 N/A ASN 21.A ND2 ILE 186.A O no hydrogen 3.113 N/A ASN 21.A ND2 HIS 671.A O no hydrogen 2.762 N/A PHE 23.A N LEU 184.A O no hydrogen 2.903 N/A MET 25.A N MET 182.A O no hydrogen 2.883 N/A ASP 26.A N MET 363.A O no hydrogen 2.589 N/A ILE 32.A N VAL 112.A O no hydrogen 2.914 N/A TYR 33.A N THR 80.A O no hydrogen 2.911 N/A HIS 34.A N SER 110.A O no hydrogen 2.865 N/A HIS 34.A NE2 ASN 77.A OD1 no hydrogen 2.951 N/A TYR 35.A N LEU 78.A O no hydrogen 2.885 N/A GLU 36.A N LYS 107.A O no hydrogen 2.953 N/A LEU 37.A N LYS 76.A O no hydrogen 2.468 N/A ASP 38.A N SER 105.A O no hydrogen 3.112 N/A LYS 40.A N LYS 103.A O no hydrogen 3.272 N/A CYS 44.A SG PRO 41.A O no hydrogen 3.339 N/A ASN 49.A N PRO 45.A O no hydrogen 3.209 N/A ASN 49.A ND2 GLY 74.A O no hydrogen 2.967 N/A ASN 49.A ND2 ARG 75.A O no hydrogen 3.606 N/A ARG 50.A N ARG 46.A O no hydrogen 2.889 N/A GLU 51.A N ARG 47.A O no hydrogen 2.945 N/A ILE 52.A N VAL 48.A O no hydrogen 2.874 N/A VAL 53.A N ASN 49.A O no hydrogen 2.904 N/A GLU 54.A N ARG 50.A O no hydrogen 2.913 N/A HIS 55.A N GLU 51.A O no hydrogen 2.925 N/A HIS 55.A ND1 GLU 51.A O no hydrogen 3.087 N/A MET 56.A N ILE 52.A O no hydrogen 2.869 N/A VAL 57.A N VAL 53.A O no hydrogen 2.899 N/A GLN 58.A N GLU 54.A O no hydrogen 2.976 N/A GLN 58.A NE2 GLU 54.A OE2 no hydrogen 2.872 N/A HIS 59.A N HIS 55.A O no hydrogen 2.896 N/A PHE 60.A N MET 56.A O no hydrogen 2.939 N/A ILE 64.A N PHE 60.A O no hydrogen 3.047 N/A PHE 65.A N PHE 60.A O no hydrogen 3.238 N/A GLY 66.A N LYS 61.A O no hydrogen 2.897 N/A LYS 69.A N GLU 359.A OE2 no hydrogen 3.085 N/A VAL 71.A N TYR 79.A O no hydrogen 3.065 N/A PHE 72.A N HIS 140.A ND1 no hydrogen 2.854 N/A ASP 73.A N ASN 77.A O no hydrogen 3.347 N/A ARG 75.A N ASP 73.A OD1 no hydrogen 3.097 N/A LYS 76.A NZ LEU 37.A O no hydrogen 3.525 N/A LYS 76.A NZ ASP 38.A OD1 no hydrogen 3.301 N/A ASN 77.A N ASP 73.A OD1 no hydrogen 3.023 N/A ASN 77.A ND2 ASP 73.A OD2 no hydrogen 3.190 N/A LEU 78.A N TYR 35.A O no hydrogen 2.929 N/A TYR 79.A N VAL 71.A O no hydrogen 3.016 N/A THR 80.A N TYR 33.A O no hydrogen 2.925 N/A THR 80.A OG1 MET 82.A O no hydrogen 3.353 N/A LEU 84.A N TYR 35.A OH no hydrogen 2.699 N/A ILE 86.A N LEU 84.A O no hydrogen 2.695 N/A VAL 91.A N ILE 106.A O no hydrogen 2.934 N/A LEU 93.A N VAL 104.A O no hydrogen 3.030 N/A VAL 95.A N PHE 102.A O no hydrogen 2.878 N/A LEU 97.A N ARG 100.A O no hydrogen 2.856 N/A ARG 100.A N LEU 97.A O no hydrogen 2.996 N/A PHE 102.A N VAL 95.A O no hydrogen 2.897 N/A VAL 104.A N LEU 93.A O no hydrogen 2.951 N/A SER 105.A N ASP 38.A O no hydrogen 3.372 N/A SER 105.A OG ASP 38.A O no hydrogen 3.321 N/A ILE 106.A N VAL 91.A O no hydrogen 2.845 N/A LYS 107.A N GLU 36.A O no hydrogen 3.232 N/A TRP 108.A NE1 SER 110.A O no hydrogen 2.848 N/A VAL 109.A N HIS 34.A O no hydrogen 2.810 N/A SER 110.A N HIS 34.A O no hydrogen 2.966 N/A SER 110.A OG CYS 111.A O no hydrogen 3.251 N/A VAL 112.A N ILE 32.A O no hydrogen 2.924 N/A LEU 114.A N ILE 30.A O no hydrogen 3.441 N/A GLN 115.A NE2 ASP 119.A OD1 no hydrogen 3.219 N/A GLN 115.A NE2 ASP 119.A OD2 no hydrogen 3.188 N/A ALA 116.A N SER 113.A OG no hydrogen 3.118 N/A HIS 118.A N LEU 114.A O no hydrogen 2.870 N/A HIS 118.A NE2 ILE 27.A O no hydrogen 2.753 N/A ASP 119.A N GLN 115.A O no hydrogen 2.876 N/A ALA 120.A N ALA 116.A O no hydrogen 2.928 N/A LEU 121.A N LEU 117.A O no hydrogen 3.158 N/A SER 122.A N ASP 119.A O no hydrogen 2.755 N/A SER 122.A OG ASP 119.A O no hydrogen 2.887 N/A GLN 132.A N PHE 128.A O no hydrogen 2.913 N/A ALA 133.A N GLU 129.A O no hydrogen 2.907 N/A LEU 134.A N THR 130.A O no hydrogen 2.922 N/A ASP 135.A N ILE 131.A O no hydrogen 2.897 N/A VAL 136.A N GLN 132.A O no hydrogen 2.908 N/A VAL 137.A N ALA 133.A O no hydrogen 2.943 N/A MET 138.A N LEU 134.A O no hydrogen 2.899 N/A ARG 139.A N ASP 135.A O no hydrogen 2.914 N/A ARG 139.A NH1 ASP 135.A OD2 no hydrogen 2.676 N/A SER 143.A N ARG 139.A O no hydrogen 3.261 N/A SER 143.A OG ARG 139.A O no hydrogen 2.414 N/A MET 144.A N LEU 141.A O no hydrogen 2.968 N/A ARG 145.A N LEU 141.A O no hydrogen 2.943 N/A ARG 145.A N PRO 142.A O no hydrogen 3.272 N/A TYR 146.A N PRO 142.A O no hydrogen 2.809 N/A THR 147.A N PHE 154.A O no hydrogen 2.907 N/A VAL 149.A N SER 152.A O no hydrogen 2.914 N/A SER 152.A N VAL 149.A O no hydrogen 2.902 N/A PHE 153.A N PHE 171.A O no hydrogen 2.899 N/A PHE 154.A N THR 147.A O no hydrogen 2.903 N/A THR 155.A N PHE 169.A O no hydrogen 3.456 N/A LEU 161.A N ARG 165.A O no hydrogen 3.217 N/A ARG 165.A NE GLN 323.A OE1 no hydrogen 3.075 N/A ARG 165.A NH1 TYR 194.A OH no hydrogen 2.919 N/A GLU 166.A N PHE 193.A O no hydrogen 2.891 N/A VAL 167.A N ASN 159.A O no hydrogen 3.148 N/A TRP 168.A N THR 191.A O no hydrogen 2.884 N/A GLY 170.A N SER 189.A O no hydrogen 2.860 N/A PHE 171.A N PHE 153.A O no hydrogen 2.908 N/A HIS 172.A N ASP 187.A O no hydrogen 2.807 N/A HIS 172.A NE2 SER 174.A OG no hydrogen 2.950 N/A GLN 173.A N ARG 151.A O no hydrogen 3.205 N/A GLN 173.A NE2 MET 138.A O no hydrogen 3.025 N/A SER 174.A N ASN 185.A O no hydrogen 3.042 N/A SER 174.A OG HIS 172.A NE2 no hydrogen 2.950 N/A ARG 176.A N MET 183.A O no hydrogen 2.835 N/A ARG 176.A NH1 GLU 632.A OE1 no hydrogen 3.368 N/A ARG 176.A NH2 SER 174.A OG no hydrogen 3.248 N/A SER 178.A N LYS 181.A O no hydrogen 3.330 N/A SER 178.A OG LEU 179.A O no hydrogen 3.536 N/A SER 178.A OG LYS 181.A O no hydrogen 3.353 N/A SER 178.A OG LYS 698.A O no hydrogen 2.952 N/A TRP 180.A N LEU 121.A O no hydrogen 3.231 N/A LYS 181.A N LEU 179.A O no hydrogen 2.895 N/A MET 183.A N ARG 176.A O no hydrogen 2.739 N/A LEU 184.A N PHE 23.A O no hydrogen 2.885 N/A ASN 185.A N SER 174.A O no hydrogen 2.894 N/A ASN 185.A ND2 HIS 671.A O no hydrogen 3.455 N/A ILE 186.A N ASN 21.A O no hydrogen 3.343 N/A ASP 187.A N HIS 172.A O no hydrogen 3.036 N/A VAL 188.A N ASP 187.A OD1 no hydrogen 2.750 N/A SER 189.A N GLY 170.A O no hydrogen 2.962 N/A THR 191.A N TRP 168.A O no hydrogen 3.005 N/A PHE 193.A N GLU 166.A O no hydrogen 2.941 N/A TYR 194.A N GLN 313.A O no hydrogen 2.889 N/A LYS 195.A N GLY 164.A O no hydrogen 3.191 N/A LYS 195.A NZ GLU 205.A OE2 no hydrogen 3.505 N/A GLN 197.A NE2 GLU 205.A OE1 no hydrogen 3.042 N/A VAL 199.A N CYS 307.A O no hydrogen 2.925 N/A PHE 202.A N PRO 198.A O no hydrogen 3.112 N/A VAL 203.A N VAL 199.A O no hydrogen 2.873 N/A CYS 204.A N ILE 200.A O no hydrogen 2.930 N/A CYS 204.A SG ILE 200.A O no hydrogen 3.399 N/A GLU 205.A N GLU 201.A O no hydrogen 2.896 N/A VAL 206.A N PHE 202.A O no hydrogen 2.905 N/A LEU 207.A N VAL 203.A O no hydrogen 2.855 N/A PHE 209.A N CYS 204.A O no hydrogen 2.543 N/A GLU 213.A N SER 211.A OG no hydrogen 3.299 N/A ARG 224.A N THR 220.A O no hydrogen 2.927 N/A VAL 225.A N ASP 221.A O no hydrogen 2.814 N/A LYS 226.A N SER 222.A O no hydrogen 3.270 N/A PHE 227.A N GLN 223.A O no hydrogen 2.925 N/A THR 228.A N ARG 224.A O no hydrogen 2.852 N/A THR 228.A OG1 ARG 224.A O no hydrogen 2.378 N/A LYS 229.A N VAL 225.A O no hydrogen 2.906 N/A GLU 230.A N PHE 227.A O no hydrogen 3.161 N/A ILE 231.A N PHE 227.A O no hydrogen 2.927 N/A LYS 232.A N THR 228.A O no hydrogen 3.021 N/A GLY 233.A N VAL 244.A O no hydrogen 2.878 N/A LEU 234.A N ILE 231.A O no hydrogen 3.074 N/A LYS 235.A N GLN 313.A OE1 no hydrogen 2.592 N/A VAL 236.A N TYR 242.A O no hydrogen 2.895 N/A GLU 237.A N ASN 308.A O no hydrogen 2.896 N/A THR 239.A N VAL 306.A O no hydrogen 3.254 N/A TYR 242.A N VAL 236.A O no hydrogen 2.850 N/A ARG 243.A NH1 GLY 233.A O no hydrogen 3.067 N/A VAL 244.A N LEU 234.A O no hydrogen 3.048 N/A CYS 245.A N GLN 292.A O no hydrogen 2.819 N/A CYS 245.A SG GLN 292.A O no hydrogen 3.141 N/A CYS 245.A SG GLY 294.A O no hydrogen 3.480 N/A ASN 246.A N GLN 292.A O no hydrogen 2.938 N/A VAL 247.A N ASN 246.A OD1 no hydrogen 2.397 N/A THR 248.A N CYS 290.A O no hydrogen 2.852 N/A THR 248.A OG1 ARG 250.A O no hydrogen 2.972 N/A THR 248.A OG1 CYS 290.A O no hydrogen 3.263 N/A ARG 250.A NE HIS 254.A O no hydrogen 3.470 N/A ARG 250.A NH2 HIS 254.A O no hydrogen 3.395 N/A ALA 252.A N LEU 288.A O no hydrogen 3.095 N/A SER 253.A N PRO 286.A O no hydrogen 3.152 N/A SER 253.A OG HIS 254.A ND1 no hydrogen 2.569 N/A HIS 254.A N PRO 251.A O no hydrogen 3.050 N/A HIS 254.A ND1 SER 253.A OG no hydrogen 2.569 N/A GLN 255.A N PRO 251.A O no hydrogen 2.769 N/A GLN 255.A NE2 THR 256.A O no hydrogen 2.812 N/A THR 256.A OG1 GLU 268.A OE1 no hydrogen 3.311 N/A PHE 257.A N CYS 269.A O no hydrogen 2.902 N/A LEU 259.A N VAL 267.A O no hydrogen 2.898 N/A GLN 261.A N GLN 265.A O no hydrogen 2.968 N/A GLY 264.A N GLN 261.A O no hydrogen 2.833 N/A VAL 267.A N LEU 259.A O no hydrogen 2.917 N/A CYS 269.A N PHE 257.A O no hydrogen 2.898 N/A CYS 269.A SG THR 270.A O no hydrogen 3.445 N/A VAL 271.A N GLN 255.A O no hydrogen 2.927 N/A ALA 272.A N ALA 252.A O no hydrogen 3.033 N/A GLN 273.A N THR 270.A OG1 no hydrogen 2.962 N/A TYR 274.A N THR 270.A O no hydrogen 2.949 N/A PHE 275.A N VAL 271.A O no hydrogen 2.910 N/A LYS 276.A N ALA 272.A O no hydrogen 2.922 N/A ASP 277.A N GLN 273.A O no hydrogen 2.908 N/A ARG 278.A N TYR 274.A O no hydrogen 2.888 N/A ARG 278.A NH1 ARG 278.A O no hydrogen 3.092 N/A LEU 281.A N PHE 275.A O no hydrogen 2.880 N/A ARG 284.A N GLU 305.A OE1 no hydrogen 2.810 N/A TYR 285.A N GLU 305.A OE2 no hydrogen 2.800 N/A LEU 288.A N TYR 285.A O no hydrogen 3.420 N/A CYS 290.A N THR 248.A OG1 no hydrogen 2.648 N/A LEU 291.A N LEU 302.A O no hydrogen 2.857 N/A GLN 292.A N ASN 246.A O no hydrogen 2.876 N/A VAL 293.A N THR 300.A O no hydrogen 2.921 N/A GLY 294.A N ARG 243.A O no hydrogen 3.173 N/A GLU 296.A N GLN 295.A OE1 no hydrogen 3.244 N/A LYS 298.A N GLN 295.A O no hydrogen 3.161 N/A HIS 299.A ND1 TYR 301.A OH no hydrogen 2.632 N/A TYR 301.A OH HIS 299.A ND1 no hydrogen 2.632 N/A LEU 302.A N LEU 291.A O no hydrogen 2.904 N/A CYS 307.A N LEU 304.A O no hydrogen 3.376 N/A CYS 307.A SG PRO 303.A O no hydrogen 3.226 N/A ASN 308.A N GLU 237.A O no hydrogen 2.917 N/A ILE 309.A N GLN 197.A O no hydrogen 2.869 N/A VAL 310.A N LYS 235.A O no hydrogen 3.096 N/A GLN 313.A NE2 LYS 235.A O no hydrogen 2.715 N/A GLN 313.A NE2 VAL 310.A O no hydrogen 2.756 N/A CYS 315.A N ALA 192.A O no hydrogen 2.729 N/A CYS 315.A SG TYR 194.A OH no hydrogen 3.699 N/A CYS 315.A SG LYS 317.A O no hydrogen 3.419 N/A LYS 317.A NZ GLU 230.A O no hydrogen 3.247 N/A THR 320.A N GLN 323.A OE1 no hydrogen 3.319 N/A GLN 323.A N THR 320.A OG1 no hydrogen 3.262 N/A GLN 323.A NE2 GLY 162.A O no hydrogen 2.296 N/A THR 324.A N THR 320.A O no hydrogen 2.799 N/A THR 324.A OG1 THR 320.A O no hydrogen 2.913 N/A SER 325.A N ASP 321.A O no hydrogen 2.915 N/A SER 325.A OG ASP 321.A O no hydrogen 2.664 N/A THR 326.A N ASN 322.A O no hydrogen 2.922 N/A THR 326.A OG1 ASN 322.A O no hydrogen 2.767 N/A MET 327.A N GLN 323.A O no hydrogen 2.899 N/A ILE 328.A N THR 324.A O no hydrogen 2.903 N/A ARG 329.A N SER 325.A O no hydrogen 2.904 N/A ALA 330.A N THR 326.A O no hydrogen 2.915 N/A THR 331.A N MET 327.A O no hydrogen 2.910 N/A THR 331.A N ILE 328.A O no hydrogen 3.092 N/A THR 331.A OG1 MET 327.A O no hydrogen 2.619 N/A THR 331.A OG1 ILE 328.A O no hydrogen 3.279 N/A ALA 332.A N ILE 328.A O no hydrogen 2.679 N/A ARG 333.A NE THR 331.A O no hydrogen 3.322 N/A ARG 333.A NH2 ALA 330.A O no hydrogen 3.387 N/A SER 334.A OG ASP 337.A OD2 no hydrogen 2.786 N/A ALA 335.A N SER 686.A O no hydrogen 2.803 N/A ARG 338.A N SER 334.A O no hydrogen 2.928 N/A ARG 338.A NH1 ASP 187.A OD1 no hydrogen 2.991 N/A ARG 338.A NH1 VAL 188.A O no hydrogen 2.990 N/A GLN 339.A N ALA 335.A O no hydrogen 2.903 N/A GLN 339.A NE2 GLN 19.A OE1 no hydrogen 3.272 N/A GLU 340.A N PRO 336.A O no hydrogen 2.916 N/A GLU 341.A N ASP 337.A O no hydrogen 2.902 N/A ILE 342.A N ARG 338.A O no hydrogen 2.904 N/A SER 343.A N GLN 339.A O no hydrogen 2.940 N/A SER 343.A OG GLN 339.A O no hydrogen 3.157 N/A LYS 344.A N GLU 340.A O no hydrogen 2.892 N/A LEU 345.A N GLU 341.A O no hydrogen 2.907 N/A MET 346.A N ILE 342.A O no hydrogen 2.898 N/A ARG 347.A N SER 343.A O no hydrogen 2.913 N/A SER 348.A N LYS 344.A O no hydrogen 2.880 N/A ALA 349.A N LEU 345.A O no hydrogen 2.907 N/A ASP 350.A N MET 346.A O no hydrogen 3.016 N/A ASN 352.A ND2 VAL 364.A O no hydrogen 3.357 N/A THR 353.A N ASP 350.A O no hydrogen 3.219 N/A THR 353.A OG1 ASP 350.A O no hydrogen 3.082 N/A THR 353.A OG1 ASP 350.A OD2 no hydrogen 2.696 N/A ASP 354.A N PHE 351.A O no hydrogen 3.101 N/A TYR 356.A N ASP 354.A OD1 no hydrogen 2.860 N/A VAL 357.A N ASP 354.A OD1 no hydrogen 3.418 N/A ARG 358.A N ASP 354.A O no hydrogen 2.774 N/A GLU 359.A N PRO 355.A O no hydrogen 2.890 N/A PHE 360.A N TYR 356.A O no hydrogen 3.144 N/A GLY 361.A N ARG 358.A O no hydrogen 2.878 N/A ILE 362.A N VAL 357.A O no hydrogen 2.964 N/A MET 363.A N ASP 26.A O no hydrogen 3.165 N/A VAL 364.A N ASN 352.A OD1 no hydrogen 3.377 N/A LYS 365.A N GLU 24.A O no hydrogen 2.872 N/A THR 369.A N ALA 20.A O no hydrogen 2.981 N/A THR 369.A OG1 PHE 22.A O no hydrogen 2.317 N/A VAL 371.A N LEU 18.A O no hydrogen 2.901 N/A GLY 373.A N ILE 16.A O no hydrogen 2.901 N/A ARG 374.A N THR 694.A O no hydrogen 3.067 N/A ARG 374.A NE SER 12.A O no hydrogen 2.886 N/A ARG 374.A NH1 GLN 739.A OE1 no hydrogen 3.536 N/A ARG 374.A NH2 GLN 739.A OE1 no hydrogen 2.592 N/A VAL 375.A N ARG 14.A O no hydrogen 2.871 N/A LEU 376.A N GLY 692.A O no hydrogen 2.904 N/A ILE 381.A N ALA 391.A O no hydrogen 3.023 N/A LEU 382.A N ILE 540.A O no hydrogen 2.799 N/A TYR 383.A N ALA 389.A O no hydrogen 2.830 N/A GLY 384.A N GLN 404.A O no hydrogen 3.154 N/A LYS 388.A N GLY 384.A O no hydrogen 2.595 N/A ALA 391.A N ILE 381.A O no hydrogen 2.913 N/A VAL 394.A N VAL 397.A O no hydrogen 2.915 N/A VAL 397.A N VAL 394.A O no hydrogen 3.106 N/A TRP 398.A N THR 753.A O no hydrogen 2.993 N/A TRP 398.A NE1 TYR 383.A OH no hydrogen 2.901 N/A ARG 401.A NE ASP 399.A OD2 no hydrogen 2.416 N/A LYS 403.A N MET 400.A O no hydrogen 3.181 N/A LYS 403.A NZ ASP 399.A O no hydrogen 3.202 N/A LYS 403.A NZ ARG 401.A O no hydrogen 2.839 N/A PHE 405.A N ALA 444.A O no hydrogen 2.682 N/A HIS 406.A N ASN 538.A O no hydrogen 2.819 N/A THR 407.A N VAL 537.A O no hydrogen 2.886 N/A ILE 409.A N ASN 531.A OD1 no hydrogen 3.297 N/A ILE 411.A N PRO 447.A O no hydrogen 3.079 N/A LYS 412.A N GLN 479.A OE1 no hydrogen 3.107 N/A LYS 412.A NZ GLU 410.A OE1 no hydrogen 2.446 N/A ALA 415.A N LEU 480.A O no hydrogen 2.880 N/A ILE 416.A N PHE 454.A O no hydrogen 2.888 N/A ALA 417.A N VAL 482.A O no hydrogen 2.813 N/A CYS 418.A N LYS 456.A O no hydrogen 2.909 N/A PHE 419.A N ILE 484.A O no hydrogen 2.563 N/A ALA 420.A N ILE 484.A O no hydrogen 3.243 N/A CYS 425.A N PRO 421.A O no hydrogen 2.739 N/A THR 426.A N HIS 429.A ND1 no hydrogen 2.916 N/A LEU 430.A N THR 426.A O no hydrogen 3.269 N/A LYS 431.A N GLU 427.A O no hydrogen 2.959 N/A SER 432.A N VAL 428.A O no hydrogen 2.899 N/A PHE 433.A N HIS 429.A O no hydrogen 2.859 N/A THR 434.A N LEU 430.A O no hydrogen 2.911 N/A THR 434.A OG1 LEU 430.A O no hydrogen 3.040 N/A THR 434.A OG1 LYS 431.A O no hydrogen 2.824 N/A GLU 435.A N LYS 431.A O no hydrogen 2.901 N/A GLN 436.A N SER 432.A O no hydrogen 2.906 N/A GLN 436.A NE2 THR 518.A OG1 no hydrogen 3.381 N/A LEU 437.A N PHE 433.A O no hydrogen 2.884 N/A ARG 438.A N THR 434.A O no hydrogen 2.893 N/A ARG 438.A NE ILE 448.A O no hydrogen 2.992 N/A LYS 439.A N GLU 435.A O no hydrogen 2.980 N/A ILE 440.A N GLN 436.A O no hydrogen 2.939 N/A SER 441.A N LEU 437.A O no hydrogen 2.881 N/A SER 441.A OG LEU 437.A O no hydrogen 2.291 N/A ARG 442.A N ARG 438.A O no hydrogen 2.882 N/A ASP 443.A N LYS 439.A O no hydrogen 2.956 N/A ALA 444.A N SER 441.A O no hydrogen 2.821 N/A GLY 445.A N SER 441.A O no hydrogen 2.972 N/A MET 446.A N SER 441.A O no hydrogen 3.214 N/A GLN 449.A N ILE 411.A O no hydrogen 2.683 N/A CYS 453.A N TRP 414.A O no hydrogen 3.211 N/A CYS 453.A SG TRP 414.A O no hydrogen 3.238 N/A LYS 456.A N ILE 416.A O no hydrogen 2.917 N/A ALA 458.A N CYS 418.A O no hydrogen 2.782 N/A SER 463.A N GLY 460.A O no hydrogen 3.309 N/A SER 463.A OG GLN 459.A O no hydrogen 3.059 N/A SER 463.A OG GLY 460.A O no hydrogen 2.827 N/A VAL 464.A N ALA 461.A O no hydrogen 2.921 N/A MET 467.A N SER 463.A O no hydrogen 3.309 N/A PHE 468.A N VAL 464.A O no hydrogen 3.106 N/A ARG 469.A N GLU 465.A O no hydrogen 2.726 N/A HIS 470.A N PRO 466.A O no hydrogen 2.758 N/A HIS 470.A N MET 467.A O no hydrogen 2.950 N/A LEU 471.A N MET 467.A O no hydrogen 2.966 N/A LYS 472.A N PHE 468.A O no hydrogen 3.124 N/A LYS 472.A NZ LEU 503.A O no hydrogen 3.127 N/A ASN 473.A N HIS 470.A O no hydrogen 2.929 N/A THR 474.A N LEU 471.A O no hydrogen 2.934 N/A TYR 475.A N LEU 471.A O no hydrogen 2.874 N/A GLN 479.A N VAL 413.A O no hydrogen 3.356 N/A GLN 479.A NE2 GLU 410.A O no hydrogen 3.606 N/A VAL 481.A N ALA 506.A O no hydrogen 3.102 N/A VAL 482.A N ALA 415.A O no hydrogen 2.878 N/A VAL 483.A N GLN 508.A O no hydrogen 3.166 N/A ILE 484.A N ALA 417.A O no hydrogen 2.713 N/A LEU 485.A N VAL 510.A O no hydrogen 3.165 N/A THR 489.A OG1 PRO 486.A O no hydrogen 3.523 N/A THR 489.A OG1 LYS 488.A O no hydrogen 2.455 N/A TYR 492.A N THR 489.A O no hydrogen 3.395 N/A GLU 494.A N PRO 490.A O no hydrogen 3.363 N/A VAL 495.A N VAL 491.A O no hydrogen 2.843 N/A LYS 496.A N TYR 492.A O no hydrogen 2.917 N/A LYS 496.A NZ THR 507.A O no hydrogen 2.956 N/A LYS 496.A NZ THR 507.A OG1 no hydrogen 2.881 N/A ARG 497.A N ALA 493.A O no hydrogen 2.679 N/A VAL 498.A N GLU 494.A O no hydrogen 2.943 N/A GLY 499.A N VAL 495.A O no hydrogen 2.892 N/A ASP 500.A N LYS 496.A O no hydrogen 2.895 N/A THR 501.A N ARG 497.A O no hydrogen 2.901 N/A THR 501.A OG1 ARG 497.A O no hydrogen 2.318 N/A VAL 502.A N VAL 498.A O no hydrogen 3.247 N/A LEU 503.A N VAL 498.A O no hydrogen 2.835 N/A MET 505.A N GLY 499.A O no hydrogen 2.848 N/A GLN 508.A N VAL 481.A O no hydrogen 3.311 N/A GLN 508.A NE2 CYS 509.A O no hydrogen 2.254 N/A VAL 510.A N VAL 483.A O no hydrogen 2.949 N/A MET 512.A N LEU 485.A O no hydrogen 2.733 N/A ASN 514.A N GLN 511.A O no hydrogen 3.089 N/A VAL 515.A N MET 512.A O no hydrogen 2.821 N/A GLN 516.A NE2 GLN 424.A O no hydrogen 3.180 N/A GLN 521.A NE2 ASN 525.A OD1 no hydrogen 3.043 N/A THR 522.A N THR 519.A OG1 no hydrogen 3.351 N/A THR 522.A OG1 THR 519.A OG1 no hydrogen 2.584 N/A LEU 523.A N THR 519.A O no hydrogen 3.042 N/A SER 524.A N PRO 520.A O no hydrogen 2.904 N/A ASN 525.A N GLN 521.A O no hydrogen 2.901 N/A LEU 526.A N THR 522.A O no hydrogen 2.900 N/A CYS 527.A N LEU 523.A O no hydrogen 2.906 N/A CYS 527.A SG SER 441.A OG no hydrogen 3.541 N/A CYS 527.A SG LEU 523.A O no hydrogen 3.163 N/A LEU 528.A N SER 524.A O no hydrogen 2.943 N/A LYS 529.A N LEU 526.A O no hydrogen 3.204 N/A ILE 530.A N LEU 526.A O no hydrogen 3.000 N/A ASN 531.A N CYS 527.A O no hydrogen 2.867 N/A ASN 531.A ND2 ASN 538.A OD1 no hydrogen 2.624 N/A LYS 533.A N LYS 529.A O no hydrogen 2.938 N/A LYS 533.A NZ THR 507.A O no hydrogen 2.948 N/A LYS 533.A NZ GLN 508.A OE1 no hydrogen 3.068 N/A LEU 534.A N ASN 531.A O no hydrogen 3.255 N/A GLY 535.A N VAL 532.A O no hydrogen 3.260 N/A GLY 536.A N ASN 531.A O no hydrogen 2.880 N/A VAL 537.A N THR 407.A OG1 no hydrogen 2.892 N/A ASN 538.A ND2 LEU 528.A O no hydrogen 2.639 N/A ASN 538.A ND2 VAL 750.A O no hydrogen 3.552 N/A ILE 540.A N LEU 382.A O no hydrogen 3.149 N/A LEU 542.A N SER 380.A O no hydrogen 3.262 N/A GLY 545.A N LEU 542.A O no hydrogen 2.842 N/A ARG 546.A NE PRO 543.A O no hydrogen 3.225 N/A ARG 546.A NH1 ALA 579.A O no hydrogen 2.575 N/A ARG 546.A NH1 HIS 580.A O no hydrogen 2.946 N/A PHE 550.A N PRO 547.A O no hydrogen 3.331 N/A GLN 551.A N PRO 548.A O no hydrogen 2.931 N/A ILE 555.A N ARG 622.A O no hydrogen 3.092 N/A PHE 556.A N SER 576.A OG no hydrogen 2.760 N/A LEU 557.A N ILE 624.A O no hydrogen 2.697 N/A GLY 558.A N VAL 574.A O no hydrogen 2.932 N/A ALA 559.A N TYR 626.A O no hydrogen 2.935 N/A ASP 560.A N ALA 572.A O no hydrogen 2.830 N/A THR 562.A N ILE 570.A O no hydrogen 2.856 N/A HIS 563.A ND1 SER 569.A OG no hydrogen 3.226 N/A HIS 563.A NE2 GLU 596.A OE1 no hydrogen 3.029 N/A SER 569.A N GLN 591.A O no hydrogen 2.932 N/A SER 569.A OG HIS 563.A ND1 no hydrogen 3.226 N/A SER 569.A OG GLN 592.A O no hydrogen 3.059 N/A ILE 570.A N THR 562.A O no hydrogen 2.952 N/A ALA 571.A N ARG 589.A O no hydrogen 2.951 N/A ALA 572.A N ASP 560.A O no hydrogen 2.867 N/A VAL 573.A N THR 587.A O no hydrogen 2.874 N/A VAL 574.A N GLY 558.A O no hydrogen 2.892 N/A GLY 575.A N CYS 585.A O no hydrogen 2.920 N/A SER 576.A N PHE 556.A O no hydrogen 2.904 N/A MET 577.A N ARG 583.A O no hydrogen 2.927 N/A ASN 582.A N ASP 578.A OD1 no hydrogen 2.933 N/A ARG 583.A N ASP 578.A OD2 no hydrogen 3.471 N/A ARG 583.A NH1 ARG 795.A O no hydrogen 2.682 N/A CYS 585.A N GLY 575.A O no hydrogen 2.886 N/A CYS 585.A SG LEU 794.A O no hydrogen 3.483 N/A THR 587.A N VAL 573.A O no hydrogen 2.880 N/A THR 587.A OG1 VAL 573.A O no hydrogen 2.540 N/A ARG 589.A N ALA 571.A O no hydrogen 2.917 N/A ARG 589.A NE ASP 600.A OD2 no hydrogen 3.170 N/A ARG 589.A NH1 VAL 588.A O no hydrogen 3.443 N/A GLN 591.A N SER 569.A O no hydrogen 2.933 N/A GLN 591.A NE2 GLN 595.A O no hydrogen 2.818 N/A GLN 591.A NE2 ILE 597.A O no hydrogen 2.956 N/A HIS 593.A ND1 LYS 567.A O no hydrogen 2.546 N/A ARG 594.A N SER 569.A OG no hydrogen 2.819 N/A GLN 595.A N GLN 592.A O no hydrogen 3.209 N/A GLN 595.A NE2 GLN 599.A OE1 no hydrogen 3.579 N/A ILE 598.A N GLU 642.A OE2 no hydrogen 3.120 N/A GLN 599.A N GLN 591.A OE1 no hydrogen 3.090 N/A VAL 605.A N LEU 601.A O no hydrogen 2.892 N/A ARG 606.A N ALA 602.A O no hydrogen 2.919 N/A GLU 607.A N ALA 603.A O no hydrogen 2.916 N/A LEU 608.A N MET 604.A O no hydrogen 2.893 N/A LEU 609.A N VAL 605.A O no hydrogen 2.891 N/A ILE 610.A N ARG 606.A O no hydrogen 2.912 N/A GLN 611.A N GLU 607.A O no hydrogen 2.929 N/A PHE 612.A N LEU 608.A O no hydrogen 2.884 N/A TYR 613.A N LEU 609.A O no hydrogen 2.923 N/A LYS 614.A N ILE 610.A O no hydrogen 2.917 N/A LYS 614.A NZ GLN 611.A OE1 no hydrogen 3.297 N/A SER 615.A N GLN 611.A O no hydrogen 2.904 N/A SER 615.A N PHE 612.A O no hydrogen 3.273 N/A SER 615.A OG MET 577.A O no hydrogen 3.141 N/A THR 616.A N PHE 612.A O no hydrogen 2.893 N/A THR 616.A OG1 PHE 612.A O no hydrogen 2.561 N/A PHE 618.A N THR 616.A OG1 no hydrogen 3.354 N/A LYS 619.A NZ GLU 654.A OE1 no hydrogen 2.375 N/A LYS 619.A NZ GLU 654.A OE2 no hydrogen 3.360 N/A THR 621.A N PRO 553.A O no hydrogen 2.674 N/A THR 621.A OG1 GLN 552.A OE1 no hydrogen 2.860 N/A THR 621.A OG1 PRO 553.A O no hydrogen 2.861 N/A ILE 623.A N GLY 660.A O no hydrogen 2.621 N/A ILE 624.A N ILE 555.A O no hydrogen 3.022 N/A PHE 625.A N THR 662.A O no hydrogen 2.916 N/A TYR 626.A N LEU 557.A O no hydrogen 3.074 N/A TYR 626.A OH THR 742.A OG1 no hydrogen 3.046 N/A ARG 627.A N ILE 664.A O no hydrogen 2.726 N/A ARG 627.A NE GLU 642.A OE1 no hydrogen 2.886 N/A ARG 627.A NE GLU 642.A OE2 no hydrogen 3.068 N/A ARG 627.A NH1 GLU 596.A OE2 no hydrogen 2.922 N/A ARG 627.A NH1 ASP 628.A O no hydrogen 3.173 N/A ARG 627.A NH2 GLU 596.A O no hydrogen 2.666 N/A ARG 627.A NH2 GLU 642.A OE2 no hydrogen 2.662 N/A ASP 628.A N ALA 559.A O no hydrogen 2.969 N/A GLY 629.A N VAL 666.A O no hydrogen 3.323 N/A GLN 634.A N SER 631.A O no hydrogen 3.109 N/A GLN 634.A NE2 GLN 637.A OE1 no hydrogen 3.602 N/A VAL 638.A N GLN 634.A O no hydrogen 3.278 N/A LEU 639.A N PHE 635.A O no hydrogen 2.912 N/A HIS 640.A N GLN 636.A O no hydrogen 2.916 N/A HIS 641.A N GLN 637.A O no hydrogen 2.921 N/A GLU 642.A N VAL 638.A O no hydrogen 2.929 N/A LEU 643.A N LEU 639.A O no hydrogen 2.928 N/A ALA 645.A N HIS 641.A O no hydrogen 2.893 N/A ILE 646.A N GLU 642.A O no hydrogen 2.943 N/A ARG 647.A N LEU 643.A O no hydrogen 2.936 N/A GLU 648.A N LEU 644.A O no hydrogen 2.883 N/A ALA 649.A N ALA 645.A O no hydrogen 2.915 N/A CYS 650.A N ILE 646.A O no hydrogen 2.964 N/A CYS 650.A SG ILE 646.A O no hydrogen 3.346 N/A ILE 651.A N ARG 647.A O no hydrogen 2.912 N/A LYS 652.A N GLU 648.A O no hydrogen 2.880 N/A LEU 653.A N CYS 650.A O no hydrogen 3.248 N/A GLU 654.A N CYS 650.A O no hydrogen 3.324 N/A TYR 657.A OH PRO 620.A O no hydrogen 2.675 N/A GLY 660.A N THR 621.A O no hydrogen 3.020 N/A ILE 661.A N ASP 730.A OD2 no hydrogen 3.362 N/A THR 662.A N ILE 623.A O no hydrogen 2.846 N/A THR 662.A OG1 ASP 729.A OD1 no hydrogen 2.982 N/A PHE 663.A N TRP 728.A O no hydrogen 2.742 N/A ILE 664.A N PHE 625.A O no hydrogen 2.916 N/A VAL 665.A N HIS 725.A O no hydrogen 2.896 N/A VAL 666.A N ARG 627.A O no hydrogen 2.752 N/A GLN 667.A N HIS 723.A O no hydrogen 2.872 N/A HIS 670.A NE2 PRO 721.A O no hydrogen 2.698 N/A THR 672.A N HIS 670.A ND1 no hydrogen 3.017 N/A THR 672.A OG1 TYR 708.A OH no hydrogen 2.743 N/A ARG 673.A N ASN 21.A OD1 no hydrogen 2.739 N/A ARG 673.A NE ASP 187.A OD2 no hydrogen 3.270 N/A ARG 673.A NH1 SER 719.A O no hydrogen 3.387 N/A PHE 675.A N GLN 19.A O no hydrogen 2.888 N/A CYS 676.A SG ASN 688.A O no hydrogen 4.042 N/A THR 677.A N LYS 17.A O no hydrogen 3.196 N/A GLU 681.A N ASP 678.A O no hydrogen 3.153 N/A VAL 683.A N ASN 688.A O no hydrogen 3.033 N/A GLY 687.A N GLY 684.A O no hydrogen 3.146 N/A ASN 688.A ND2 GLY 717.A O no hydrogen 2.758 N/A GLY 692.A N CYS 710.A O no hydrogen 2.699 N/A THR 694.A N ARG 374.A O no hydrogen 2.834 N/A THR 694.A OG1 ARG 374.A O no hydrogen 3.555 N/A THR 694.A OG1 GLY 692.A O no hydrogen 3.181 N/A VAL 695.A N TYR 708.A O no hydrogen 2.904 N/A ILE 699.A N THR 697.A O no hydrogen 2.841 N/A THR 700.A OG1 ASP 696.A O no hydrogen 3.211 N/A HIS 701.A N ASP 706.A OD1 no hydrogen 2.948 N/A HIS 701.A N ASP 706.A OD2 no hydrogen 3.197 N/A THR 703.A N HIS 701.A ND1 no hydrogen 3.232 N/A THR 703.A OG1 HIS 701.A ND1 no hydrogen 3.340 N/A GLU 704.A N HIS 701.A ND1 no hydrogen 3.015 N/A PHE 707.A N TYR 724.A O no hydrogen 2.913 N/A TYR 708.A N VAL 695.A O no hydrogen 2.866 N/A TYR 708.A OH THR 672.A OG1 no hydrogen 2.743 N/A LEU 709.A N SER 722.A O no hydrogen 2.896 N/A CYS 710.A N THR 693.A O no hydrogen 2.931 N/A CYS 710.A SG HIS 712.A O no hydrogen 3.698 N/A SER 711.A OG VAL 756.A O no hydrogen 2.337 N/A SER 711.A OG SER 757.A O no hydrogen 3.050 N/A THR 718.A OG1 ARG 333.A O no hydrogen 3.277 N/A SER 719.A N ASN 688.A OD1 no hydrogen 3.025 N/A ARG 720.A NH1 LYS 668.A O no hydrogen 2.599 N/A ARG 720.A NH1 HIS 670.A O no hydrogen 2.959 N/A SER 722.A OG SER 757.A O no hydrogen 2.742 N/A HIS 723.A N GLN 667.A O no hydrogen 2.915 N/A HIS 723.A NE2 ASP 706.A OD2 no hydrogen 2.947 N/A TYR 724.A N PHE 707.A O no hydrogen 2.882 N/A TYR 724.A OH SER 757.A O no hydrogen 3.276 N/A HIS 725.A N VAL 665.A O no hydrogen 2.933 N/A HIS 725.A NE2 GLU 704.A OE1 no hydrogen 2.710 N/A VAL 726.A N PHE 705.A O no hydrogen 2.826 N/A TRP 728.A N PHE 663.A O no hydrogen 3.088 N/A TRP 728.A NE1 ASP 730.A OD1 no hydrogen 2.737 N/A TRP 728.A NE1 ASP 730.A OD2 no hydrogen 3.196 N/A ASP 730.A N ILE 661.A O no hydrogen 3.133 N/A ASN 731.A ND2 GLY 660.A O no hydrogen 3.590 N/A ASN 731.A ND2 THR 662.A OG1 no hydrogen 2.678 N/A PHE 733.A N ASP 729.A OD2 no hydrogen 2.611 N/A SER 735.A N ASP 8.A OD1 no hydrogen 2.630 N/A SER 735.A OG ASP 8.A O no hydrogen 2.275 N/A SER 735.A OG ASP 8.A OD1 no hydrogen 2.743 N/A GLU 737.A N SER 734.A OG no hydrogen 3.367 N/A LEU 738.A N SER 734.A O no hydrogen 3.082 N/A GLN 739.A N SER 735.A O no hydrogen 2.905 N/A ILE 740.A N ASP 736.A O no hydrogen 2.892 N/A LEU 741.A N GLU 737.A O no hydrogen 2.903 N/A THR 742.A N LEU 738.A O no hydrogen 2.897 N/A THR 742.A OG1 TYR 626.A OH no hydrogen 3.046 N/A THR 742.A OG1 LEU 738.A O no hydrogen 2.713 N/A TYR 743.A N GLN 739.A O no hydrogen 2.929 N/A GLN 744.A N ILE 740.A O no hydrogen 2.856 N/A GLN 744.A NE2 GLY 545.A O no hydrogen 3.447 N/A LEU 745.A N LEU 741.A O no hydrogen 2.939 N/A CYS 746.A N TYR 743.A O no hydrogen 3.176 N/A CYS 746.A SG SER 711.A OG no hydrogen 3.350 N/A CYS 746.A SG THR 742.A O no hydrogen 3.176 N/A HIS 747.A N GLN 744.A O no hydrogen 2.964 N/A HIS 747.A ND1 TYR 743.A O no hydrogen 2.915 N/A THR 748.A N LEU 745.A O no hydrogen 3.324 N/A THR 748.A OG1 LEU 745.A O no hydrogen 2.553 N/A VAL 750.A N TYR 764.A OH no hydrogen 3.248 N/A ARG 751.A NH1 ALA 800.A OXT no hydrogen 2.639 N/A CYS 752.A SG ARG 754.A O no hydrogen 3.721 N/A THR 753.A OG1 TRP 398.A O no hydrogen 2.599 N/A SER 755.A N GLY 396.A O no hydrogen 2.898 N/A SER 755.A OG SER 711.A O no hydrogen 2.450 N/A VAL 756.A N CYS 746.A O no hydrogen 3.056 N/A ALA 760.A N LEU 745.A O no hydrogen 3.249 N/A TYR 763.A N PRO 759.A O no hydrogen 3.365 N/A TYR 764.A N ALA 760.A O no hydrogen 2.855 N/A TYR 764.A OH THR 748.A O no hydrogen 3.297 N/A ALA 765.A N PRO 761.A O no hydrogen 2.885 N/A HIS 766.A N ALA 762.A O no hydrogen 2.954 N/A LEU 767.A N TYR 763.A O no hydrogen 2.925 N/A VAL 768.A N TYR 764.A O no hydrogen 2.871 N/A ALA 769.A N ALA 765.A O no hydrogen 2.965 N/A PHE 770.A N HIS 766.A O no hydrogen 2.928 N/A ARG 771.A N LEU 767.A O no hydrogen 2.897 N/A ARG 771.A NH1 ASP 500.A OD2 no hydrogen 3.150 N/A ARG 771.A NH1 TYR 798.A O no hydrogen 3.271 N/A ALA 772.A N VAL 768.A O no hydrogen 2.903 N/A ARG 773.A N ALA 769.A O no hydrogen 2.947 N/A HIS 775.A N ARG 771.A O no hydrogen 2.928 N/A HIS 775.A NE2 ASP 500.A OD2 no hydrogen 2.916 N/A LEU 776.A N ARG 773.A O no hydrogen 3.270 N/A LEU 783.A N ASP 779.A O no hydrogen 3.069 N/A ALA 784.A N HIS 780.A O no hydrogen 2.908 N/A LYS 785.A N GLN 781.A O no hydrogen 2.911 N/A ALA 786.A N ALA 782.A O no hydrogen 2.896 N/A VAL 787.A N LEU 783.A O no hydrogen 2.902 N/A GLN 788.A N ALA 784.A O no hydrogen 3.263 N/A GLN 788.A N LYS 785.A O no hydrogen 3.323 N/A HIS 790.A N ASP 500.A O no hydrogen 2.878 N/A ASP 792.A N HIS 790.A ND1 no hydrogen 2.865 N/A THR 793.A OG1 ASP 500.A O no hydrogen 3.108 N/A LEU 794.A N HIS 790.A O no hydrogen 2.981 N/A LEU 794.A N GLN 791.A O no hydrogen 3.204 N/A THR 796.A OG1 THR 793.A O no hydrogen 2.814 N/A TYR 798.A N THR 796.A O no hydrogen 2.935 N/A ALA 800.A N MET 797.A O no hydrogen 3.304 N/A