Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5w5y_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 6.A NH1 GLU 9.A OE1 no hydrogen 2.602 N/A GLU 11.A N THR 7.A O no hydrogen 2.868 N/A SER 12.A N LEU 8.A O no hydrogen 2.903 N/A SER 12.A OG LEU 8.A O no hydrogen 2.865 N/A ARG 13.A N GLU 9.A O no hydrogen 2.974 N/A PHE 14.A N ARG 10.A O no hydrogen 2.758 N/A ILE 15.A N GLU 11.A O no hydrogen 2.954 N/A ASN 16.A N SER 12.A O no hydrogen 2.880 N/A LEU 27.A N PHE 24.A O no hydrogen 2.796 N/A GLU 29.A N PRO 25.A O no hydrogen 2.900 N/A ALA 30.A N LEU 26.A O no hydrogen 2.864 N/A GLN 32.A N GLU 29.A O no hydrogen 3.309 N/A HIS 34.A N VAL 31.A O no hydrogen 2.975 N/A ILE 35.A N VAL 31.A O no hydrogen 3.080 N/A GLY 36.A N GLN 32.A O no hydrogen 2.852 N/A PHE 38.A N HIS 34.A O no hydrogen 2.962 N/A ASN 39.A N ILE 35.A O no hydrogen 2.815 N/A ALA 40.A N GLY 36.A O no hydrogen 2.931 N/A LEU 41.A N PHE 38.A O no hydrogen 3.074 N/A THR 42.A N ASN 39.A O no hydrogen 2.980 N/A THR 42.A OG1 ASN 39.A O no hydrogen 3.327 N/A GLU 43.A N ASN 39.A O no hydrogen 2.967 N/A GLY 47.A N PRO 45.A O no hydrogen 2.880 N/A GLY 48.A N PRO 45.A O no hydrogen 3.087 N/A LEU 49.A N ALA 40.A O no hydrogen 2.645 N/A ASN 51.A N GLY 48.A O no hydrogen 3.144 N/A LEU 52.A N GLY 48.A O no hydrogen 3.293 N/A GLY 53.A N LEU 49.A O no hydrogen 2.930 N/A VAL 54.A N LEU 50.A O no hydrogen 2.981 N/A LYS 55.A N ASN 51.A O no hydrogen 2.940 N/A LYS 55.A NZ ASP 46.A OD1 no hydrogen 3.187 N/A LYS 55.A NZ ASP 46.A OD2 no hydrogen 2.488 N/A ASP 56.A N LEU 52.A O no hydrogen 2.899 N/A ASP 56.A N GLY 53.A O no hydrogen 2.968 N/A ILE 57.A N GLY 53.A O no hydrogen 2.968 N/A LYS 60.A N VAL 81.A O no hydrogen 2.826 N/A LYS 60.A NZ ASP 402.A OD1 no hydrogen 2.507 N/A ILE 62.A N LEU 79.A O no hydrogen 2.827 N/A ASP 64.A N ASN 77.A O no hydrogen 3.307 N/A LYS 66.A NZ ASN 77.A OD1 no hydrogen 2.908 N/A GLY 73.A N SER 70.A O no hydrogen 3.296 N/A LYS 78.A NZ ASN 131.A OD1 no hydrogen 2.655 N/A SER 80.A N SER 128.A O no hydrogen 2.830 N/A SER 80.A OG GLU 59.A OE1 no hydrogen 3.478 N/A VAL 81.A N LYS 60.A O no hydrogen 2.982 N/A SER 82.A N LYS 126.A O no hydrogen 2.903 N/A GLU 84.A N LYS 124.A O no hydrogen 2.907 N/A VAL 86.A N ASN 51.A OD1 no hydrogen 3.323 N/A SER 87.A N LEU 122.A O no hydrogen 2.657 N/A ALA 89.A N LYS 120.A O no hydrogen 3.108 N/A SER 93.A N ARG 103.A O no hydrogen 3.448 N/A SER 93.A OG MET 92.A O no hydrogen 3.424 N/A ASP 95.A N ASP 95.A OD1 no hydrogen 2.385 N/A ALA 100.A N SER 98.A O no hydrogen 2.059 N/A VAL 105.A N PRO 91.A O no hydrogen 3.043 N/A GLU 109.A N TYR 106.A O no hydrogen 2.912 N/A SER 110.A N TYR 106.A O no hydrogen 3.276 N/A SER 110.A OG SER 116.A O no hydrogen 3.357 N/A ARG 111.A N PRO 107.A O no hydrogen 2.906 N/A ARG 111.A NE GLU 184.A OE2 no hydrogen 2.950 N/A ARG 111.A NH1 GLU 169.A OE1 no hydrogen 3.410 N/A ARG 111.A NH1 GLU 169.A OE2 no hydrogen 3.138 N/A ARG 111.A NH2 TYR 177.A OH no hydrogen 2.208 N/A ARG 111.A NH2 GLU 184.A OE2 no hydrogen 3.475 N/A GLN 112.A N SER 108.A O no hydrogen 2.912 N/A ARG 113.A N GLU 109.A O no hydrogen 2.856 N/A ARG 113.A NE THR 115.A OG1 no hydrogen 2.537 N/A ARG 113.A NH1 ASP 874.A OD2 no hydrogen 2.862 N/A ARG 113.A NH2 THR 115.A OG1 no hydrogen 2.885 N/A LEU 114.A N ARG 111.A O no hydrogen 2.909 N/A THR 115.A N SER 110.A O no hydrogen 2.907 N/A THR 115.A OG1 SER 116.A O no hydrogen 3.513 N/A TYR 117.A N ILE 179.A O no hydrogen 2.751 N/A TYR 117.A OH VAL 105.A O no hydrogen 3.371 N/A GLY 119.A N LEU 145.A O no hydrogen 2.891 N/A LEU 121.A N GLY 143.A O no hydrogen 2.980 N/A LEU 122.A N SER 87.A O no hydrogen 2.879 N/A LEU 123.A N ARG 140.A O no hydrogen 2.938 N/A LYS 124.A N GLN 85.A O no hydrogen 2.778 N/A LEU 125.A N GLU 138.A O no hydrogen 2.707 N/A LYS 126.A N SER 82.A O no hydrogen 2.886 N/A TRP 127.A N LEU 136.A O no hydrogen 2.829 N/A TRP 127.A NE1 PHE 424.A O no hydrogen 3.080 N/A SER 128.A N SER 80.A O no hydrogen 2.876 N/A SER 128.A OG ASN 135.A OD1 no hydrogen 3.519 N/A VAL 129.A N GLU 134.A O no hydrogen 2.749 N/A ASN 130.A N LYS 78.A O no hydrogen 2.846 N/A ASN 130.A ND2 GLU 133.A OE1 no hydrogen 2.065 N/A GLY 132.A N VAL 129.A O no hydrogen 3.031 N/A GLU 133.A N ASN 130.A O no hydrogen 3.043 N/A GLU 134.A N VAL 129.A O no hydrogen 2.982 N/A LEU 136.A N TRP 127.A O no hydrogen 2.970 N/A GLU 138.A N LEU 125.A O no hydrogen 2.981 N/A ARG 140.A N LEU 123.A O no hydrogen 3.045 N/A CYS 142.A N LEU 121.A O no hydrogen 2.574 N/A CYS 142.A SG ARG 140.A O no hydrogen 3.674 N/A LEU 145.A N GLY 119.A O no hydrogen 2.824 N/A VAL 147.A N TYR 117.A O no hydrogen 3.414 N/A LEU 149.A N TYR 177.A O no hydrogen 3.154 N/A SER 151.A N MET 148.A O no hydrogen 3.262 N/A SER 151.A OG MET 148.A O no hydrogen 2.480 N/A ASN 152.A N ASN 39.A OD1 no hydrogen 2.577 N/A ARG 153.A N SER 151.A OG no hydrogen 3.231 N/A ARG 153.A NE ILE 88.A O no hydrogen 2.881 N/A ARG 153.A NH1 ASN 152.A O no hydrogen 2.796 N/A CYS 154.A N SER 151.A O no hydrogen 2.981 N/A CYS 154.A SG TYR 117.A OH no hydrogen 3.284 N/A HIS 155.A NE2 PRO 91.A O no hydrogen 3.267 N/A ASN 157.A N CYS 154.A O no hydrogen 2.779 N/A SER 160.A N GLU 163.A OE1 no hydrogen 3.003 N/A SER 160.A OG LYS 19.A O no hydrogen 3.242 N/A LEU 164.A N SER 160.A O no hydrogen 2.774 N/A VAL 165.A N PRO 161.A O no hydrogen 2.868 N/A GLN 166.A N TYR 162.A O no hydrogen 2.901 N/A HIS 167.A N LEU 164.A O no hydrogen 3.108 N/A LYS 168.A N VAL 165.A O no hydrogen 3.029 N/A GLU 169.A N LEU 164.A O no hydrogen 3.200 N/A SER 171.A OG ASP 172.A OD1 no hydrogen 3.260 N/A GLU 173.A N GLU 170.A O no hydrogen 2.603 N/A GLY 176.A N LEU 149.A O no hydrogen 3.036 N/A TYR 177.A OH GLU 173.A OE2 no hydrogen 2.488 N/A TYR 177.A OH GLU 184.A OE2 no hydrogen 2.676 N/A PHE 178.A N LYS 185.A O no hydrogen 2.822 N/A VAL 180.A N ILE 183.A O no hydrogen 2.956 N/A ASN 181.A N SER 116.A OG no hydrogen 2.850 N/A ILE 183.A N VAL 180.A O no hydrogen 2.911 N/A LYS 185.A N PHE 178.A O no hydrogen 2.854 N/A LEU 186.A N VAL 470.A O no hydrogen 2.876 N/A ARG 188.A N TYR 468.A O no hydrogen 2.872 N/A LEU 190.A N LEU 387.A O no hydrogen 3.031 N/A ILE 191.A N HIS 488.A O no hydrogen 3.187 N/A VAL 192.A N GLU 385.A O no hydrogen 2.900 N/A GLN 193.A NE2 ARG 194.A O no hydrogen 3.605 N/A GLN 193.A NE2 GLN 219.A O no hydrogen 3.113 N/A ARG 194.A N HIS 383.A O no hydrogen 3.112 N/A ARG 194.A NH1 GLU 609.A OE1 no hydrogen 3.484 N/A ARG 194.A NH2 GLU 609.A OE1 no hydrogen 3.378 N/A ARG 195.A NE GLU 385.A OE1 no hydrogen 2.989 N/A ARG 195.A NE GLU 385.A OE2 no hydrogen 3.452 N/A ARG 195.A NH1 GLN 227.A OE1 no hydrogen 2.960 N/A ARG 195.A NH2 GLN 227.A OE1 no hydrogen 2.453 N/A ASN 196.A N ARG 221.A O no hydrogen 2.982 N/A ASN 196.A ND2 ASP 573.A OD1 no hydrogen 2.732 N/A MET 199.A N GLN 219.A O no hydrogen 2.907 N/A ALA 200.A N ASP 376.A OD2 no hydrogen 3.168 N/A ILE 201.A N GLY 217.A O no hydrogen 2.861 N/A ARG 203.A N HIS 215.A O no hydrogen 2.867 N/A ARG 203.A NE SER 205.A OG no hydrogen 3.264 N/A PHE 206.A N ARG 203.A O no hydrogen 2.883 N/A ASN 208.A N PRO 204.A O no hydrogen 2.916 N/A GLY 210.A N ALA 207.A O no hydrogen 3.474 N/A SER 214.A N TYR 236.A O no hydrogen 3.315 N/A SER 214.A OG TYR 236.A O no hydrogen 2.680 N/A ILE 218.A N LEU 234.A O no hydrogen 2.918 N/A GLN 219.A N MET 199.A O no hydrogen 2.974 N/A ILE 220.A N ASN 232.A O no hydrogen 2.979 N/A ARG 221.A NH1 GLN 193.A O no hydrogen 3.412 N/A ARG 221.A NH1 GLU 385.A OE2 no hydrogen 2.549 N/A SER 222.A N GLN 230.A O no hydrogen 2.994 N/A SER 222.A OG HIS 345.A ND1 no hydrogen 2.999 N/A VAL 223.A N ASN 196.A OD1 no hydrogen 3.141 N/A ARG 224.A N THR 228.A O no hydrogen 2.937 N/A ARG 224.A NH1 THR 228.A OG1 no hydrogen 2.875 N/A ARG 224.A NH2 ARG 340.A O no hydrogen 3.283 N/A GLN 227.A N ARG 224.A O no hydrogen 2.689 N/A GLN 227.A NE2 PRO 225.A O no hydrogen 3.105 N/A GLN 227.A NE2 HIS 630.A ND1 no hydrogen 2.970 N/A THR 228.A N ASP 226.A OD1 no hydrogen 3.148 N/A THR 228.A OG1 ASP 226.A OD1 no hydrogen 2.690 N/A THR 228.A OG1 ASP 226.A OD2 no hydrogen 3.261 N/A SER 229.A OG SER 222.A O no hydrogen 3.442 N/A SER 229.A OG ASP 461.A OD2 no hydrogen 3.414 N/A GLN 230.A N SER 222.A O no hydrogen 2.806 N/A GLN 230.A NE2 SER 247.A O no hydrogen 2.574 N/A THR 231.A OG1 ASP 461.A OD1 no hydrogen 3.330 N/A THR 231.A OG1 ASP 461.A OD2 no hydrogen 2.933 N/A ASN 232.A N ILE 220.A O no hydrogen 2.881 N/A VAL 233.A N ARG 245.A O no hydrogen 3.032 N/A LEU 234.A N ILE 218.A O no hydrogen 2.873 N/A HIS 235.A N THR 243.A O no hydrogen 2.876 N/A LEU 237.A N GLN 241.A O no hydrogen 2.483 N/A ASN 238.A N SER 212.A O no hydrogen 2.493 N/A GLY 240.A N LEU 237.A O no hydrogen 2.880 N/A VAL 242.A N GLN 241.A OE1 no hydrogen 2.852 N/A THR 243.A N HIS 235.A O no hydrogen 2.924 N/A PHE 244.A N VAL 255.A O no hydrogen 2.774 N/A ARG 245.A N VAL 233.A O no hydrogen 2.810 N/A ARG 245.A NH1 GLU 252.A OE1 no hydrogen 2.233 N/A PHE 246.A N TYR 253.A O no hydrogen 3.001 N/A TRP 248.A N ASN 251.A O no hydrogen 2.831 N/A TRP 248.A NE1 VAL 321.A O no hydrogen 3.205 N/A ARG 249.A NH2 GLN 323.A OE1 no hydrogen 3.215 N/A ASN 251.A N TRP 248.A O no hydrogen 2.832 N/A ASN 251.A ND2 TYR 253.A OH no hydrogen 2.879 N/A TYR 253.A N PHE 246.A O no hydrogen 2.909 N/A VAL 255.A N PHE 244.A O no hydrogen 2.923 N/A VAL 257.A N VAL 242.A O no hydrogen 3.346 N/A MET 259.A N PRO 256.A O no hydrogen 2.767 N/A ILE 260.A N PRO 256.A O no hydrogen 3.430 N/A LEU 261.A N VAL 257.A O no hydrogen 2.888 N/A LYS 262.A N VAL 258.A O no hydrogen 2.969 N/A LYS 262.A NZ ASP 269.A OD1 no hydrogen 2.535 N/A ALA 263.A N MET 259.A O no hydrogen 2.835 N/A LEU 264.A N ILE 260.A O no hydrogen 2.957 N/A LEU 264.A N LEU 261.A O no hydrogen 3.245 N/A THR 267.A OG1 CYS 265.A O no hydrogen 3.295 N/A SER 268.A N GLU 271.A OE1 no hydrogen 2.645 N/A GLU 271.A N SER 268.A O no hydrogen 3.125 N/A GLU 271.A N SER 268.A OG no hydrogen 2.998 N/A ILE 272.A N SER 268.A O no hydrogen 3.295 N/A PHE 273.A N ASP 269.A O no hydrogen 2.901 N/A ASP 274.A N ARG 270.A O no hydrogen 2.896 N/A GLY 275.A N GLU 271.A O no hydrogen 2.876 N/A ILE 276.A N ILE 272.A O no hydrogen 2.924 N/A ILE 276.A N PHE 273.A O no hydrogen 3.022 N/A ILE 277.A N PHE 273.A O no hydrogen 2.855 N/A ASP 280.A N ILE 277.A O no hydrogen 2.823 N/A ASP 283.A N ASP 280.A O no hydrogen 3.101 N/A SER 284.A N LYS 282.A O no hydrogen 3.084 N/A THR 287.A N ASP 283.A O no hydrogen 2.472 N/A THR 287.A OG1 ASP 283.A O no hydrogen 2.844 N/A ASP 288.A N SER 284.A O no hydrogen 2.906 N/A ARG 289.A N PHE 285.A O no hydrogen 3.058 N/A ARG 289.A NE TYR 236.A OH no hydrogen 2.631 N/A ARG 289.A NH1 PHE 285.A O no hydrogen 3.220 N/A LEU 290.A N LEU 286.A O no hydrogen 2.881 N/A GLU 291.A N THR 287.A O no hydrogen 2.927 N/A LEU 292.A N ASP 288.A O no hydrogen 2.931 N/A LEU 293.A N ARG 289.A O no hydrogen 2.929 N/A LEU 294.A N LEU 290.A O no hydrogen 2.926 N/A ARG 295.A N GLU 291.A O no hydrogen 2.892 N/A GLY 296.A N LEU 292.A O no hydrogen 2.896 N/A PHE 297.A N LEU 293.A O no hydrogen 2.947 N/A LYS 298.A N LEU 294.A O no hydrogen 2.950 N/A LYS 298.A NZ ASP 269.A OD2 no hydrogen 3.047 N/A LYS 299.A N ARG 295.A O no hydrogen 2.889 N/A ARG 300.A N GLY 296.A O no hydrogen 2.954 N/A ARG 300.A NE TYR 301.A OH no hydrogen 3.113 N/A TYR 301.A N PHE 297.A O no hydrogen 3.183 N/A LEU 304.A N TYR 301.A O no hydrogen 3.078 N/A ASN 306.A N GLN 309.A OE1 no hydrogen 3.087 N/A ARG 307.A NE ALA 263.A O no hydrogen 2.680 N/A ARG 307.A NE LEU 264.A O no hydrogen 3.081 N/A ARG 307.A NH2 LEU 264.A O no hydrogen 3.261 N/A THR 308.A OG1 ASN 306.A OD1 no hydrogen 3.505 N/A GLN 309.A N ASN 306.A OD1 no hydrogen 2.819 N/A VAL 310.A N ASN 306.A O no hydrogen 3.166 N/A LEU 311.A N ARG 307.A O no hydrogen 2.877 N/A GLN 312.A N THR 308.A O no hydrogen 2.897 N/A TYR 313.A N GLN 309.A O no hydrogen 2.886 N/A LEU 314.A N VAL 310.A O no hydrogen 2.915 N/A GLY 315.A N LEU 311.A O no hydrogen 2.913 N/A ASP 316.A N GLN 312.A O no hydrogen 2.822 N/A LYS 317.A N TYR 313.A O no hydrogen 2.862 N/A PHE 318.A N LEU 314.A O no hydrogen 2.917 N/A ARG 319.A NH1 ASP 316.A OD1 no hydrogen 3.463 N/A VAL 321.A N PHE 318.A O no hydrogen 2.814 N/A PHE 322.A N PHE 318.A O no hydrogen 3.087 N/A GLN 328.A N SER 325.A O no hydrogen 2.544 N/A SER 329.A N GLU 332.A OE1 no hydrogen 2.439 N/A VAL 333.A N SER 329.A O no hydrogen 2.767 N/A GLY 334.A N ASP 330.A O no hydrogen 2.936 N/A GLN 335.A N LEU 331.A O no hydrogen 2.960 N/A GLN 335.A NE2 GLN 335.A O no hydrogen 3.096 N/A GLN 335.A NE2 ASP 339.A OD1 no hydrogen 2.868 N/A GLN 335.A NE2 ASP 339.A OD2 no hydrogen 3.490 N/A GLU 336.A N GLU 332.A O no hydrogen 2.892 N/A VAL 337.A N VAL 333.A O no hydrogen 2.893 N/A LEU 338.A N GLY 334.A O no hydrogen 2.951 N/A ASP 339.A N GLN 335.A O no hydrogen 2.917 N/A ARG 340.A N GLU 336.A O no hydrogen 2.919 N/A ARG 340.A N VAL 337.A O no hydrogen 2.846 N/A ARG 340.A NE GLU 336.A OE2 no hydrogen 2.734 N/A ILE 341.A N LEU 338.A O no hydrogen 3.310 N/A VAL 342.A N LEU 338.A O no hydrogen 3.080 N/A LEU 343.A N ASN 232.A OD1 no hydrogen 3.352 N/A HIS 345.A ND1 SER 222.A OG no hydrogen 2.999 N/A HIS 345.A NE2 GLY 574.A O no hydrogen 2.777 N/A LEU 346.A N LEU 343.A O no hydrogen 2.826 N/A GLY 347.A N VAL 344.A O no hydrogen 3.032 N/A GLY 350.A N GLY 347.A O no hydrogen 3.083 N/A LYS 354.A N GLY 350.A O no hydrogen 2.429 N/A LYS 354.A NZ LEU 338.A O no hydrogen 3.472 N/A LYS 354.A NZ VAL 342.A O no hydrogen 2.748 N/A PHE 355.A N SER 351.A O no hydrogen 2.913 N/A ARG 356.A N GLN 352.A O no hydrogen 2.884 N/A MET 357.A N ASP 353.A O no hydrogen 2.926 N/A LEU 358.A N LYS 354.A O no hydrogen 2.874 N/A LEU 359.A N PHE 355.A O no hydrogen 2.931 N/A PHE 360.A N ARG 356.A O no hydrogen 2.943 N/A MET 361.A N MET 357.A O no hydrogen 2.859 N/A ILE 362.A N LEU 358.A O no hydrogen 2.952 N/A ARG 363.A N LEU 359.A O no hydrogen 2.903 N/A ARG 363.A NH2 ASP 280.A OD2 no hydrogen 2.085 N/A LYS 364.A N PHE 360.A O no hydrogen 2.890 N/A LYS 364.A NZ PRO 198.A O no hydrogen 2.292 N/A LYS 364.A NZ ASP 376.A OD2 no hydrogen 3.444 N/A LEU 365.A N MET 361.A O no hydrogen 2.892 N/A TYR 366.A N ILE 362.A O no hydrogen 2.936 N/A SER 367.A N ARG 363.A O no hydrogen 2.902 N/A SER 367.A OG ARG 363.A O no hydrogen 2.909 N/A SER 367.A OG GLU 372.A OE2 no hydrogen 2.360 N/A LEU 368.A N LYS 364.A O no hydrogen 2.885 N/A VAL 369.A N LEU 365.A O no hydrogen 2.878 N/A ALA 370.A N TYR 366.A O no hydrogen 2.935 N/A GLY 371.A N SER 367.A O no hydrogen 3.210 N/A GLU 372.A N SER 367.A O no hydrogen 3.066 N/A CYS 373.A SG SER 374.A O no hydrogen 3.652 N/A SER 374.A N GLY 619.A O no hydrogen 2.698 N/A SER 374.A OG ARG 618.A O no hydrogen 2.082 N/A ASP 376.A N ALA 200.A O no hydrogen 2.702 N/A ASP 379.A N ASN 377.A OD1 no hydrogen 2.728 N/A ALA 380.A N ASN 377.A O no hydrogen 3.250 N/A THR 381.A OG1 SER 508.A OG no hydrogen 2.601 N/A GLN 382.A NE2 GLN 620.A OE1 no hydrogen 2.613 N/A HIS 383.A N ALA 380.A O no hydrogen 2.869 N/A GLN 384.A N THR 381.A O no hydrogen 3.310 N/A GLU 385.A N VAL 192.A O no hydrogen 2.879 N/A VAL 386.A N SER 631.A O no hydrogen 3.172 N/A LEU 387.A N LEU 190.A O no hydrogen 2.763 N/A LEU 392.A N LEU 388.A O no hydrogen 3.028 N/A TYR 393.A N GLY 389.A O no hydrogen 2.911 N/A GLY 394.A N GLY 390.A O no hydrogen 2.897 N/A MET 395.A N PHE 391.A O no hydrogen 2.925 N/A ILE 396.A N LEU 392.A O no hydrogen 2.902 N/A LEU 397.A N TYR 393.A O no hydrogen 2.924 N/A LYS 398.A N GLY 394.A O no hydrogen 2.901 N/A LYS 398.A NZ ASP 56.A OD2 no hydrogen 2.833 N/A LYS 398.A NZ ASP 226.A OD2 no hydrogen 2.496 N/A GLU 399.A N MET 395.A O no hydrogen 2.920 N/A LYS 400.A N ILE 396.A O no hydrogen 2.895 N/A ILE 401.A N LEU 397.A O no hydrogen 2.881 N/A ASP 402.A N LYS 398.A O no hydrogen 2.959 N/A GLU 403.A N GLU 399.A O no hydrogen 2.877 N/A TYR 404.A N LYS 400.A O no hydrogen 2.871 N/A LEU 405.A N ILE 401.A O no hydrogen 2.973 N/A GLN 406.A N ASP 402.A O no hydrogen 2.926 N/A ASN 407.A N GLU 403.A O no hydrogen 2.784 N/A ILE 408.A N TYR 404.A O no hydrogen 2.981 N/A ILE 409.A N LEU 405.A O no hydrogen 2.926 N/A ALA 410.A N GLN 406.A O no hydrogen 2.860 N/A GLN 411.A N ASN 407.A O no hydrogen 2.903 N/A VAL 412.A N ILE 408.A O no hydrogen 2.906 N/A ARG 413.A N ILE 409.A O no hydrogen 2.869 N/A MET 414.A N ALA 410.A O no hydrogen 2.910 N/A ASP 415.A N GLN 411.A O no hydrogen 2.941 N/A ILE 416.A N VAL 412.A O no hydrogen 2.836 N/A ASN 417.A N ARG 413.A O no hydrogen 2.791 N/A ASN 417.A N MET 414.A O no hydrogen 3.250 N/A ARG 418.A N ASP 415.A O no hydrogen 3.316 N/A MET 420.A N ASP 415.A O no hydrogen 3.125 N/A ASP 426.A N ASN 423.A O no hydrogen 3.366 N/A ASP 426.A N ASN 423.A OD1 no hydrogen 3.060 N/A LYS 427.A NZ GLU 138.A OE1 no hydrogen 3.451 N/A ARG 428.A N ASP 426.A OD1 no hydrogen 3.303 N/A ARG 428.A NE ASP 426.A OD1 no hydrogen 3.012 N/A ARG 428.A NE ASP 426.A OD2 no hydrogen 2.573 N/A MET 430.A N ASP 426.A O no hydrogen 3.127 N/A SER 431.A N LYS 427.A O no hydrogen 2.983 N/A SER 431.A OG LYS 427.A O no hydrogen 3.501 N/A ARG 432.A N ARG 428.A O no hydrogen 2.821 N/A VAL 433.A N TYR 429.A O no hydrogen 2.838 N/A LEU 434.A N MET 430.A O no hydrogen 2.979 N/A MET 435.A N SER 431.A O no hydrogen 3.053 N/A ARG 436.A N VAL 433.A O no hydrogen 2.740 N/A VAL 437.A N VAL 433.A O no hydrogen 3.345 N/A GLU 439.A N GLU 439.A OE1 no hydrogen 2.233 N/A ASN 440.A N ASN 438.A OD1 no hydrogen 2.763 N/A ILE 441.A N GLU 439.A O no hydrogen 2.741 N/A GLY 442.A N CYS 142.A O no hydrogen 2.764 N/A SER 443.A N ASN 440.A OD1 no hydrogen 2.836 N/A MET 445.A N ILE 441.A O no hydrogen 2.927 N/A GLN 446.A N GLY 442.A O no hydrogen 2.904 N/A TYR 447.A N SER 443.A O no hydrogen 2.848 N/A PHE 448.A N LYS 444.A O no hydrogen 2.953 N/A LEU 449.A N MET 445.A O no hydrogen 2.923 N/A SER 450.A N TYR 447.A O no hydrogen 2.778 N/A THR 451.A OG1 TYR 447.A O no hydrogen 3.013 N/A GLY 452.A N PHE 448.A O no hydrogen 2.699 N/A ASN 453.A N THR 451.A OG1 no hydrogen 3.397 N/A GLN 457.A NE2 GLN 406.A OE1 no hydrogen 3.307 N/A GLY 459.A N SER 456.A O no hydrogen 3.109 N/A LEU 460.A N SER 458.A OG no hydrogen 3.416 N/A LEU 462.A N GLY 459.A O no hydrogen 2.939 N/A GLN 463.A N GLN 463.A OE1 no hydrogen 2.285 N/A TYR 468.A OH GLN 464.A O no hydrogen 2.166 N/A THR 469.A OG1 LEU 186.A O no hydrogen 3.506 N/A VAL 470.A N LEU 186.A O no hydrogen 2.899 N/A ALA 472.A N GLU 184.A O no hydrogen 2.659 N/A LYS 474.A NZ GLU 173.A OE1 no hydrogen 3.517 N/A TYR 478.A N ASN 476.A OD1 no hydrogen 2.602 N/A ARG 479.A NE GLU 473.A OE1 no hydrogen 3.356 N/A ARG 479.A NH2 GLU 473.A OE1 no hydrogen 2.711 N/A PHE 480.A N ASN 476.A O no hydrogen 2.896 N/A ILE 481.A N PHE 477.A O no hydrogen 2.927 N/A SER 482.A N TYR 478.A O no hydrogen 2.900 N/A SER 482.A OG TYR 478.A O no hydrogen 2.594 N/A HIS 483.A N ARG 479.A O no hydrogen 2.979 N/A ARG 485.A N SER 482.A O no hydrogen 3.100 N/A MET 486.A N HIS 483.A O no hydrogen 3.339 N/A VAL 487.A N ASN 527.A O no hydrogen 2.902 N/A HIS 488.A N MET 189.A O no hydrogen 3.154 N/A HIS 488.A ND1 LEU 525.A O no hydrogen 3.090 N/A ARG 489.A N LEU 525.A O no hydrogen 2.833 N/A ARG 489.A NH1 ILE 191.A O no hydrogen 3.127 N/A ARG 489.A NH2 ASP 379.A OD1 no hydrogen 2.653 N/A ALA 494.A N GLY 490.A O no hydrogen 3.326 N/A GLN 495.A N SER 491.A O no hydrogen 2.975 N/A GLN 495.A N PHE 492.A O no hydrogen 3.187 N/A ARG 502.A NH1 SER 521.A O no hydrogen 2.360 N/A ARG 502.A NH1 CYS 523.A O no hydrogen 2.379 N/A ARG 502.A NH2 SER 521.A O no hydrogen 2.607 N/A LYS 503.A N THR 499.A O no hydrogen 2.988 N/A GLU 507.A N GLU 507.A OE1 no hydrogen 2.475 N/A SER 508.A N LEU 505.A O no hydrogen 3.378 N/A SER 508.A OG THR 381.A OG1 no hydrogen 2.601 N/A TRP 509.A N PRO 506.A O no hydrogen 3.255 N/A TRP 509.A NE1 GLU 674.A OE2 no hydrogen 3.182 N/A PHE 511.A N SER 508.A O no hydrogen 2.715 N/A LEU 512.A N SER 508.A O no hydrogen 2.998 N/A CYS 513.A N HIS 528.A O no hydrogen 2.721 N/A CYS 513.A SG SER 682.A OG no hydrogen 3.140 N/A HIS 516.A ND1 SER 682.A OG no hydrogen 3.083 N/A CYS 523.A N GLY 520.A O no hydrogen 2.763 N/A CYS 523.A SG PRO 518.A O no hydrogen 3.221 N/A LEU 525.A N PRO 522.A O no hydrogen 2.586 N/A LEU 526.A N PRO 522.A O no hydrogen 3.219 N/A ASN 527.A ND2 GLY 524.A O no hydrogen 3.539 N/A HIS 528.A ND1 HIS 516.A O no hydrogen 3.054 N/A PHE 529.A N ARG 485.A O no hydrogen 2.810 N/A ALA 530.A N PHE 511.A O no hydrogen 2.824 N/A HIS 531.A N LEU 681.A O no hydrogen 3.034 N/A HIS 531.A ND1 TYR 744.A OH no hydrogen 2.818 N/A CYS 533.A N ALA 530.A O no hydrogen 2.983 N/A CYS 533.A SG ARG 534.A O no hydrogen 3.367 N/A ARG 534.A N LEU 634.A O no hydrogen 2.822 N/A SER 536.A N ARG 632.A O no hydrogen 3.033 N/A SER 536.A OG GLY 629.A O no hydrogen 2.954 N/A SER 536.A OG ARG 632.A O no hydrogen 3.353 N/A GLN 539.A NE2 ASP 573.A OD2 no hydrogen 2.580 N/A SER 540.A OG ASP 541.A OD1 no hydrogen 2.822 N/A ARG 544.A N ASP 541.A O no hydrogen 3.199 N/A SER 547.A N ARG 544.A O no hydrogen 3.127 N/A ILE 548.A N ARG 544.A O no hydrogen 3.433 N/A LEU 549.A N ILE 545.A O no hydrogen 2.903 N/A TYR 550.A N PRO 546.A O no hydrogen 2.871 N/A SER 551.A N SER 547.A O no hydrogen 2.989 N/A SER 551.A OG SER 547.A O no hydrogen 2.861 N/A LEU 552.A N ILE 548.A O no hydrogen 2.867 N/A GLY 553.A N TYR 550.A O no hydrogen 3.349 N/A VAL 554.A N LEU 549.A O no hydrogen 3.148 N/A ALA 555.A N TRP 579.A O no hydrogen 3.332 N/A ALA 557.A N ILE 577.A O no hydrogen 3.306 N/A HIS 559.A N PRO 556.A O no hydrogen 2.619 N/A THR 560.A N PRO 556.A O no hydrogen 2.567 N/A THR 560.A OG1 ALA 555.A O no hydrogen 2.848 N/A THR 560.A OG1 PRO 556.A O no hydrogen 3.171 N/A LEU 567.A N GLY 564.A O no hydrogen 2.823 N/A CYS 568.A N VAL 580.A O no hydrogen 2.884 N/A CYS 569.A SG GLY 578.A O no hydrogen 3.803 N/A VAL 570.A N GLY 578.A O no hydrogen 2.841 N/A GLN 571.A N LEU 624.A O no hydrogen 3.011 N/A ILE 572.A N LYS 575.A O no hydrogen 2.938 N/A ASP 573.A N LEU 626.A O no hydrogen 3.053 N/A LYS 575.A N ILE 572.A O no hydrogen 3.016 N/A LYS 575.A NZ ASP 353.A OD2 no hydrogen 2.036 N/A ILE 577.A N VAL 570.A O no hydrogen 2.852 N/A GLY 578.A N VAL 570.A O no hydrogen 2.979 N/A TRP 579.A N ALA 555.A O no hydrogen 3.391 N/A VAL 580.A N CYS 568.A O no hydrogen 2.901 N/A HIS 582.A NE2 PRO 565.A O no hydrogen 3.017 N/A GLN 584.A N SER 581.A OG no hydrogen 2.878 N/A GLN 584.A NE2 LEU 552.A O no hydrogen 3.279 N/A GLY 585.A N SER 581.A O no hydrogen 2.620 N/A LYS 586.A N HIS 582.A O no hydrogen 2.981 N/A ILE 587.A N GLU 583.A O no hydrogen 2.964 N/A ILE 588.A N GLN 584.A O no hydrogen 2.841 N/A ALA 589.A N GLY 585.A O no hydrogen 2.931 N/A ASP 590.A N LYS 586.A O no hydrogen 2.966 N/A THR 591.A N ILE 587.A O no hydrogen 2.904 N/A THR 591.A OG1 ILE 587.A O no hydrogen 2.625 N/A THR 591.A OG1 ILE 588.A O no hydrogen 3.324 N/A LEU 592.A N ILE 588.A O no hydrogen 2.825 N/A ARG 593.A N ALA 589.A O no hydrogen 2.968 N/A ARG 593.A NH1 ASP 646.A OD2 no hydrogen 2.988 N/A ARG 593.A NH1 GLU 652.A OE1 no hydrogen 3.559 N/A ARG 593.A NH2 GLU 652.A OE1 no hydrogen 2.792 N/A TYR 594.A N ASP 590.A O no hydrogen 2.971 N/A TRP 595.A N THR 591.A O no hydrogen 2.942 N/A LYS 596.A N LEU 592.A O no hydrogen 2.838 N/A LYS 596.A N ARG 593.A O no hydrogen 3.142 N/A LYS 596.A NZ LEU 608.A O no hydrogen 2.464 N/A LYS 596.A NZ ILE 647.A O no hydrogen 3.380 N/A VAL 597.A N ARG 593.A O no hydrogen 2.995 N/A GLU 598.A N TYR 594.A O no hydrogen 2.871 N/A THR 601.A OG1 TRP 595.A O no hydrogen 2.891 N/A LEU 608.A N PRO 605.A O no hydrogen 2.896 N/A GLU 609.A N PHE 627.A O no hydrogen 2.900 N/A ILE 610.A N GLU 652.A OE1 no hydrogen 2.992 N/A GLY 611.A N TYR 625.A O no hydrogen 2.949 N/A TYR 612.A OH HIS 582.A O no hydrogen 3.209 N/A VAL 613.A N GLY 623.A O no hydrogen 2.816 N/A SER 616.A OG PRO 614.A O no hydrogen 3.390 N/A GLY 619.A N SER 616.A O no hydrogen 2.821 N/A GLY 623.A N VAL 613.A O no hydrogen 2.998 N/A LEU 624.A N CYS 569.A O no hydrogen 2.816 N/A LEU 626.A N GLN 571.A O no hydrogen 2.856 N/A PHE 627.A N GLU 609.A O no hydrogen 2.877 N/A SER 631.A N SER 536.A O no hydrogen 3.040 N/A SER 631.A OG VAL 386.A O no hydrogen 2.671 N/A ARG 632.A NE GLY 629.A O no hydrogen 2.765 N/A ARG 632.A NH1 ASP 607.A O no hydrogen 2.762 N/A ARG 632.A NH2 ASP 607.A O no hydrogen 2.985 N/A ARG 632.A NH2 GLY 628.A O no hydrogen 3.412 N/A LEU 634.A N ARG 534.A O no hydrogen 2.942 N/A ARG 635.A N VAL 648.A O no hydrogen 2.875 N/A ARG 635.A NE GLN 653.A OE1 no hydrogen 2.910 N/A ARG 635.A NH1 GLU 674.A OE1 no hydrogen 3.067 N/A ARG 635.A NH2 GLN 653.A OE1 no hydrogen 3.564 N/A ARG 635.A NH2 GLU 674.A OE2 no hydrogen 2.869 N/A VAL 637.A N ASP 646.A O no hydrogen 2.885 N/A ARG 638.A N VAL 673.A O no hydrogen 2.758 N/A ARG 638.A NE ASP 643.A OD1 no hydrogen 2.545 N/A ARG 638.A NH2 ASP 643.A OD1 no hydrogen 2.800 N/A ARG 638.A NH2 ASP 643.A OD2 no hydrogen 3.461 N/A TYR 639.A N LYS 644.A O no hydrogen 2.849 N/A LEU 640.A N THR 671.A O no hydrogen 3.215 N/A ASP 643.A N LEU 640.A O no hydrogen 2.941 N/A LYS 644.A N TYR 639.A O no hydrogen 2.956 N/A LYS 644.A NZ VAL 597.A O no hydrogen 3.366 N/A ASP 646.A N VAL 637.A O no hydrogen 2.844 N/A VAL 648.A N ARG 635.A O no hydrogen 2.895 N/A GLY 649.A N GLU 652.A OE2 no hydrogen 3.337 N/A PHE 651.A N GLU 609.A OE2 no hydrogen 3.169 N/A GLN 653.A N GLY 649.A O no hydrogen 3.216 N/A GLN 653.A NE2 TRP 509.A O no hydrogen 2.926 N/A TYR 655.A N GLU 652.A O no hydrogen 3.184 N/A TYR 655.A OH GLN 620.A OE1 no hydrogen 3.193 N/A MET 656.A N GLN 653.A O no hydrogen 2.793 N/A ASN 657.A ND2 VAL 669.A O no hydrogen 3.198 N/A ALA 659.A N HIS 672.A O no hydrogen 2.847 N/A GLN 663.A N GLN 663.A OE1 no hydrogen 2.402 N/A GLU 664.A N THR 661.A O no hydrogen 3.163 N/A ILE 665.A N PRO 662.A O no hydrogen 3.481 N/A GLN 666.A N HIS 670.A ND1 no hydrogen 2.789 N/A THR 671.A N ASN 657.A O no hydrogen 2.916 N/A THR 671.A OG1 HIS 672.A ND1 no hydrogen 2.872 N/A HIS 672.A N ASN 657.A O no hydrogen 3.423 N/A HIS 672.A ND1 THR 671.A OG1 no hydrogen 2.872 N/A VAL 673.A N ARG 638.A O no hydrogen 2.835 N/A GLU 674.A N ALA 659.A O no hydrogen 2.934 N/A ASN 679.A N THR 676.A O no hydrogen 2.847 N/A ILE 680.A N PRO 677.A O no hydrogen 2.990 N/A LEU 681.A N THR 678.A O no hydrogen 2.949 N/A SER 682.A OG HIS 516.A ND1 no hydrogen 3.083 N/A ASN 686.A N SER 682.A O no hydrogen 3.107 N/A ASN 686.A ND2 THR 678.A O no hydrogen 3.625 N/A ASN 686.A ND2 LEU 681.A O no hydrogen 3.289 N/A ASN 686.A ND2 SER 682.A O no hydrogen 2.562 N/A LEU 687.A N ILE 683.A O no hydrogen 2.948 N/A THR 688.A N LEU 684.A O no hydrogen 3.156 N/A THR 688.A OG1 LEU 684.A O no hydrogen 3.335 N/A PHE 690.A N SER 965.A O no hydrogen 3.104 N/A PHE 693.A N PHE 690.A O no hydrogen 2.705 N/A ASN 694.A ND2 ASN 699.A OD1 no hydrogen 3.094 N/A ASN 694.A ND2 HIS 905.A ND1 no hydrogen 3.100 N/A GLN 695.A N MET 942.A O no hydrogen 3.299 N/A ARG 698.A N GLN 695.A O no hydrogen 2.752 N/A ARG 698.A NH1 GLY 906.A O no hydrogen 3.448 N/A ASN 699.A N GLN 695.A O no hydrogen 3.349 N/A ASN 699.A ND2 SER 691.A O no hydrogen 2.622 N/A MET 700.A N SER 696.A O no hydrogen 2.994 N/A TYR 701.A N PRO 697.A O no hydrogen 2.908 N/A TYR 701.A OH ASP 519.A OD2 no hydrogen 3.406 N/A GLN 702.A N ARG 698.A O no hydrogen 2.870 N/A CYS 703.A N ASN 699.A O no hydrogen 2.900 N/A CYS 703.A SG ASN 699.A O no hydrogen 3.494 N/A GLN 704.A N MET 700.A O no hydrogen 2.997 N/A MET 705.A N TYR 701.A O no hydrogen 2.859 N/A GLY 706.A N GLN 702.A O no hydrogen 2.868 N/A LYS 707.A N CYS 703.A O no hydrogen 2.938 N/A GLN 708.A N GLN 704.A O no hydrogen 2.916 N/A THR 709.A OG1 MET 705.A O no hydrogen 2.677 N/A MET 710.A N ARG 1019.A O no hydrogen 2.759 N/A THR 712.A OG1 PRO 750.A O no hydrogen 3.260 N/A VAL 715.A N GLU 170.A OE1 no hydrogen 2.606 N/A VAL 715.A N GLU 170.A OE2 no hydrogen 2.673 N/A ALA 716.A N GLU 170.A OE2 no hydrogen 2.429 N/A HIS 719.A N ALA 716.A O no hydrogen 2.596 N/A ARG 720.A N LEU 717.A O no hydrogen 3.330 N/A ARG 720.A NE ASP 722.A OD1 no hydrogen 3.181 N/A ARG 720.A NE ASP 722.A OD2 no hydrogen 3.201 N/A ARG 720.A NH1 GLU 184.A OE2 no hydrogen 2.908 N/A ARG 720.A NH2 ASP 722.A OD1 no hydrogen 3.243 N/A SER 721.A OG ARG 720.A O no hydrogen 2.872 N/A LEU 725.A N TYR 788.A O no hydrogen 2.901 N/A ARG 727.A N THR 786.A O no hydrogen 2.893 N/A LEU 728.A N GLY 711.A O no hydrogen 3.193 N/A GLN 729.A N TYR 784.A O no hydrogen 3.283 N/A THR 730.A OG1 GLY 781.A O no hydrogen 3.449 N/A GLN 732.A N GLY 752.A O no hydrogen 3.067 N/A THR 733.A OG1 TYR 741.A OH no hydrogen 3.332 N/A LYS 737.A N GLN 963.A O no hydrogen 3.180 N/A LYS 737.A NZ PRO 734.A O no hydrogen 3.153 N/A TYR 741.A N ALA 738.A O no hydrogen 2.938 N/A TYR 741.A OH THR 733.A OG1 no hydrogen 3.332 N/A ASP 742.A N ASN 739.A O no hydrogen 3.201 N/A ASP 743.A N ASN 739.A O no hydrogen 2.951 N/A TYR 744.A N LEU 740.A O no hydrogen 2.805 N/A TYR 744.A OH HIS 531.A ND1 no hydrogen 2.818 N/A GLY 745.A N ASP 742.A O no hydrogen 2.944 N/A MET 746.A N TYR 741.A O no hydrogen 3.146 N/A ASN 748.A N GLY 745.A O no hydrogen 2.898 N/A ASN 748.A ND2 GLY 745.A O no hydrogen 3.082 N/A PHE 749.A N MET 746.A O no hydrogen 2.933 N/A PHE 753.A N TYR 1017.A O no hydrogen 2.927 N/A ASN 754.A N GLN 732.A OE1 no hydrogen 2.610 N/A ALA 755.A N VAL 1015.A O no hydrogen 2.877 N/A VAL 756.A N ASP 930.A OD2 no hydrogen 2.363 N/A VAL 757.A N GLY 1013.A O no hydrogen 2.864 N/A ALA 758.A N ILE 931.A O no hydrogen 2.894 N/A VAL 759.A N TYR 1011.A O no hydrogen 2.898 N/A ILE 760.A N ILE 933.A O no hydrogen 2.790 N/A TYR 762.A OH ASP 919.A O no hydrogen 3.383 N/A TYR 762.A OH SER 999.A OG no hydrogen 3.048 N/A THR 763.A OG1 ASP 766.A OD2 no hydrogen 3.352 N/A ALA 770.A N MET 767.A O no hydrogen 2.849 N/A MET 771.A N VAL 910.A O no hydrogen 2.891 N/A ILE 772.A N ILE 932.A O no hydrogen 3.442 N/A ILE 773.A N ARG 913.A O no hydrogen 3.481 N/A ASN 774.A N ASP 930.A O no hydrogen 2.916 N/A ASN 774.A ND2 PRO 929.A O no hydrogen 3.588 N/A LYS 775.A N TRP 915.A O no hydrogen 2.643 N/A LYS 775.A NZ GLU 779.A OE2 no hydrogen 2.206 N/A SER 776.A OG THR 917.A OG1 no hydrogen 2.476 N/A ALA 777.A N ASN 774.A O no hydrogen 3.242 N/A ASP 778.A N ASN 774.A O no hydrogen 3.185 N/A GLU 779.A N LYS 775.A O no hydrogen 2.894 N/A ARG 780.A N SER 776.A O no hydrogen 3.022 N/A ARG 780.A N ALA 777.A O no hydrogen 2.953 N/A GLY 781.A N ASP 778.A O no hydrogen 2.918 N/A PHE 782.A N ALA 777.A O no hydrogen 3.057 N/A TYR 784.A N GLY 781.A O no hydrogen 2.956 N/A GLY 785.A N ARG 893.A O no hydrogen 3.411 N/A THR 786.A N ARG 727.A O no hydrogen 2.939 N/A MET 787.A N ILE 891.A O no hydrogen 2.876 N/A TYR 788.A N LEU 725.A O no hydrogen 2.874 N/A LYS 789.A N TYR 889.A O no hydrogen 2.944 N/A THR 790.A N ASN 723.A O no hydrogen 3.452 N/A THR 790.A OG1 ASP 722.A O no hydrogen 2.177 N/A GLU 791.A N ILE 887.A O no hydrogen 2.890 N/A VAL 793.A N VAL 885.A O no hydrogen 2.832 N/A LEU 795.A N GLN 883.A O no hydrogen 2.984 N/A ALA 796.A N ASP 794.A OD1 no hydrogen 2.820 N/A ASN 798.A ND2 ASN 798.A O no hydrogen 2.083 N/A ARG 799.A N ALA 796.A O no hydrogen 2.445 N/A ARG 799.A NH1 LEU 795.A O no hydrogen 2.961 N/A ASP 803.A N ASP 803.A OD1 no hydrogen 2.196 N/A THR 806.A OG1 PRO 804.A O no hydrogen 3.376 N/A THR 806.A OG1 ASP 847.A OD1 no hydrogen 2.978 N/A HIS 808.A N PHE 846.A O no hydrogen 2.918 N/A GLY 810.A N ALA 844.A O no hydrogen 2.722 N/A LYS 818.A NZ ASP 814.A O no hydrogen 2.983 N/A LYS 818.A NZ ASP 814.A OD1 no hydrogen 2.500 N/A TRP 820.A N PRO 817.A O no hydrogen 2.859 N/A LEU 821.A N LYS 818.A O no hydrogen 2.951 N/A GLU 822.A N GLU 819.A O no hydrogen 2.944 N/A LYS 823.A N TRP 820.A O no hydrogen 3.126 N/A LYS 823.A NZ TYR 835.A O no hydrogen 3.004 N/A LYS 823.A NZ ASP 840.A OD2 no hydrogen 3.360 N/A LEU 824.A N TRP 820.A O no hydrogen 2.869 N/A ASP 825.A N LEU 829.A O no hydrogen 2.763 N/A GLU 826.A N ASP 825.A OD1 no hydrogen 2.672 N/A GLY 828.A N ASP 825.A O no hydrogen 2.594 N/A LEU 829.A N ASP 827.A OD1 no hydrogen 3.073 N/A TYR 831.A N LYS 823.A O no hydrogen 3.159 N/A GLY 833.A N ILE 866.A O no hydrogen 2.808 N/A THR 834.A N TYR 831.A O no hydrogen 2.835 N/A THR 834.A OG1 TYR 831.A O no hydrogen 2.580 N/A VAL 836.A N ALA 864.A O no hydrogen 2.776 N/A GLU 837.A N ASP 840.A OD2 no hydrogen 3.237 N/A GLY 839.A N TYR 858.A O no hydrogen 2.904 N/A ASP 840.A N GLU 837.A O no hydrogen 2.844 N/A ILE 842.A N LYS 856.A O no hydrogen 2.902 N/A ALA 844.A N GLY 828.A O no hydrogen 3.049 N/A TYR 845.A N LYS 854.A O no hydrogen 2.769 N/A THR 849.A N ASP 847.A OD1 no hydrogen 2.716 N/A THR 849.A OG1 ASP 847.A OD1 no hydrogen 2.511 N/A LEU 850.A N ASP 847.A O no hydrogen 3.118 N/A ASN 851.A N ASP 847.A O no hydrogen 2.988 N/A THR 853.A OG1 ASN 813.A OD1 no hydrogen 2.347 N/A LYS 854.A N TYR 845.A O no hydrogen 3.045 N/A LYS 856.A N CYS 843.A O no hydrogen 3.034 N/A TYR 858.A N ASP 840.A O no hydrogen 3.199 N/A TYR 858.A OH GLU 862.A O no hydrogen 2.859 N/A SER 860.A OG TYR 858.A OH no hydrogen 3.112 N/A SER 860.A OG GLU 862.A O no hydrogen 3.461 N/A GLU 862.A N SER 860.A OG no hydrogen 3.377 N/A ALA 864.A N VAL 836.A O no hydrogen 2.823 N/A TYR 865.A N ARG 890.A O no hydrogen 2.957 N/A ILE 866.A N THR 834.A O no hydrogen 3.318 N/A GLU 867.A N LYS 888.A O no hydrogen 2.839 N/A ASN 870.A N SER 886.A O no hydrogen 2.875 N/A ILE 872.A N THR 884.A O no hydrogen 2.926 N/A SER 876.A N GLY 873.A O no hydrogen 3.349 N/A SER 876.A OG GLY 873.A O no hydrogen 2.214 N/A GLU 881.A N GLU 881.A OE1 no hydrogen 2.418 N/A LEU 882.A N PHE 879.A O no hydrogen 3.252 N/A GLN 883.A NE2 GLN 807.A O no hydrogen 2.422 N/A THR 884.A OG1 ASP 794.A OD1 no hydrogen 3.524 N/A VAL 885.A N VAL 793.A O no hydrogen 2.955 N/A SER 886.A N ASN 870.A O no hydrogen 2.888 N/A SER 886.A OG GLU 791.A O no hydrogen 3.564 N/A ILE 887.A N GLU 791.A O no hydrogen 2.920 N/A LYS 888.A N GLU 868.A O no hydrogen 2.904 N/A LYS 888.A NZ ARG 720.A O no hydrogen 2.964 N/A LYS 888.A NZ GLU 868.A OE1 no hydrogen 2.940 N/A TYR 889.A N LYS 789.A O no hydrogen 2.809 N/A ARG 890.A N TYR 865.A O no hydrogen 2.643 N/A ILE 891.A N MET 787.A O no hydrogen 2.857 N/A ARG 892.A NE TYR 784.A OH no hydrogen 2.589 N/A ARG 892.A NH2 TYR 784.A OH no hydrogen 2.901 N/A ARG 893.A N GLY 785.A O no hydrogen 2.939 N/A GLY 898.A N CYS 911.A O no hydrogen 2.787 N/A ASP 899.A N GLN 896.A O no hydrogen 2.725 N/A PHE 901.A N GLY 909.A O no hydrogen 2.869 N/A SER 902.A N GLN 1018.A O no hydrogen 2.890 N/A SER 902.A OG SER 903.A O no hydrogen 3.147 N/A ARG 904.A NE GLU 949.A OE2 no hydrogen 3.142 N/A ARG 904.A NH1 VAL 736.A O no hydrogen 2.619 N/A ARG 904.A NH2 VAL 736.A O no hydrogen 2.673 N/A ARG 904.A NH2 GLU 949.A OE2 no hydrogen 2.687 N/A HIS 905.A NE2 GLU 949.A OE1 no hydrogen 2.167 N/A GLY 906.A N GLN 702.A OE1 no hydrogen 2.908 N/A GLY 909.A N PHE 901.A O no hydrogen 2.841 N/A CYS 911.A N ASP 899.A O no hydrogen 3.109 N/A CYS 911.A SG ARG 913.A O no hydrogen 3.108 N/A SER 912.A N MET 771.A O no hydrogen 2.920 N/A SER 912.A OG TYR 765.A O no hydrogen 2.777 N/A SER 912.A OG MET 771.A O no hydrogen 3.440 N/A LYS 914.A NZ ASP 778.A OD2 no hydrogen 3.488 N/A TRP 915.A N ILE 773.A O no hydrogen 2.948 N/A THR 917.A OG1 ASN 774.A OD1 no hydrogen 2.340 N/A THR 917.A OG1 SER 776.A OG no hydrogen 2.476 N/A ASP 919.A N PRO 916.A O no hydrogen 2.956 N/A MET 920.A N PRO 916.A O no hydrogen 3.044 N/A MET 920.A N THR 917.A O no hydrogen 3.328 N/A PHE 922.A N TYR 998.A O no hydrogen 3.162 N/A SER 923.A N ILE 927.A O no hydrogen 2.749 N/A GLU 924.A N PRO 996.A O no hydrogen 2.999 N/A THR 925.A N SER 923.A OG no hydrogen 2.805 N/A THR 925.A OG1 TYR 989.A OH no hydrogen 3.296 N/A GLY 926.A N SER 923.A O no hydrogen 2.945 N/A ASP 930.A N VAL 756.A O no hydrogen 2.457 N/A ILE 931.A N VAL 756.A O no hydrogen 2.916 N/A ILE 932.A N ILE 772.A O no hydrogen 3.150 N/A ILE 933.A N ALA 758.A O no hydrogen 2.986 N/A ASN 934.A ND2 ASP 766.A O no hydrogen 2.353 N/A HIS 936.A N ASN 934.A OD1 no hydrogen 2.564 N/A HIS 936.A ND1 ASN 934.A OD1 no hydrogen 2.334 N/A ALA 937.A N ASN 934.A O no hydrogen 3.397 N/A PHE 938.A N PRO 935.A O no hydrogen 2.922 N/A SER 940.A OG ALA 937.A O no hydrogen 3.313 N/A ARG 941.A NH1 ALA 937.A O no hydrogen 2.965 N/A MET 942.A N PHE 938.A O no hydrogen 2.667 N/A THR 943.A OG1 GLN 907.A OE1 no hydrogen 2.808 N/A GLY 945.A N ASN 694.A OD1 no hydrogen 2.816 N/A MET 946.A N THR 943.A O no hydrogen 2.547 N/A VAL 948.A N ILE 944.A O no hydrogen 2.980 N/A GLU 949.A N GLY 945.A O no hydrogen 2.849 N/A SER 950.A N MET 946.A O no hydrogen 2.902 N/A SER 950.A OG MET 946.A O no hydrogen 2.914 N/A LEU 951.A N PHE 947.A O no hydrogen 3.031 N/A ALA 952.A N VAL 948.A O no hydrogen 2.840 N/A GLY 953.A N GLU 949.A O no hydrogen 2.875 N/A LYS 954.A N SER 950.A O no hydrogen 2.962 N/A LYS 954.A NZ GLY 993.A O no hydrogen 2.878 N/A LYS 954.A NZ VAL 1012.A O no hydrogen 3.258 N/A ALA 955.A N LEU 951.A O no hydrogen 3.001 N/A GLY 956.A N ALA 952.A O no hydrogen 2.834 N/A ALA 957.A N GLY 953.A O no hydrogen 2.916 N/A LEU 958.A N LYS 954.A O no hydrogen 2.999 N/A HIS 959.A N ALA 955.A O no hydrogen 2.924 N/A ILE 961.A N GLY 956.A O no hydrogen 2.669 N/A GLN 963.A N ILE 735.A O no hydrogen 2.891 N/A SER 965.A N LYS 737.A O no hydrogen 3.014 N/A THR 966.A N ASP 964.A OD1 no hydrogen 2.876 N/A THR 966.A OG1 ASP 964.A OD1 no hydrogen 2.613 N/A THR 966.A OG1 ASP 964.A OD2 no hydrogen 3.509 N/A TRP 968.A N ASP 692.A OD2 no hydrogen 2.714 N/A ILE 969.A N THR 966.A O no hydrogen 3.076 N/A ASN 971.A N ASP 974.A O no hydrogen 3.349 N/A ASP 973.A N ASN 971.A OD1 no hydrogen 3.084 N/A ASP 974.A N ASN 971.A O no hydrogen 2.666 N/A ASP 978.A N THR 975.A OG1 no hydrogen 3.139 N/A TYR 979.A N THR 975.A O no hydrogen 3.108 N/A PHE 980.A N PRO 976.A O no hydrogen 2.869 N/A GLU 982.A N ASP 978.A O no hydrogen 2.869 N/A GLN 983.A N TYR 979.A O no hydrogen 2.990 N/A GLN 983.A NE2 HIS 959.A ND1 no hydrogen 3.288 N/A LEU 984.A N PHE 980.A O no hydrogen 2.871 N/A ALA 985.A N GLY 981.A O no hydrogen 2.886 N/A LYS 986.A N GLU 982.A O no hydrogen 2.909 N/A ALA 987.A N GLN 983.A O no hydrogen 2.977 N/A GLY 988.A N LEU 984.A O no hydrogen 3.065 N/A GLY 988.A N ALA 985.A O no hydrogen 3.179 N/A TYR 989.A N LEU 984.A O no hydrogen 3.227 N/A TYR 989.A OH THR 925.A OG1 no hydrogen 3.296 N/A HIS 992.A N ASN 990.A OD1 no hydrogen 2.472 N/A GLY 993.A N ASN 990.A O no hydrogen 2.794 N/A GLU 995.A N ILE 1010.A O no hydrogen 2.742 N/A TYR 998.A N PHE 922.A O no hydrogen 2.737 N/A SER 999.A N GLU 1004.A O no hydrogen 2.944 N/A SER 999.A OG TYR 762.A OH no hydrogen 3.048 N/A LEU 1006.A N MET 997.A O no hydrogen 3.068 N/A ILE 1010.A N GLU 995.A O no hydrogen 2.939 N/A TYR 1011.A OH PHE 947.A O no hydrogen 2.520 N/A GLY 1013.A N VAL 757.A O no hydrogen 2.903 N/A VAL 1014.A N SER 950.A O no hydrogen 3.432 N/A VAL 1015.A N ALA 755.A O no hydrogen 2.944 N/A TYR 1016.A N GLU 949.A OE2 no hydrogen 3.118 N/A TYR 1016.A OH ASN 751.A OD1 no hydrogen 2.972 N/A TYR 1017.A N PHE 753.A O no hydrogen 2.854 N/A GLN 1018.A N SER 902.A O no hydrogen 2.834 N/A GLN 1018.A NE2 SER 903.A O no hydrogen 3.564 N/A ARG 1019.A NH1 GLY 783.A O no hydrogen 2.911 N/A ARG 1019.A NH1 ARG 893.A O no hydrogen 3.062 N/A ARG 1019.A NH2 ARG 893.A O no hydrogen 3.476 N/A LEU 1020.A N LYS 900.A O no hydrogen 3.361 N/A ARG 1021.A N GLN 708.A O no hydrogen 3.259 N/A ARG 1021.A NE GLN 708.A OE1 no hydrogen 3.083 N/A ARG 1021.A NH2 GLN 708.A OE1 no hydrogen 2.652 N/A MET 1023.A N ARG 1021.A O no hydrogen 2.748 N/A ASP 1026.A N MET 1023.A O no hydrogen 2.727 N/A LYS 1027.A N VAL 1024.A O no hydrogen 2.907 N/A PHE 1028.A N ASN 1025.A O no hydrogen 3.355 N/A ARG 1031.A NH2 PRO 1035.A O no hydrogen 2.576 N/A THR 1033.A OG1 SER 1032.A O no hydrogen 2.587 N/A ASN 1037.A N GLN 1042.A O no hydrogen 3.117 N/A LEU 1039.A N ASN 1037.A OD1 no hydrogen 3.130 N/A THR 1040.A N ASN 1037.A O no hydrogen 3.193 N/A MET 1041.A N ASN 1037.A O no hydrogen 2.554 N/A GLN 1042.A N THR 1040.A OG1 no hydrogen 3.280 N/A VAL 1044.A N PRO 1035.A O no hydrogen 3.261 N/A ARG 1049.A N GLY 1046.A O no hydrogen 2.936 N/A HIS 1050.A N ARG 1047.A O no hydrogen 2.903 N/A GLY 1051.A N GLY 1046.A O no hydrogen 2.704 N/A GLY 1052.A N VAL 1044.A O no hydrogen 3.276 N/A GLY 1056.A N GLU 1059.A OE1 no hydrogen 2.833 N/A ARG 1060.A N GLY 1056.A O no hydrogen 3.000 N/A ASP 1061.A N GLU 1057.A O no hydrogen 2.886 N/A ALA 1062.A N MET 1058.A O no hydrogen 2.878 N/A LEU 1063.A N GLU 1059.A O no hydrogen 2.905 N/A ILE 1064.A N ARG 1060.A O no hydrogen 2.929 N/A GLY 1065.A N ASP 1061.A O no hydrogen 2.859 N/A HIS 1066.A N ALA 1062.A O no hydrogen 3.112 N/A GLY 1067.A N ILE 1064.A O no hydrogen 2.986 N/A THR 1068.A N LEU 1063.A O no hydrogen 3.311 N/A SER 1069.A N GLY 1067.A O no hydrogen 2.789 N/A LEU 1071.A N THR 1068.A O no hydrogen 2.522 N/A LEU 1072.A N THR 1068.A O no hydrogen 2.775 N/A GLN 1073.A N SER 1069.A O no hydrogen 2.922 N/A ASP 1074.A N PHE 1070.A O no hydrogen 2.959 N/A ARG 1075.A N LEU 1071.A O no hydrogen 2.859 N/A LEU 1076.A N LEU 1072.A O no hydrogen 2.925 N/A LEU 1077.A N GLN 1073.A O no hydrogen 3.050 N/A ASN 1078.A N GLN 1073.A O no hydrogen 3.123 N/A SER 1079.A N ASP 1074.A O no hydrogen 2.976 N/A SER 1079.A OG ASP 1074.A O no hydrogen 3.027 N/A SER 1079.A OG ASP 1074.A OD1 no hydrogen 3.565 N/A SER 1080.A N LEU 1077.A O no hydrogen 2.739 N/A THR 1083.A N ASN 1153.A O no hydrogen 2.888 N/A GLN 1084.A NE2 TYR 1082.A OH no hydrogen 3.555 N/A ALA 1085.A N GLY 1151.A O no hydrogen 2.887 N/A VAL 1087.A N PHE 1149.A O no hydrogen 2.848 N/A CYS 1088.A N SER 1093.A O no hydrogen 2.942 N/A ARG 1089.A N ASN 1147.A O no hydrogen 3.311 N/A ARG 1089.A NE ASN 1147.A O no hydrogen 3.476 N/A ARG 1089.A NE ASN 1147.A OD1 no hydrogen 2.976 N/A ARG 1089.A NH2 ASN 1147.A OD1 no hydrogen 2.889 N/A CYS 1091.A N CYS 1088.A O no hydrogen 3.213 N/A GLY 1092.A N CYS 1088.A O no hydrogen 2.834 N/A THR 1097.A OG1 SER 1086.A O no hydrogen 3.353 N/A GLN 1098.A N CYS 1111.A O no hydrogen 2.865 N/A GLN 1098.A NE2 ASP 1136.A OD2 no hydrogen 3.263 N/A SER 1100.A N THR 1109.A O no hydrogen 2.606 N/A SER 1100.A OG THR 1109.A O no hydrogen 2.616 N/A VAL 1101.A N ILE 1135.A O no hydrogen 2.737 N/A ARG 1103.A N SER 1106.A O no hydrogen 2.855 N/A ARG 1103.A NE SER 1106.A OG no hydrogen 2.990 N/A SER 1106.A N ARG 1103.A O no hydrogen 2.879 N/A THR 1109.A N SER 1100.A OG no hydrogen 3.139 N/A CYS 1111.A N GLN 1098.A O no hydrogen 2.940 N/A CYS 1111.A SG THR 1109.A O no hydrogen 3.932 N/A CYS 1112.A N GLN 1145.A O no hydrogen 2.595 N/A CYS 1112.A SG THR 1096.A OG1 no hydrogen 3.218 N/A ARG 1113.A N THR 1096.A O no hydrogen 3.179 N/A ARG 1113.A NH1 GLN 1098.A OE1 no hydrogen 2.997 N/A ARG 1113.A NH1 ASP 1136.A OD2 no hydrogen 3.367 N/A ARG 1114.A NH1 GLU 1170.A OE1 no hydrogen 3.299 N/A ARG 1114.A NH1 GLU 1170.A OE2 no hydrogen 2.303 N/A CYS 1115.A N CYS 1112.A O no hydrogen 3.242 N/A SER 1116.A OG CYS 1112.A O no hydrogen 3.368 N/A SER 1116.A OG ARG 1113.A O no hydrogen 2.527 N/A SER 1116.A OG GLU 1142.A OE1 no hydrogen 2.687 N/A SER 1116.A OG GLN 1145.A OE1 no hydrogen 3.461 N/A MET 1117.A N ASP 1143.A O no hydrogen 2.799 N/A PHE 1119.A N TRP 1141.A O no hydrogen 3.219 N/A ASP 1121.A N ARG 1118.A O no hydrogen 2.834 N/A LYS 1123.A N ASP 1121.A OD1 no hydrogen 2.962 N/A LYS 1124.A N ASP 1121.A O no hydrogen 2.676 N/A LEU 1126.A N LYS 1123.A O no hydrogen 2.216 N/A THR 1127.A OG1 LYS 1123.A O no hydrogen 3.522 N/A PHE 1134.A N GLU 1142.A O no hydrogen 2.972 N/A ASP 1136.A N ILE 1140.A O no hydrogen 2.951 N/A SER 1138.A N ASP 1136.A OD1 no hydrogen 2.713 N/A SER 1138.A OG ASP 1136.A OD1 no hydrogen 2.536 N/A GLN 1139.A N ASP 1136.A O no hydrogen 2.553 N/A GLU 1142.A N PHE 1134.A O no hydrogen 2.853 N/A ASP 1143.A N MET 1117.A O no hydrogen 3.001 N/A GLY 1144.A N LYS 1132.A O no hydrogen 2.859 N/A GLN 1145.A N CYS 1115.A O no hydrogen 2.049 N/A GLY 1146.A N GLY 1144.A O no hydrogen 2.277 N/A ASN 1147.A ND2 GLU 1090.A OE2 no hydrogen 2.715 N/A LYS 1148.A NZ SER 1086.A OG no hydrogen 2.850 N/A PHE 1149.A N VAL 1087.A O no hydrogen 2.886 N/A GLY 1151.A N ALA 1085.A O no hydrogen 2.900 N/A ASN 1153.A N THR 1083.A O no hydrogen 2.901 N/A THR 1155.A N ASP 1081.A O no hydrogen 3.134 N/A THR 1155.A OG1 ASP 1081.A O no hydrogen 2.780 N/A THR 1156.A N ASP 1081.A OD2 no hydrogen 3.266 N/A THR 1156.A OG1 ASP 1081.A OD2 no hydrogen 2.855 N/A THR 1157.A N GLU 1154.A O no hydrogen 2.874 N/A THR 1157.A OG1 GLU 1154.A O no hydrogen 2.959 N/A ALA 1159.A N THR 1155.A O no hydrogen 2.980 N/A ILE 1160.A N THR 1156.A O no hydrogen 2.856 N/A ILE 1160.A N THR 1157.A O no hydrogen 2.754 N/A LEU 1164.A N ILE 1160.A O no hydrogen 2.785 N/A LYS 1165.A N PRO 1161.A O no hydrogen 2.832 N/A LEU 1167.A N VAL 1163.A O no hydrogen 2.955 N/A ASP 1168.A N LYS 1165.A O no hydrogen 3.194 N/A ALA 1173.A N GLY 1092.A O no hydrogen 2.463 N/A