Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8q3k_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A OG1 TYR 4.A O no hydrogen 3.271 N/A GLU 8.A N GLU 8.A OE1 no hydrogen 2.336 N/A THR 9.A N PRO 6.A O no hydrogen 2.999 N/A VAL 10.A N ILE 7.A O no hydrogen 3.100 N/A ASN 12.A ND2 THR 567.A O no hydrogen 2.910 N/A ASN 12.A ND2 PHE 569.A O no hydrogen 2.775 N/A GLU 13.A N GLU 13.A OE1 no hydrogen 2.715 N/A GLU 14.A N GLU 14.A OE1 no hydrogen 2.297 N/A LEU 15.A N ASN 12.A O no hydrogen 3.142 N/A THR 16.A OG1 GLU 17.A OE1 no hydrogen 2.720 N/A GLU 17.A N GLU 17.A OE1 no hydrogen 2.471 N/A MET 20.A N THR 16.A O no hydrogen 3.342 N/A LEU 21.A N ALA 18.A O no hydrogen 3.203 N/A SER 22.A N ASP 19.A O no hydrogen 2.908 N/A SER 22.A OG ASP 19.A O no hydrogen 2.618 N/A SER 22.A OG ALA 574.A O no hydrogen 3.479 N/A PHE 23.A N MET 20.A O no hydrogen 2.789 N/A SER 25.A N LEU 21.A O no hydrogen 2.914 N/A SER 25.A OG SER 22.A O no hydrogen 2.472 N/A ALA 26.A N SER 22.A O no hydrogen 2.890 N/A ALA 27.A N PHE 23.A O no hydrogen 2.906 N/A VAL 28.A N ILE 24.A O no hydrogen 2.956 N/A ASN 29.A N SER 25.A O no hydrogen 2.894 N/A SER 30.A N ALA 26.A O no hydrogen 2.901 N/A SER 30.A OG GLU 585.A OE1 no hydrogen 2.781 N/A SER 30.A OG GLU 585.A OE2 no hydrogen 2.483 N/A THR 31.A N ALA 27.A O no hydrogen 2.928 N/A THR 31.A OG1 ALA 27.A O no hydrogen 2.874 N/A THR 31.A OG1 VAL 28.A O no hydrogen 3.543 N/A THR 31.A OG1 GLY 32.A O no hydrogen 3.369 N/A GLY 32.A N VAL 28.A O no hydrogen 2.550 N/A TYR 36.A OH VAL 328.A O no hydrogen 3.373 N/A ASN 37.A ND2 VAL 126.A O no hydrogen 3.053 N/A LYS 39.A NZ THR 434.A OG1 no hydrogen 3.210 N/A SER 40.A N TYR 36.A O no hydrogen 2.844 N/A SER 40.A OG TYR 36.A O no hydrogen 2.794 N/A SER 40.A OG ASN 37.A O no hydrogen 2.547 N/A PHE 41.A N ASN 37.A O no hydrogen 2.979 N/A ASP 42.A N ILE 38.A O no hydrogen 2.851 N/A ASP 43.A N LYS 39.A O no hydrogen 2.880 N/A LEU 44.A N SER 40.A O no hydrogen 2.878 N/A MET 45.A N PHE 41.A O no hydrogen 2.946 N/A ASP 46.A N ASP 42.A O no hydrogen 2.868 N/A ASN 47.A N ASP 43.A O no hydrogen 2.921 N/A ILE 49.A N LEU 44.A O no hydrogen 2.920 N/A GLN 51.A N ASN 47.A O no hydrogen 2.749 N/A ILE 52.A N GLY 48.A O no hydrogen 2.478 N/A VAL 53.A N ILE 49.A O no hydrogen 2.920 N/A LYS 54.A N PRO 50.A O no hydrogen 2.936 N/A GLN 55.A N ILE 52.A O no hydrogen 3.003 N/A ARG 61.A NE CYS 93.A O no hydrogen 3.523 N/A ARG 61.A NH2 ASN 91.A O no hydrogen 2.767 N/A GLN 63.A NE2 ASN 65.A OD1 no hydrogen 2.639 N/A ALA 71.A N LEU 67.A O no hydrogen 3.073 N/A ARG 72.A N PRO 68.A O no hydrogen 2.980 N/A LEU 73.A N ASN 69.A O no hydrogen 2.472 N/A CYS 74.A N LYS 70.A O no hydrogen 2.748 N/A GLY 75.A N ARG 72.A O no hydrogen 3.244 N/A SER 77.A OG GLU 362.A OE1 no hydrogen 3.101 N/A TYR 78.A N ILE 118.A O no hydrogen 3.168 N/A TYR 78.A OH HIS 94.A ND1 no hydrogen 2.977 N/A SER 79.A OG ASN 358.A OD1 no hydrogen 2.840 N/A GLY 80.A N PHE 84.A O no hydrogen 2.934 N/A ARG 88.A N TYR 116.A O no hydrogen 3.226 N/A ARG 88.A NH2 GLU 112.A O no hydrogen 3.501 N/A SER 90.A N MET 87.A O no hydrogen 3.052 N/A SER 90.A OG MET 87.A O no hydrogen 2.589 N/A ASN 91.A N ASP 42.A OD1 no hydrogen 2.725 N/A ASN 91.A N ASP 42.A OD2 no hydrogen 3.446 N/A ASN 91.A ND2 ASN 91.A O no hydrogen 2.687 N/A CYS 93.A N SER 90.A O no hydrogen 3.176 N/A CYS 93.A SG TYR 78.A OH no hydrogen 2.842 N/A CYS 93.A SG THR 95.A OG1 no hydrogen 3.452 N/A THR 95.A OG1 GLU 108.A OE2 no hydrogen 3.084 N/A HIS 96.A N CYS 93.A O no hydrogen 3.358 N/A HIS 96.A ND1 HIS 94.A O no hydrogen 3.139 N/A LEU 98.A N THR 95.A O no hydrogen 2.964 N/A LYS 100.A NZ ASN 111.A OD1 no hydrogen 3.435 N/A LYS 103.A N SER 99.A O no hydrogen 2.726 N/A LYS 104.A N LYS 100.A O no hydrogen 3.053 N/A GLU 105.A N THR 101.A O no hydrogen 3.028 N/A ILE 106.A N ALA 102.A O no hydrogen 2.644 N/A GLY 107.A N LYS 103.A O no hydrogen 2.956 N/A GLU 108.A N LYS 103.A O no hydrogen 2.590 N/A ASN 111.A ND2 ASP 109.A OD1 no hydrogen 3.382 N/A GLU 112.A N ASP 109.A O no hydrogen 3.153 N/A GLY 115.A N ARG 88.A O no hydrogen 2.489 N/A TYR 116.A OH GLU 112.A OE1 no hydrogen 3.321 N/A PHE 117.A N TRP 124.A O no hydrogen 2.407 N/A GLY 122.A N ALA 119.A O no hydrogen 3.076 N/A TRP 124.A N PHE 117.A O no hydrogen 2.743 N/A TRP 124.A NE1 ALA 119.A O no hydrogen 3.007 N/A LEU 129.A N HIS 329.A O no hydrogen 3.137 N/A GLU 130.A N GLU 130.A OE1 no hydrogen 2.411 N/A ASN 131.A N ARG 327.A O no hydrogen 2.535 N/A ILE 132.A N ASN 131.A OD1 no hydrogen 3.217 N/A ARG 133.A N THR 325.A O no hydrogen 2.703 N/A ASN 135.A N ILE 157.A O no hydrogen 2.834 N/A ASN 135.A ND2 GLN 159.A O no hydrogen 3.472 N/A ASN 135.A ND2 ASN 473.A O no hydrogen 2.815 N/A THR 136.A OG1 PHE 134.A O no hydrogen 3.555 N/A HIS 138.A N GLU 155.A O no hydrogen 2.852 N/A HIS 138.A ND1 THR 136.A O no hydrogen 2.948 N/A HIS 140.A N ARG 153.A O no hydrogen 3.049 N/A ASN 149.A N GLY 147.A O no hydrogen 2.726 N/A ILE 151.A N TYR 174.A O no hydrogen 2.886 N/A ARG 153.A N HIS 140.A O no hydrogen 3.128 N/A GLY 154.A N ILE 172.A O no hydrogen 2.869 N/A GLU 155.A N HIS 138.A O no hydrogen 3.313 N/A PHE 156.A N ILE 170.A O no hydrogen 3.124 N/A SER 158.A N SER 168.A O no hydrogen 2.752 N/A GLN 159.A N ASN 135.A OD1 no hydrogen 3.126 N/A GLN 159.A NE2 GLY 161.A O no hydrogen 2.411 N/A GLU 165.A N GLY 162.A O no hydrogen 3.225 N/A SER 167.A N ASN 166.A OD1 no hydrogen 2.729 N/A SER 168.A N SER 158.A O no hydrogen 2.875 N/A SER 168.A OG ILE 281.A O no hydrogen 3.065 N/A ILE 170.A N PHE 156.A O no hydrogen 2.996 N/A ILE 171.A N GLU 183.A O no hydrogen 2.953 N/A ILE 172.A N GLY 154.A O no hydrogen 2.734 N/A ARG 173.A N THR 181.A O no hydrogen 3.005 N/A ARG 173.A NE GLU 183.A OE1 no hydrogen 3.084 N/A ARG 173.A NH2 GLU 183.A OE1 no hydrogen 3.122 N/A TYR 174.A N ILE 152.A O no hydrogen 3.370 N/A MET 175.A N ALA 179.A O no hydrogen 2.844 N/A THR 176.A N ASN 149.A O no hydrogen 3.047 N/A THR 176.A OG1 ASN 148.A O no hydrogen 3.415 N/A THR 176.A OG1 ASN 149.A O no hydrogen 2.468 N/A GLY 178.A N MET 175.A O no hydrogen 3.103 N/A ILE 182.A N ILE 194.A O no hydrogen 2.780 N/A GLU 183.A N ILE 171.A O no hydrogen 2.969 N/A SER 186.A OG ILE 184.A O no hydrogen 3.018 N/A SER 190.A OG SER 186.A O no hydrogen 2.670 N/A LEU 192.A N PHE 189.A O no hydrogen 3.359 N/A ILE 194.A N ILE 182.A O no hydrogen 3.227 N/A TRP 196.A N ILE 180.A O no hydrogen 2.966 N/A TRP 196.A NE1 SER 236.A OG no hydrogen 3.148 N/A ILE 199.A N PRO 195.A O no hydrogen 3.397 N/A PHE 200.A N TRP 196.A O no hydrogen 2.939 N/A ARG 201.A N TYR 197.A O no hydrogen 3.056 N/A MET 202.A N LEU 198.A O no hydrogen 2.852 N/A GLY 204.A N ARG 201.A O no hydrogen 3.050 N/A MET 205.A N PHE 200.A O no hydrogen 3.076 N/A SER 210.A N ASP 209.A OD1 no hydrogen 2.611 N/A SER 210.A OG ASP 209.A OD1 no hydrogen 3.348 N/A ILE 211.A N GLY 207.A O no hydrogen 3.151 N/A ILE 212.A N ASP 208.A O no hydrogen 2.980 N/A GLU 213.A N ASP 209.A O no hydrogen 2.925 N/A GLN 214.A N SER 210.A O no hydrogen 2.922 N/A VAL 216.A N ILE 212.A O no hydrogen 2.964 N/A PHE 217.A N GLU 213.A O no hydrogen 2.267 N/A LEU 219.A N ASP 218.A OD1 no hydrogen 2.978 N/A SER 223.A N SER 221.A OG no hydrogen 3.307 N/A THR 227.A N SER 223.A O no hydrogen 2.725 N/A THR 227.A OG1 SER 223.A O no hydrogen 3.392 N/A THR 227.A OG1 PRO 224.A O no hydrogen 2.729 N/A PHE 228.A N PRO 224.A O no hydrogen 3.048 N/A MET 229.A N VAL 225.A O no hydrogen 3.148 N/A ILE 230.A N THR 227.A O no hydrogen 2.714 N/A GLU 231.A N GLU 231.A OE1 no hydrogen 2.816 N/A ILE 232.A N PHE 228.A O no hydrogen 3.255 N/A LEU 233.A N MET 229.A O no hydrogen 2.928 N/A GLU 234.A N ILE 230.A O no hydrogen 2.535 N/A LYS 235.A N GLU 231.A O no hydrogen 3.159 N/A LYS 235.A NZ THR 177.A O no hydrogen 3.304 N/A ILE 237.A N GLU 234.A O no hydrogen 2.985 N/A HIS 238.A N LYS 235.A O no hydrogen 3.199 N/A ASP 241.A N GLN 248.A OE1 no hydrogen 2.940 N/A GLN 248.A N GLN 245.A O no hydrogen 3.034 N/A GLU 254.A N GLU 254.A OE1 no hydrogen 2.586 N/A ILE 256.A N ASN 252.A O no hydrogen 3.460 N/A ILE 257.A N ARG 253.A O no hydrogen 3.237 N/A GLN 258.A N GLU 254.A O no hydrogen 2.933 N/A PHE 259.A N LYS 255.A O no hydrogen 3.191 N/A SER 261.A N ILE 257.A O no hydrogen 3.262 N/A GLU 262.A N GLN 258.A O no hydrogen 3.282 N/A LYS 263.A N PHE 259.A O no hydrogen 3.241 N/A VAL 264.A N LEU 260.A O no hydrogen 2.805 N/A VAL 264.A N SER 261.A O no hydrogen 3.376 N/A TYR 269.A N ASN 265.A O no hydrogen 3.263 N/A LEU 270.A N ALA 266.A O no hydrogen 2.768 N/A ASN 271.A N VAL 267.A O no hydrogen 2.610 N/A GLU 272.A N GLN 268.A O no hydrogen 2.441 N/A ARG 273.A N TYR 269.A O no hydrogen 2.701 N/A ARG 273.A NE TYR 269.A OH no hydrogen 3.169 N/A GLN 274.A N LEU 270.A O no hydrogen 2.894 N/A LEU 275.A N ASN 271.A O no hydrogen 2.872 N/A THR 276.A OG1 GLU 272.A O no hydrogen 2.941 N/A ILE 277.A N ARG 273.A O no hydrogen 2.900 N/A LEU 278.A N GLN 274.A O no hydrogen 2.851 N/A ASP 279.A N LEU 275.A O no hydrogen 2.884 N/A LYS 280.A N THR 276.A O no hydrogen 2.934 N/A LYS 280.A NZ GLN 288.A O no hydrogen 2.493 N/A ILE 281.A N ILE 277.A O no hydrogen 2.896 N/A ILE 281.A N LEU 278.A O no hydrogen 2.991 N/A LEU 282.A N LEU 278.A O no hydrogen 2.658 N/A HIS 285.A N SER 158.A OG no hydrogen 3.287 N/A MET 286.A N LEU 283.A O no hydrogen 3.080 N/A GLY 287.A N PRO 284.A O no hydrogen 2.868 N/A THR 289.A OG1 ASP 291.A OD1 no hydrogen 2.832 N/A THR 289.A OG1 ASP 291.A OD2 no hydrogen 2.728 N/A ASP 291.A N THR 289.A OG1 no hydrogen 3.341 N/A LYS 296.A N THR 292.A O no hydrogen 3.164 N/A LYS 296.A NZ ASP 279.A OD1 no hydrogen 3.361 N/A LYS 296.A NZ GLY 287.A O no hydrogen 2.898 N/A LEU 297.A N ARG 293.A O no hydrogen 2.931 N/A ARG 298.A N VAL 294.A O no hydrogen 2.900 N/A ARG 298.A NE ASN 459.A OD1 no hydrogen 2.690 N/A ARG 298.A NH1 LEU 454.A O no hydrogen 2.760 N/A ARG 298.A NH1 VAL 457.A O no hydrogen 3.501 N/A ARG 298.A NH2 ASN 459.A OD1 no hydrogen 2.457 N/A PHE 299.A N ARG 295.A O no hydrogen 2.946 N/A LEU 300.A N LYS 296.A O no hydrogen 2.888 N/A GLY 301.A N LEU 297.A O no hydrogen 2.901 N/A LEU 302.A N ARG 298.A O no hydrogen 2.919 N/A LEU 303.A N PHE 299.A O no hydrogen 2.947 N/A ILE 304.A N LEU 300.A O no hydrogen 2.912 N/A HIS 305.A N GLY 301.A O no hydrogen 2.860 N/A LYS 306.A N LEU 302.A O no hydrogen 2.952 N/A ILE 307.A N LEU 303.A O no hydrogen 2.954 N/A LEU 308.A N ILE 304.A O no hydrogen 2.892 N/A LEU 309.A N HIS 305.A O no hydrogen 2.883 N/A VAL 310.A N LYS 306.A O no hydrogen 2.979 N/A ILE 311.A N ILE 307.A O no hydrogen 2.935 N/A MET 312.A N LEU 308.A O no hydrogen 2.926 N/A ASN 313.A N VAL 310.A O no hydrogen 3.125 N/A VAL 314.A N LEU 309.A O no hydrogen 3.097 N/A THR 318.A N ILE 139.A O no hydrogen 3.257 N/A ARG 320.A NH2 HIS 142.A ND1 no hydrogen 3.503 N/A ASP 321.A N ASP 319.A OD1 no hydrogen 3.209 N/A ARG 324.A NE GLU 602.A OE2 no hydrogen 2.949 N/A THR 325.A OG1 SER 322.A O no hydrogen 3.505 N/A LYS 326.A N TYR 323.A O no hydrogen 3.437 N/A ARG 327.A N ASN 131.A O no hydrogen 2.765 N/A ARG 327.A NE LYS 326.A O no hydrogen 2.939 N/A ARG 327.A NH2 GLU 599.A OE2 no hydrogen 2.370 N/A VAL 328.A N GLY 522.A O no hydrogen 2.704 N/A HIS 329.A N LEU 129.A O no hydrogen 2.576 N/A GLY 330.A N TYR 36.A OH no hydrogen 3.334 N/A SER 331.A N ASN 37.A OD1 no hydrogen 3.181 N/A SER 331.A OG ASN 37.A O no hydrogen 3.288 N/A SER 334.A N GLY 330.A O no hydrogen 3.443 N/A LEU 335.A N SER 331.A O no hydrogen 2.787 N/A ALA 336.A N GLY 332.A O no hydrogen 2.971 N/A LYS 337.A N VAL 333.A O no hydrogen 3.307 N/A LYS 337.A N SER 334.A O no hydrogen 3.235 N/A PHE 339.A N LEU 335.A O no hydrogen 2.923 N/A LYS 340.A N ALA 336.A O no hydrogen 3.105 N/A LYS 340.A NZ PHE 164.A O no hydrogen 3.036 N/A ILE 342.A N ALA 338.A O no hydrogen 3.073 N/A PHE 343.A N PHE 339.A O no hydrogen 2.682 N/A ASN 344.A N LYS 340.A O no hydrogen 3.174 N/A ASN 344.A ND2 LYS 340.A O no hydrogen 2.633 N/A THR 345.A N ALA 341.A O no hydrogen 2.856 N/A THR 345.A OG1 ALA 341.A O no hydrogen 2.022 N/A SER 346.A N ILE 342.A O no hydrogen 2.557 N/A VAL 347.A N PHE 343.A O no hydrogen 2.966 N/A VAL 347.A N ASN 344.A O no hydrogen 2.905 N/A ILE 348.A N ASN 344.A O no hydrogen 2.628 N/A ALA 349.A N THR 345.A O no hydrogen 3.093 N/A ILE 351.A N ILE 348.A O no hydrogen 2.832 N/A ASN 358.A N SER 355.A O no hydrogen 3.117 N/A SER 360.A OG LEU 357.A O no hydrogen 2.763 N/A MET 361.A N LEU 357.A O no hydrogen 2.893 N/A GLU 362.A N ASN 358.A O no hydrogen 2.894 N/A GLN 363.A N ARG 359.A O no hydrogen 2.943 N/A SER 364.A N SER 360.A O no hydrogen 2.876 N/A ILE 365.A N MET 361.A O no hydrogen 2.887 N/A ILE 366.A N GLU 362.A O no hydrogen 2.943 N/A SER 367.A N GLN 363.A O no hydrogen 2.889 N/A THR 372.A N ASN 368.A O no hydrogen 2.917 N/A THR 372.A OG1 ASN 368.A O no hydrogen 3.390 N/A THR 372.A OG1 LEU 369.A O no hydrogen 2.621 N/A ILE 373.A N LEU 369.A O no hydrogen 2.880 N/A SER 374.A N LEU 370.A O no hydrogen 2.894 N/A SER 374.A OG ASN 371.A O no hydrogen 3.112 N/A ALA 375.A N ASN 371.A O no hydrogen 2.914 N/A LEU 376.A N THR 372.A O no hydrogen 3.139 N/A ARG 377.A N ILE 373.A O no hydrogen 2.819 N/A ARG 377.A NE LEU 33.A O no hydrogen 2.713 N/A ARG 377.A NH1 ALA 430.A O no hydrogen 3.071 N/A ARG 377.A NH2 GLY 32.A O no hydrogen 3.122 N/A ARG 377.A NH2 LEU 33.A O no hydrogen 3.094 N/A THR 378.A N ALA 375.A O no hydrogen 3.384 N/A THR 378.A OG1 SER 374.A O no hydrogen 2.446 N/A VAL 379.A N LYS 424.A O no hydrogen 2.552 N/A ASN 380.A N LEU 128.A O no hydrogen 2.988 N/A THR 381.A OG1 GLU 130.A OE2 no hydrogen 2.651 N/A THR 384.A OG1 GLU 130.A OE2 no hydrogen 3.512 N/A THR 384.A OG1 THR 381.A OG1 no hydrogen 2.376 N/A THR 385.A N THR 381.A O no hydrogen 3.139 N/A THR 385.A OG1 HIS 382.A O no hydrogen 2.456 N/A ASN 386.A N HIS 382.A O no hydrogen 2.923 N/A ASN 386.A ND2 HIS 382.A NE2 no hydrogen 3.140 N/A ALA 387.A N ASN 383.A O no hydrogen 3.222 N/A SER 388.A N THR 385.A O no hydrogen 2.868 N/A SER 388.A OG THR 385.A O no hydrogen 2.310 N/A GLU 392.A N SER 388.A O no hydrogen 3.052 N/A MET 396.A N ARG 393.A O no hydrogen 3.399 N/A MET 397.A N ALA 394.A O no hydrogen 3.281 N/A ARG 398.A N ASP 395.A O no hydrogen 2.587 N/A SER 403.A N HIS 401.A ND1 no hydrogen 3.236 N/A TYR 404.A N HIS 401.A O no hydrogen 2.867 N/A TYR 407.A N TYR 404.A O no hydrogen 2.790 N/A TYR 407.A OH ILE 596.A O no hydrogen 2.297 N/A ILE 408.A N TYR 404.A O no hydrogen 3.058 N/A CYS 409.A N GLN 425.A O no hydrogen 2.796 N/A CYS 409.A SG ALA 411.A O no hydrogen 3.953 N/A GLN 412.A NE2 TYR 654.A O no hydrogen 3.574 N/A THR 416.A N SER 413.A O no hydrogen 3.474 N/A LYS 424.A N VAL 379.A O no hydrogen 3.257 N/A LYS 424.A NZ TYR 323.A OH no hydrogen 3.161 N/A LYS 424.A NZ TYR 404.A OH no hydrogen 3.243 N/A GLN 425.A NE2 SER 413.A OG no hydrogen 3.337 N/A LEU 426.A N ARG 377.A O no hydrogen 3.280 N/A ALA 427.A N TYR 407.A O no hydrogen 2.968 N/A ILE 428.A N LEU 634.A O no hydrogen 2.899 N/A ALA 430.A N ALA 427.A O no hydrogen 3.192 N/A ASN 431.A N THR 525.A O no hydrogen 2.824 N/A CYS 433.A SG THR 434.A O no hydrogen 3.405 N/A CYS 433.A SG HIS 503.A ND1 no hydrogen 3.252 N/A GLY 436.A N LEU 519.A O no hydrogen 2.855 N/A GLU 437.A N GLU 437.A OE1 no hydrogen 2.233 N/A LYS 442.A N VAL 438.A O no hydrogen 2.825 N/A LYS 442.A NZ GLU 475.A OE1 no hydrogen 2.338 N/A GLN 443.A N LEU 439.A O no hydrogen 2.971 N/A GLN 443.A NE2 GLN 443.A O no hydrogen 3.607 N/A ARG 444.A N SER 440.A O no hydrogen 2.930 N/A LEU 445.A N LEU 441.A O no hydrogen 2.855 N/A LEU 446.A N LYS 442.A O no hydrogen 2.927 N/A SER 447.A N GLN 443.A O no hydrogen 2.902 N/A SER 447.A OG GLN 443.A O no hydrogen 2.550 N/A SER 447.A OG ARG 444.A O no hydrogen 3.031 N/A SER 447.A OG ASP 448.A OD1 no hydrogen 3.398 N/A ASP 448.A N ARG 444.A O no hydrogen 2.941 N/A GLN 452.A N CYS 479.A O no hydrogen 2.819 N/A GLN 453.A N GLN 453.A OE1 no hydrogen 2.648 N/A GLN 453.A NE2 LEU 446.A O no hydrogen 3.041 N/A ASP 456.A N GLN 453.A O no hydrogen 2.982 N/A VAL 457.A N GLN 453.A O no hydrogen 3.272 N/A ILE 462.A N SER 458.A O no hydrogen 3.008 N/A ARG 464.A N LYS 460.A O no hydrogen 3.002 N/A ARG 464.A NH1 GLU 220.A OE2 no hydrogen 2.397 N/A LYS 465.A N ASP 461.A O no hydrogen 2.873 N/A GLY 466.A N VAL 463.A O no hydrogen 3.300 N/A LEU 467.A N ILE 462.A O no hydrogen 2.806 N/A ALA 468.A N CYS 480.A O no hydrogen 2.662 N/A VAL 470.A N GLY 478.A O no hydrogen 2.881 N/A PHE 471.A N VAL 515.A O no hydrogen 2.851 N/A ILE 472.A N GLU 475.A O no hydrogen 2.917 N/A ASN 473.A N PHE 517.A O no hydrogen 2.671 N/A GLU 475.A N ILE 472.A O no hydrogen 2.840 N/A ILE 477.A N VAL 470.A O no hydrogen 3.079 N/A CYS 479.A N GLN 452.A O no hydrogen 3.134 N/A CYS 479.A SG GLY 478.A O no hydrogen 3.092 N/A CYS 480.A N ALA 468.A O no hydrogen 2.537 N/A CYS 480.A SG ALA 468.A O no hydrogen 3.783 N/A CYS 480.A SG ASN 482.A O no hydrogen 3.359 N/A LEU 486.A N ASN 482.A O no hydrogen 3.446 N/A ALA 487.A N ALA 483.A O no hydrogen 2.927 N/A GLN 488.A N PHE 484.A O no hydrogen 2.905 N/A ARG 489.A N GLU 485.A O no hydrogen 2.910 N/A TYR 490.A N LEU 486.A O no hydrogen 2.936 N/A ARG 491.A N ALA 487.A O no hydrogen 2.900 N/A ARG 491.A NE ILE 506.A O no hydrogen 3.281 N/A ARG 491.A NH2 ILE 506.A O no hydrogen 2.752 N/A ARG 491.A NH2 ASN 603.A OD1 no hydrogen 2.521 N/A MET 492.A N GLN 488.A O no hydrogen 2.925 N/A PHE 493.A N ARG 489.A O no hydrogen 2.921 N/A ARG 494.A N TYR 490.A O no hydrogen 2.876 N/A ARG 494.A NH1 THR 504.A O no hydrogen 2.731 N/A ARG 494.A NH1 GLU 600.A OE1 no hydrogen 2.722 N/A ARG 494.A NH2 GLU 600.A OE2 no hydrogen 2.421 N/A ARG 495.A N ARG 491.A O no hydrogen 2.924 N/A GLU 496.A N MET 492.A O no hydrogen 2.895 N/A GLY 497.A N PHE 493.A O no hydrogen 2.803 N/A HIS 503.A N HIS 501.A ND1 no hydrogen 3.203 N/A THR 504.A N HIS 501.A O no hydrogen 3.145 N/A THR 504.A OG1 HIS 501.A O no hydrogen 3.145 N/A THR 505.A N TRP 518.A O no hydrogen 3.013 N/A THR 505.A OG1 THR 597.A OG1 no hydrogen 3.252 N/A TYR 507.A N GLU 516.A O no hydrogen 3.328 N/A TRP 508.A N ASN 603.A OD1 no hydrogen 2.728 N/A ASP 509.A N GLU 514.A O no hydrogen 3.020 N/A MET 511.A N ASP 509.A OD1 no hydrogen 2.842 N/A VAL 512.A N ASP 509.A OD1 no hydrogen 3.354 N/A VAL 515.A N ARG 469.A O no hydrogen 3.155 N/A GLU 516.A N TYR 507.A O no hydrogen 2.777 N/A TRP 518.A N THR 505.A O no hydrogen 3.032 N/A TRP 518.A NE1 GLU 516.A OE1 no hydrogen 2.475 N/A VAL 521.A N ASP 520.A OD1 no hydrogen 2.803 N/A GLY 522.A N CYS 433.A O no hydrogen 3.294 N/A ARG 523.A NE ASP 520.A O no hydrogen 3.217 N/A ARG 523.A NH1 HIS 503.A O no hydrogen 2.893 N/A ARG 523.A NH2 HIS 503.A O no hydrogen 3.321 N/A ARG 523.A NH2 ASP 520.A O no hydrogen 3.226 N/A THR 525.A N ASN 431.A O no hydrogen 2.964 N/A THR 525.A OG1 ASN 431.A O no hydrogen 2.630 N/A ARG 526.A NH2 ASP 628.A OD2 no hydrogen 3.263 N/A LEU 528.A N GLU 594.A O no hydrogen 2.990 N/A LEU 529.A N VAL 627.A O no hydrogen 3.218 N/A ILE 530.A N ILE 592.A O no hydrogen 2.936 N/A VAL 531.A N THR 625.A O no hydrogen 2.875 N/A ASN 534.A N ILE 564.A O no hydrogen 3.222 N/A TYR 538.A N ASN 534.A O no hydrogen 2.828 N/A ASN 539.A N ILE 535.A O no hydrogen 2.536 N/A GLN 540.A N GLU 536.A O no hydrogen 3.025 N/A ALA 541.A N LYS 537.A O no hydrogen 2.963 N/A CYS 542.A N TYR 538.A O no hydrogen 2.928 N/A TYR 543.A N ASN 539.A O no hydrogen 2.951 N/A LYS 544.A N GLN 540.A O no hydrogen 3.168 N/A ALA 545.A N ALA 541.A O no hydrogen 2.913 N/A ALA 546.A N CYS 542.A O no hydrogen 3.125 N/A GLU 547.A N TYR 543.A O no hydrogen 3.061 N/A ALA 548.A N LYS 544.A O no hydrogen 3.062 N/A ARG 549.A N ALA 545.A O no hydrogen 3.078 N/A LYS 550.A N ALA 546.A O no hydrogen 3.245 N/A LYS 551.A N GLU 547.A O no hydrogen 3.100 N/A LYS 554.A NZ LYS 551.A O no hydrogen 3.524 N/A GLU 557.A N GLU 557.A OE2 no hydrogen 2.392 N/A LYS 558.A N ASP 555.A O no hydrogen 2.910 N/A LYS 558.A NZ ASP 555.A OD2 no hydrogen 3.191 N/A HIS 559.A N TRP 556.A O no hydrogen 2.885 N/A ILE 564.A N ASN 534.A OD1 no hydrogen 3.219 N/A GLN 565.A N LYS 617.A O no hydrogen 3.069 N/A GLN 565.A NE2 HIS 616.A O no hydrogen 2.669 N/A GLN 565.A NE2 ARG 622.A O no hydrogen 2.905 N/A ASN 566.A N ASP 532.A O no hydrogen 2.995 N/A ASN 566.A ND2 ASN 12.A OD1 no hydrogen 2.978 N/A THR 567.A OG1 ILE 530.A O no hydrogen 3.431 N/A ARG 568.A NH1 GLY 5.A O no hydrogen 2.916 N/A ARG 568.A NH2 GLY 5.A O no hydrogen 2.694 N/A PHE 569.A N THR 567.A OG1 no hydrogen 3.354 N/A THR 570.A OG1 ARG 568.A O no hydrogen 3.265 N/A ALA 574.A N THR 570.A O no hydrogen 3.134 N/A LYS 575.A N SER 571.A O no hydrogen 3.190 N/A ASP 576.A N GLN 572.A O no hydrogen 3.117 N/A ILE 577.A N MET 573.A O no hydrogen 3.083 N/A LEU 578.A N ALA 574.A O no hydrogen 3.374 N/A ALA 579.A N LYS 575.A O no hydrogen 2.960 N/A GLY 580.A N ILE 577.A O no hydrogen 2.889 N/A THR 581.A N ASP 576.A O no hydrogen 2.955 N/A GLU 585.A N GLU 585.A OE1 no hydrogen 2.278 N/A ASP 586.A N THR 583.A OG1 no hydrogen 3.426 N/A LEU 587.A N THR 583.A O no hydrogen 2.923 N/A VAL 588.A N LEU 584.A O no hydrogen 2.765 N/A ALA 589.A N GLU 585.A O no hydrogen 2.802 N/A GLN 590.A N ASP 586.A O no hydrogen 3.147 N/A GLN 590.A NE2 ASP 586.A OD1 no hydrogen 3.002 N/A CYS 593.A SG LEU 528.A O no hydrogen 2.923 N/A GLU 594.A N LEU 528.A O no hydrogen 3.074 N/A ILE 596.A N ARG 526.A O no hydrogen 3.071 N/A THR 597.A OG1 THR 505.A OG1 no hydrogen 3.252 N/A THR 597.A OG1 GLU 599.A OE1 no hydrogen 2.678 N/A GLU 600.A N THR 597.A OG1 no hydrogen 3.327 N/A ALA 601.A N THR 597.A O no hydrogen 2.757 N/A GLU 602.A N GLU 599.A O no hydrogen 3.204 N/A ASN 603.A N GLU 600.A O no hydrogen 3.071 N/A ASN 603.A ND2 TRP 508.A O no hydrogen 2.913 N/A CYS 604.A N ALA 601.A O no hydrogen 3.050 N/A CYS 604.A SG GLU 600.A O no hydrogen 3.288 N/A CYS 604.A SG HIS 626.A NE2 no hydrogen 3.341 N/A LEU 605.A N THR 625.A OG1 no hydrogen 2.546 N/A ALA 607.A N HIS 626.A O no hydrogen 2.908 N/A LEU 613.A N SER 609.A O no hydrogen 3.141 N/A ARG 614.A N ILE 610.A O no hydrogen 2.972 N/A ARG 614.A NH1 LEU 15.A O no hydrogen 3.107 N/A ARG 614.A NH2 LEU 15.A O no hydrogen 3.126 N/A LYS 615.A N ILE 611.A O no hydrogen 2.846 N/A HIS 616.A N GLU 612.A O no hydrogen 3.096 N/A LYS 617.A N ARG 614.A O no hydrogen 3.024 N/A HIS 618.A ND1 PHE 563.A O no hydrogen 2.984 N/A ASP 619.A N HIS 616.A O no hydrogen 3.355 N/A THR 621.A N ASP 619.A OD1 no hydrogen 2.375 N/A ARG 622.A N ASP 619.A OD1 no hydrogen 3.235 N/A PHE 624.A N GLN 565.A OE1 no hydrogen 2.783 N/A THR 625.A N LEU 605.A O no hydrogen 2.598 N/A THR 625.A OG1 LEU 605.A O no hydrogen 2.596 N/A HIS 626.A N LEU 605.A O no hydrogen 3.356 N/A VAL 627.A N LEU 529.A O no hydrogen 2.796 N/A ASP 628.A N ALA 607.A O no hydrogen 3.283 N/A GLN 631.A NE2 ALA 840.A O no hydrogen 2.370 N/A ALA 632.A N VAL 629.A O no hydrogen 2.837 N/A ILE 633.A N PRO 630.A O no hydrogen 3.504 N/A LEU 634.A N GLN 631.A O no hydrogen 3.350 N/A LEU 639.A N GLY 635.A O no hydrogen 2.654 N/A VAL 640.A N LEU 636.A O no hydrogen 2.922 N/A SER 641.A N ALA 638.A O no hydrogen 3.298 N/A TYR 643.A N GLY 838.A O no hydrogen 2.882 N/A CYS 646.A N TYR 643.A O no hydrogen 3.014 N/A THR 647.A N ALA 644.A O no hydrogen 2.769 N/A THR 647.A OG1 ALA 644.A O no hydrogen 2.892 N/A ARG 651.A N GLN 648.A OE1 no hydrogen 2.778 N/A THR 656.A OG1 GLU 655.A O no hydrogen 2.255 N/A ASN 659.A N TYR 719.A O no hydrogen 2.858 N/A PHE 662.A N THR 717.A O no hydrogen 3.383 N/A PHE 664.A N ALA 715.A O no hydrogen 3.154 N/A ASN 666.A ND2 GLN 663.A O no hydrogen 3.402 N/A GLU 667.A N GLY 683.A O no hydrogen 3.362 N/A LEU 670.A N ASN 685.A OD1 no hydrogen 3.220 N/A LYS 672.A N THR 836.A O no hydrogen 3.096 N/A LYS 672.A NZ ASN 677.A OD1 no hydrogen 2.735 N/A THR 673.A OG1 LEU 639.A O no hydrogen 2.701 N/A ALA 675.A N THR 673.A OG1 no hydrogen 3.138 N/A HIS 676.A N THR 673.A O no hydrogen 3.306 N/A ASN 677.A N ILE 674.A O no hydrogen 3.053 N/A TYR 678.A N ALA 675.A O no hydrogen 3.156 N/A VAL 679.A N ALA 675.A O no hydrogen 3.294 N/A LEU 684.A N HIS 886.A O no hydrogen 2.725 N/A ASN 685.A ND2 MET 668.A O no hydrogen 2.835 N/A THR 686.A N THR 884.A O no hydrogen 3.357 N/A THR 686.A OG1 THR 884.A O no hydrogen 3.182 N/A VAL 688.A N GLY 882.A O no hydrogen 2.924 N/A ALA 689.A N LEU 804.A O no hydrogen 2.995 N/A TYR 690.A N PHE 880.A O no hydrogen 3.046 N/A TYR 690.A OH THR 823.A OG1 no hydrogen 3.312 N/A TYR 690.A OH THR 884.A OG1 no hydrogen 3.389 N/A MET 691.A N VAL 806.A O no hydrogen 3.248 N/A TYR 693.A OH ASP 792.A O no hydrogen 2.652 N/A TYR 693.A OH ASN 868.A OD1 no hydrogen 2.757 N/A ASN 697.A ND2 MET 691.A O no hydrogen 3.114 N/A ASN 697.A ND2 ILE 805.A O no hydrogen 3.220 N/A GLN 698.A NE2 GLY 695.A O no hydrogen 3.385 N/A SER 701.A N GLN 698.A O no hydrogen 3.134 N/A SER 701.A OG GLN 698.A O no hydrogen 3.005 N/A VAL 702.A N ILE 783.A O no hydrogen 2.959 N/A VAL 704.A N LEU 786.A O no hydrogen 2.816 N/A GLN 706.A N LEU 788.A O no hydrogen 2.496 N/A GLN 706.A NE2 GLN 706.A O no hydrogen 3.189 N/A GLN 706.A NE2 ASP 710.A OD1 no hydrogen 2.543 N/A PHE 708.A N SER 705.A OG no hydrogen 3.248 N/A ILE 709.A N SER 705.A O no hydrogen 3.200 N/A ASP 710.A N GLN 706.A O no hydrogen 2.890 N/A ARG 711.A N SER 707.A O no hydrogen 2.907 N/A GLY 712.A N ILE 709.A O no hydrogen 3.197 N/A GLY 713.A N PHE 708.A O no hydrogen 3.123 N/A ALA 715.A N GLY 712.A O no hydrogen 3.194 N/A GLY 716.A N ARG 766.A O no hydrogen 2.993 N/A THR 717.A N PHE 662.A O no hydrogen 3.137 N/A PHE 718.A N TYR 764.A O no hydrogen 2.771 N/A ARG 720.A N LEU 762.A O no hydrogen 2.693 N/A ARG 720.A NH2 TYR 764.A OH no hydrogen 2.910 N/A GLU 722.A N MET 760.A O no hydrogen 3.107 N/A LYS 723.A N LEU 759.A O no hydrogen 3.228 N/A LYS 723.A NZ GLY 121.A O no hydrogen 3.070 N/A GLY 730.A N VAL 754.A O no hydrogen 2.432 N/A THR 731.A OG1 PRO 728.A O no hydrogen 2.618 N/A VAL 733.A N ALA 752.A O no hydrogen 2.998 N/A LYS 734.A NZ ASP 737.A OD1 no hydrogen 2.953 N/A LYS 734.A NZ ASP 737.A OD2 no hydrogen 3.255 N/A LYS 735.A NZ GLY 747.A O no hydrogen 3.185 N/A GLY 736.A N TYR 746.A O no hydrogen 2.448 N/A ILE 739.A N VAL 744.A O no hydrogen 2.924 N/A TYR 746.A OH GLU 750.A O no hydrogen 2.471 N/A TYR 746.A OH TYR 764.A OH no hydrogen 3.131 N/A ALA 752.A N VAL 733.A O no hydrogen 3.260 N/A VAL 754.A N THR 731.A O no hydrogen 3.097 N/A ASP 755.A N ARG 761.A O no hydrogen 2.423 N/A ALA 756.A N ARG 761.A O no hydrogen 3.447 N/A ARG 761.A N ALA 756.A O no hydrogen 2.937 N/A LEU 762.A N ARG 720.A O no hydrogen 2.768 N/A ARG 763.A N VAL 753.A O no hydrogen 3.113 N/A TYR 764.A N PHE 718.A O no hydrogen 2.649 N/A TYR 764.A OH TYR 746.A OH no hydrogen 3.131 N/A ARG 766.A N GLY 716.A O no hydrogen 2.976 N/A ARG 766.A NH1 ASP 895.A OD1 no hydrogen 3.104 N/A ARG 766.A NH2 ASP 895.A OD1 no hydrogen 2.881 N/A ASN 769.A N ASP 772.A OD2 no hydrogen 2.977 N/A GLY 771.A N ALA 784.A O no hydrogen 2.662 N/A ASP 772.A N ASN 769.A O no hydrogen 2.800 N/A MET 774.A N GLY 782.A O no hydrogen 2.666 N/A SER 775.A N GLN 887.A O no hydrogen 2.983 N/A SER 775.A OG SER 776.A O no hydrogen 3.501 N/A SER 776.A OG TYR 885.A O no hydrogen 3.485 N/A ARG 777.A NH1 VAL 671.A O no hydrogen 2.776 N/A ARG 777.A NH1 HIS 676.A NE2 no hydrogen 3.485 N/A ARG 777.A NH2 VAL 671.A O no hydrogen 2.737 N/A ARG 777.A NH2 GLU 822.A OE2 no hydrogen 2.401 N/A SER 778.A OG THR 816.A OG1 no hydrogen 2.473 N/A ASN 780.A ND2 SER 778.A O no hydrogen 3.041 N/A GLY 782.A N MET 774.A O no hydrogen 2.560 N/A ILE 783.A N ASP 700.A O no hydrogen 3.312 N/A ALA 784.A N ASP 772.A O no hydrogen 2.801 N/A ALA 785.A N VAL 702.A O no hydrogen 2.800 N/A LEU 788.A N VAL 704.A O no hydrogen 3.253 N/A THR 790.A OG1 GLN 801.A OE1 no hydrogen 3.428 N/A ASP 792.A N PRO 789.A O no hydrogen 2.893 N/A MET 793.A N PRO 789.A O no hydrogen 3.282 N/A PHE 795.A N PHE 867.A O no hydrogen 3.285 N/A THR 796.A N LEU 800.A O no hydrogen 2.703 N/A THR 796.A OG1 LEU 800.A O no hydrogen 3.383 N/A GLU 797.A N LYS 865.A O no hydrogen 2.857 N/A ASP 798.A N THR 796.A OG1 no hydrogen 3.296 N/A GLY 799.A N THR 796.A O no hydrogen 2.801 N/A LEU 800.A N THR 796.A OG1 no hydrogen 3.028 N/A GLN 801.A NE2 THR 790.A OG1 no hydrogen 3.124 N/A ASP 803.A N ILE 687.A O no hydrogen 2.593 N/A LEU 804.A N ILE 687.A O no hydrogen 3.233 N/A ILE 805.A N ILE 703.A O no hydrogen 3.071 N/A VAL 806.A N ALA 689.A O no hydrogen 2.963 N/A ASN 807.A ND2 ASN 697.A OD1 no hydrogen 3.183 N/A HIS 809.A N ASN 807.A OD1 no hydrogen 3.358 N/A SER 810.A N ASN 807.A O no hydrogen 3.174 N/A SER 810.A OG ASN 807.A O no hydrogen 3.385 N/A HIS 811.A N PRO 808.A O no hydrogen 3.297 N/A HIS 811.A NE2 ASN 817.A OD1 no hydrogen 2.749 N/A ARG 814.A NE SER 810.A O no hydrogen 3.398 N/A MET 815.A N HIS 811.A O no hydrogen 2.441 N/A ASN 817.A ND2 CYS 646.A O no hydrogen 2.756 N/A GLN 819.A N THR 816.A O no hydrogen 2.862 N/A ILE 821.A N ASN 817.A O no hydrogen 2.927 N/A GLU 822.A N GLY 818.A O no hydrogen 2.831 N/A THR 823.A N GLN 819.A O no hydrogen 2.930 N/A THR 823.A OG1 TYR 690.A OH no hydrogen 3.312 N/A THR 823.A OG1 GLN 819.A O no hydrogen 2.773 N/A THR 823.A OG1 THR 884.A OG1 no hydrogen 2.834 N/A THR 824.A N MET 820.A O no hydrogen 2.937 N/A THR 824.A OG1 MET 820.A O no hydrogen 2.715 N/A VAL 825.A N ILE 821.A O no hydrogen 2.899 N/A GLY 826.A N GLU 822.A O no hydrogen 2.821 N/A LEU 827.A N THR 823.A O no hydrogen 2.988 N/A ASN 829.A N VAL 825.A O no hydrogen 2.910 N/A ASN 829.A ND2 LEU 670.A O no hydrogen 3.199 N/A ASN 829.A ND2 THR 836.A OG1 no hydrogen 2.701 N/A ALA 830.A N GLY 826.A O no hydrogen 2.837 N/A LEU 831.A N LEU 827.A O no hydrogen 3.003 N/A GLN 832.A N ALA 828.A O no hydrogen 2.869 N/A GLN 832.A NE2 GLU 856.A OE1 no hydrogen 2.390 N/A GLY 833.A N ALA 830.A O no hydrogen 3.149 N/A VAL 834.A N ASN 829.A O no hydrogen 2.895 N/A THR 836.A N LEU 670.A O no hydrogen 3.349 N/A GLY 838.A N LYS 672.A O no hydrogen 2.765 N/A THR 839.A N ASP 837.A OD1 no hydrogen 3.053 N/A THR 839.A OG1 ASP 837.A OD1 no hydrogen 2.411 N/A THR 839.A OG1 ASP 837.A OD2 no hydrogen 3.063 N/A PHE 841.A N ASN 645.A OD1 no hydrogen 2.746 N/A LEU 842.A N THR 839.A O no hydrogen 3.455 N/A LEU 849.A N ASN 845.A O no hydrogen 3.137 N/A SER 850.A N VAL 846.A O no hydrogen 2.920 N/A SER 850.A OG VAL 846.A O no hydrogen 3.016 N/A GLU 851.A N GLN 847.A O no hydrogen 2.905 N/A ARG 852.A N LEU 848.A O no hydrogen 2.857 N/A ARG 852.A NH1 ASN 829.A OD1 no hydrogen 3.060 N/A ARG 852.A NH2 ASN 829.A OD1 no hydrogen 2.670 N/A ARG 852.A NH2 GLN 832.A OE1 no hydrogen 3.175 N/A LEU 853.A N LEU 849.A O no hydrogen 2.941 N/A ALA 854.A N SER 850.A O no hydrogen 2.917 N/A GLN 855.A N GLU 851.A O no hydrogen 2.890 N/A GLU 856.A N ARG 852.A O no hydrogen 2.934 N/A GLY 857.A N LEU 853.A O no hydrogen 3.336 N/A GLY 857.A N ALA 854.A O no hydrogen 3.271 N/A GLY 862.A N ARG 859.A O no hydrogen 3.172 N/A CYS 863.A N ASN 861.A OD1 no hydrogen 3.080 N/A GLN 864.A N ILE 879.A O no hydrogen 3.012 N/A PHE 867.A N PHE 795.A O no hydrogen 2.710 N/A ASN 868.A N GLU 873.A O no hydrogen 2.597 N/A GLY 872.A N ASN 868.A O no hydrogen 2.501 N/A PHE 875.A N MET 866.A O no hydrogen 2.918 N/A ILE 879.A N GLN 864.A O no hydrogen 2.867 N/A GLY 882.A N VAL 688.A O no hydrogen 3.209 N/A THR 884.A N THR 686.A O no hydrogen 3.220 N/A THR 884.A OG1 TYR 690.A OH no hydrogen 3.389 N/A THR 884.A OG1 THR 823.A OG1 no hydrogen 2.834 N/A THR 884.A OG1 PRO 883.A O no hydrogen 2.619 N/A TYR 885.A OH GLU 667.A O no hydrogen 2.906 N/A HIS 886.A N LEU 684.A O no hydrogen 2.941 N/A HIS 886.A ND1 THR 884.A O no hydrogen 2.941 N/A GLN 887.A N SER 775.A O no hydrogen 3.200 N/A ARG 888.A NH1 ASN 767.A O no hydrogen 3.477 N/A ARG 888.A NH2 ASN 767.A O no hydrogen 3.352 N/A LEU 889.A N LYS 773.A O no hydrogen 2.829 N/A VAL 893.A N ASP 772.A OD1 no hydrogen 3.474 N/A ASP 895.A N PHE 892.A O no hydrogen 3.260 N/A ASP 896.A N VAL 893.A O no hydrogen 3.234 N/A ARG 897.A N VAL 893.A O no hydrogen 3.252 N/A TYR 898.A OH GLY 921.A O no hydrogen 2.538 N/A SER 902.A OG ALA 901.A O no hydrogen 2.916 N/A ASP 907.A N GLN 912.A O no hydrogen 2.797 N/A LEU 909.A N ASP 907.A OD1 no hydrogen 3.148 N/A THR 910.A OG1 ASP 907.A OD2 no hydrogen 3.078 N/A GLY 911.A N ASP 907.A O no hydrogen 2.657 N/A LEU 914.A N PRO 905.A O no hydrogen 3.203 N/A GLY 916.A N GLY 922.A O no hydrogen 3.077 N/A LYS 917.A NZ ASP 895.A O no hydrogen 3.245 N/A LYS 917.A NZ ARG 897.A O no hydrogen 2.860 N/A SER 919.A OG ASP 915.A O no hydrogen 3.508 N/A HIS 920.A N LYS 917.A O no hydrogen 3.059 N/A GLY 921.A N GLY 916.A O no hydrogen 2.921 N/A GLY 922.A N LEU 914.A O no hydrogen 3.067 N/A HIS 930.A N GLY 926.A O no hydrogen 3.330 N/A HIS 930.A ND1 GLY 926.A O no hydrogen 3.126 N/A HIS 930.A NE2 SER 946.A OG no hydrogen 2.956 N/A TRP 931.A N GLU 927.A O no hydrogen 2.868 N/A VAL 932.A N MET 928.A O no hydrogen 2.937 N/A LEU 933.A N GLU 929.A O no hydrogen 2.891 N/A THR 934.A N HIS 930.A O no hydrogen 2.871 N/A THR 934.A OG1 HIS 930.A O no hydrogen 2.704 N/A THR 934.A OG1 TRP 931.A O no hydrogen 2.659 N/A ALA 935.A N TRP 931.A O no hydrogen 2.885 N/A GLN 936.A N VAL 932.A O no hydrogen 2.914 N/A GLY 937.A N THR 934.A O no hydrogen 2.892 N/A ALA 938.A N LEU 933.A O no hydrogen 2.961 N/A MET 939.A N GLY 937.A O no hydrogen 3.004 N/A ILE 942.A N ALA 938.A O no hydrogen 3.229 N/A ILE 943.A N MET 939.A O no hydrogen 2.862 N/A GLU 944.A N GLN 940.A O no hydrogen 2.928 N/A LYS 945.A N THR 941.A O no hydrogen 2.939 N/A LYS 945.A NZ ASP 949.A OD2 no hydrogen 2.961 N/A SER 946.A N ILE 942.A O no hydrogen 2.872 N/A SER 946.A OG HIS 930.A NE2 no hydrogen 2.956 N/A HIS 947.A N ILE 943.A O no hydrogen 2.885 N/A HIS 947.A N GLU 944.A O no hydrogen 3.385 N/A ASP 948.A N GLU 944.A O no hydrogen 2.897 N/A ASP 949.A N GLU 944.A O no hydrogen 3.059 N/A SER 950.A N HIS 947.A O no hydrogen 3.423 N/A SER 950.A OG GLN 912.A OE1 no hydrogen 3.303 N/A CYS 953.A N SER 990.A O no hydrogen 2.954 N/A SER 955.A N VAL 988.A O no hydrogen 2.928 N/A SER 955.A OG VAL 988.A O no hydrogen 3.405 N/A ILE 957.A N GLY 986.A O no hydrogen 3.117 N/A CYS 958.A N GLU 963.A O no hydrogen 2.838 N/A ARG 959.A N ASP 984.A O no hydrogen 2.561 N/A ARG 959.A NH2 SER 1013.A O no hydrogen 2.838 N/A GLY 962.A N CYS 958.A O no hydrogen 2.576 N/A ALA 965.A N TYR 956.A O no hydrogen 2.948 N/A ILE 966.A N LYS 975.A O no hydrogen 2.826 N/A ASN 968.A N ILE 973.A O no hydrogen 3.075 N/A SER 970.A OG ASN 968.A OD1 no hydrogen 2.917 N/A ILE 973.A N ASN 968.A O no hydrogen 3.058 N/A LYS 975.A N ILE 966.A O no hydrogen 3.029 N/A ILE 985.A N TYR 974.A OH no hydrogen 2.841 N/A GLY 986.A N ILE 957.A O no hydrogen 3.113 N/A VAL 988.A N SER 955.A O no hydrogen 2.626 N/A SER 990.A N CYS 953.A O no hydrogen 2.949 N/A SER 990.A OG ARG 991.A O no hydrogen 3.535 N/A ARG 991.A N SER 990.A OG no hydrogen 2.627 N/A ARG 991.A NE ASP 951.A OD1 no hydrogen 3.039 N/A ARG 991.A NH2 GLN 912.A OE1 no hydrogen 2.849 N/A ARG 992.A N ASP 951.A O no hydrogen 2.910 N/A SER 993.A N ASP 951.A OD2 no hydrogen 3.163 N/A SER 993.A OG ASP 951.A OD2 no hydrogen 2.251 N/A ILE 995.A N ARG 991.A O no hydrogen 2.921 N/A VAL 996.A N ARG 992.A O no hydrogen 2.897 N/A PHE 997.A N SER 993.A O no hydrogen 2.881 N/A GLN 998.A N SER 994.A O no hydrogen 2.916 N/A HIS 999.A N ILE 995.A O no hydrogen 2.882 N/A GLU 1000.A N VAL 996.A O no hydrogen 2.865 N/A MET 1001.A N PHE 997.A O no hydrogen 2.933 N/A ARG 1002.A N GLN 998.A O no hydrogen 2.903 N/A ARG 1002.A NH1 HIS 999.A ND1 no hydrogen 3.353 N/A ALA 1003.A N HIS 999.A O no hydrogen 2.873 N/A ALA 1004.A N GLU 1000.A O no hydrogen 3.331 N/A ALA 1004.A N MET 1001.A O no hydrogen 3.128 N/A ASN 1005.A N ARG 1002.A O no hydrogen 2.811 N/A VAL 1006.A N MET 1001.A O no hydrogen 3.302 N/A ASN 1007.A ND2 GLU 963.A OE2 no hydrogen 3.502 N/A THR 1009.A OG1 ASN 1007.A OD1 no hydrogen 3.529 N/A SER 1010.A N GLY 962.A O no hydrogen 3.000 N/A ARG 1015.A NH1 ASP 984.A OD2 no hydrogen 3.155 N/A ARG 1015.A NH2 ASP 984.A OD1 no hydrogen 3.110 N/A ARG 1015.A NH2 ASP 984.A OD2 no hydrogen 3.075 N/A