==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CHAPERONE/PEPTIDE BINDING PROTEIN 03-MAY-12 4EZR . COMPND 2 MOLECULE: CHAPERONE PROTEIN DNAK; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR M.ZAHN,N.STRAETER . 226 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12586.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 165 73.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 50 22.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 18 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 78 34.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 0 0 0 1 0 0 1 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 2 1 1 0 1 1 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 389 A V 0 0 162 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 141.9 66.0 121.7 46.4 2 390 A L + 0 0 180 1,-0.1 2,-0.3 0, 0.0 0, 0.0 0.494 360.0 39.6 -96.0 -11.4 65.0 123.9 43.5 3 391 A L - 0 0 155 2,-0.0 2,-0.4 0, 0.0 -1,-0.1 -0.978 62.3-162.8-136.1 154.3 65.1 120.9 41.1 4 392 A L - 0 0 113 -2,-0.3 2,-0.8 -3,-0.1 0, 0.0 -0.995 20.8-134.3-134.8 124.0 64.0 117.3 41.3 5 393 A D + 0 0 120 -2,-0.4 25,-2.0 25,-0.3 2,-0.3 -0.729 41.4 165.2 -76.4 109.5 65.2 114.7 38.9 6 394 A V B -A 29 0A 58 -2,-0.8 23,-0.2 23,-0.2 20,-0.1 -0.921 43.5-101.2-127.0 157.3 62.1 112.8 37.9 7 395 A T - 0 0 10 21,-2.2 20,-2.8 -2,-0.3 21,-0.2 -0.579 23.6-156.2 -77.6 127.0 61.1 110.3 35.1 8 396 A P S S+ 0 0 54 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.770 76.4 22.6 -76.2 -18.5 59.2 112.2 32.5 9 397 A L S S- 0 0 1 16,-0.1 19,-0.1 19,-0.1 47,-0.1 -0.967 90.7 -91.1-143.5 155.6 57.5 108.9 31.3 10 398 A S - 0 0 8 -2,-0.3 45,-2.8 16,-0.1 2,-0.4 -0.313 35.7-151.7 -66.0 152.8 56.7 105.5 32.6 11 399 A L E +BC 24 54B 11 13,-2.2 12,-3.1 43,-0.2 13,-3.0 -0.989 35.0 116.2-126.4 132.9 59.2 102.7 32.1 12 400 A G E -BC 22 53B 0 41,-2.4 41,-3.6 -2,-0.4 2,-0.3 -0.867 49.4 -83.5-164.7-158.1 58.3 99.0 31.8 13 401 A I E -BC 21 52B 0 8,-2.1 8,-3.3 -2,-0.3 2,-0.4 -0.894 34.8-104.7-128.8 155.4 58.2 95.9 29.7 14 402 A E E -B 20 0B 31 37,-2.2 37,-0.4 -2,-0.3 6,-0.2 -0.678 41.6-170.6 -75.5 126.0 56.0 94.3 27.2 15 403 A T E >> -B 19 0B 5 4,-3.0 3,-1.3 -2,-0.4 4,-1.3 -0.702 41.5 -50.4-111.6 174.4 54.0 91.4 28.7 16 404 A M T 34 S+ 0 0 32 208,-1.9 -1,-0.1 1,-0.3 210,-0.1 -0.138 125.7 30.5 -47.9 128.3 51.8 88.7 27.1 17 405 A G T 34 S- 0 0 33 1,-0.1 -1,-0.3 -3,-0.1 43,-0.1 0.392 125.3 -81.4 99.9 2.6 49.2 90.2 24.7 18 406 A G T <4 S+ 0 0 17 -3,-1.3 42,-3.0 1,-0.3 43,-0.4 0.842 86.4 141.1 74.3 32.6 51.4 93.1 23.6 19 407 A V E < -BD 15 59B 16 -4,-1.3 -4,-3.0 40,-0.2 2,-0.5 -0.822 52.7-120.2-105.3 146.3 50.6 95.3 26.6 20 408 A M E -B 14 0B 12 38,-2.5 2,-0.6 -2,-0.3 -6,-0.2 -0.739 22.4-161.5 -80.0 131.4 53.1 97.6 28.5 21 409 A T E -B 13 0B 10 -8,-3.3 -8,-2.1 -2,-0.5 2,-0.3 -0.962 19.6-129.7-117.2 125.9 53.4 96.7 32.2 22 410 A T E +B 12 0B 56 -2,-0.6 -10,-0.3 -10,-0.2 3,-0.2 -0.551 32.1 170.4 -86.4 137.1 55.0 99.5 34.2 23 411 A L E S+ 0 0 5 -12,-3.1 2,-0.5 1,-0.3 -11,-0.2 0.717 79.3 29.9-105.0 -38.5 57.9 99.0 36.5 24 412 A I E S-B 11 0B 0 -13,-3.0 -13,-2.2 10,-0.0 -1,-0.3 -0.967 87.3-132.8-124.1 114.8 58.7 102.6 37.3 25 413 A A > - 0 0 51 -2,-0.5 3,-0.9 -15,-0.2 -18,-0.2 -0.295 32.3 -90.7 -64.2 146.0 55.7 105.1 37.2 26 414 A K T 3 S+ 0 0 63 1,-0.2 -1,-0.1 -18,-0.1 -16,-0.1 -0.281 112.7 28.0 -44.1 138.1 55.9 108.4 35.4 27 415 A N T 3 S+ 0 0 95 -20,-2.8 2,-0.3 1,-0.3 -1,-0.2 0.729 81.7 151.5 71.8 29.7 57.2 111.2 37.7 28 416 A T < - 0 0 29 -3,-0.9 -21,-2.2 -21,-0.2 2,-0.3 -0.721 46.7-122.8 -89.3 137.5 59.2 108.9 40.0 29 417 A T B -A 6 0A 76 -2,-0.3 -23,-0.2 -23,-0.2 -1,-0.0 -0.624 42.4-100.9 -77.9 138.2 62.2 110.7 41.6 30 418 A I S S+ 0 0 29 -25,-2.0 -25,-0.3 -2,-0.3 2,-0.1 -0.774 93.6 62.7-102.8 157.1 65.5 109.0 40.9 31 419 A P S S+ 0 0 91 0, 0.0 2,-0.3 0, 0.0 60,-0.2 0.418 79.1 149.3 -72.7 150.9 67.6 107.2 42.0 32 420 A T E -F 90 0C 26 58,-1.9 58,-2.7 -2,-0.1 2,-0.3 -0.972 32.0-164.4-152.4 160.3 65.1 104.3 42.2 33 421 A K E +F 89 0C 137 -2,-0.3 2,-0.3 56,-0.2 56,-0.2 -0.930 14.6 168.6-153.5 118.2 64.9 100.5 41.9 34 422 A H E -F 88 0C 74 54,-2.4 54,-3.4 -2,-0.3 2,-0.3 -0.979 8.0-171.8-132.5 149.8 61.7 98.4 41.5 35 423 A S E -F 87 0C 61 -2,-0.3 2,-0.3 52,-0.3 52,-0.2 -0.931 6.6-177.4-136.5 155.8 61.2 94.8 40.7 36 424 A Q E -F 86 0C 54 50,-1.9 50,-3.1 -2,-0.3 2,-0.5 -0.975 25.4-123.5-146.7 156.9 58.4 92.4 39.8 37 425 A V E +F 85 0C 58 -2,-0.3 190,-0.5 48,-0.2 48,-0.3 -0.824 30.0 178.5-106.7 129.9 58.3 88.7 39.2 38 426 A F E -FG 84 226C 0 46,-3.2 46,-3.0 -2,-0.5 2,-0.2 -0.680 8.7-154.4-117.3 174.2 56.9 87.4 35.9 39 427 A S E - G 0 225C 1 186,-2.5 186,-2.7 -2,-0.2 2,-0.2 -0.746 27.8 -76.6-139.2-167.9 56.5 83.9 34.4 40 428 A T - 0 0 1 -2,-0.2 40,-1.4 38,-0.2 8,-0.1 -0.592 21.2-148.6 -97.3 150.8 56.2 81.9 31.1 41 429 A A S S+ 0 0 10 182,-0.3 2,-0.4 -2,-0.2 38,-0.2 0.600 78.2 50.7 -88.6 -17.4 53.1 81.8 28.9 42 430 A E S > S- 0 0 93 36,-0.1 3,-1.6 35,-0.0 35,-0.2 -0.958 88.5-101.1-126.2 148.6 53.7 78.3 27.5 43 431 A D T 3 S+ 0 0 80 -2,-0.4 -2,-0.1 1,-0.3 37,-0.0 -0.274 109.0 7.9 -54.8 134.9 54.5 74.8 28.8 44 432 A N T 3 S+ 0 0 104 33,-3.1 -1,-0.3 1,-0.2 2,-0.2 0.698 83.8 169.5 65.0 16.3 58.2 74.0 28.5 45 433 A Q < - 0 0 12 -3,-1.6 -1,-0.2 32,-0.5 32,-0.1 -0.464 16.2-169.2 -60.2 131.5 59.1 77.6 27.4 46 434 A S + 0 0 66 1,-0.2 28,-2.1 -2,-0.2 27,-0.4 0.586 61.5 20.3-103.1 -10.8 62.9 77.8 27.4 47 435 A A - 0 0 9 25,-0.2 2,-0.3 26,-0.2 25,-0.3 -0.995 57.8-153.4-154.2 148.9 63.4 81.6 27.0 48 436 A V E - E 0 71B 0 23,-2.6 23,-2.9 -2,-0.3 2,-0.6 -0.956 17.4-132.1-120.8 156.7 61.7 84.9 27.5 49 437 A T E - E 0 70B 0 173,-2.3 2,-0.8 -2,-0.3 21,-0.2 -0.920 11.7-152.7-105.2 123.1 62.2 88.2 25.7 50 438 A I E - E 0 69B 0 19,-3.1 19,-1.9 -2,-0.6 2,-0.7 -0.875 13.8-172.3 -94.0 106.9 62.4 91.3 27.9 51 439 A H E - E 0 68B 25 -2,-0.8 -37,-2.2 -37,-0.4 2,-0.3 -0.921 12.9-147.8-107.5 107.9 61.3 94.3 25.8 52 440 A V E -CE 13 67B 0 15,-1.9 14,-3.3 -2,-0.7 15,-1.0 -0.595 18.7-170.3 -83.3 128.2 61.9 97.6 27.6 53 441 A L E -CE 12 65B 1 -41,-3.6 -41,-2.4 -2,-0.3 2,-0.5 -0.923 17.4-159.3-125.6 146.1 59.4 100.3 26.9 54 442 A Q E +CE 11 64B 18 10,-3.1 10,-3.1 -2,-0.4 2,-0.3 -0.983 51.1 55.4-120.5 126.9 59.1 104.0 27.7 55 443 A G S S- 0 0 0 -45,-2.8 8,-0.1 -2,-0.5 -29,-0.1 -0.868 76.3 -92.0 148.3-171.6 55.7 105.8 27.6 56 444 A E S S+ 0 0 43 -2,-0.3 2,-0.2 6,-0.2 -1,-0.1 0.143 77.2 109.3-120.0 7.0 52.1 106.0 28.9 57 445 A R - 0 0 26 2,-0.2 -37,-0.2 1,-0.1 6,-0.1 -0.594 62.9-139.1 -88.8 155.3 50.1 103.9 26.4 58 446 A K S S+ 0 0 66 -2,-0.2 -38,-2.5 -39,-0.1 2,-0.4 0.872 85.5 80.7 -84.7 -34.4 48.7 100.5 27.2 59 447 A R B > S-D 19 0B 99 -40,-0.2 3,-1.4 1,-0.2 4,-0.3 -0.551 74.2-147.8 -73.3 124.6 49.6 99.1 23.8 60 448 A A G > S+ 0 0 2 -42,-3.0 3,-2.3 -2,-0.4 -1,-0.2 0.938 97.5 58.3 -59.5 -46.1 53.3 98.1 23.8 61 449 A A G 3 S+ 0 0 91 -43,-0.4 -1,-0.3 1,-0.3 4,-0.1 0.646 101.2 58.2 -56.7 -18.7 53.6 99.0 20.1 62 450 A D G < S+ 0 0 65 -3,-1.4 -1,-0.3 2,-0.1 2,-0.2 0.441 97.2 75.0 -91.6 -2.7 52.5 102.6 20.8 63 451 A N S < S- 0 0 18 -3,-2.3 2,-0.5 -4,-0.3 -8,-0.2 -0.544 94.0 -89.0-100.0 171.6 55.3 103.2 23.3 64 452 A K E -E 54 0B 85 -10,-3.1 -10,-3.1 -2,-0.2 2,-0.5 -0.720 36.3-131.5 -83.4 128.3 59.0 103.9 22.7 65 453 A S E -E 53 0B 57 -2,-0.5 -12,-0.2 -12,-0.2 53,-0.2 -0.643 21.6-177.4 -73.1 120.5 61.3 100.8 22.5 66 454 A L E - 0 0 28 -14,-3.3 2,-0.2 -2,-0.5 -13,-0.2 0.721 59.5 -73.1 -91.2 -16.8 64.3 101.2 24.7 67 455 A G E -E 52 0B 22 -15,-1.0 -15,-1.9 46,-0.1 -1,-0.4 -0.852 44.6-127.4 149.3 172.4 65.9 97.9 23.6 68 456 A Q E +E 51 0B 82 -2,-0.2 2,-0.3 -17,-0.2 -17,-0.2 -0.988 18.3 177.5-149.5 159.8 65.3 94.2 24.2 69 457 A F E -E 50 0B 24 -19,-1.9 -19,-3.1 -2,-0.3 2,-0.3 -0.969 24.4-117.7-153.5 162.5 67.2 91.1 25.3 70 458 A N E -E 49 0B 64 -2,-0.3 2,-0.5 -21,-0.2 -21,-0.2 -0.739 8.8-157.7-106.1 144.5 66.5 87.4 25.9 71 459 A L E +E 48 0B 0 -23,-2.9 -23,-2.6 -2,-0.3 3,-0.2 -0.990 29.1 164.7-112.1 120.6 66.8 85.3 29.0 72 460 A D + 0 0 76 -2,-0.5 -25,-0.2 -25,-0.3 3,-0.1 -0.423 40.3 78.1-117.1-160.2 67.1 81.6 28.2 73 461 A G + 0 0 35 -27,-0.4 2,-0.3 1,-0.3 -26,-0.2 0.623 58.3 160.3 67.8 19.3 68.1 78.4 30.0 74 462 A I - 0 0 7 -28,-2.1 -1,-0.3 -3,-0.2 3,-0.1 -0.533 42.6-118.3 -67.7 128.7 64.7 78.3 31.7 75 463 A N - 0 0 87 -2,-0.3 -31,-0.1 1,-0.1 -30,-0.1 -0.369 37.4 -80.7 -76.0 148.9 64.2 74.8 32.8 76 464 A P S S+ 0 0 102 0, 0.0 -1,-0.1 0, 0.0 -30,-0.1 -0.222 73.0 142.2 -49.3 119.5 61.3 72.6 31.5 77 465 A A - 0 0 28 -35,-0.2 -33,-3.1 -32,-0.1 -32,-0.5 -0.986 55.0 -87.1-155.9 161.1 58.2 73.6 33.5 78 466 A P > - 0 0 59 0, 0.0 3,-1.8 0, 0.0 -38,-0.2 -0.396 63.2 -84.8 -65.3 147.9 54.4 74.2 33.1 79 467 A R T 3 S+ 0 0 40 1,-0.2 -38,-0.2 -38,-0.2 -36,-0.1 -0.228 115.4 25.9 -45.8 142.7 53.5 77.7 32.0 80 468 A G T 3 S+ 0 0 29 -40,-1.4 -1,-0.2 -38,-0.1 -39,-0.1 0.349 99.0 91.7 82.0 -5.8 53.2 80.1 35.0 81 469 A M < + 0 0 122 -3,-1.8 -2,-0.1 -41,-0.0 -1,-0.1 0.881 60.5 84.9 -88.1 -43.6 55.6 78.2 37.2 82 470 A P - 0 0 16 0, 0.0 2,-0.7 0, 0.0 -42,-0.2 -0.307 69.7-139.6 -59.3 146.2 59.0 79.8 36.5 83 471 A Q - 0 0 101 -44,-0.1 20,-2.8 -46,-0.0 2,-0.7 -0.916 20.7-178.8-112.9 106.7 59.8 83.0 38.4 84 472 A I E -FH 38 102C 0 -46,-3.0 -46,-3.2 -2,-0.7 2,-0.6 -0.912 14.4-153.9-107.0 102.3 61.6 85.5 36.3 85 473 A E E -FH 37 101C 39 16,-2.7 16,-2.0 -2,-0.7 2,-0.6 -0.683 7.0-164.3 -80.9 119.7 62.4 88.6 38.4 86 474 A V E -FH 36 100C 0 -50,-3.1 -50,-1.9 -2,-0.6 2,-0.4 -0.926 6.2-170.3-105.5 122.9 62.7 91.7 36.4 87 475 A T E -FH 35 99C 12 12,-2.6 12,-2.3 -2,-0.6 2,-0.5 -0.923 11.7-161.6-113.2 135.1 64.4 94.8 38.1 88 476 A F E +FH 34 98C 0 -54,-3.4 -54,-2.4 -2,-0.4 2,-0.5 -0.984 16.0 179.8-109.9 124.0 64.5 98.4 36.8 89 477 A D E -FH 33 97C 52 8,-2.2 8,-3.0 -2,-0.5 2,-0.6 -0.973 9.8-172.9-130.1 110.5 67.3 100.3 38.5 90 478 A I E -FH 32 96C 11 -58,-2.7 -58,-1.9 -2,-0.5 6,-0.2 -0.937 18.4-152.8-107.0 117.5 67.9 103.9 37.6 91 479 A D > - 0 0 40 4,-1.9 3,-2.2 -2,-0.6 -61,-0.0 -0.109 35.3 -87.1 -80.8 176.2 71.1 105.3 39.2 92 480 A A T 3 S+ 0 0 77 1,-0.3 -62,-0.1 2,-0.1 -1,-0.1 0.808 127.2 56.8 -48.9 -33.5 72.1 108.8 40.3 93 481 A D T 3 S- 0 0 125 2,-0.1 -1,-0.3 1,-0.1 22,-0.1 0.453 117.9-110.2 -78.5 -1.2 73.5 109.4 36.7 94 482 A G S < S+ 0 0 29 -3,-2.2 2,-0.4 1,-0.3 -2,-0.1 0.626 70.1 144.4 74.3 16.8 70.1 108.6 35.1 95 483 A I - 0 0 47 19,-0.1 -4,-1.9 20,-0.1 2,-0.5 -0.699 42.5-142.0 -85.3 131.7 71.3 105.3 33.6 96 484 A L E -HI 90 113C 8 17,-2.4 17,-2.9 -2,-0.4 2,-0.5 -0.891 13.5-167.6 -97.2 123.1 68.6 102.5 33.5 97 485 A H E -HI 89 112C 53 -8,-3.0 -8,-2.2 -2,-0.5 2,-0.5 -0.953 5.2-171.7-106.9 123.4 69.8 99.0 34.2 98 486 A V E +HI 88 111C 0 13,-3.1 13,-2.3 -2,-0.5 2,-0.3 -0.951 9.3 173.8-113.4 126.0 67.2 96.4 33.4 99 487 A S E -HI 87 110C 11 -12,-2.3 -12,-2.6 -2,-0.5 2,-0.4 -0.974 19.5-157.3-132.0 155.7 67.9 92.8 34.4 100 488 A A E -HI 86 109C 0 9,-2.7 9,-2.2 -2,-0.3 2,-0.4 -0.992 12.9-171.6-128.0 131.0 66.0 89.6 34.4 101 489 A K E -HI 85 108C 76 -16,-2.0 -16,-2.7 -2,-0.4 2,-0.6 -0.991 20.8-140.5-128.1 131.3 66.8 86.7 36.7 102 490 A D E > -H 84 0C 2 5,-2.6 4,-2.7 -2,-0.4 -18,-0.2 -0.838 14.6-154.9 -88.2 117.7 65.5 83.1 36.7 103 491 A K T 4 S+ 0 0 98 -20,-2.8 -1,-0.1 -2,-0.6 -19,-0.1 0.723 90.1 52.8 -73.6 -25.2 65.1 82.3 40.4 104 492 A N T 4 S+ 0 0 115 -21,-0.3 -1,-0.2 1,-0.1 -20,-0.1 0.938 124.1 23.1 -68.2 -53.5 65.4 78.6 39.7 105 493 A S T 4 S- 0 0 51 2,-0.1 -2,-0.2 -30,-0.0 3,-0.1 0.792 92.3-133.2 -87.5 -23.5 68.7 78.7 37.7 106 494 A G < + 0 0 49 -4,-2.7 -3,-0.1 1,-0.3 2,-0.1 0.488 54.9 150.1 77.2 2.5 70.1 82.0 39.0 107 495 A K - 0 0 96 -5,-0.2 -5,-2.6 -34,-0.1 2,-0.4 -0.438 24.2-173.2 -67.4 141.0 70.8 82.8 35.3 108 496 A E E -I 101 0C 73 -7,-0.2 2,-0.3 -2,-0.1 -7,-0.2 -0.985 17.6-174.4-141.2 143.7 70.6 86.5 34.7 109 497 A Q E -I 100 0C 91 -9,-2.2 -9,-2.7 -2,-0.4 2,-0.3 -0.981 11.1-168.5-132.1 153.5 70.7 88.9 31.7 110 498 A K E -I 99 0C 107 -2,-0.3 2,-0.4 -11,-0.2 -11,-0.2 -0.971 15.8-158.3-137.4 153.2 70.8 92.7 31.6 111 499 A I E -I 98 0C 35 -13,-2.3 -13,-3.1 -2,-0.3 2,-0.5 -0.977 14.6-153.5-123.7 139.9 70.4 95.6 29.3 112 500 A T E -I 97 0C 81 -2,-0.4 2,-0.5 -15,-0.2 -15,-0.2 -0.976 8.5-162.0-113.2 133.1 71.9 99.0 30.2 113 501 A I E -I 96 0C 12 -17,-2.9 -17,-2.4 -2,-0.5 -46,-0.1 -0.963 19.2-122.4-125.1 115.7 70.2 102.1 28.7 114 502 A K > - 0 0 146 -2,-0.5 3,-1.8 -19,-0.2 -19,-0.1 -0.094 24.3-112.0 -57.1 152.2 72.0 105.4 28.6 115 503 A A T 3 S+ 0 0 67 1,-0.3 -1,-0.1 -22,-0.1 -20,-0.1 0.773 116.3 56.9 -58.3 -26.5 70.5 108.5 30.2 116 504 A S T 3 S+ 0 0 101 4,-0.0 -1,-0.3 0, 0.0 -2,-0.1 0.554 86.1 103.8 -85.7 -11.7 70.1 110.0 26.7 117 505 A S < + 0 0 47 -3,-1.8 -51,-0.1 -51,-0.0 2,-0.1 -0.097 60.6 31.4 -64.0 172.5 68.0 107.2 25.2 118 506 A G S S- 0 0 24 -53,-0.2 2,-0.1 -52,-0.1 -53,-0.1 -0.329 101.8 -3.8 76.2-159.3 64.3 107.2 24.5 119 507 A L - 0 0 27 1,-0.1 -64,-0.0 4,-0.1 2,-0.0 -0.358 61.9-134.0 -79.2 138.5 62.0 110.1 23.6 120 508 A N > - 0 0 82 -2,-0.1 4,-2.4 1,-0.1 3,-0.2 -0.197 41.6 -83.5 -77.0 178.7 63.1 113.6 23.4 121 509 A E H > S+ 0 0 139 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.865 127.5 47.8 -49.6 -50.3 61.1 116.5 24.9 122 510 A D H > S+ 0 0 120 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.879 113.8 47.2 -66.9 -37.1 58.7 117.0 22.0 123 511 A E H > S+ 0 0 84 2,-0.2 4,-2.7 -3,-0.2 -1,-0.2 0.831 109.3 55.8 -69.5 -32.6 58.0 113.3 21.8 124 512 A I H X S+ 0 0 23 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.943 109.9 44.5 -64.0 -46.7 57.5 113.3 25.6 125 513 A Q H X S+ 0 0 112 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.918 113.3 50.3 -65.7 -43.2 54.9 116.0 25.4 126 514 A K H X S+ 0 0 108 -4,-2.3 4,-3.0 1,-0.2 -2,-0.2 0.931 110.7 51.8 -57.5 -45.7 53.1 114.3 22.4 127 515 A M H X S+ 0 0 17 -4,-2.7 4,-2.6 2,-0.2 5,-0.3 0.889 108.0 49.3 -54.8 -44.4 53.1 111.1 24.4 128 516 A V H X S+ 0 0 58 -4,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.910 115.1 45.4 -69.8 -35.0 51.5 112.6 27.5 129 517 A R H X S+ 0 0 152 -4,-2.0 4,-3.3 2,-0.2 -2,-0.2 0.876 112.3 52.3 -70.4 -42.5 48.8 114.2 25.2 130 518 A D H X S+ 0 0 36 -4,-3.0 4,-2.9 2,-0.2 -2,-0.2 0.923 106.7 49.9 -61.3 -51.1 48.3 110.9 23.3 131 519 A A H < S+ 0 0 19 -4,-2.6 -1,-0.2 2,-0.2 7,-0.2 0.924 117.0 45.5 -50.2 -43.3 47.8 108.7 26.4 132 520 A E H >< S+ 0 0 166 -4,-1.5 3,-1.2 -5,-0.3 -2,-0.2 0.931 112.3 47.7 -71.4 -40.2 45.3 111.4 27.4 133 521 A A H 3< S+ 0 0 80 -4,-3.3 3,-0.3 1,-0.3 -1,-0.2 0.877 121.7 39.2 -62.5 -34.6 43.6 111.6 23.9 134 522 A N T 3X S+ 0 0 59 -4,-2.9 4,-2.7 1,-0.2 -1,-0.3 0.059 72.8 122.7-107.0 25.5 43.4 107.9 23.8 135 523 A A H <> S+ 0 0 55 -3,-1.2 4,-1.7 1,-0.2 -1,-0.2 0.891 82.1 44.7 -57.3 -39.8 42.5 107.0 27.4 136 524 A E H > S+ 0 0 114 -3,-0.3 4,-2.6 -4,-0.2 3,-0.2 0.964 111.5 48.9 -72.3 -48.6 39.4 105.2 26.2 137 525 A A H > S+ 0 0 53 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.883 114.5 49.5 -54.3 -40.4 40.9 103.3 23.3 138 526 A D H X S+ 0 0 11 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.837 107.9 52.0 -68.0 -37.0 43.6 102.2 25.7 139 527 A R H X S+ 0 0 79 -4,-1.7 4,-2.3 -5,-0.2 5,-0.2 0.946 110.1 49.1 -61.8 -51.0 41.2 101.1 28.4 140 528 A K H X S+ 0 0 118 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.918 111.6 49.2 -57.3 -44.1 39.4 99.0 25.9 141 529 A F H X S+ 0 0 9 -4,-2.2 4,-2.7 -5,-0.2 5,-0.3 0.935 109.4 52.0 -59.8 -44.5 42.7 97.4 24.7 142 530 A E H X S+ 0 0 76 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.942 111.3 47.5 -58.4 -40.4 43.7 96.7 28.3 143 531 A E H X S+ 0 0 62 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.829 111.8 50.8 -72.5 -32.4 40.3 94.9 28.9 144 532 A L H X S+ 0 0 17 -4,-2.0 4,-2.9 -5,-0.2 -1,-0.2 0.916 110.2 48.1 -67.6 -43.2 40.7 92.9 25.7 145 533 A V H X S+ 0 0 4 -4,-2.7 4,-2.4 1,-0.2 5,-0.2 0.925 112.7 50.7 -68.9 -40.1 44.2 91.8 26.6 146 534 A Q H X S+ 0 0 108 -4,-2.6 4,-2.1 -5,-0.3 -1,-0.2 0.939 112.3 44.9 -58.2 -50.9 42.9 90.8 30.1 147 535 A T H X S+ 0 0 8 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.897 112.7 52.5 -59.3 -46.0 40.0 88.8 28.6 148 536 A R H X S+ 0 0 38 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.897 110.0 47.8 -59.6 -40.8 42.3 87.2 26.1 149 537 A N H X S+ 0 0 45 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.853 111.4 50.3 -71.1 -32.5 44.7 86.1 28.8 150 538 A Q H X S+ 0 0 99 -4,-2.1 4,-2.7 -5,-0.2 -1,-0.2 0.895 111.5 49.2 -70.4 -35.5 41.9 84.7 30.9 151 539 A G H X S+ 0 0 0 -4,-2.4 4,-3.0 2,-0.2 -2,-0.2 0.927 109.7 50.7 -68.2 -43.5 40.6 82.8 27.9 152 540 A D H X S+ 0 0 31 -4,-2.5 4,-2.9 2,-0.2 5,-0.2 0.941 110.6 50.3 -60.8 -50.5 44.1 81.5 27.3 153 541 A H H X S+ 0 0 98 -4,-2.6 4,-3.2 1,-0.2 5,-0.3 0.942 112.6 46.4 -46.0 -54.1 44.3 80.4 30.9 154 542 A L H X S+ 0 0 49 -4,-2.7 4,-2.2 2,-0.2 5,-0.2 0.898 112.3 51.4 -58.7 -45.8 40.9 78.6 30.6 155 543 A L H X S+ 0 0 3 -4,-3.0 4,-2.2 2,-0.2 -2,-0.2 0.963 117.2 37.6 -53.3 -54.2 42.0 77.0 27.3 156 544 A H H X S+ 0 0 49 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.942 116.9 49.1 -73.7 -41.2 45.2 75.6 28.7 157 545 A S H X S+ 0 0 30 -4,-3.2 4,-2.5 -5,-0.2 -1,-0.2 0.861 112.2 50.8 -61.9 -42.7 43.9 74.7 32.2 158 546 A T H X S+ 0 0 6 -4,-2.2 4,-2.5 -5,-0.3 -1,-0.2 0.930 107.8 50.7 -62.1 -47.2 40.9 72.9 30.7 159 547 A R H X S+ 0 0 75 -4,-2.2 4,-2.2 -5,-0.2 -2,-0.2 0.931 111.8 48.8 -57.6 -41.8 43.0 70.9 28.3 160 548 A K H X S+ 0 0 76 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.921 111.2 50.2 -60.0 -48.2 45.3 69.8 31.3 161 549 A Q H X S+ 0 0 59 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.851 107.2 53.1 -61.1 -40.1 42.2 68.9 33.3 162 550 A V H X S+ 0 0 15 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.965 110.1 49.6 -58.0 -51.4 40.7 66.7 30.4 163 551 A E H < S+ 0 0 153 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.911 114.5 43.0 -54.2 -47.6 44.1 64.8 30.3 164 552 A E H < S+ 0 0 97 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.790 112.8 55.6 -69.0 -28.5 44.1 64.2 34.1 165 553 A A H >< S+ 0 0 4 -4,-2.1 3,-2.3 -5,-0.2 -2,-0.2 0.913 76.4 153.1 -66.1 -44.9 40.3 63.3 33.9 166 554 A G G >< S- 0 0 44 -4,-2.7 3,-1.2 1,-0.3 -1,-0.1 -0.235 75.3 -1.1 49.3-127.2 40.8 60.6 31.3 167 555 A D G 3 S+ 0 0 167 1,-0.2 -1,-0.3 -3,-0.1 4,-0.1 0.675 120.1 78.2 -64.7 -22.0 38.0 58.0 31.6 168 556 A K G < S+ 0 0 131 -3,-2.3 -1,-0.2 -4,-0.1 -2,-0.2 0.832 82.4 78.6 -58.7 -31.0 36.4 59.8 34.6 169 557 A L S < S- 0 0 12 -3,-1.2 5,-0.1 -7,-0.2 41,-0.0 -0.705 89.5-120.8 -82.0 119.8 34.9 62.3 32.0 170 558 A P > - 0 0 54 0, 0.0 4,-2.1 0, 0.0 3,-0.4 -0.266 21.0-114.6 -56.6 143.7 31.8 61.0 30.1 171 559 A A H > S+ 0 0 79 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.854 115.2 50.2 -39.9 -55.3 31.9 60.8 26.3 172 560 A D H > S+ 0 0 138 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.860 110.6 50.0 -58.5 -44.8 29.2 63.5 25.8 173 561 A D H > S+ 0 0 43 -3,-0.4 4,-2.7 2,-0.2 -1,-0.2 0.898 110.2 50.1 -60.2 -40.6 31.0 65.9 28.1 174 562 A K H X S+ 0 0 94 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.836 109.7 49.3 -76.1 -32.7 34.3 65.5 26.4 175 563 A T H X S+ 0 0 94 -4,-1.9 4,-2.1 -5,-0.2 -1,-0.2 0.938 113.2 47.4 -61.4 -49.0 32.9 66.1 22.9 176 564 A A H X S+ 0 0 32 -4,-2.0 4,-1.7 1,-0.2 -2,-0.2 0.955 114.0 47.3 -61.8 -54.3 31.1 69.2 24.1 177 565 A I H X S+ 0 0 0 -4,-2.7 4,-1.9 29,-0.3 -1,-0.2 0.898 111.4 49.3 -49.9 -50.6 34.3 70.5 25.9 178 566 A E H X S+ 0 0 82 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.848 109.8 51.6 -67.7 -30.7 36.7 69.9 22.9 179 567 A S H X S+ 0 0 79 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.890 112.9 46.5 -64.7 -39.6 34.3 71.6 20.4 180 568 A A H X S+ 0 0 1 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.792 108.6 54.8 -70.3 -32.7 34.2 74.5 22.8 181 569 A L H X S+ 0 0 2 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.884 107.9 49.0 -73.4 -38.3 38.0 74.5 23.2 182 570 A T H X S+ 0 0 80 -4,-1.8 4,-2.7 2,-0.2 5,-0.2 0.969 111.6 49.7 -61.3 -49.9 38.5 74.7 19.4 183 571 A A H X S+ 0 0 28 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.905 112.9 46.8 -59.2 -42.2 36.1 77.6 19.2 184 572 A L H X S+ 0 0 0 -4,-2.3 4,-2.4 15,-0.2 -1,-0.2 0.936 108.1 55.0 -64.3 -43.7 37.8 79.4 22.0 185 573 A E H X S+ 0 0 72 -4,-2.6 4,-0.6 1,-0.2 -2,-0.2 0.923 111.5 46.9 -52.0 -45.8 41.3 78.8 20.5 186 574 A T H >< S+ 0 0 86 -4,-2.7 3,-1.4 1,-0.2 4,-0.4 0.941 110.8 50.1 -62.5 -43.1 40.0 80.4 17.3 187 575 A A H >< S+ 0 0 15 -4,-2.3 3,-1.5 1,-0.3 5,-0.3 0.842 100.0 64.6 -69.9 -27.9 38.4 83.4 19.1 188 576 A L H 3< S+ 0 0 21 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.755 95.4 62.1 -64.3 -21.2 41.7 84.0 21.0 189 577 A K T << S+ 0 0 155 -3,-1.4 -1,-0.3 -4,-0.6 -2,-0.2 0.652 99.9 64.1 -74.1 -19.7 43.2 84.8 17.6 190 578 A G S < S- 0 0 30 -3,-1.5 -3,-0.0 -4,-0.4 0, 0.0 -0.051 81.4-126.2 -91.6-160.1 40.8 87.7 17.0 191 579 A E + 0 0 129 -2,-0.0 2,-0.9 -43,-0.0 -3,-0.1 0.050 69.2 118.8-136.7 11.8 40.4 91.0 18.8 192 580 A D > - 0 0 97 -5,-0.3 4,-1.9 1,-0.2 5,-0.2 -0.804 43.6-169.3 -88.2 104.8 36.7 90.7 19.5 193 581 A K H > S+ 0 0 58 -2,-0.9 4,-2.7 1,-0.2 -1,-0.2 0.859 84.9 51.7 -64.3 -40.5 36.3 90.7 23.3 194 582 A A H > S+ 0 0 61 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.879 107.8 53.0 -65.5 -36.8 32.6 89.7 23.3 195 583 A A H > S+ 0 0 33 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.903 110.0 47.3 -64.9 -46.9 33.4 86.7 21.0 196 584 A I H X S+ 0 0 0 -4,-1.9 4,-2.5 -9,-0.2 5,-0.2 0.928 112.6 49.7 -55.9 -49.1 36.1 85.5 23.4 197 585 A E H X S+ 0 0 86 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.870 108.9 53.9 -61.4 -31.4 33.7 85.9 26.3 198 586 A A H X S+ 0 0 47 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.873 110.5 44.7 -69.4 -39.5 31.1 84.0 24.4 199 587 A K H X S+ 0 0 69 -4,-1.9 4,-2.1 2,-0.2 -15,-0.2 0.863 112.1 52.5 -75.4 -31.9 33.4 81.1 23.8 200 588 A M H X S+ 0 0 31 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.864 109.6 50.0 -64.0 -41.9 34.5 81.1 27.4 201 589 A Q H X S+ 0 0 119 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.883 108.4 51.4 -59.7 -44.8 31.0 81.0 28.5 202 590 A E H X S+ 0 0 77 -4,-1.8 4,-1.6 2,-0.2 -2,-0.2 0.929 110.7 49.3 -60.7 -40.0 30.2 78.1 26.3 203 591 A L H X S+ 0 0 1 -4,-2.1 4,-1.6 1,-0.2 3,-0.2 0.918 110.5 50.6 -68.0 -40.1 33.2 76.3 27.8 204 592 A A H < S+ 0 0 68 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.824 111.2 50.1 -63.8 -33.7 32.0 77.1 31.3 205 593 A Q H < S+ 0 0 129 -4,-1.9 3,-0.3 1,-0.2 -1,-0.2 0.777 115.8 39.6 -74.7 -32.9 28.5 75.8 30.5 206 594 A V H < S+ 0 0 40 -4,-1.6 3,-0.4 -3,-0.2 -29,-0.3 0.654 108.2 62.6 -91.8 -11.0 29.7 72.5 29.0 207 595 A S X + 0 0 4 -4,-1.6 4,-2.6 1,-0.2 5,-0.2 0.241 62.5 109.7-100.9 9.2 32.5 71.8 31.6 208 596 A Q H > S+ 0 0 155 -3,-0.3 4,-1.2 1,-0.2 -1,-0.2 0.863 83.9 45.9 -61.9 -36.5 30.5 71.5 34.9 209 597 A K H > S+ 0 0 71 -3,-0.4 4,-2.3 2,-0.2 3,-0.4 0.949 112.9 51.2 -68.5 -46.9 31.1 67.7 35.1 210 598 A L H > S+ 0 0 0 -4,-0.3 4,-3.0 1,-0.2 -2,-0.2 0.879 107.5 52.3 -52.6 -41.0 34.8 68.2 34.3 211 599 A M H X S+ 0 0 83 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.838 108.7 51.3 -67.2 -30.9 35.2 70.9 37.0 212 600 A E H X S+ 0 0 76 -4,-1.2 4,-2.4 -3,-0.4 -2,-0.2 0.938 111.7 46.4 -71.2 -43.0 33.6 68.5 39.5 213 601 A I H X S+ 0 0 7 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.932 113.0 49.6 -60.5 -51.4 36.1 65.8 38.5 214 602 A A H X S+ 0 0 15 -4,-3.0 4,-0.7 1,-0.2 -1,-0.2 0.845 112.4 47.0 -56.5 -43.6 39.1 68.2 38.7 215 603 A Q H >< S+ 0 0 131 -4,-2.0 3,-0.6 -5,-0.2 -1,-0.2 0.877 112.8 50.8 -64.0 -43.3 38.1 69.5 42.2 216 604 A Q H 3< S+ 0 0 120 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.867 101.2 61.7 -68.0 -35.3 37.6 65.9 43.4 217 605 A Q H 3< 0 0 48 -4,-2.5 -1,-0.2 -5,-0.1 -2,-0.2 0.803 360.0 360.0 -60.4 -25.5 41.0 64.8 42.1 218 606 A H << 0 0 169 -4,-0.7 -3,-0.1 -3,-0.6 -4,-0.0 0.026 360.0 360.0-120.9 360.0 42.8 67.3 44.4 219 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 220 12 B S 0 0 99 0, 0.0 -171,-0.1 0, 0.0 -150,-0.0 0.000 360.0 360.0 360.0-169.5 63.4 86.3 20.2 221 13 B H - 0 0 102 1,-0.2 -172,-0.2 -175,-0.0 -173,-0.1 -0.646 360.0 -43.1-143.3-178.4 60.5 84.7 22.2 222 14 B P - 0 0 45 0, 0.0 -173,-2.3 0, 0.0 -1,-0.2 -0.097 57.2-115.4 -53.0 156.1 57.3 85.2 24.0 223 15 B R - 0 0 53 -175,-0.2 -182,-0.3 1,-0.1 -208,-0.2 -0.490 43.4 -90.4 -83.4 159.6 57.0 88.1 26.4 224 16 B P - 0 0 0 0, 0.0 -208,-1.9 0, 0.0 2,-0.4 -0.381 36.2-128.5 -66.9 155.5 56.6 87.2 30.1 225 17 B I E -G 39 0C 17 -186,-2.7 -186,-2.5 -210,-0.2 2,-0.5 -0.830 14.5-125.0-110.9 145.9 53.2 86.8 31.7 226 18 B R E G 38 0C 133 -2,-0.4 -188,-0.1 -188,-0.2 -211,-0.0 -0.700 360.0 360.0 -83.2 126.8 52.1 88.5 34.8 227 19 B V 0 0 149 -190,-0.5 -190,-0.1 -2,-0.5 -1,-0.0 -0.757 360.0 360.0 -94.5 360.0 50.9 86.0 37.3