==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-APR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 15-FEB-13 3ZNR . COMPND 2 MOLECULE: HISTONE DEACETYLASE 7; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.LOBERA,K.MADAUSS,D.POHLHAUS,R.TRUMP,M.NOLAN . 1108 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 42100.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 764 69.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 130 11.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 21 1.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 5 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 0.7 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 . 94 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 125 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 321 29.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 1.8 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 1 2 3 1 6 0 3 4 5 0 3 1 2 0 0 0 3 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 6 0 2 7 9 3 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 . 9 1 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 ANTIPARALLEL BRIDGES PER LADDER . 0 1 0 0 0 0 3 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 1 516 A L 0 0 84 0, 0.0 760,-0.1 0, 0.0 2,-0.0 0.000 360.0 360.0 360.0 132.0 24.6 -11.7 -3.1 2 517 A P - 0 0 36 0, 0.0 2,-1.6 0, 0.0 124,-0.1 -0.320 360.0-113.4 -74.0 153.6 24.6 -8.9 -0.5 3 518 A F S S+ 0 0 93 122,-0.2 2,-0.2 123,-0.1 122,-0.2 -0.598 77.3 101.7 -88.3 77.2 21.9 -8.5 2.2 4 519 A T S S- 0 0 40 -2,-1.6 122,-1.9 120,-0.3 123,-0.6 -0.656 81.5 -56.4-136.0-167.3 20.3 -5.3 1.1 5 520 A T E -a 127 0A 2 43,-0.2 45,-2.5 -2,-0.2 2,-0.3 -0.593 52.6-136.0 -79.9 141.9 17.1 -4.2 -0.8 6 521 A G E -ab 128 50A 0 121,-2.5 123,-2.5 -2,-0.2 2,-0.4 -0.771 12.4-159.7 -99.1 143.3 16.6 -5.8 -4.2 7 522 A L E -ab 129 51A 0 43,-2.4 45,-3.7 -2,-0.3 2,-0.5 -0.990 3.8-157.1-121.6 132.0 15.5 -3.9 -7.3 8 523 A I E +ab 130 52A 0 121,-1.8 123,-2.0 -2,-0.4 2,-0.3 -0.932 29.0 139.9-109.4 127.4 13.9 -5.6 -10.4 9 524 A Y + 0 0 28 43,-1.9 2,-0.3 -2,-0.5 123,-0.1 -0.940 13.6 165.8-162.3 141.9 14.0 -3.9 -13.8 10 525 A D > - 0 0 29 121,-0.3 3,-1.2 -2,-0.3 4,-0.3 -0.964 39.9-126.1-157.8 147.8 14.6 -4.9 -17.4 11 526 A S G >> S+ 0 0 70 -2,-0.3 3,-1.8 1,-0.2 4,-0.6 0.720 98.6 80.8 -67.4 -23.1 14.0 -3.3 -20.8 12 527 A V G >4 S+ 0 0 41 1,-0.3 3,-1.1 2,-0.2 4,-0.3 0.854 88.2 56.3 -48.5 -39.6 12.0 -6.3 -22.0 13 528 A M G X4 S+ 0 0 0 -3,-1.2 3,-0.7 1,-0.2 -1,-0.3 0.657 94.3 66.6 -73.2 -16.8 9.0 -4.9 -20.2 14 529 A L G <4 S+ 0 0 29 -3,-1.8 -1,-0.2 -4,-0.3 16,-0.2 0.723 86.4 72.7 -69.5 -22.2 9.2 -1.6 -22.1 15 530 A K G << + 0 0 111 -3,-1.1 2,-1.1 -4,-0.6 -1,-0.2 0.715 69.6 99.9 -68.7 -23.1 8.3 -3.6 -25.3 16 531 A H < + 0 0 4 -3,-0.7 2,-0.3 -4,-0.3 14,-0.1 -0.543 54.7 117.4 -69.6 98.6 4.6 -4.0 -24.1 17 532 A Q - 0 0 72 -2,-1.1 84,-0.1 12,-0.1 85,-0.1 -0.970 66.0 -92.9-161.7 151.3 2.8 -1.3 -26.1 18 533 A C > - 0 0 9 -2,-0.3 3,-1.0 4,-0.1 80,-0.1 -0.235 32.3-121.4 -65.4 154.0 0.1 -0.9 -28.7 19 534 A S T 3 S+ 0 0 99 1,-0.2 -1,-0.1 78,-0.2 79,-0.0 0.738 108.2 68.9 -70.1 -24.7 1.0 -0.8 -32.4 20 535 A C T 3 S- 0 0 45 2,-0.1 -1,-0.2 1,-0.1 3,-0.1 0.719 94.4-144.6 -67.1 -23.3 -0.6 2.7 -32.8 21 536 A G < + 0 0 44 -3,-1.0 2,-0.9 1,-0.2 -1,-0.1 0.367 50.4 137.6 80.7 -4.1 2.2 4.1 -30.6 22 537 A D > - 0 0 66 1,-0.2 4,-1.3 2,-0.1 -1,-0.2 -0.670 29.9-176.1 -82.8 106.3 -0.0 6.7 -28.9 23 538 A N T 4 S+ 0 0 71 -2,-0.9 -1,-0.2 2,-0.2 6,-0.1 0.630 81.7 60.3 -75.6 -15.5 1.0 6.6 -25.2 24 539 A S T 4 S+ 0 0 105 1,-0.1 -1,-0.2 -3,-0.1 -2,-0.1 0.916 107.6 42.7 -75.4 -46.7 -1.8 9.2 -24.3 25 540 A R T 4 S+ 0 0 133 1,-0.3 -2,-0.2 2,-0.1 -1,-0.1 0.799 121.1 44.6 -67.3 -31.0 -4.6 6.9 -25.6 26 541 A H S < S- 0 0 18 -4,-1.3 -1,-0.3 1,-0.1 -8,-0.1 -0.778 74.1-179.5-114.6 84.8 -2.9 3.9 -23.9 27 542 A P + 0 0 43 0, 0.0 2,-1.6 0, 0.0 -1,-0.1 0.601 65.6 81.1 -70.2 -16.0 -1.9 5.4 -20.4 28 543 A E S S+ 0 0 20 66,-0.2 2,-0.2 3,-0.0 283,-0.1 -0.659 76.8 160.7 -83.5 79.6 -0.3 2.2 -19.1 29 544 A H > - 0 0 21 -2,-1.6 3,-1.4 -6,-0.1 4,-0.4 -0.534 57.9-107.3-109.1 167.9 2.9 3.1 -21.0 30 545 A A T 3> S+ 0 0 7 1,-0.3 4,-1.9 -16,-0.2 3,-0.4 0.796 110.2 72.6 -62.9 -32.3 6.6 2.1 -20.9 31 546 A G H 3> S+ 0 0 16 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.741 83.6 72.1 -53.2 -27.1 7.5 5.5 -19.5 32 547 A R H <> S+ 0 0 5 -3,-1.4 4,-1.4 1,-0.2 -1,-0.2 0.968 109.6 26.8 -55.6 -60.7 6.0 4.5 -16.2 33 548 A I H > S+ 0 0 0 -4,-0.4 4,-2.2 -3,-0.4 -1,-0.2 0.803 120.6 58.7 -73.3 -29.9 8.7 2.0 -15.2 34 549 A Q H X S+ 0 0 101 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.898 107.2 45.6 -66.1 -42.8 11.3 3.9 -17.3 35 550 A S H X S+ 0 0 23 -4,-2.9 4,-2.4 2,-0.2 -1,-0.2 0.893 113.8 48.8 -68.1 -41.9 10.8 7.2 -15.3 36 551 A I H X S+ 0 0 0 -4,-1.4 4,-2.1 -5,-0.3 -2,-0.2 0.906 109.9 52.5 -63.4 -43.1 10.9 5.4 -11.9 37 552 A W H X S+ 0 0 41 -4,-2.2 4,-0.8 2,-0.2 -2,-0.2 0.911 115.2 39.2 -61.5 -46.5 14.1 3.5 -12.8 38 553 A S H X S+ 0 0 44 -4,-1.8 4,-2.5 1,-0.2 3,-0.4 0.865 111.5 59.3 -72.5 -37.7 16.0 6.6 -13.8 39 554 A R H X S+ 0 0 29 -4,-2.4 4,-2.0 1,-0.2 6,-0.2 0.879 101.5 54.9 -55.0 -42.0 14.5 8.6 -10.9 40 555 A L H <>S+ 0 0 1 -4,-2.1 6,-1.8 1,-0.2 5,-1.7 0.824 110.3 45.9 -64.2 -32.4 16.0 6.1 -8.5 41 556 A Q H ><5S+ 0 0 26 -4,-0.8 3,-0.9 -3,-0.4 -2,-0.2 0.886 110.3 53.0 -74.8 -42.5 19.4 6.7 -10.0 42 557 A E H 3<5S+ 0 0 97 -4,-2.5 530,-0.3 1,-0.2 -2,-0.2 0.856 112.5 45.3 -58.4 -38.0 19.0 10.5 -10.0 43 558 A R T 3<5S- 0 0 23 -4,-2.0 532,-0.2 -5,-0.2 -1,-0.2 0.450 114.6-118.0 -88.6 -4.4 18.1 10.4 -6.2 44 559 A G T < 5S+ 0 0 2 -3,-0.9 4,-0.4 -4,-0.2 -3,-0.2 0.530 85.1 109.9 83.5 8.8 21.0 8.0 -5.4 45 560 A L >< + 0 0 10 -5,-1.7 4,-0.7 -6,-0.2 3,-0.3 0.765 64.5 65.3 -84.9 -27.6 18.8 5.1 -4.2 46 561 A R T >4 S+ 0 0 36 -6,-1.8 3,-0.6 1,-0.2 -5,-0.2 0.861 98.1 51.3 -69.1 -40.0 19.5 2.7 -7.1 47 562 A S T 34 S+ 0 0 19 -7,-0.3 -1,-0.2 1,-0.2 -2,-0.1 0.757 104.2 59.7 -68.6 -26.2 23.2 2.2 -6.5 48 563 A Q T 34 S+ 0 0 37 -4,-0.4 -1,-0.2 -3,-0.3 -43,-0.2 0.731 100.8 69.5 -72.3 -24.5 22.5 1.3 -2.9 49 564 A C S << S- 0 0 1 -4,-0.7 2,-0.8 -3,-0.6 -43,-0.2 -0.500 92.2-109.5 -91.9 161.6 20.3 -1.6 -3.9 50 565 A E E -b 6 0A 44 -45,-2.5 -43,-2.4 -2,-0.2 2,-0.5 -0.854 39.1-146.8 -88.9 110.9 21.2 -4.9 -5.6 51 566 A C E -b 7 0A 54 -2,-0.8 2,-0.3 -45,-0.2 -43,-0.2 -0.717 18.9-175.4 -90.9 120.6 19.8 -4.5 -9.1 52 567 A L E -b 8 0A 30 -45,-3.7 -43,-1.9 -2,-0.5 64,-0.0 -0.802 26.3-148.7-113.8 154.5 18.5 -7.6 -10.8 53 568 A R - 0 0 98 -2,-0.3 2,-0.2 1,-0.2 -1,-0.1 0.818 36.2-153.0 -86.9 -36.5 17.1 -8.2 -14.3 54 569 A G - 0 0 20 58,-0.1 2,-0.3 57,-0.1 -1,-0.2 -0.611 9.8-112.5 93.0-157.2 14.7 -11.0 -13.4 55 570 A R - 0 0 81 53,-0.5 57,-0.3 -2,-0.2 56,-0.2 -0.979 27.6 -75.4-166.0 168.3 13.5 -13.7 -15.7 56 571 A K - 0 0 99 -2,-0.3 2,-0.3 55,-0.2 52,-0.2 -0.562 46.7-121.0 -70.5 138.6 10.6 -15.2 -17.7 57 572 A A - 0 0 0 50,-1.8 54,-0.1 -2,-0.2 53,-0.1 -0.655 31.8-118.6 -74.6 137.3 8.0 -17.1 -15.7 58 573 A S > - 0 0 40 -2,-0.3 4,-2.0 1,-0.1 3,-0.3 -0.358 21.3-111.5 -71.4 158.7 7.7 -20.7 -16.9 59 574 A L H > S+ 0 0 54 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.870 120.4 56.9 -57.6 -36.8 4.4 -22.0 -18.2 60 575 A E H > S+ 0 0 139 1,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.875 105.8 49.6 -62.5 -39.5 4.2 -24.2 -15.1 61 576 A E H >4 S+ 0 0 17 -3,-0.3 3,-0.7 1,-0.2 4,-0.3 0.894 110.6 49.4 -67.3 -40.7 4.5 -21.1 -12.9 62 577 A L H >X S+ 0 0 0 -4,-2.0 4,-2.4 1,-0.2 3,-1.1 0.850 107.2 56.2 -64.3 -35.8 1.7 -19.3 -14.8 63 578 A Q H 3< S+ 0 0 97 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.600 88.5 75.7 -74.9 -12.4 -0.5 -22.4 -14.6 64 579 A S T << S+ 0 0 19 -3,-0.7 -1,-0.2 -4,-0.5 -2,-0.2 0.706 117.3 16.7 -69.6 -21.0 -0.3 -22.4 -10.7 65 580 A V T <4 S+ 0 0 6 -3,-1.1 -2,-0.2 -4,-0.3 2,-0.2 0.671 125.4 53.0-115.2 -36.8 -2.7 -19.4 -10.8 66 581 A H S < S- 0 0 4 -4,-2.4 76,-0.2 1,-0.1 75,-0.1 -0.586 82.8 -98.6-108.3 164.9 -4.3 -19.4 -14.2 67 582 A S > - 0 0 23 74,-2.5 4,-2.1 -2,-0.2 5,-0.2 -0.242 33.7-110.3 -75.0 165.1 -6.1 -21.9 -16.4 68 583 A E H > S+ 0 0 57 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.910 119.7 50.2 -61.4 -44.8 -4.5 -23.9 -19.2 69 584 A R H > S+ 0 0 70 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.868 109.6 51.4 -62.3 -39.2 -6.5 -22.0 -21.9 70 585 A H H > S+ 0 0 6 2,-0.2 4,-2.4 1,-0.2 5,-0.3 0.925 112.0 45.8 -63.0 -46.1 -5.4 -18.7 -20.3 71 586 A V H X S+ 0 0 2 -4,-2.1 4,-1.5 2,-0.2 5,-0.4 0.817 113.4 49.5 -70.1 -33.1 -1.7 -19.7 -20.4 72 587 A L H X S+ 0 0 111 -4,-2.1 4,-0.8 3,-0.2 -1,-0.2 0.921 113.9 46.6 -68.1 -44.0 -1.9 -21.0 -23.9 73 588 A L H < S+ 0 0 111 -4,-2.3 -2,-0.2 -5,-0.2 -3,-0.2 0.920 131.5 16.2 -64.1 -48.0 -3.6 -17.7 -25.1 74 589 A Y H < S+ 0 0 30 -4,-2.4 -3,-0.2 -5,-0.2 -1,-0.2 0.509 126.5 50.2-108.0 -8.1 -1.3 -15.2 -23.4 75 590 A G H < S+ 0 0 1 -4,-1.5 2,-0.2 -5,-0.3 -3,-0.2 0.666 98.9 58.5-108.0 -21.4 1.8 -17.3 -22.5 76 591 A T S < S- 0 0 38 -4,-0.8 4,-0.1 -5,-0.4 27,-0.1 -0.714 83.3-100.7-115.3 161.0 2.9 -19.1 -25.6 77 592 A N - 0 0 102 -2,-0.2 23,-0.1 1,-0.1 -3,-0.1 -0.663 30.9-130.0 -76.2 129.4 3.9 -18.3 -29.2 78 593 A P S S+ 0 0 116 0, 0.0 2,-2.1 0, 0.0 -1,-0.1 0.817 99.1 74.5 -47.9 -39.0 1.0 -18.9 -31.7 79 594 A L 0 0 153 1,-0.1 -2,-0.1 -3,-0.0 0, 0.0 -0.515 360.0 360.0 -78.7 74.3 3.3 -21.0 -33.9 80 595 A S 0 0 140 -2,-2.1 -1,-0.1 -4,-0.1 -4,-0.0 -0.334 360.0 360.0-163.5 360.0 3.3 -24.0 -31.7 81 ! 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 82 614 A V 0 0 118 0, 0.0 8,-1.8 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 139.0 -10.2 -8.3 -30.7 83 615 A M B -H 89 0B 146 6,-0.2 6,-0.2 8,-0.1 5,-0.1 -0.435 360.0-151.3 -75.0 149.6 -9.9 -5.2 -33.0 84 616 A L > - 0 0 13 4,-1.3 3,-1.0 -2,-0.1 9,-0.0 -0.817 26.9-109.4-122.2 159.7 -9.7 -1.8 -31.4 85 617 A P T 3 S+ 0 0 126 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.851 119.7 50.6 -54.4 -38.8 -10.8 1.8 -32.5 86 618 A C T 3 S- 0 0 38 2,-0.1 3,-0.1 1,-0.1 -3,-0.0 0.670 121.2-107.4 -75.0 -19.7 -7.1 2.8 -32.9 87 619 A G S < S+ 0 0 44 -3,-1.0 -1,-0.1 1,-0.4 -3,-0.0 -0.015 80.9 112.9 118.9 -28.3 -6.4 -0.2 -35.1 88 620 A G - 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0 0 106 -5,-1.7 2,-0.4 -6,-0.2 -1,-0.3 -0.719 38.2-140.8 -82.7 116.9 25.2 -23.5 26.9 1077 863 C R - 0 0 211 -2,-0.6 2,-0.4 -38,-0.0 -41,-0.1 -0.637 5.7-145.7 -86.8 130.5 27.0 -25.4 29.7 1078 864 C V - 0 0 36 -2,-0.4 -1,-0.0 -43,-0.1 -46,-0.0 -0.784 12.8-135.6 -93.0 135.1 28.7 -28.7 29.0 1079 865 C D > - 0 0 91 -2,-0.4 3,-1.1 1,-0.1 -43,-0.0 -0.819 11.4-164.8 -93.3 114.3 28.6 -31.3 31.8 1080 866 C P G > S+ 0 0 44 0, 0.0 3,-0.5 0, 0.0 6,-0.2 0.779 86.8 59.8 -70.1 -25.9 32.0 -33.0 32.2 1081 867 C L G 3 S+ 0 0 161 1,-0.2 6,-0.0 3,-0.1 -2,-0.0 0.453 88.2 76.0 -81.2 -1.1 30.6 -35.9 34.3 1082 868 C S G < S+ 0 0 70 -3,-1.1 2,-0.3 1,-0.1 -1,-0.2 -0.099 80.5 83.2 -98.8 33.6 28.3 -37.0 31.5 1083 869 C E X> - 0 0 56 -3,-0.5 2,-1.7 2,-0.0 3,-1.2 -0.829 61.2-158.2-143.3 99.9 31.1 -38.6 29.5 1084 870 C E T 34 S+ 0 0 115 -2,-0.3 -3,-0.1 1,-0.2 -2,-0.0 -0.610 94.4 46.9 -71.7 87.9 32.4 -42.1 30.1 1085 871 C G T 34 S+ 0 0 32 -2,-1.7 3,-0.4 3,-0.0 -1,-0.2 0.019 92.4 70.0 161.9 -40.6 35.7 -41.3 28.4 1086 872 C W T <4 S+ 0 0 30 -3,-1.2 -2,-0.1 1,-0.2 -5,-0.1 0.644 92.2 67.0 -71.2 -18.0 36.8 -38.0 29.9 1087 873 C K S < S+ 0 0 95 -4,-0.7 -1,-0.2 2,-0.1 -3,-0.1 0.796 80.4 98.6 -69.7 -31.5 37.3 -40.1 33.1 1088 874 C Q S S- 0 0 144 -3,-0.4 -3,-0.0 1,-0.1 0, 0.0 -0.267 81.3-113.5 -58.6 143.0 40.2 -41.9 31.5 1089 875 C K - 0 0 74 1,-0.1 -102,-0.1 -99,-0.0 -1,-0.1 -0.456 35.4 -97.4 -77.7 151.8 43.7 -40.6 32.3 1090 876 C P - 0 0 28 0, 0.0 -1,-0.1 0, 0.0 -107,-0.1 -0.340 47.4 -96.0 -69.8 152.1 45.9 -39.0 29.6 1091 877 C N > - 0 0 21 -109,-0.3 4,-2.3 1,-0.1 3,-0.3 -0.102 31.6-104.8 -70.4 166.7 48.5 -41.1 27.8 1092 878 C L H > S+ 0 0 116 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.872 119.1 53.0 -60.2 -42.4 52.2 -41.4 28.8 1093 879 C N H > S+ 0 0 38 1,-0.2 4,-1.6 2,-0.2 -117,-0.4 0.860 110.5 47.6 -63.0 -37.6 53.4 -39.2 25.8 1094 880 C A H > S+ 0 0 0 -3,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.904 111.4 50.8 -68.1 -43.9 50.9 -36.4 26.8 1095 881 C I H X S+ 0 0 62 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.940 111.3 48.0 -57.5 -49.5 52.0 -36.6 30.5 1096 882 C R H X S+ 0 0 157 -4,-2.7 4,-1.3 1,-0.2 -1,-0.2 0.848 111.2 51.1 -61.7 -36.8 55.7 -36.4 29.4 1097 883 C S H X S+ 0 0 10 -4,-1.6 4,-1.5 2,-0.2 -1,-0.2 0.909 110.8 47.6 -66.7 -44.3 55.0 -33.4 27.2 1098 884 C L H X S+ 0 0 5 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.872 107.3 56.6 -64.6 -39.3 53.1 -31.5 29.9 1099 885 C E H X S+ 0 0 94 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.840 104.2 54.4 -59.9 -35.0 56.0 -32.2 32.4 1100 886 C A H X S+ 0 0 19 -4,-1.3 4,-2.1 2,-0.2 -1,-0.2 0.906 108.6 47.8 -63.8 -43.6 58.3 -30.5 29.9 1101 887 C V H X S+ 0 0 0 -4,-1.5 4,-2.8 2,-0.2 -2,-0.2 0.915 113.1 48.0 -63.5 -45.0 56.1 -27.4 29.8 1102 888 C I H X S+ 0 0 59 -4,-2.5 4,-1.1 1,-0.2 -2,-0.2 0.910 110.9 51.9 -60.5 -44.3 56.0 -27.4 33.7 1103 889 C R H < S+ 0 0 162 -4,-2.4 4,-0.2 1,-0.2 -2,-0.2 0.898 116.6 38.7 -60.4 -44.7 59.7 -27.8 33.9 1104 890 C V H >< S+ 0 0 32 -4,-2.1 3,-0.9 1,-0.2 -2,-0.2 0.919 118.8 45.0 -73.7 -45.6 60.4 -24.9 31.5 1105 891 C H H >X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 3,-0.9 0.452 85.4 89.4 -87.6 0.2 57.7 -22.5 32.7 1106 892 C S T 3< S+ 0 0 44 -4,-1.1 -1,-0.2 1,-0.2 -2,-0.1 0.763 84.5 61.3 -59.4 -26.3 58.4 -23.0 36.5 1107 893 C K T <4 S+ 0 0 151 -3,-0.9 -1,-0.2 -4,-0.2 -2,-0.2 0.777 116.7 25.7 -68.9 -28.7 60.8 -20.1 36.0 1108 894 C Y T <4 S+ 0 0 63 -3,-0.9 2,-0.4 1,-0.2 -2,-0.2 0.733 114.8 54.8-111.8 -30.5 58.1 -17.6 34.9 1109 895 C W >< - 0 0 14 -4,-2.5 3,-1.4 1,-0.1 4,-0.4 -0.941 58.9-149.5-120.7 129.8 54.7 -18.7 36.4 1110 896 C G G > S+ 0 0 37 -2,-0.4 3,-0.6 1,-0.3 -1,-0.1 0.782 100.8 59.1 -63.0 -30.2 53.9 -19.4 40.0 1111 897 C C G 3 S+ 0 0 55 1,-0.2 -1,-0.3 -113,-0.1 -5,-0.1 0.587 107.0 48.5 -74.9 -11.5 51.2 -22.0 39.0 1112 898 C M G < 0 0 6 -3,-1.4 -6,-0.2 -7,-0.3 -1,-0.2 0.437 360.0 360.0-104.0 -4.5 54.0 -24.0 37.3 1113 899 C Q < 0 0 170 -3,-0.6 -10,-0.1 -4,-0.4 -3,-0.0 -0.568 360.0 360.0 -75.0 360.0 56.5 -23.9 40.2