==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-AUG-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL BINDING PROTEIN 14-JUL-11 3SWV . COMPND 2 MOLECULE: BREFELDIN A-INHIBITED GUANINE NUCLEOTIDE-EXCHANGE . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.SEETHARAMAN,M.SU,F.FOROUHAR,D.WANG,H.JANJUA,K.CUNNINGHAM,L . 188 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11392.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 121 64.4 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 . 0 0.0 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 16 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 17.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 68 36.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 3 1 1 3 1 1 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 . 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1 637 A F 0 0 236 0, 0.0 3,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -91.8 18.8 47.1 19.8 2 638 A E > + 0 0 146 1,-0.2 3,-1.1 2,-0.1 4,-0.1 0.244 360.0 99.7 -99.3 14.0 20.6 43.9 18.8 3 639 A V T 3 + 0 0 88 1,-0.3 -1,-0.2 2,-0.2 3,-0.2 0.019 42.7 111.2 -84.0 27.7 17.2 42.2 18.3 4 640 A I T > S+ 0 0 93 1,-0.2 3,-0.9 -3,-0.2 -1,-0.3 0.740 70.9 65.7 -67.9 -21.6 18.0 42.9 14.7 5 641 A K G X> S+ 0 0 105 -3,-1.1 3,-2.4 1,-0.2 4,-1.2 0.877 81.9 68.3 -67.0 -45.7 18.2 39.1 14.9 6 642 A Q G 34 S+ 0 0 126 1,-0.3 -1,-0.2 2,-0.2 -2,-0.1 0.562 91.8 68.1 -56.3 -3.4 14.6 38.5 15.6 7 643 A Q G <4 S+ 0 0 143 -3,-0.9 -1,-0.3 2,-0.2 3,-0.2 0.690 95.5 49.1 -90.2 -23.0 14.0 39.8 12.1 8 644 A K T X4 S+ 0 0 91 -3,-2.4 3,-1.7 1,-0.2 -2,-0.2 0.744 93.9 74.9 -84.0 -27.8 15.6 36.8 10.3 9 645 A E T 3< S+ 0 0 102 -4,-1.2 -1,-0.2 1,-0.3 -2,-0.2 0.765 75.0 83.1 -53.9 -23.1 13.5 34.6 12.6 10 646 A I T > + 0 0 88 1,-0.3 3,-1.7 -3,-0.2 4,-0.5 0.333 54.4 105.3 -63.0 8.8 10.9 35.9 10.0 11 647 A I T < + 0 0 26 -3,-1.7 -1,-0.3 1,-0.3 4,-0.2 0.144 57.9 87.5 -75.3 21.8 12.3 33.0 8.0 12 648 A E T 3> S+ 0 0 86 -3,-0.2 4,-0.5 2,-0.2 -1,-0.3 0.674 78.0 56.7 -91.0 -25.4 9.0 31.5 9.0 13 649 A H H <> S+ 0 0 90 -3,-1.7 4,-1.9 1,-0.2 3,-0.3 0.851 100.6 59.6 -73.8 -34.5 7.2 33.0 6.1 14 650 A G H > S+ 0 0 0 -4,-0.5 4,-1.1 1,-0.3 -1,-0.2 0.719 111.2 39.2 -65.9 -21.9 9.6 31.2 3.8 15 651 A I H > S+ 0 0 15 -3,-0.2 4,-0.9 2,-0.2 38,-0.3 0.487 108.8 63.1-101.7 -10.3 8.5 27.9 5.3 16 652 A E H < S+ 0 0 135 -4,-0.5 -2,-0.2 -3,-0.3 -3,-0.2 0.806 115.8 31.6 -78.9 -34.8 4.9 29.1 5.3 17 653 A L H >X S+ 0 0 44 -4,-1.9 4,-3.2 2,-0.1 3,-2.3 0.839 113.4 61.9 -88.5 -43.0 5.1 29.4 1.5 18 654 A F H 3< S+ 0 0 0 -4,-1.1 -2,-0.2 1,-0.3 -3,-0.2 0.829 93.0 67.0 -53.0 -36.2 7.5 26.5 1.1 19 655 A N T 3< S+ 0 0 50 -4,-0.9 -1,-0.3 2,-0.2 -2,-0.1 0.523 123.3 11.7 -67.3 -5.1 4.9 24.1 2.6 20 656 A K T <4 S+ 0 0 144 -3,-2.3 -2,-0.2 36,-0.0 3,-0.2 0.491 142.1 31.5-132.6 -52.5 2.6 24.6 -0.4 21 657 A K >X + 0 0 107 -4,-3.2 4,-1.8 1,-0.2 3,-1.8 -0.725 66.4 170.3-111.0 79.2 4.7 26.4 -3.0 22 658 A P H 3> S+ 0 0 23 0, 0.0 4,-1.6 0, 0.0 5,-0.3 0.879 75.9 64.3 -57.2 -39.2 8.2 25.0 -2.3 23 659 A K H 34 S+ 0 0 171 1,-0.2 -5,-0.1 -3,-0.2 -2,-0.0 0.402 111.5 41.7 -66.7 8.0 9.6 26.6 -5.4 24 660 A R H <> S+ 0 0 91 -3,-1.8 4,-3.3 3,-0.1 5,-0.3 0.703 101.6 59.7-118.8 -52.2 8.8 29.8 -3.6 25 661 A G H X S+ 0 0 0 -4,-1.8 4,-1.4 1,-0.2 -2,-0.2 0.850 116.3 40.5 -48.9 -36.1 9.7 29.5 0.0 26 662 A I H < S+ 0 0 10 -4,-1.6 -1,-0.2 2,-0.2 9,-0.2 0.874 111.2 54.9 -79.3 -42.7 13.3 28.9 -1.3 27 663 A Q H > S+ 0 0 88 -5,-0.3 4,-1.0 1,-0.2 3,-0.3 0.880 114.6 42.9 -55.9 -40.6 13.1 31.6 -4.0 28 664 A F H X S+ 0 0 38 -4,-3.3 2,-1.7 1,-0.2 4,-1.1 0.832 99.6 69.0 -75.4 -39.0 12.1 34.1 -1.2 29 665 A L H < S+ 0 0 4 -4,-1.4 6,-2.1 -5,-0.3 -1,-0.2 -0.136 110.8 37.3 -76.0 42.4 14.7 32.8 1.3 30 666 A Q H 4 S+ 0 0 49 -2,-1.7 3,-0.5 -3,-0.3 -1,-0.2 0.245 100.9 67.4-156.9 -38.6 17.2 34.4 -1.0 31 667 A E H < S+ 0 0 115 -4,-1.0 -2,-0.2 1,-0.3 -3,-0.1 0.689 115.2 37.6 -63.4 -17.6 15.4 37.5 -2.3 32 668 A Q S < S- 0 0 105 -4,-1.1 -1,-0.3 3,-0.0 -3,-0.1 0.395 122.8-114.8-108.3 -7.6 16.0 38.4 1.4 33 669 A G S S+ 0 0 56 -3,-0.5 -3,-0.2 -5,-0.2 -4,-0.1 0.937 78.7 123.3 72.0 49.6 19.3 36.8 1.4 34 670 A X + 0 0 83 -6,-0.2 2,-0.3 -8,-0.1 -4,-0.2 0.677 63.5 46.0-109.8 -27.5 18.5 34.0 3.9 35 671 A L S S- 0 0 22 -6,-2.1 2,-0.4 -9,-0.2 -1,-0.1 -0.867 91.2 -95.0-120.2 152.7 19.4 30.8 1.9 36 672 A G - 0 0 20 -2,-0.3 5,-0.2 5,-0.2 9,-0.1 -0.503 22.0-144.6 -70.4 123.7 22.4 29.9 -0.2 37 673 A T S S+ 0 0 111 -2,-0.4 -1,-0.2 -7,-0.1 5,-0.0 0.844 84.2 78.2 -52.7 -37.5 21.9 30.5 -3.9 38 674 A S S S- 0 0 41 1,-0.1 4,-0.1 3,-0.0 3,-0.1 -0.104 92.3-116.9 -64.8 172.3 23.9 27.4 -4.6 39 675 A V S >> S+ 0 0 33 2,-0.2 3,-4.2 1,-0.2 4,-1.8 0.911 104.0 67.9 -81.7 -47.8 22.2 24.0 -4.2 40 676 A E T 34 S+ 0 0 76 1,-0.3 4,-0.3 2,-0.2 -1,-0.2 0.727 100.7 56.8 -45.7 -22.8 24.1 22.3 -1.3 41 677 A D T 3> S+ 0 0 42 2,-0.2 4,-2.3 -5,-0.2 -1,-0.3 0.649 106.0 48.4 -84.2 -18.4 22.5 25.0 0.8 42 678 A I H <> S+ 0 0 0 -3,-4.2 4,-2.0 2,-0.2 -2,-0.2 0.756 110.0 48.3 -91.1 -31.1 19.0 23.9 -0.3 43 679 A A H < S+ 0 0 0 -4,-1.8 -2,-0.2 2,-0.2 -3,-0.2 0.692 118.2 48.1 -77.1 -18.0 19.7 20.2 0.4 44 680 A Q H >> S+ 0 0 96 -5,-0.5 3,-1.7 -4,-0.3 4,-1.4 0.895 109.5 46.5 -85.3 -51.6 20.9 21.7 3.6 45 681 A F H >X S+ 0 0 19 -4,-2.3 3,-0.8 1,-0.3 4,-0.7 0.935 110.9 54.4 -57.0 -44.6 18.0 24.0 4.4 46 682 A L H 3< S+ 0 0 9 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.577 113.6 45.6 -63.7 -8.4 15.8 21.0 3.6 47 683 A H H <4 S+ 0 0 67 -3,-1.7 -2,-0.3 -5,-0.0 -1,-0.3 0.576 117.0 41.8-108.5 -18.2 18.0 19.4 6.2 48 684 A Q H << S+ 0 0 121 -4,-1.4 2,-1.6 -3,-0.8 -3,-0.2 0.927 98.6 55.9 -94.6 -76.2 17.9 22.2 8.8 49 685 A E >< - 0 0 33 -4,-0.7 2,-0.6 1,-0.2 3,-0.6 -0.443 63.3-172.4 -65.7 86.8 14.6 24.0 9.5 50 686 A E T 3 + 0 0 178 -2,-1.6 -1,-0.2 1,-0.3 4,-0.1 0.064 66.7 87.8 -74.8 28.0 12.4 21.0 10.4 51 687 A R T 3 + 0 0 120 -2,-0.6 2,-0.3 2,-0.1 -1,-0.3 0.061 66.0 118.1-107.2 22.0 9.2 22.9 10.5 52 688 A L S < S- 0 0 16 -3,-0.6 2,-0.2 1,-0.1 -36,-0.1 -0.669 85.8 -90.1 -87.6 141.2 9.0 22.1 6.8 53 689 A D >> - 0 0 57 -2,-0.3 4,-2.6 -38,-0.3 3,-2.4 -0.365 33.5-144.5 -55.5 114.0 6.1 20.0 5.5 54 690 A S T 34 S+ 0 0 56 1,-0.3 44,-2.2 -2,-0.2 -1,-0.2 0.518 102.6 43.8 -59.5 -6.8 7.5 16.5 5.8 55 691 A T T 3> S+ 0 0 47 42,-0.2 4,-0.9 2,-0.1 -1,-0.3 0.323 110.2 53.5-118.9 -1.7 5.5 15.7 2.6 56 692 A Q H <> S+ 0 0 30 -3,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.680 108.4 50.1-100.9 -30.9 6.5 18.9 0.8 57 693 A V H X S+ 0 0 4 -4,-2.6 4,-2.9 2,-0.2 -3,-0.2 0.887 108.0 57.6 -71.8 -39.7 10.1 18.2 1.4 58 694 A G H 4 S+ 0 0 0 -5,-0.3 -2,-0.2 1,-0.2 -1,-0.1 0.979 109.7 39.1 -52.3 -69.8 9.4 14.8 -0.0 59 695 A D H >< S+ 0 0 53 -4,-0.9 3,-1.1 1,-0.2 -1,-0.2 0.865 118.0 51.9 -49.7 -42.3 8.1 15.9 -3.4 60 696 A F H >< S+ 0 0 19 -4,-1.8 3,-1.3 1,-0.3 2,-0.5 0.983 102.6 55.2 -60.7 -60.7 10.7 18.7 -3.6 61 697 A L T 3< S+ 0 0 0 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.268 115.0 44.2 -59.2 16.6 13.8 16.5 -2.9 62 698 A G T < S+ 0 0 1 -3,-1.1 -1,-0.3 -2,-0.5 -2,-0.2 0.079 79.3 118.9-155.2 38.0 12.7 14.3 -5.8 63 699 A D S < S- 0 0 78 -3,-1.3 6,-0.1 2,-0.1 -3,-0.0 -0.432 71.1-104.6 -98.6 177.9 11.5 16.2 -8.9 64 700 A S S S+ 0 0 67 -2,-0.1 2,-0.4 4,-0.1 -1,-0.0 0.081 76.1 122.3 -91.9 24.4 12.9 16.3 -12.4 65 701 A A >> - 0 0 38 1,-0.1 4,-2.3 2,-0.0 3,-1.2 -0.731 66.5-134.1 -91.3 133.9 14.6 19.7 -12.2 66 702 A R T 34 S+ 0 0 189 -2,-0.4 4,-0.3 1,-0.3 -1,-0.1 0.840 114.1 53.0 -48.8 -36.1 18.4 19.9 -12.8 67 703 A F T 3> S+ 0 0 93 1,-0.1 4,-1.7 2,-0.1 -1,-0.3 0.822 113.3 45.3 -69.0 -32.9 18.4 22.0 -9.7 68 704 A N H <> S+ 0 0 13 -3,-1.2 4,-2.3 2,-0.2 5,-0.4 0.925 97.8 61.7 -78.9 -54.0 16.5 19.2 -7.8 69 705 A K H < S+ 0 0 112 -4,-2.3 -1,-0.2 1,-0.2 4,-0.1 0.649 120.7 34.5 -51.0 -13.6 18.3 15.9 -8.8 70 706 A E H > S+ 0 0 99 -5,-0.4 4,-3.8 -4,-0.3 5,-0.4 0.749 106.8 62.0-106.9 -45.7 21.2 17.7 -7.1 71 707 A V H < S+ 0 0 0 -4,-1.7 -2,-0.2 1,-0.3 -3,-0.2 0.765 115.0 42.5 -52.9 -22.6 19.5 19.7 -4.3 72 708 A X T X S+ 0 0 6 -4,-2.3 4,-2.3 2,-0.2 3,-0.3 0.797 108.5 56.2 -91.8 -36.7 18.6 16.1 -3.4 73 709 A Y H > S+ 0 0 78 -5,-0.4 4,-2.1 1,-0.3 -2,-0.2 0.916 107.6 49.2 -61.5 -42.1 22.1 14.7 -4.0 74 710 A A H < S+ 0 0 16 -4,-3.8 -1,-0.3 1,-0.2 -2,-0.2 0.710 112.6 50.9 -67.4 -19.2 23.5 17.3 -1.6 75 711 A Y H >4 S+ 0 0 1 -5,-0.4 3,-0.8 -3,-0.3 4,-0.4 0.777 109.1 48.2 -86.4 -31.7 20.8 16.0 0.7 76 712 A V H 3< S+ 0 0 1 -4,-2.3 3,-0.3 1,-0.2 -2,-0.2 0.784 112.0 51.0 -77.0 -28.5 21.8 12.4 0.1 77 713 A D T 3< S+ 0 0 54 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.1 -0.093 100.8 62.2-100.0 31.3 25.4 13.3 0.8 78 714 A Q S < S+ 0 0 84 -3,-0.8 2,-0.7 1,-0.1 -1,-0.2 0.411 90.7 78.2-122.9 -20.7 24.5 15.1 4.0 79 715 A L S S- 0 0 23 -4,-0.4 2,-0.4 -3,-0.3 -1,-0.1 -0.841 77.4-147.0 -95.7 113.9 23.2 11.8 5.5 80 716 A D - 0 0 107 -2,-0.7 -3,-0.1 1,-0.1 37,-0.0 -0.658 21.3-179.6 -85.1 132.8 26.0 9.6 6.7 81 717 A F > + 0 0 12 -2,-0.4 3,-0.8 36,-0.1 2,-0.5 -0.221 33.4 150.1-118.7 35.4 25.6 5.8 6.4 82 718 A C T 3 - 0 0 47 1,-0.2 3,-0.1 38,-0.1 -2,-0.1 -0.641 68.7 -7.8 -79.7 118.4 29.0 5.3 7.9 83 719 A E T 3 S+ 0 0 194 -2,-0.5 2,-0.3 1,-0.2 -1,-0.2 0.729 107.3 108.2 71.3 30.2 29.4 2.1 9.9 84 720 A K S < S- 0 0 67 -3,-0.8 -1,-0.2 2,-0.0 5,-0.1 -0.984 70.2 -99.1-139.0 147.4 25.7 0.9 9.8 85 721 A E >> - 0 0 120 -2,-0.3 3,-1.4 1,-0.1 4,-1.3 -0.193 39.5-105.1 -63.1 153.2 23.6 -1.8 8.1 86 722 A F H 3> S+ 0 0 1 1,-0.3 4,-1.9 2,-0.2 5,-0.3 0.878 117.1 61.1 -41.7 -56.6 21.6 -1.1 5.0 87 723 A V H 3> S+ 0 0 7 1,-0.2 4,-2.6 2,-0.2 -1,-0.3 0.824 105.3 50.2 -42.1 -42.5 18.2 -1.1 6.9 88 724 A S H <> S+ 0 0 43 -3,-1.4 4,-4.4 2,-0.2 5,-0.5 0.967 104.2 53.6 -64.6 -58.1 19.4 1.8 9.0 89 725 A A H X S+ 0 0 0 -4,-1.3 4,-1.6 1,-0.3 5,-0.2 0.925 115.2 43.2 -41.1 -56.8 20.6 4.1 6.2 90 726 A L H >X S+ 0 0 0 -4,-1.9 4,-3.7 2,-0.2 3,-0.6 0.954 115.8 49.7 -54.1 -53.5 17.2 3.7 4.7 91 727 A R H 3< S+ 0 0 51 -4,-2.6 -2,-0.2 -5,-0.3 -1,-0.2 0.946 119.4 36.1 -49.3 -58.1 15.6 4.1 8.2 92 728 A T H 3< S+ 0 0 60 -4,-4.4 3,-0.3 1,-0.2 -1,-0.3 0.547 121.6 48.3 -77.6 -7.9 17.6 7.2 8.9 93 729 A F H X< S+ 0 0 0 -4,-1.6 2,-2.0 -3,-0.6 3,-1.9 0.888 107.3 52.0 -91.3 -57.6 17.4 8.5 5.3 94 730 A L T 3< S+ 0 0 15 -4,-3.7 5,-0.2 1,-0.3 -1,-0.2 -0.161 99.2 69.3 -73.6 43.6 13.7 8.0 4.8 95 731 A E T 3 S+ 0 0 114 -2,-2.0 -1,-0.3 -3,-0.3 -2,-0.1 0.275 77.9 74.3-138.2 -2.9 13.0 9.9 7.9 96 732 A G S < S- 0 0 26 -3,-1.9 2,-0.3 1,-0.1 -2,-0.1 0.480 118.2 -9.0 -89.7 -5.0 14.1 13.3 6.7 97 733 A F S S- 0 0 12 -4,-0.2 2,-0.5 -40,-0.1 -42,-0.2 -0.942 82.4 -87.9-170.6-178.3 10.9 13.4 4.6 98 734 A R - 0 0 146 -44,-2.2 -39,-0.1 -2,-0.3 -3,-0.1 -0.954 44.1-111.3-117.4 120.1 7.9 11.2 3.5 99 735 A L - 0 0 54 -2,-0.5 2,-0.2 -5,-0.2 -40,-0.1 -0.184 33.8-129.2 -50.1 124.5 8.2 9.1 0.4 100 736 A P - 0 0 9 0, 0.0 2,-0.9 0, 0.0 6,-0.2 -0.476 11.9-123.0 -79.5 144.3 5.9 10.3 -2.5 101 737 A G S S+ 0 0 82 -2,-0.2 2,-0.6 4,-0.1 -2,-0.0 -0.054 76.8 115.2 -78.1 36.4 3.5 8.0 -4.4 102 738 A E >> - 0 0 85 -2,-0.9 4,-2.1 1,-0.1 3,-1.1 -0.935 54.1-157.9-112.5 110.3 5.2 9.0 -7.7 103 739 A A H 3> S+ 0 0 86 -2,-0.6 4,-1.2 1,-0.3 -1,-0.1 0.818 90.7 52.4 -53.2 -44.7 7.0 6.0 -9.3 104 740 A Q H 34 S+ 0 0 141 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.700 113.2 48.3 -68.8 -18.5 9.4 7.9 -11.5 105 741 A K H X> S+ 0 0 13 -3,-1.1 4,-1.6 2,-0.2 3,-1.4 0.887 100.3 58.7 -88.7 -47.6 10.5 9.8 -8.3 106 742 A I H 3X S+ 0 0 22 -4,-2.1 4,-3.4 1,-0.3 5,-0.3 0.926 105.1 54.4 -47.4 -49.8 11.1 7.0 -5.8 107 743 A D H 3X S+ 0 0 37 -4,-1.2 4,-0.6 1,-0.2 -1,-0.3 0.733 101.7 58.8 -58.7 -26.3 13.6 5.5 -8.2 108 744 A R H <> S+ 0 0 36 -3,-1.4 4,-1.8 -4,-0.2 3,-0.5 0.976 115.7 32.8 -67.9 -53.7 15.6 8.8 -8.3 109 745 A L H X S+ 0 0 1 -4,-1.6 4,-0.5 1,-0.2 5,-0.2 0.886 118.7 54.2 -67.9 -41.2 16.2 8.8 -4.6 110 746 A X H X S+ 0 0 1 -4,-3.4 4,-0.6 -5,-0.3 -1,-0.2 0.587 109.7 50.0 -70.1 -11.8 16.4 5.0 -4.4 111 747 A E H X S+ 0 0 108 -4,-0.6 4,-2.4 -3,-0.5 -1,-0.2 0.815 116.5 38.0 -92.5 -39.8 19.0 5.2 -7.1 112 748 A K H < S+ 0 0 51 -4,-1.8 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