==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PROTEIN TRANSPORT/VIRAL PROTEIN 24-SEP-10 2XS1 . COMPND 2 MOLECULE: PROGRAMMED CELL DEATH 6-INTERACTING PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Q.ZHAI,M.LANDESMAN,H.ROBINSON,W.I.SUNDQUIST,C.P.HILL . 712 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 38907.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 561 78.8 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 . 7 1.0 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 . 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 . 25 3.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 60 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 454 63.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.1 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 0 1 1 0 0 3 0 1 0 0 0 0 1 0 0 1 3 0 1 0 1 1 0 1 1 5 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 . 1 0 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 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 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 2 A A 0 0 130 0, 0.0 2,-0.7 0, 0.0 293,-0.1 0.000 360.0 360.0 360.0 78.6 2.0 -22.5 -17.7 2 3 A T + 0 0 55 241,-0.1 2,-0.4 293,-0.1 291,-0.0 -0.839 360.0 167.3-108.1 103.5 1.4 -23.1 -21.4 3 4 A F - 0 0 29 -2,-0.7 2,-0.3 132,-0.2 132,-0.0 -0.861 35.8-115.9-110.0 144.7 -1.6 -25.2 -22.3 4 5 A I + 0 0 12 -2,-0.4 2,-0.3 185,-0.1 131,-0.1 -0.620 36.4 176.0 -79.3 134.4 -3.0 -25.4 -25.9 5 6 A S - 0 0 55 -2,-0.3 2,-0.4 129,-0.1 123,-0.1 -0.904 23.6-122.4-130.1 169.1 -6.4 -24.0 -26.5 6 7 A V - 0 0 5 122,-0.5 126,-0.2 -2,-0.3 2,-0.2 -0.882 19.9-124.5-115.2 139.5 -8.5 -23.6 -29.7 7 8 A Q - 0 0 113 -2,-0.4 2,-0.1 1,-0.1 121,-0.1 -0.509 33.7-101.9 -81.4 148.3 -10.1 -20.5 -31.1 8 9 A L - 0 0 9 -2,-0.2 2,-0.1 120,-0.1 -1,-0.1 -0.426 32.7-115.1 -69.8 140.6 -13.8 -20.2 -31.9 9 10 A K - 0 0 6 112,-0.2 2,-0.3 -2,-0.1 87,-0.1 -0.442 27.5-128.7 -65.3 143.7 -15.2 -20.5 -35.4 10 11 A K - 0 0 135 85,-0.4 85,-3.0 -2,-0.1 2,-0.3 -0.791 26.8-178.8 -96.3 142.5 -16.8 -17.4 -37.0 11 12 A T B -A 94 0A 19 42,-0.4 2,-0.3 -2,-0.3 83,-0.2 -0.987 25.9-120.6-136.3 147.7 -20.3 -17.6 -38.5 12 13 A S - 0 0 42 81,-2.0 81,-0.4 -2,-0.3 2,-0.1 -0.643 39.9-101.5 -83.4 145.6 -22.5 -15.0 -40.3 13 14 A E - 0 0 131 -2,-0.3 2,-0.3 79,-0.1 -1,-0.1 -0.427 43.0-175.1 -63.6 135.7 -25.9 -14.2 -38.8 14 15 A V - 0 0 27 -2,-0.1 2,-1.0 32,-0.1 36,-0.1 -0.961 34.9-101.1-131.9 154.3 -28.8 -15.9 -40.6 15 16 A D + 0 0 76 -2,-0.3 31,-0.0 1,-0.2 -2,-0.0 -0.625 37.8 179.0 -78.2 102.2 -32.5 -15.6 -40.0 16 17 A L S > S+ 0 0 6 -2,-1.0 4,-0.7 2,-0.1 -1,-0.2 0.922 74.0 51.0 -72.0 -46.9 -33.5 -18.8 -38.0 17 18 A A H >> S+ 0 0 8 1,-0.2 4,-2.7 26,-0.2 3,-1.9 0.966 95.6 70.6 -53.1 -61.6 -37.2 -18.1 -37.6 18 19 A K H 3> S+ 0 0 117 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.719 104.4 33.3 -30.6 -69.9 -38.1 -17.4 -41.3 19 20 A P H 3> S+ 0 0 15 0, 0.0 4,-1.4 0, 0.0 -1,-0.3 0.737 123.0 52.9 -67.0 -16.9 -37.8 -20.8 -43.0 20 21 A L H < S+ 0 0 0 -4,-3.0 3,-0.8 1,-0.2 -2,-0.2 0.917 108.8 38.5 -46.0 -56.5 -44.7 -24.1 -39.2 25 26 A Q H >< S+ 0 0 97 -4,-2.5 3,-1.5 1,-0.2 -1,-0.2 0.869 108.6 62.5 -69.1 -37.7 -47.8 -22.4 -40.6 26 27 A Q H 3< S+ 0 0 131 -4,-1.7 -1,-0.2 -5,-0.3 -2,-0.2 0.781 110.5 41.5 -53.9 -27.4 -47.9 -24.5 -43.8 27 28 A T T << S+ 0 0 51 -4,-1.2 -1,-0.3 -3,-0.8 -2,-0.2 0.253 114.5 45.0-110.8 11.2 -48.4 -27.5 -41.5 28 29 A Y S < S- 0 0 45 -3,-1.5 2,-0.3 -5,-0.1 3,-0.0 -0.791 90.8 -63.7-148.5-177.8 -50.9 -26.3 -38.9 29 30 A P > - 0 0 65 0, 0.0 3,-1.0 0, 0.0 6,-0.4 -0.585 51.3-111.8 -82.1 134.6 -54.1 -24.4 -38.2 30 31 A S T 3 S- 0 0 123 -2,-0.3 3,-0.1 1,-0.3 4,-0.0 -0.425 106.9 -1.2 -59.6 128.8 -54.3 -20.7 -39.0 31 32 A G T 3 S+ 0 0 69 1,-0.2 -1,-0.3 -2,-0.1 5,-0.1 0.261 105.0 145.0 70.3 -16.1 -54.5 -18.9 -35.7 32 33 A G X> - 0 0 17 -3,-1.0 4,-1.0 1,-0.1 3,-0.7 -0.137 68.5-105.3 -52.6 149.6 -54.4 -22.4 -34.2 33 34 A E H 3> S+ 0 0 150 1,-0.2 4,-1.2 2,-0.2 5,-0.3 0.663 111.0 79.0 -56.8 -18.6 -52.6 -22.8 -30.9 34 35 A E H >> S+ 0 0 59 1,-0.2 4,-3.0 2,-0.2 3,-1.8 0.984 96.9 42.0 -51.1 -66.6 -49.7 -24.5 -32.7 35 36 A Q H <>>S+ 0 0 33 -3,-0.7 4,-1.3 -6,-0.4 5,-0.9 0.891 102.9 72.4 -43.7 -46.2 -48.3 -21.2 -33.9 36 37 A A H 3<5S+ 0 0 46 -4,-1.0 -1,-0.3 1,-0.2 -2,-0.2 0.795 120.1 11.4 -43.1 -39.6 -49.1 -19.8 -30.4 37 38 A Q H X5S+ 0 0 22 -4,-3.0 4,-2.6 -5,-0.3 3,-0.8 0.930 110.6 45.6 -61.1 -51.8 -44.2 -23.1 -32.0 39 40 A C H 3X5S+ 0 0 17 -4,-1.3 4,-1.1 -5,-0.3 -1,-0.2 0.811 112.6 54.1 -62.2 -28.3 -43.7 -19.8 -33.7 40 41 A R H 3>S+ 0 0 100 -4,-2.1 4,-2.6 1,-0.2 5,-1.0 0.919 114.7 46.6 -56.7 -43.6 -27.3 -15.0 -32.4 51 52 A A H <5S+ 0 0 20 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.851 115.6 44.6 -68.2 -35.9 -26.5 -15.2 -28.6 52 53 A A H <5S+ 0 0 13 -4,-2.9 -1,-0.2 14,-0.2 -2,-0.2 0.620 133.9 13.5 -84.0 -14.5 -24.4 -18.4 -28.9 53 54 A V H <5S+ 0 0 18 -4,-1.4 -42,-0.4 -3,-0.3 -3,-0.2 0.545 119.9 56.4-140.1 -20.4 -22.4 -17.3 -32.0 54 55 A G T <5S+ 0 0 59 -4,-2.6 -3,-0.2 -5,-0.5 -4,-0.1 0.814 85.8 96.4 -88.8 -33.8 -22.8 -13.6 -32.8 55 56 A R S - 0 0 110 -2,-2.8 4,-2.1 1,-0.1 3,-0.3 -0.908 69.0-131.4-118.1 132.8 -17.7 -17.4 -18.8 61 62 A E H > S+ 0 0 112 -2,-0.4 4,-3.1 1,-0.2 5,-0.2 0.828 112.3 58.7 -54.9 -30.0 -19.5 -20.7 -17.9 62 63 A G H > S+ 0 0 34 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.962 106.7 45.6 -58.9 -53.0 -22.7 -18.8 -18.6 63 64 A A H > S+ 0 0 29 -3,-0.3 4,-1.2 1,-0.2 -2,-0.2 0.805 113.4 51.4 -58.9 -30.9 -21.5 -18.1 -22.2 64 65 A L H X S+ 0 0 5 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.931 108.5 49.4 -75.5 -44.8 -20.5 -21.8 -22.4 65 66 A E H X S+ 0 0 28 -4,-3.1 4,-4.1 2,-0.2 5,-0.3 0.885 107.2 55.9 -55.8 -40.8 -23.9 -23.1 -21.3 66 67 A T H X S+ 0 0 23 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.894 111.0 44.8 -59.5 -40.2 -25.6 -20.8 -23.8 67 68 A L H X S+ 0 0 6 -4,-1.2 4,-2.0 2,-0.2 -2,-0.2 0.886 115.0 47.6 -69.0 -43.4 -23.5 -22.5 -26.5 68 69 A L H X S+ 0 0 13 -4,-2.5 4,-2.7 2,-0.2 279,-0.3 0.952 111.5 50.4 -64.0 -49.7 -24.2 -25.9 -25.1 69 70 A R H X S+ 0 0 95 -4,-4.1 4,-3.1 1,-0.2 5,-0.3 0.951 109.5 51.8 -52.7 -49.2 -27.9 -25.2 -24.9 70 71 A Y H X S+ 0 0 0 -4,-2.4 4,-2.3 -5,-0.3 -1,-0.2 0.876 108.9 49.6 -57.8 -37.9 -27.8 -24.0 -28.5 71 72 A Y H X S+ 0 0 9 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.915 113.5 48.0 -65.2 -40.4 -26.1 -27.3 -29.5 72 73 A D H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.971 114.0 44.0 -60.1 -57.2 -28.8 -29.2 -27.6 73 74 A Q H X S+ 0 0 7 -4,-3.1 4,-0.8 2,-0.2 -2,-0.2 0.923 111.9 52.9 -56.2 -49.7 -31.7 -27.3 -29.0 74 75 A I H >X S+ 0 0 3 -4,-2.3 3,-1.2 -5,-0.3 4,-0.7 0.937 112.1 46.1 -53.9 -48.2 -30.3 -27.4 -32.6 75 76 A C H >< S+ 0 0 22 -4,-2.2 3,-0.8 1,-0.2 -1,-0.2 0.882 106.8 59.1 -56.9 -40.5 -30.0 -31.2 -32.2 76 77 A S H 3< S+ 0 0 24 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.619 102.7 55.5 -70.1 -9.8 -33.5 -31.5 -30.7 77 78 A I H X< S+ 0 0 3 -3,-1.2 3,-1.7 -4,-0.8 4,-0.5 0.720 79.4 88.4 -94.1 -26.9 -34.9 -29.9 -33.9 78 79 A E G X< S+ 0 0 83 -3,-0.8 3,-0.8 -4,-0.7 5,-0.4 0.803 91.1 43.7 -47.4 -44.8 -33.6 -32.3 -36.6 79 80 A P G 3 S+ 0 0 68 0, 0.0 281,-1.8 0, 0.0 282,-0.5 0.693 109.3 59.1 -74.1 -18.9 -36.5 -34.9 -36.5 80 81 A K G < S+ 0 0 21 -3,-1.7 -2,-0.2 279,-0.2 278,-0.1 0.321 102.8 50.0-103.6 6.5 -39.2 -32.2 -36.4 81 82 A F S < S- 0 0 8 -3,-0.8 2,-1.5 -4,-0.5 3,-0.3 -0.991 83.7-117.8-142.1 147.8 -38.4 -30.3 -39.6 82 83 A P > + 0 0 26 0, 0.0 4,-0.8 0, 0.0 6,-0.5 -0.217 56.6 142.0 -81.5 47.3 -37.9 -31.7 -43.2 83 84 A F T >4 + 0 0 28 -2,-1.5 3,-0.9 -5,-0.4 5,-0.2 0.866 57.2 74.1 -52.5 -41.6 -34.2 -30.6 -43.7 84 85 A S T 34 S+ 0 0 123 -3,-0.3 -1,-0.2 1,-0.3 0, 0.0 0.851 96.1 43.7 -44.3 -59.6 -33.3 -33.8 -45.6 85 86 A E T 34 S- 0 0 125 -3,-0.4 -1,-0.3 1,-0.1 -2,-0.2 0.813 98.0-146.8 -59.0 -30.9 -35.0 -33.0 -48.9 86 87 A N << + 0 0 67 -3,-0.9 -1,-0.1 -4,-0.8 -2,-0.1 0.412 67.4 120.9 78.7 -0.9 -33.6 -29.5 -48.6 87 88 A Q S S+ 0 0 184 -5,-0.3 2,-1.2 1,-0.2 -4,-0.1 0.813 70.2 75.2 -56.9 -27.0 -36.6 -27.8 -50.3 88 89 A I S S- 0 0 28 -6,-0.5 2,-0.8 -5,-0.2 -1,-0.2 -0.765 81.6-172.9 -79.3 94.5 -36.4 -26.3 -46.8 89 90 A C + 0 0 73 -2,-1.2 2,-0.4 2,-0.0 25,-0.1 -0.841 24.5 150.3-107.9 106.8 -33.4 -24.1 -47.4 90 91 A L - 0 0 17 -2,-0.8 2,-0.4 23,-0.2 -74,-0.0 -0.996 36.4-142.3-120.6 128.8 -31.8 -22.2 -44.6 91 92 A T - 0 0 76 -2,-0.4 2,-0.5 22,-0.1 22,-0.3 -0.825 7.7-154.5-104.2 131.5 -28.1 -21.6 -45.2 92 93 A F E - B 0 112A 3 20,-2.6 20,-3.3 -2,-0.4 2,-0.6 -0.887 7.7-164.2-105.6 124.7 -25.3 -21.8 -42.6 93 94 A T E + B 0 111A 27 -2,-0.5 -81,-2.0 -81,-0.4 2,-0.3 -0.907 15.4 165.6-114.8 110.0 -22.1 -19.9 -43.2 94 95 A W E -AB 11 110A 0 16,-2.3 16,-2.0 -2,-0.6 2,-0.3 -0.874 23.1-141.5-118.7 156.7 -19.0 -20.6 -41.1 95 96 A K E - B 0 109A 49 -85,-3.0 -85,-0.4 -2,-0.3 14,-0.2 -0.780 35.6 -90.9-109.8 156.4 -15.3 -19.7 -41.4 96 97 A D > - 0 0 6 12,-2.1 3,-0.5 -2,-0.3 -86,-0.1 -0.444 27.1-140.6 -64.7 134.6 -12.3 -21.9 -40.6 97 98 A A T 3 S+ 0 0 20 1,-0.2 -1,-0.1 -2,-0.1 -90,-0.0 0.853 102.2 35.4 -60.5 -34.9 -11.1 -21.4 -37.0 98 99 A F T 3 S- 0 0 25 137,-0.1 -1,-0.2 2,-0.1 3,-0.1 0.342 105.1-118.4-104.9 1.9 -7.5 -21.6 -38.2 99 100 A D < + 0 0 93 -3,-0.5 2,-0.4 1,-0.2 6,-0.2 0.881 61.9 158.2 55.1 38.4 -7.6 -19.8 -41.6 100 101 A K + 0 0 46 8,-0.1 76,-0.5 135,-0.1 2,-0.3 -0.775 13.5 167.8 -97.2 137.6 -6.4 -23.1 -43.0 101 102 A G - 0 0 42 -2,-0.4 4,-0.1 4,-0.1 74,-0.0 -0.998 42.8-134.7-149.3 145.8 -7.0 -24.0 -46.7 102 103 A S S S+ 0 0 122 -2,-0.3 2,-0.3 2,-0.1 -1,-0.1 0.786 99.3 58.4 -69.4 -27.8 -5.8 -26.7 -49.1 103 104 A L S S- 0 0 150 -3,-0.1 2,-0.4 1,-0.0 -2,-0.0 -0.799 105.6 -94.5-102.6 149.0 -5.3 -23.8 -51.7 104 105 A F S S+ 0 0 202 -2,-0.3 2,-0.2 -4,-0.0 -2,-0.1 -0.459 76.2 96.1 -73.7 117.9 -3.0 -20.9 -50.9 105 106 A G S S- 0 0 75 -2,-0.4 -4,-0.1 -6,-0.2 3,-0.1 -0.864 74.4 -94.0-168.3-160.9 -4.8 -17.9 -49.4 106 107 A G S S+ 0 0 57 1,-0.3 2,-0.3 -2,-0.2 -1,-0.1 0.865 93.2 5.8-100.3 -59.6 -5.6 -16.2 -46.1 107 108 A S - 0 0 67 -7,-0.0 2,-0.4 -12,-0.0 -1,-0.3 -0.978 58.0-153.1-134.5 142.8 -9.1 -17.4 -45.0 108 109 A V - 0 0 59 -2,-0.3 -12,-2.1 -8,-0.1 2,-0.2 -0.956 12.9-171.2-121.1 134.0 -11.6 -20.0 -46.2 109 110 A K E -B 95 0A 130 -2,-0.4 2,-0.3 -14,-0.2 -14,-0.2 -0.691 4.7-166.6-118.0 167.6 -15.3 -19.8 -45.7 110 111 A L E -B 94 0A 14 -16,-2.0 -16,-2.3 -2,-0.2 2,-0.5 -0.834 5.0-166.2-161.7 116.9 -18.1 -22.3 -46.4 111 112 A A E +B 93 0A 47 -18,-0.3 2,-0.4 -2,-0.3 -18,-0.3 -0.931 18.0 169.9-104.9 125.2 -21.9 -21.8 -46.4 112 113 A L E -B 92 0A 27 -20,-3.3 -20,-2.6 -2,-0.5 2,-0.3 -1.000 36.6-143.3-135.6 140.0 -24.0 -25.0 -46.3 113 114 A A + 0 0 19 -2,-0.4 2,-0.5 -22,-0.3 -23,-0.2 -0.187 68.3 115.6 -89.1 40.8 -27.8 -25.5 -45.9 114 115 A S >> - 0 0 30 -2,-0.3 4,-1.8 -22,-0.2 3,-1.2 -0.954 58.5-154.3-115.6 117.4 -27.1 -28.7 -43.9 115 116 A L H 3> S+ 0 0 8 -2,-0.5 4,-2.7 1,-0.3 5,-0.2 0.800 98.1 64.7 -59.0 -28.7 -28.1 -28.8 -40.2 116 117 A G H 3> S+ 0 0 6 53,-0.3 4,-1.7 2,-0.2 -1,-0.3 0.872 102.2 48.4 -58.9 -38.6 -25.4 -31.4 -39.9 117 118 A Y H <> S+ 0 0 0 -3,-1.2 4,-2.1 52,-0.3 -2,-0.2 0.942 110.7 49.5 -68.9 -49.2 -22.8 -28.7 -40.8 118 119 A E H X S+ 0 0 0 -4,-1.8 4,-2.4 1,-0.2 -2,-0.2 0.907 110.2 52.7 -50.7 -47.4 -24.3 -26.3 -38.3 119 120 A K H X S+ 0 0 47 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.879 108.4 49.0 -59.9 -44.0 -24.2 -29.0 -35.6 120 121 A S H X S+ 0 0 4 -4,-1.7 4,-2.6 2,-0.2 -1,-0.2 0.925 112.0 48.0 -64.7 -44.6 -20.5 -29.8 -36.1 121 122 A C H X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 -112,-0.2 0.897 111.6 49.7 -65.4 -40.9 -19.5 -26.1 -36.0 122 123 A V H X S+ 0 0 0 -4,-2.4 4,-1.9 -5,-0.2 -1,-0.2 0.928 112.2 47.6 -62.7 -45.0 -21.5 -25.4 -32.8 123 124 A L H X S+ 0 0 2 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.929 109.5 54.2 -63.0 -43.9 -20.0 -28.5 -31.1 124 125 A F H X S+ 0 0 0 -4,-2.6 4,-3.7 1,-0.2 5,-0.2 0.937 108.8 47.9 -53.0 -52.5 -16.5 -27.4 -32.2 125 126 A N H X S+ 0 0 4 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.839 109.6 54.0 -57.7 -35.2 -17.1 -24.0 -30.6 126 127 A C H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.921 113.0 42.9 -61.6 -45.4 -18.3 -25.8 -27.5 127 128 A A H X S+ 0 0 0 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.947 115.8 48.3 -65.8 -46.5 -15.0 -27.8 -27.5 128 129 A A H X S+ 0 0 0 -4,-3.7 4,-1.6 1,-0.2 -122,-0.5 0.906 112.5 47.5 -65.3 -41.7 -12.9 -24.7 -28.3 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482 483 A E H X4 S+ 0 0 112 -3,-0.9 3,-0.8 1,-0.2 -1,-0.2 0.918 114.0 50.4 -65.2 -47.0 -44.8 -11.1 -61.7 483 484 A L H 3< S+ 0 0 66 -4,-1.8 4,-0.4 1,-0.2 -1,-0.2 0.798 110.4 51.7 -62.3 -28.6 -46.1 -11.4 -58.1 484 485 A Y H 3X S+ 0 0 0 -4,-2.4 4,-2.4 -5,-0.2 5,-0.3 0.585 77.7 94.8 -92.7 -11.3 -49.6 -12.5 -59.3 485 486 A K H > S+ 0 0 86 0, 0.0 4,-1.8 0, 0.0 3,-0.7 0.968 111.5 44.7 -58.6 -55.3 -49.1 -18.0 -58.8 487 488 A L H 3> S+ 0 0 17 -4,-0.4 4,-2.8 1,-0.3 -2,-0.2 0.861 112.5 52.8 -60.5 -34.8 -52.6 -16.9 -57.9 488 489 A R H 3X S+ 0 0 54 -4,-2.4 4,-2.0 2,-0.2 -1,-0.3 0.758 103.5 58.0 -71.8 -23.6 -53.5 -16.7 -61.5 489 490 A A H X S+ 0 0 66 -4,-1.8 4,-2.5 2,-0.2 3,-1.3 0.989 108.8 57.1 -59.3 -59.8 -54.8 -21.2 -59.2 491 492 A G H 3X S+ 0 0 2 -4,-2.8 4,-2.4 1,-0.3 -2,-0.2 0.837 105.5 49.8 -33.1 -52.7 -57.4 -19.2 -61.1 492 493 A T H 3X S+ 0 0 69 -4,-2.0 4,-1.6 2,-0.2 -1,-0.3 0.829 111.0 49.2 -67.8 -31.7 -56.9 -21.2 -64.3 493 494 A N H X S+ 0 0 34 -4,-2.1 4,-1.7 -3,-0.4 3,-0.7 0.888 110.4 47.6 -69.3 -42.1 -83.4 -36.0 -65.7 513 514 A Q H 3< S+ 0 0 119 -4,-2.7 4,-0.4 1,-0.2 -2,-0.2 0.789 108.2 58.5 -71.8 -22.9 -85.5 -34.8 -68.6 514 515 A S T 3< S+ 0 0 85 -4,-1.4 -1,-0.2 -5,-0.3 -2,-0.2 0.658 119.8 27.0 -78.2 -15.9 -85.2 -38.3 -70.1 515 516 A H T <> S+ 0 0 50 -3,-0.7 4,-1.8 -4,-0.5 -2,-0.2 0.511 91.2 97.4-122.4 -3.3 -86.8 -39.8 -66.9 516 517 A R H X S+ 0 0 81 -4,-1.7 4,-2.8 1,-0.2 5,-0.2 0.900 81.7 54.2 -51.7 -48.4 -89.0 -37.0 -65.5 517 518 A D H > S+ 0 0 123 -4,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.919 109.6 45.0 -58.6 -48.3 -92.3 -38.2 -67.1 518 519 A T H > S+ 0 0 46 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.873 113.1 51.5 -67.6 -34.9 -92.2 -41.7 -65.7 519 520 A I H X S+ 0 0 1 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.912 105.6 55.4 -65.0 -43.0 -91.2 -40.5 -62.3 520 521 A V H < S+ 0 0 31 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.918 110.1 47.5 -51.3 -46.3 -94.1 -38.0 -62.3 521 522 A L H >< S+ 0 0 41 -4,-2.0 3,-2.5 1,-0.2 -2,-0.2 0.949 105.4 57.7 -59.5 -49.6 -96.4 -41.1 -62.9 522 523 A L H 3< S+ 0 0 0 -4,-2.5 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0.541 78.1 69.9 -59.2 -3.7 -100.0 -70.5 -62.3 542 543 A M G < S+ 0 0 29 -3,-1.6 2,-1.2 1,-0.1 -1,-0.3 0.811 79.8 79.9 -81.2 -34.7 -99.2 -67.7 -59.9 543 544 A Q S < S- 0 0 151 -3,-1.9 -1,-0.1 1,-0.2 -3,-0.0 -0.620 119.8 -22.1 -84.9 93.5 -100.8 -69.4 -56.9 544 545 A G S S+ 0 0 62 -2,-1.2 -1,-0.2 1,-0.3 -2,-0.1 0.196 87.0 153.8 101.4 -16.6 -98.4 -72.0 -55.5 545 546 A S > - 0 0 24 -4,-0.3 4,-1.5 -5,-0.3 -1,-0.3 -0.052 46.0-130.5 -47.3 147.0 -96.2 -72.6 -58.5 546 547 A E H > S+ 0 0 142 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.947 103.9 54.0 -66.1 -54.7 -92.7 -73.8 -57.8 547 548 A V H > S+ 0 0 22 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.834 107.3 55.4 -50.1 -35.7 -90.8 -71.4 -60.0 548 549 A V H > S+ 0 0 9 -7,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.942 110.2 42.5 -66.8 -48.6 -92.6 -68.6 -58.2 549 550 A N H X S+ 0 0 83 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.904 115.9 49.6 -64.5 -41.1 -91.4 -69.7 -54.7 550 551 A V H X S+ 0 0 57 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.952 114.3 44.7 -59.4 -51.5 -87.9 -70.4 -56.0 551 552 A L H X S+ 0 0 0 -4,-2.7 4,-2.8 -5,-0.3 -2,-0.2 0.897 111.8 54.4 -59.8 -41.2 -87.7 -67.0 -57.6 552 553 A K H X S+ 0 0 133 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.898 108.9 46.2 -62.6 -43.7 -89.2 -65.4 -54.5 553 554 A S H X S+ 0 0 62 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.939 112.2 51.0 -67.0 -45.9 -86.6 -66.8 -52.2 554 555 A L H X S+ 0 0 15 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.945 113.5 46.6 -51.3 -49.5 -83.8 -65.8 -54.5 555 556 A L H X S+ 0 0 18 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.857 109.9 52.3 -64.0 -38.2 -85.3 -62.3 -54.6 556 557 A S H X S+ 0 0 55 -4,-2.5 4,-1.5 2,-0.2 -1,-0.2 0.927 112.6 45.5 -63.3 -44.7 -85.7 -62.2 -50.8 557 558 A N H X S+ 0 0 64 -4,-2.6 4,-2.7 2,-0.2 3,-0.3 0.932 110.3 52.3 -64.1 -49.0 -82.0 -63.1 -50.3 558 559 A L H X S+ 0 0 2 -4,-2.8 4,-1.8 1,-0.3 -1,-0.2 0.892 108.9 52.8 -54.1 -39.5 -80.8 -60.7 -53.0 559 560 A D H X S+ 0 0 84 -4,-2.0 4,-2.0 2,-0.2 -1,-0.3 0.866 108.2 48.9 -62.9 -37.7 -82.8 -58.1 -51.1 560 561 A E H X S+ 0 0 112 -4,-1.5 4,-1.6 -3,-0.3 -2,-0.2 0.872 107.8 56.6 -69.7 -38.3 -81.0 -59.0 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111.1 48.8 -70.8 -36.0 -71.8 -47.1 -42.7 571 572 A D H X S+ 0 0 84 -4,-2.3 4,-1.1 2,-0.2 -1,-0.2 0.875 108.9 55.2 -71.5 -35.9 -69.5 -49.2 -40.5 572 573 A L H < S+ 0 0 1 -4,-2.6 3,-0.3 1,-0.2 -2,-0.2 0.940 115.4 38.3 -55.5 -47.5 -66.7 -48.6 -43.0 573 574 A K H < S+ 0 0 134 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.729 111.1 57.1 -79.4 -26.5 -67.1 -44.8 -42.7 574 575 A S H < S+ 0 0 100 -4,-1.7 2,-0.2 -5,-0.1 -1,-0.2 0.663 95.0 76.3 -85.3 -17.5 -67.8 -44.6 -38.9 575 576 A V < + 0 0 60 -4,-1.1 2,-0.3 -3,-0.3 31,-0.0 -0.611 51.7 162.7 -92.6 150.6 -64.6 -46.3 -37.7 576 577 A N - 0 0 123 -2,-0.2 2,-0.5 2,-0.0 -3,-0.0 -0.900 25.7-145.5-163.5 151.5 -61.1 -45.0 -37.5 577 578 A F - 0 0 56 -2,-0.3 2,-0.6 3,-0.0 -2,-0.0 -0.948 17.0-140.1-110.7 125.4 -57.8 -45.7 -35.9 578 579 A D - 0 0 111 -2,-0.5 4,-0.3 1,-0.1 3,-0.2 -0.783 18.0-169.4 -78.0 120.7 -55.5 -42.9 -34.8 579 580 A M > + 0 0 1 -2,-0.6 4,-1.9 1,-0.2 5,-0.2 0.316 56.7 102.7 -99.7 6.1 -52.1 -44.3 -35.8 580 581 A T H > S+ 0 0 37 1,-0.2 4,-2.8 2,-0.2 3,-0.5 0.952 83.7 45.2 -58.1 -55.3 -50.0 -41.7 -34.1 581 582 A S H > S+ 0 0 87 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.877 109.7 54.6 -53.1 -46.8 -49.1 -43.9 -31.1 582 583 A K H > S+ 0 0 78 -4,-0.3 4,-1.8 1,-0.2 -1,-0.2 0.861 113.6 43.6 -60.0 -33.9 -48.3 -46.9 -33.3 583 584 A F H X S+ 0 0 0 -4,-1.9 4,-2.3 -3,-0.5 -2,-0.2 0.930 113.1 49.0 -77.5 -46.5 -45.9 -44.7 -35.3 584 585 A L H X S+ 0 0 68 -4,-2.8 4,-2.6 2,-0.2 5,-0.3 0.865 111.1 51.9 -59.4 -39.3 -44.3 -43.0 -32.2 585 586 A T H X S+ 0 0 76 -4,-2.9 4,-3.3 -5,-0.2 5,-0.5 0.987 109.2 48.8 -61.6 -55.5 -43.8 -46.4 -30.6 586 587 A A H X S+ 0 0 15 -4,-1.8 4,-1.2 -5,-0.2 -2,-0.2 0.868 115.1 47.3 -48.2 -39.4 -42.1 -47.7 -33.8 587 588 A L H < S+ 0 0 46 -4,-2.3 -1,-0.2 2,-0.2 -2,-0.2 0.833 117.2 38.4 -76.9 -34.0 -39.9 -44.5 -33.7 588 589 A A H < S+ 0 0 92 -4,-2.6 -2,-0.2 -3,-0.4 -3,-0.2 0.872 120.2 46.4 -82.3 -40.3 -38.9 -44.6 -30.0 589 590 A Q H < S+ 0 0 152 -4,-3.3 2,-0.2 -5,-0.3 -2,-0.2 0.800 126.7 23.4 -66.6 -29.7 -38.5 -48.4 -29.9 590 591 A D S < 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601 A V H X S+ 0 0 69 -4,-2.2 4,-2.2 -5,-0.3 -1,-0.2 0.865 111.8 49.9 -42.5 -45.4 -51.3 -52.7 -43.8 601 602 A T H X S+ 0 0 87 -4,-1.1 4,-1.0 -5,-0.2 -1,-0.2 0.875 115.7 39.4 -70.2 -39.6 -51.3 -54.5 -40.5 602 603 A E H X S+ 0 0 6 -4,-2.5 4,-2.7 -3,-0.4 3,-0.5 0.928 113.6 54.1 -75.9 -46.6 -53.6 -52.1 -38.7 603 604 A L H X S+ 0 0 15 -4,-3.4 4,-3.3 -5,-0.3 5,-0.4 0.939 107.7 52.8 -47.2 -51.7 -55.9 -51.6 -41.7 604 605 A D H X S+ 0 0 114 -4,-2.2 4,-0.9 -5,-0.3 -1,-0.3 0.830 112.6 44.5 -54.4 -37.2 -56.3 -55.4 -41.8 605 606 A R H < S+ 0 0 166 -4,-1.0 4,-0.2 -3,-0.5 -1,-0.2 0.834 120.4 38.0 -79.1 -36.2 -57.3 -55.4 -38.2 606 607 A V H < S+ 0 0 31 -4,-2.7 4,-0.2 1,-0.1 -2,-0.2 0.873 133.9 20.4 -81.7 -38.1 -59.7 -52.5 -38.2 607 608 A Y H X S+ 0 0 2 -4,-3.3 4,-3.2 -5,-0.3 5,-0.3 0.356 96.5 94.3-117.0 1.2 -61.3 -53.0 -41.6 608 609 A G H X S+ 0 0 9 -4,-0.9 4,-1.6 -5,-0.4 5,-0.1 0.844 83.4 51.3 -72.8 -37.5 -60.7 -56.7 -42.4 609 610 A G H > S+ 0 0 53 -4,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.952 117.8 42.0 -59.4 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110.9 51.4 -61.3 -48.4 -98.7 -54.0 -68.7 649 650 A E H X S+ 0 0 59 -4,-3.0 4,-2.7 1,-0.2 5,-0.2 0.871 107.5 53.2 -56.7 -41.1 -95.2 -55.5 -68.4 650 651 A E H X S+ 0 0 90 -4,-2.1 4,-2.4 -5,-0.2 -1,-0.2 0.938 111.0 45.9 -63.1 -44.5 -93.7 -52.6 -70.3 651 652 A V H X S+ 0 0 22 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.916 113.6 48.2 -65.9 -43.9 -95.3 -50.1 -67.9 652 653 A L H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 5,-0.2 0.975 111.8 49.7 -58.7 -56.9 -94.3 -52.1 -64.7 653 654 A K H X S+ 0 0 55 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.922 113.3 47.6 -43.8 -50.2 -90.7 -52.5 -66.0 654 655 A N H X S+ 0 0 60 -4,-2.4 4,-1.7 -5,-0.2 -1,-0.2 0.835 108.9 53.8 -66.8 -33.5 -90.6 -48.7 -66.7 655 656 A L H X S+ 0 0 2 -4,-2.3 4,-1.1 -3,-0.2 -1,-0.2 0.888 109.9 46.6 -67.7 -37.9 -92.1 -47.9 -63.3 656 657 A A H >X S+ 0 0 8 -4,-2.3 4,-2.0 1,-0.2 3,-0.7 0.957 112.6 50.5 -67.6 -48.2 -89.3 -49.9 -61.4 657 658 A T H 3X S+ 0 0 50 -4,-2.4 4,-2.5 1,-0.3 -1,-0.2 0.842 106.1 56.7 -54.0 -35.6 -86.7 -48.2 -63.6 658 659 A A H 3X S+ 0 0 1 -4,-1.7 4,-2.0 2,-0.2 -1,-0.3 0.822 104.7 52.1 -69.6 -30.0 -88.2 -44.9 -62.7 659 660 A Y H X S+ 0 0 118 -4,-1.5 4,-2.2 2,-0.2 3,-0.8 0.970 112.1 51.3 -62.6 -51.6 -60.7 -18.4 -49.3 686 687 A F H 3X S+ 0 0 2 -4,-3.1 4,-1.8 1,-0.3 -2,-0.2 0.882 107.2 53.8 -52.0 -39.3 -59.1 -17.8 -52.7 687 688 A Q H 3X S+ 0 0 57 -4,-2.0 4,-1.9 1,-0.2 -1,-0.3 0.831 106.2 52.8 -67.2 -32.9 -60.9 -14.4 -52.9 688 689 A N H X S+ 0 0 115 -4,-3.4 4,-1.6 1,-0.2 3,-1.0 0.945 113.5 46.0 -47.2 -57.4 -55.0 -9.6 -48.9 693 694 A I H 3X S+ 0 0 43 -4,-2.6 4,-0.8 1,-0.3 -1,-0.2 0.791 110.5 52.5 -64.2 -29.1 -52.3 -9.5 -51.6 694 695 A V H 3< S+ 0 0 16 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.702 115.0 43.4 -79.0 -16.3 -53.8 -6.5 -53.4 695 696 A F H << S+ 0 0 149 -4,-1.3 -2,-0.2 -3,-1.0 -1,-0.2 0.598 103.3 60.1-106.6 -11.6 -53.9 -4.6 -50.1 696 697 A A H < 0 0 89 -4,-1.6 -2,-0.2 -5,-0.2 -3,-0.1 0.739 360.0 360.0 -76.8 -25.7 -50.4 -5.5 -48.8 697 698 A R < 0 0 75 -4,-0.8 -3,-0.1 -5,-0.3 -2,-0.0 0.402 360.0 360.0 -69.4 360.0 -49.3 -3.8 -52.0 698 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0 0 50 -4,-2.3 4,-1.0 1,-0.2 -1,-0.2 0.822 106.1 56.5 -58.1 -32.1 -60.2 -32.5 -58.2 709 52 B L H >X S+ 0 0 2 -4,-1.3 4,-3.1 2,-0.2 3,-0.8 0.954 104.1 48.3 -69.5 -52.0 -61.7 -30.5 -55.3 710 53 B L H 3< S+ 0 0 125 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.942 103.7 63.6 -50.5 -52.1 -60.2 -32.6 -52.5 711 54 B H H 3< S+ 0 0 165 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.842 115.6 30.5 -36.3 -46.5 -56.8 -32.3 -54.3 712 55 B L H << 0 0 72 -4,-1.0 -2,-0.2 -3,-0.8 -1,-0.2 0.930 360.0 360.0 -84.9 -51.6 -57.0 -28.5 -53.7 713 56 B N < 0 0 90 -4,-3.1 -3,-0.2 -5,-0.1 -2,-0.1 0.997 360.0 360.0 -70.9 360.0 -59.0 -28.2 -50.5