==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 25-MAR-13 4JVO . COMPND 2 MOLECULE: MICROCIN IMMUNITY PROTEIN MCCF; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS ANTHRACIS; . AUTHOR B.NOCEK,A.TIKHONOV,K.SEVERINOV,W.F.ANDERSON,A.JOACHIMIAK,CEN . 670 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23441.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 448 66.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 76 11.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 60 9.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 2 0.3 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 . 55 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 67 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 151 22.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 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 6 2 2 0 0 2 0 2 2 5 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 2 6 4 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 . 4 4 4 2 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 ANTIPARALLEL BRIDGES PER LADDER . 2 0 2 2 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 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 S 0 0 140 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 169.7 3.8 64.9 10.5 2 -1 A N - 0 0 146 1,-0.1 2,-0.0 0, 0.0 0, 0.0 -0.243 360.0 -89.9 -65.5 153.0 6.0 67.9 11.5 3 0 A A - 0 0 106 1,-0.0 -1,-0.1 3,-0.0 3,-0.0 -0.368 53.7-169.9 -54.6 142.8 8.0 69.6 8.9 4 1 A M - 0 0 62 -3,-0.1 125,-0.0 1,-0.0 -1,-0.0 -0.941 32.3 -75.0-138.1 162.0 11.4 68.1 8.5 5 2 A P + 0 0 93 0, 0.0 -1,-0.0 0, 0.0 100,-0.0 -0.245 56.3 175.2 -52.7 138.4 14.8 68.8 6.9 6 3 A L - 0 0 20 124,-0.1 329,-0.1 102,-0.1 104,-0.1 -0.988 32.1-101.6-145.2 157.0 14.5 68.1 3.1 7 4 A P - 0 0 1 0, 0.0 329,-2.3 0, 0.0 102,-0.2 -0.352 44.2 -99.7 -75.3 155.0 16.8 68.5 0.1 8 5 A K - 0 0 83 100,-0.6 102,-0.2 327,-0.2 3,-0.1 -0.491 44.0-100.9 -71.5 141.5 16.4 71.4 -2.2 9 6 A S - 0 0 20 327,-2.8 152,-0.2 -2,-0.2 2,-0.1 -0.256 43.6 -98.6 -54.9 146.2 14.6 70.7 -5.5 10 7 A L - 0 0 1 150,-2.6 2,-0.3 152,-0.1 -1,-0.1 -0.482 41.1-160.2 -64.2 147.4 16.7 70.3 -8.6 11 8 A K > - 0 0 147 -2,-0.1 3,-2.1 -3,-0.1 70,-0.1 -0.939 30.1 -89.4-128.3 152.1 17.1 73.3 -10.8 12 9 A Y T 3 S+ 0 0 143 -2,-0.3 33,-0.1 1,-0.3 32,-0.1 -0.281 115.6 25.9 -57.4 143.1 18.1 73.7 -14.4 13 10 A G T 3 S+ 0 0 32 1,-0.3 -1,-0.3 30,-0.1 32,-0.1 0.440 89.8 141.9 79.9 -2.5 21.8 74.1 -14.6 14 11 A D < - 0 0 29 -3,-2.1 32,-2.4 1,-0.1 2,-0.5 -0.261 54.5-109.2 -66.3 159.3 22.5 72.3 -11.3 15 12 A T E -ab 46 80A 32 64,-0.6 66,-2.4 30,-0.2 67,-1.2 -0.816 24.3-160.0 -93.1 123.2 25.5 70.0 -10.9 16 13 A I E -ab 47 82A 0 30,-2.8 32,-2.4 -2,-0.5 2,-0.4 -0.940 11.1-149.2 -97.8 120.7 24.9 66.3 -10.6 17 14 A G E -ab 48 83A 0 65,-3.1 67,-2.7 -2,-0.6 2,-0.4 -0.791 11.6-156.0 -93.1 134.6 27.8 64.4 -9.0 18 15 A I E +ab 49 84A 0 30,-2.4 32,-1.8 -2,-0.4 2,-0.3 -0.893 14.3 174.8-114.0 141.8 28.3 60.9 -10.2 19 16 A Y E - b 0 85A 0 65,-1.4 67,-2.6 -2,-0.4 68,-0.3 -0.909 27.7-137.0-138.6 165.2 30.0 58.1 -8.3 20 17 A S + 0 0 0 -2,-0.3 41,-0.3 65,-0.2 68,-0.1 -0.812 23.7 170.9-127.0 90.0 30.7 54.3 -8.8 21 18 A P S S- 0 0 0 0, 0.0 73,-0.2 0, 0.0 74,-0.1 0.557 75.7 -3.8 -80.7 -6.2 30.1 52.5 -5.5 22 19 A S S S+ 0 0 0 1,-0.4 39,-1.5 65,-0.3 67,-0.2 0.026 115.3 40.5-146.5-106.1 30.4 49.1 -7.1 23 20 A S S S- 0 0 17 65,-2.2 2,-1.9 37,-0.2 -1,-0.4 -0.283 70.8-125.3 -67.1 142.3 30.8 48.0 -10.7 24 21 A P >> + 0 0 5 0, 0.0 4,-2.1 0, 0.0 3,-1.6 -0.286 50.9 151.6 -84.4 58.9 33.3 50.0 -12.9 25 22 A V H 3> + 0 0 2 -2,-1.9 4,-2.7 1,-0.3 8,-0.2 0.778 61.9 67.0 -63.9 -28.9 30.8 50.8 -15.7 26 23 A T H 34 S+ 0 0 8 -3,-0.3 -1,-0.3 1,-0.2 8,-0.1 0.755 112.3 35.8 -68.3 -22.2 32.4 54.0 -16.7 27 24 A Y H <4 S+ 0 0 131 -3,-1.6 -2,-0.2 28,-0.3 -1,-0.2 0.821 122.7 41.6 -88.3 -41.8 35.4 51.9 -17.8 28 25 A T H < S+ 0 0 75 -4,-2.1 -3,-0.2 1,-0.2 -2,-0.2 0.747 124.5 31.9 -89.8 -18.7 33.6 48.8 -19.2 29 26 A S X + 0 0 6 -4,-2.7 4,-2.2 -5,-0.2 -1,-0.2 -0.568 69.9 157.3-127.0 66.2 30.7 50.5 -21.0 30 27 A P H > + 0 0 61 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.801 68.3 55.4 -64.8 -34.3 32.2 53.7 -22.2 31 28 A K H > S+ 0 0 113 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.946 111.3 43.0 -65.2 -45.7 29.8 54.4 -25.1 32 29 A R H > S+ 0 0 1 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.902 114.3 53.0 -67.1 -38.2 26.7 54.2 -22.9 33 30 A F H X S+ 0 0 7 -4,-2.2 4,-2.4 -8,-0.2 5,-0.2 0.961 111.1 44.7 -61.4 -49.0 28.5 56.3 -20.2 34 31 A E H X S+ 0 0 97 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.902 113.6 51.0 -62.2 -37.8 29.4 59.0 -22.7 35 32 A R H X S+ 0 0 57 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.898 109.4 50.2 -66.6 -39.9 25.9 59.0 -24.1 36 33 A A H X S+ 0 0 0 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.914 111.8 47.5 -62.1 -49.7 24.3 59.3 -20.7 37 34 A K H X S+ 0 0 23 -4,-2.4 4,-2.6 2,-0.2 5,-0.3 0.948 112.6 49.9 -54.4 -49.2 26.5 62.3 -19.7 38 35 A S H X S+ 0 0 67 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.868 106.1 56.6 -60.9 -33.7 25.7 63.9 -23.0 39 36 A Y H X S+ 0 0 34 -4,-2.1 4,-1.4 1,-0.2 -1,-0.2 0.935 113.4 38.8 -61.1 -52.0 22.0 63.3 -22.5 40 37 A L H <>S+ 0 0 0 -4,-1.9 5,-2.1 2,-0.2 4,-0.4 0.856 115.4 51.7 -70.1 -37.8 22.0 65.2 -19.2 41 38 A L H ><5S+ 0 0 82 -4,-2.6 3,-1.3 1,-0.2 -1,-0.2 0.894 107.7 53.7 -66.1 -39.2 24.5 67.9 -20.4 42 39 A Q H 3<5S+ 0 0 144 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.887 104.3 55.9 -63.5 -34.3 22.2 68.6 -23.4 43 40 A K T 3<5S- 0 0 71 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.553 128.9-100.2 -69.8 -12.0 19.3 69.1 -21.0 44 41 A G T < 5S+ 0 0 36 -3,-1.3 -3,-0.2 -4,-0.4 -2,-0.1 0.440 80.3 124.3 107.6 4.4 21.3 71.8 -19.3 45 42 A F < - 0 0 3 -5,-2.1 2,-0.4 -33,-0.1 -1,-0.3 -0.412 52.6-130.8 -88.0 163.9 22.8 70.1 -16.2 46 43 A H E -a 15 0A 109 -32,-2.4 -30,-2.8 -2,-0.1 2,-0.5 -0.899 15.5-145.6-108.6 148.7 26.5 69.9 -15.3 47 44 A I E -a 16 0A 31 -2,-0.4 2,-0.7 -32,-0.2 -30,-0.2 -0.975 4.5-159.7-118.9 126.9 28.1 66.6 -14.3 48 45 A L E -a 17 0A 68 -32,-2.4 -30,-2.4 -2,-0.5 2,-0.5 -0.920 20.9-141.2-101.8 113.7 30.9 66.4 -11.7 49 46 A E E -a 18 0A 86 -2,-0.7 -30,-0.1 -32,-0.2 -32,-0.1 -0.633 16.9-124.7 -80.4 122.1 32.7 63.2 -12.3 50 47 A G > - 0 0 7 -32,-1.8 3,-2.2 -2,-0.5 20,-0.1 -0.165 30.5 -97.4 -62.9 164.7 33.7 61.4 -9.1 51 48 A S T 3 S+ 0 0 75 1,-0.3 -1,-0.1 19,-0.2 -32,-0.1 0.577 120.2 53.8 -63.2 -14.7 37.3 60.5 -8.5 52 49 A L T > S+ 0 0 3 15,-0.1 3,-2.2 3,-0.1 -1,-0.3 0.337 74.3 130.6-102.0 6.4 36.9 56.8 -9.7 53 50 A T T < S+ 0 0 29 -3,-2.2 3,-0.1 1,-0.3 -4,-0.0 -0.406 81.1 10.5 -62.6 128.4 35.4 57.7 -13.0 54 51 A G T 3 S+ 0 0 42 1,-0.3 -1,-0.3 -2,-0.1 2,-0.2 0.409 102.1 125.2 81.5 3.1 37.3 55.7 -15.7 55 52 A R < - 0 0 111 -3,-2.2 2,-0.4 2,-0.0 -28,-0.3 -0.499 44.2-155.7 -91.8 161.4 39.1 53.5 -13.2 56 53 A Y + 0 0 100 -2,-0.2 5,-0.2 -3,-0.1 3,-0.1 -0.967 28.2 161.6-142.9 124.9 39.0 49.8 -13.2 57 54 A D B > -F 60 0B 25 3,-2.2 3,-1.3 -2,-0.4 2,-0.7 -0.331 61.2-105.9-135.7 52.0 39.5 47.2 -10.4 58 55 A Y T 3 S+ 0 0 98 1,-0.3 -1,-0.2 3,-0.1 552,-0.1 -0.524 106.0 13.5 71.8 -99.8 37.9 44.2 -12.1 59 56 A Y T 3 S+ 0 0 20 -2,-0.7 -1,-0.3 550,-0.2 2,-0.3 0.546 135.1 36.3 -82.6 -9.8 34.5 43.6 -10.4 60 57 A R B < S-F 57 0B 10 -3,-1.3 -3,-2.2 -37,-0.2 -37,-0.2 -0.887 78.9-117.7-139.3 170.2 34.6 47.1 -8.7 61 58 A S S S- 0 0 3 -39,-1.5 2,-0.3 -2,-0.3 -3,-0.1 0.695 85.4 -40.1 -82.5 -21.3 35.8 50.6 -9.3 62 59 A G S S- 0 0 1 -40,-0.2 -1,-0.2 -5,-0.2 -5,-0.1 -0.969 82.4 -44.8 175.6-179.2 38.3 50.7 -6.5 63 60 A S > - 0 0 28 -2,-0.3 4,-2.5 -3,-0.1 5,-0.3 -0.128 59.2-101.7 -61.7 166.1 39.0 49.7 -2.9 64 61 A I H > S+ 0 0 2 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.952 124.8 46.8 -53.7 -49.8 36.5 50.1 -0.2 65 62 A Q H > S+ 0 0 64 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.880 111.0 50.6 -61.1 -42.3 38.3 53.2 1.0 66 63 A E H > S+ 0 0 74 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.891 111.0 48.8 -64.0 -38.8 38.7 54.7 -2.4 67 64 A R H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 5,-0.2 0.897 111.6 48.7 -68.2 -41.7 35.0 54.3 -3.1 68 65 A A H X S+ 0 0 1 -4,-2.3 4,-2.8 -5,-0.3 5,-0.2 0.932 111.2 51.4 -64.9 -38.3 34.0 55.9 0.3 69 66 A K H X S+ 0 0 97 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.891 107.3 53.4 -61.1 -43.6 36.4 58.8 -0.5 70 67 A E H X S+ 0 0 1 -4,-1.9 4,-1.0 2,-0.2 -1,-0.2 0.949 114.1 40.6 -58.5 -49.8 34.8 59.2 -3.9 71 68 A L H >X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 3,-0.6 0.921 112.6 54.6 -66.9 -43.9 31.3 59.5 -2.5 72 69 A N H 3X S+ 0 0 10 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.841 100.6 59.3 -60.2 -35.7 32.3 61.6 0.5 73 70 A A H 3< S+ 0 0 56 -4,-2.0 4,-0.3 -5,-0.2 -1,-0.2 0.883 109.6 44.7 -62.4 -35.0 33.9 64.2 -1.8 74 71 A L H X< S+ 0 0 6 -4,-1.0 3,-1.2 -3,-0.6 6,-0.3 0.922 110.9 52.7 -69.0 -46.1 30.5 64.7 -3.4 75 72 A I H 3< S+ 0 0 1 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.870 112.0 46.8 -56.5 -41.7 28.6 64.8 -0.1 76 73 A R T 3< S+ 0 0 145 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.499 88.9 99.6 -80.6 -3.0 31.0 67.5 1.1 77 74 A N X - 0 0 39 -3,-1.2 3,-1.6 -4,-0.3 -4,-0.0 -0.740 57.8-160.7 -93.6 110.9 30.8 69.6 -2.0 78 75 A P T 3 S+ 0 0 99 0, 0.0 -1,-0.2 0, 0.0 -4,-0.0 0.696 87.7 62.4 -65.4 -15.5 28.3 72.5 -1.5 79 76 A N T 3 S+ 0 0 116 -65,-0.0 -64,-0.6 -3,-0.0 2,-0.5 0.525 82.6 90.8 -87.4 -6.8 28.0 72.9 -5.3 80 77 A V E < +b 15 0A 4 -3,-1.6 -64,-0.2 -6,-0.3 3,-0.1 -0.788 46.2 177.7 -93.9 127.1 26.5 69.5 -5.9 81 78 A S E S+ 0 0 35 -66,-2.4 29,-1.9 -2,-0.5 2,-0.3 0.631 70.1 27.6 -99.2 -21.4 22.7 69.3 -5.8 82 79 A C E -bc 16 110A 0 -67,-1.2 -65,-3.1 27,-0.2 2,-0.5 -0.996 61.9-155.5-148.1 134.3 22.2 65.7 -6.7 83 80 A I E -bc 17 111A 0 27,-3.1 29,-2.5 -2,-0.3 2,-0.4 -0.982 21.3-179.0-117.8 121.3 24.4 62.6 -6.1 84 81 A M E -bc 18 112A 0 -67,-2.7 -65,-1.4 -2,-0.5 29,-0.2 -0.969 24.5-126.3-128.4 129.5 23.7 59.8 -8.6 85 82 A S E -b 19 0A 0 27,-1.6 53,-2.6 -2,-0.4 -65,-0.2 -0.416 11.3-140.9 -69.1 150.8 25.2 56.4 -8.8 86 83 A T S S- 0 0 0 -67,-2.6 53,-2.3 1,-0.4 2,-0.3 0.883 75.8 -38.1 -73.8 -37.2 26.6 55.4 -12.2 87 84 A I - 0 0 0 -68,-0.3 -1,-0.4 52,-0.2 -65,-0.3 -0.937 60.3-116.6-175.6 168.8 25.4 51.8 -11.8 88 85 A G + 0 0 1 -2,-0.3 -65,-2.2 -3,-0.1 2,-0.4 0.392 32.1 157.2 -94.0-134.0 25.0 49.2 -9.1 89 86 A G - 0 0 17 582,-0.3 27,-0.1 -67,-0.2 -1,-0.1 -0.978 64.7 -65.9 140.8-120.2 26.7 45.8 -8.8 90 87 A M S S+ 0 0 41 -2,-0.4 3,-0.3 25,-0.1 -1,-0.1 0.465 108.5 71.1-142.1 -9.8 27.0 44.1 -5.4 91 88 A N > + 0 0 0 1,-0.2 3,-1.4 2,-0.1 4,-0.3 0.272 52.5 104.0-117.2 15.4 29.4 46.1 -3.2 92 89 A S G > S+ 0 0 0 1,-0.3 3,-1.9 2,-0.2 4,-0.4 0.815 75.0 69.0 -60.2 -34.2 27.9 49.4 -2.1 93 90 A N G > S+ 0 0 2 -3,-0.3 3,-1.1 1,-0.3 -1,-0.3 0.758 85.2 70.7 -59.7 -23.5 27.3 48.0 1.4 94 91 A S G < S+ 0 0 2 -3,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.768 94.0 56.4 -59.9 -30.1 31.1 48.0 1.9 95 92 A L G X S+ 0 0 0 -3,-1.9 3,-2.5 -4,-0.3 4,-0.5 0.650 79.4 94.6 -71.8 -25.9 31.1 51.9 2.0 96 93 A L G X S+ 0 0 0 -3,-1.1 3,-0.9 -4,-0.4 -1,-0.2 0.799 80.1 50.4 -51.2 -40.5 28.6 52.2 4.9 97 94 A P G 3 S+ 0 0 43 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.651 114.4 47.2 -65.4 -14.2 30.9 52.5 7.8 98 95 A Y G < S+ 0 0 59 -3,-2.5 2,-0.2 -4,-0.1 -2,-0.2 0.336 79.7 115.3-115.0 1.0 32.9 55.2 6.1 99 96 A I < - 0 0 10 -3,-0.9 2,-1.9 -4,-0.5 3,-0.2 -0.491 69.3-122.0 -79.8 142.6 30.3 57.6 4.8 100 97 A D > + 0 0 42 1,-0.2 4,-1.7 -32,-0.2 3,-0.2 -0.548 41.1 165.6 -83.9 76.0 30.1 61.2 6.1 101 98 A Y H > S+ 0 0 23 -2,-1.9 4,-2.7 1,-0.2 5,-0.2 0.869 73.2 57.7 -62.2 -34.1 26.6 61.1 7.3 102 99 A D H > S+ 0 0 111 1,-0.2 4,-2.1 -3,-0.2 -1,-0.2 0.897 105.5 49.7 -66.4 -42.0 27.1 64.3 9.4 103 100 A A H > S+ 0 0 22 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.883 111.5 50.0 -63.0 -36.6 28.2 66.2 6.2 104 101 A F H < S+ 0 0 0 -4,-1.7 3,-0.4 1,-0.2 -2,-0.2 0.931 110.9 47.3 -65.8 -43.4 25.1 64.9 4.5 105 102 A Q H < S+ 0 0 95 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.882 108.9 55.6 -71.3 -27.8 22.8 66.0 7.3 106 103 A N H < S+ 0 0 140 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.833 129.2 14.5 -73.3 -21.9 24.5 69.4 7.4 107 104 A N S < S- 0 0 69 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 -0.583 86.2-155.6-149.6 77.5 23.8 70.0 3.7 108 105 A P - 0 0 29 0, 0.0 -100,-0.6 0, 0.0 2,-0.3 -0.268 14.4-176.4 -63.3 144.9 21.2 67.5 2.4 109 106 A K - 0 0 6 -102,-0.2 2,-0.6 21,-0.0 -27,-0.2 -0.812 39.1 -86.1-130.3 164.3 21.2 66.7 -1.3 110 107 A I E -c 82 0A 0 -29,-1.9 -27,-3.1 -2,-0.3 2,-0.5 -0.705 43.8-164.4 -72.5 117.0 19.0 64.5 -3.6 111 108 A M E +c 83 0A 0 -2,-0.6 22,-2.5 20,-0.3 2,-0.3 -0.954 18.3 170.9-109.3 118.5 20.6 61.0 -3.4 112 109 A I E +cd 84 133A 0 -29,-2.5 -27,-1.6 -2,-0.5 2,-0.3 -0.979 14.6 95.4-138.5 145.9 19.3 58.8 -6.3 113 110 A G E - 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