==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-AUG-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL CYCLE/CHAPERONE 09-MAY-12 4F38 . COMPND 2 MOLECULE: TRANSFORMING PROTEIN RHOA; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR Z.GUO,Z.TNIMOV,K.ALEXANDROV . 382 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20017.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 237 62.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 7.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 63 16.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 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 0.5 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 . 29 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 61 16.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.3 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 1 1 0 1 2 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 2 1 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 PARALLEL BRIDGES PER LADDER . 1 2 0 1 0 1 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 2 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 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 1 A M 0 0 225 0, 0.0 2,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -57.7 -30.0 6.8 42.6 2 2 A A + 0 0 85 1,-0.0 2,-0.3 52,-0.0 50,-0.1 -0.235 360.0 172.8 -72.9 165.9 -28.5 7.7 39.2 3 3 A A - 0 0 31 50,-0.0 2,-0.2 -2,-0.0 50,-0.2 -0.943 38.0 -59.4-163.9 164.3 -24.8 7.2 38.6 4 4 A I E -a 53 0A 93 48,-0.6 50,-3.6 -2,-0.3 2,-0.6 -0.467 50.0-147.9 -57.4 130.6 -21.8 7.2 36.3 5 5 A R E -a 54 0A 155 -2,-0.2 2,-0.4 48,-0.2 50,-0.2 -0.931 14.6-172.5-112.5 120.0 -22.4 4.6 33.5 6 6 A K E -a 55 0A 47 48,-2.8 50,-2.8 -2,-0.6 2,-0.4 -0.884 20.2-129.6-110.3 138.4 -19.4 2.8 32.1 7 7 A K E -a 56 0A 31 69,-0.4 71,-2.8 -2,-0.4 72,-1.5 -0.756 24.8-174.9 -92.1 132.1 -19.5 0.5 29.1 8 8 A L E -ab 57 79A 0 48,-3.1 50,-2.3 -2,-0.4 2,-0.4 -0.989 4.1-167.4-129.9 128.8 -18.0 -3.0 29.4 9 9 A V E -ab 58 80A 0 70,-1.9 72,-1.8 -2,-0.4 2,-0.6 -0.948 9.5-147.5-121.6 138.4 -17.6 -5.5 26.6 10 10 A I E + b 0 81A 0 48,-2.6 50,-0.3 -2,-0.4 2,-0.2 -0.902 20.4 176.0-115.4 123.0 -16.8 -9.2 27.0 11 11 A V E + b 0 82A 0 70,-2.2 72,-3.5 -2,-0.6 2,-0.2 -0.738 14.8 113.2-121.0 168.6 -14.8 -11.1 24.4 12 12 A G - 0 0 0 -2,-0.2 72,-0.1 70,-0.2 4,-0.1 -0.692 62.0 -60.3 143.8 157.8 -13.3 -14.6 23.9 13 13 A D > - 0 0 25 70,-0.5 3,-0.6 78,-0.2 2,-0.3 0.081 69.1 -88.1 -55.7 178.5 -13.4 -17.8 22.0 14 14 A G T 3 S+ 0 0 37 1,-0.2 -1,-0.1 48,-0.2 47,-0.0 -0.721 109.7 34.5 -97.9 144.5 -16.6 -19.6 22.2 15 15 A A T 3 S+ 0 0 85 -2,-0.3 -1,-0.2 -3,-0.1 -2,-0.1 0.555 83.5 114.7 93.5 8.8 -17.2 -22.1 24.9 16 16 A C S < S- 0 0 1 -3,-0.6 101,-0.2 -4,-0.1 70,-0.2 0.579 90.0-102.8 -95.4 -8.3 -15.3 -20.0 27.3 17 17 A G S > S+ 0 0 15 66,-0.1 4,-1.9 68,-0.1 5,-0.2 0.663 74.1 136.7 103.7 18.1 -18.1 -19.1 29.6 18 18 A K H > S+ 0 0 11 -5,-0.2 4,-1.7 1,-0.2 3,-0.2 0.978 75.2 42.8 -63.4 -58.7 -18.8 -15.5 28.6 19 19 A T H > S+ 0 0 15 18,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.831 113.0 53.5 -55.7 -39.9 -22.6 -15.7 28.5 20 20 A C H > S+ 0 0 17 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.906 104.2 54.0 -67.5 -42.1 -22.8 -17.7 31.8 21 21 A L H X S+ 0 0 0 -4,-1.9 4,-1.5 -3,-0.2 -1,-0.2 0.921 111.8 46.5 -55.3 -46.5 -20.7 -15.2 33.8 22 22 A L H X S+ 0 0 1 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.871 108.6 53.9 -65.2 -42.0 -23.1 -12.5 32.7 23 23 A I H X>S+ 0 0 4 -4,-2.1 4,-1.8 1,-0.2 5,-0.8 0.951 110.9 46.7 -57.6 -47.5 -26.2 -14.4 33.5 24 24 A V H <5S+ 0 0 6 -4,-2.4 4,-0.3 1,-0.2 -1,-0.2 0.797 107.2 57.8 -71.6 -27.3 -25.0 -15.1 37.0 25 25 A F H <5S+ 0 0 43 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.916 121.7 24.7 -69.3 -41.7 -24.1 -11.5 37.5 26 26 A S H <5S+ 0 0 51 -4,-2.0 -2,-0.2 -3,-0.2 -3,-0.1 0.951 134.4 29.4 -76.7 -75.6 -27.6 -10.3 36.7 27 27 A K T <5S- 0 0 130 -4,-1.8 -3,-0.2 -5,-0.2 -2,-0.1 0.719 86.5-143.1 -61.8 -32.0 -30.0 -13.2 37.5 28 28 A D S S- 0 0 74 -50,-0.1 3,-1.7 1,-0.1 -2,-0.1 -0.358 75.4-117.9 -72.5 149.5 -17.4 -17.3 16.6 64 64 A E G > S+ 0 0 152 1,-0.3 3,-2.0 2,-0.2 4,-0.2 0.761 106.9 70.9 -63.8 -29.3 -15.3 -16.4 13.5 65 65 A D G 3 S+ 0 0 60 1,-0.3 -1,-0.3 2,-0.1 3,-0.2 0.526 99.9 51.0 -68.4 0.6 -18.4 -15.8 11.2 66 66 A Y G <> + 0 0 0 -3,-1.7 4,-3.3 1,-0.1 -1,-0.3 0.258 69.1 116.7-117.6 11.1 -19.1 -12.7 13.3 67 67 A D T <4 S+ 0 0 26 -3,-2.0 -2,-0.1 1,-0.2 -1,-0.1 0.673 87.4 38.5 -43.3 -26.4 -15.6 -11.3 13.0 68 68 A R T 4 S+ 0 0 11 -4,-0.2 -1,-0.2 -3,-0.2 4,-0.2 0.753 118.3 45.6 -99.0 -37.0 -17.3 -8.3 11.2 69 69 A L T >4 S+ 0 0 0 1,-0.1 3,-1.8 -4,-0.1 4,-0.2 0.924 103.3 64.7 -72.0 -48.2 -20.5 -8.0 13.2 70 70 A R G >< S+ 0 0 0 -4,-3.3 3,-1.9 1,-0.3 4,-0.2 0.805 90.9 60.5 -48.9 -46.8 -18.8 -8.2 16.7 71 71 A P G > S+ 0 0 0 0, 0.0 3,-1.5 0, 0.0 257,-0.5 0.633 80.3 87.7 -64.1 -10.2 -16.7 -5.0 16.5 72 72 A L G < S+ 0 0 19 -3,-1.8 -2,-0.2 1,-0.3 258,-0.1 0.823 88.9 50.8 -55.5 -30.0 -19.9 -2.9 16.2 73 73 A S G < S+ 0 0 4 -3,-1.9 -1,-0.3 -4,-0.2 4,-0.2 0.562 88.0 82.5 -89.8 -2.7 -20.0 -2.9 20.0 74 74 A Y X + 0 0 6 -3,-1.5 3,-2.1 -4,-0.2 -1,-0.2 0.872 65.1 95.1 -66.5 -36.9 -16.4 -1.7 20.6 75 75 A P T 3 S+ 0 0 28 0, 0.0 3,-0.1 0, 0.0 252,-0.1 -0.232 93.6 17.8 -59.8 153.5 -17.0 2.0 20.2 76 76 A D T 3 S+ 0 0 148 1,-0.2 -69,-0.4 2,-0.1 -2,-0.1 0.126 89.4 151.1 80.9 -20.7 -17.7 3.8 23.5 77 77 A T < - 0 0 12 -3,-2.1 -1,-0.2 -4,-0.2 -69,-0.2 -0.154 30.4-172.3 -55.7 132.4 -16.2 0.9 25.5 78 78 A D S S+ 0 0 49 -71,-2.8 2,-0.3 1,-0.3 -70,-0.2 0.740 70.2 2.7 -94.1 -30.9 -14.6 1.8 28.9 79 79 A V E -b 8 0A 0 -72,-1.5 -70,-1.9 31,-0.1 2,-0.5 -0.986 61.5-140.0-158.1 151.2 -13.2 -1.6 29.6 80 80 A I E -bd 9 112A 0 31,-2.0 33,-2.5 -2,-0.3 2,-0.8 -0.953 3.1-156.0-120.9 121.7 -12.8 -5.1 28.1 81 81 A L E -bd 10 113A 0 -72,-1.8 -70,-2.2 -2,-0.5 2,-0.7 -0.878 17.1-161.8 -90.9 111.1 -13.1 -8.4 29.9 82 82 A M E -bd 11 114A 0 31,-2.1 33,-3.0 -2,-0.8 2,-0.3 -0.876 13.7-157.2 -99.5 117.6 -11.1 -10.8 27.8 83 83 A C E + d 0 115A 1 -72,-3.5 -70,-0.5 -2,-0.7 2,-0.3 -0.685 23.9 165.1-104.6 146.6 -12.1 -14.4 28.6 84 84 A F E - d 0 116A 0 31,-2.0 33,-3.1 -2,-0.3 2,-0.5 -0.954 38.4-109.7-138.3 161.8 -10.6 -17.8 28.3 85 85 A S E > - d 0 117A 1 -2,-0.3 3,-1.6 3,-0.3 7,-0.3 -0.794 11.0-145.4 -93.5 135.2 -11.6 -21.0 29.9 86 86 A I T 3 S+ 0 0 0 31,-2.5 53,-2.3 -2,-0.5 -1,-0.1 0.772 103.3 56.5 -63.3 -25.6 -9.4 -22.5 32.6 87 87 A D T 3 S+ 0 0 42 30,-0.3 -1,-0.3 51,-0.2 3,-0.1 0.194 102.6 63.4 -93.2 17.6 -10.4 -26.0 31.3 88 88 A S X> - 0 0 32 -3,-1.6 4,-1.1 1,-0.1 3,-1.0 -0.758 49.4-179.5-143.1 93.4 -9.1 -25.1 27.8 89 89 A P H 3> S+ 0 0 22 0, 0.0 4,-2.1 0, 0.0 3,-0.3 0.844 87.3 67.3 -60.3 -27.0 -5.6 -24.4 27.1 90 90 A D H 3> S+ 0 0 103 1,-0.2 4,-1.1 2,-0.2 -2,-0.0 0.851 98.9 50.4 -58.4 -34.5 -6.7 -23.9 23.5 91 91 A S H <4 S+ 0 0 6 -3,-1.0 -78,-0.2 -6,-0.2 -1,-0.2 0.811 108.9 50.0 -72.9 -32.2 -8.6 -20.8 24.5 92 92 A L H >< S+ 0 0 15 -4,-1.1 3,-1.3 -3,-0.3 -2,-0.2 0.862 106.3 56.9 -73.1 -39.0 -5.7 -19.2 26.4 93 93 A E H 3< S+ 0 0 123 -4,-2.1 4,-0.3 1,-0.2 -2,-0.2 0.848 102.1 57.2 -55.0 -38.2 -3.5 -19.9 23.3 94 94 A N T 3X>S+ 0 0 51 -4,-1.1 4,-2.4 1,-0.2 5,-1.7 0.561 84.8 85.5 -75.3 -5.8 -6.0 -17.8 21.3 95 95 A I T <4>S+ 0 0 0 -3,-1.3 5,-3.0 1,-0.2 -1,-0.2 0.933 100.6 28.2 -65.3 -52.4 -5.6 -14.7 23.6 96 96 A P T 45S+ 0 0 30 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.448 124.0 53.3 -89.8 3.2 -2.5 -13.2 21.9 97 97 A E T 45S- 0 0 122 -4,-0.3 -2,-0.2 -3,-0.1 -3,-0.1 0.875 131.4 -1.4 -94.7 -59.8 -3.4 -14.7 18.5 98 98 A K T X5S+ 0 0 40 -4,-2.4 4,-1.9 3,-0.1 -3,-0.2 0.907 128.2 47.5 -96.2 -52.9 -7.0 -13.5 18.0 99 99 A W H > S+ 0 0 9 0, 0.0 4,-1.9 0, 0.0 106,-0.2 0.992 113.9 44.0 -59.1 -54.9 -4.8 -8.1 18.3 102 102 A E H X S+ 0 0 6 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.863 119.6 42.2 -48.3 -46.7 -8.6 -7.4 17.7 103 103 A V H X S+ 0 0 0 -4,-2.7 4,-3.0 2,-0.2 -1,-0.2 0.934 114.5 47.9 -75.4 -45.9 -9.0 -5.5 20.9 104 104 A K H < S+ 0 0 122 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.770 117.1 47.4 -66.4 -21.2 -5.8 -3.4 20.8 105 105 A H H < S+ 0 0 35 -4,-1.9 -2,-0.2 -5,-0.3 -1,-0.2 0.883 120.4 34.2 -83.2 -41.4 -6.8 -2.7 17.2 106 106 A F H < S+ 0 0 11 -4,-2.4 -2,-0.2 1,-0.2 -3,-0.2 0.719 131.1 28.9 -88.3 -19.3 -10.4 -1.7 17.9 107 107 A C S >< S- 0 0 9 -4,-3.0 3,-1.9 1,-0.2 -1,-0.2 -0.500 74.9-175.7-135.6 62.3 -10.0 -0.1 21.3 108 108 A P T 3 S+ 0 0 71 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.764 76.6 20.5 -39.2 -67.6 -6.5 1.3 21.3 109 109 A N T 3 S+ 0 0 103 74,-0.1 -5,-0.1 2,-0.0 0, 0.0 -0.135 90.9 122.9-103.5 45.1 -6.1 2.7 24.8 110 110 A V < - 0 0 31 -3,-1.9 -31,-0.1 -2,-0.3 -3,-0.1 -0.845 63.2-115.1-105.9 131.3 -8.7 0.8 26.7 111 111 A P - 0 0 42 0, 0.0 -31,-2.0 0, 0.0 2,-0.4 -0.290 28.4-154.2 -71.0 154.5 -7.8 -1.2 29.7 112 112 A I E -d 80 0A 5 40,-0.3 42,-3.8 -33,-0.2 43,-0.7 -0.914 7.4-158.8-124.0 146.7 -8.2 -5.0 29.6 113 113 A I E -de 81 155A 0 -33,-2.5 -31,-2.1 -2,-0.4 2,-0.5 -0.988 19.3-133.0-128.9 125.9 -8.7 -7.5 32.3 114 114 A L E -de 82 156A 0 41,-2.1 43,-3.4 -2,-0.4 2,-0.6 -0.628 22.4-164.2 -77.3 121.9 -7.9 -11.1 31.8 115 115 A V E -de 83 157A 0 -33,-3.0 -31,-2.0 -2,-0.5 2,-0.7 -0.934 7.8-161.0-116.1 111.1 -10.7 -13.3 33.0 116 116 A G E -de 84 158A 0 41,-1.9 43,-2.9 -2,-0.6 3,-0.3 -0.837 22.0-150.6 -92.0 111.1 -10.1 -17.0 33.5 117 117 A N E +d 85 0A 4 -33,-3.1 -31,-2.5 -2,-0.7 -30,-0.3 -0.480 60.7 22.9 -87.0 155.6 -13.5 -18.7 33.6 118 118 A K > + 0 0 52 -33,-0.2 3,-1.3 -2,-0.1 42,-0.3 0.949 53.7 171.6 60.9 55.8 -14.7 -21.9 35.4 119 119 A K G > S+ 0 0 60 40,-1.8 3,-3.5 -3,-0.3 4,-0.5 0.880 72.9 73.7 -49.0 -42.3 -12.2 -22.2 38.3 120 120 A D G 3 S+ 0 0 52 1,-0.3 3,-0.2 2,-0.2 -1,-0.2 0.715 90.8 58.2 -56.2 -18.5 -14.4 -25.0 39.6 121 121 A L G X S+ 0 0 35 -3,-1.3 3,-1.2 1,-0.2 -1,-0.3 0.562 81.6 84.5 -85.8 -10.6 -13.0 -27.2 36.8 122 122 A R T < S+ 0 0 24 -3,-3.5 -1,-0.2 1,-0.3 -2,-0.2 0.908 105.7 26.2 -59.0 -45.8 -9.3 -26.8 37.8 123 123 A N T 3 S+ 0 0 140 -4,-0.5 2,-0.5 -3,-0.2 -1,-0.3 -0.444 92.2 120.4-118.2 54.0 -9.6 -29.7 40.3 124 124 A D <> - 0 0 58 -3,-1.2 4,-2.3 1,-0.2 5,-0.1 -0.987 56.7-143.6-117.7 126.3 -12.4 -31.6 38.8 125 125 A E H > S+ 0 0 124 -2,-0.5 4,-2.5 2,-0.2 5,-0.3 0.955 95.2 52.7 -60.0 -59.4 -11.5 -35.2 37.9 126 126 A H H > S+ 0 0 120 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.905 114.0 47.8 -42.6 -50.2 -13.5 -35.8 34.7 127 127 A T H >> S+ 0 0 11 1,-0.2 4,-2.6 2,-0.2 3,-0.6 0.930 108.4 52.4 -57.7 -54.1 -11.9 -32.5 33.4 128 128 A R H 3X S+ 0 0 90 -4,-2.3 4,-1.8 1,-0.3 -1,-0.2 0.854 114.4 43.9 -51.2 -40.0 -8.3 -33.5 34.5 129 129 A R H 3X S+ 0 0 136 -4,-2.5 4,-1.0 2,-0.2 -1,-0.3 0.686 109.6 54.1 -85.3 -18.2 -8.7 -36.8 32.6 130 130 A E H <>S+ 0 0 13 -4,-2.6 3,-1.9 1,-0.2 5,-1.7 0.942 110.1 55.5 -63.8 -43.8 -7.5 -33.0 29.1 132 132 A A H ><5S+ 0 0 58 -4,-1.8 3,-1.9 -5,-0.3 -1,-0.2 0.769 91.3 73.3 -60.1 -26.3 -5.0 -35.8 29.8 133 133 A K H 3<5S+ 0 0 141 -4,-1.0 -1,-0.3 1,-0.3 -2,-0.2 0.817 109.6 32.6 -53.7 -34.9 -6.7 -37.8 26.9 134 134 A M T <<5S- 0 0 113 -3,-1.9 -1,-0.3 -4,-0.5 -2,-0.2 -0.236 124.5 -98.2-117.2 45.1 -4.8 -35.3 24.7 135 135 A K T < 5S+ 0 0 209 -3,-1.9 2,-0.3 1,-0.2 -3,-0.2 0.758 85.1 121.6 50.9 34.6 -1.7 -34.7 26.9 136 136 A Q < - 0 0 48 -5,-1.7 -1,-0.2 -8,-0.1 -2,-0.2 -0.884 44.7-159.9-122.4 157.5 -2.9 -31.5 28.5 137 137 A E - 0 0 121 -2,-0.3 3,-0.1 -6,-0.1 -9,-0.1 -0.812 40.5 -82.3-122.1 164.9 -3.6 -30.3 32.0 138 138 A P - 0 0 4 0, 0.0 -51,-0.2 0, 0.0 2,-0.1 -0.289 61.4 -81.8 -64.5 158.3 -5.8 -27.4 33.1 139 139 A V - 0 0 2 -53,-2.3 -53,-0.0 -54,-0.1 -3,-0.0 -0.412 43.5-130.2 -68.3 134.4 -4.4 -23.9 32.9 140 140 A K >> - 0 0 117 -2,-0.1 4,-1.7 1,-0.1 3,-1.3 -0.590 13.9-125.5 -79.4 141.5 -2.2 -22.9 35.9 141 141 A P H 3> S+ 0 0 58 0, 0.0 4,-2.4 0, 0.0 -1,-0.1 0.847 114.0 56.2 -56.2 -31.0 -2.9 -19.5 37.6 142 142 A E H 3> S+ 0 0 125 1,-0.2 4,-0.9 2,-0.2 5,-0.1 0.722 103.8 53.8 -75.5 -18.2 0.7 -18.6 37.0 143 143 A E H <> S+ 0 0 71 -3,-1.3 4,-1.1 2,-0.2 -1,-0.2 0.885 112.0 43.4 -76.1 -42.1 0.2 -19.2 33.3 144 144 A G H X S+ 0 0 0 -4,-1.7 4,-2.1 1,-0.2 3,-0.3 0.911 106.8 63.9 -67.9 -42.1 -2.7 -16.8 33.2 145 145 A R H X S+ 0 0 98 -4,-2.4 4,-1.0 1,-0.2 -1,-0.2 0.843 107.0 39.1 -51.0 -44.5 -0.9 -14.3 35.4 146 146 A D H X S+ 0 0 88 -4,-0.9 4,-2.7 2,-0.2 -1,-0.2 0.711 106.8 63.9 -90.4 -20.0 1.9 -13.6 32.9 147 147 A M H X S+ 0 0 7 -4,-1.1 4,-3.2 -3,-0.3 5,-0.3 0.939 103.1 51.2 -53.0 -51.3 -0.4 -13.7 29.9 148 148 A A H <>S+ 0 0 4 -4,-2.1 5,-2.7 1,-0.2 4,-0.4 0.867 113.3 44.9 -53.1 -40.1 -2.0 -10.7 31.6 149 149 A N H <5S+ 0 0 132 -4,-1.0 3,-0.3 3,-0.2 -1,-0.2 0.871 111.8 52.2 -72.6 -36.4 1.5 -9.2 31.8 150 150 A R H <5S+ 0 0 166 -4,-2.7 -2,-0.2 1,-0.2 -3,-0.2 0.913 116.8 37.5 -69.2 -43.4 2.3 -10.2 28.2 151 151 A I T <5S- 0 0 9 -4,-3.2 -1,-0.2 -5,-0.1 -2,-0.2 0.450 112.8-119.5 -85.9 -3.7 -0.9 -8.6 26.8 152 152 A G T 5 + 0 0 55 -4,-0.4 -40,-0.3 -3,-0.3 -3,-0.2 0.993 48.2 172.4 58.9 64.9 -0.6 -5.7 29.2 153 153 A A < - 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0 0 77 1,-0.3 2,-0.2 -105,-0.1 -104,-0.1 0.546 360.0-170.2 -81.4 130.9 -1.0 -7.7 13.1 207 27 B Y - 0 0 30 -106,-0.2 -1,-0.3 -107,-0.1 -109,-0.1 -0.519 16.0-144.2 -59.7 148.6 -4.7 -7.8 13.4 208 28 B K - 0 0 142 -2,-0.2 156,-0.0 -110,-0.1 -106,-0.0 -0.995 15.7-114.8-122.8 132.3 -6.1 -9.2 10.2 209 29 B P - 0 0 60 0, 0.0 3,-0.1 0, 0.0 -141,-0.1 -0.205 38.3 -97.3 -65.4 154.6 -9.4 -8.0 8.7 210 30 B P - 0 0 11 0, 0.0 3,-0.1 0, 0.0 -145,-0.1 -0.328 42.3 -93.2 -71.8 149.2 -12.3 -10.3 8.5 211 31 B A - 0 0 90 1,-0.1 -143,-0.1 -2,-0.0 -144,-0.0 -0.349 65.4 -87.2 -52.8 143.0 -13.2 -12.2 5.4 212 32 B Q + 0 0 153 -3,-0.1 2,-0.3 -144,-0.0 -1,-0.1 -0.222 55.6 177.5 -64.0 148.9 -15.7 -10.0 3.7 213 33 B K - 0 0 51 -3,-0.1 89,-0.3 89,-0.1 2,-0.1 -0.934 21.0-135.8-158.1 134.9 -19.4 -10.3 4.6 214 34 B S > - 0 0 26 -2,-0.3 4,-2.5 1,-0.1 5,-0.1 -0.458 25.1-120.1 -89.3 158.1 -22.7 -8.6 3.8 215 35 B I H > S+ 0 0 15 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.902 116.9 51.9 -63.5 -40.9 -25.4 -7.6 6.2 216 36 B Q H > S+ 0 0 130 2,-0.2 4,-0.5 1,-0.2 -1,-0.2 0.906 110.7 48.5 -59.6 -42.2 -27.9 -9.8 4.4 217 37 B E H >> S+ 0 0 107 1,-0.2 4,-1.1 2,-0.2 3,-0.8 0.885 110.8 52.2 -64.5 -39.1 -25.4 -12.7 4.7 218 38 B I H 3< S+ 0 0 0 -4,-2.5 3,-0.4 1,-0.2 -2,-0.2 0.910 104.4 55.1 -62.4 -42.5 -25.0 -11.9 8.4 219 39 B Q H 3< S+ 0 0 78 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.612 106.5 53.2 -70.1 -9.8 -28.8 -12.0 9.0 220 40 B E H X< S+ 0 0 99 -3,-0.8 3,-1.0 -4,-0.5 -1,-0.2 0.736 81.5 95.8-102.2 -27.2 -29.1 -15.5 7.7 221 41 B L T 3< S+ 0 0 50 -4,-1.1 0, 0.0 -3,-0.4 0, 0.0 -0.417 105.2 0.1 -56.2 138.1 -26.4 -17.3 9.7 222 42 B D T > S+ 0 0 62 1,-0.1 3,-0.7 2,-0.1 -1,-0.3 0.874 79.3 164.8 44.4 49.5 -28.0 -19.1 12.7 223 43 B K T < + 0 0 122 -3,-1.0 -1,-0.1 1,-0.2 -2,-0.1 0.711 68.8 62.9 -66.2 -24.3 -31.4 -17.7 11.6 224 44 B D T 3 S+ 0 0 134 -4,-0.1 2,-0.6 4,-0.0 -1,-0.2 0.796 81.3 90.6 -66.0 -36.9 -32.9 -20.3 14.0 225 45 B D <> - 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