==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-APR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 11-SEP-08 2K8I . COMPND 2 MOLECULE: PEPTIDYL-PROLYL CIS-TRANS ISOMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR U.WEININGER,J.BALBACH . 171 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11301.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 100 58.5 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 . 50 29.2 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 . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 1.8 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 . 19 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 9 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 0 1 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 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 1 2 1 1 1 0 0 0 1 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 1 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 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 0 116 0, 0.0 53,-0.4 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 143.4 12.0 -18.8 6.2 2 2 A K - 0 0 97 51,-0.1 51,-0.2 1,-0.1 2,-0.2 -0.706 360.0 -91.4-106.2 156.1 12.1 -16.4 3.3 3 3 A V + 0 0 4 49,-2.3 48,-1.6 46,-0.3 2,-0.2 -0.439 62.5 138.0 -64.7 126.9 9.8 -15.9 0.4 4 4 A A > - 0 0 30 -2,-0.2 3,-1.2 46,-0.2 32,-0.2 -0.827 52.9 -40.5-152.7-169.8 10.7 -18.1 -2.7 5 5 A K T 3 S+ 0 0 125 -2,-0.2 32,-0.2 1,-0.2 3,-0.1 -0.236 119.4 11.1 -65.2 153.9 9.1 -20.2 -5.4 6 6 A D T 3 S+ 0 0 53 30,-1.6 136,-1.3 1,-0.2 2,-0.4 0.506 101.3 114.0 51.6 6.1 6.2 -22.6 -4.6 7 7 A L E < -A 141 0A 37 -3,-1.2 29,-1.8 29,-0.2 2,-0.4 -0.812 61.7-141.0 -92.9 149.4 5.9 -20.9 -1.3 8 8 A V E -AB 140 35A 8 132,-3.3 132,-2.8 -2,-0.4 2,-0.3 -0.882 22.3-178.5-115.6 142.9 2.7 -19.0 -0.8 9 9 A V E -AB 139 34A 5 25,-2.3 25,-2.2 -2,-0.4 2,-0.5 -0.967 25.4-142.9-142.3 155.7 2.5 -15.7 1.0 10 10 A S E +AB 138 33A 28 128,-1.7 128,-2.0 -2,-0.3 127,-1.4 -0.983 30.4 171.7-117.9 117.6 0.1 -13.1 2.1 11 11 A L E -AB 136 32A 2 21,-2.1 21,-4.1 -2,-0.5 2,-0.5 -0.907 26.1-140.2-127.8 158.5 1.4 -9.5 1.9 12 12 A A E +A 135 0A 2 123,-2.5 123,-1.7 -2,-0.3 2,-0.3 -0.956 30.3 171.7-124.8 112.7 -0.3 -6.1 2.3 13 13 A Y E -A 134 0A 13 -2,-0.5 13,-3.5 121,-0.2 2,-0.4 -0.835 27.0-148.5-126.6 160.9 0.8 -3.4 -0.1 14 14 A Q E -AC 133 25A 48 119,-1.0 119,-2.5 -2,-0.3 2,-0.6 -0.984 16.1-157.3-129.5 118.7 -0.2 0.1 -1.1 15 15 A V E +AC 132 24A 0 9,-2.0 8,-2.6 -2,-0.4 9,-1.8 -0.865 23.6 153.4-106.3 122.5 0.3 1.1 -4.7 16 16 A R E -AC 131 22A 81 115,-2.8 115,-4.0 -2,-0.6 6,-0.2 -0.923 36.8-110.9-139.1 161.2 0.7 4.8 -5.6 17 17 A T E > -A 130 0A 6 4,-2.5 3,-1.4 -2,-0.3 113,-0.2 -0.283 33.3-101.1 -90.3 175.9 2.4 6.6 -8.4 18 18 A E T 3 S+ 0 0 89 111,-1.1 112,-0.1 1,-0.3 -1,-0.1 0.733 122.7 66.8 -63.9 -21.5 5.4 8.8 -8.5 19 19 A D T 3 S- 0 0 29 2,-0.1 -1,-0.3 84,-0.1 3,-0.1 0.693 117.0-116.7 -73.2 -18.6 2.9 11.7 -8.6 20 20 A G S < S+ 0 0 33 -3,-1.4 2,-0.2 1,-0.3 -2,-0.1 0.156 71.7 130.6 105.4 -16.5 1.9 10.7 -5.1 21 21 A V - 0 0 82 81,-0.2 -4,-2.5 -5,-0.1 -1,-0.3 -0.467 57.9-121.9 -79.1 138.8 -1.7 9.6 -5.9 22 22 A L E +C 16 0A 75 -6,-0.2 -6,-0.3 -2,-0.2 3,-0.1 -0.613 30.5 173.1 -79.7 134.4 -3.0 6.3 -4.7 23 23 A V E - 0 0 81 -8,-2.6 2,-0.3 1,-0.4 -7,-0.2 0.751 64.4 -12.3-109.1 -38.5 -4.3 3.9 -7.3 24 24 A D E -C 15 0A 97 -9,-1.8 -9,-2.0 2,-0.0 -1,-0.4 -0.961 58.5-166.6-156.9 168.5 -4.9 0.6 -5.3 25 25 A E E -C 14 0A 87 -2,-0.3 -11,-0.2 -11,-0.2 107,-0.0 -0.942 19.1-155.3-165.5 137.5 -4.3 -0.9 -2.0 26 26 A S - 0 0 19 -13,-3.5 6,-0.2 -2,-0.3 -2,-0.0 -0.969 37.8-134.8-113.0 111.4 -4.4 -4.2 -0.1 27 27 A P - 0 0 48 0, 0.0 3,-0.4 0, 0.0 -14,-0.1 -0.052 16.1-115.8 -68.4 165.8 -4.7 -3.4 3.6 28 28 A V S S+ 0 0 92 1,-0.2 -16,-0.0 -16,-0.1 -2,-0.0 0.646 115.6 63.2 -71.6 -16.1 -2.9 -4.8 6.6 29 29 A S S S+ 0 0 104 1,-0.3 -1,-0.2 2,-0.0 -17,-0.0 0.823 119.1 19.0 -79.2 -33.7 -6.2 -6.2 7.8 30 30 A A S S- 0 0 55 -3,-0.4 -1,-0.3 -19,-0.0 -19,-0.0 -0.900 84.2-151.6-142.1 113.0 -6.6 -8.4 4.7 31 31 A P - 0 0 35 0, 0.0 2,-0.5 0, 0.0 -19,-0.3 -0.078 25.7 -99.1 -75.6 169.2 -3.5 -9.2 2.6 32 32 A L E -B 11 0A 45 -21,-4.1 -21,-2.1 -6,-0.2 2,-0.6 -0.845 40.1-147.4 -84.1 126.4 -3.0 -10.1 -1.0 33 33 A D E +B 10 0A 58 -2,-0.5 2,-0.3 -23,-0.2 -23,-0.2 -0.875 32.6 147.0-104.9 120.6 -2.8 -13.8 -1.3 34 34 A Y E -B 9 0A 4 -25,-2.2 -25,-2.3 -2,-0.6 2,-0.7 -0.984 47.6-119.0-150.3 157.4 -0.6 -15.3 -4.0 35 35 A L E > -B 8 0A 0 -2,-0.3 3,-0.7 115,-0.3 5,-0.4 -0.892 40.5-126.7-102.7 114.6 1.7 -18.2 -4.8 36 36 A H T 3 S+ 0 0 1 -29,-1.8 -30,-1.6 -2,-0.7 -29,-0.2 -0.248 86.6 25.9 -69.8 142.4 5.2 -16.9 -5.4 37 37 A G T 3 S+ 0 0 30 -32,-0.2 -1,-0.2 -31,-0.1 -32,-0.1 0.760 101.7 86.1 81.8 23.9 7.0 -17.8 -8.6 38 38 A H S < S- 0 0 74 -3,-0.7 -2,-0.1 -33,-0.0 -33,-0.0 0.380 103.7-106.3-129.5 -7.9 3.8 -18.4 -10.5 39 39 A G + 0 0 57 -4,-0.2 -3,-0.1 3,-0.1 4,-0.1 0.890 61.1 155.4 83.5 41.2 3.1 -14.8 -11.7 40 40 A S S S+ 0 0 53 -5,-0.4 -4,-0.1 2,-0.1 -7,-0.1 0.866 70.8 3.3 -71.9 -38.9 0.2 -14.1 -9.4 41 41 A L S S- 0 0 35 1,-0.4 2,-0.1 2,-0.0 26,-0.0 0.501 112.4 -33.4-113.4-103.0 0.6 -10.3 -9.3 42 42 A I - 0 0 25 1,-0.1 4,-0.4 26,-0.0 -1,-0.4 -0.380 51.2-106.1-116.3-163.6 3.0 -8.3 -11.4 43 43 A S S > S+ 0 0 63 23,-1.6 4,-0.8 -2,-0.1 24,-0.2 0.917 108.3 36.0 -94.8 -49.1 6.6 -8.6 -12.7 44 44 A G H > S+ 0 0 14 22,-3.2 4,-1.3 19,-0.2 23,-0.1 0.768 111.3 59.0 -79.2 -26.4 8.7 -6.3 -10.6 45 45 A L H > S+ 0 0 0 21,-0.5 4,-3.2 2,-0.2 3,-0.3 0.965 100.0 51.3 -74.4 -52.8 7.0 -6.8 -7.2 46 46 A E H > S+ 0 0 12 -4,-0.4 4,-1.8 1,-0.3 -1,-0.2 0.918 113.3 46.0 -50.6 -49.8 7.4 -10.6 -6.7 47 47 A T H < S+ 0 0 100 -4,-0.8 -1,-0.3 1,-0.2 -2,-0.2 0.835 114.0 49.1 -64.9 -31.8 11.1 -10.5 -7.4 48 48 A A H < S+ 0 0 29 -4,-1.3 -1,-0.2 -3,-0.3 -2,-0.2 0.889 109.0 52.8 -71.9 -40.4 11.4 -7.5 -5.1 49 49 A L H >< S+ 0 0 11 -4,-3.2 3,-1.6 -5,-0.1 -46,-0.3 0.810 91.1 104.1 -61.6 -33.4 9.5 -9.3 -2.4 50 50 A E T 3< S+ 0 0 82 -4,-1.8 -46,-0.2 -5,-0.3 3,-0.1 -0.043 76.5 25.8 -52.1 152.9 11.9 -12.2 -2.8 51 51 A G T 3 S+ 0 0 40 -48,-1.6 -1,-0.2 1,-0.3 -2,-0.1 0.104 99.0 111.9 78.9 -22.6 14.5 -12.8 -0.1 52 52 A H < - 0 0 51 -3,-1.6 -49,-2.3 -4,-0.1 2,-0.3 -0.304 54.8-145.9 -82.6 164.5 12.3 -11.0 2.5 53 53 A E > - 0 0 104 -51,-0.2 3,-1.6 1,-0.1 83,-0.2 -0.898 39.2 -67.6-127.2 160.5 10.6 -12.5 5.5 54 54 A V T 3 S+ 0 0 65 -53,-0.4 83,-0.2 -2,-0.3 -1,-0.1 -0.001 115.9 33.7 -49.7 143.8 7.3 -11.7 7.2 55 55 A G T 3 S+ 0 0 64 81,-3.5 -1,-0.2 1,-0.3 2,-0.2 0.202 81.9 133.5 96.0 -15.6 7.1 -8.4 9.0 56 56 A D < - 0 0 71 -3,-1.6 80,-1.7 80,-0.2 2,-0.4 -0.500 34.0-171.5 -70.0 133.9 9.3 -6.5 6.5 57 57 A K E +D 135 0A 123 -2,-0.2 2,-0.3 78,-0.2 78,-0.2 -0.993 20.6 131.4-132.1 128.8 8.0 -3.2 5.4 58 58 A F E -D 134 0A 55 76,-1.6 76,-3.2 -2,-0.4 2,-0.4 -0.972 50.1-106.3-165.4 157.2 9.4 -1.1 2.7 59 59 A D E -D 133 0A 82 -2,-0.3 2,-0.3 74,-0.3 74,-0.3 -0.780 31.1-156.2 -96.4 141.5 8.3 0.8 -0.4 60 60 A V E -D 132 0A 12 72,-3.0 72,-2.7 -2,-0.4 2,-0.5 -0.873 4.4-154.5-117.1 143.9 9.1 -0.5 -3.8 61 61 A A E +D 131 0A 62 -2,-0.3 2,-0.4 70,-0.2 70,-0.2 -0.934 20.8 167.6-126.5 112.0 9.4 1.4 -7.0 62 62 A V E -D 130 0A 17 68,-2.1 68,-3.1 -2,-0.5 6,-0.1 -0.962 34.0-114.6-125.7 137.6 8.9 -0.5 -10.3 63 63 A G E >> -D 129 0A 19 -2,-0.4 3,-2.4 66,-0.3 4,-0.6 -0.316 32.3-107.8 -68.0 152.8 8.4 0.9 -13.8 64 64 A A T 34 S+ 0 0 1 64,-1.7 3,-0.2 1,-0.3 -1,-0.1 0.681 116.4 70.4 -52.6 -20.9 5.1 0.5 -15.6 65 65 A N T 34 S+ 0 0 86 1,-0.2 -1,-0.3 62,-0.1 4,-0.1 0.822 112.8 25.9 -67.3 -30.4 6.9 -2.1 -17.8 66 66 A D T <4 S+ 0 0 61 -3,-2.4 -22,-3.2 2,-0.1 -23,-1.6 0.245 133.2 28.1-118.7 8.2 7.1 -4.5 -14.9 67 67 A A S < S- 0 0 15 -4,-0.6 2,-0.1 1,-0.3 -4,-0.1 -0.541 100.9 -63.5-138.9-156.1 4.1 -3.3 -12.9 68 68 A Y S S+ 0 0 88 -2,-0.2 -1,-0.3 1,-0.1 -2,-0.1 -0.164 83.0 97.3 -80.6-169.4 0.8 -1.6 -13.6 69 69 A G + 0 0 19 1,-0.1 59,-0.3 -2,-0.1 3,-0.2 0.710 52.5 175.2 101.2 20.9 0.7 1.9 -15.0 70 70 A Q - 0 0 117 1,-0.2 56,-0.1 -6,-0.1 -1,-0.1 -0.006 48.1 -47.4 -59.0 168.6 0.2 1.1 -18.7 71 71 A Y + 0 0 129 54,-0.6 2,-0.4 1,-0.1 -1,-0.2 -0.013 58.0 178.7 -44.7 123.2 -0.4 3.8 -21.3 72 72 A D > - 0 0 65 -3,-0.2 3,-1.8 1,-0.1 49,-0.2 -0.950 19.6-162.6-130.6 113.4 -2.9 6.4 -20.3 73 73 A E T 3 S+ 0 0 123 -2,-0.4 3,-0.4 1,-0.3 -1,-0.1 0.490 87.4 74.2 -74.9 -2.5 -3.6 9.3 -22.7 74 74 A N T 3 S+ 0 0 120 1,-0.2 -1,-0.3 3,-0.0 -3,-0.0 0.617 90.7 60.5 -77.9 -12.2 -5.2 11.3 -19.9 75 75 A L S < S+ 0 0 9 -3,-1.8 46,-0.6 2,-0.0 2,-0.5 0.534 93.7 75.0 -91.8 -10.0 -1.6 11.7 -18.7 76 76 A V E +E 120 0B 27 -3,-0.4 2,-0.3 44,-0.2 44,-0.2 -0.899 60.6 139.6-106.4 132.6 -0.6 13.5 -22.0 77 77 A Q E -E 119 0B 55 42,-1.8 42,-1.9 -2,-0.5 2,-0.6 -0.930 50.9 -98.1-158.0 177.4 -1.7 17.1 -22.6 78 78 A R E -E 118 0B 155 -2,-0.3 40,-0.2 40,-0.2 -2,-0.0 -0.934 35.1-165.8-115.3 114.3 -0.6 20.5 -23.9 79 79 A V E -E 117 0B 29 38,-1.5 38,-2.7 -2,-0.6 2,-0.1 -0.844 26.3-110.4-106.5 132.9 0.6 23.0 -21.3 80 80 A P E >> -E 116 0B 63 0, 0.0 3,-1.4 0, 0.0 4,-0.5 -0.372 24.2-129.6 -59.2 131.9 1.0 26.8 -22.0 81 81 A K G >4 S+ 0 0 80 34,-2.9 3,-0.7 1,-0.3 35,-0.1 0.721 102.0 72.3 -58.3 -24.4 4.7 27.7 -21.9 82 82 A D G >4 S+ 0 0 137 33,-0.4 3,-0.9 1,-0.2 -1,-0.3 0.893 89.0 59.6 -57.8 -43.4 3.9 30.5 -19.5 83 83 A V G <4 S+ 0 0 76 -3,-1.4 2,-0.5 1,-0.3 3,-0.4 0.825 97.9 60.5 -55.7 -32.9 3.3 28.1 -16.7 84 84 A F G X< + 0 0 23 -3,-0.7 3,-1.6 -4,-0.5 -1,-0.3 -0.164 64.1 138.1 -90.6 40.2 6.9 26.8 -17.1 85 85 A M T < + 0 0 166 -3,-0.9 -1,-0.2 -2,-0.5 -2,-0.1 0.776 69.5 54.4 -57.5 -29.1 8.4 30.2 -16.3 86 86 A G T 3 S+ 0 0 73 -3,-0.4 -1,-0.3 0, 0.0 2,-0.1 0.659 87.2 100.6 -81.1 -15.4 11.0 28.6 -14.1 87 87 A V S < S- 0 0 38 -3,-1.6 3,-0.2 1,-0.1 9,-0.0 -0.436 71.2-137.8 -73.3 142.3 12.2 26.3 -16.9 88 88 A D S S- 0 0 144 1,-0.3 2,-0.4 -2,-0.1 -1,-0.1 0.998 81.7 -13.2 -61.1 -68.0 15.3 27.3 -18.8 89 89 A E - 0 0 130 2,-0.0 2,-1.2 0, 0.0 -1,-0.3 -0.941 63.7-132.3-142.4 115.6 14.2 26.5 -22.3 90 90 A L + 0 0 27 -2,-0.4 2,-0.3 -3,-0.2 -9,-0.0 -0.550 48.7 158.5 -66.6 98.9 11.1 24.5 -23.2 91 91 A Q > - 0 0 123 -2,-1.2 3,-1.1 20,-0.0 18,-0.3 -0.793 46.3 -92.9-121.5 165.7 12.7 22.2 -25.7 92 92 A V T 3 S+ 0 0 77 -2,-0.3 18,-0.2 1,-0.2 3,-0.1 -0.573 110.2 27.4 -80.2 139.8 11.8 18.8 -27.1 93 93 A G T 3 S+ 0 0 48 16,-3.9 2,-0.4 1,-0.3 -1,-0.2 0.461 89.7 137.6 89.0 1.2 13.3 15.8 -25.4 94 94 A M < - 0 0 57 -3,-1.1 15,-2.6 15,-0.2 2,-0.4 -0.669 38.7-156.3 -87.6 135.2 13.5 17.8 -22.1 95 95 A R E +F 108 0B 166 -2,-0.4 2,-0.3 13,-0.2 13,-0.2 -0.891 25.0 144.1-111.2 139.6 12.6 16.1 -18.9 96 96 A F E -F 107 0B 40 11,-1.7 11,-1.6 -2,-0.4 2,-0.4 -0.966 51.6 -99.6-163.6 154.4 11.5 17.8 -15.7 97 97 A L E -F 106 0B 111 -2,-0.3 2,-0.4 9,-0.2 -2,-0.0 -0.723 43.2-161.4 -77.6 131.3 9.1 17.4 -12.8 98 98 A A E -F 105 0B 6 7,-1.6 7,-3.9 -2,-0.4 2,-0.4 -0.942 14.7-134.6-119.8 134.9 6.0 19.4 -13.5 99 99 A E E +F 104 0B 174 -2,-0.4 2,-0.2 5,-0.3 -2,-0.0 -0.756 41.9 156.0 -88.8 137.2 3.5 20.6 -11.0 100 100 A T E > -F 103 0B 51 3,-0.9 3,-1.5 -2,-0.4 -1,-0.0 -0.731 60.4 -76.7-145.4-176.2 -0.1 20.0 -12.3 101 101 A D T 3 S+ 0 0 161 1,-0.3 -2,-0.0 -2,-0.2 -1,-0.0 0.866 132.2 48.9 -55.2 -35.6 -3.7 19.4 -11.4 102 102 A Q T 3 S- 0 0 94 1,-0.4 -1,-0.3 -81,-0.0 -81,-0.2 0.041 123.3-103.2 -98.0 25.5 -2.6 15.9 -10.5 103 103 A G E < S-F 100 0B 24 -3,-1.5 -3,-0.9 -83,-0.1 -1,-0.4 -0.370 77.8 -11.0 81.7-173.4 0.3 17.0 -8.4 104 104 A P E -F 99 0B 49 0, 0.0 -5,-0.3 0, 0.0 -7,-0.1 -0.501 68.7-170.4 -58.9 124.0 4.0 16.8 -9.6 105 105 A V E -F 98 0B 3 -7,-3.9 -7,-1.6 -2,-0.3 2,-1.0 -0.974 20.0-137.9-124.6 113.7 4.0 14.8 -12.8 106 106 A P E +F 97 0B 59 0, 0.0 -9,-0.2 0, 0.0 2,-0.2 -0.617 42.9 162.9 -72.1 101.5 7.4 13.7 -14.3 107 107 A V E -F 96 0B 9 -11,-1.6 -11,-1.7 -2,-1.0 2,-0.4 -0.635 32.6-138.3-117.8 173.3 6.9 14.4 -18.0 108 108 A E E -FG 95 120B 28 12,-0.8 12,-1.6 -2,-0.2 2,-0.4 -1.000 23.7-118.8-136.0 136.4 9.0 14.8 -21.1 109 109 A I E + G 0 119B 0 -15,-2.6 -16,-3.9 -2,-0.4 10,-0.3 -0.583 29.1 173.6 -77.5 129.6 8.5 17.4 -23.9 110 110 A T E S+ 0 0 75 8,-3.6 2,-0.3 1,-0.4 9,-0.2 0.351 70.4 1.9-114.8 1.6 7.8 15.8 -27.3 111 111 A A E - G 0 118B 22 7,-0.9 7,-3.2 -20,-0.2 2,-0.4 -0.915 54.1-147.6 178.3 153.9 7.1 19.1 -29.0 112 112 A V E - G 0 117B 40 5,-0.3 5,-0.3 -2,-0.3 -20,-0.1 -0.933 23.2-174.6-139.4 108.6 6.9 22.9 -28.5 113 113 A E - 0 0 94 3,-2.7 5,-0.0 -2,-0.4 -2,-0.0 0.107 48.5 -68.0 -87.4-156.0 4.4 24.8 -30.4 114 114 A D S S- 0 0 156 1,-0.1 3,-0.1 3,-0.0 -1,-0.0 0.912 123.9 -4.9 -64.4 -44.0 3.8 28.6 -30.7 115 115 A D S S+ 0 0 96 1,-0.2 -34,-2.9 -34,-0.0 -33,-0.4 0.498 129.1 43.6-131.9 -15.1 2.6 29.1 -27.1 116 116 A H E -E 80 0B 55 -36,-0.3 -3,-2.7 -35,-0.1 2,-0.3 -0.935 65.7-134.7-136.6 159.3 2.4 25.6 -25.5 117 117 A V E -EG 79 112B 0 -38,-2.7 -38,-1.5 -2,-0.3 2,-0.6 -0.735 17.1-124.0-112.7 162.3 4.4 22.5 -25.3 118 118 A V E +EG 78 111B 23 -7,-3.2 -8,-3.6 -2,-0.3 -7,-0.9 -0.934 31.4 175.1-109.3 116.5 3.4 18.9 -25.6 119 119 A V E -EG 77 109B 1 -42,-1.9 -42,-1.8 -2,-0.6 2,-0.4 -0.977 11.4-167.5-122.6 138.8 4.3 16.5 -22.8 120 120 A D E -EG 76 108B 37 -12,-1.6 -12,-0.8 -2,-0.4 -44,-0.2 -0.989 15.7-158.4-124.2 126.4 3.5 12.9 -22.4 121 121 A G S S+ 0 0 10 -46,-0.6 2,-0.8 -2,-0.4 7,-0.3 0.734 82.8 80.0 -71.7 -22.0 3.9 11.1 -19.1 122 122 A N + 0 0 8 -50,-0.2 5,-0.2 1,-0.2 -1,-0.1 -0.775 58.0 163.3 -87.2 111.2 4.0 7.9 -21.1 123 123 A H + 0 0 98 3,-2.1 -1,-0.2 -2,-0.8 4,-0.2 0.876 68.7 0.1 -95.1 -82.2 7.4 7.5 -22.6 124 124 A M S S- 0 0 119 1,-0.0 -2,-0.1 0, 0.0 0, 0.0 0.990 146.2 -28.0 -76.8 -62.0 8.4 4.1 -23.9 125 125 A L S S- 0 0 87 -55,-0.0 -54,-0.6 0, 0.0 -3,-0.1 0.475 126.1 -49.6-119.0 -20.3 5.2 2.2 -23.1 126 126 A A - 0 0 0 -56,-0.1 -3,-2.1 -55,-0.1 2,-0.4 -0.152 66.2-165.9 180.0 -61.4 4.3 4.4 -20.2 127 127 A G + 0 0 22 1,-0.3 -5,-0.1 -5,-0.2 -62,-0.1 -0.013 39.5 130.7 89.7 -32.4 7.4 4.5 -18.2 128 128 A Q - 0 0 32 -2,-0.4 -64,-1.7 -7,-0.3 -1,-0.3 -0.278 53.8-131.1 -55.8 136.4 5.9 6.0 -15.0 129 129 A N E - D 0 63A 51 -66,-0.3 -111,-1.1 -65,-0.1 2,-0.4 -0.578 10.8-139.6 -89.5 156.4 7.0 4.0 -12.0 130 130 A L E -AD 17 62A 3 -68,-3.1 -68,-2.1 -2,-0.2 2,-0.5 -0.899 8.1-143.2-112.5 147.4 4.7 2.8 -9.3 131 131 A K E -AD 16 61A 66 -115,-4.0 -115,-2.8 -2,-0.4 2,-0.5 -0.952 15.5-170.8-114.9 122.7 5.5 2.8 -5.6 132 132 A F E -AD 15 60A 0 -72,-2.7 -72,-3.0 -2,-0.5 2,-0.9 -0.948 14.5-152.9-115.3 121.2 4.3 -0.1 -3.5 133 133 A N E -AD 14 59A 49 -119,-2.5 -119,-1.0 -2,-0.5 2,-0.4 -0.834 26.8-159.1 -92.9 107.2 4.5 0.0 0.2 134 134 A V E -AD 13 58A 1 -76,-3.2 -76,-1.6 -2,-0.9 2,-0.4 -0.723 21.8-177.4 -99.7 139.7 4.7 -3.7 1.0 135 135 A E E -AD 12 57A 75 -123,-1.7 -123,-2.5 -2,-0.4 2,-0.7 -0.851 19.4-148.6-133.0 90.8 3.9 -5.3 4.3 136 136 A V E -A 11 0A 14 -80,-1.7 -81,-3.5 -2,-0.4 -125,-0.3 -0.506 15.9-176.7 -66.8 107.6 4.6 -9.0 4.2 137 137 A V E - 0 0 65 -127,-1.4 2,-0.3 -2,-0.7 -126,-0.2 0.929 59.4 -17.9 -72.4 -47.6 2.0 -10.5 6.6 138 138 A A E -A 10 0A 46 -128,-2.0 -128,-1.7 -84,-0.1 2,-0.4 -0.988 49.5-149.6-160.6 157.3 3.1 -14.2 6.4 139 139 A I E +A 9 0A 15 -2,-0.3 2,-0.3 -130,-0.2 -130,-0.2 -0.999 20.2 172.0-137.7 134.3 5.0 -16.8 4.4 140 140 A R E -A 8 0A 166 -132,-2.8 -132,-3.3 -2,-0.4 2,-0.5 -0.997 36.5-116.2-143.5 142.8 4.2 -20.5 4.2 141 141 A E E -A 7 0A 149 -2,-0.3 -134,-0.2 -134,-0.3 -135,-0.1 -0.716 50.8-109.7 -79.7 126.5 5.5 -23.4 2.1 142 142 A A - 0 0 17 -136,-1.3 -1,-0.1 -2,-0.5 10,-0.0 0.014 12.5-117.4 -66.8 166.6 2.5 -24.6 0.0 143 143 A T - 0 0 56 1,-0.1 2,-2.1 -3,-0.1 -1,-0.1 0.051 45.4-112.6 -92.2 23.1 0.5 -27.7 0.4 144 144 A E S > S+ 0 0 153 -138,-0.2 4,-3.4 1,-0.2 5,-0.2 -0.159 115.0 73.7 69.7 -42.6 1.5 -29.1 -3.0 145 145 A E H > S+ 0 0 107 -2,-2.1 4,-2.2 2,-0.2 5,-0.3 0.916 93.4 51.5 -63.4 -42.2 -2.2 -28.6 -4.0 146 146 A E H >>S+ 0 0 1 2,-0.2 4,-2.1 1,-0.2 5,-1.1 0.861 113.8 44.8 -61.8 -35.0 -1.6 -24.9 -4.1 147 147 A L H 45S+ 0 0 48 2,-0.2 -2,-0.2 3,-0.2 -1,-0.2 0.927 111.6 51.5 -73.5 -46.5 1.3 -25.6 -6.4 148 148 A A H <5S+ 0 0 83 -4,-3.4 -2,-0.2 1,-0.2 -1,-0.2 0.804 119.5 36.8 -60.4 -31.9 -0.6 -28.2 -8.5 149 149 A H H <5S- 0 0 120 -4,-2.2 -1,-0.2 2,-0.3 -2,-0.2 0.780 108.9-123.2 -93.4 -31.7 -3.4 -25.6 -9.0 150 150 A G T <5S+ 0 0 24 -4,-2.1 -115,-0.3 1,-0.3 2,-0.3 0.519 78.7 49.1 103.2 8.3 -1.1 -22.6 -9.2 151 151 A H S