==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 19-OCT-09 3KAD . COMPND 2 MOLECULE: PEPTIDYL-PROLYL CIS-TRANS ISOMERASE NIMA- . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR L.M.BAKER,P.DOKURNO,D.A.ROBINSON,A.E.SURGENOR,J.B.MURRAY, . 145 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8210.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 87 60.0 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 . 28 19.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 1.4 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 1.4 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 . 7 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 29 20.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.4 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 0 0 0 1 1 0 0 0 0 0 0 1 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 . 1 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 1 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 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 7 A L 0 0 95 0, 0.0 3,-0.1 0, 0.0 31,-0.1 0.000 360.0 360.0 360.0 149.8 56.4 -12.3 8.5 2 8 A P > - 0 0 30 0, 0.0 3,-1.9 0, 0.0 121,-0.0 -0.147 360.0 -56.6 -69.5 168.8 53.5 -11.0 6.2 3 9 A P T 3 S+ 0 0 98 0, 0.0 19,-0.1 0, 0.0 3,-0.1 -0.072 123.4 10.3 -46.6 129.9 50.0 -10.0 7.7 4 10 A G T 3 S+ 0 0 12 1,-0.3 17,-2.3 -3,-0.1 2,-0.3 0.161 97.6 123.4 95.1 -21.7 48.2 -12.9 9.6 5 11 A W E < +A 20 0A 12 -3,-1.9 2,-0.3 15,-0.2 -1,-0.3 -0.587 33.0 175.3 -88.7 138.0 51.3 -15.2 9.7 6 12 A E E -A 19 0A 93 13,-2.9 13,-2.6 -2,-0.3 2,-0.3 -0.965 28.5-123.9-134.9 150.0 52.8 -16.6 12.9 7 13 A K E +A 18 0A 116 -2,-0.3 2,-0.3 11,-0.2 11,-0.2 -0.678 38.2 174.8 -85.9 143.8 55.6 -19.0 13.6 8 14 A A E -A 17 0A 23 9,-2.7 9,-2.2 -2,-0.3 2,-0.6 -0.942 32.1-106.6-145.9 172.0 54.7 -22.0 15.7 9 15 A M E -A 16 0A 116 -2,-0.3 2,-0.3 7,-0.2 7,-0.2 -0.870 29.2-129.3-105.8 126.2 56.0 -25.2 17.1 10 16 A S > - 0 0 9 5,-2.6 4,-1.3 -2,-0.6 5,-0.0 -0.588 11.7-153.3 -73.7 135.3 54.8 -28.5 15.6 11 17 A R T 4 S+ 0 0 248 -2,-0.3 -1,-0.2 1,-0.2 -2,-0.0 0.818 90.1 50.0 -83.4 -27.8 53.7 -30.8 18.5 12 18 A S T 4 S+ 0 0 120 1,-0.1 -1,-0.2 3,-0.1 -2,-0.0 0.946 127.0 13.4 -72.7 -54.3 54.4 -34.0 16.5 13 19 A S T 4 S- 0 0 64 2,-0.2 -2,-0.2 3,-0.0 -1,-0.1 0.551 90.4-119.0 -99.8 -14.7 58.0 -33.4 15.2 14 20 A G S < S+ 0 0 47 -4,-1.3 2,-0.2 1,-0.3 -3,-0.1 0.507 71.4 136.2 79.4 0.4 59.4 -30.5 17.2 15 21 A R - 0 0 134 -6,-0.1 -5,-2.6 1,-0.1 -1,-0.3 -0.589 59.7-113.5 -83.8 147.7 59.7 -28.7 13.8 16 22 A V E +A 9 0A 53 -7,-0.2 2,-0.3 -2,-0.2 -7,-0.2 -0.438 38.7 177.3 -66.3 145.1 58.7 -25.1 13.3 17 23 A Y E -A 8 0A 70 -9,-2.2 -9,-2.7 -2,-0.1 2,-0.4 -0.868 21.8-126.3-136.9-179.6 55.8 -24.5 11.0 18 24 A Y E -AB 7 27A 19 9,-2.9 9,-2.3 -2,-0.3 2,-0.3 -0.981 23.5-179.8-131.2 137.4 53.9 -21.3 10.0 19 25 A F E -AB 6 26A 65 -13,-2.6 -13,-2.9 -2,-0.4 2,-0.5 -0.964 19.9-141.1-140.2 154.9 50.2 -20.6 10.2 20 26 A N E > -A 5 0A 0 5,-2.3 4,-2.0 -2,-0.3 5,-0.3 -0.973 2.7-161.8-121.1 117.4 48.0 -17.7 9.2 21 27 A H T 4 S+ 0 0 105 -17,-2.3 -16,-0.1 -2,-0.5 -1,-0.1 0.563 91.6 51.3 -81.8 -8.3 45.1 -16.9 11.6 22 28 A I T 4 S+ 0 0 58 -18,-0.2 -1,-0.2 -19,-0.1 98,-0.1 0.823 125.8 22.9 -89.7 -36.8 43.3 -14.7 8.9 23 29 A T T 4 S- 0 0 1 2,-0.1 108,-2.8 100,-0.1 -2,-0.2 0.556 94.8-130.6-103.8 -7.9 43.4 -17.4 6.1 24 30 A N < + 0 0 77 -4,-2.0 -3,-0.1 1,-0.2 2,-0.1 0.625 55.8 149.5 59.4 20.0 43.8 -20.6 8.2 25 31 A A - 0 0 11 -5,-0.3 -5,-2.3 106,-0.2 2,-0.3 -0.438 23.7-175.1 -73.4 148.3 46.7 -21.6 5.9 26 32 A S E +B 19 0A 57 -7,-0.2 2,-0.3 -2,-0.1 -7,-0.2 -0.988 10.4 156.3-145.9 145.8 49.4 -23.7 7.4 27 33 A Q E -B 18 0A 53 -9,-2.3 -9,-2.9 -2,-0.3 -2,-0.0 -0.980 45.7-125.3-160.8 152.8 52.7 -24.9 5.9 28 34 A W S S+ 0 0 113 -2,-0.3 2,-0.1 -11,-0.2 -1,-0.1 0.829 87.6 84.0 -66.9 -37.1 56.2 -26.0 6.8 29 35 A E S S- 0 0 127 1,-0.1 -11,-0.1 -11,-0.1 -2,-0.1 -0.399 90.9-107.4 -76.5 144.7 57.9 -23.4 4.6 30 36 A R - 0 0 148 -2,-0.1 -1,-0.1 1,-0.1 -2,-0.1 -0.514 52.8-104.2 -67.3 131.1 58.5 -19.8 5.8 31 37 A P 0 0 9 0, 0.0 -1,-0.1 0, 0.0 -26,-0.0 -0.264 360.0 360.0 -66.3 145.0 55.9 -17.7 3.8 32 38 A S 0 0 131 -31,-0.1 93,-0.0 93,-0.0 -2,-0.0 -0.815 360.0 360.0 127.5 360.0 56.4 -15.3 0.8 33 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 34 51 A E 0 0 165 0, 0.0 89,-0.1 0, 0.0 88,-0.0 0.000 360.0 360.0 360.0 128.0 48.2 -4.6 0.2 35 52 A P - 0 0 45 0, 0.0 3,-0.1 0, 0.0 0, 0.0 -0.262 360.0-137.9 -66.0 151.2 46.4 -4.6 -3.3 36 53 A A S S+ 0 0 84 1,-0.2 74,-0.6 73,-0.1 2,-0.3 0.757 91.0 21.9 -71.5 -35.6 43.2 -2.5 -4.1 37 54 A R E -C 109 0B 130 72,-0.2 2,-0.3 85,-0.0 72,-0.2 -0.989 65.0-172.0-135.2 148.2 41.7 -5.5 -5.9 38 55 A V E -C 108 0B 2 70,-2.2 70,-2.7 -2,-0.3 2,-0.4 -0.939 16.3-141.7-129.7 155.0 42.1 -9.3 -5.8 39 56 A R E +C 107 0B 81 107,-2.1 106,-2.6 -2,-0.3 107,-1.4 -0.982 30.4 174.8-112.0 128.9 40.7 -12.0 -8.0 40 57 A C E - D 0 144B 0 66,-1.2 65,-2.4 -2,-0.4 66,-0.4 -0.974 24.3-157.3-132.0 154.8 39.8 -15.2 -6.2 41 58 A S E -CD 104 143B 10 102,-2.5 102,-3.3 -2,-0.3 2,-0.3 -0.826 22.2-172.7-111.3 162.5 38.1 -18.6 -6.8 42 59 A H E - D 0 142B 8 61,-1.7 2,-0.5 -2,-0.3 100,-0.2 -0.970 26.4-140.0-149.5 166.6 36.6 -20.6 -4.0 43 60 A L E - D 0 141B 0 98,-2.0 98,-1.7 -2,-0.3 2,-0.5 -0.996 26.2-159.2-126.1 115.2 35.0 -23.9 -3.2 44 61 A L E - D 0 140B 8 -2,-0.5 51,-3.2 96,-0.2 2,-0.5 -0.877 9.7-169.7 -97.2 126.9 32.0 -23.6 -0.8 45 62 A V E - D 0 139B 1 94,-3.1 94,-3.1 -2,-0.5 2,-0.1 -0.977 16.1-157.6-114.3 119.7 30.7 -26.5 1.3 46 63 A K - 0 0 13 -2,-0.5 2,-0.2 92,-0.2 92,-0.2 -0.433 8.2-167.6 -87.0 161.1 27.3 -25.6 2.8 47 64 A H > - 0 0 8 90,-0.3 3,-2.0 -2,-0.1 17,-0.2 -0.835 43.1 -85.2-142.4 177.0 25.9 -27.2 5.9 48 65 A S T 3 S+ 0 0 62 15,-2.5 16,-0.1 1,-0.3 13,-0.1 0.829 127.1 52.7 -59.7 -25.5 22.4 -27.4 7.8 49 66 A Q T 3 S+ 0 0 145 3,-0.1 -1,-0.3 13,-0.0 89,-0.1 0.519 82.7 119.5 -89.4 -1.6 23.4 -24.1 9.6 50 67 A S S < S- 0 0 7 -3,-2.0 87,-0.2 87,-0.1 86,-0.1 -0.244 78.8-110.6 -58.8 155.8 24.2 -22.1 6.4 51 68 A R S S+ 0 0 174 85,-2.9 86,-0.1 1,-0.3 -1,-0.1 0.917 114.7 20.3 -49.4 -50.5 22.2 -18.9 5.6 52 69 A R S S- 0 0 141 85,-0.2 2,-2.8 84,-0.2 -1,-0.3 -0.830 74.7-162.5-125.5 90.7 20.7 -20.7 2.7 53 70 A P + 0 0 50 0, 0.0 8,-2.6 0, 0.0 2,-0.3 -0.210 63.2 86.3 -76.4 61.4 20.9 -24.5 3.1 54 71 A S + 0 0 34 -2,-2.8 2,-0.3 6,-0.2 5,-0.2 -0.982 48.3 165.8-149.4 144.5 20.2 -25.2 -0.7 55 72 A S - 0 0 13 3,-2.8 3,-0.3 -2,-0.3 41,-0.1 -0.969 54.2 -90.7-151.5 176.0 22.4 -25.3 -3.8 56 73 A W S S+ 0 0 111 -2,-0.3 3,-0.1 39,-0.3 39,-0.1 0.772 126.6 50.6 -53.0 -26.9 22.6 -26.4 -7.5 57 74 A R S S+ 0 0 97 1,-0.3 2,-0.4 37,-0.1 -1,-0.2 0.867 123.6 14.9 -79.9 -33.9 23.9 -29.8 -6.1 58 75 A Q - 0 0 74 -3,-0.3 -3,-2.8 1,-0.1 -1,-0.3 -0.995 56.0-149.0-152.0 122.7 21.2 -30.5 -3.5 59 76 A E S S+ 0 0 176 -2,-0.4 2,-0.5 1,-0.3 -1,-0.1 0.916 98.2 28.8 -65.5 -39.2 17.8 -29.0 -2.9 60 77 A K S S- 0 0 148 -6,-0.1 2,-0.6 -5,-0.0 -1,-0.3 -0.932 76.0-154.7-122.5 117.1 18.1 -29.6 0.8 61 78 A I + 0 0 2 -8,-2.6 -11,-0.1 -2,-0.5 -14,-0.1 -0.730 23.8 162.7 -87.3 122.0 21.6 -29.5 2.4 62 79 A T + 0 0 86 -2,-0.6 -14,-0.2 -16,-0.1 -1,-0.1 0.464 29.1 117.7-118.4 -11.8 21.5 -31.6 5.6 63 80 A R - 0 0 35 -17,-0.1 -15,-2.5 1,-0.1 2,-0.1 -0.240 67.0-113.2 -55.7 150.4 25.2 -32.4 6.4 64 81 A T > - 0 0 63 -17,-0.2 4,-2.7 -16,-0.1 5,-0.2 -0.392 23.8-105.4 -75.5 168.8 26.4 -30.9 9.7 65 82 A K H > S+ 0 0 90 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.924 124.9 51.6 -56.0 -40.1 28.9 -28.1 10.1 66 83 A E H > S+ 0 0 93 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.880 108.4 48.9 -66.3 -43.3 31.3 -30.8 11.3 67 84 A E H > S+ 0 0 102 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.893 110.6 52.0 -64.7 -36.3 30.7 -33.1 8.3 68 85 A A H X S+ 0 0 0 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.872 108.3 51.8 -62.5 -41.5 31.2 -30.0 6.0 69 86 A L H X S+ 0 0 55 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.924 108.1 50.5 -65.4 -40.6 34.5 -29.3 7.8 70 87 A E H X S+ 0 0 151 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.873 110.1 50.5 -62.5 -39.5 35.7 -32.9 7.2 71 88 A L H X S+ 0 0 63 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.933 112.2 47.3 -60.4 -50.1 34.7 -32.6 3.4 72 89 A I H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 5,-0.2 0.910 111.3 50.5 -54.9 -48.2 36.8 -29.3 3.2 73 90 A N H X S+ 0 0 73 -4,-2.8 4,-1.7 1,-0.2 -1,-0.2 0.876 110.3 50.1 -61.1 -36.5 39.7 -30.9 5.0 74 91 A G H X S+ 0 0 19 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.902 111.0 49.8 -71.6 -40.8 39.6 -33.9 2.5 75 92 A Y H X S+ 0 0 24 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.927 109.8 50.3 -65.0 -40.9 39.5 -31.5 -0.5 76 93 A I H X S+ 0 0 19 -4,-2.7 4,-3.0 1,-0.2 -1,-0.2 0.899 109.3 52.6 -60.3 -42.2 42.5 -29.5 0.8 77 94 A Q H X S+ 0 0 137 -4,-1.7 4,-2.2 -5,-0.2 6,-0.3 0.928 111.2 45.7 -59.4 -46.1 44.4 -32.8 1.3 78 95 A K H <>S+ 0 0 75 -4,-2.2 6,-2.0 2,-0.2 5,-1.3 0.843 114.4 47.5 -66.5 -35.6 43.8 -33.8 -2.3 79 96 A I H ><5S+ 0 0 33 -4,-2.6 3,-0.6 4,-0.2 -2,-0.2 0.915 113.8 47.7 -70.0 -42.0 44.7 -30.4 -3.6 80 97 A K H 3<5S+ 0 0 128 -4,-3.0 -2,-0.2 1,-0.2 -3,-0.2 0.863 112.4 48.4 -68.6 -35.5 47.9 -30.2 -1.5 81 98 A S T 3<5S- 0 0 81 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.559 112.1-119.4 -75.9 -13.3 49.0 -33.7 -2.5 82 99 A G T < 5S+ 0 0 62 -3,-0.6 -3,-0.2 -4,-0.5 3,-0.1 0.635 79.8 124.7 83.3 11.2 48.4 -33.0 -6.2 83 100 A E S - 0 0 88 -2,-0.3 4,-1.9 -3,-0.1 5,-0.2 -0.600 24.5-115.2 -93.7 154.9 43.4 -29.8 -8.7 86 103 A F H > S+ 0 0 8 -2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.895 113.6 53.7 -44.5 -52.1 41.4 -27.0 -7.1 87 104 A E H > S+ 0 0 68 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.882 107.7 50.7 -60.6 -41.3 39.4 -26.2 -10.3 88 105 A S H > S+ 0 0 46 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.876 113.1 43.9 -63.0 -45.4 38.2 -29.8 -10.6 89 106 A L H X S+ 0 0 4 -4,-1.9 4,-2.6 2,-0.2 5,-0.4 0.852 113.6 51.4 -67.8 -36.3 37.0 -30.1 -7.1 90 107 A A H X S+ 0 0 0 -4,-2.6 4,-1.7 -5,-0.2 -2,-0.2 0.937 110.9 48.8 -63.1 -47.4 35.3 -26.6 -7.3 91 108 A S H < S+ 0 0 39 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.905 121.9 33.5 -56.4 -47.1 33.5 -27.6 -10.5 92 109 A Q H < S+ 0 0 94 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.824 132.7 20.2 -79.7 -34.5 32.3 -30.9 -9.1 93 110 A F H < S+ 0 0 55 -4,-2.6 -3,-0.2 -5,-0.2 2,-0.2 0.546 81.1 115.3-123.6 -10.9 31.7 -30.1 -5.4 94 111 A S < - 0 0 0 -4,-1.7 -49,-0.2 -5,-0.4 5,-0.1 -0.492 51.4-149.9 -71.0 137.2 31.3 -26.5 -4.6 95 112 A D S S+ 0 0 2 -51,-3.2 2,-0.4 -2,-0.2 -39,-0.3 0.306 73.7 91.5 -90.3 7.1 27.8 -25.5 -3.4 96 113 A C S > S- 0 0 28 -52,-0.2 3,-2.5 -6,-0.1 4,-0.2 -0.823 84.4-126.1 -97.4 145.9 28.2 -22.1 -4.9 97 114 A S G > S+ 0 0 96 -2,-0.4 3,-1.7 1,-0.3 4,-0.2 0.725 105.5 79.8 -64.1 -17.4 26.9 -21.4 -8.5 98 115 A S G > > + 0 0 16 1,-0.3 5,-2.1 2,-0.2 3,-1.5 0.569 67.6 87.9 -59.3 -16.0 30.4 -20.2 -9.2 99 116 A A G X 5S+ 0 0 1 -3,-2.5 3,-1.9 1,-0.2 -1,-0.3 0.840 77.4 65.6 -43.9 -35.8 31.3 -23.9 -9.5 100 117 A K G < 5S+ 0 0 140 -3,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.731 102.4 45.9 -71.5 -19.1 30.3 -23.5 -13.2 101 118 A A G X 5S- 0 0 54 -3,-1.5 3,-1.8 -4,-0.2 -1,-0.3 -0.104 129.1 -94.9-107.8 34.1 33.3 -21.2 -13.6 102 119 A R T < 5S- 0 0 163 -3,-1.9 -3,-0.2 1,-0.3 -2,-0.2 0.806 83.8 -57.7 54.2 31.3 35.8 -23.5 -11.7 103 120 A G T 3 -C 37 0B 37 -2,-0.3 3,-0.8 -72,-0.2 4,-0.4 -0.632 46.4 -68.1-109.1 176.1 37.9 -4.8 -3.8 110 127 A R T 3 S+ 0 0 88 -74,-0.6 -1,-0.2 1,-0.2 5,-0.0 -0.238 114.9 42.1 -59.1 151.1 37.4 -4.4 -0.0 111 128 A G T 3 S+ 0 0 70 2,-0.2 -1,-0.2 -3,-0.1 4,-0.1 0.602 95.9 79.5 86.2 12.2 33.9 -3.8 1.1 112 129 A Q S < S+ 0 0 110 -3,-0.8 2,-0.2 2,-0.1 -2,-0.1 0.729 81.2 53.0-110.8 -43.1 32.0 -6.2 -1.3 113 130 A M S S- 0 0 56 -4,-0.4 -2,-0.2 1,-0.2 5,-0.1 -0.610 101.5 -74.4 -97.8 159.7 32.3 -9.8 0.1 114 131 A A > - 0 0 57 -2,-0.2 4,-3.3 1,-0.1 5,-0.2 -0.145 55.3-113.1 -38.9 138.6 31.4 -11.2 3.6 115 132 A K H > S+ 0 0 60 1,-0.2 4,-3.3 2,-0.2 5,-0.3 0.846 113.3 49.4 -51.3 -48.7 34.2 -10.0 6.0 116 133 A P H > S+ 0 0 59 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.921 115.0 45.9 -63.9 -39.6 35.8 -13.2 6.8 117 134 A F H > S+ 0 0 6 -3,-0.2 4,-2.9 2,-0.2 -2,-0.2 0.963 116.5 46.1 -63.2 -44.7 36.0 -14.2 3.1 118 135 A E H X S+ 0 0 23 -4,-3.3 4,-2.5 1,-0.2 5,-0.2 0.938 111.3 50.3 -65.0 -44.7 37.3 -10.7 2.2 119 136 A D H X S+ 0 0 67 -4,-3.3 4,-1.2 -5,-0.2 -1,-0.2 0.911 112.9 47.2 -59.7 -41.9 39.9 -10.7 5.0 120 137 A A H X S+ 0 0 0 -4,-1.8 4,-1.0 -5,-0.3 3,-0.5 0.945 111.1 51.4 -65.1 -43.5 41.2 -14.0 3.9 121 138 A S H >< S+ 0 0 0 -4,-2.9 3,-0.5 1,-0.2 -2,-0.2 0.891 111.3 46.7 -61.0 -43.9 41.3 -13.1 0.2 122 139 A F H 3< S+ 0 0 10 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.689 108.4 57.1 -73.6 -14.4 43.3 -9.9 0.9 123 140 A A H 3< S+ 0 0 15 -4,-1.2 -1,-0.2 -3,-0.5 2,-0.2 0.616 93.0 84.0 -91.7 -9.6 45.7 -11.8 3.2 124 141 A L S << S- 0 0 3 -4,-1.0 2,-0.3 -3,-0.5 3,-0.1 -0.585 74.3-135.5 -83.5 150.5 46.7 -14.3 0.5 125 142 A R > - 0 0 69 -2,-0.2 3,-2.5 1,-0.1 19,-0.3 -0.681 46.6 -73.2 -95.5 159.3 49.3 -13.5 -2.1 126 143 A T T 3 S+ 0 0 80 1,-0.3 19,-0.2 -2,-0.3 -1,-0.1 -0.258 125.2 22.2 -52.8 131.8 48.7 -14.3 -5.8 127 144 A G T 3 S+ 0 0 56 17,-2.7 -1,-0.3 1,-0.3 2,-0.1 0.084 98.6 117.1 99.7 -24.8 48.9 -18.1 -6.2 128 145 A E < - 0 0 39 -3,-2.5 16,-2.3 15,-0.1 2,-0.4 -0.419 50.0-147.7 -89.1 155.8 48.2 -19.0 -2.4 129 146 A M B -E 143 0B 35 14,-0.2 14,-0.2 -2,-0.1 -106,-0.1 -0.937 10.8-131.7-122.1 142.9 45.3 -20.9 -1.1 130 147 A S - 0 0 2 12,-3.0 -106,-0.2 -2,-0.4 3,-0.1 -0.265 15.4-123.4 -78.4 168.2 43.5 -20.5 2.3 131 148 A G - 0 0 4 -108,-2.8 11,-0.4 1,-0.2 2,-0.2 -0.182 69.4 -35.9 -82.1-160.8 42.5 -23.1 4.8 132 149 A P - 0 0 22 0, 0.0 2,-0.5 0, 0.0 -1,-0.2 -0.440 64.8-168.2 -59.9 119.0 38.9 -23.6 5.9 133 150 A V E -F 140 0B 5 7,-2.1 7,-3.2 -2,-0.2 2,-0.5 -0.983 8.9-147.5-115.4 121.6 37.3 -20.1 6.0 134 151 A F E +F 139 0B 83 -2,-0.5 2,-0.3 5,-0.2 5,-0.2 -0.763 27.3 154.7 -94.7 132.8 33.9 -19.9 7.7 135 152 A T E > -F 138 0B 18 3,-2.6 3,-0.9 -2,-0.5 -2,-0.0 -0.866 60.5 -91.0-135.1 177.2 31.2 -17.5 6.7 136 153 A D T 3 S+ 0 0 111 -2,-0.3 -85,-2.9 1,-0.2 -84,-0.2 0.747 124.1 61.6 -58.9 -22.8 27.4 -17.5 7.1 137 154 A S T 3 S- 0 0 43 -87,-0.2 2,-0.3 1,-0.2 -90,-0.3 0.812 120.2 -94.8 -70.1 -32.2 27.2 -19.2 3.7 138 155 A G E < - F 0 135B 1 -3,-0.9 -3,-2.6 -92,-0.2 2,-0.4 -0.992 62.8 -30.4 149.4-148.9 29.2 -22.2 4.8 139 156 A I E -DF 45 134B 0 -94,-3.1 -94,-3.1 -2,-0.3 2,-0.3 -0.934 59.2-162.5-112.2 134.5 32.9 -23.3 4.8 140 157 A H E -DF 44 133B 9 -7,-3.2 -7,-2.1 -2,-0.4 2,-0.5 -0.804 22.9-156.1-119.6 149.5 35.2 -22.0 2.0 141 158 A I E -D 43 0B 0 -98,-1.7 -98,-2.0 -2,-0.3 2,-0.4 -0.992 29.6-157.3-113.2 126.8 38.6 -22.9 0.4 142 159 A I E -D 42 0B 0 -2,-0.5 -12,-3.0 -11,-0.4 2,-0.5 -0.941 13.3-168.6-113.6 130.4 39.8 -19.7 -1.2 143 160 A L E -DE 41 129B 28 -102,-3.3 -102,-2.5 -2,-0.4 2,-0.6 -0.970 14.7-146.5-114.9 120.2 42.4 -19.5 -4.1 144 161 A R E +D 40 0B 22 -16,-2.3 -17,-2.7 -2,-0.5 -104,-0.3 -0.731 21.6 173.9 -85.4 118.0 43.8 -16.1 -4.9 145 162 A T 0 0 49 -106,-2.6 -105,-0.2 -2,-0.6 -1,-0.2 0.719 360.0 360.0 -97.9 -23.3 44.4 -16.0 -8.7 146 163 A E 0 0 116 -107,-1.4 -107,-2.1 -20,-0.1 -1,-0.2 -0.962 360.0 360.0-151.2 360.0 45.4 -12.3 -9.2