==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JUN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 23-MAR-11 2LB5 . COMPND 2 MOLECULE: SENSOR HISTIDINE KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SYNECHOCOCCUS SP. JA-2-3B'A(2-13); . AUTHOR C.C.CORNILESCU,G.CORNILESCU,A.T.ULIJASZ,R.D.VIERSTRA,J.L.MAR . 172 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11262.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 111 64.5 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 . 32 18.6 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 . 1 0.6 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 . 8 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 48 27.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.2 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 1 0 0 0 0 0 0 0 0 1 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 1 1 0 1 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 ANTIPARALLEL 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 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 31 A L > 0 0 16 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -57.3 122.1 -69.6 50.2 2 32 A D H > + 0 0 78 1,-0.2 4,-0.9 2,-0.2 163,-0.0 0.877 360.0 44.6 -57.5 -38.8 119.9 -72.2 51.8 3 33 A Q H >> S+ 0 0 146 2,-0.2 4,-0.8 1,-0.2 3,-0.8 0.961 111.3 50.8 -70.5 -53.2 122.7 -74.7 51.6 4 34 A I H >> S+ 0 0 86 1,-0.3 3,-1.5 2,-0.2 4,-1.1 0.918 107.9 53.4 -50.6 -49.2 125.5 -72.3 52.8 5 35 A L H 3X S+ 0 0 7 -4,-2.7 4,-3.3 1,-0.3 5,-0.3 0.822 94.5 71.9 -58.2 -31.3 123.4 -71.4 55.8 6 36 A R H X S+ 0 0 11 -4,-3.2 4,-3.4 1,-0.2 3,-0.7 0.918 107.3 63.4 -61.0 -44.5 127.2 -70.6 65.2 13 43 A R H 3X S+ 0 0 80 -4,-1.5 4,-0.8 -5,-0.4 5,-0.4 0.874 100.2 54.3 -46.8 -41.7 125.6 -73.2 67.4 14 44 A A H 3< S+ 0 0 74 -4,-1.5 -1,-0.3 -3,-0.4 -2,-0.2 0.895 114.0 40.5 -61.2 -40.6 129.1 -74.3 68.3 15 45 A F H << S+ 0 0 145 -4,-1.1 -2,-0.2 -3,-0.7 -1,-0.2 0.956 123.8 36.8 -72.9 -52.4 129.9 -70.8 69.4 16 46 A L H < S- 0 0 35 -4,-3.4 -2,-0.2 2,-0.1 -1,-0.2 0.466 94.1-148.6 -78.7 -0.6 126.6 -70.0 71.1 17 47 A G < + 0 0 60 -4,-0.8 2,-0.2 -5,-0.5 -3,-0.2 0.710 40.4 160.7 40.4 20.6 126.6 -73.6 72.2 18 48 A T - 0 0 14 -5,-0.4 -1,-0.2 -6,-0.2 3,-0.1 -0.511 46.3-136.8 -73.9 138.4 122.9 -73.2 71.9 19 49 A D S S+ 0 0 14 1,-0.2 21,-0.5 -2,-0.2 2,-0.4 0.832 90.9 28.2 -64.3 -32.2 120.9 -76.5 71.7 20 50 A R E +AB 39 139A 0 119,-1.0 119,-2.4 19,-0.3 2,-0.3 -0.979 65.8 159.1-138.5 123.7 118.7 -75.1 69.0 21 51 A V E +AB 38 138A 0 17,-0.8 17,-1.9 -2,-0.4 2,-0.3 -0.991 9.0 172.0-143.9 133.7 119.5 -72.4 66.4 22 52 A K E -AB 37 137A 21 115,-1.6 115,-1.4 -2,-0.3 2,-0.4 -0.975 26.5-127.2-141.5 155.1 117.8 -71.7 63.0 23 53 A V E -AB 36 136A 6 13,-0.7 12,-0.9 -2,-0.3 13,-0.6 -0.836 19.4-157.6-103.8 139.1 117.9 -69.1 60.3 24 54 A Y E -AB 34 135A 41 111,-2.9 111,-1.4 -2,-0.4 10,-0.2 -0.957 5.3-164.7-122.7 118.9 114.7 -67.4 59.1 25 55 A R E - B 0 134A 72 8,-2.0 8,-0.5 -2,-0.5 2,-0.4 -0.550 10.2-141.6 -95.4 163.3 114.4 -65.8 55.6 26 56 A F - 0 0 87 107,-1.2 6,-0.2 6,-0.2 -2,-0.0 -0.953 4.9-152.1-129.6 147.2 111.6 -63.4 54.5 27 57 A D > - 0 0 42 4,-1.4 3,-2.1 -2,-0.4 4,-0.2 -0.885 25.1-124.7-117.6 148.8 109.7 -63.0 51.3 28 58 A P T 3 S+ 0 0 132 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.779 111.1 63.9 -59.7 -27.5 108.1 -59.8 49.9 29 59 A E T 3 S- 0 0 161 2,-0.2 3,-0.1 1,-0.1 -3,-0.0 0.579 126.8-100.6 -74.6 -8.4 104.8 -61.6 49.6 30 60 A G S < S+ 0 0 17 -3,-2.1 24,-1.2 1,-0.3 2,-0.4 0.676 84.2 126.5 96.1 21.9 104.9 -61.9 53.4 31 61 A H E -E 53 0B 92 -4,-0.2 -4,-1.4 22,-0.1 2,-0.3 -0.924 35.8-172.5-116.3 138.9 106.1 -65.5 53.5 32 62 A G E -E 52 0B 0 20,-1.4 20,-1.3 -2,-0.4 2,-0.3 -0.949 2.5-164.1-129.4 149.9 109.2 -66.8 55.3 33 63 A T E -E 51 0B 38 -8,-0.5 -8,-2.0 -2,-0.3 2,-0.7 -0.940 23.1-120.4-132.9 153.9 110.9 -70.2 55.3 34 64 A V E +A 24 0A 9 16,-0.9 15,-1.2 -2,-0.3 -10,-0.2 -0.844 28.3 172.5 -96.0 114.0 113.4 -72.1 57.5 35 65 A V E + 0 0 22 -12,-0.9 2,-0.3 -2,-0.7 -1,-0.1 0.370 68.2 26.1-101.0 2.8 116.5 -73.0 55.5 36 66 A A E +A 23 0A 1 -13,-0.6 -13,-0.7 -31,-0.1 2,-0.3 -0.977 56.9 168.3-163.2 150.4 118.4 -74.2 58.5 37 67 A E E -A 22 0A 27 -2,-0.3 2,-0.3 -15,-0.2 -15,-0.2 -0.857 9.5-166.8-168.2 128.2 117.9 -75.7 62.0 38 68 A A E -A 21 0A 6 -17,-1.9 -17,-0.8 -2,-0.3 2,-0.4 -0.895 5.4-161.0-119.6 152.3 120.1 -77.4 64.6 39 69 A R E -A 20 0A 103 -2,-0.3 -19,-0.3 -19,-0.2 -20,-0.1 -0.989 6.4-171.4-133.8 141.6 119.2 -79.3 67.7 40 70 A G S S+ 0 0 27 -21,-0.5 -1,-0.1 -2,-0.4 -20,-0.1 0.719 84.7 1.7 -92.9-103.2 121.2 -80.2 70.8 41 71 A G S S- 0 0 67 1,-0.1 -21,-0.1 -21,-0.0 -1,-0.0 0.260 102.7-112.1 -71.9 16.4 119.8 -82.7 73.3 42 72 A E + 0 0 116 -23,-0.2 -1,-0.1 1,-0.1 4,-0.1 0.941 66.7 151.4 50.9 53.9 116.9 -82.9 70.9 43 73 A R + 0 0 100 2,-0.1 -1,-0.1 1,-0.1 -23,-0.0 0.627 64.3 41.2 -85.7 -15.3 114.5 -81.2 73.3 44 74 A L S S- 0 0 27 1,-0.0 -1,-0.1 73,-0.0 3,-0.0 -0.949 88.2-109.1-132.3 152.8 112.5 -79.8 70.4 45 75 A P - 0 0 81 0, 0.0 2,-0.6 0, 0.0 -2,-0.1 -0.182 44.8 -87.1 -72.5 169.2 111.3 -81.3 67.0 46 76 A S + 0 0 76 1,-0.2 -9,-0.0 -4,-0.1 -7,-0.0 -0.710 39.1 177.7 -84.4 117.5 112.7 -80.3 63.6 47 77 A L > + 0 0 36 -2,-0.6 3,-1.6 3,-0.0 -13,-0.2 0.587 38.6 127.1 -92.3 -13.0 110.8 -77.2 62.3 48 78 A L T 3 + 0 0 86 1,-0.3 -13,-0.1 -15,-0.1 3,-0.1 -0.112 68.4 32.4 -47.4 138.1 112.9 -77.1 59.1 49 79 A G T 3 S+ 0 0 65 -15,-1.2 2,-0.4 1,-0.3 -1,-0.3 0.418 92.3 123.5 92.0 -0.6 110.8 -77.0 56.0 50 80 A L < - 0 0 86 -3,-1.6 -16,-0.9 -16,-0.1 2,-0.6 -0.809 55.3-142.1 -98.3 132.4 108.1 -75.1 57.7 51 81 A T E -E 33 0B 86 -2,-0.4 -18,-0.2 -18,-0.2 -3,-0.0 -0.823 14.8-148.3 -94.7 123.3 106.8 -71.8 56.4 52 82 A F E -E 32 0B 34 -20,-1.3 -20,-1.4 -2,-0.6 2,-0.2 -0.718 16.2-120.5 -93.0 138.0 106.0 -69.2 59.0 53 83 A P E > -E 31 0B 87 0, 0.0 3,-1.8 0, 0.0 4,-0.1 -0.520 11.5-131.9 -76.7 140.6 103.2 -66.7 58.4 54 84 A A G > S+ 0 0 36 -24,-1.2 3,-3.5 1,-0.3 -23,-0.1 0.850 102.3 76.3 -59.3 -34.6 104.0 -63.0 58.5 55 85 A G G 3 S+ 0 0 73 1,-0.3 -1,-0.3 -25,-0.2 -3,-0.0 0.759 74.1 81.7 -48.3 -24.8 101.0 -62.5 60.8 56 86 A D G < S+ 0 0 71 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.762 104.0 29.6 -53.9 -24.0 103.3 -63.9 63.5 57 87 A I < - 0 0 78 -3,-3.5 -1,-0.2 1,-0.2 0, 0.0 -0.992 68.8-158.9-142.0 131.8 104.7 -60.4 63.7 58 88 A P - 0 0 89 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.948 41.8-102.2 -70.1 -93.0 103.1 -57.0 63.1 59 89 A E S > S+ 0 0 119 3,-0.0 4,-2.1 0, 0.0 3,-0.2 0.200 102.7 76.9-166.7 -48.0 105.6 -54.3 62.4 60 90 A E H > S+ 0 0 66 1,-0.3 4,-0.9 2,-0.2 -3,-0.0 0.858 102.6 48.5 -47.4 -39.3 106.2 -52.1 65.4 61 91 A A H >> S+ 0 0 34 1,-0.2 4,-0.8 2,-0.2 3,-0.6 0.913 107.6 53.1 -68.2 -43.3 108.3 -54.9 66.8 62 92 A R H 3> S+ 0 0 97 1,-0.2 4,-0.6 2,-0.2 3,-0.4 0.793 96.4 70.7 -63.1 -27.2 110.3 -55.4 63.6 63 93 A R H >X S+ 0 0 98 -4,-2.1 3,-2.4 1,-0.3 4,-1.7 0.925 92.2 55.5 -55.1 -47.4 111.1 -51.7 63.7 64 94 A L H S+ 0 0 43 -4,-0.9 4,-3.2 -3,-0.6 5,-1.8 0.862 98.8 62.3 -53.9 -37.0 113.4 -52.2 66.7 65 95 A F H 3<5S+ 0 0 23 -4,-0.8 -1,-0.3 -3,-0.4 -2,-0.2 0.716 108.3 44.0 -61.1 -19.7 115.2 -54.8 64.5 66 96 A R H <<5S+ 0 0 78 -3,-2.4 -2,-0.2 -4,-0.6 -1,-0.2 0.786 132.5 17.9 -94.6 -33.3 116.0 -51.8 62.2 67 97 A L H <5S+ 0 0 94 -4,-1.7 30,-1.4 29,-0.1 -3,-0.2 0.776 132.3 41.3-106.4 -39.8 117.0 -49.3 64.9 68 98 A A T <5S- 0 0 0 -4,-3.2 -3,-0.2 -5,-0.3 -4,-0.1 0.826 72.8-177.0 -81.3 -33.0 117.7 -51.4 67.9 69 99 A Q < + 0 0 42 -5,-1.8 -4,-0.1 1,-0.2 -3,-0.1 0.859 61.7 84.0 31.7 57.3 119.5 -54.1 66.0 70 100 A V - 0 0 29 -6,-0.1 -1,-0.2 27,-0.0 53,-0.2 0.399 60.8-173.5-146.2 -49.0 119.9 -56.1 69.2 71 101 A R + 0 0 16 1,-0.2 52,-0.7 -7,-0.1 2,-0.4 0.879 13.8 171.5 45.8 98.8 116.8 -58.1 69.9 72 102 A V E -C 122 0A 9 50,-0.1 31,-1.4 52,-0.0 2,-0.5 -0.982 19.0-157.4-142.3 129.4 117.1 -59.7 73.3 73 103 A I E -C 121 0A 21 48,-1.4 48,-0.8 -2,-0.4 3,-0.1 -0.902 11.3-145.5-110.6 130.9 114.4 -61.6 75.3 74 104 A V - 0 0 54 -2,-0.5 6,-0.1 1,-0.2 5,-0.1 -0.329 51.1 -54.5 -85.3 171.5 114.5 -61.9 79.1 75 105 A D > - 0 0 38 1,-0.2 3,-2.3 -2,-0.1 4,-0.4 -0.220 46.3-137.9 -49.0 118.9 113.4 -65.0 81.1 76 106 A V G > S+ 0 0 18 43,-1.8 3,-0.6 1,-0.3 -1,-0.2 0.617 101.7 71.7 -56.5 -8.8 109.8 -65.6 80.0 77 107 A E G 3 S+ 0 0 134 42,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.835 80.3 68.4 -76.5 -33.3 109.3 -66.2 83.7 78 108 A A G < S- 0 0 66 -3,-2.3 -1,-0.2 1,-0.1 -2,-0.2 0.664 99.6-140.7 -59.6 -13.8 109.7 -62.5 84.5 79 109 A Q < - 0 0 129 -3,-0.6 2,-0.3 -4,-0.4 -3,-0.1 0.958 26.4-172.4 49.5 62.9 106.4 -62.1 82.6 80 110 A S - 0 0 39 -5,-0.2 2,-0.4 -6,-0.1 25,-0.3 -0.689 6.2-155.5 -85.7 139.5 107.2 -58.9 80.8 81 111 A R + 0 0 150 -2,-0.3 2,-0.4 23,-0.1 25,-0.2 -0.964 18.1 168.9-122.5 129.7 104.4 -57.3 78.9 82 112 A S + 0 0 44 -2,-0.4 24,-0.9 21,-0.1 2,-0.2 -0.940 9.4 161.9-141.5 116.6 104.7 -54.9 76.0 83 113 A I - 0 0 104 -2,-0.4 -2,-0.0 1,-0.2 2,-0.0 -0.441 42.8 -66.3-117.8-167.5 101.9 -53.8 73.8 84 114 A S - 0 0 66 -2,-0.2 -1,-0.2 1,-0.0 0, 0.0 -0.197 45.0-134.3 -76.5 173.6 101.1 -51.0 71.3 85 115 A Q - 0 0 142 3,-0.0 2,-0.5 -2,-0.0 3,-0.4 -0.961 20.9-102.7-132.9 149.9 100.8 -47.3 72.2 86 116 A P S S- 0 0 88 0, 0.0 3,-0.0 0, 0.0 0, 0.0 -0.581 93.9 -24.5 -73.7 119.9 98.3 -44.6 71.3 87 117 A E S S+ 0 0 168 -2,-0.5 3,-0.1 1,-0.1 0, 0.0 0.916 88.1 143.6 39.0 81.6 99.7 -42.2 68.6 88 118 A S + 0 0 77 -3,-0.4 -1,-0.1 1,-0.1 -3,-0.0 -0.302 3.4 148.7-144.0 53.9 103.4 -42.8 69.2 89 119 A W - 0 0 207 2,-0.0 -1,-0.1 -3,-0.0 -2,-0.1 0.845 46.7-146.7 -57.3 -33.9 105.1 -42.7 65.8 90 120 A G - 0 0 65 1,-0.1 2,-0.5 -3,-0.1 -2,-0.1 0.908 4.5-138.4 63.6 100.8 108.2 -41.3 67.6 91 121 A L + 0 0 181 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.790 36.0 151.3 -94.6 128.4 110.1 -38.9 65.4 92 122 A S - 0 0 72 -2,-0.5 0, 0.0 1,-0.1 0, 0.0 -0.992 44.5-137.7-153.2 154.0 113.9 -39.1 65.4 93 123 A A S S- 0 0 109 -2,-0.3 -1,-0.1 1,-0.1 2,-0.0 0.971 81.8 -45.9 -76.4 -58.8 116.8 -38.4 63.1 94 124 A R + 0 0 215 2,-0.1 -1,-0.1 -27,-0.0 -27,-0.0 -0.301 67.7 158.3 179.9 85.0 119.0 -41.5 63.8 95 125 A V - 0 0 98 2,-0.1 -28,-0.0 3,-0.0 0, 0.0 -0.833 32.5-141.9-121.2 93.3 119.6 -42.6 67.4 96 126 A P - 0 0 91 0, 0.0 2,-0.2 0, 0.0 -28,-0.2 -0.158 68.8 -24.0 -51.2 141.5 120.6 -46.3 67.6 97 127 A L + 0 0 97 -30,-1.4 -2,-0.1 -33,-0.2 -28,-0.1 -0.336 66.3 161.5 55.3-116.2 119.2 -48.2 70.6 98 128 A G + 0 0 73 1,-0.3 -1,-0.2 -2,-0.2 -30,-0.0 0.835 48.7 99.9 69.8 32.8 118.4 -45.6 73.2 99 129 A E S S- 0 0 68 1,-0.2 -1,-0.3 -31,-0.1 4,-0.1 -0.857 81.4 -54.6-140.2 174.0 116.1 -48.0 75.0 100 130 A P - 0 0 89 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.032 53.3-109.1 -46.3 157.7 116.0 -50.4 78.0 101 131 A L S S+ 0 0 128 2,-0.0 2,-0.3 0, 0.0 0, 0.0 0.585 104.7 48.4 -69.6 -7.9 118.7 -53.1 78.3 102 132 A Q S S- 0 0 56 -31,-0.0 -29,-0.1 -28,-0.0 -31,-0.1 -0.876 75.6-136.4-130.2 163.0 115.8 -55.5 77.5 103 133 A R - 0 0 26 -31,-1.4 -29,-0.1 -2,-0.3 -21,-0.1 -0.729 23.1-153.1-123.4 82.2 113.1 -55.7 74.9 104 134 A P - 0 0 51 0, 0.0 2,-0.4 0, 0.0 -23,-0.1 -0.161 11.0-154.9 -51.2 142.9 109.8 -56.8 76.6 105 135 A V - 0 0 27 -25,-0.3 5,-0.2 1,-0.1 -22,-0.1 -0.983 22.8 -99.2-129.4 137.7 107.4 -58.6 74.3 106 136 A D >> - 0 0 41 -24,-0.9 3,-2.0 -2,-0.4 4,-0.8 0.034 49.4 -93.2 -45.0 158.7 103.6 -59.0 74.5 107 137 A P H 3> S+ 0 0 47 0, 0.0 4,-1.6 0, 0.0 5,-0.3 0.616 116.4 87.0 -53.3 -10.7 102.2 -62.2 76.1 108 138 A C H 3> S+ 0 0 102 1,-0.2 4,-1.2 2,-0.2 -2,-0.1 0.909 95.6 35.8 -57.3 -43.2 102.1 -63.4 72.5 109 139 A H H <> S+ 0 0 20 -3,-2.0 4,-3.9 2,-0.2 5,-0.4 0.778 105.3 73.7 -82.2 -27.9 105.7 -64.5 72.7 110 140 A V H X S+ 0 0 36 -4,-0.8 4,-2.9 1,-0.2 5,-0.2 0.960 108.5 29.9 -48.3 -64.9 105.4 -65.6 76.3 111 141 A H H X S+ 0 0 135 -4,-1.6 4,-4.6 2,-0.2 5,-0.2 0.900 117.8 60.9 -63.0 -40.9 103.3 -68.7 75.4 112 142 A Y H X S+ 0 0 111 -4,-1.2 4,-0.8 -5,-0.3 -2,-0.2 0.955 114.0 33.5 -49.7 -58.6 105.1 -69.0 72.1 113 143 A L H ><>S+ 0 0 8 -4,-3.9 3,-1.7 2,-0.2 5,-1.7 0.968 121.4 48.3 -63.1 -54.5 108.5 -69.4 73.7 114 144 A K H ><5S+ 0 0 129 -4,-2.9 3,-2.8 -5,-0.4 -2,-0.2 0.889 103.4 62.7 -53.4 -41.4 107.2 -71.3 76.7 115 145 A S H 3<5S+ 0 0 81 -4,-4.6 -1,-0.3 1,-0.3 -2,-0.2 0.801 104.1 48.9 -54.8 -28.5 105.2 -73.5 74.3 116 146 A M T <<5S- 0 0 31 -3,-1.7 -1,-0.3 -4,-0.8 -2,-0.2 0.463 117.1-120.1 -88.2 -2.8 108.7 -74.5 73.0 117 147 A G T < 5 + 0 0 37 -3,-2.8 2,-0.6 -4,-0.3 -3,-0.2 0.750 69.8 136.9 70.2 23.4 109.8 -75.1 76.6 118 148 A V < - 0 0 1 -5,-1.7 -1,-0.2 1,-0.2 23,-0.2 -0.906 33.8-178.0-107.8 114.3 112.5 -72.5 76.1 119 149 A A S S+ 0 0 22 -2,-0.6 -43,-1.8 21,-0.2 2,-0.3 0.825 73.6 49.9 -77.0 -32.0 112.9 -70.1 79.1 120 150 A S E - D 0 140A 21 20,-1.4 20,-1.1 -45,-0.2 2,-0.3 -0.779 63.1-173.2-109.5 152.2 115.6 -68.1 77.3 121 151 A S E -CD 73 139A 5 -48,-0.8 -48,-1.4 -2,-0.3 2,-0.6 -0.810 2.9-172.7-149.9 104.7 115.6 -66.7 73.8 122 152 A L E +CD 72 138A 39 16,-1.1 16,-2.2 -2,-0.3 2,-0.3 -0.869 15.2 179.1-100.8 116.4 118.6 -65.1 72.1 123 153 A V E - D 0 137A 13 -52,-0.7 14,-0.3 -2,-0.6 -2,-0.0 -0.846 11.8-174.1-118.2 155.1 117.8 -63.4 68.8 124 154 A V E - D 0 136A 3 12,-3.1 12,-2.5 -2,-0.3 2,-0.2 -0.940 19.4-133.2-151.8 121.8 119.9 -61.5 66.3 125 155 A P E - D 0 135A 1 0, 0.0 2,-0.6 0, 0.0 10,-0.2 -0.477 6.8-149.2 -79.8 144.6 118.8 -59.7 63.1 126 156 A L E + D 0 134A 4 8,-1.5 8,-1.8 -2,-0.2 7,-1.3 -0.857 27.6 167.0-115.7 95.4 120.5 -60.1 59.8 127 157 A M E - D 0 132A 42 -2,-0.6 2,-0.5 5,-0.2 5,-0.2 -0.904 20.3-159.2-113.7 136.5 120.2 -56.8 57.8 128 158 A H E > - D 0 131A 28 3,-1.8 3,-2.1 -2,-0.4 2,-0.7 -0.960 65.3 -38.2-115.7 124.0 122.1 -55.9 54.7 129 159 A H T 3 S- 0 0 152 -2,-0.5 -2,-0.1 1,-0.3 3,-0.0 -0.537 123.8 -30.2 67.5-109.6 122.4 -52.2 53.7 130 160 A Q T 3 S+ 0 0 139 -2,-0.7 2,-0.3 2,-0.0 -1,-0.3 0.295 125.1 76.8-121.7 4.4 118.9 -50.8 54.5 131 161 A E E < S- D 0 128A 114 -3,-2.1 -3,-1.8 -65,-0.0 2,-0.6 -0.762 75.8-121.3-117.0 161.2 116.9 -53.9 54.0 132 162 A L E + D 0 127A 30 -2,-0.3 -5,-0.2 -5,-0.2 3,-0.1 -0.907 31.9 165.0-105.4 123.2 116.3 -57.1 55.9 133 163 A W E - 0 0 91 -7,-1.3 -107,-1.2 -2,-0.6 2,-0.3 0.817 63.7 -2.4-102.6 -43.6 117.2 -60.3 54.2 134 164 A G E -BD 25 126A 7 -8,-1.8 -8,-1.5 -109,-0.2 2,-0.3 -0.845 57.2-136.7-142.8 177.0 117.3 -62.9 57.0 135 165 A L E -BD 24 125A 31 -111,-1.4 -111,-2.9 -2,-0.3 2,-0.4 -0.981 9.9-150.4-145.5 129.3 116.9 -63.3 60.8 136 166 A L E +BD 23 124A 13 -12,-2.5 -12,-3.1 -2,-0.3 2,-0.3 -0.805 21.1 172.1-101.0 140.9 118.9 -65.3 63.3 137 167 A V E -BD 22 123A 19 -115,-1.4 -115,-1.6 -2,-0.4 2,-0.3 -0.997 13.5-164.9-147.5 148.7 117.4 -66.8 66.4 138 168 A S E -BD 21 122A 6 -16,-2.2 -16,-1.1 -2,-0.3 2,-0.3 -0.990 5.8-177.6-136.2 144.4 118.4 -69.1 69.2 139 169 A H E +BD 20 121A 11 -119,-2.4 -119,-1.0 -2,-0.3 2,-0.3 -1.000 16.8 133.9-143.3 142.4 116.4 -71.0 71.9 140 170 A H E - D 0 120A 57 -20,-1.1 -20,-1.4 -2,-0.3 -21,-0.2 -0.976 51.5 -73.1-172.5 167.8 117.4 -73.3 74.8 141 171 A A S S- 0 0 32 -2,-0.3 -122,-0.1 1,-0.2 -23,-0.1 0.028 89.4 -39.8 -62.0 179.3 116.8 -74.1 78.5 142 172 A E + 0 0 144 1,-0.2 -1,-0.2 -23,-0.0 -24,-0.0 -0.201 64.0 177.4 -47.0 97.8 118.1 -71.8 81.2 143 173 A P - 0 0 65 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 -0.077 46.7-105.4 -97.3 32.9 121.6 -71.0 79.7 144 174 A R - 0 0 213 2,-0.1 0, 0.0 -24,-0.0 0, 0.0 0.390 56.4 -50.7 57.4 155.8 122.5 -68.7 82.5 145 175 A P - 0 0 121 0, 0.0 2,-0.4 0, 0.0 -71,-0.0 -0.026 58.6-122.7 -53.7 160.5 122.5 -64.8 82.1 146 176 A Y - 0 0 93 4,-0.0 2,-0.3 3,-0.0 -2,-0.1 -0.907 14.9-131.9-114.1 139.5 124.3 -63.3 79.1 147 177 A S > - 0 0 62 -2,-0.4 4,-2.1 1,-0.1 5,-0.1 -0.666 9.3-137.9 -89.7 142.1 127.1 -60.7 79.3 148 178 A Q H > S+ 0 0 125 -2,-0.3 4,-1.8 2,-0.2 -1,-0.1 0.871 104.7 56.5 -63.7 -37.1 126.9 -57.5 77.1 149 179 A E H > S+ 0 0 129 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.945 111.6 40.8 -60.0 -49.7 130.6 -57.9 76.4 150 180 A E H > S+ 0 0 136 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.837 108.0 63.9 -68.1 -32.5 130.2 -61.4 75.0 151 181 A L H X S+ 0 0 37 -4,-2.1 4,-2.7 1,-0.2 -1,-0.2 0.902 99.7 53.1 -57.9 -42.3 127.0 -60.3 73.2 152 182 A Q H X S+ 0 0 109 -4,-1.8 4,-2.2 2,-0.2 5,-0.3 0.956 100.6 59.3 -58.6 -52.6 129.0 -57.9 71.1 153 183 A V H X S+ 0 0 107 -4,-1.3 4,-1.0 1,-0.3 -1,-0.2 0.883 114.1 38.8 -42.2 -45.6 131.4 -60.6 69.9 154 184 A V H X S+ 0 0 23 -4,-1.5 4,-2.0 2,-0.2 -1,-0.3 0.866 103.9 69.1 -74.9 -37.0 128.4 -62.4 68.6 155 185 A Q H X S+ 0 0 34 -4,-2.7 4,-0.7 1,-0.3 -2,-0.2 0.876 104.8 43.7 -47.7 -40.5 126.8 -59.2 67.4 156 186 A L H X S+ 0 0 99 -4,-2.2 4,-2.4 1,-0.2 3,-0.5 0.849 104.5 63.5 -73.2 -34.8 129.6 -59.1 64.8 157 187 A L H X S+ 0 0 35 -4,-1.0 4,-1.4 -5,-0.3 -2,-0.2 0.842 102.3 51.0 -57.2 -32.8 129.2 -62.8 64.1 158 188 A A H X S+ 0 0 2 -4,-2.0 4,-1.4 1,-0.2 -1,-0.3 0.792 107.2 53.8 -74.5 -28.2 125.7 -61.8 62.9 159 189 A D H X S+ 0 0 67 -4,-0.7 4,-0.9 -3,-0.5 -2,-0.2 0.898 102.8 56.9 -71.6 -41.2 127.2 -59.2 60.7 160 190 A Q H >X S+ 0 0 123 -4,-2.4 3,-2.2 1,-0.2 4,-1.2 0.965 107.8 45.8 -54.2 -58.0 129.6 -61.6 59.0 161 191 A V H 3X S+ 0 0 23 -4,-1.4 4,-3.2 1,-0.3 5,-0.5 0.895 100.7 68.7 -52.7 -42.0 126.8 -63.9 57.8 162 192 A S H 3X S+ 0 0 9 -4,-1.4 4,-1.2 1,-0.3 -1,-0.3 0.805 102.6 47.4 -47.1 -29.4 125.0 -60.8 56.6 163 193 A I H