==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-DEC-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PHOTOSYNTHESIS 21-JUL-11 3T15 . COMPND 2 MOLECULE: RIBULOSE BISPHOSPHATE CARBOXYLASE/OXYGENASE ACTIV . SOURCE 2 ORGANISM_SCIENTIFIC: NICOTIANA TABACUM; . AUTHOR M.STOTZ,P.WENDLER,O.MUELLER-CAJAR,F.U.HARTL,A.BRACHER,M.HAYE . 263 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14555.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 190 72.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 8.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 1.1 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 18 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 118 44.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.1 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 0 1 0 0 1 0 2 2 0 0 0 1 0 0 0 0 1 0 0 1 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 3 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 PARALLEL BRIDGES PER LADDER . 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 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 68 A N 0 0 138 0, 0.0 2,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 -34.6 25.6 43.0 -11.0 2 69 A L - 0 0 68 11,-0.2 2,-0.3 1,-0.1 15,-0.1 -0.434 360.0 -85.3 -78.2 149.0 26.5 42.8 -7.3 3 70 A D + 0 0 100 1,-0.1 -1,-0.1 -2,-0.1 0, 0.0 -0.350 45.1 177.1 -64.9 118.6 29.8 41.3 -6.0 4 71 A N + 0 0 35 -2,-0.3 7,-1.2 7,-0.1 2,-0.3 0.284 44.5 97.7-111.7 2.5 29.4 37.5 -5.6 5 72 A K E +A 10 0A 106 5,-0.2 2,-0.3 3,-0.0 5,-0.2 -0.766 46.8 177.8 -95.8 144.9 32.9 36.3 -4.5 6 73 A L E > -A 9 0A 42 3,-3.2 3,-2.8 -2,-0.3 53,-0.0 -0.894 61.8 -25.3-154.5 116.5 33.5 35.8 -0.8 7 74 A D T 3 S- 0 0 73 -2,-0.3 3,-0.1 1,-0.3 166,-0.1 0.940 128.1 -46.2 39.8 62.9 36.5 34.5 1.1 8 75 A G T 3 S+ 0 0 37 1,-0.2 -1,-0.3 165,-0.1 2,-0.3 0.365 120.2 117.8 67.4 -6.0 37.7 32.6 -2.0 9 76 A F E < -A 6 0A 45 -3,-2.8 -3,-3.2 162,-0.1 2,-0.3 -0.643 57.2-138.4 -95.0 150.5 34.2 31.3 -2.4 10 77 A Y E -A 5 0A 33 156,-0.4 2,-0.4 -2,-0.3 -5,-0.2 -0.795 9.1-157.3-108.0 148.1 31.9 32.0 -5.4 11 78 A I - 0 0 0 -7,-1.2 -7,-0.1 -2,-0.3 41,-0.0 -0.991 28.6-114.0-124.6 129.8 28.2 32.7 -5.3 12 79 A A > - 0 0 0 -2,-0.4 4,-3.1 1,-0.2 3,-0.2 -0.429 25.7-147.6 -61.5 114.1 25.8 32.2 -8.2 13 80 A P H > S+ 0 0 43 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.739 97.7 54.1 -65.3 -21.4 24.8 35.8 -9.0 14 81 A A H > S+ 0 0 56 2,-0.2 4,-1.9 3,-0.1 5,-0.2 0.929 111.5 46.0 -68.1 -45.5 21.4 34.6 -10.1 15 82 A F H > S+ 0 0 2 -3,-0.2 4,-2.6 1,-0.2 5,-0.2 0.949 113.1 50.4 -62.6 -50.2 21.0 32.9 -6.7 16 83 A M H X S+ 0 0 10 -4,-3.1 4,-3.1 1,-0.2 5,-0.4 0.940 108.9 48.7 -49.4 -55.4 22.3 36.0 -4.9 17 84 A D H X S+ 0 0 65 -4,-2.0 4,-1.4 1,-0.2 5,-0.3 0.864 112.3 51.8 -60.3 -36.8 20.0 38.6 -6.6 18 85 A K H X S+ 0 0 52 -4,-1.9 4,-1.9 3,-0.2 -1,-0.2 0.970 119.2 32.5 -63.2 -51.7 17.1 36.3 -5.9 19 86 A L H X S+ 0 0 1 -4,-2.6 4,-2.8 2,-0.2 -2,-0.2 0.967 118.4 50.3 -73.4 -53.6 17.8 36.0 -2.2 20 87 A V H X S+ 0 0 21 -4,-3.1 4,-2.4 1,-0.2 3,-0.3 0.958 118.0 41.2 -45.6 -61.9 19.4 39.4 -1.4 21 88 A V H X S+ 0 0 73 -4,-1.4 4,-1.8 -5,-0.4 -1,-0.2 0.829 110.8 56.7 -56.8 -37.0 16.4 41.1 -3.1 22 89 A H H X S+ 0 0 2 -4,-1.9 4,-1.0 -5,-0.3 -1,-0.2 0.927 114.9 40.9 -61.8 -39.1 13.9 38.7 -1.5 23 90 A I H >< S+ 0 0 0 -4,-2.8 3,-2.1 -3,-0.3 4,-0.4 0.999 114.3 45.5 -73.1 -68.5 15.3 39.7 1.8 24 91 A T H >X S+ 0 0 58 -4,-2.4 3,-1.1 1,-0.3 4,-0.5 0.749 107.5 64.1 -48.4 -26.3 15.8 43.5 1.4 25 92 A K H >< S+ 0 0 50 -4,-1.8 3,-1.3 -5,-0.3 -1,-0.3 0.900 96.4 55.0 -61.3 -43.7 12.3 43.6 -0.1 26 93 A N T << S+ 0 0 17 -3,-2.1 -1,-0.2 -4,-1.0 -2,-0.2 0.446 104.4 55.9 -73.8 -0.4 10.6 42.4 3.1 27 94 A F T <4 S+ 0 0 52 -3,-1.1 -1,-0.3 -4,-0.4 -2,-0.2 0.543 99.2 74.5-102.7 -13.3 12.3 45.3 5.0 28 95 A L S << S- 0 0 97 -3,-1.3 2,-0.6 -4,-0.5 -3,-0.0 -0.523 71.2-139.5 -96.2 161.3 10.9 48.0 2.8 29 96 A K + 0 0 101 -2,-0.2 -3,-0.1 2,-0.0 -4,-0.0 -0.898 36.9 176.3-113.9 94.2 7.4 49.5 2.5 30 97 A L > - 0 0 57 -2,-0.6 3,-0.7 -5,-0.2 5,-0.1 -0.864 31.8 -96.9-109.5 143.0 7.3 49.8 -1.3 31 98 A P T 3 S- 0 0 109 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.189 83.7 -12.9 -74.9 139.4 4.1 51.0 -3.0 32 99 A N T 3 S+ 0 0 175 1,-0.1 2,-0.3 0, 0.0 0, 0.0 0.820 98.7 107.6 50.6 45.0 1.4 48.9 -4.6 33 100 A I < - 0 0 108 -3,-0.7 2,-0.7 2,-0.0 -3,-0.2 -0.935 64.3-135.3-146.5 130.5 3.1 45.5 -4.6 34 101 A K - 0 0 160 -2,-0.3 0, 0.0 -3,-0.1 0, 0.0 -0.773 26.2-149.1 -83.5 117.1 2.3 42.6 -2.4 35 102 A V - 0 0 35 -2,-0.7 2,-0.2 -5,-0.1 -2,-0.0 -0.748 13.1-124.6 -93.6 126.9 5.7 41.3 -1.3 36 103 A P - 0 0 22 0, 0.0 116,-0.2 0, 0.0 -10,-0.1 -0.496 14.4-155.6 -76.7 134.7 5.9 37.5 -0.6 37 104 A L S S+ 0 0 26 114,-1.0 96,-0.7 -2,-0.2 2,-0.4 0.917 75.3 48.9 -73.9 -44.4 7.2 36.8 2.9 38 105 A I E -bc 133 152B 2 113,-1.0 115,-2.0 94,-0.2 2,-0.5 -0.786 63.6-162.0-105.4 139.0 8.6 33.4 2.2 39 106 A L E -bc 134 153B 1 94,-2.3 96,-2.7 -2,-0.4 2,-0.5 -0.984 10.0-157.5-118.3 114.6 10.9 32.4 -0.6 40 107 A G E -bc 135 154B 0 113,-2.4 115,-1.7 -2,-0.5 2,-0.5 -0.854 7.6-156.5 -95.1 125.1 11.0 28.6 -1.3 41 108 A I E +bc 136 155B 2 94,-3.9 96,-1.6 -2,-0.5 2,-0.3 -0.871 19.7 163.5-107.8 124.5 14.2 27.5 -3.1 42 109 A W E + c 0 156B 64 113,-2.6 115,-2.8 -2,-0.5 2,-0.2 -0.861 39.3 30.0-134.5 172.2 14.3 24.2 -5.1 43 110 A G E + c 0 157B 11 95,-0.8 115,-0.2 94,-0.3 6,-0.1 -0.559 54.5 117.6 79.0-146.4 16.4 22.6 -7.8 44 111 A G > - 0 0 1 113,-1.9 3,-1.0 -2,-0.2 5,-0.4 0.768 51.8-173.0 49.3 31.7 20.2 23.2 -7.9 45 112 A K T 3 + 0 0 87 1,-0.2 2,-0.6 112,-0.2 -1,-0.2 -0.199 66.4 14.5 -54.7 140.8 20.8 19.5 -7.2 46 113 A G T 3 S+ 0 0 24 1,-0.3 148,-2.4 -3,-0.1 149,-0.4 -0.081 109.4 97.6 84.9 -37.5 24.5 18.6 -6.6 47 114 A Q S < S- 0 0 22 -3,-1.0 2,-2.6 -2,-0.6 -1,-0.3 -0.549 95.7-100.7 -83.9 150.9 25.2 22.3 -6.2 48 115 A G > + 0 0 13 1,-0.2 4,-3.4 -2,-0.2 5,-0.2 -0.413 52.8 164.5 -80.1 74.2 25.4 23.6 -2.6 49 116 A K H > S+ 0 0 23 -2,-2.6 4,-1.7 -5,-0.4 -1,-0.2 0.927 81.2 40.1 -58.5 -50.6 21.9 25.1 -2.5 50 117 A S H > S+ 0 0 24 -3,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.905 116.3 53.0 -60.6 -40.5 22.0 25.3 1.3 51 118 A F H > S+ 0 0 68 1,-0.2 4,-2.8 2,-0.2 -2,-0.2 0.865 104.0 55.0 -66.5 -34.8 25.6 26.4 1.1 52 119 A Q H X S+ 0 0 1 -4,-3.4 4,-2.8 2,-0.2 -1,-0.2 0.906 107.5 51.2 -60.6 -41.4 24.7 29.1 -1.4 53 120 A C H X S+ 0 0 0 -4,-1.7 4,-3.5 2,-0.2 -2,-0.2 0.982 109.3 48.0 -59.0 -60.7 22.2 30.4 1.2 54 121 A E H X S+ 0 0 88 -4,-2.2 4,-3.0 1,-0.2 5,-0.3 0.905 111.9 52.5 -39.7 -55.8 24.8 30.4 4.0 55 122 A L H X S+ 0 0 11 -4,-2.8 4,-2.4 2,-0.2 -1,-0.2 0.932 111.7 44.3 -47.7 -55.4 27.2 32.2 1.6 56 123 A V H X S+ 0 0 0 -4,-2.8 4,-0.9 1,-0.2 5,-0.3 0.974 112.8 52.1 -57.6 -53.4 24.6 34.9 0.8 57 124 A F H >X>S+ 0 0 2 -4,-3.5 5,-2.8 1,-0.2 3,-1.3 0.897 110.2 47.4 -52.5 -48.1 23.7 35.3 4.5 58 125 A R H ><5S+ 0 0 61 -4,-3.0 3,-1.5 1,-0.3 -1,-0.2 0.946 103.9 62.8 -58.4 -45.1 27.3 35.8 5.6 59 126 A K H 3<5S+ 0 0 68 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.704 114.1 33.5 -56.7 -20.4 27.7 38.3 2.8 60 127 A M H <<5S- 0 0 45 -3,-1.3 -1,-0.3 -4,-0.9 -2,-0.2 0.465 116.1-113.0-106.3 -9.2 25.1 40.5 4.5 61 128 A G T <<5 + 0 0 48 -3,-1.5 2,-0.5 -4,-1.0 -3,-0.2 0.930 61.6 155.0 70.4 46.0 26.1 39.5 8.0 62 129 A I < - 0 0 5 -5,-2.8 -1,-0.3 -8,-0.2 37,-0.1 -0.933 33.9-161.2-100.6 127.3 22.9 37.7 8.7 63 130 A N - 0 0 133 -2,-0.5 37,-0.1 35,-0.4 -9,-0.0 -0.892 29.2-151.0 -96.1 94.5 23.0 35.0 11.3 64 131 A P - 0 0 25 0, 0.0 2,-1.0 0, 0.0 37,-0.2 -0.212 18.4-110.4 -68.4 160.3 19.9 33.3 10.2 65 132 A I E -d 101 0B 20 35,-2.2 37,-1.6 20,-0.1 24,-0.1 -0.856 45.9-151.1 -85.9 106.5 17.7 31.4 12.6 66 133 A M E +d 102 0B 92 -2,-1.0 2,-0.3 35,-0.2 37,-0.2 -0.303 19.7 179.9 -72.0 158.2 18.4 27.9 11.4 67 134 A M E -d 103 0B 12 35,-0.8 37,-1.1 -2,-0.1 2,-0.3 -0.950 16.5-140.2-151.8 148.9 16.0 25.0 11.5 68 135 A S E > -d 104 0B 55 -2,-0.3 4,-1.2 35,-0.1 37,-0.1 -0.764 17.3-131.5-101.8 157.9 16.3 21.4 10.4 69 136 A A H > S+ 0 0 33 35,-0.8 4,-0.7 -2,-0.3 3,-0.3 0.897 111.0 57.3 -64.3 -44.9 13.6 19.3 8.8 70 137 A G H > S+ 0 0 57 1,-0.3 4,-1.5 2,-0.2 -1,-0.2 0.742 105.7 52.8 -61.1 -22.9 14.4 16.4 11.2 71 138 A E H 4 S+ 0 0 97 2,-0.2 -1,-0.3 3,-0.2 -2,-0.2 0.859 104.3 53.7 -76.2 -41.3 13.6 18.9 13.9 72 139 A L H < S+ 0 0 20 -4,-1.2 -2,-0.2 -3,-0.3 -1,-0.2 0.462 107.8 53.7 -75.9 -4.7 10.2 19.8 12.4 73 140 A E H < 0 0 78 -4,-0.7 -2,-0.2 -5,-0.1 -1,-0.2 0.882 360.0 360.0 -84.7 -62.2 9.4 16.1 12.5 74 141 A S < 0 0 100 -4,-1.5 3,-0.3 3,-0.1 -2,-0.2 0.449 360.0 360.0-106.6 360.0 10.1 15.5 16.2 75 ! 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 76 145 A G > 0 0 98 0, 0.0 4,-1.1 0, 0.0 5,-0.3 0.000 360.0 360.0 360.0 -55.6 4.2 20.0 20.0 77 146 A E H > + 0 0 36 -3,-0.3 4,-1.5 1,-0.2 5,-0.3 0.825 360.0 59.2 -48.7 -50.0 7.5 20.6 18.2 78 147 A P H 4 S+ 0 0 27 0, 0.0 4,-0.4 0, 0.0 -1,-0.2 0.918 118.5 25.1 -54.2 -56.6 6.2 21.0 14.5 79 148 A A H >> S+ 0 0 33 -3,-0.2 3,-2.1 2,-0.1 4,-1.1 0.994 125.9 45.7 -66.2 -74.0 3.8 24.0 15.1 80 149 A K H 3X S+ 0 0 57 -4,-1.1 4,-2.3 1,-0.3 3,-0.3 0.822 104.8 58.1 -35.7 -64.2 5.4 25.6 18.2 81 150 A L H 3X S+ 0 0 31 -4,-1.5 4,-1.7 -5,-0.3 -1,-0.3 0.643 105.2 53.4 -54.4 -19.2 9.1 25.6 17.1 82 151 A I H <> S+ 0 0 4 -3,-2.1 4,-2.9 -4,-0.4 -1,-0.3 0.963 109.7 45.3 -73.9 -59.5 8.3 27.6 14.0 83 152 A R H X S+ 0 0 133 -4,-1.1 4,-2.8 -3,-0.3 -2,-0.2 0.920 118.5 44.8 -45.4 -53.1 6.5 30.3 15.9 84 153 A Q H X S+ 0 0 59 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.872 113.5 48.0 -64.5 -41.3 9.4 30.4 18.4 85 154 A R H X S+ 0 0 11 -4,-1.7 4,-1.4 -5,-0.3 -1,-0.2 0.774 113.7 49.5 -73.1 -26.4 12.1 30.3 15.8 86 155 A Y H X S+ 0 0 13 -4,-2.9 4,-3.1 2,-0.2 -2,-0.2 0.950 112.4 46.7 -65.5 -52.9 10.3 33.1 13.9 87 156 A R H X S+ 0 0 54 -4,-2.8 4,-3.2 1,-0.2 -2,-0.2 0.856 108.8 55.6 -61.0 -39.0 10.0 35.1 17.2 88 157 A E H X S+ 0 0 117 -4,-2.4 4,-1.3 2,-0.2 -1,-0.2 0.935 112.8 40.9 -58.4 -50.7 13.7 34.5 17.9 89 158 A A H X S+ 0 0 0 -4,-1.4 4,-2.9 2,-0.2 5,-0.2 0.912 114.1 54.3 -61.6 -45.3 14.7 35.9 14.5 90 159 A A H X S+ 0 0 7 -4,-3.1 4,-4.1 1,-0.2 -2,-0.2 0.904 105.9 51.1 -58.8 -44.6 12.2 38.7 14.9 91 160 A E H < S+ 0 0 61 -4,-3.2 4,-0.4 2,-0.2 -1,-0.2 0.805 110.1 51.2 -64.5 -30.9 13.6 39.7 18.3 92 161 A I H >X S+ 0 0 64 -4,-1.3 4,-3.1 -5,-0.2 3,-1.9 0.995 116.0 39.5 -62.6 -64.8 17.0 39.8 16.6 93 162 A I H 3< S+ 0 0 27 -4,-2.9 -2,-0.2 1,-0.3 -3,-0.2 0.879 114.5 56.2 -47.0 -43.3 15.7 42.0 13.8 94 163 A R T 3< S+ 0 0 73 -4,-4.1 -1,-0.3 -5,-0.2 -2,-0.2 0.478 109.6 43.9 -81.5 -3.0 13.6 43.9 16.4 95 164 A K T <4 S- 0 0 97 -3,-1.9 2,-0.3 -4,-0.4 -2,-0.2 0.749 130.0 -93.3 -87.3 -49.9 16.7 44.7 18.4 96 165 A G S < S+ 0 0 32 -4,-3.1 -1,-0.3 1,-0.3 -2,-0.1 -0.911 82.3 78.7 156.1 178.6 18.4 45.6 15.1 97 166 A N S S- 0 0 155 -2,-0.3 -1,-0.3 -3,-0.1 -2,-0.2 0.503 85.6 -68.5 62.4 144.0 20.6 44.3 12.3 98 167 A M + 0 0 82 -38,-0.2 -35,-0.4 -37,-0.1 2,-0.3 -0.322 59.2 166.9 -67.3 141.2 19.1 42.2 9.5 99 168 A C - 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0 0 29 -5,-0.5 -1,-0.2 -8,-0.1 5,-0.1 -0.897 34.4-102.3-111.0 127.6 45.0 26.4 -8.9 178 271 A P > - 0 0 65 0, 0.0 4,-2.0 0, 0.0 5,-0.2 -0.050 21.2-128.1 -38.3 135.9 44.7 28.0 -12.3 179 272 A A H > S+ 0 0 74 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.849 116.0 59.7 -55.8 -33.6 41.2 29.2 -13.3 180 273 A E H > S+ 0 0 159 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.942 101.3 50.3 -52.5 -56.9 42.2 27.2 -16.4 181 274 A D H > S+ 0 0 29 1,-0.2 4,-1.7 2,-0.2 3,-0.3 0.910 109.4 50.6 -52.7 -50.0 42.6 24.0 -14.4 182 275 A V H X S+ 0 0 3 -4,-2.0 4,-1.9 1,-0.2 5,-0.3 0.878 109.8 51.5 -59.3 -39.3 39.2 24.4 -12.7 183 276 A V H X S+ 0 0 43 -4,-1.8 4,-1.7 -5,-0.2 -1,-0.2 0.859 107.2 53.1 -65.5 -34.7 37.6 24.8 -16.1 184 277 A K H X S+ 0 0 46 -4,-1.9 4,-1.9 -3,-0.3 -2,-0.2 0.914 112.4 42.1 -69.9 -40.9 39.2 21.7 -17.5 185 278 A I H X S+ 0 0 4 -4,-1.7 4,-1.3 2,-0.2 -2,-0.2 0.908 112.5 51.2 -76.3 -46.7 38.0 19.3 -14.8 186 279 A V H >< S+ 0 0 10 -4,-1.9 3,-0.5 1,-0.2 -1,-0.2 0.911 116.0 43.9 -55.8 -43.3 34.5 20.7 -14.4 187 280 A D H 3< S+ 0 0 81 -4,-1.7 -2,-0.2 -5,-0.3 -1,-0.2 0.905 112.4 53.3 -67.7 -37.2 34.2 20.3 -18.2 188 281 A N H 3< S+ 0 0 74 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.681 113.5 42.9 -72.9 -13.7 35.8 16.9 -17.9 189 282 A F S << S- 0 0 14 -4,-1.3 3,-0.3 -3,-0.5 -1,-0.3 -0.482 78.0-179.7-134.4 60.2 33.3 15.7 -15.3 190 283 A P + 0 0 95 0, 0.0 3,-0.1 0, 0.0 -3,-0.1 -0.166 64.4 21.4 -73.0 159.9 29.8 16.7 -16.2 191 284 A G S S+ 0 0 85 1,-0.2 2,-0.4 0, 0.0 -145,-0.0 0.926 90.4 131.2 43.5 54.4 26.7 15.9 -14.2 192 285 A Q - 0 0 39 -3,-0.3 -1,-0.2 -6,-0.1 -3,-0.1 -0.980 55.4-119.9-126.1 142.5 28.9 15.4 -11.0 193 286 A S > - 0 0 47 -2,-0.4 4,-0.9 1,-0.1 -146,-0.2 0.047 24.9-107.3 -70.2-178.4 27.9 17.1 -7.7 194 287 A I H > S+ 0 0 34 -148,-2.4 4,-2.2 2,-0.2 3,-0.2 0.827 123.1 65.0 -75.2 -29.9 30.0 19.5 -5.7 195 288 A D H > S+ 0 0 128 -149,-0.4 4,-2.7 1,-0.2 5,-0.3 0.923 93.9 61.1 -53.6 -44.9 30.4 16.5 -3.4 196 289 A F H > S+ 0 0 7 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.926 107.1 42.8 -44.2 -54.5 32.3 14.9 -6.3 197 290 A F H X S+ 0 0 13 -4,-0.9 4,-2.8 2,-0.2 -1,-0.2 0.868 111.4 52.6 -71.0 -36.5 35.0 17.6 -6.3 198 291 A G H X S+ 0 0 29 -4,-2.2 4,-2.8 1,-0.2 5,-0.3 0.991 112.2 47.9 -53.9 -61.1 35.3 17.8 -2.5 199 292 A A H X S+ 0 0 45 -4,-2.7 4,-1.6 2,-0.2 -2,-0.2 0.803 110.4 52.8 -40.9 -42.8 35.8 14.0 -2.6 200 293 A L H >X S+ 0 0 0 -4,-2.0 4,-0.8 -5,-0.3 3,-0.7 0.988 110.9 44.3 -67.0 -55.8 38.3 14.4 -5.4 201 294 A R H >X S+ 0 0 51 -4,-2.8 4,-1.3 1,-0.3 3,-0.9 0.879 114.0 51.3 -54.0 -41.1 40.4 17.0 -3.5 202 295 A A H 3X S+ 0 0 47 -4,-2.8 4,-3.0 1,-0.2 -1,-0.3 0.813 101.5 62.7 -65.5 -29.0 40.2 14.8 -0.3 203 296 A R H X S+ 0 0 76 -4,-1.3 4,-1.9 2,-0.2 3,-0.6 0.969 111.0 56.2 -47.0 -58.6 45.3 14.2 0.6 206 299 A D H 3X S+ 0 0 78 -4,-3.0 4,-2.5 1,-0.3 3,-0.2 0.918 104.7 51.4 -41.0 -61.7 44.3 10.6 1.4 207 300 A D H 3X S+ 0 0 17 -4,-1.7 4,-2.1 1,-0.2 -1,-0.3 0.815 106.5 54.0 -46.7 -44.8 46.9 9.2 -1.0 208 301 A E H < S+ 0 0 97 -4,-2.5 3,-0.5 -5,-0.2 4,-0.3 0.884 120.7 45.9 -50.5 -46.9 53.0 2.6 4.1 215 308 A G H 3< S+ 0 0 57 -4,-3.1 2,-1.6 -5,-0.2 -2,-0.2 0.992 112.5 44.9 -60.9 -66.6 56.3 4.3 4.0 216 309 A T T 3< S- 0 0 69 -4,-3.5 -1,-0.2 -5,-0.2 8,-0.1 -0.445 122.9 -75.2 -94.4 63.8 57.0 5.0 7.7 217 310 A G < - 0 0 32 -2,-1.6 -1,-0.2 -3,-0.5 -3,-0.1 0.955 26.4-145.6 60.0 100.7 56.0 1.7 9.3 218 311 A I S > S+ 0 0 139 -4,-0.3 3,-0.8 1,-0.2 4,-0.3 0.929 106.2 49.5 -52.4 -45.7 52.4 0.6 9.8 219 312 A E T 3 S+ 0 0 106 1,-0.2 2,-0.4 2,-0.1 3,-0.3 0.889 113.7 44.3 -59.1 -45.6 53.5 -1.1 13.1 220 313 A K T 3 S+ 0 0 63 1,-0.2 4,-0.5 2,-0.1 -1,-0.2 -0.371 86.8 97.8-100.8 52.0 55.4 2.1 14.4 221 314 A I <> + 0 0 27 -3,-0.8 4,-2.3 -2,-0.4 5,-0.3 0.860 68.6 60.0-103.3 -53.4 52.8 4.8 13.5 222 315 A G H >>S+ 0 0 40 -4,-0.3 4,-0.7 -3,-0.3 5,-0.6 0.773 111.3 47.5 -47.8 -32.4 50.8 5.4 16.7 223 316 A D H >45S+ 0 0 97 3,-0.2 3,-0.7 2,-0.2 5,-0.2 0.948 111.2 45.2 -71.4 -56.6 54.1 6.5 18.3 224 317 A K H 345S+ 0 0 40 -4,-0.5 -2,-0.2 1,-0.3 -1,-0.2 0.756 121.5 45.6 -60.8 -19.7 55.4 8.7 15.5 225 318 A L H 3<5S- 0 0 53 -4,-2.3 -1,-0.3 7,-0.2 -2,-0.2 0.669 136.1 -1.1 -95.2 -23.3 51.9 10.1 15.6 226 319 A L T <<5S+ 0 0 127 -3,-0.7 2,-1.2 -4,-0.7 -3,-0.2 0.586 121.8 51.4-134.0 -72.2 51.4 10.4 19.4 227 320 A N S - 0 0 62 -2,-1.7 4,-2.7 1,-0.1 5,-0.1 -0.408 35.5-116.4 -80.3 156.7 48.1 19.7 -10.3 242 335 A I H > S+ 0 0 33 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.882 112.6 47.2 -59.3 -49.6 45.8 19.2 -13.3 243 336 A E H > S+ 0 0 146 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.834 112.6 52.4 -63.7 -34.3 47.0 15.7 -14.4 244 337 A K H > S+ 0 0 61 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.990 110.5 49.1 -56.0 -57.0 46.8 14.6 -10.7 245 338 A L H X S+ 0 0 6 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.832 112.5 45.0 -56.3 -45.2 43.2 15.9 -10.7 246 339 A L H X S+ 0 0 51 -4,-2.6 4,-2.3 2,-0.2 5,-0.3 0.932 112.2 51.0 -64.8 -49.6 42.1 14.1 -13.9 247 340 A E H X S+ 0 0 52 -4,-2.1 4,-2.3 1,-0.2 3,-0.5 0.968 115.1 44.1 -52.0 -55.0 43.7 10.9 -12.9 248 341 A Y H X S+ 0 0 33 -4,-2.9 4,-1.9 1,-0.2 -1,-0.2 0.804 110.2 56.5 -61.8 -31.7 41.9 11.1 -9.6 249 342 A G H X S+ 0 0 0 -4,-2.0 4,-1.5 -5,-0.3 -1,-0.2 0.853 110.2 41.9 -70.4 -38.8 38.6 12.2 -11.1 250 343 A N H X S+ 0 0 86 -4,-2.3 4,-3.7 -3,-0.5 5,-0.3 0.927 111.6 57.2 -72.4 -45.8 38.3 9.2 -13.5 251 344 A M H X S+ 0 0 94 -4,-2.3 4,-2.1 -5,-0.3 -2,-0.2 0.877 109.3 45.1 -44.9 -46.8 39.5 6.9 -10.7 252 345 A L H X S+ 0 0 26 -4,-1.9 4,-3.1 2,-0.2 -1,-0.2 0.853 113.5 50.3 -71.6 -35.3 36.6 8.2 -8.5 253 346 A V H X S+ 0 0 43 -4,-1.5 4,-3.4 2,-0.2 5,-0.3 0.900 108.7 50.4 -67.9 -46.4 34.1 7.8 -11.4 254 347 A Q H X S+ 0 0 63 -4,-3.7 4,-1.8 2,-0.2 -2,-0.2 0.980 113.3 48.1 -54.1 -53.6 35.2 4.3 -12.2 255 348 A E H X S+ 0 0 85 -4,-2.1 4,-2.2 -5,-0.3 3,-0.4 0.917 112.9 47.1 -51.6 -53.8 34.7 3.6 -8.5 256 349 A Q H X S+ 0 0 75 -4,-3.1 4,-2.3 1,-0.2 3,-0.5 0.957 111.9 49.5 -48.8 -59.1 31.3 5.3 -8.5 257 350 A E H X S+ 0 0 37 -4,-3.4 4,-1.1 1,-0.3 -1,-0.2 0.750 111.4 53.2 -54.5 -26.9 30.2 3.5 -11.7 258 351 A N H X S+ 0 0 90 -4,-1.8 4,-2.7 -3,-0.4 -1,-0.3 0.872 104.1 50.7 -80.8 -41.0 31.3 0.3 -9.9 259 352 A V H X S+ 0 0 73 -4,-2.2 4,-2.7 -3,-0.5 -2,-0.2 0.901 108.2 55.0 -62.3 -40.9 29.3 0.7 -6.7 260 353 A K H X S+ 0 0 53 -4,-2.3 4,-2.7 -5,-0.2 5,-0.3 0.918 110.3 48.0 -54.4 -43.2 26.3 1.3 -8.9 261 354 A R H X S+ 0 0 160 -4,-1.1 4,-2.1 -5,-0.2 5,-0.2 0.967 114.3 42.1 -63.9 -56.8 27.1 -2.1 -10.5 262 355 A V H X S+ 0 0 93 -4,-2.7 4,-1.1 1,-0.2 -1,-0.2 0.780 116.3 53.6 -62.3 -28.1 27.6 -4.0 -7.3 263 356 A Q H X S+ 0 0 127 -4,-2.7 4,-1.0 -5,-0.2 -2,-0.2 0.978 114.3 36.3 -67.2 -59.3 24.5 -2.2 -5.9 264 357 A L H < S+ 0 0 76 -4,-2.7 -2,-0.2 1,-0.2 -3,-0.2 0.733 118.9 51.2 -69.6 -25.9 22.0 -3.1 -8.6 265 358 A A H < S+ 0 0 90 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.728 110.9 46.8 -86.6 -25.3 23.5 -6.6 -9.2 266 359 A D H < 0 0 90 -4,-1.1 -2,-0.2 -5,-0.2 -1,-0.2 0.657 360.0 360.0 -78.2 -20.2 23.3 -7.4 -5.4 267 360 A K < 0 0 116 -4,-1.0 -1,-0.2 -5,-0.1 -2,-0.1 -0.364 360.0 360.0-120.2 360.0 19.7 -6.0 -5.6