==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ELECTRON TRANSPORT 26-APR-10 3AHP . COMPND 2 MOLECULE: CUTA1; . SOURCE 2 ORGANISM_SCIENTIFIC: SHEWANELLA; . AUTHOR S.TANAKA,C.ANGKAWIDJAJA,Y.KOGA,K.TAKANO,S.KANAYA . 640 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26156.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 494 77.2 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 . 219 34.2 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.9 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 . 48 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 168 26.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 0.9 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 0 5 6 0 6 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 6 0 11 1 10 2 6 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 0 0 0 0 6 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 3 A K 0 0 180 0, 0.0 62,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 123.0 49.2 -26.7 8.3 2 4 A P - 0 0 20 0, 0.0 61,-0.1 0, 0.0 88,-0.1 -0.064 360.0-142.5 -68.5 150.9 46.5 -23.9 8.5 3 5 A E S S+ 0 0 115 86,-0.2 60,-2.5 60,-0.1 61,-0.5 0.870 89.9 36.3 -66.8 -34.6 43.1 -23.9 10.0 4 6 A Q E -AB 62 89A 12 85,-0.6 85,-2.2 58,-0.3 2,-0.3 -0.840 67.6-154.3-131.1 154.2 41.9 -21.8 7.1 5 7 A L E -AB 61 88A 7 56,-2.5 56,-1.6 -2,-0.3 2,-0.5 -0.929 14.0-148.5-125.6 150.9 42.5 -21.2 3.4 6 8 A L E -AB 60 87A 0 81,-3.3 81,-2.6 -2,-0.3 2,-0.5 -0.983 27.7-161.7-110.4 116.9 42.2 -18.6 0.7 7 9 A I E -AB 59 86A 0 52,-2.5 52,-2.3 -2,-0.5 2,-0.4 -0.919 5.1-156.8-107.9 129.1 41.3 -20.3 -2.6 8 10 A F E +AB 58 85A 5 77,-2.3 77,-2.1 -2,-0.5 2,-0.3 -0.846 24.2 154.9-102.6 136.8 41.8 -18.7 -6.0 9 11 A T E -AB 57 84A 2 48,-2.3 48,-3.5 -2,-0.4 2,-0.4 -0.966 28.1-137.6-154.9 171.5 39.8 -19.8 -9.0 10 12 A T E -A 56 0A 2 73,-0.9 73,-0.2 -2,-0.3 -2,-0.0 -0.983 7.2-164.4-139.0 133.3 38.5 -18.6 -12.3 11 13 A C E -A 55 0A 0 44,-2.5 44,-3.5 -2,-0.4 6,-0.0 -0.948 29.0-124.3-113.6 154.9 35.2 -18.9 -14.2 12 14 A P S S+ 0 0 32 0, 0.0 2,-0.3 0, 0.0 41,-0.1 0.776 91.7 7.2 -68.0 -30.8 34.6 -18.3 -17.9 13 15 A D S > S- 0 0 69 42,-0.1 4,-1.7 41,-0.1 42,-0.1 -0.969 76.3-107.3-146.8 167.5 31.8 -15.8 -17.2 14 16 A A H > S+ 0 0 53 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.818 113.1 57.5 -62.2 -35.6 30.1 -13.9 -14.3 15 17 A D H > S+ 0 0 120 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.938 108.9 43.6 -65.1 -46.0 26.9 -16.0 -14.5 16 18 A I H > S+ 0 0 10 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.882 115.1 50.7 -68.5 -31.6 28.6 -19.3 -14.0 17 19 A A H X S+ 0 0 0 -4,-1.7 4,-2.6 2,-0.2 -2,-0.2 0.944 110.3 48.3 -69.2 -47.8 30.8 -17.8 -11.2 18 20 A C H X S+ 0 0 46 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.902 111.5 49.2 -62.3 -40.1 27.9 -16.3 -9.3 19 21 A R H X S+ 0 0 155 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.891 112.8 47.9 -75.0 -25.6 25.9 -19.5 -9.5 20 22 A I H X S+ 0 0 1 -4,-1.9 4,-1.9 -5,-0.2 -2,-0.2 0.870 110.8 51.3 -72.4 -39.3 28.9 -21.6 -8.3 21 23 A A H X S+ 0 0 0 -4,-2.6 4,-1.2 2,-0.2 -2,-0.2 0.894 109.2 51.6 -59.9 -41.4 29.5 -19.0 -5.5 22 24 A T H X S+ 0 0 36 -4,-2.2 4,-2.9 1,-0.2 5,-0.2 0.909 109.6 49.1 -67.3 -41.0 25.9 -19.3 -4.4 23 25 A A H X S+ 0 0 25 -4,-1.6 4,-2.0 1,-0.2 -1,-0.2 0.925 109.5 51.3 -58.5 -46.3 26.0 -23.1 -4.2 24 26 A L H <>S+ 0 0 0 -4,-1.9 5,-2.2 1,-0.2 6,-1.9 0.756 116.1 41.1 -72.4 -22.8 29.1 -23.1 -2.2 25 27 A V H ><5S+ 0 0 1 -4,-1.2 3,-0.8 3,-0.2 -1,-0.2 0.794 110.1 54.8 -98.0 -28.5 27.6 -20.7 0.3 26 28 A E H 3<5S+ 0 0 119 -4,-2.9 -2,-0.2 1,-0.2 -3,-0.2 0.832 109.3 51.6 -58.2 -36.3 24.2 -22.3 0.4 27 29 A A T 3<5S- 0 0 53 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.436 112.2-126.9 -83.8 -0.1 26.1 -25.4 1.2 28 30 A K T < 5S+ 0 0 84 -3,-0.8 78,-0.3 2,-0.2 -3,-0.2 0.831 76.2 123.2 56.5 34.9 27.9 -23.5 4.0 29 31 A L S -A 4 0A 10 -33,-0.5 3,-0.9 -2,-0.3 4,-0.3 -0.679 34.6-131.1 -84.8 135.6 38.1 -23.9 6.5 63 65 A T G > S+ 0 0 45 -60,-2.5 3,-2.2 -2,-0.3 -59,-0.1 0.883 107.6 64.7 -49.2 -40.4 40.8 -26.2 5.3 64 66 A T G 3 S+ 0 0 100 -61,-0.5 -1,-0.2 1,-0.3 4,-0.2 0.853 100.9 48.7 -59.0 -33.8 38.7 -29.1 6.7 65 67 A D G X> S+ 0 0 8 -3,-0.9 4,-2.0 1,-0.2 3,-0.9 0.450 83.0 105.6 -80.8 1.4 36.0 -28.3 4.1 66 68 A Y H <> S+ 0 0 31 -3,-2.2 4,-3.4 -4,-0.3 5,-0.2 0.851 70.7 54.8 -56.9 -46.2 38.5 -28.2 1.2 67 69 A P H 3> S+ 0 0 85 0, 0.0 4,-2.3 0, 0.0 -1,-0.3 0.872 112.2 44.9 -59.3 -31.0 37.8 -31.5 -0.5 68 70 A A H <> S+ 0 0 45 -3,-0.9 4,-2.7 2,-0.2 5,-0.2 0.906 112.8 49.8 -79.9 -41.7 34.1 -30.7 -0.9 69 71 A I H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 5,-0.3 0.956 111.4 51.7 -59.1 -47.6 34.7 -27.1 -2.1 70 72 A E H X S+ 0 0 35 -4,-3.4 4,-2.7 1,-0.2 5,-0.2 0.966 113.6 41.6 -50.9 -63.2 37.1 -28.6 -4.6 71 73 A Q H X S+ 0 0 104 -4,-2.3 4,-2.2 1,-0.2 5,-0.3 0.855 113.7 53.1 -55.6 -38.8 34.6 -31.1 -5.9 72 74 A L H X S+ 0 0 48 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.962 113.9 40.8 -65.0 -47.3 31.8 -28.8 -5.9 73 75 A V H X S+ 0 0 0 -4,-2.4 4,-1.1 -5,-0.2 -2,-0.2 0.882 117.5 48.3 -67.3 -39.9 33.5 -26.2 -7.9 74 76 A I H < S+ 0 0 17 -4,-2.7 -2,-0.2 -5,-0.3 -1,-0.2 0.877 111.5 46.4 -76.0 -44.1 35.2 -28.6 -10.3 75 77 A T H < S+ 0 0 107 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.866 117.2 45.9 -54.9 -45.2 32.1 -30.6 -11.1 76 78 A M H < S+ 0 0 78 -4,-1.7 -2,-0.2 -5,-0.3 -1,-0.2 0.680 94.8 94.7 -75.0 -22.2 30.1 -27.4 -11.7 77 79 A H S < S- 0 0 11 -4,-1.1 -66,-0.1 -5,-0.1 -60,-0.0 -0.601 73.6-139.8 -74.5 135.5 32.9 -25.8 -13.7 78 80 A P S S+ 0 0 83 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.811 78.6 81.0 -64.9 -31.5 32.6 -26.3 -17.5 79 81 A Y S S- 0 0 106 1,-0.1 -2,-0.1 -3,-0.0 0, 0.0 -0.499 78.3-132.6 -78.0 149.2 36.3 -26.9 -18.1 80 82 A E S S+ 0 0 180 1,-0.3 -1,-0.1 -2,-0.2 -3,-0.1 0.870 101.7 17.9 -62.0 -48.4 37.9 -30.3 -17.5 81 83 A V S S- 0 0 64 122,-0.1 -1,-0.3 123,-0.0 3,-0.1 -0.708 83.9-179.9-131.7 84.8 40.8 -28.9 -15.5 82 84 A P - 0 0 4 0, 0.0 2,-0.4 0, 0.0 119,-0.1 -0.215 40.1 -85.5 -82.1 168.1 40.1 -25.3 -14.3 83 85 A E + 0 0 13 -73,-0.2 -73,-0.9 117,-0.0 2,-0.3 -0.628 58.6 154.5 -77.4 127.6 42.3 -23.1 -12.2 84 86 A F E +B 9 0A 0 -2,-0.4 117,-1.0 -75,-0.2 2,-0.4 -0.832 10.2 166.5-158.6 107.6 41.9 -23.9 -8.5 85 87 A I E -BE 8 200A 0 -77,-2.1 -77,-2.3 -2,-0.3 2,-0.5 -0.991 24.8-136.9-135.8 143.2 44.6 -23.2 -6.0 86 88 A A E -BE 7 199A 1 113,-3.6 112,-2.1 -2,-0.4 113,-0.8 -0.862 16.2-175.2-102.6 138.5 44.9 -23.0 -2.2 87 89 A T E -B 6 0A 1 -81,-2.6 -81,-3.3 -2,-0.5 2,-0.2 -0.944 29.0-109.4-126.9 141.8 46.7 -20.4 -0.2 88 90 A P E -B 5 0A 0 0, 0.0 2,-0.5 0, 0.0 -83,-0.2 -0.491 15.7-150.3 -73.0 136.0 47.2 -20.4 3.6 89 91 A I E +B 4 0A 5 -85,-2.2 -85,-0.6 -2,-0.2 214,-0.2 -0.925 23.2 168.0 -92.4 129.5 45.5 -18.0 5.9 90 92 A I + 0 0 61 212,-2.9 2,-0.3 -2,-0.5 213,-0.2 0.195 59.3 2.6-126.9 8.1 47.8 -17.4 8.8 91 93 A G E +M 302 0C 20 211,-0.9 211,-2.8 2,-0.0 -1,-0.3 -0.953 58.5 139.7-173.5 171.4 46.2 -14.4 10.5 92 94 A G E -M 301 0C 10 209,-0.3 2,-0.4 -2,-0.3 209,-0.2 -0.900 64.0 -42.3 168.6 179.9 43.3 -12.0 10.5 93 95 A F >> - 0 0 38 207,-1.6 4,-1.9 -2,-0.3 3,-1.2 -0.560 57.9-131.0 -62.6 121.7 40.9 -10.2 12.7 94 96 A G H 3> S+ 0 0 40 -2,-0.4 4,-3.3 1,-0.3 5,-0.2 0.839 103.3 51.0 -46.1 -54.6 39.8 -12.8 15.3 95 97 A P H 3> S+ 0 0 62 0, 0.0 4,-1.6 0, 0.0 -1,-0.3 0.838 111.9 50.1 -57.4 -30.2 36.1 -12.3 15.1 96 98 A Y H <> S+ 0 0 7 -3,-1.2 4,-1.7 2,-0.2 -2,-0.2 0.886 111.8 45.3 -71.4 -45.5 36.3 -12.6 11.3 97 99 A L H X S+ 0 0 34 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.900 113.5 52.8 -60.0 -41.2 38.3 -15.8 11.4 98 100 A Q H X S+ 0 0 89 -4,-3.3 4,-2.8 -5,-0.3 -2,-0.2 0.866 104.7 54.0 -64.3 -34.7 35.8 -17.0 14.1 99 101 A W H < S+ 0 0 55 -4,-1.6 4,-0.2 1,-0.2 -1,-0.2 0.912 108.4 50.0 -72.8 -32.0 32.9 -16.2 11.8 100 102 A I H >X S+ 0 0 2 -4,-1.7 3,-0.8 1,-0.2 4,-0.7 0.906 113.8 45.6 -62.1 -49.4 34.5 -18.4 9.1 101 103 A K H >< S+ 0 0 85 -4,-2.0 3,-0.8 1,-0.2 -2,-0.2 0.909 110.7 52.7 -59.4 -45.3 35.0 -21.2 11.6 102 104 A D T 3< S+ 0 0 111 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.465 102.1 62.3 -66.7 -6.4 31.4 -21.0 13.1 103 105 A N T <4 S+ 0 0 19 -3,-0.8 -1,-0.2 -4,-0.2 -2,-0.2 0.656 88.2 71.1-119.6 -25.3 29.9 -21.2 9.8 104 106 A S << - 0 0 19 -3,-0.8 -75,-0.1 -4,-0.7 -76,-0.1 -0.862 57.0-167.6 -82.4 128.2 31.0 -24.5 8.8 105 107 A P 0 0 103 0, 0.0 -1,-0.1 0, 0.0 -76,-0.1 0.765 360.0 360.0 -72.6 -24.1 29.3 -27.2 10.7 106 108 A S 0 0 131 -78,-0.3 -2,-0.1 -3,-0.1 -77,-0.1 0.288 360.0 360.0 114.2 360.0 32.0 -29.5 9.2 107 !* 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 0.0 108 2 B Y 0 0 100 0, 0.0 90,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 142.7 57.2 -23.5 4.0 109 3 B K - 0 0 194 3,-0.0 62,-0.0 87,-0.0 197,-0.0 -0.463 360.0-174.5-139.4 76.9 58.9 -24.9 1.0 110 4 B P - 0 0 24 0, 0.0 88,-0.1 0, 0.0 61,-0.1 -0.117 33.5-131.3 -69.7 157.1 56.2 -25.4 -1.7 111 5 B E S S+ 0 0 124 86,-0.3 60,-2.6 1,-0.1 61,-0.6 0.820 93.4 31.5 -65.4 -39.7 56.4 -27.1 -5.1 112 6 B Q E -IJ 170 197B 16 85,-0.5 85,-1.9 58,-0.3 2,-0.3 -0.914 69.9-150.2-132.0 149.5 54.5 -24.1 -6.6 113 7 B L E -IJ 169 196B 9 56,-2.5 56,-1.8 -2,-0.3 2,-0.5 -0.889 12.8-145.4-117.4 151.8 54.1 -20.4 -6.1 114 8 B L E -IJ 168 195B 0 81,-2.9 81,-3.4 -2,-0.3 2,-0.4 -0.984 28.0-162.7-104.1 119.8 51.5 -17.7 -6.6 115 9 B I E -IJ 167 194B 0 52,-2.6 52,-2.7 -2,-0.5 2,-0.4 -0.875 5.7-159.6-105.7 132.9 53.3 -14.5 -7.5 116 10 B F E +IJ 166 193B 9 77,-3.6 77,-2.7 -2,-0.4 2,-0.3 -0.933 24.7 147.8-108.7 139.3 51.8 -11.0 -7.3 117 11 B T E -IJ 165 192B 4 48,-2.0 48,-2.9 -2,-0.4 2,-0.3 -0.902 29.2-135.8-159.3-174.3 53.1 -8.1 -9.2 118 12 B T E -I 164 0B 3 73,-0.8 73,-0.1 -2,-0.3 25,-0.0 -0.976 4.7-157.3-155.0 140.0 52.1 -4.9 -11.0 119 13 B C E -I 163 0B 0 44,-2.1 44,-4.3 -2,-0.3 3,-0.0 -0.972 30.4-120.0-125.9 153.8 52.8 -3.1 -14.2 120 14 B P S S- 0 0 29 0, 0.0 2,-0.3 0, 0.0 41,-0.1 0.730 94.7 -3.7 -67.3 -21.6 52.4 0.7 -15.0 121 15 B D S > S- 0 0 65 42,-0.1 4,-1.7 41,-0.1 3,-0.2 -0.967 76.7 -98.7-158.7 179.3 49.9 -0.2 -17.7 122 16 B A H > S+ 0 0 53 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.759 112.8 60.0 -75.3 -32.3 48.2 -3.1 -19.5 123 17 B D H > S+ 0 0 124 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.905 108.6 45.4 -61.2 -44.3 50.5 -3.1 -22.6 124 18 B I H > S+ 0 0 20 2,-0.2 4,-2.8 -3,-0.2 5,-0.3 0.922 111.5 52.4 -62.8 -44.2 53.5 -3.7 -20.5 125 19 B A H X S+ 0 0 0 -4,-1.7 4,-3.7 1,-0.2 -2,-0.2 0.942 111.2 48.2 -58.7 -44.0 51.6 -6.4 -18.5 126 20 B C H X S+ 0 0 39 -4,-2.7 4,-2.8 2,-0.2 -1,-0.2 0.876 110.4 50.5 -61.5 -44.4 50.8 -8.1 -21.7 127 21 B R H X S+ 0 0 132 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.940 116.0 41.4 -61.1 -49.5 54.3 -7.9 -23.0 128 22 B I H X S+ 0 0 1 -4,-2.8 4,-2.9 2,-0.2 5,-0.2 0.940 114.4 52.3 -65.6 -48.5 55.7 -9.5 -19.8 129 23 B A H X S+ 0 0 0 -4,-3.7 4,-2.9 -5,-0.3 -2,-0.2 0.941 110.4 48.7 -46.3 -55.6 52.9 -12.0 -19.6 130 24 B T H X S+ 0 0 37 -4,-2.8 4,-3.6 2,-0.2 5,-0.3 0.932 112.1 48.0 -54.1 -48.9 53.5 -13.1 -23.2 131 25 B A H X S+ 0 0 0 -4,-2.2 4,-2.7 1,-0.2 6,-0.2 0.971 112.1 49.7 -56.3 -54.9 57.3 -13.5 -22.6 132 26 B L H <>S+ 0 0 0 -4,-2.9 5,-2.3 2,-0.2 6,-1.3 0.901 116.1 42.8 -50.0 -47.4 56.6 -15.5 -19.4 133 27 B V H ><5S+ 0 0 0 -4,-2.9 3,-1.9 -5,-0.2 -2,-0.2 0.965 114.0 48.3 -74.3 -44.1 54.2 -17.8 -21.2 134 28 B E H 3<5S+ 0 0 53 -4,-3.6 -2,-0.2 1,-0.3 -1,-0.2 0.809 109.5 52.9 -67.8 -18.3 56.3 -18.2 -24.4 135 29 B A T 3<5S- 0 0 4 -4,-2.7 -1,-0.3 -5,-0.3 -2,-0.2 0.477 110.5-128.3 -83.5 -4.7 59.4 -19.0 -22.4 136 30 B K T < 5S+ 0 0 26 -3,-1.9 -3,-0.2 -5,-0.2 3,-0.1 0.850 73.6 125.8 53.4 40.2 57.3 -21.6 -20.6 137 31 B L S S-N 156 0C 182 3,-2.1 3,-1.5 -2,-0.4 -2,-0.0 -0.955 77.3 -8.9-140.7 124.1 57.7 8.6 -2.6 154 48 B D T 3 S- 0 0 134 -2,-0.3 3,-0.1 1,-0.3 -1,-0.0 0.831 127.2 -65.6 59.9 33.5 59.9 11.5 -1.5 155 49 B N T 3 S+ 0 0 116 1,-0.3 2,-0.3 3,-0.0 -1,-0.3 0.787 111.4 118.2 48.2 34.2 57.5 11.7 1.4 156 50 B N E < S-N 153 0C 95 -3,-1.5 -3,-2.1 -5,-0.0 2,-0.6 -0.866 72.2-111.4-104.7 161.2 54.6 12.6 -0.6 157 51 B I E -N 152 0C 55 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.791 41.7-171.2 -94.9 114.5 51.6 10.5 -0.9 158 52 B C E -N 151 0C 30 -7,-2.9 -7,-1.7 -2,-0.6 2,-0.3 -0.794 17.6-168.8-112.3 151.0 51.3 9.0 -4.4 159 53 B Q E +N 150 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48,-3.5 -2,-0.4 2,-0.3 -0.968 27.3-142.8-155.9 167.7 76.5 -21.7 -25.1 549 12 F T E -H 595 0F 4 73,-0.8 73,-0.1 -2,-0.3 25,-0.0 -0.909 5.1-157.9-129.2 158.4 74.8 -24.8 -26.5 550 13 F C E -H 594 0F 0 44,-1.8 44,-2.0 -2,-0.3 66,-0.0 -0.948 28.2-122.9-130.8 158.4 71.3 -26.3 -26.1 551 14 F P S S+ 0 0 40 0, 0.0 2,-0.3 0, 0.0 41,-0.1 0.610 95.9 29.9 -64.0 -3.5 70.3 -29.9 -26.6 552 15 F D > - 0 0 65 42,-0.2 4,-2.3 1,-0.1 42,-0.1 -0.987 67.5-131.9-172.2 128.9 67.8 -28.6 -29.0 553 16 F A H > S+ 0 0 56 -2,-0.3 4,-2.7 2,-0.2 5,-0.2 0.881 112.5 54.4 -69.5 -37.2 67.0 -25.9 -31.6 554 17 F D H > S+ 0 0 117 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.901 111.2 43.9 -56.6 -48.3 63.5 -25.5 -30.0 555 18 F I H > S+ 0 0 18 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.916 112.4 53.3 -68.0 -41.9 65.1 -25.0 -26.6 556 19 F A H X S+ 0 0 0 -4,-2.3 4,-3.2 1,-0.2 -2,-0.2 0.934 108.3 50.1 -56.2 -49.1 67.7 -22.6 -28.0 557 20 F C H X S+ 0 0 33 -4,-2.7 4,-3.6 1,-0.2 5,-0.3 0.937 109.2 51.1 -58.0 -47.7 65.0 -20.5 -29.7 558 21 F R H X S+ 0 0 43 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.921 114.5 42.5 -55.8 -49.4 63.0 -20.2 -26.4 559 22 F I H X S+ 0 0 1 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.950 115.6 50.9 -66.4 -47.2 66.0 -19.1 -24.5 560 23 F A H X S+ 0 0 0 -4,-3.2 4,-2.5 -5,-0.2 -2,-0.2 0.948 111.0 47.0 -46.9 -57.5 67.1 -16.8 -27.3 561 24 F T H X S+ 0 0 17 -4,-3.6 4,-2.8 1,-0.2 -1,-0.2 0.844 111.2 51.3 -71.0 -29.0 63.7 -15.2 -27.6 562 25 F A H X S+ 0 0 0 -4,-2.3 4,-2.0 -5,-0.3 6,-0.3 0.922 108.2 52.2 -59.0 -47.4 63.4 -14.7 -23.9 563 26 F L H <>S+ 0 0 0 -4,-2.7 5,-1.2 -5,-0.2 6,-1.2 0.929 115.5 41.5 -56.3 -43.7 66.8 -13.0 -23.9 564 27 F V H ><5S+ 0 0 1 -4,-2.5 3,-3.8 2,-0.2 -2,-0.2 0.986 108.9 56.8 -66.2 -58.0 65.6 -10.7 -26.6 565 28 F E H 3<5S+ 0 0 23 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.829 111.0 47.7 -41.7 -37.5 62.1 -10.1 -25.2 566 29 F A T 3<5S- 0 0 3 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.482 106.5-129.1 -86.7 -5.3 64.0 -8.9 -22.0 567 30 F K T < 5S+ 0 0 71 -3,-3.8 -3,-0.2 2,-0.3 -2,-0.1 0.607 75.0 122.5 68.0 13.9 66.4 -6.7 -23.9 568 31 F L S -H 543 0F 8 -33,-0.4 3,-2.2 -2,-0.3 -58,-0.3 -0.676 34.8-131.3 -78.6 135.6 76.8 -5.7 -22.1 602 65 F T G > S+ 0 0 28 -60,-2.6 3,-2.2 -2,-0.3 -59,-0.1 0.903 108.5 62.4 -53.3 -41.6 79.2 -7.0 -19.5 603 66 F T G 3 S+ 0 0 95 -61,-0.6 -1,-0.3 1,-0.3 4,-0.2 0.631 99.9 53.4 -61.0 -14.3 77.0 -5.2 -16.9 604 67 F D G <> S+ 0 0 12 -3,-2.2 4,-2.0 1,-0.1 -1,-0.3 0.228 80.5 104.0-101.4 9.7 74.0 -7.4 -17.9 605 68 F Y H <> S+ 0 0 34 -3,-2.2 4,-3.0 1,-0.2 5,-0.2 0.922 72.4 52.1 -64.1 -50.3 75.9 -10.7 -17.4 606 69 F P H > S+ 0 0 85 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.893 111.9 48.9 -59.3 -33.8 74.5 -11.9 -14.1 607 70 F A H > S+ 0 0 13 2,-0.2 4,-1.1 1,-0.2 -2,-0.2 0.936 110.6 48.5 -68.6 -49.4 71.0 -11.5 -15.4 608 71 F I H >X S+ 0 0 0 -4,-2.0 4,-2.7 1,-0.2 3,-0.8 0.938 112.5 51.2 -55.6 -45.5 71.7 -13.4 -18.7 609 72 F E H 3X S+ 0 0 45 -4,-3.0 4,-2.1 1,-0.3 5,-0.3 0.908 108.2 50.4 -58.4 -48.1 73.3 -16.1 -16.6 610 73 F Q H 3X S+ 0 0 76 -4,-2.4 4,-1.7 -5,-0.2 -1,-0.3 0.843 115.5 43.8 -44.4 -39.0 70.4 -16.5 -14.2 611 74 F L H > - 0 0 35 -117,-1.8 4,-1.6 -2,-0.3 3,-0.9 -0.450 60.1-134.8 -68.5 121.5 81.8 -0.9 -35.4 633 96 F G H >> S+ 0 0 39 -2,-0.3 4,-2.6 1,-0.3 3,-0.7 0.882 100.5 47.2 -42.7 -58.3 81.0 2.0 -33.2 634 97 F P H 3> S+ 0 0 61 0, 0.0 4,-2.0 0, 0.0 -1,-0.3 0.767 110.4 52.4 -60.7 -30.2 77.2 2.2 -33.9 635 98 F Y H <> S+ 0 0 6 -3,-0.9 4,-1.8 2,-0.2 -2,-0.2 0.820 112.2 46.7 -68.9 -28.9 76.7 -1.5 -33.5 636 99 F L H