==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SEED PROTEIN 20-FEB-95 1CNV . COMPND 2 MOLECULE: CONCANAVALIN B; . SOURCE 2 ORGANISM_SCIENTIFIC: CANAVALIA ENSIFORMIS; . AUTHOR M.HENNIG . 283 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12428.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 202 71.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 50 17.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 10 3.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 27 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 71 25.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.8 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 2 0 1 2 1 1 0 0 0 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 2 0 4 1 2 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 . 5 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 0 0 0 0 1 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 D > 0 0 61 0, 0.0 3,-0.7 0, 0.0 4,-0.0 0.000 360.0 360.0 360.0-172.9 -12.2 70.2 -16.7 2 2 A I G > + 0 0 37 1,-0.2 3,-1.8 2,-0.2 247,-0.0 0.897 360.0 58.9 -64.9 -40.6 -9.7 72.9 -15.8 3 3 A S G 3 S+ 0 0 73 1,-0.3 -1,-0.2 280,-0.1 280,-0.1 0.748 102.0 54.6 -62.4 -24.3 -12.4 75.3 -14.4 4 4 A S G < S+ 0 0 61 -3,-0.7 -1,-0.3 2,-0.1 -2,-0.2 0.226 78.0 150.5 -94.0 13.2 -13.5 72.7 -11.8 5 5 A T < - 0 0 18 -3,-1.8 2,-0.4 256,-0.1 256,-0.2 -0.190 35.2-151.1 -49.1 128.8 -9.9 72.4 -10.4 6 6 A E E -a 261 0A 50 254,-1.4 256,-2.1 22,-0.0 2,-0.5 -0.872 10.2-146.8-102.3 135.2 -9.9 71.5 -6.7 7 7 A I E -a 262 0A 6 -2,-0.4 22,-2.9 254,-0.2 23,-1.4 -0.940 14.4-173.8-112.5 129.1 -6.8 72.8 -4.8 8 8 A A E -ab 263 30A 0 254,-2.4 256,-2.5 -2,-0.5 2,-0.3 -0.832 5.1-167.0-112.3 155.0 -5.3 70.9 -1.8 9 9 A V E -ab 264 31A 0 21,-1.7 23,-2.6 -2,-0.3 2,-0.4 -0.992 20.8-124.7-145.5 148.3 -2.5 72.1 0.4 10 10 A Y E - b 0 32A 2 254,-1.6 257,-2.2 -2,-0.3 2,-0.3 -0.822 32.0-179.9 -92.2 133.2 -0.1 70.7 3.0 11 11 A W E + b 0 33A 5 21,-2.7 23,-2.4 -2,-0.4 7,-0.0 -0.981 33.8 102.4-133.4 143.2 -0.2 72.5 6.4 12 12 A G + 0 0 5 -2,-0.3 2,-0.3 1,-0.3 41,-0.2 0.447 53.0 94.9 160.5 6.8 1.9 71.7 9.5 13 13 A Q S > S- 0 0 63 37,-0.1 3,-1.8 1,-0.1 4,-0.4 -0.843 75.2-113.7-119.3 159.9 4.8 74.1 10.1 14 14 A R G > S+ 0 0 140 37,-1.1 3,-1.6 -2,-0.3 38,-0.1 0.893 115.1 55.5 -56.0 -43.6 5.1 77.3 12.1 15 15 A E G 3 S+ 0 0 63 1,-0.3 -1,-0.3 -3,-0.0 3,-0.1 0.559 91.8 75.1 -69.1 -8.6 5.6 79.4 9.0 16 16 A D G < S- 0 0 3 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.662 94.8-139.2 -76.9 -18.0 2.3 78.2 7.6 17 17 A G < - 0 0 34 -3,-1.6 -1,-0.2 -4,-0.4 -5,-0.1 -0.332 46.7 -22.8 84.9-176.0 0.2 80.3 10.0 18 18 A L > - 0 0 79 1,-0.1 4,-1.9 -3,-0.1 5,-0.1 -0.401 52.0-131.8 -70.4 146.4 -2.9 79.1 11.8 19 19 A L H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.932 109.5 55.7 -60.9 -43.7 -5.0 76.3 10.3 20 20 A R H > S+ 0 0 65 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.909 108.4 46.6 -55.3 -44.8 -8.1 78.4 10.8 21 21 A D H > S+ 0 0 83 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.854 108.6 56.1 -68.1 -34.6 -6.6 81.2 8.7 22 22 A T H >< S+ 0 0 0 -4,-1.9 3,-0.9 1,-0.2 5,-0.4 0.939 111.6 42.9 -62.4 -45.8 -5.5 78.8 6.0 23 23 A a H >< S+ 0 0 1 -4,-2.4 3,-1.7 1,-0.2 5,-0.2 0.885 106.1 62.6 -66.8 -39.3 -9.1 77.5 5.6 24 24 A K H 3< S+ 0 0 116 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.595 85.6 74.7 -65.3 -12.1 -10.5 81.1 5.8 25 25 A T T << S- 0 0 49 -3,-0.9 -1,-0.3 -4,-0.6 -2,-0.2 0.777 90.7-144.9 -69.3 -26.7 -8.7 82.0 2.5 26 26 A N < + 0 0 112 -3,-1.7 -2,-0.1 -4,-0.3 -3,-0.1 0.607 69.6 114.2 68.2 14.5 -11.2 79.9 0.6 27 27 A N + 0 0 31 -5,-0.4 2,-0.4 -4,-0.0 -20,-0.1 0.659 65.7 61.3 -83.1 -21.8 -8.4 79.0 -1.7 28 28 A Y - 0 0 2 -6,-0.3 -20,-0.2 -5,-0.2 -2,-0.1 -0.890 45.1-176.6-119.4 144.9 -8.4 75.3 -0.7 29 29 A K S S+ 0 0 91 -22,-2.9 49,-2.6 -2,-0.4 2,-0.4 0.624 85.4 33.7-101.4 -23.4 -10.9 72.4 -0.8 30 30 A I E -bc 8 78A 1 -23,-1.4 -21,-1.7 47,-0.2 2,-0.4 -1.000 62.4-170.2-136.8 136.3 -8.6 69.9 1.0 31 31 A V E -bc 9 79A 0 47,-2.7 49,-2.7 -2,-0.4 2,-0.6 -0.996 12.2-150.6-127.5 128.4 -6.0 70.5 3.7 32 32 A F E -bc 10 80A 0 -23,-2.6 -21,-2.7 -2,-0.4 2,-0.6 -0.902 10.2-144.6 -98.6 119.3 -3.5 67.8 4.8 33 33 A I E -bc 11 81A 0 47,-3.2 49,-2.6 -2,-0.6 2,-0.4 -0.735 40.3-119.8 -79.4 120.0 -2.4 68.1 8.4 34 34 A S E - c 0 82A 11 -23,-2.4 49,-0.1 -2,-0.6 51,-0.0 -0.952 56.7 -1.6-134.2 118.1 1.3 66.9 8.0 35 35 A F E + 0 0 21 47,-0.7 2,-1.0 -2,-0.4 14,-0.5 0.616 18.9 178.5-151.0 157.5 2.6 64.5 9.3 36 36 A L E + c 0 83A 0 46,-2.0 48,-2.3 -3,-0.2 12,-0.1 -0.938 40.6 160.9 -90.5 101.0 2.2 61.7 11.6 37 37 A D + 0 0 28 -2,-1.0 52,-1.0 10,-0.2 2,-0.4 0.222 41.3 72.0-117.7 13.2 5.7 60.5 10.9 38 38 A K E +j 89 0B 98 9,-0.3 9,-0.3 50,-0.2 2,-0.3 -0.870 59.4 113.1-135.1 102.2 6.7 58.3 13.8 39 39 A F E +j 90 0B 4 50,-1.2 52,-1.5 -2,-0.4 2,-0.3 -0.969 20.5 126.7-159.7 158.3 5.2 54.8 14.0 40 40 A G > - 0 0 10 3,-0.4 3,-2.5 -2,-0.3 52,-0.1 -0.942 69.5 -37.4 169.7-173.7 6.3 51.2 13.7 41 41 A b T 3 S+ 0 0 84 1,-0.3 -1,-0.1 -2,-0.3 53,-0.0 0.738 131.3 37.4 -40.9 -47.8 6.2 47.8 15.6 42 42 A E T 3 S+ 0 0 197 1,-0.1 2,-0.8 2,-0.0 -1,-0.3 0.340 94.3 88.8 -97.0 14.9 6.7 49.1 19.1 43 43 A I < + 0 0 60 -3,-2.5 -3,-0.4 1,-0.2 -1,-0.1 -0.795 44.6 168.8-113.0 88.2 4.6 52.3 18.9 44 44 A R S S+ 0 0 192 -2,-0.8 -1,-0.2 1,-0.3 60,-0.1 0.775 76.8 32.0 -69.5 -33.0 1.1 51.3 19.9 45 45 A K S S- 0 0 110 59,-0.0 -1,-0.3 2,-0.0 56,-0.0 -0.776 85.2-149.5-128.8 84.1 -0.3 54.8 20.2 46 46 A P - 0 0 0 0, 0.0 2,-0.3 0, 0.0 -7,-0.1 -0.257 11.1-143.0 -54.6 139.4 1.5 57.2 17.8 47 47 A E - 0 0 104 -9,-0.3 2,-0.5 69,-0.1 -9,-0.3 -0.786 9.6-128.3-105.3 148.0 1.8 60.8 19.0 48 48 A L + 0 0 0 -2,-0.3 2,-0.4 -12,-0.1 14,-0.2 -0.837 26.3 176.7-100.1 130.7 1.5 63.8 16.7 49 49 A E - 0 0 73 -14,-0.5 2,-0.6 -2,-0.5 6,-0.2 -0.961 10.0-167.9-136.0 116.4 4.2 66.5 16.6 50 50 A L B >> -K 54 0C 3 4,-2.1 3,-2.5 -2,-0.4 4,-2.1 -0.937 36.2-108.8-105.8 117.1 4.0 69.4 14.3 51 51 A E T 34 S- 0 0 128 -2,-0.6 -37,-1.1 1,-0.3 4,-0.1 -0.181 95.8 -8.5 -49.9 120.0 7.3 71.4 14.2 52 52 A G T 34 S+ 0 0 23 -39,-0.2 -1,-0.3 1,-0.1 -39,-0.1 0.502 131.2 70.6 69.5 8.1 7.1 74.7 15.8 53 53 A V T <4 S- 0 0 18 -3,-2.5 2,-0.3 1,-0.3 -2,-0.2 0.774 102.5 -21.2-118.5 -55.9 3.3 74.3 16.1 54 54 A c B < S+K 50 0C 0 -4,-2.1 -4,-2.1 2,-0.1 -1,-0.3 -0.995 77.8 74.7-160.0 158.3 2.3 71.6 18.7 55 55 A G B >>>S-L 60 0D 4 5,-3.0 3,-1.9 -2,-0.3 5,-1.0 -0.557 90.0 -35.0 126.8 167.4 3.5 68.6 20.6 56 56 A P T 345S+ 0 0 88 0, 0.0 -2,-0.1 0, 0.0 0, 0.0 -0.573 131.7 35.5 -53.2 104.2 5.7 67.7 23.5 57 57 A S T 345S+ 0 0 112 -2,-0.6 -8,-0.0 -6,-0.0 -2,-0.0 0.027 108.5 58.0 115.9 -17.6 8.4 70.6 22.9 58 58 A V T <45S- 0 0 54 -3,-1.9 -9,-0.0 2,-0.2 -7,-0.0 0.525 102.0-134.2-107.9 -5.0 6.5 73.5 21.6 59 59 A G T <5S+ 0 0 73 -4,-0.9 -5,-0.0 1,-0.2 0, 0.0 0.703 72.0 109.9 60.0 30.8 4.6 73.2 24.9 60 60 A N B < -L 55 0D 59 -5,-1.0 -5,-3.0 3,-0.0 -2,-0.2 -0.986 69.8-126.4-132.5 122.3 1.4 73.5 23.1 61 61 A P > - 0 0 73 0, 0.0 3,-1.6 0, 0.0 4,-0.1 -0.464 9.2-135.8 -70.1 141.2 -0.9 70.5 22.8 62 62 A c G > S+ 0 0 7 1,-0.3 3,-2.1 -14,-0.2 4,-0.2 0.719 98.0 78.7 -66.4 -19.0 -2.1 69.5 19.3 63 63 A S G > S+ 0 0 51 1,-0.3 3,-1.5 2,-0.2 -1,-0.3 0.645 73.7 77.7 -64.4 -14.2 -5.6 69.0 20.7 64 64 A F G < S+ 0 0 70 -3,-1.6 3,-0.5 1,-0.3 4,-0.4 0.712 82.6 68.7 -67.5 -17.4 -5.9 72.8 20.6 65 65 A L G <> S+ 0 0 1 -3,-2.1 4,-2.6 1,-0.2 3,-0.3 0.625 71.7 93.9 -75.8 -14.1 -6.5 72.3 16.9 66 66 A E H <> S+ 0 0 53 -3,-1.5 4,-2.2 1,-0.2 -1,-0.2 0.888 86.3 43.7 -46.1 -52.3 -9.8 70.6 17.5 67 67 A S H > S+ 0 0 64 -3,-0.5 4,-2.2 -4,-0.2 -1,-0.2 0.857 113.6 51.0 -66.0 -35.0 -12.0 73.8 17.1 68 68 A Q H > S+ 0 0 9 -4,-0.4 4,-2.5 -3,-0.3 -1,-0.2 0.893 108.4 52.5 -68.7 -38.8 -10.0 75.0 14.0 69 69 A I H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.945 111.5 46.7 -60.6 -47.0 -10.5 71.6 12.4 70 70 A K H X S+ 0 0 53 -4,-2.2 4,-2.7 -5,-0.2 -2,-0.2 0.887 110.1 52.6 -65.1 -36.8 -14.2 71.8 13.0 71 71 A E H X S+ 0 0 43 -4,-2.2 4,-1.4 2,-0.2 -1,-0.2 0.931 109.8 49.9 -61.2 -48.6 -14.4 75.4 11.6 72 72 A a H <>S+ 0 0 0 -4,-2.5 5,-2.4 1,-0.2 3,-0.5 0.937 112.1 47.3 -54.9 -48.0 -12.6 74.3 8.5 73 73 A Q H ><5S+ 0 0 50 -4,-2.4 3,-2.0 1,-0.2 -2,-0.2 0.914 106.9 56.7 -64.1 -39.7 -15.1 71.4 8.0 74 74 A R H 3<5S+ 0 0 190 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.800 105.4 52.1 -64.2 -28.1 -18.1 73.7 8.6 75 75 A M T 3<5S- 0 0 61 -4,-1.4 -1,-0.3 -3,-0.5 -2,-0.2 0.289 127.8 -96.3 -92.1 14.1 -17.0 75.9 5.8 76 76 A G T < 5S+ 0 0 45 -3,-2.0 2,-0.4 1,-0.3 -3,-0.2 0.500 79.3 135.7 90.4 4.0 -16.7 73.0 3.4 77 77 A V < - 0 0 4 -5,-2.4 2,-0.5 -6,-0.2 -1,-0.3 -0.694 48.8-136.8 -89.0 133.7 -13.0 72.2 3.6 78 78 A K E -c 30 0A 80 -49,-2.6 -47,-2.7 -2,-0.4 2,-0.5 -0.794 15.7-155.3 -89.3 130.5 -11.9 68.5 3.9 79 79 A V E -c 31 0A 0 -2,-0.5 45,-2.5 -49,-0.2 46,-0.8 -0.942 13.0-175.5-111.8 118.6 -9.2 67.9 6.5 80 80 A F E -cd 32 125A 0 -49,-2.7 -47,-3.2 -2,-0.5 2,-0.5 -0.783 24.6-130.1-107.8 155.8 -7.0 64.9 6.1 81 81 A L E -cd 33 126A 0 44,-2.0 46,-2.8 -2,-0.3 2,-0.5 -0.931 26.9-145.3-102.6 127.5 -4.3 63.5 8.4 82 82 A A E -cd 34 127A 0 -49,-2.6 -46,-2.0 -2,-0.5 -47,-0.7 -0.861 7.7-152.3 -99.0 127.6 -1.1 62.8 6.3 83 83 A L E -cd 36 128A 0 44,-3.3 46,-1.9 -2,-0.5 2,-0.6 -0.742 61.1 -1.2 -94.2 145.1 1.1 59.8 7.2 84 84 A G E + d 0 129A 0 -48,-2.3 3,-0.3 -2,-0.3 46,-0.2 -0.705 66.5 169.5 88.7-123.2 4.8 59.8 6.4 85 85 A G - 0 0 0 44,-2.9 47,-0.6 -2,-0.6 46,-0.3 -0.401 57.3 -46.6 101.4-175.7 6.4 62.7 4.7 86 86 A P S S+ 0 0 56 0, 0.0 2,-0.2 0, 0.0 -1,-0.2 0.667 117.9 37.6 -67.2 -24.1 10.0 63.8 4.0 87 87 A K S S+ 0 0 139 -3,-0.3 45,-0.1 2,-0.0 2,-0.1 -0.762 81.3 53.6-125.3 176.1 11.3 63.1 7.5 88 88 A G S S- 0 0 43 -2,-0.2 2,-0.5 1,-0.1 -50,-0.2 -0.314 75.8 -79.0 96.5 179.6 10.9 60.7 10.4 89 89 A T E +j 38 0B 101 -52,-1.0 -50,-1.2 -2,-0.1 2,-0.4 -0.956 56.3 162.4-128.8 104.1 11.0 57.0 11.0 90 90 A Y E +j 39 0B 1 -2,-0.5 44,-2.3 42,-0.4 2,-0.3 -0.992 9.6 162.1-134.5 138.0 7.9 55.2 9.9 91 91 A S - 0 0 20 -52,-1.5 3,-0.1 -2,-0.4 47,-0.1 -0.988 38.7-141.3-149.6 143.2 7.0 51.6 9.1 92 92 A A - 0 0 0 45,-0.5 2,-2.4 -2,-0.3 6,-0.1 0.474 41.0-163.5 -80.1 -6.1 3.7 49.7 8.8 93 93 A b - 0 0 32 -54,-0.1 2,-0.3 44,-0.1 -1,-0.2 -0.262 45.8 -22.2 63.8 -64.9 5.7 46.9 10.5 94 94 A S S > S- 0 0 41 -2,-2.4 4,-2.3 44,-0.1 5,-0.1 -0.966 70.6 -85.3-164.7 176.1 3.6 43.7 9.9 95 95 A A H > S+ 0 0 51 -2,-0.3 4,-1.2 1,-0.2 5,-0.1 0.883 126.4 47.6 -63.2 -37.8 0.1 42.4 9.0 96 96 A D H > S+ 0 0 128 1,-0.2 4,-2.1 2,-0.2 3,-0.3 0.934 111.9 47.5 -70.5 -45.0 -0.9 42.5 12.7 97 97 A Y H > S+ 0 0 9 1,-0.2 4,-3.2 2,-0.2 5,-0.3 0.856 104.6 62.1 -65.4 -32.6 0.4 46.0 13.3 98 98 A A H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.901 107.1 44.8 -59.5 -39.1 -1.3 47.2 10.2 99 99 A K H X S+ 0 0 75 -4,-1.2 4,-2.5 -3,-0.3 5,-0.2 0.938 112.6 51.3 -68.6 -46.0 -4.6 46.2 11.8 100 100 A D H X S+ 0 0 74 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.925 113.6 44.3 -55.5 -48.0 -3.6 47.8 15.1 101 101 A L H X S+ 0 0 2 -4,-3.2 4,-2.8 2,-0.2 -1,-0.2 0.891 110.9 53.1 -66.7 -40.3 -2.7 51.1 13.4 102 102 A A H X S+ 0 0 0 -4,-2.1 4,-2.2 -5,-0.3 -1,-0.2 0.923 111.9 46.5 -61.1 -43.1 -5.8 51.1 11.2 103 103 A E H X S+ 0 0 61 -4,-2.5 4,-2.9 2,-0.2 5,-0.3 0.918 111.1 52.5 -64.8 -42.9 -8.0 50.7 14.3 104 104 A Y H X S+ 0 0 15 -4,-2.3 4,-2.7 -5,-0.2 5,-0.3 0.930 109.6 48.3 -58.5 -47.9 -6.0 53.4 16.1 105 105 A L H X>S+ 0 0 0 -4,-2.8 4,-2.1 1,-0.2 5,-1.2 0.922 114.4 47.0 -61.2 -41.4 -6.6 55.9 13.2 106 106 A H H X5S+ 0 0 9 -4,-2.2 4,-0.8 3,-0.2 5,-0.5 0.950 116.2 41.9 -66.4 -49.7 -10.3 55.1 13.2 107 107 A T H <5S+ 0 0 26 -4,-2.9 7,-1.3 1,-0.2 6,-0.5 0.893 127.1 30.3 -64.6 -41.3 -10.8 55.4 17.0 108 108 A Y H <5S+ 0 0 29 -4,-2.7 10,-0.3 -5,-0.3 13,-0.3 0.604 134.6 18.6 -98.8 -15.2 -8.7 58.5 17.5 109 109 A F H <5S+ 0 0 0 -4,-2.1 14,-3.2 -5,-0.3 -3,-0.2 0.614 121.8 42.5-128.7 -20.6 -9.0 60.4 14.3 110 110 A L B < -N 119 0F 12 3,-2.2 3,-2.3 -2,-0.4 -7,-0.1 -0.549 51.0 -68.9-123.1-170.3 -6.8 61.8 20.4 117 117 A P T 3 S+ 0 0 13 0, 0.0 3,-0.1 0, 0.0 -8,-0.1 0.778 134.9 40.3 -51.7 -31.0 -3.8 63.9 19.6 118 118 A L T 3 S- 0 0 0 1,-0.4 2,-0.2 -10,-0.3 -49,-0.1 0.199 120.9-105.8-104.4 14.4 -6.0 66.4 17.7 119 119 A G B < -N 116 0F 0 -3,-2.3 -3,-2.2 -54,-0.1 2,-0.9 -0.644 69.0 -27.9 94.8-161.5 -8.9 66.4 20.2 120 120 A K S S+ 0 0 91 -5,-0.2 2,-0.3 -2,-0.2 -5,-0.1 -0.858 91.6 144.1 -93.8 99.6 -12.2 64.6 19.7 121 121 A V - 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0 0 9 -38,-3.0 -254,-1.4 -2,-0.4 2,-0.3 0.699 54.6 -86.2-107.3 -30.2 -9.5 66.3 -10.1 261 261 A G E -ai 6 223A 0 -39,-0.9 -37,-1.9 -256,-0.2 -1,-0.3 -0.999 46.6 -61.2 156.8-157.8 -7.1 69.2 -9.4 262 262 A I E -ai 7 224A 1 -256,-2.1 -254,-2.4 -2,-0.3 2,-0.4 -0.917 25.3-149.3-129.7 153.7 -3.7 70.1 -7.9 263 263 A A E -ai 8 225A 0 -39,-2.5 -37,-2.8 -2,-0.3 2,-0.5 -0.968 18.6-140.7-119.6 138.4 -2.1 69.8 -4.5 264 264 A L E -ai 9 226A 0 -256,-2.5 -254,-1.6 -2,-0.4 2,-0.7 -0.900 10.6-130.6-111.0 116.1 0.5 72.3 -3.4 265 265 A W E S+ i 0 227A 36 -39,-2.8 -37,-2.5 -2,-0.5 -36,-0.4 -0.909 82.2 6.5 -80.5 104.3 3.7 71.5 -1.4 266 266 A N > - 0 0 8 -2,-0.7 4,-2.2 -256,-0.3 -1,-0.2 0.798 48.1-145.2-134.5 174.3 3.4 73.7 1.1 267 267 A R H > S+ 0 0 22 -257,-2.2 4,-2.5 2,-0.2 5,-0.2 0.881 106.4 53.9 -52.8 -46.2 1.2 76.4 2.6 268 268 A Q H > S+ 0 0 51 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.946 110.4 46.3 -57.4 -49.8 4.2 78.6 3.6 269 269 A A H > S+ 0 0 2 1,-0.2 4,-1.7 2,-0.2 6,-0.3 0.887 111.7 51.7 -62.1 -37.5 5.5 78.6 -0.0 270 270 A D H X>S+ 0 0 2 -4,-2.2 4,-2.6 1,-0.2 5,-0.6 0.921 108.8 51.3 -64.8 -43.1 2.0 79.3 -1.4 271 271 A K H <5S+ 0 0 124 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.892 111.2 48.4 -59.8 -43.5 1.7 82.3 1.1 272 272 A E H <5S+ 0 0 124 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.794 123.2 29.2 -70.3 -32.3 5.1 83.7 -0.1 273 273 A T H <5S- 0 0 58 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.605 93.2-127.2-107.1 -16.1 4.5 83.5 -3.8 274 274 A G T X5 + 0 0 20 -4,-2.6 4,-2.4 -5,-0.2 5,-0.2 0.731 53.0 153.1 73.7 26.0 0.7 83.8 -4.3 275 275 A Y H >< + 0 0 1 -5,-0.6 4,-2.2 -6,-0.3 5,-0.2 0.933 69.2 37.7 -54.8 -60.9 0.6 80.6 -6.3 276 276 A S H > S+ 0 0 1 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.863 113.4 58.8 -64.1 -33.1 -3.0 79.4 -5.7 277 277 A T H > S+ 0 0 82 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.933 109.8 43.0 -60.4 -44.4 -4.3 83.1 -5.8 278 278 A N H X S+ 0 0 61 -4,-2.4 4,-1.4 2,-0.2 -1,-0.2 0.873 113.3 51.7 -70.1 -36.4 -2.9 83.5 -9.3 279 279 A I H >X S+ 0 0 2 -4,-2.2 4,-0.6 -5,-0.2 3,-0.6 0.959 109.9 49.7 -63.3 -48.0 -4.2 80.0 -10.4 280 280 A I H >< S+ 0 0 69 -4,-3.0 3,-1.0 1,-0.3 -1,-0.2 0.874 105.5 57.3 -58.7 -39.4 -7.7 80.8 -9.1 281 281 A R H 3< S+ 0 0 176 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.866 111.6 43.1 -60.3 -36.2 -7.7 84.1 -11.0 282 282 A Y H << 0 0 127 -4,-1.4 -1,-0.2 -3,-0.6 -2,-0.2 0.376 360.0 360.0 -92.5 1.3 -7.1 82.2 -14.2 283 283 A L << 0 0 69 -3,-1.0 -2,-0.2 -4,-0.6 -1,-0.1 0.886 360.0 360.0 -84.6 360.0 -9.5 79.3 -13.7