==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 27-NOV-12 4I47 . COMPND 2 MOLECULE: RRNA N-GLYCOSIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MOMORDICA BALSAMINA; . AUTHOR S.YAMINI,G.S.KUSHWAHA,A.BHUSHAN,M.SINHA,P.KAUR,S.SHARMA,T.P. . 246 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11504.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 168 68.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 4.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 35 14.2 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 . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.8 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 . 15 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 72 29.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 2.0 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 1 0 1 1 0 1 0 0 2 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 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 0 0 PARALLEL BRIDGES PER LADDER . 2 1 0 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 ANTIPARALLEL BRIDGES PER LADDER . 2 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 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 0 130 0, 0.0 2,-0.4 0, 0.0 49,-0.2 0.000 360.0 360.0 360.0 156.0 25.7 10.5 28.3 2 2 A V E -a 50 0A 12 47,-1.6 49,-2.5 2,-0.0 2,-0.3 -0.931 360.0-163.7-118.6 142.4 23.2 12.9 26.9 3 3 A S E -a 51 0A 59 -2,-0.4 2,-0.4 47,-0.2 49,-0.2 -0.955 10.4-176.7-128.9 146.4 19.5 13.2 27.9 4 4 A F E -a 52 0A 8 47,-2.0 49,-2.4 -2,-0.3 2,-0.5 -0.991 8.9-160.4-141.8 129.2 16.3 14.7 26.5 5 5 A R E -a 53 0A 154 -2,-0.4 49,-0.2 47,-0.2 50,-0.1 -0.952 7.7-160.6-113.2 117.8 12.9 14.8 28.0 6 6 A L S > S+ 0 0 16 47,-2.8 3,-1.5 -2,-0.5 2,-0.6 0.720 70.9 94.9 -67.0 -22.8 9.9 15.4 25.7 7 7 A S T 3 S+ 0 0 67 46,-0.3 3,-0.1 47,-0.3 -2,-0.1 -0.626 105.5 1.5 -74.1 115.9 7.8 16.4 28.7 8 8 A G T 3 S+ 0 0 73 -2,-0.6 -1,-0.3 1,-0.3 2,-0.2 0.538 97.3 152.2 84.2 6.6 8.1 20.2 28.9 9 9 A A < + 0 0 13 -3,-1.5 -1,-0.3 4,-0.1 -3,-0.1 -0.467 15.4 170.5 -72.2 138.2 10.2 20.3 25.9 10 10 A D > - 0 0 62 -2,-0.2 4,-1.9 -3,-0.1 3,-0.2 -0.788 54.3 -82.5-134.1 178.4 10.1 23.5 23.8 11 11 A P H > S+ 0 0 45 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.864 127.0 54.1 -53.2 -37.2 12.3 24.6 20.8 12 12 A S H > S+ 0 0 76 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.884 107.2 45.9 -66.7 -44.9 14.9 25.9 23.3 13 13 A S H > S+ 0 0 29 -3,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.857 111.7 53.0 -70.1 -33.6 15.4 22.7 25.3 14 14 A Y H X S+ 0 0 0 -4,-1.9 4,-2.5 2,-0.2 5,-0.3 0.949 107.0 52.7 -62.9 -47.5 15.6 20.7 22.1 15 15 A G H X S+ 0 0 12 -4,-2.0 4,-1.8 1,-0.2 -2,-0.2 0.888 109.6 49.4 -54.1 -40.5 18.3 23.1 20.8 16 16 A M H X S+ 0 0 106 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.867 109.3 50.9 -68.8 -36.5 20.3 22.5 24.1 17 17 A F H X S+ 0 0 6 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.899 111.8 47.3 -67.0 -41.8 20.0 18.7 23.8 18 18 A I H X S+ 0 0 0 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.826 111.4 50.8 -69.7 -31.9 21.3 18.8 20.2 19 19 A K H X S+ 0 0 131 -4,-1.8 4,-2.4 -5,-0.3 -2,-0.2 0.916 110.6 49.8 -68.0 -44.0 24.1 21.1 21.2 20 20 A D H X S+ 0 0 83 -4,-2.2 4,-1.0 1,-0.2 -2,-0.2 0.897 108.8 52.7 -59.7 -44.5 24.9 18.6 24.0 21 21 A L H X S+ 0 0 2 -4,-2.3 4,-0.6 2,-0.2 3,-0.5 0.905 109.2 49.0 -59.2 -44.8 24.9 15.8 21.5 22 22 A R H >< S+ 0 0 33 -4,-1.9 3,-1.4 1,-0.2 -2,-0.2 0.939 111.3 49.1 -61.3 -46.7 27.3 17.6 19.3 23 23 A N H 3< S+ 0 0 120 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.636 100.0 66.7 -69.8 -13.6 29.7 18.3 22.2 24 24 A A H 3< S+ 0 0 34 -4,-1.0 -1,-0.3 -3,-0.5 -2,-0.2 0.690 84.7 88.1 -79.5 -17.4 29.5 14.7 23.2 25 25 A L S << S- 0 0 8 -3,-1.4 42,-0.1 -4,-0.6 2,-0.0 -0.705 77.8-132.1 -87.0 122.8 31.3 13.7 20.1 26 26 A P + 0 0 54 0, 0.0 12,-0.7 0, 0.0 2,-0.3 -0.335 32.2 161.0 -73.3 155.9 35.2 13.7 20.2 27 27 A H - 0 0 77 10,-0.2 10,-0.1 1,-0.1 3,-0.1 -0.926 29.2-160.2-167.8 145.4 37.4 15.3 17.7 28 28 A T S S+ 0 0 130 8,-0.4 2,-0.3 -2,-0.3 9,-0.1 0.747 78.0 32.3-102.4 -31.6 41.0 16.5 17.7 29 29 A E - 0 0 103 7,-0.4 7,-2.5 5,-0.0 2,-0.4 -0.894 62.4-142.8-130.4 157.2 40.9 18.9 14.7 30 30 A K E -F 35 0B 118 -2,-0.3 2,-0.5 5,-0.2 -3,-0.0 -0.894 13.9-150.6-111.5 143.0 38.5 21.2 13.0 31 31 A V E > S-F 34 0B 1 3,-2.5 3,-1.8 -2,-0.4 169,-0.0 -0.963 82.9 -17.2-120.0 114.4 38.5 21.6 9.2 32 32 A Y T 3 S- 0 0 88 -2,-0.5 -1,-0.2 1,-0.3 168,-0.0 0.827 131.9 -54.1 59.1 30.4 37.5 25.0 7.9 33 33 A N T 3 S+ 0 0 133 1,-0.2 -1,-0.3 0, 0.0 -3,-0.0 0.356 115.2 114.4 86.4 -0.5 36.0 25.5 11.4 34 34 A I E < S-F 31 0B 11 -3,-1.8 -3,-2.5 1,-0.0 -1,-0.2 -0.874 74.7-105.6-105.5 129.6 33.9 22.3 11.5 35 35 A P E -F 30 0B 29 0, 0.0 205,-1.8 0, 0.0 2,-0.6 -0.213 30.2-143.8 -51.7 125.6 34.7 19.4 13.9 36 36 A L B -g 240 0C 12 -7,-2.5 -7,-0.4 203,-0.2 -8,-0.4 -0.841 19.1-126.4 -94.3 124.2 36.2 16.5 12.0 37 37 A L - 0 0 2 203,-3.0 -10,-0.2 -2,-0.6 30,-0.1 -0.393 31.9 -94.4 -70.4 146.4 35.0 13.2 13.5 38 38 A L - 0 0 36 -12,-0.7 204,-0.3 28,-0.3 3,-0.1 -0.161 23.1-129.9 -58.5 148.9 37.6 10.6 14.5 39 39 A P S S- 0 0 45 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.925 83.2 -22.9 -65.8 -45.0 38.7 7.9 12.1 40 40 A S - 0 0 82 26,-0.0 2,-0.3 2,-0.0 205,-0.0 -0.973 59.3-149.1-160.5 161.7 38.1 5.1 14.6 41 41 A V - 0 0 34 -2,-0.3 2,-0.4 -3,-0.1 5,-0.1 -0.997 22.2-115.3-141.2 144.9 37.9 4.6 18.4 42 42 A S > - 0 0 115 -2,-0.3 3,-1.0 3,-0.1 -2,-0.0 -0.648 61.5 -37.1 -90.2 132.6 38.8 1.7 20.7 43 43 A G G > S- 0 0 28 -2,-0.4 3,-1.5 1,-0.2 51,-0.1 -0.238 114.9 -12.8 68.6-148.2 36.4 -0.3 22.8 44 44 A A G > S+ 0 0 57 1,-0.3 3,-1.3 2,-0.2 -1,-0.2 0.575 120.2 78.2 -66.8 -12.4 33.4 1.0 24.7 45 45 A G G < S+ 0 0 55 -3,-1.0 -1,-0.3 1,-0.2 -2,-0.2 0.543 79.8 71.8 -75.8 -3.6 34.6 4.6 24.2 46 46 A R G < S+ 0 0 53 -3,-1.5 20,-2.5 -5,-0.1 2,-0.4 0.561 89.8 71.6 -86.0 -9.8 33.3 4.4 20.6 47 47 A Y E < - B 0 65A 21 -3,-1.3 2,-0.4 18,-0.2 18,-0.2 -0.914 60.8-159.5-119.1 136.3 29.6 4.5 21.7 48 48 A L E - B 0 64A 16 16,-3.2 16,-3.2 -2,-0.4 2,-0.5 -0.884 16.8-140.2-106.0 137.4 27.6 7.3 23.2 49 49 A L E - B 0 63A 39 -2,-0.4 -47,-1.6 14,-0.2 2,-0.5 -0.888 11.7-162.5-106.1 124.9 24.4 6.6 25.1 50 50 A M E -aB 2 62A 1 12,-2.9 12,-2.9 -2,-0.5 2,-0.7 -0.913 4.9-156.4-104.7 122.8 21.3 8.7 24.7 51 51 A H E -aB 3 61A 44 -49,-2.5 -47,-2.0 -2,-0.5 2,-0.5 -0.887 16.5-172.3 -99.5 116.6 18.6 8.5 27.3 52 52 A L E -aB 4 60A 0 8,-2.6 8,-1.7 -2,-0.7 2,-0.5 -0.940 6.6-164.7-114.4 130.5 15.3 9.6 25.7 53 53 A F E -aB 5 59A 37 -49,-2.4 -47,-2.8 -2,-0.5 -46,-0.3 -0.956 9.9-145.2-116.6 125.5 12.1 10.1 27.8 54 54 A N > - 0 0 2 4,-2.2 3,-2.8 -2,-0.5 -47,-0.3 -0.291 43.2 -84.3 -79.6 171.6 8.7 10.4 26.2 55 55 A Y T 3 S+ 0 0 144 1,-0.3 -1,-0.1 -49,-0.2 -2,-0.0 0.805 129.0 51.0 -44.9 -41.4 6.0 12.6 27.5 56 56 A D T 3 S- 0 0 126 1,-0.1 -1,-0.3 2,-0.0 -2,-0.0 0.472 120.5-104.7 -79.9 -1.9 4.8 10.1 30.2 57 57 A G S < S+ 0 0 41 -3,-2.8 -2,-0.1 1,-0.3 -1,-0.1 0.381 73.5 138.6 97.3 -6.3 8.3 9.6 31.4 58 58 A N - 0 0 87 -5,-0.1 -4,-2.2 1,-0.0 2,-0.3 -0.370 36.7-154.2 -69.0 154.9 9.1 6.2 29.9 59 59 A T E -B 53 0A 51 -6,-0.2 18,-0.5 -2,-0.0 2,-0.3 -0.954 25.4-171.2-141.0 155.8 12.6 5.8 28.5 60 60 A I E -BC 52 76A 0 -8,-1.7 -8,-2.6 -2,-0.3 2,-0.5 -0.970 22.1-137.8-134.8 145.0 14.8 4.0 26.0 61 61 A T E -BC 51 75A 17 14,-1.7 14,-2.4 -2,-0.3 2,-0.5 -0.947 18.5-156.9-109.2 123.5 18.6 4.3 25.8 62 62 A V E -BC 50 74A 0 -12,-2.9 -12,-2.9 -2,-0.5 2,-0.6 -0.864 7.0-142.7-105.2 131.0 20.1 4.6 22.3 63 63 A A E -BC 49 73A 0 10,-2.2 9,-2.9 -2,-0.5 10,-0.8 -0.817 19.6-170.3 -96.1 120.0 23.6 3.7 21.5 64 64 A V E -BC 48 71A 4 -16,-3.2 -16,-3.2 -2,-0.6 2,-0.8 -0.908 24.2-126.0-113.0 136.2 25.3 5.9 18.9 65 65 A D E >>> -BC 47 70A 3 5,-3.0 4,-3.4 -2,-0.4 3,-1.8 -0.703 18.4-151.0 -79.8 111.4 28.6 5.3 17.2 66 66 A V T 345S+ 0 0 6 -20,-2.5 -28,-0.3 -2,-0.8 -1,-0.1 0.526 88.6 62.3 -64.4 -5.3 30.8 8.4 17.9 67 67 A T T 345S+ 0 0 0 -21,-0.4 175,-0.5 -30,-0.1 -1,-0.3 0.589 129.0 4.7 -94.1 -9.7 32.8 8.2 14.7 68 68 A N T <45S- 0 0 22 -3,-1.8 -2,-0.2 2,-0.1 3,-0.1 0.481 92.5-118.0-142.5 -19.6 29.8 8.6 12.4 69 69 A V T <5 + 0 0 1 -4,-3.4 2,-0.3 1,-0.3 -3,-0.2 0.716 59.1 154.2 76.1 23.8 26.7 9.3 14.6 70 70 A Y E < -C 65 0A 105 -5,-0.6 -5,-3.0 89,-0.1 2,-0.4 -0.602 46.5-123.7 -83.1 143.9 25.0 6.1 13.4 71 71 A I E -C 64 0A 10 -2,-0.3 -7,-0.2 -7,-0.2 3,-0.1 -0.726 27.4-177.6 -85.3 135.6 22.5 4.6 15.7 72 72 A M E - 0 0 2 -9,-2.9 11,-2.1 1,-0.5 2,-0.3 0.720 55.4 -52.6-106.0 -30.6 23.5 0.9 16.4 73 73 A G E -CD 63 82A 1 -10,-0.8 -10,-2.2 9,-0.2 -1,-0.5 -0.949 51.9-132.7 173.8-173.8 20.6 -0.3 18.6 74 74 A Y E -CD 62 81A 3 7,-2.4 7,-3.3 -2,-0.3 2,-0.4 -0.973 12.9-116.2-158.7 170.0 18.8 0.6 21.8 75 75 A L E -CD 61 80A 37 -14,-2.4 -14,-1.7 -2,-0.3 2,-0.5 -0.959 16.7-174.0-121.4 128.8 17.4 -0.7 25.1 76 76 A A E > -CD 60 79A 4 3,-2.4 3,-2.2 -2,-0.4 2,-0.3 -0.957 69.7 -55.3-122.6 108.3 13.8 -0.9 26.2 77 77 A L T 3 S- 0 0 150 -18,-0.5 63,-0.0 -2,-0.5 0, 0.0 -0.442 123.5 -18.2 56.5-114.1 13.4 -2.0 29.8 78 78 A T T 3 S+ 0 0 43 -2,-0.3 23,-1.4 21,-0.1 22,-1.4 0.232 118.0 87.1-110.6 14.6 15.4 -5.2 29.7 79 79 A T E < -De 76 101A 13 -3,-2.2 -3,-2.4 21,-0.2 2,-0.4 -0.950 60.7-151.8-114.5 132.5 15.5 -6.1 26.0 80 80 A S E -De 75 102A 2 21,-2.3 23,-3.3 -2,-0.5 2,-0.4 -0.810 8.0-158.4 -99.8 145.3 18.3 -4.7 23.8 81 81 A Y E -De 74 103A 8 -7,-3.3 -7,-2.4 -2,-0.4 2,-0.3 -0.991 11.9-179.9-125.2 128.5 17.6 -4.2 20.1 82 82 A F E -De 73 104A 4 21,-2.3 23,-2.7 -2,-0.4 -9,-0.2 -0.939 30.4-107.2-127.3 150.0 20.4 -4.1 17.5 83 83 A F - 0 0 6 -11,-2.1 2,-1.6 -2,-0.3 25,-0.2 -0.299 37.5-107.4 -68.2 157.8 20.4 -3.6 13.8 84 84 A N S S+ 0 0 85 23,-2.5 -1,-0.1 20,-0.1 3,-0.1 -0.644 83.3 96.6 -89.7 82.4 21.1 -6.5 11.6 85 85 A E S > S- 0 0 48 -2,-1.6 4,-2.4 1,-0.1 3,-0.3 -0.953 82.5-104.0-164.3 150.1 24.6 -5.5 10.4 86 86 A P H > S+ 0 0 115 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.856 116.4 48.8 -41.6 -57.7 28.3 -6.1 11.4 87 87 A A H > S+ 0 0 44 1,-0.2 4,-2.6 2,-0.2 5,-0.1 0.909 112.2 49.7 -55.0 -45.8 28.9 -2.8 13.2 88 88 A A H > S+ 0 0 0 -3,-0.3 4,-1.4 1,-0.2 -1,-0.2 0.919 111.4 49.2 -59.4 -44.9 25.8 -3.1 15.2 89 89 A D H < S+ 0 0 81 -4,-2.4 4,-0.4 2,-0.2 3,-0.3 0.899 109.8 51.1 -62.1 -40.8 26.8 -6.7 16.1 90 90 A L H >< S+ 0 0 79 -4,-2.8 3,-1.4 1,-0.2 -2,-0.2 0.927 108.1 54.6 -60.9 -42.1 30.3 -5.4 17.1 91 91 A A H >X S+ 0 0 0 -4,-2.6 3,-1.9 1,-0.3 4,-1.5 0.793 91.7 71.0 -62.8 -30.9 28.5 -2.8 19.3 92 92 A S T 3< S+ 0 0 19 -4,-1.4 -1,-0.3 -3,-0.3 -2,-0.2 0.686 89.0 66.1 -61.4 -17.9 26.5 -5.4 21.2 93 93 A Q T <4 S+ 0 0 103 -3,-1.4 -1,-0.3 -4,-0.4 -2,-0.2 0.558 110.5 30.7 -81.7 -8.9 29.7 -6.5 22.9 94 94 A Y T <4 S+ 0 0 102 -3,-1.9 2,-0.3 1,-0.2 3,-0.2 0.586 114.8 52.1-122.5 -21.3 30.2 -3.2 24.8 95 95 A V S < S+ 0 0 12 -4,-1.5 -1,-0.2 1,-0.2 -32,-0.0 -0.908 106.0 10.4-124.4 154.1 26.7 -1.8 25.5 96 96 A F S > S+ 0 0 22 -2,-0.3 3,-0.9 1,-0.1 -1,-0.2 0.847 72.2 146.7 54.8 40.5 23.5 -3.1 27.0 97 97 A R T 3 + 0 0 187 1,-0.2 -1,-0.1 -3,-0.2 -2,-0.1 0.777 63.4 60.7 -76.4 -25.7 25.3 -6.2 28.3 98 98 A S T 3 S+ 0 0 121 3,-0.0 -1,-0.2 2,-0.0 2,-0.1 0.347 79.7 119.6 -82.6 6.6 23.1 -6.4 31.4 99 99 A A < - 0 0 21 -3,-0.9 -20,-0.2 1,-0.1 3,-0.1 -0.449 66.2-135.2 -71.8 143.8 20.0 -6.9 29.3 100 100 A R S S+ 0 0 210 -22,-1.4 2,-0.3 1,-0.2 -21,-0.2 0.914 85.2 10.4 -69.2 -43.4 18.1 -10.1 29.7 101 101 A R E -e 79 0A 156 -23,-1.4 -21,-2.3 2,-0.0 2,-0.5 -0.996 65.3-148.8-139.1 144.7 17.6 -10.8 26.0 102 102 A K E -e 80 0A 91 -2,-0.3 2,-0.4 -23,-0.2 -21,-0.2 -0.955 13.4-162.3-113.4 127.0 19.0 -9.2 22.9 103 103 A I E -e 81 0A 30 -23,-3.3 -21,-2.3 -2,-0.5 2,-0.6 -0.906 10.2-145.0-112.0 135.8 17.0 -9.1 19.7 104 104 A T E -e 82 0A 61 -2,-0.4 -21,-0.2 -23,-0.2 -20,-0.1 -0.887 23.1-129.1 -99.4 121.6 18.4 -8.5 16.2 105 105 A L - 0 0 1 -23,-2.7 2,-0.1 -2,-0.6 -21,-0.1 -0.368 22.5-114.3 -65.4 146.3 16.0 -6.5 14.0 106 106 A P S S+ 0 0 70 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.167 93.2 44.6 -72.3 22.8 15.3 -8.0 10.6 107 107 A Y S S- 0 0 7 -2,-0.1 -23,-2.5 -22,-0.0 -2,-0.1 -0.983 81.9-109.5-157.8 158.8 17.1 -5.2 8.7 108 108 A S - 0 0 13 -2,-0.3 -23,-0.1 -25,-0.2 -26,-0.0 -0.391 41.2-103.9 -84.1 171.0 20.2 -3.1 8.8 109 109 A G S S+ 0 0 17 -2,-0.1 2,-0.3 -38,-0.1 -38,-0.2 0.210 76.0 115.4 -87.8 18.7 20.0 0.6 9.7 110 110 A N S >> S- 0 0 76 1,-0.1 4,-2.1 4,-0.0 3,-0.5 -0.670 73.8-115.3 -90.9 144.5 20.4 2.4 6.4 111 111 A Y H 3> S+ 0 0 34 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.810 111.8 56.7 -38.4 -49.3 17.5 4.5 5.0 112 112 A E H 3> S+ 0 0 131 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.958 112.8 39.8 -54.0 -54.2 17.0 2.3 2.0 113 113 A R H <> S+ 0 0 101 -3,-0.5 4,-1.9 1,-0.2 -1,-0.2 0.839 115.1 51.9 -66.3 -33.7 16.4 -0.8 4.1 114 114 A L H X S+ 0 0 0 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.851 107.4 52.9 -70.9 -33.8 14.4 1.0 6.8 115 115 A Q H X>S+ 0 0 24 -4,-2.6 4,-0.8 -5,-0.3 5,-0.7 0.795 108.6 50.8 -71.0 -29.8 12.0 2.5 4.2 116 116 A I H ><5S+ 0 0 133 -4,-1.3 3,-0.8 -5,-0.2 -2,-0.2 0.958 112.5 44.3 -70.5 -52.5 11.3 -0.9 2.7 117 117 A A H 3<5S+ 0 0 29 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.789 113.6 52.3 -62.6 -28.8 10.5 -2.5 6.1 118 118 A A H 3<5S- 0 0 19 -4,-1.6 -1,-0.2 2,-0.2 -2,-0.2 0.678 105.0-129.9 -81.9 -20.0 8.4 0.5 7.1 119 119 A G T <<5S+ 0 0 68 -3,-0.8 -3,-0.2 -4,-0.8 -4,-0.1 0.457 78.5 69.9 84.1 1.5 6.3 0.4 3.9 120 120 A K S - 0 0 59 0, 0.0 3,-1.7 0, 0.0 4,-0.2 -0.514 37.8-111.8 -77.7 154.1 9.7 6.5 2.0 122 122 A R G > S+ 0 0 10 1,-0.3 3,-0.6 2,-0.2 64,-0.0 0.572 109.8 79.3 -65.7 -5.2 10.6 9.2 4.6 123 123 A E G 3 S+ 0 0 97 1,-0.2 -1,-0.3 57,-0.1 63,-0.0 0.871 101.4 39.7 -64.6 -34.5 9.2 11.8 2.2 124 124 A K G < S+ 0 0 147 -3,-1.7 -1,-0.2 56,-0.1 -2,-0.2 0.321 93.7 94.5 -98.8 5.2 5.8 10.8 3.6 125 125 A I S < S- 0 0 15 -3,-0.6 2,-0.2 -4,-0.2 54,-0.1 -0.885 73.1-130.0-101.6 123.1 6.6 10.2 7.2 126 126 A P - 0 0 59 0, 0.0 2,-0.3 0, 0.0 54,-0.3 -0.460 26.9-167.9 -70.0 137.7 5.9 13.2 9.5 127 127 A I B +H 179 0D 1 52,-2.0 52,-2.2 -2,-0.2 2,-0.3 -0.828 28.9 99.9-124.1 164.9 8.6 14.3 11.9 128 128 A G S > S- 0 0 0 -2,-0.3 4,-0.9 50,-0.2 47,-0.2 -0.934 82.2 -63.3 152.8-168.8 8.9 16.7 14.8 129 129 A L H > S+ 0 0 5 45,-1.8 4,-2.1 42,-0.4 46,-0.2 0.829 130.3 55.1 -80.3 -33.7 8.9 16.4 18.6 130 130 A P H > S+ 0 0 44 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.973 110.2 48.4 -61.5 -43.6 5.4 15.0 18.8 131 131 A A H > S+ 0 0 9 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.775 106.0 56.7 -62.5 -30.5 6.6 12.3 16.4 132 132 A L H X S+ 0 0 0 -4,-0.9 4,-2.7 2,-0.2 -1,-0.2 0.942 104.7 52.8 -66.9 -43.4 9.7 11.7 18.6 133 133 A D H X S+ 0 0 40 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.892 111.8 45.5 -55.7 -44.1 7.4 11.1 21.5 134 134 A T H X S+ 0 0 81 -4,-1.7 4,-2.7 2,-0.2 -1,-0.2 0.897 109.9 55.3 -63.7 -44.8 5.4 8.5 19.4 135 135 A A H X S+ 0 0 2 -4,-2.4 4,-1.6 2,-0.2 -2,-0.2 0.931 109.0 45.9 -54.2 -52.6 8.7 6.9 18.2 136 136 A I H >X S+ 0 0 0 -4,-2.7 4,-1.2 1,-0.2 3,-0.6 0.945 112.8 51.8 -57.3 -50.5 9.9 6.3 21.7 137 137 A S H 3< S+ 0 0 46 -4,-2.0 4,-0.5 1,-0.2 3,-0.3 0.862 109.8 49.4 -52.0 -44.9 6.5 4.9 22.7 138 138 A T H 3< S+ 0 0 43 -4,-2.7 3,-0.4 1,-0.2 -1,-0.2 0.758 107.6 53.1 -68.6 -29.7 6.5 2.5 19.7 139 139 A L H << S+ 0 0 1 -4,-1.6 -1,-0.2 -3,-0.6 -2,-0.2 0.693 92.2 73.4 -82.7 -18.6 10.0 1.2 20.5 140 140 A L S < S+ 0 0 32 -4,-1.2 2,-0.5 -3,-0.3 -1,-0.2 0.812 104.2 40.8 -64.0 -29.2 9.1 0.4 24.1 141 141 A H S S- 0 0 148 -4,-0.5 -1,-0.2 -3,-0.4 6,-0.0 -0.960 100.6-110.0-127.8 114.5 7.1 -2.6 22.8 142 142 A Y + 0 0 103 -2,-0.5 2,-0.1 -3,-0.1 -3,-0.1 0.025 52.0 140.9 -44.7 139.4 8.5 -4.7 19.9 143 143 A D > - 0 0 83 -4,-0.1 4,-3.2 2,-0.0 5,-0.2 -0.475 35.4-153.5 179.3 96.8 7.0 -4.6 16.4 144 144 A S H > S+ 0 0 32 1,-0.2 4,-1.2 2,-0.2 5,-0.1 0.784 96.6 48.6 -54.2 -31.9 9.6 -4.7 13.6 145 145 A T H > S+ 0 0 84 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.906 115.8 42.2 -75.9 -40.5 7.3 -2.9 11.1 146 146 A A H > S+ 0 0 33 -3,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.851 111.6 56.5 -71.4 -37.0 6.4 -0.2 13.6 147 147 A A H X S+ 0 0 2 -4,-3.2 4,-2.6 2,-0.2 5,-0.2 0.839 100.4 58.0 -63.9 -37.7 10.1 0.1 14.8 148 148 A A H X S+ 0 0 0 -4,-1.2 4,-1.7 -5,-0.2 -1,-0.2 0.958 110.5 43.4 -56.9 -52.0 11.3 0.8 11.2 149 149 A G H X S+ 0 0 18 -4,-1.2 4,-1.3 1,-0.2 -2,-0.2 0.914 114.8 48.7 -60.5 -45.1 9.0 3.8 11.0 150 150 A A H X S+ 0 0 7 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.833 109.9 52.6 -64.5 -34.7 9.9 5.0 14.5 151 151 A L H X S+ 0 0 0 -4,-2.6 4,-2.9 2,-0.2 5,-0.2 0.821 103.3 56.5 -73.3 -30.4 13.6 4.6 13.8 152 152 A L H X S+ 0 0 0 -4,-1.7 4,-1.1 -5,-0.2 -1,-0.2 0.885 112.3 43.3 -67.4 -34.4 13.3 6.7 10.7 153 153 A V H X S+ 0 0 9 -4,-1.3 4,-2.3 2,-0.2 -2,-0.2 0.898 115.2 48.8 -74.3 -41.6 11.9 9.5 12.9 154 154 A L H X S+ 0 0 0 -4,-2.4 4,-0.7 1,-0.2 5,-0.4 0.913 109.1 51.5 -64.4 -46.6 14.4 8.9 15.7 155 155 A I H <>S+ 0 0 16 -4,-2.9 5,-2.0 1,-0.2 6,-0.3 0.856 115.6 42.8 -59.5 -37.4 17.5 9.0 13.4 156 156 A Q H <5S+ 0 0 1 -4,-1.1 5,-0.5 -5,-0.2 -2,-0.2 0.858 110.3 51.7 -80.3 -37.8 16.3 12.2 11.8 157 157 A T H <5S+ 0 0 0 -4,-2.3 -1,-0.2 3,-0.1 -2,-0.2 0.479 129.5 18.0 -78.8 -2.5 15.2 14.1 14.9 158 158 A T T X5S+ 0 0 1 -4,-0.7 4,-2.1 -3,-0.2 3,-0.3 0.490 129.3 32.0-126.4 -82.2 18.6 13.4 16.5 159 159 A A H >5S+ 0 0 4 -5,-0.4 4,-1.7 1,-0.2 -3,-0.2 0.899 123.6 44.8 -48.9 -54.4 21.6 12.3 14.3 160 160 A E H > S+ 0 0 63 71,-3.4 4,-2.3 -2,-0.4 3,-0.3 0.916 99.6 58.3 -53.9 -45.3 21.8 23.3 11.7 166 166 A Y H > S+ 0 0 45 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.900 105.4 47.3 -52.9 -47.6 19.1 23.5 9.1 167 167 A I H > S+ 0 0 0 -7,-0.3 4,-1.6 1,-0.2 -1,-0.2 0.814 109.4 53.5 -69.2 -28.6 17.6 20.2 10.1 168 168 A E H X S+ 0 0 12 -4,-1.7 4,-1.5 -7,-0.4 -1,-0.2 0.893 110.5 48.8 -68.8 -38.6 17.7 21.2 13.8 169 169 A Q H X S+ 0 0 79 -4,-2.3 4,-1.4 2,-0.2 -2,-0.2 0.868 106.6 55.7 -67.1 -39.2 15.8 24.3 12.8 170 170 A Q H X S+ 0 0 15 -4,-2.2 4,-0.7 1,-0.2 -1,-0.2 0.877 108.8 48.3 -60.0 -39.9 13.3 22.3 10.9 171 171 A I H < S+ 0 0 0 -4,-1.6 -42,-0.4 1,-0.2 -1,-0.2 0.806 105.3 56.5 -73.8 -30.1 12.5 20.3 14.0 172 172 A Q H >< S+ 0 0 49 -4,-1.5 3,-1.1 1,-0.2 -1,-0.2 0.832 105.0 53.0 -70.5 -29.8 12.2 23.3 16.2 173 173 A E H 3< S+ 0 0 139 -4,-1.4 3,-0.3 1,-0.3 -1,-0.2 0.731 109.8 50.7 -71.5 -23.9 9.4 24.5 13.8 174 174 A R T 3< S+ 0 0 9 -4,-0.7 -45,-1.8 1,-0.2 -1,-0.3 -0.023 73.7 119.0-103.4 28.8 7.8 21.1 14.4 175 175 A A S < S+ 0 0 7 -3,-1.1 -1,-0.2 1,-0.2 -2,-0.1 0.739 92.2 16.3 -67.7 -24.8 7.9 21.3 18.2 176 176 A Y S S+ 0 0 169 -3,-0.3 2,-0.3 1,-0.3 -1,-0.2 0.259 131.3 44.9-131.0 8.9 4.1 21.1 18.6 177 177 A R S S- 0 0 170 -3,-0.1 -1,-0.3 -50,-0.1 -48,-0.1 -0.901 73.2-135.2-158.1 125.1 3.2 19.9 15.2 178 178 A D + 0 0 54 -2,-0.3 2,-0.3 -50,-0.1 -50,-0.2 -0.425 25.4 173.8 -79.3 153.7 4.6 17.1 12.9 179 179 A E B -H 127 0D 92 -52,-2.2 -52,-2.0 -2,-0.1 3,-0.1 -0.956 37.1-102.4-158.8 139.4 5.2 17.7 9.3 180 180 A V - 0 0 58 -2,-0.3 -57,-0.1 -54,-0.3 -56,-0.1 -0.241 54.4 -92.5 -59.6 155.3 6.9 15.6 6.6 181 181 A P - 0 0 10 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.401 34.6-114.2 -73.4 149.6 10.4 16.8 5.8 182 182 A S > - 0 0 35 1,-0.1 4,-1.8 -2,-0.1 3,-0.5 -0.411 29.4-112.0 -74.4 155.5 11.2 19.3 3.0 183 183 A S H > S+ 0 0 74 1,-0.2 4,-2.3 2,-0.2 33,-0.2 0.710 118.2 63.5 -65.4 -16.5 13.2 17.9 0.0 184 184 A A H > S+ 0 0 6 2,-0.2 4,-2.7 34,-0.2 -1,-0.2 0.945 103.9 47.8 -68.0 -46.6 16.0 20.2 1.1 185 185 A T H > S+ 0 0 1 -3,-0.5 4,-2.7 2,-0.2 -2,-0.2 0.916 112.4 46.9 -57.6 -49.5 16.2 18.1 4.3 186 186 A I H X S+ 0 0 12 -4,-1.8 4,-2.1 1,-0.2 -1,-0.2 0.938 112.5 52.1 -59.4 -46.4 16.1 14.8 2.5 187 187 A S H X S+ 0 0 18 -4,-2.3 4,-1.0 2,-0.2 -2,-0.2 0.900 111.0 45.7 -55.7 -48.5 18.8 16.1 0.1 188 188 A L H >X S+ 0 0 8 -4,-2.7 3,-1.6 2,-0.2 4,-1.1 0.958 109.0 55.7 -61.1 -52.6 21.1 17.2 3.0 189 189 A E H 3< S+ 0 0 10 -4,-2.7 3,-0.5 1,-0.3 4,-0.2 0.876 110.4 47.0 -46.3 -43.0 20.6 13.9 4.8 190 190 A N H 3< S+ 0 0 98 -4,-2.1 4,-0.3 1,-0.2 -1,-0.3 0.670 112.4 48.7 -76.1 -18.3 21.7 12.1 1.6 191 191 A S H S+ 0 0 44 -4,-0.2 4,-2.2 -3,-0.2 -1,-0.2 0.960 114.6 44.4 -66.0 -55.5 29.0 11.8 3.2 194 194 A G H > S+ 0 0 34 -4,-0.3 4,-2.8 1,-0.2 5,-0.2 0.930 116.1 46.4 -56.2 -51.5 29.8 13.6 -0.1 195 195 A L H X S+ 0 0 0 -4,-3.0 4,-2.6 1,-0.2 5,-0.3 0.912 110.4 54.5 -57.4 -45.7 30.0 17.1 1.5 196 196 A S H X S+ 0 0 0 -4,-2.1 4,-1.0 -5,-0.4 -1,-0.2 0.894 112.4 43.6 -55.2 -44.0 32.2 15.7 4.3 197 197 A K H X S+ 0 0 91 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.923 114.9 48.2 -69.2 -46.7 34.6 14.3 1.8 198 198 A Q H X S+ 0 0 11 -4,-2.8 4,-0.5 1,-0.2 12,-0.2 0.785 107.0 54.2 -67.3 -31.2 34.6 17.4 -0.5 199 199 A I H < S+ 0 0 1 -4,-2.6 -1,-0.2 -5,-0.2 4,-0.2 0.829 112.1 46.9 -72.3 -29.3 35.2 19.9 2.4 200 200 A Q H >< S+ 0 0 21 -4,-1.0 3,-1.1 -5,-0.3 4,-0.2 0.858 108.5 53.5 -77.6 -36.3 38.2 17.8 3.3 201 201 A L H 3< S+ 0 0 62 -4,-2.0 3,-0.3 1,-0.2 -1,-0.2 0.586 101.8 61.8 -72.1 -11.4 39.5 17.6 -0.3 202 202 A A T ><>S+ 0 0 0 -4,-0.5 5,-2.8 1,-0.2 3,-1.5 0.564 79.6 88.1 -90.6 -9.0 39.3 21.4 -0.4 203 203 A Q T < 5S+ 0 0 99 -3,-1.1 3,-0.2 1,-0.3 -1,-0.2 0.768 101.0 27.8 -61.5 -31.4 41.9 21.8 2.4 204 204 A G T 3 5S+ 0 0 74 -3,-0.3 -1,-0.3 -4,-0.2 -2,-0.1 0.029 115.3 67.7-117.1 24.9 44.9 21.7 0.1 205 205 A N T X 5S- 0 0 38 -3,-1.5 3,-1.5 3,-0.0 -2,-0.2 -0.085 118.2 -94.0-134.1 32.3 43.0 23.1 -2.9 206 206 A N T 3 5S- 0 0 158 1,-0.3 -3,-0.2 -3,-0.2 3,-0.1 0.676 79.7 -62.3 62.6 19.7 42.2 26.7 -1.7 207 207 A G T 3 - 0 0 54 4,-1.8 3,-0.9 -2,-0.4 -33,-0.2 -0.232 33.4 -73.6 -99.1-171.7 17.2 24.2 -1.6 218 218 A S T 3 S+ 0 0 103 1,-0.3 -34,-0.2 2,-0.1 -35,-0.1 0.883 133.1 41.1 -42.6 -51.4 14.6 25.9 0.6 219 219 A K T 3 S- 0 0 172 2,-0.1 -1,-0.3 -36,-0.1 -36,-0.0 0.708 120.2-105.7 -75.7 -21.4 12.5 26.5 -2.5 220 220 A G S < S+ 0 0 38 -3,-0.9 2,-0.4 1,-0.3 -2,-0.1 0.631 72.4 141.0 102.2 19.5 13.1 23.1 -4.2 221 221 A N - 0 0 98 1,-0.0 -4,-1.8 0, 0.0 -1,-0.3 -0.831 58.5-110.4 -99.8 135.2 15.5 24.4 -6.8 222 222 A R E -J 216 0F 153 -2,-0.4 2,-0.3 -6,-0.2 -6,-0.2 -0.419 43.3-174.7 -61.5 125.8 18.6 22.3 -7.8 223 223 A V E -J 215 0F 42 -8,-3.1 -8,-2.3 -2,-0.2 2,-0.4 -0.955 18.2-137.9-130.1 149.2 21.7 24.0 -6.5 224 224 A Q E -J 214 0F 106 -2,-0.3 2,-0.6 -10,-0.2 -10,-0.2 -0.865 6.2-157.8-107.3 135.9 25.5 23.3 -6.9 225 225 A I E +J 213 0F 9 -12,-2.4 -12,-2.4 -2,-0.4 3,-0.1 -0.945 23.5 159.0-114.4 112.7 28.0 23.7 -4.2 226 226 A T E + 0 0 58 -2,-0.6 -17,-2.6 -14,-0.2 2,-0.3 0.543 58.5 19.2-106.1 -11.5 31.5 24.2 -5.5 227 227 A N E > S-J 208 0F 46 -19,-0.3 3,-1.3 -17,-0.0 -19,-0.2 -0.979 75.9-100.8-158.4 157.0 33.5 25.7 -2.6 228 228 A V T 3 S+ 0 0 23 -21,-2.7 -20,-0.1 -2,-0.3 6,-0.1 0.525 104.2 77.5 -63.6 -7.0 33.6 26.4 1.2 229 229 A T T 3 S+ 0 0 106 -22,-0.2 -1,-0.2 4,-0.1 -21,-0.1 0.671 73.8 111.2 -76.1 -13.0 32.4 30.0 1.0 230 230 A S S X> S- 0 0 32 -3,-1.3 4,-3.0 1,-0.1 3,-1.0 -0.213 81.2-119.8 -60.6 146.9 28.9 28.5 0.6 231 231 A N H 3>>S+ 0 0 122 1,-0.3 4,-3.4 2,-0.2 5,-1.4 0.852 112.0 63.8 -54.7 -37.2 26.3 28.9 3.3 232 232 A V H 34>S+ 0 0 16 3,-0.2 5,-2.5 1,-0.2 4,-0.3 0.869 114.0 33.1 -55.7 -39.5 26.0 25.1 3.6 233 233 A V H <45S+ 0 0 7 -3,-1.0 -2,-0.2 -6,-0.2 -1,-0.2 0.875 122.9 45.0 -84.6 -43.5 29.7 25.0 4.7 234 234 A T H <5S+ 0 0 83 -4,-3.0 -2,-0.2 1,-0.1 -3,-0.2 0.782 137.0 2.6 -74.2 -26.1 29.8 28.3 6.6 235 235 A S T <5S+ 0 0 68 -4,-3.4 -3,-0.2 -5,-0.3 -2,-0.1 0.572 122.7 52.4-137.8 -15.0 26.5 27.8 8.5 236 236 A N T - 0 0 15 -175,-0.5 3,-2.3 -2,-0.4 -45,-0.1 -0.394 17.3-126.9 -62.7 133.9 36.3 11.5 8.4 243 243 A T G > S+ 0 0 53 1,-0.3 3,-1.6 -47,-0.2 -1,-0.1 0.736 103.8 78.2 -55.3 -25.0 37.3 10.4 4.8 244 244 A K G 3 S+ 0 0 172 1,-0.3 -1,-0.3 2,-0.1 -2,-0.1 0.610 95.7 51.4 -61.5 -5.7 38.9 7.3 6.3 245 245 A N G < 0 0 64 -3,-2.3 -1,-0.3 -178,-0.1 -2,-0.2 0.146 360.0 360.0-113.8 18.8 35.3 6.0 6.5 246 246 A I < 0 0 111 -3,-1.6 -2,-0.1 -5,-0.0 -3,-0.1 0.786 360.0 360.0-122.8 360.0 33.9 6.6 3.0