==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 04-FEB-07 2JFT . COMPND 2 MOLECULE: SER-THR PHOSPHATASE MSPP; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM SMEGMATIS; . AUTHOR M.BELLINZONI,A.WEHENKEL,W.SHEPARD,P.M.ALZARI . 234 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10619.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 155 66.2 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 . 56 23.9 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 . 2 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 . 12 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 59 25.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.3 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 1 0 1 1 0 0 0 0 0 1 0 0 0 1 1 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 . 2 1 0 4 2 1 0 1 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 1 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 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 0 A G 0 0 130 0, 0.0 2,-0.2 0, 0.0 233,-0.0 0.000 360.0 360.0 360.0-177.4 40.4 27.2 5.4 2 1 A M - 0 0 141 232,-0.3 4,-0.1 1,-0.1 2,-0.1 -0.572 360.0-116.2 -95.1 151.0 42.8 25.7 7.9 3 2 A A - 0 0 59 -2,-0.2 231,-0.3 2,-0.1 -1,-0.1 -0.296 30.5-114.8 -67.7 158.7 45.3 27.1 10.4 4 3 A S S S+ 0 0 39 230,-0.2 230,-1.8 1,-0.2 2,-0.5 0.881 109.7 41.3 -70.2 -37.0 49.0 26.5 10.0 5 4 A V E +A 233 0A 33 228,-0.2 228,-0.2 229,-0.2 -1,-0.2 -0.966 64.4 179.0-107.5 120.5 49.1 24.5 13.2 6 5 A L E - 0 0 86 226,-2.8 2,-0.3 -2,-0.5 227,-0.2 0.891 66.2 -33.2 -83.1 -46.7 46.1 22.2 13.6 7 6 A S E -A 232 0A 52 225,-1.0 225,-3.0 2,-0.0 -1,-0.4 -0.974 53.3-157.1-167.6 166.1 47.2 20.6 16.9 8 7 A A E -A 231 0A 37 -2,-0.3 2,-0.3 223,-0.2 223,-0.2 -0.973 6.2-170.6-146.5 158.8 50.2 19.6 18.9 9 8 A A E -A 230 0A 10 221,-2.2 221,-2.8 -2,-0.3 2,-0.3 -0.988 3.7-160.1-150.7 157.4 50.9 17.2 21.7 10 9 A T E +A 229 0A 62 -2,-0.3 2,-0.3 219,-0.2 219,-0.2 -0.974 7.5 179.1-136.3 153.0 53.8 16.4 24.1 11 10 A A E -A 228 0A 22 217,-2.3 217,-2.6 -2,-0.3 2,-0.4 -0.984 4.6-170.9-149.5 148.4 55.0 13.6 26.3 12 11 A T E -A 227 0A 69 -2,-0.3 2,-0.4 215,-0.2 215,-0.2 -0.998 5.1-172.6-138.6 141.8 58.0 13.1 28.5 13 12 A D E -A 226 0A 37 213,-2.1 213,-2.4 -2,-0.4 10,-0.1 -0.987 21.2-157.9-140.9 122.4 59.1 9.8 30.2 14 13 A Q - 0 0 79 -2,-0.4 4,-0.5 211,-0.2 3,-0.3 0.843 40.6-148.8 -62.6 -36.6 61.8 9.3 32.7 15 14 A G - 0 0 12 1,-0.2 207,-0.1 2,-0.1 -1,-0.1 -0.089 28.4 -77.6 76.3 172.8 61.9 5.6 31.8 16 15 A P S S+ 0 0 91 0, 0.0 -1,-0.2 0, 0.0 207,-0.1 0.401 119.4 47.6 -86.3 -0.7 62.9 2.8 34.2 17 16 A V S S+ 0 0 90 205,-0.9 206,-0.1 -3,-0.3 -2,-0.1 0.812 87.9 77.4-108.2 -53.9 66.7 3.3 34.2 18 17 A R - 0 0 105 204,-0.5 206,-0.1 -4,-0.5 3,-0.0 -0.312 66.2-141.8 -68.2 146.4 67.6 6.9 34.7 19 18 A E S S+ 0 0 182 1,-0.1 2,-0.3 -3,-0.0 -1,-0.1 0.645 84.7 26.9 -83.5 -15.3 67.5 8.4 38.2 20 19 A N S S- 0 0 78 -6,-0.1 2,-0.9 23,-0.0 205,-0.1 -0.975 74.6-124.2-139.5 152.9 66.2 11.7 36.9 21 20 A N + 0 0 43 -2,-0.3 -7,-0.1 1,-0.1 -6,-0.1 -0.879 34.3 171.7 -92.9 101.9 64.2 13.0 34.0 22 21 A Q + 0 0 25 -2,-0.9 15,-2.4 15,-0.2 24,-0.2 0.357 46.8 97.1 -98.3 9.0 66.7 15.6 32.7 23 22 A D E -E 36 0B 11 13,-0.2 2,-0.3 23,-0.1 13,-0.2 -0.553 51.8-174.7 -85.4 159.4 64.7 16.2 29.5 24 23 A A E -E 35 0B 17 11,-2.0 11,-2.5 -2,-0.2 2,-0.3 -0.969 3.7-163.5-147.2 155.8 62.2 19.2 29.2 25 24 A C E -E 34 0B 41 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.954 4.3-159.0-142.2 165.7 59.8 20.3 26.5 26 25 A L E +E 33 0B 26 7,-2.2 7,-2.4 -2,-0.3 2,-0.3 -0.997 11.6 175.0-146.8 135.1 57.8 23.4 25.5 27 26 A A E +E 32 0B 52 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.905 23.2 149.3-142.1 107.9 54.6 23.8 23.4 28 27 A D E > -E 31 0B 90 3,-3.1 3,-2.4 -2,-0.3 2,-0.4 -0.826 66.1 -54.4-150.9 105.1 53.4 27.5 23.4 29 28 A G T 3 S- 0 0 55 -2,-0.3 -1,-0.0 1,-0.3 68,-0.0 -0.465 123.1 -16.9 62.0-114.0 51.6 29.2 20.6 30 29 A I T 3 S+ 0 0 59 -2,-0.4 67,-2.7 -3,-0.1 2,-0.5 0.395 119.9 95.8-100.1 2.9 53.9 28.7 17.5 31 30 A L E < +EF 28 96B 2 -3,-2.4 -3,-3.1 65,-0.2 2,-0.4 -0.854 45.8 170.3-101.3 129.1 57.0 27.8 19.6 32 31 A Y E +EF 27 95B 15 63,-2.7 63,-3.2 -2,-0.5 2,-0.3 -0.984 7.9 164.8-135.3 138.9 57.9 24.1 20.3 33 32 A A E -EF 26 94B 0 -7,-2.4 -7,-2.2 -2,-0.4 2,-0.4 -0.997 26.2-157.5-156.8 154.2 61.1 22.8 21.8 34 33 A V E -EF 25 93B 0 59,-2.1 59,-2.5 -2,-0.3 2,-0.4 -0.992 11.5-171.2-126.0 140.6 62.9 19.9 23.4 35 34 A A E -E 24 0B 0 -11,-2.5 -11,-2.0 -2,-0.4 2,-0.7 -0.994 7.1-160.6-131.5 124.6 65.9 20.2 25.7 36 35 A D E -E 23 0B 15 -2,-0.4 55,-2.2 -13,-0.2 -13,-0.2 -0.891 16.4-155.3-107.0 104.6 67.9 17.1 26.8 37 36 A G E -I 90 0C 3 -15,-2.4 2,-0.3 -2,-0.7 53,-0.3 -0.433 9.9-168.4 -77.1 155.4 70.0 18.0 29.9 38 37 A F E +I 89 0C 64 51,-2.6 51,-1.7 4,-0.2 3,-0.3 -0.955 39.8 36.0-138.7 160.5 73.1 16.2 30.9 39 38 A G S > S- 0 0 29 -2,-0.3 3,-2.1 49,-0.2 4,-0.3 -0.209 103.3 -49.7 87.0 179.5 75.4 16.1 33.9 40 39 A A T 3 S+ 0 0 70 1,-0.3 -1,-0.2 47,-0.2 3,-0.1 0.752 143.9 32.1 -61.1 -28.0 74.7 16.2 37.6 41 40 A R T 3> S+ 0 0 70 -3,-0.3 4,-2.0 1,-0.1 3,-0.4 -0.040 80.1 125.0-117.3 28.2 72.5 19.4 37.1 42 41 A G H <> S+ 0 0 0 -3,-2.1 4,-2.4 1,-0.2 5,-0.2 0.833 71.6 56.8 -59.4 -32.8 71.2 18.5 33.6 43 42 A H H > S+ 0 0 57 -4,-0.3 4,-2.2 1,-0.2 5,-0.3 0.901 107.7 48.5 -65.7 -40.6 67.5 18.8 34.8 44 43 A H H > S+ 0 0 82 -3,-0.4 4,-2.2 2,-0.2 5,-0.3 0.902 110.6 52.5 -63.7 -38.4 68.3 22.4 35.9 45 44 A A H X S+ 0 0 0 -4,-2.0 4,-2.3 44,-0.2 -2,-0.2 0.946 112.8 41.0 -63.0 -51.5 70.0 23.1 32.6 46 45 A S H X S+ 0 0 2 -4,-2.4 4,-2.1 43,-0.3 5,-0.2 0.936 116.8 47.4 -69.6 -41.6 67.1 21.9 30.4 47 46 A A H X S+ 0 0 56 -4,-2.2 4,-2.2 -5,-0.2 5,-0.2 0.924 114.8 46.6 -65.4 -42.3 64.3 23.5 32.5 48 47 A T H X S+ 0 0 37 -4,-2.2 4,-2.4 -5,-0.3 5,-0.3 0.919 109.2 55.2 -64.2 -42.5 66.1 26.8 32.8 49 48 A A H X S+ 0 0 0 -4,-2.3 4,-2.6 -5,-0.3 -1,-0.2 0.940 111.3 43.8 -55.9 -47.5 66.9 26.9 29.0 50 49 A L H X S+ 0 0 10 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.862 111.1 53.2 -71.8 -35.7 63.2 26.5 28.1 51 50 A K H X S+ 0 0 171 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.927 114.7 42.5 -59.6 -45.6 62.0 29.0 30.7 52 51 A T H X S+ 0 0 32 -4,-2.4 4,-2.5 -5,-0.2 5,-0.2 0.914 113.1 52.4 -68.0 -40.8 64.4 31.6 29.3 53 52 A L H X S+ 0 0 0 -4,-2.6 4,-2.6 -5,-0.3 5,-0.2 0.927 109.8 49.6 -58.3 -49.9 63.6 30.6 25.7 54 53 A S H X S+ 0 0 28 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.922 112.7 46.3 -60.3 -45.5 59.9 31.0 26.3 55 54 A A H X S+ 0 0 65 -4,-2.0 4,-1.5 -5,-0.2 -1,-0.2 0.898 113.7 47.9 -64.8 -41.1 60.3 34.4 27.9 56 55 A G H X S+ 0 0 24 -4,-2.5 4,-0.9 2,-0.2 -2,-0.2 0.905 111.6 49.2 -70.1 -37.3 62.6 35.8 25.2 57 56 A F H >< S+ 0 0 13 -4,-2.6 3,-0.8 -5,-0.2 -2,-0.2 0.918 108.6 53.8 -66.2 -40.7 60.5 34.6 22.3 58 57 A A H 3< S+ 0 0 74 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.856 108.0 50.9 -64.2 -32.3 57.4 36.1 23.9 59 58 A A H 3< S+ 0 0 88 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.736 132.1 12.6 -74.4 -20.4 59.2 39.5 24.1 60 59 A A S << S- 0 0 39 -4,-0.9 2,-2.2 -3,-0.8 -1,-0.3 -0.536 71.7-172.1-156.0 74.0 60.3 39.3 20.4 61 60 A P + 0 0 65 0, 0.0 2,-0.3 0, 0.0 -4,-0.1 -0.382 52.7 88.6 -82.7 71.1 58.5 36.6 18.4 62 61 A D S > S- 0 0 68 -2,-2.2 4,-2.3 -5,-0.1 5,-0.2 -0.850 93.8 -83.8-145.0-179.9 60.3 36.7 15.1 63 62 A R H > S+ 0 0 117 -2,-0.3 4,-2.3 39,-0.2 5,-0.2 0.951 127.5 45.1 -59.9 -48.8 63.4 35.0 13.8 64 63 A D H > S+ 0 0 114 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.893 113.0 52.1 -65.4 -37.0 66.0 37.4 15.3 65 64 A G H > S+ 0 0 7 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.863 108.4 50.9 -64.4 -39.2 64.1 37.3 18.6 66 65 A L H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.938 111.3 47.2 -62.7 -44.7 64.2 33.5 18.7 67 66 A L H X S+ 0 0 40 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.901 112.8 49.2 -67.9 -38.8 67.9 33.4 18.0 68 67 A E H X S+ 0 0 100 -4,-2.5 4,-2.7 2,-0.2 -1,-0.2 0.892 108.6 54.2 -64.1 -37.8 68.5 36.1 20.7 69 68 A A H X S+ 0 0 1 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.893 107.3 50.3 -63.6 -35.9 66.3 34.0 23.1 70 69 A V H X S+ 0 0 1 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.920 110.9 49.4 -67.0 -41.4 68.5 31.0 22.4 71 70 A Q H X S+ 0 0 59 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.906 111.8 48.6 -63.3 -44.0 71.6 33.1 23.2 72 71 A Q H X S+ 0 0 83 -4,-2.7 4,-2.6 2,-0.2 -1,-0.2 0.898 109.1 52.4 -65.6 -37.7 70.0 34.3 26.4 73 72 A A H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 5,-0.3 0.932 109.9 49.9 -60.3 -44.4 69.1 30.8 27.4 74 73 A N H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.940 112.8 46.2 -54.5 -52.2 72.8 29.8 26.9 75 74 A L H X S+ 0 0 49 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.912 112.2 49.9 -62.7 -43.2 74.0 32.7 29.0 76 75 A R H X S+ 0 0 105 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.940 112.6 46.0 -63.9 -45.4 71.6 32.1 31.8 77 76 A V H X S+ 0 0 1 -4,-2.5 4,-2.4 2,-0.2 5,-0.3 0.912 114.3 48.6 -64.7 -42.9 72.4 28.4 32.1 78 77 A F H X S+ 0 0 65 -4,-2.5 4,-2.3 -5,-0.3 -2,-0.2 0.916 109.7 52.4 -66.5 -37.0 76.1 29.1 31.9 79 78 A E H < S+ 0 0 116 -4,-2.7 4,-0.2 1,-0.2 -1,-0.2 0.896 116.6 39.9 -60.8 -38.0 75.8 31.8 34.6 80 79 A L H < S+ 0 0 70 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.846 130.4 23.2 -83.4 -30.4 74.0 29.4 36.9 81 80 A L H >< S+ 0 0 7 -4,-2.4 3,-1.8 80,-0.2 7,-0.2 0.530 92.4 94.6-114.5 -8.4 75.9 26.1 36.3 82 81 A G T 3< S+ 0 0 34 -4,-2.3 -3,-0.1 -5,-0.3 -1,-0.1 0.656 82.9 55.4 -68.7 -14.5 79.3 27.2 35.0 83 82 A D T 3 S+ 0 0 162 -4,-0.2 -1,-0.3 -5,-0.1 -2,-0.1 0.405 79.6 115.6 -98.3 5.8 81.0 27.1 38.5 84 83 A E S < S- 0 0 71 -3,-1.8 4,-0.0 2,-0.1 -3,-0.0 -0.307 78.2-116.0 -67.8 157.0 80.1 23.5 39.3 85 84 A P S S+ 0 0 118 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.676 99.5 32.7 -73.2 -16.8 83.0 21.1 39.6 86 85 A T S S- 0 0 83 0, 0.0 2,-0.4 0, 0.0 -2,-0.1 -0.900 96.8 -93.7-131.4 164.4 81.8 19.1 36.6 87 86 A V + 0 0 97 -2,-0.3 2,-0.3 -4,-0.1 -47,-0.2 -0.635 39.0 172.0 -86.5 129.4 80.0 20.2 33.4 88 87 A S + 0 0 3 -2,-0.4 2,-0.3 -7,-0.2 -49,-0.2 -0.949 16.8 134.0-124.7 153.3 76.3 20.1 33.0 89 88 A G E -I 38 0C 0 -51,-1.7 -51,-2.6 -2,-0.3 2,-0.3 -0.900 35.5-117.1-170.3-162.8 74.4 21.5 30.1 90 89 A T E -IJ 37 160C 0 70,-2.1 70,-3.1 -53,-0.3 -53,-0.3 -0.999 11.2-123.0-155.0 152.7 71.6 20.8 27.6 91 90 A T - 0 0 1 -55,-2.2 2,-0.3 -2,-0.3 20,-0.2 -0.471 29.5-161.9 -77.3 165.9 70.7 20.2 24.1 92 91 A L E + G 0 110B 2 18,-2.6 18,-2.6 -57,-0.2 2,-0.4 -0.884 16.7 176.7-153.9 127.4 68.0 22.5 22.6 93 92 A T E -FG 34 109B 1 -59,-2.5 -59,-2.1 -2,-0.3 2,-0.4 -0.986 15.1-178.3-127.3 117.9 65.9 22.1 19.5 94 93 A A E -FG 33 108B 0 14,-2.9 14,-2.6 -2,-0.4 2,-0.4 -0.956 10.4-166.9-118.6 137.3 63.3 24.8 18.9 95 94 A V E -FG 32 107B 0 -63,-3.2 -63,-2.7 -2,-0.4 2,-0.5 -0.988 1.8-169.0-119.6 128.1 60.7 25.1 16.1 96 95 A A E -FG 31 106B 0 10,-2.3 10,-2.2 -2,-0.4 2,-1.9 -0.986 15.7-148.0-114.3 120.6 58.8 28.3 15.5 97 96 A V + 0 0 6 -67,-2.7 2,-0.1 -2,-0.5 -93,-0.1 -0.494 31.8 178.8 -88.1 69.1 56.0 27.8 13.0 98 97 A F - 0 0 4 -2,-1.9 -36,-0.0 6,-0.3 -2,-0.0 -0.407 29.2-113.7 -67.6 148.3 56.1 31.2 11.5 99 98 A E > > - 0 0 98 5,-0.2 5,-2.4 -2,-0.1 3,-1.7 -0.284 38.9 -96.7 -67.5 165.0 53.9 32.4 8.7 100 99 A P G > 5S+ 0 0 108 0, 0.0 3,-2.2 0, 0.0 -1,-0.1 0.869 123.2 62.4 -55.2 -37.0 55.5 33.1 5.3 101 100 A G G 3 5S+ 0 0 81 1,-0.3 -3,-0.0 2,-0.1 0, 0.0 0.750 104.5 47.9 -65.7 -20.0 55.6 36.8 6.1 102 101 A Q G < 5S- 0 0 93 -3,-1.7 -1,-0.3 -40,-0.0 -39,-0.2 0.176 135.4 -88.6-101.6 17.3 58.0 36.0 9.0 103 102 A G T < 5 - 0 0 69 -3,-2.2 -2,-0.1 -4,-0.1 -4,-0.1 0.388 66.6 -94.6 96.0 0.2 60.1 33.8 6.7 104 103 A G S - C 0 122A 76 3,-2.2 3,-2.4 -2,-0.5 60,-0.1 -0.994 64.9 -10.5-145.7 126.8 55.1 13.0 5.2 120 119 A D T 3 S- 0 0 150 -2,-0.4 3,-0.1 1,-0.3 59,-0.1 0.831 129.4 -51.9 52.0 36.7 53.2 10.3 3.3 121 120 A G T 3 S+ 0 0 51 1,-0.3 2,-0.4 77,-0.0 -1,-0.3 0.412 113.9 116.5 88.2 -6.5 54.1 7.7 5.9 122 121 A H E < -C 119 0A 144 -3,-2.4 -3,-2.2 2,-0.0 2,-0.5 -0.798 49.0-157.7-101.1 141.2 57.9 8.5 5.7 123 122 A M E +C 118 0A 27 -2,-0.4 2,-0.4 -5,-0.2 -5,-0.2 -0.982 18.0 173.4-116.3 118.4 59.8 9.8 8.7 124 123 A E E -C 117 0A 91 -7,-2.4 -7,-2.4 -2,-0.5 2,-0.5 -0.971 31.5-122.5-133.3 145.3 63.1 11.7 8.0 125 124 A Q E -C 116 0A 31 -2,-0.4 -9,-0.3 -9,-0.2 19,-0.0 -0.719 22.3-175.8 -83.1 125.4 65.5 13.6 10.2 126 125 A L + 0 0 56 -11,-2.8 2,-0.2 -2,-0.5 -10,-0.2 0.665 60.7 64.5 -92.2 -30.5 66.0 17.2 9.1 127 126 A T S S- 0 0 7 -12,-1.0 2,-0.4 42,-0.0 -2,-0.0 -0.639 77.0-124.0 -94.3 156.7 68.6 18.3 11.6 128 127 A D - 0 0 39 -2,-0.2 2,-0.4 -19,-0.1 41,-0.1 -0.785 26.6-120.2 -98.0 148.1 72.2 17.2 12.0 129 128 A D - 0 0 35 -2,-0.4 2,-1.5 5,-0.2 -17,-0.2 -0.745 9.2-140.6 -86.2 130.7 73.4 15.9 15.4 130 129 A H + 0 0 0 -19,-2.7 27,-2.3 -2,-0.4 28,-1.0 -0.639 67.4 105.4 -91.7 73.9 76.2 17.8 17.1 131 130 A S B > S-K 156 0D 2 -2,-1.5 4,-2.7 25,-0.3 5,-0.3 -0.936 89.0 -97.4-141.4 168.0 77.9 14.6 18.4 132 131 A V H > S+ 0 0 42 23,-2.2 4,-1.3 20,-0.6 21,-0.2 0.944 128.9 40.2 -55.4 -45.5 80.9 12.6 17.4 133 132 A A H > S+ 0 0 1 19,-0.5 4,-1.6 1,-0.2 -1,-0.2 0.921 113.4 54.4 -69.7 -41.8 78.7 10.3 15.4 134 133 A G H > S+ 0 0 2 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.855 104.4 54.6 -60.6 -34.9 76.5 13.1 14.1 135 134 A E H X S+ 0 0 55 -4,-2.7 4,-1.5 1,-0.2 -1,-0.2 0.866 102.8 56.2 -69.2 -33.6 79.6 15.0 12.7 136 135 A L H <>S+ 0 0 42 -4,-1.3 5,-2.5 -5,-0.3 6,-0.9 0.895 107.3 49.5 -67.1 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