==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 20-JUN-05 2CWF . COMPND 2 MOLECULE: DELTA1-PIPERIDEINE-2-CARBOXYLATE REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS SYRINGAE PV. TOMATO; . AUTHOR M.GOTO,H.MURAMATSU,H.MIHARA,T.KURIHARA,N.ESAKI,R.OMI, . 669 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25082.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 491 73.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 20 3.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 105 15.7 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 . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.6 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 . 33 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 63 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 220 32.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 24 3.6 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 2 0 0 0 6 1 1 0 2 5 1 1 1 0 2 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 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 PARALLEL BRIDGES PER LADDER . 4 4 1 3 2 4 0 0 2 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 2 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 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 10 A T 0 0 124 0, 0.0 320,-0.3 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 106.0 6.2 50.5 48.4 2 11 A Q E -A 320 0A 109 318,-1.2 318,-3.0 317,-0.1 2,-0.5 -0.364 360.0-128.7 -81.6 165.2 3.7 52.0 45.9 3 12 A T E +A 319 0A 74 316,-0.2 2,-0.3 -2,-0.1 316,-0.2 -0.967 25.4 179.0-123.6 121.0 4.0 51.5 42.1 4 13 A V E -A 318 0A 17 314,-2.3 314,-3.4 -2,-0.5 2,-0.1 -0.886 28.2-114.0-118.6 149.9 3.9 54.4 39.6 5 14 A S > - 0 0 39 -2,-0.3 4,-2.4 312,-0.2 5,-0.2 -0.378 29.5-110.4 -78.3 160.2 4.2 54.3 35.9 6 15 A Y H > S+ 0 0 29 307,-0.2 4,-2.0 1,-0.2 5,-0.1 0.927 119.4 46.5 -56.1 -49.2 7.1 55.9 34.0 7 16 A P H > S+ 0 0 70 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.820 110.8 54.1 -66.4 -27.4 5.0 58.7 32.5 8 17 A Q H > S+ 0 0 111 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.914 107.0 50.5 -69.9 -43.0 3.4 59.3 35.9 9 18 A L H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 5,-0.2 0.917 109.6 51.4 -60.7 -43.7 6.8 59.7 37.6 10 19 A I H X S+ 0 0 32 -4,-2.0 4,-3.0 1,-0.2 5,-0.2 0.955 110.0 48.2 -57.3 -53.1 7.8 62.2 34.9 11 20 A D H X S+ 0 0 111 -4,-2.1 4,-1.7 1,-0.2 -1,-0.2 0.879 112.8 49.7 -55.9 -40.4 4.7 64.3 35.4 12 21 A L H X S+ 0 0 27 -4,-2.3 4,-1.7 2,-0.2 -1,-0.2 0.922 113.2 44.2 -66.7 -45.8 5.3 64.3 39.1 13 22 A L H X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.882 109.3 57.3 -67.9 -36.9 8.9 65.3 38.9 14 23 A R H X S+ 0 0 85 -4,-3.0 4,-2.4 -5,-0.2 -1,-0.2 0.907 106.3 49.9 -59.6 -41.2 8.1 68.0 36.3 15 24 A R H X S+ 0 0 142 -4,-1.7 4,-2.8 -5,-0.2 -1,-0.2 0.918 107.8 54.0 -63.0 -43.3 5.6 69.5 38.8 16 25 A I H X S+ 0 0 0 -4,-1.7 4,-1.4 1,-0.2 -2,-0.2 0.909 110.5 46.0 -57.6 -44.3 8.3 69.5 41.5 17 26 A F H <>S+ 0 0 0 -4,-2.3 5,-2.4 2,-0.2 -1,-0.2 0.919 113.4 47.5 -66.5 -44.4 10.8 71.4 39.3 18 27 A V H ><5S+ 0 0 53 -4,-2.4 3,-1.5 1,-0.2 -2,-0.2 0.909 110.4 53.3 -63.2 -41.2 8.2 74.0 38.1 19 28 A V H 3<5S+ 0 0 84 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.824 108.8 51.6 -62.5 -31.1 7.1 74.5 41.7 20 29 A H T 3<5S- 0 0 72 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.072 129.1 -88.2 -97.4 25.1 10.7 75.1 42.6 21 30 A G T < 5S+ 0 0 31 -3,-1.5 -3,-0.2 1,-0.3 2,-0.1 0.494 78.5 134.4 91.5 3.8 11.4 77.7 40.0 22 31 A T < - 0 0 4 -5,-2.4 -1,-0.3 1,-0.1 43,-0.3 -0.498 60.3-104.2 -84.4 159.9 12.6 76.0 36.9 23 32 A S > - 0 0 17 41,-2.4 4,-2.7 -2,-0.1 5,-0.2 -0.388 32.9-109.8 -74.4 159.3 11.2 76.9 33.5 24 33 A P H > S+ 0 0 54 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.904 120.0 52.8 -57.3 -39.3 8.6 74.5 32.0 25 34 A E H > S+ 0 0 122 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.921 110.7 44.5 -61.8 -47.9 11.2 73.5 29.4 26 35 A V H > S+ 0 0 7 38,-0.2 4,-2.8 1,-0.2 5,-0.3 0.905 110.8 56.0 -64.7 -40.3 13.9 72.7 31.9 27 36 A A H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 5,-0.2 0.905 106.7 49.8 -58.3 -43.4 11.3 70.9 34.0 28 37 A D H X S+ 0 0 73 -4,-2.2 4,-2.1 -5,-0.2 5,-0.2 0.938 113.4 45.8 -60.9 -48.1 10.4 68.6 31.1 29 38 A V H X S+ 0 0 35 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.931 117.1 41.8 -62.0 -49.6 14.0 67.8 30.4 30 39 A L H X S+ 0 0 0 -4,-2.8 4,-3.1 2,-0.2 5,-0.3 0.891 112.5 54.8 -68.1 -39.1 15.1 67.1 34.0 31 40 A A H X S+ 0 0 0 -4,-2.5 4,-2.8 -5,-0.3 5,-0.2 0.943 111.6 43.4 -59.6 -49.6 11.9 65.2 34.8 32 41 A E H X S+ 0 0 110 -4,-2.1 4,-2.5 -5,-0.2 -1,-0.2 0.909 115.5 49.8 -62.7 -42.9 12.4 62.7 31.9 33 42 A N H X S+ 0 0 14 -4,-2.1 4,-1.8 -5,-0.2 -2,-0.2 0.964 115.6 40.9 -60.9 -53.0 16.1 62.4 32.7 34 43 A C H X S+ 0 0 0 -4,-3.1 4,-2.1 1,-0.2 -2,-0.2 0.926 116.8 48.7 -62.7 -46.2 15.6 61.7 36.4 35 44 A A H X S+ 0 0 0 -4,-2.8 4,-2.8 -5,-0.3 -1,-0.2 0.884 108.4 55.5 -61.8 -38.1 12.5 59.4 35.8 36 45 A S H X S+ 0 0 12 -4,-2.5 4,-2.0 -5,-0.2 -1,-0.2 0.889 106.6 50.4 -61.7 -40.0 14.5 57.5 33.1 37 46 A A H X>S+ 0 0 0 -4,-1.8 5,-2.5 8,-0.2 4,-0.6 0.933 111.7 47.0 -63.9 -44.9 17.3 56.8 35.6 38 47 A Q H ><5S+ 0 0 16 -4,-2.1 3,-1.2 1,-0.2 -2,-0.2 0.917 109.8 55.1 -61.7 -43.0 14.7 55.5 38.1 39 48 A R H 3<5S+ 0 0 25 -4,-2.8 274,-0.3 1,-0.3 -1,-0.2 0.874 109.5 46.5 -56.2 -42.4 13.1 53.4 35.4 40 49 A D H 3<5S- 0 0 1 -4,-2.0 269,-0.3 -5,-0.1 -1,-0.3 0.469 118.6-107.7 -82.3 -4.5 16.5 51.8 34.6 41 50 A G T <<5S+ 0 0 10 -3,-1.2 2,-1.8 -4,-0.6 -3,-0.2 0.606 74.7 139.0 87.8 10.2 17.3 51.0 38.2 42 51 A S > < + 0 0 14 -5,-2.5 3,-2.6 -6,-0.2 4,-0.4 -0.452 21.4 168.5 -85.9 62.9 20.0 53.7 38.4 43 52 A H G > > + 0 0 113 -2,-1.8 5,-0.6 1,-0.3 3,-0.5 0.709 66.8 66.1 -49.8 -27.7 18.9 54.7 41.9 44 53 A S G 3 5S+ 0 0 25 1,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.750 114.6 30.0 -69.1 -22.4 22.0 56.8 42.4 45 54 A H G < 5S+ 0 0 52 -3,-2.6 -8,-0.2 -8,-0.1 -1,-0.2 0.239 110.3 81.9-119.9 10.7 20.8 59.2 39.7 46 55 A G T X 5S- 0 0 0 -3,-0.5 3,-2.3 -4,-0.4 4,-0.2 0.291 111.9 -36.3 -90.5-141.0 17.0 58.7 40.1 47 56 A I G > 5S+ 0 0 20 1,-0.3 3,-1.7 2,-0.2 -3,-0.1 0.697 124.1 80.2 -58.6 -18.4 14.6 60.3 42.5 48 57 A F G 3 S+ 0 0 32 -3,-2.3 4,-2.3 1,-0.2 -1,-0.3 0.537 79.5 91.4 -84.9 -8.5 18.9 63.3 43.4 50 59 A I H <> S+ 0 0 1 -3,-1.7 4,-2.8 1,-0.2 5,-0.3 0.927 84.2 51.8 -55.0 -49.5 15.8 65.4 43.8 51 60 A P H > S+ 0 0 86 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.926 112.3 47.4 -53.9 -44.0 16.9 66.9 47.2 52 61 A G H > S+ 0 0 8 -4,-0.4 4,-1.8 2,-0.2 209,-0.3 0.859 110.5 51.6 -64.7 -37.8 20.2 67.8 45.7 53 62 A Y H X S+ 0 0 2 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.957 114.1 43.4 -62.7 -49.8 18.5 69.4 42.6 54 63 A L H X S+ 0 0 18 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.867 112.0 51.6 -66.0 -38.5 16.3 71.5 44.8 55 64 A S H X S+ 0 0 39 -4,-2.6 4,-1.0 -5,-0.3 -1,-0.2 0.882 111.2 49.7 -66.9 -35.7 18.9 72.6 47.2 56 65 A S H <>S+ 0 0 0 -4,-1.8 6,-1.0 -5,-0.2 5,-0.7 0.885 112.7 46.4 -69.3 -38.9 21.1 73.7 44.3 57 66 A L H ><5S+ 0 0 19 -4,-2.0 3,-1.4 1,-0.2 -2,-0.2 0.887 101.2 67.8 -69.5 -39.9 18.3 75.7 42.7 58 67 A A H 3<5S+ 0 0 88 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.835 103.5 42.2 -49.0 -44.2 17.3 77.3 46.0 59 68 A S T 3<5S- 0 0 44 -4,-1.0 -1,-0.3 -3,-0.2 -2,-0.2 0.579 111.6-115.5 -83.0 -10.5 20.5 79.4 46.3 60 69 A G T < 5S+ 0 0 42 -3,-1.4 -3,-0.2 -4,-0.4 -2,-0.1 0.452 76.3 134.0 87.7 -0.1 20.5 80.3 42.6 61 70 A W S - 0 0 68 21,-2.8 3,-1.5 -2,-0.4 23,-0.4 -0.769 16.9-170.4 -91.1 105.6 19.7 78.8 37.0 64 73 A G T 3 S+ 0 0 4 -2,-0.9 -41,-2.4 1,-0.3 -38,-0.2 0.569 89.1 47.8 -69.9 -8.3 16.6 76.7 36.5 65 74 A K T 3 S+ 0 0 119 -43,-0.3 -1,-0.3 -39,-0.1 20,-0.1 0.203 80.0 141.3-116.0 14.0 15.3 79.2 34.0 66 75 A A < - 0 0 10 -3,-1.5 -43,-0.1 18,-0.1 20,-0.1 -0.231 44.0-143.1 -58.5 143.3 18.5 79.5 31.9 67 76 A V - 0 0 109 16,-0.1 -1,-0.1 18,-0.0 14,-0.1 -0.928 19.4-129.9-112.5 107.5 18.1 79.8 28.2 68 77 A P - 0 0 31 0, 0.0 2,-0.6 0, 0.0 14,-0.2 -0.218 13.3-144.1 -55.3 143.0 20.9 77.9 26.3 69 78 A V E -B 81 0B 71 12,-2.2 12,-2.3 2,-0.0 2,-0.4 -0.944 12.5-152.2-114.7 110.3 22.6 79.9 23.6 70 79 A V E -B 80 0B 58 -2,-0.6 2,-0.6 10,-0.2 10,-0.2 -0.696 7.0-164.0 -86.4 129.1 23.6 77.8 20.6 71 80 A E E -B 79 0B 55 8,-3.7 8,-2.6 -2,-0.4 2,-1.1 -0.944 8.9-156.6-118.1 111.8 26.6 78.8 18.5 72 81 A D E +B 78 0B 96 -2,-0.6 6,-0.2 6,-0.2 3,-0.1 -0.753 30.3 157.3 -85.7 98.9 27.0 77.3 15.1 73 82 A V E + 0 0 36 4,-1.3 2,-0.3 -2,-1.1 5,-0.2 0.404 54.8 9.5-109.4 2.5 30.7 77.7 14.6 74 83 A G E > S-B 77 0B 11 3,-1.2 3,-1.4 1,-0.1 -1,-0.2 -0.970 76.2 -98.6-172.4 159.4 31.7 75.1 12.1 75 84 A A T 3 S+ 0 0 53 365,-0.4 30,-0.3 -2,-0.3 366,-0.1 0.809 130.1 18.0 -54.9 -28.5 30.5 72.6 9.6 76 85 A A T 3 S+ 0 0 0 365,-1.9 33,-2.2 364,-0.1 2,-0.4 0.026 114.7 84.8-131.7 27.6 31.1 70.0 12.3 77 86 A F E < +Bc 74 109B 0 -3,-1.4 -4,-1.3 31,-0.2 -3,-1.2 -0.976 43.1 173.8-140.7 126.2 31.3 72.1 15.4 78 87 A V E -Bc 72 110B 0 31,-2.8 33,-2.6 -2,-0.4 2,-0.3 -0.989 8.4-167.6-129.6 136.1 28.6 73.5 17.8 79 88 A R E -Bc 71 111B 3 -8,-2.6 -8,-3.7 -2,-0.4 2,-0.4 -0.913 3.4-166.9-119.0 149.8 29.1 75.3 21.0 80 89 A V E -Bc 70 112B 0 31,-2.1 33,-2.3 -2,-0.3 2,-0.7 -0.988 15.8-146.3-140.4 128.1 26.4 76.0 23.6 81 90 A D E -Bc 69 113B 48 -12,-2.3 -12,-2.2 -2,-0.4 33,-0.2 -0.862 8.3-162.3 -91.5 115.6 26.5 78.4 26.5 82 91 A A > - 0 0 1 31,-3.0 3,-1.5 -2,-0.7 32,-0.2 0.595 25.2-139.3 -74.4 -9.6 24.4 76.7 29.2 83 92 A C T 3 - 0 0 44 30,-0.4 -16,-0.1 1,-0.3 31,-0.1 0.878 66.0 -53.2 50.7 47.8 24.2 80.1 30.9 84 93 A N T 3 S+ 0 0 48 30,-1.5 -21,-2.8 1,-0.2 -1,-0.3 0.631 115.6 117.5 65.0 16.8 24.7 78.6 34.4 85 94 A G S < S- 0 0 2 -3,-1.5 31,-1.7 29,-0.3 -1,-0.2 -0.322 74.8 -64.5 -99.8-172.9 21.8 76.3 33.8 86 95 A F B > -d 116 0B 5 -23,-0.4 4,-0.8 29,-0.2 31,-0.2 -0.316 39.3-126.4 -72.2 157.3 21.7 72.5 33.6 87 96 A A H > S+ 0 0 0 29,-2.2 4,-2.3 1,-0.2 3,-0.3 0.881 101.4 62.7 -71.8 -39.7 23.6 70.6 30.9 88 97 A Q H > S+ 0 0 6 28,-0.3 4,-2.6 1,-0.2 -1,-0.2 0.874 101.5 49.7 -57.2 -42.8 20.7 68.5 29.6 89 98 A P H > S+ 0 0 15 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.865 111.3 51.3 -65.6 -31.9 18.6 71.5 28.5 90 99 A A H X S+ 0 0 0 -4,-0.8 4,-1.2 -3,-0.3 -2,-0.2 0.896 110.4 47.9 -69.3 -42.2 21.7 72.9 26.6 91 100 A L H X S+ 0 0 2 -4,-2.3 4,-1.3 1,-0.2 3,-0.5 0.933 111.2 51.0 -63.1 -45.9 22.2 69.5 24.9 92 101 A A H X S+ 0 0 34 -4,-2.6 4,-0.5 1,-0.2 3,-0.3 0.875 105.5 56.6 -60.4 -37.9 18.6 69.3 23.9 93 102 A A H < S+ 0 0 48 -4,-1.8 -1,-0.2 1,-0.2 4,-0.2 0.831 118.5 31.3 -64.2 -32.9 18.7 72.9 22.4 94 103 A A H X S+ 0 0 0 -4,-1.2 4,-2.5 -3,-0.5 -1,-0.2 0.444 92.1 98.7-105.8 -0.8 21.5 72.0 20.1 95 104 A R H X S+ 0 0 86 -4,-1.3 4,-2.6 -3,-0.3 5,-0.2 0.889 82.0 48.2 -54.9 -50.2 20.7 68.3 19.4 96 105 A S H X S+ 0 0 83 -4,-0.5 4,-2.2 1,-0.2 -1,-0.2 0.919 114.8 46.3 -60.1 -44.0 18.9 68.7 16.1 97 106 A L H > S+ 0 0 42 -4,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.906 111.9 52.3 -64.3 -40.8 21.7 70.9 14.7 98 107 A L H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.916 110.5 47.0 -61.3 -45.6 24.4 68.5 16.0 99 108 A I H X S+ 0 0 15 -4,-2.6 4,-2.5 2,-0.2 5,-0.3 0.891 109.5 54.1 -65.1 -40.1 22.7 65.5 14.4 100 109 A D H X S+ 0 0 104 -4,-2.2 4,-1.9 -5,-0.2 -2,-0.2 0.935 112.7 43.9 -59.6 -45.7 22.4 67.4 11.1 101 110 A K H X>S+ 0 0 20 -4,-2.3 4,-3.1 2,-0.2 5,-0.8 0.915 111.6 52.6 -65.7 -44.6 26.1 68.1 11.1 102 111 A A H X5S+ 0 0 0 -4,-2.6 4,-1.3 1,-0.2 171,-0.4 0.917 113.4 43.5 -58.8 -44.8 27.1 64.6 12.1 103 112 A R H <5S+ 0 0 102 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.859 121.8 40.0 -70.0 -34.1 25.1 63.1 9.3 104 113 A S H <5S+ 0 0 86 -4,-1.9 307,-0.4 -5,-0.3 -2,-0.2 0.961 128.1 27.5 -79.1 -56.6 26.3 65.7 6.8 105 114 A A H <5S- 0 0 2 -4,-3.1 307,-1.9 -30,-0.3 -3,-0.2 0.728 106.5-118.2 -79.1 -24.0 30.0 66.1 7.7 106 115 A G S <> S+ 0 0 3 1,-0.1 3,-1.7 2,-0.1 4,-1.2 0.688 88.9 79.6 -96.0 -21.7 25.8 60.3 31.2 122 131 A W H 3> S+ 0 0 8 1,-0.3 4,-2.6 2,-0.2 3,-0.2 0.842 86.4 61.1 -57.2 -31.1 24.2 57.3 29.5 123 132 A P H 34 S+ 0 0 22 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.804 103.4 53.4 -66.0 -22.2 21.0 59.3 29.0 124 133 A D H <4 S+ 0 0 8 -3,-1.7 4,-0.3 2,-0.1 -2,-0.2 0.841 118.2 30.8 -78.8 -35.5 23.1 61.8 26.9 125 134 A V H >X S+ 0 0 0 -4,-1.2 4,-1.5 -3,-0.2 3,-0.7 0.783 103.2 74.1 -95.5 -29.3 24.6 59.3 24.5 126 135 A E H 3X S+ 0 0 13 -4,-2.6 4,-2.2 1,-0.2 5,-0.2 0.882 91.3 56.5 -52.5 -46.8 21.9 56.6 24.2 127 136 A P H 3> S+ 0 0 33 0, 0.0 4,-0.8 0, 0.0 -1,-0.2 0.847 105.2 52.5 -56.6 -35.8 19.5 58.7 22.0 128 137 A F H X4>S+ 0 0 0 -3,-0.7 5,-2.4 -4,-0.3 3,-0.6 0.920 110.0 47.3 -67.1 -42.3 22.2 59.2 19.4 129 138 A A H ><5S+ 0 0 3 -4,-1.5 3,-2.1 1,-0.3 -1,-0.2 0.842 104.3 60.9 -67.0 -34.4 22.9 55.4 19.2 130 139 A E H 3<5S+ 0 0 116 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.784 105.2 50.9 -62.3 -24.7 19.1 54.8 19.0 131 140 A Q T <<5S- 0 0 84 -4,-0.8 -1,-0.3 -3,-0.6 -2,-0.2 0.192 128.1 -99.6 -97.2 14.3 19.4 56.9 15.8 132 141 A G T < 5S+ 0 0 30 -3,-2.1 2,-0.2 1,-0.3 -3,-0.2 0.553 85.4 120.3 81.8 8.3 22.2 54.8 14.4 133 142 A L < - 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