==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-OCT-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 05-OCT-09 3K4I . COMPND 2 MOLECULE: UNCHARACTERIZED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS SYRINGAE PV. TOMATO; . AUTHOR V.N.MALASHKEVICH,R.TORO,J.M.SAUDER,S.K.BURLEY,S.C.ALMO,NEW Y . 615 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24996.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 425 69.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 61 9.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 80 13.0 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 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 28 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 74 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 148 24.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 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 0 2 4 3 0 3 3 0 0 0 0 0 0 0 0 0 0 0 1 2 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 6 2 1 0 3 3 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 . 3 3 3 4 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 ANTIPARALLEL BRIDGES PER LADDER . 3 0 0 0 0 0 0 3 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 7 A F 0 0 135 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 143.6 33.2 55.3 76.1 2 8 A E - 0 0 137 2,-0.0 2,-0.2 0, 0.0 167,-0.1 -0.961 360.0-113.4-146.4 135.5 29.7 54.5 77.3 3 9 A Y - 0 0 140 -2,-0.3 150,-0.1 165,-0.1 151,-0.0 -0.495 42.1-170.8 -60.2 126.9 26.4 54.2 75.5 4 10 A T - 0 0 45 -2,-0.2 2,-0.1 149,-0.1 167,-0.1 -0.983 16.4-138.9-132.2 115.5 24.4 57.0 77.0 5 11 A P - 0 0 125 0, 0.0 2,-0.5 0, 0.0 148,-0.0 -0.409 17.9-139.1 -72.0 155.7 20.7 57.6 76.4 6 12 A I - 0 0 29 -2,-0.1 5,-0.1 165,-0.1 44,-0.0 -0.974 18.5-116.3-120.7 124.6 19.6 61.2 75.8 7 13 A A >> - 0 0 58 -2,-0.5 4,-1.9 1,-0.1 3,-0.8 -0.223 18.6-125.3 -57.1 141.5 16.4 62.5 77.4 8 14 A Q H 3> S+ 0 0 119 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.880 111.4 60.5 -55.7 -36.6 13.6 63.6 75.0 9 15 A S H 3> S+ 0 0 78 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.860 102.8 51.5 -65.5 -31.0 13.6 67.0 76.7 10 16 A V H <> S+ 0 0 29 -3,-0.8 4,-1.5 2,-0.2 -1,-0.2 0.939 111.0 47.7 -64.9 -49.1 17.3 67.5 75.6 11 17 A L H X S+ 0 0 26 -4,-1.9 4,-1.1 2,-0.2 -2,-0.2 0.911 112.4 49.8 -53.7 -44.3 16.3 66.6 72.0 12 18 A D H >< S+ 0 0 78 -4,-2.9 3,-0.6 1,-0.2 4,-0.4 0.922 110.1 49.6 -64.7 -42.3 13.4 69.0 72.2 13 19 A E H 3< S+ 0 0 117 -4,-2.3 3,-0.4 1,-0.2 -1,-0.2 0.798 110.6 51.1 -64.2 -24.8 15.6 71.8 73.5 14 20 A C H >< S+ 0 0 0 -4,-1.5 3,-1.4 1,-0.2 -1,-0.2 0.701 84.4 96.9 -84.9 -17.0 18.0 71.0 70.7 15 21 A E T << S+ 0 0 95 -4,-1.1 -1,-0.2 -3,-0.6 -2,-0.2 0.770 95.1 26.0 -44.1 -46.0 15.2 71.2 68.1 16 22 A H T 3 S+ 0 0 137 -3,-0.4 -1,-0.3 -4,-0.4 2,-0.1 0.481 91.8 120.6-100.7 -2.1 15.8 74.8 67.1 17 23 A L < - 0 0 8 -3,-1.4 2,-0.1 -4,-0.2 162,-0.1 -0.373 60.9-124.6 -70.0 134.0 19.6 75.2 67.9 18 24 A D > - 0 0 38 -2,-0.1 4,-1.6 1,-0.1 3,-0.4 -0.418 16.8-120.6 -73.6 152.3 21.9 76.1 65.0 19 25 A T H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.813 113.0 62.3 -60.3 -32.8 24.9 73.9 64.2 20 26 A A H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.910 103.8 47.9 -58.9 -42.2 27.2 76.9 64.9 21 27 A S H > S+ 0 0 1 -3,-0.4 4,-2.0 2,-0.2 -1,-0.2 0.889 112.3 48.3 -66.7 -41.2 26.0 77.0 68.5 22 28 A L H X S+ 0 0 0 -4,-1.6 4,-2.6 2,-0.2 -2,-0.2 0.900 111.9 49.4 -67.7 -38.9 26.5 73.2 68.9 23 29 A S H X S+ 0 0 0 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.907 110.0 51.2 -65.5 -40.6 30.0 73.4 67.4 24 30 A D H X S+ 0 0 30 -4,-2.3 4,-1.4 2,-0.2 -2,-0.2 0.891 111.4 48.3 -63.7 -39.5 30.9 76.4 69.7 25 31 A A H X S+ 0 0 1 -4,-2.0 4,-0.6 2,-0.2 3,-0.2 0.927 111.4 49.6 -64.3 -47.0 29.8 74.3 72.7 26 32 A L H ><>S+ 0 0 0 -4,-2.6 5,-2.2 1,-0.2 3,-1.6 0.916 106.8 55.8 -57.4 -44.9 31.8 71.3 71.5 27 33 A D H ><5S+ 0 0 39 -4,-2.8 3,-2.0 1,-0.3 -1,-0.2 0.846 98.2 62.1 -55.5 -37.1 34.8 73.5 71.1 28 34 A S H 3<5S+ 0 0 67 -4,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.721 107.1 45.3 -63.8 -21.1 34.5 74.6 74.7 29 35 A L T <<5S- 0 0 54 -3,-1.6 -1,-0.3 -4,-0.6 -2,-0.2 0.305 123.4-107.5 -98.4 4.1 35.1 70.9 75.5 30 36 A G T < 5S+ 0 0 67 -3,-2.0 2,-0.4 1,-0.2 -3,-0.2 0.706 76.0 134.7 76.6 24.7 38.0 70.6 73.1 31 37 A I < - 0 0 47 -5,-2.2 2,-0.5 -8,-0.1 -1,-0.2 -0.898 48.5-147.7-115.6 131.1 36.0 68.6 70.6 32 38 A D + 0 0 92 -2,-0.4 -9,-0.0 1,-0.1 132,-0.0 -0.850 25.8 163.5 -86.3 127.0 35.7 68.9 66.7 33 39 A G + 0 0 0 -2,-0.5 132,-2.4 -10,-0.1 2,-0.1 0.521 31.6 111.8-121.0 -9.3 32.2 67.9 65.5 34 40 A G B -A 164 0A 1 130,-0.2 130,-0.2 249,-0.1 128,-0.1 -0.410 51.6-150.7 -75.1 145.4 31.9 69.2 62.0 35 41 A L > - 0 0 2 128,-2.1 3,-1.9 3,-0.2 128,-0.4 -0.794 22.3-147.5-111.6 86.7 31.7 67.0 58.9 36 42 A P T 3 S+ 0 0 38 0, 0.0 292,-0.1 0, 0.0 3,-0.1 -0.197 77.5 19.2 -60.5 139.3 33.1 69.2 56.1 37 43 A G T 3 S+ 0 0 47 290,-0.4 2,-1.2 1,-0.2 85,-0.1 0.233 86.8 117.0 89.5 -17.7 31.7 68.7 52.7 38 44 A I < - 0 0 2 -3,-1.9 125,-0.4 125,-0.1 2,-0.2 -0.723 54.2-171.3 -84.1 96.0 28.5 66.9 53.9 39 45 A A E -B 122 0A 40 83,-2.2 83,-2.3 -2,-1.2 85,-0.2 -0.582 29.2-102.6-102.2 148.3 26.1 69.6 52.6 40 46 A S E -B 121 0A 17 120,-0.3 81,-0.2 119,-0.3 -1,-0.1 -0.447 30.8-173.0 -63.2 131.9 22.4 70.2 53.0 41 47 A Q + 0 0 21 79,-2.8 -1,-0.1 1,-0.2 80,-0.1 0.540 69.3 58.8-104.8 -11.1 20.6 69.1 49.8 42 48 A V S > S- 0 0 2 78,-0.5 3,-1.7 71,-0.1 -1,-0.2 -0.916 89.7-124.6-125.4 98.6 17.1 70.3 50.6 43 49 A P T 3 S+ 0 0 105 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 -0.125 89.9 14.7 -43.3 134.4 17.0 74.1 51.2 44 50 A G T 3 S+ 0 0 66 1,-0.3 2,-0.2 -4,-0.0 116,-0.0 0.500 97.3 122.5 82.3 6.2 15.4 75.2 54.5 45 51 A T < + 0 0 6 -3,-1.7 2,-0.3 73,-0.1 -1,-0.3 -0.598 29.8 167.9-100.9 164.1 15.6 71.8 56.2 46 52 A R - 0 0 70 -2,-0.2 2,-0.3 113,-0.1 113,-0.2 -0.969 10.9-161.1-160.5 160.1 17.2 70.7 59.4 47 53 A C E -C 158 0A 5 111,-2.2 111,-2.3 -2,-0.3 2,-0.4 -0.997 10.3-167.0-150.4 157.0 17.2 67.7 61.7 48 54 A V E +C 157 0A 18 -2,-0.3 2,-0.3 109,-0.2 109,-0.2 -0.995 37.8 108.4-136.4 133.5 18.1 66.6 65.2 49 55 A G E -C 156 0A 2 107,-2.0 107,-3.1 -2,-0.4 2,-0.4 -0.988 62.4 -59.3 177.2-171.5 18.3 62.9 66.3 50 56 A I E -Cd 155 70A 47 19,-1.7 21,-2.4 -2,-0.3 105,-0.2 -0.729 53.5-112.3 -97.6 128.4 20.2 59.9 67.3 51 57 A A E - d 0 71A 2 103,-3.2 102,-2.5 -2,-0.4 2,-0.5 -0.374 28.0-174.9 -65.4 125.0 22.8 58.4 65.0 52 58 A F E - d 0 72A 6 19,-2.3 21,-2.8 100,-0.2 2,-0.3 -0.990 25.1-145.0-110.8 116.0 22.0 55.0 63.5 53 59 A T E - d 0 73A 0 -2,-0.5 87,-2.5 19,-0.2 2,-0.4 -0.614 20.6-175.7 -95.6 145.2 25.1 54.1 61.5 54 60 A V E -Ed 139 74A 0 19,-2.5 21,-3.0 -2,-0.3 2,-0.5 -0.992 7.0-162.2-138.2 123.5 25.3 52.2 58.3 55 61 A Q E -Ed 138 75A 37 83,-3.0 82,-3.3 -2,-0.4 83,-1.5 -0.941 6.6-168.6-111.0 124.7 28.6 51.2 56.6 56 62 A Y E -E 136 0A 16 19,-2.7 80,-0.2 -2,-0.5 21,-0.2 -0.666 2.7-169.9-100.1 161.5 28.8 50.2 53.0 57 63 A Q E -E 135 0A 65 78,-2.9 78,-3.3 -2,-0.2 76,-0.1 -0.965 33.9 -81.6-144.6 163.0 31.7 48.6 51.2 58 64 A P E E 134 0A 88 0, 0.0 76,-0.2 0, 0.0 75,-0.1 -0.211 360.0 360.0 -64.5 157.1 32.6 47.9 47.5 59 65 A V 0 0 103 74,-1.0 75,-0.1 73,-0.1 74,-0.1 0.915 360.0 360.0 -72.7 360.0 31.1 44.8 45.9 60 ! 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 61 76 A N > 0 0 58 0, 0.0 3,-1.1 0, 0.0 553,-0.2 0.000 360.0 360.0 360.0-148.6 17.3 46.1 53.8 62 77 A Y G > + 0 0 2 1,-0.2 3,-2.4 2,-0.1 4,-0.2 0.670 360.0 85.8 -60.4 -23.6 18.7 47.6 57.1 63 78 A I G > S+ 0 0 0 1,-0.3 3,-1.7 2,-0.2 -1,-0.2 0.758 74.9 68.7 -65.8 -22.2 16.1 50.3 57.4 64 79 A D G < S+ 0 0 48 -3,-1.1 -1,-0.3 1,-0.3 -2,-0.1 0.724 98.3 54.8 -63.4 -21.5 13.5 48.1 59.1 65 80 A Q G < S+ 0 0 114 -3,-2.4 -1,-0.3 -4,-0.2 -2,-0.2 0.466 80.8 108.7 -89.4 -3.8 15.8 48.1 62.1 66 81 A V < - 0 0 12 -3,-1.7 3,-0.1 -4,-0.2 6,-0.1 -0.641 66.0-133.7 -83.7 118.9 16.1 51.9 62.5 67 82 A P > - 0 0 75 0, 0.0 3,-1.6 0, 0.0 -2,-0.1 -0.361 29.6 -94.1 -66.9 146.1 14.3 53.3 65.6 68 83 A S T 3 S+ 0 0 90 1,-0.2 30,-0.2 30,-0.1 29,-0.2 -0.294 113.4 38.7 -48.6 141.9 12.0 56.3 65.3 69 84 A G T 3 S+ 0 0 24 28,-3.2 -19,-1.7 1,-0.3 -1,-0.2 0.333 89.7 132.9 92.5 -4.4 13.9 59.5 66.2 70 85 A S E < -d 50 0A 5 -3,-1.6 29,-2.6 -21,-0.2 30,-0.7 -0.386 50.5-148.9 -74.3 151.5 17.0 58.3 64.4 71 86 A V E -df 51 100A 0 -21,-2.4 -19,-2.3 28,-0.2 2,-0.4 -0.998 26.5-135.3-110.3 119.9 19.2 60.3 62.0 72 87 A I E -df 52 101A 0 28,-2.5 30,-2.9 -2,-0.5 2,-0.6 -0.642 17.3-164.7 -76.5 127.8 20.6 57.7 59.6 73 88 A V E -df 53 102A 0 -21,-2.8 -19,-2.5 -2,-0.4 2,-0.5 -0.956 9.0-169.8-116.0 110.4 24.3 58.2 59.0 74 89 A S E -df 54 103A 0 28,-3.0 30,-2.9 -2,-0.6 2,-0.6 -0.891 8.5-158.7-109.2 124.3 25.5 56.3 56.0 75 90 A S E +df 55 104A 2 -21,-3.0 -19,-2.7 -2,-0.5 30,-0.1 -0.889 21.7 161.2-103.6 125.4 29.1 55.9 55.1 76 91 A N > - 0 0 1 28,-2.1 3,-2.3 -2,-0.6 30,-0.1 -0.195 66.5 -95.4-137.2 41.2 29.9 55.0 51.4 77 92 A S T 3 S- 0 0 84 1,-0.3 28,-0.2 -21,-0.2 -2,-0.1 0.706 70.9 -74.9 52.0 24.9 33.6 55.9 51.1 78 93 A G T 3 S+ 0 0 19 26,-1.8 27,-0.3 1,-0.2 -1,-0.3 0.709 81.5 174.8 66.5 19.0 32.6 59.4 49.7 79 94 A R < - 0 0 51 -3,-2.3 27,-0.4 25,-0.5 -1,-0.2 -0.233 28.4-171.9 -64.5 144.4 31.7 57.7 46.4 80 95 A H S S+ 0 0 96 25,-0.1 368,-0.2 1,-0.1 -1,-0.1 0.326 73.9 73.5-114.4 2.2 30.1 59.6 43.6 81 96 A D S S+ 0 0 65 1,-0.1 2,-0.3 45,-0.1 364,-0.1 0.471 102.8 24.6 -99.8 -5.4 29.4 56.7 41.3 82 97 A C S S- 0 0 0 -6,-0.1 24,-0.6 51,-0.1 2,-0.3 -0.970 72.6-127.8-157.4 158.7 26.4 55.2 43.2 83 98 A T B -i 106 0B 4 45,-1.8 47,-0.4 -2,-0.3 24,-0.2 -0.846 9.0-166.2-118.3 149.4 23.7 56.4 45.6 84 99 A V S S+ 0 0 5 22,-1.7 2,-0.3 -2,-0.3 23,-0.2 0.038 76.4 47.2-122.5 23.1 22.7 55.0 49.1 85 100 A W + 0 0 4 21,-0.2 23,-3.0 18,-0.0 2,-0.2 -0.934 61.9 137.8-158.8 142.3 19.4 56.9 49.5 86 101 A G > - 0 0 5 -2,-0.3 4,-1.8 21,-0.2 5,-0.1 -0.789 62.2 -50.0-163.5-154.6 16.5 57.5 47.2 87 102 A D H > S+ 0 0 13 -2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.880 123.1 50.9 -67.9 -41.2 12.7 57.7 46.9 88 103 A I H > S+ 0 0 19 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.944 113.6 45.9 -61.4 -47.8 11.7 54.4 48.6 89 104 A X H > S+ 0 0 17 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.844 109.9 55.2 -67.6 -31.5 13.8 55.1 51.6 90 105 A T H X S+ 0 0 0 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.954 109.9 45.0 -63.5 -49.3 12.5 58.7 51.9 91 106 A H H X S+ 0 0 48 -4,-2.4 4,-1.3 1,-0.2 -2,-0.2 0.864 112.3 54.1 -65.0 -34.1 8.9 57.6 52.0 92 107 A F H X S+ 0 0 5 -4,-2.3 4,-0.9 -5,-0.2 3,-0.4 0.935 108.2 48.5 -59.7 -49.7 10.0 54.9 54.5 93 108 A A H >X>S+ 0 0 0 -4,-2.6 5,-1.7 1,-0.2 3,-0.9 0.935 109.2 52.6 -60.7 -39.8 11.6 57.5 56.8 94 109 A L H 3<5S+ 0 0 90 -4,-2.4 3,-0.2 1,-0.2 -1,-0.2 0.804 112.8 45.1 -66.7 -27.9 8.5 59.7 56.6 95 110 A A H 3<5S+ 0 0 53 -4,-1.3 -1,-0.2 -3,-0.4 -2,-0.2 0.545 117.9 43.2 -87.8 -9.8 6.3 56.7 57.7 96 111 A N H <<5S- 0 0 63 -4,-0.9 -2,-0.2 -3,-0.9 -1,-0.2 0.162 111.4-103.5-132.3 16.7 8.5 55.6 60.5 97 112 A G T <5 + 0 0 25 -4,-0.5 -28,-3.2 1,-0.2 2,-0.4 0.709 61.0 157.5 71.2 23.8 9.7 58.7 62.3 98 113 A I < - 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D 0 571I 4 -136,-2.2 -9,-0.2 -2,-0.4 -16,-0.1 -0.922 12.0-167.6-104.5 121.3 22.7 59.1 28.5 581 181 C V E - D 0 570I 0 -11,-2.6 -11,-2.5 -2,-0.5 5,-0.1 -0.940 26.9-119.4-109.8 117.7 20.5 56.5 26.8 582 182 C P >> - 0 0 29 0, 0.0 3,-1.8 0, 0.0 4,-0.6 -0.271 19.5-129.8 -57.8 136.1 22.0 55.0 23.6 583 183 C Q G >4 S+ 0 0 6 1,-0.3 3,-1.0 2,-0.2 4,-0.4 0.851 105.8 57.8 -58.0 -38.0 19.7 55.7 20.7 584 184 C Q G 34 S+ 0 0 56 1,-0.2 -1,-0.3 2,-0.1 4,-0.1 0.690 116.0 37.0 -67.4 -14.7 19.7 52.1 19.5 585 185 C L G <> S+ 0 0 34 -3,-1.8 4,-2.8 2,-0.1 5,-0.2 0.396 85.5 106.5-111.1 1.6 18.3 51.1 23.0 586 186 C A H S+ 0 0 63 -4,-0.4 4,-2.2 1,-0.2 -1,-0.2 0.915 116.6 46.8 -57.7 -45.3 12.6 52.3 23.2 588 188 C E H > S+ 0 0 75 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.894 112.3 49.7 -66.6 -40.8 13.7 49.3 25.2 589 189 C V H X S+ 0 0 0 -4,-2.8 4,-2.8 2,-0.2 -2,-0.2 0.915 110.3 50.4 -65.2 -40.1 15.2 51.4 28.1 590 190 C V H X S+ 0 0 0 -4,-2.5 4,-2.1 -5,-0.2 -2,-0.2 0.922 110.3 50.0 -66.1 -42.2 12.0 53.5 28.3 591 191 C L H X S+ 0 0 94 -4,-2.2 4,-1.4 -5,-0.2 -1,-0.2 0.927 113.6 45.5 -57.6 -46.5 9.9 50.4 28.5 592 192 C R H X S+ 0 0 89 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.906 110.4 53.9 -66.4 -38.3 12.1 48.9 31.2 593 193 C A H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.879 105.6 53.4 -64.1 -39.6 12.1 52.2 33.2 594 194 C R H X S+ 0 0 103 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.883 109.2 48.8 -62.1 -40.2 8.4 52.4 33.2 595 195 C A H X S+ 0 0 47 -4,-1.4 4,-2.4 2,-0.2 -2,-0.2 0.873 109.5 52.5 -66.0 -41.8 8.2 48.9 34.7 596 196 C V H X S+ 0 0 38 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.937 109.9 48.9 -57.4 -45.6 10.8 49.9 37.3 597 197 C E H X S+ 0 0 33 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.909 110.6 51.0 -63.0 -42.1 8.7 52.9 38.3 598 198 C Q H X S+ 0 0 83 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.947 111.0 46.6 -61.5 -49.6 5.6 50.8 38.5 599 199 C T H X S+ 0 0 52 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.904 114.8 48.5 -56.2 -44.5 7.2 48.2 40.8 600 200 C E H X S+ 0 0 20 -4,-2.4 4,-2.9 1,-0.2 -1,-0.2 0.841 104.8 57.4 -67.9 -37.2 8.6 50.9 43.0 601 201 C R H X S+ 0 0 134 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.905 108.0 48.0 -61.8 -39.3 5.4 52.8 43.3 602 202 C R H X S+ 0 0 108 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.906 110.7 51.5 -68.8 -37.9 3.7 49.7 44.8 603 203 C I H X S+ 0 0 14 -4,-1.8 4,-2.7 2,-0.2 5,-0.2 0.948 111.9 46.2 -62.9 -45.8 6.7 49.3 47.2 604 204 C I H X S+ 0 0 26 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.914 111.2 52.3 -59.8 -46.2 6.3 52.9 48.3 605 205 C E H < S+ 0 0 110 -4,-2.7 4,-0.3 -5,-0.2 -1,-0.2 0.911 110.7 49.6 -57.4 -40.4 2.5 52.5 48.6 606 206 C A H ><>S+ 0 0 11 -4,-2.5 5,-2.2 1,-0.2 3,-1.5 0.946 111.4 45.0 -64.8 -53.0 3.1 49.4 50.8 607 207 C I H ><5S+ 0 0 0 -4,-2.7 3,-1.1 1,-0.3 -1,-0.2 0.810 109.3 58.3 -63.0 -24.9 5.6 51.0 53.2 608 208 C S T 3<5S+ 0 0 70 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.502 104.3 52.7 -82.3 -3.7 3.3 54.0 53.4 609 209 C S T < 5S- 0 0 97 -3,-1.5 -1,-0.2 -4,-0.3 -2,-0.2 0.146 133.2 -88.8-111.5 15.3 0.6 51.7 54.6 610 210 C G T < 5S+ 0 0 62 -3,-1.1 -3,-0.2 1,-0.3 2,-0.2 0.565 77.6 144.6 91.8 12.2 2.9 50.2 57.4 611 211 C S < - 0 0 17 -5,-2.2 -1,-0.3 -6,-0.1 2,-0.1 -0.542 53.1-116.6 -69.9 145.4 4.6 47.4 55.6 612 212 C T > - 0 0 52 -2,-0.2 4,-2.2 1,-0.1 5,-0.1 -0.442 26.1-117.0 -66.5 157.9 8.2 46.7 56.5 613 213 C L H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.908 117.3 58.4 -63.8 -39.1 10.5 47.2 53.6 614 214 C E H > S+ 0 0 120 1,-0.2 4,-1.0 -553,-0.2 -1,-0.2 0.939 108.4 44.7 -52.0 -53.4 11.4 43.5 53.8 615 215 C Q H >> S+ 0 0 102 1,-0.2 4,-0.8 2,-0.2 3,-0.6 0.910 114.0 48.9 -56.6 -51.8 7.7 42.6 53.3 616 216 C A H >X S+ 0 0 0 -4,-2.2 4,-1.3 1,-0.2 3,-0.7 0.888 104.7 58.9 -58.3 -44.2 7.1 45.1 50.5 617 217 C R H 3< S+ 0 0 103 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.738 113.2 36.0 -64.4 -27.0 10.2 44.0 48.5 618 218 C X H << S+ 0 0 161 -4,-1.0 -1,-0.2 -3,-0.6 -2,-0.2 0.390 110.7 57.6-112.9 3.9 9.2 40.4 48.1 619 219 C T H << 0 0 94 -4,-0.8 -2,-0.2 -3,-0.7 -3,-0.1 0.591 360.0 360.0 -89.2 -17.7 5.5 40.9 47.7 620 220 C Y < 0 0 125 -4,-1.3 -3,-0.2 -5,-0.2 -2,-0.1 0.453 360.0 360.0-135.9 360.0 6.6 43.1 44.8