==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-APR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 05-MAR-10 3M1Y . COMPND 2 MOLECULE: PHOSPHOSERINE PHOSPHATASE (SERB); . SOURCE 2 ORGANISM_SCIENTIFIC: HELICOBACTER PYLORI; . AUTHOR B.SYED IBRAHIM,S.K.BURLEY,S.SWAMINATHAN,NEW YORK SGX . 823 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 35424.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 628 76.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 124 15.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 44 5.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.4 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 . 8 1.0 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 . 1 0.1 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 . 53 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 125 15.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 236 28.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 2.6 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 7 0 2 1 5 5 8 3 1 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 8 0 4 12 0 4 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 . 8 0 0 0 4 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 . 0 4 0 0 0 0 4 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 S 0 0 144 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 32.7 16.1 59.0 17.7 2 1 A L - 0 0 106 1,-0.1 2,-0.5 86,-0.0 0, 0.0 0.881 360.0-127.5 72.6 104.8 16.7 56.8 14.6 3 2 A Q - 0 0 67 148,-0.1 2,-0.3 147,-0.1 85,-0.2 -0.689 30.6-173.2 -84.9 123.0 19.4 54.2 14.8 4 3 A K E -a 88 0A 31 83,-3.0 85,-3.1 -2,-0.5 2,-0.4 -0.800 15.3-138.6-117.9 159.3 21.9 54.2 11.9 5 4 A L E -ab 89 157A 0 151,-2.7 153,-3.3 -2,-0.3 2,-0.4 -0.965 14.6-177.6-121.9 129.8 24.8 52.0 10.8 6 5 A A E -ab 90 158A 0 83,-3.0 85,-3.2 -2,-0.4 2,-0.4 -0.986 5.6-171.0-123.5 129.5 28.3 53.0 9.6 7 6 A V E -ab 91 159A 0 151,-2.2 153,-2.1 -2,-0.4 2,-0.4 -0.982 3.1-163.4-125.5 130.1 30.9 50.5 8.5 8 7 A F E -ab 92 160A 1 83,-2.7 85,-2.8 -2,-0.4 153,-0.2 -0.877 16.8-134.3-112.3 142.5 34.5 51.3 7.7 9 8 A D E -a 93 0A 4 151,-2.3 5,-0.3 -2,-0.4 85,-0.2 -0.464 22.1-146.1 -79.4 166.6 37.0 49.3 5.7 10 9 A F >>> + 0 0 1 83,-0.8 3,-1.9 3,-0.2 4,-1.9 0.878 69.1 67.5-101.2 -66.5 40.3 49.2 7.6 11 10 A D B 345S-h 15 0B 11 1,-0.3 151,-0.2 2,-0.2 7,-0.2 -0.389 122.2 -3.1 -64.1 127.2 43.4 49.1 5.3 12 11 A S T 345S+ 0 0 26 3,-1.7 -1,-0.3 5,-1.4 4,-0.2 0.691 131.4 66.5 63.4 20.7 43.8 52.3 3.3 13 12 A T T <45S+ 0 0 0 -3,-1.9 -2,-0.2 2,-0.5 -3,-0.2 0.522 118.4 8.8-128.6 -63.1 40.6 53.7 4.8 14 13 A L T <5S+ 0 0 1 -4,-1.9 59,-2.3 -5,-0.3 2,-0.4 0.867 136.5 41.6 -87.7 -43.1 41.1 54.2 8.6 15 14 A V B > - 0 0 62 -2,-0.3 4,-2.2 -7,-0.2 3,-0.9 -0.973 25.6-147.0-117.7 112.3 48.0 47.9 4.3 19 18 A T H 3> S+ 0 0 0 -2,-0.6 4,-1.6 1,-0.3 5,-0.2 0.840 94.1 52.4 -46.5 -50.4 48.5 45.7 7.4 20 19 A I H 3> S+ 0 0 11 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.829 112.1 48.3 -60.8 -32.5 49.8 42.6 5.6 21 20 A E H <> S+ 0 0 59 -3,-0.9 4,-2.4 2,-0.2 5,-0.3 0.956 108.2 50.1 -74.6 -49.8 52.4 44.7 3.9 22 21 A S H X S+ 0 0 33 -4,-2.2 4,-0.6 1,-0.3 -1,-0.2 0.805 114.3 49.6 -57.3 -26.5 53.7 46.5 7.0 23 22 A L H X S+ 0 0 0 -4,-1.6 4,-1.0 -5,-0.3 3,-0.3 0.905 107.6 53.8 -76.5 -44.6 53.9 43.0 8.4 24 23 A A H ><>S+ 0 0 0 -4,-1.9 5,-3.0 1,-0.2 3,-0.7 0.923 111.0 42.7 -57.9 -50.5 55.8 41.7 5.4 25 24 A R H 3<5S+ 0 0 148 -4,-2.4 -1,-0.2 3,-0.2 -2,-0.2 0.688 107.7 60.8 -74.2 -15.5 58.6 44.3 5.5 26 25 A A H 3<5S+ 0 0 43 -4,-0.6 -1,-0.2 -5,-0.3 -2,-0.2 0.737 113.7 37.3 -78.1 -22.2 58.9 44.1 9.2 27 26 A W T <<5S- 0 0 90 -4,-1.0 -2,-0.2 -3,-0.7 -1,-0.2 0.362 119.3-114.3-104.7 -3.3 59.8 40.4 8.7 28 27 A G T 5S+ 0 0 64 -4,-0.4 -3,-0.2 -5,-0.1 -4,-0.1 0.732 90.0 102.6 77.0 25.3 61.8 41.2 5.5 29 28 A V >>< + 0 0 29 -5,-3.0 4,-2.4 -6,-0.2 3,-0.9 0.126 36.6 116.8-123.2 20.4 59.6 39.4 3.0 30 29 A F H 3> S+ 0 0 35 -6,-0.5 4,-3.3 1,-0.2 5,-0.2 0.902 70.6 58.5 -57.2 -44.9 57.7 42.3 1.5 31 30 A D H 34 S+ 0 0 127 1,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.781 112.7 40.8 -59.1 -25.5 59.1 41.9 -2.0 32 31 A E H X> S+ 0 0 104 -3,-0.9 3,-0.8 2,-0.2 4,-0.7 0.910 116.0 47.8 -85.0 -48.8 57.7 38.4 -2.1 33 32 A V H >< S+ 0 0 0 -4,-2.4 3,-1.1 1,-0.2 -2,-0.2 0.880 103.4 64.1 -58.3 -40.4 54.3 39.2 -0.5 34 33 A K T 3< S+ 0 0 124 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.850 105.6 45.0 -51.8 -38.4 54.0 42.2 -2.8 35 34 A T T <4 S+ 0 0 103 -3,-0.8 2,-1.6 -4,-0.5 -1,-0.3 0.590 84.1 102.9 -85.3 -12.8 53.7 39.9 -5.8 36 35 A I << + 0 0 29 -3,-1.1 2,-0.2 -4,-0.7 15,-0.1 -0.554 38.8 129.3 -78.0 89.6 51.3 37.3 -4.3 37 36 A T - 0 0 66 -2,-1.6 5,-0.1 14,-0.0 2,-0.1 -0.732 37.4-167.2-142.9 87.8 48.1 38.3 -6.0 38 37 A L 0 0 72 5,-0.3 5,-2.1 -2,-0.2 9,-0.2 -0.380 360.0 360.0 -77.5 154.2 46.3 35.2 -7.5 39 38 A K 0 0 173 3,-0.3 -1,-0.1 -2,-0.1 5,-0.1 0.467 360.0 360.0-142.0 360.0 43.4 35.4 -10.0 40 ! 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 41 43 A E 0 0 127 0, 0.0 -2,-0.1 0, 0.0 -3,-0.1 0.000 360.0 360.0 360.0 19.5 39.4 38.8 -11.1 42 44 A T - 0 0 74 1,-0.2 2,-1.0 -5,-0.1 -3,-0.3 0.686 360.0-136.1 4.7 126.2 41.4 38.2 -7.8 43 45 A D > - 0 0 56 -5,-2.1 4,-1.8 1,-0.2 -5,-0.3 -0.845 22.0-173.4 -92.1 92.7 41.1 35.2 -5.6 44 46 A F H > S+ 0 0 48 -2,-1.0 4,-2.3 1,-0.2 5,-0.2 0.882 75.4 55.7 -61.6 -41.9 41.1 37.0 -2.2 45 47 A H H > S+ 0 0 27 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.922 111.4 38.2 -60.4 -52.2 41.2 33.8 -0.2 46 48 A K H > S+ 0 0 91 2,-0.2 4,-2.3 1,-0.2 5,-0.3 0.931 114.8 55.0 -67.7 -45.2 44.3 32.1 -1.6 47 49 A S H X S+ 0 0 4 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.937 111.2 45.7 -51.9 -51.4 46.2 35.4 -1.9 48 50 A L H X S+ 0 0 9 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.917 112.7 47.1 -58.8 -51.8 45.6 36.1 1.8 49 51 A I H X S+ 0 0 55 -4,-2.1 4,-1.4 1,-0.2 -1,-0.2 0.812 112.2 51.9 -65.2 -28.4 46.5 32.7 3.1 50 52 A L H X S+ 0 0 68 -4,-2.3 4,-1.0 2,-0.2 -1,-0.2 0.912 110.1 47.2 -74.0 -41.9 49.7 32.6 1.0 51 53 A R H >< S+ 0 0 53 -4,-2.1 3,-0.7 -5,-0.3 4,-0.3 0.913 110.1 53.8 -64.1 -42.3 50.9 36.0 2.2 52 54 A V H >< S+ 0 0 2 -4,-2.3 3,-2.0 1,-0.3 -1,-0.2 0.882 101.1 58.9 -61.4 -38.3 50.2 35.0 5.8 53 55 A S H >< S+ 0 0 58 -4,-1.4 3,-2.1 1,-0.3 -1,-0.3 0.810 92.1 68.7 -61.4 -29.4 52.3 31.9 5.5 54 56 A K T << S+ 0 0 73 -4,-1.0 -1,-0.3 -3,-0.7 -2,-0.2 0.637 94.2 61.3 -63.1 -11.9 55.3 34.1 4.5 55 57 A L T X S+ 0 0 0 -3,-2.0 3,-2.2 -4,-0.3 -1,-0.3 0.271 72.3 145.7 -98.4 8.8 55.0 35.2 8.2 56 58 A K T < S+ 0 0 117 -3,-2.1 70,-0.2 1,-0.3 -3,-0.1 -0.254 72.2 10.9 -55.0 130.1 55.7 31.8 9.7 57 59 A N T 3 S+ 0 0 99 68,-3.5 -1,-0.3 1,-0.3 69,-0.1 0.289 83.6 148.8 84.8 -4.6 57.6 32.1 13.0 58 60 A X < - 0 0 0 -3,-2.2 67,-3.3 67,-0.2 -1,-0.3 -0.389 55.7-111.7 -60.0 122.5 57.3 35.8 13.3 59 61 A P B > -C 124 0A 49 0, 0.0 4,-2.2 0, 0.0 65,-0.3 -0.298 16.4-131.5 -60.0 144.4 57.2 36.5 17.0 60 62 A L H > S+ 0 0 46 63,-2.1 4,-3.3 1,-0.2 5,-0.3 0.868 104.0 59.8 -62.3 -41.0 53.9 37.8 18.3 61 63 A K H > S+ 0 0 142 62,-0.4 4,-1.8 1,-0.2 -1,-0.2 0.906 110.1 44.5 -57.3 -40.0 55.3 40.8 20.2 62 64 A L H > S+ 0 0 54 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.972 114.3 46.2 -67.5 -55.1 56.7 42.0 16.9 63 65 A A H X S+ 0 0 0 -4,-2.2 4,-2.9 1,-0.2 -2,-0.2 0.907 114.4 49.3 -53.2 -45.2 53.6 41.4 14.8 64 66 A K H X S+ 0 0 95 -4,-3.3 4,-2.2 2,-0.2 -1,-0.2 0.878 110.5 51.0 -61.7 -40.1 51.5 43.0 17.6 65 67 A E H < S+ 0 0 49 -4,-1.8 4,-0.3 -5,-0.3 -2,-0.2 0.914 113.0 44.9 -64.1 -45.9 53.9 46.0 17.7 66 68 A V H >< S+ 0 0 25 -4,-2.7 3,-1.2 1,-0.2 -2,-0.2 0.927 114.4 49.1 -64.5 -46.5 53.6 46.5 13.9 67 69 A C H >< S+ 0 0 0 -4,-2.9 3,-0.7 1,-0.2 -2,-0.2 0.837 111.2 48.4 -64.4 -34.3 49.9 46.1 13.9 68 70 A E T 3< S+ 0 0 50 -4,-2.2 539,-0.5 1,-0.2 -1,-0.2 0.406 108.1 58.4 -87.6 4.9 49.3 48.6 16.8 69 71 A S T < + 0 0 23 -3,-1.2 540,-0.4 -4,-0.3 -1,-0.2 0.208 67.9 133.0-118.1 13.6 51.5 51.2 15.1 70 72 A L < - 0 0 5 -3,-0.7 2,-0.4 -4,-0.1 -53,-0.1 -0.362 62.5-109.7 -64.6 143.1 49.9 51.8 11.7 71 73 A P - 0 0 45 0, 0.0 -55,-2.8 0, 0.0 2,-0.1 -0.637 30.8-138.9 -79.7 130.4 49.5 55.5 10.8 72 74 A L B -I 15 0B 17 -2,-0.4 -57,-0.3 543,-0.3 2,-0.2 -0.455 17.3-112.8 -83.2 158.2 45.9 56.7 10.9 73 75 A F > - 0 0 16 -59,-2.3 3,-1.2 -2,-0.1 124,-0.1 -0.524 45.4 -91.4 -82.9 158.7 44.5 59.1 8.3 74 76 A E B 3 S+j 197 0C 68 122,-0.8 124,-3.1 1,-0.2 125,-0.4 -0.401 110.1 29.8 -71.7 150.0 43.6 62.6 9.5 75 77 A G T 3> S+ 0 0 9 123,-0.2 4,-3.3 122,-0.2 5,-0.3 0.375 80.9 127.2 84.4 -4.5 40.0 63.2 10.8 76 78 A A H <> S+ 0 0 0 -3,-1.2 4,-2.3 2,-0.2 3,-0.3 0.957 78.2 33.6 -46.5 -70.5 39.8 59.6 11.9 77 79 A L H > S+ 0 0 23 541,-1.5 4,-2.9 1,-0.2 5,-0.3 0.904 118.7 54.5 -53.9 -46.9 38.7 60.2 15.5 78 80 A E H > S+ 0 0 59 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.864 109.5 47.2 -55.8 -43.1 36.7 63.4 14.4 79 81 A L H X S+ 0 0 4 -4,-3.3 4,-2.0 -3,-0.3 -1,-0.2 0.946 113.1 47.9 -66.3 -50.0 34.7 61.4 11.8 80 82 A V H X S+ 0 0 0 -4,-2.3 4,-2.4 -5,-0.3 -2,-0.2 0.909 112.7 47.5 -59.9 -44.8 33.9 58.6 14.2 81 83 A S H X S+ 0 0 52 -4,-2.9 4,-2.2 1,-0.2 -1,-0.2 0.900 110.9 52.5 -63.7 -38.8 32.8 60.9 17.1 82 84 A A H < S+ 0 0 17 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.856 110.5 48.7 -64.3 -35.0 30.7 62.9 14.6 83 85 A L H ><>S+ 0 0 14 -4,-2.0 3,-1.3 1,-0.2 5,-1.2 0.922 111.3 48.1 -71.6 -43.6 29.0 59.6 13.5 84 86 A K H ><5S+ 0 0 69 -4,-2.4 3,-1.6 1,-0.3 -2,-0.2 0.854 104.3 59.9 -65.9 -34.2 28.3 58.4 17.1 85 87 A E T 3<5S+ 0 0 163 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.551 103.1 55.4 -72.0 -4.0 26.9 61.8 18.1 86 88 A K T < 5S- 0 0 143 -3,-1.3 -1,-0.3 -5,-0.1 -2,-0.2 -0.011 126.9 -96.4-116.8 28.7 24.3 61.2 15.3 87 89 A N T < 5S+ 0 0 62 -3,-1.6 -83,-3.0 1,-0.2 2,-0.4 0.859 73.9 150.1 61.0 40.7 23.1 57.9 16.6 88 90 A Y E < -a 4 0A 34 -5,-1.2 2,-0.6 -85,-0.2 -83,-0.2 -0.846 46.3-139.2-103.0 138.2 25.3 55.8 14.3 89 91 A K E -a 5 0A 37 -85,-3.1 -83,-3.0 -2,-0.4 2,-0.6 -0.871 28.3-149.2 -90.4 124.7 26.6 52.4 15.4 90 92 A V E +a 6 0A 0 -2,-0.6 21,-2.4 -85,-0.2 22,-0.9 -0.903 23.4 170.4-107.5 119.1 30.2 52.6 14.1 91 93 A V E -ad 7 112A 0 -85,-3.2 -83,-2.7 -2,-0.6 2,-0.4 -0.862 22.3-143.4-125.1 157.6 31.8 49.3 12.9 92 94 A C E -ad 8 113A 2 20,-1.7 22,-2.6 -2,-0.3 2,-0.4 -0.979 7.7-164.7-126.8 130.4 34.9 48.2 11.1 93 95 A F E +ad 9 114A 0 -85,-2.8 -83,-0.8 -2,-0.4 2,-0.4 -0.918 14.6 178.4-110.3 134.9 35.4 45.4 8.6 94 96 A S E - 0 0 0 20,-2.6 39,-0.3 -2,-0.4 22,-0.3 -0.946 38.6-160.4-147.4 126.8 38.8 44.1 7.7 95 97 A G E S+ 0 0 13 -2,-0.4 20,-0.1 20,-0.1 -1,-0.1 0.534 89.7 76.6 -71.8 -2.5 40.3 41.5 5.4 96 98 A G E S- 0 0 4 1,-0.1 20,-2.3 20,-0.0 2,-0.3 0.319 93.5 -71.2 -84.6-142.8 43.2 42.1 7.8 97 99 A F E >> - d 0 116A 1 18,-0.2 4,-2.3 1,-0.1 3,-1.0 -0.884 20.3-127.3-127.3 152.3 43.8 41.0 11.4 98 100 A D H 3> S+ 0 0 38 18,-2.4 4,-2.6 -2,-0.3 5,-0.4 0.613 102.6 74.1 -70.5 -11.1 42.4 41.8 14.8 99 101 A L H 3> S+ 0 0 36 17,-0.3 4,-0.7 2,-0.2 -1,-0.3 0.934 113.7 31.1 -62.4 -39.4 45.8 42.4 16.3 100 102 A A H X> S+ 0 0 0 -3,-1.0 4,-1.8 2,-0.1 3,-0.5 0.975 123.7 45.2 -77.7 -60.3 45.4 45.6 14.3 101 103 A T H 3X S+ 0 0 2 -4,-2.3 4,-1.8 1,-0.2 -3,-0.2 0.769 107.9 56.8 -58.7 -32.8 41.6 46.0 14.4 102 104 A N H 3X S+ 0 0 62 -4,-2.6 4,-1.7 2,-0.2 -1,-0.2 0.908 108.2 48.7 -66.0 -39.7 41.2 45.4 18.1 103 105 A H H S+ 0 0 51 -4,-1.8 5,-2.4 -5,-0.2 4,-0.7 0.935 111.4 39.6 -65.7 -43.7 38.6 49.7 17.7 106 108 A D H <5S+ 0 0 95 -4,-1.7 -2,-0.2 3,-0.2 -1,-0.2 0.904 116.5 50.7 -70.1 -42.0 39.5 50.7 21.3 107 109 A L H <5S+ 0 0 22 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.844 120.8 33.3 -64.7 -37.6 41.4 53.8 20.2 108 110 A L H <5S- 0 0 1 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.472 108.0-122.3 -97.8 -3.5 38.6 55.1 18.0 109 111 A H T <5 + 0 0 97 -4,-0.7 -3,-0.2 -5,-0.2 2,-0.2 0.915 44.3 178.4 61.3 44.3 35.9 53.8 20.3 110 112 A L < - 0 0 4 -5,-2.4 -19,-0.2 -6,-0.3 -1,-0.2 -0.508 35.4-130.0 -73.6 146.7 34.3 51.7 17.5 111 113 A D S S- 0 0 14 -21,-2.4 2,-0.3 1,-0.2 -20,-0.2 0.785 82.4 -14.6 -69.9 -26.1 31.3 49.7 18.6 112 114 A A E -d 91 0A 2 -22,-0.9 -20,-1.7 243,-0.1 2,-0.3 -0.983 53.5-151.4-169.0 162.9 32.9 46.6 16.9 113 115 A A E -d 92 0A 9 -2,-0.3 2,-0.4 -22,-0.2 -20,-0.2 -0.992 7.5-165.9-142.5 141.1 35.5 45.2 14.5 114 116 A F E +d 93 0A 2 -22,-2.6 -20,-2.6 -2,-0.3 2,-0.2 -0.959 32.9 121.6-134.2 115.1 35.4 42.1 12.4 115 117 A S E - 0 0 3 -2,-0.4 17,-1.8 -22,-0.2 -18,-0.2 -0.654 55.9 -74.8-146.6-157.7 38.5 40.8 10.8 116 118 A N E -dE 97 131A 0 -20,-2.3 -18,-2.4 -22,-0.3 2,-0.4 -0.607 36.3-118.1-110.2 173.3 40.6 37.6 10.8 117 119 A T E - E 0 130A 51 13,-3.4 13,-1.4 -20,-0.2 2,-0.9 -0.925 8.6-140.1-116.9 135.5 43.0 36.0 13.3 118 120 A L E - E 0 129A 7 -2,-0.4 11,-0.2 11,-0.2 2,-0.1 -0.821 35.1-125.5 -91.5 107.9 46.8 35.3 12.8 119 121 A I E - 0 0 20 9,-1.7 7,-2.5 -2,-0.9 9,-0.4 -0.319 26.2-154.0 -60.6 128.9 47.1 31.9 14.5 120 122 A V E - 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0 0 7 -5,-1.8 -1,-0.2 -6,-0.1 -2,-0.1 -0.984 39.8-131.7-130.8 119.2 46.0 86.8 32.0 778 155 D S > - 0 0 55 -2,-0.4 3,-0.7 1,-0.1 -151,-0.2 -0.019 22.5-110.8 -65.0 165.9 47.3 90.4 31.5 779 156 D K G > S+ 0 0 92 1,-0.2 3,-1.8 2,-0.2 20,-0.8 0.867 119.1 62.4 -63.5 -36.1 49.2 92.6 33.8 780 157 D T G 3 S+ 0 0 90 1,-0.3 -1,-0.2 18,-0.2 18,-0.1 0.767 107.2 42.7 -62.0 -26.9 46.1 94.8 33.9 781 158 D N G < S+ 0 0 46 -3,-0.7 -154,-2.7 18,-0.1 2,-0.5 0.146 95.6 102.4-107.1 19.0 44.2 91.9 35.4 782 159 D T E < -f 627 0J 2 -3,-1.8 17,-2.4 -156,-0.2 18,-1.4 -0.900 47.8-170.6-110.0 127.0 46.9 90.8 37.9 783 160 D L E -fj 628 800J 8 -156,-3.4 -154,-2.8 -2,-0.5 2,-0.3 -0.944 8.7-170.3-114.7 133.2 46.9 91.6 41.6 784 161 D V E -fj 629 801J 0 16,-2.9 18,-3.1 -2,-0.4 2,-0.4 -0.925 9.9-167.3-127.0 150.8 49.9 91.0 43.7 785 162 D V E +fj 630 802J 0 -156,-2.1 -154,-1.8 -2,-0.3 2,-0.3 -0.973 21.9 146.2-139.8 120.4 50.6 91.0 47.5 786 163 D G E - j 0 803J 0 16,-1.7 18,-1.3 -2,-0.4 20,-0.1 -0.970 33.9-157.2-150.2 164.5 54.0 91.0 49.2 787 164 D D + 0 0 11 -2,-0.3 20,-1.0 -154,-0.3 23,-0.2 0.707 69.2 59.1-115.6 -30.8 56.0 92.2 52.3 788 165 D G S > S- 0 0 6 18,-0.2 3,-0.8 22,-0.1 4,-0.2 -0.368 88.6-100.2-100.1 179.3 59.7 92.2 51.4 789 166 D A G > S+ 0 0 57 1,-0.2 3,-1.1 2,-0.2 4,-0.2 0.731 118.8 66.2 -66.5 -22.3 62.1 93.7 48.9 790 167 D N G > S+ 0 0 73 1,-0.2 3,-1.5 2,-0.2 4,-0.4 0.846 88.3 66.5 -66.9 -34.1 61.9 90.4 47.0 791 168 D D G <> S+ 0 0 0 -3,-0.8 4,-1.6 1,-0.3 3,-0.4 0.567 77.8 85.7 -65.6 -8.3 58.3 91.0 46.2 792 169 D L H <> S+ 0 0 26 -3,-1.1 4,-1.2 1,-0.2 -1,-0.3 0.825 80.2 61.4 -64.1 -30.1 59.3 93.9 44.0 793 170 D S H <4 S+ 0 0 7 -3,-1.5 3,-0.3 1,-0.2 4,-0.3 0.893 104.3 48.0 -63.7 -39.0 59.8 91.5 41.1 794 171 D X H >4 S+ 0 0 0 -3,-0.4 3,-1.8 -4,-0.4 -1,-0.2 0.890 104.5 61.9 -66.1 -39.3 56.1 90.6 41.2 795 172 D F H >< S+ 0 0 3 -4,-1.6 3,-1.5 1,-0.3 -1,-0.2 0.811 89.2 70.1 -55.9 -33.6 55.2 94.3 41.4 796 173 D K T 3< S+ 0 0 120 -4,-1.2 -1,-0.3 -3,-0.3 -2,-0.2 0.736 107.1 36.2 -59.3 -23.0 56.8 94.8 38.0 797 174 D H T < S+ 0 0 44 -3,-1.8 2,-0.3 -4,-0.3 -1,-0.3 -0.020 101.1 88.8-123.9 32.4 53.9 92.9 36.3 798 175 D A < - 0 0 0 -3,-1.5 -15,-0.2 1,-0.1 3,-0.2 -0.919 54.5-156.0-129.5 154.1 50.9 93.7 38.3 799 176 D H S S+ 0 0 109 -17,-2.4 2,-0.7 -20,-0.8 -16,-0.2 0.864 93.9 44.6 -89.3 -48.5 48.2 96.5 38.1 800 177 D I E S-j 783 0J 36 -18,-1.4 -16,-2.9 -21,-0.3 2,-0.7 -0.885 74.1-174.8-102.1 109.8 47.3 96.3 41.8 801 178 D K E -j 784 0J 44 -2,-0.7 14,-2.2 -18,-0.2 15,-1.8 -0.884 4.1-167.6-112.7 103.2 50.4 96.1 44.0 802 179 D I E -jk 785 816J 1 -18,-3.1 -16,-1.7 -2,-0.7 2,-0.5 -0.628 11.9-159.9 -90.8 144.8 49.7 95.6 47.7 803 180 D A E -jk 786 817J 0 13,-1.0 15,-2.7 -2,-0.3 2,-0.8 -0.962 12.5-163.4-124.1 104.7 52.3 95.9 50.4 804 181 D F E S- k 0 818J 0 -18,-1.3 15,-0.2 -2,-0.5 13,-0.1 -0.832 73.3 -33.1 -97.8 102.9 51.0 94.0 53.5 805 182 D N S S+ 0 0 47 13,-2.3 -1,-0.2 -2,-0.8 14,-0.1 0.906 106.8 157.3 50.9 45.9 53.0 95.1 56.6 806 183 D A - 0 0 15 -3,-0.2 2,-0.4 -20,-0.1 -18,-0.2 0.204 46.5 -89.2 -83.8-160.6 55.9 95.6 54.3 807 184 D K >> - 0 0 106 -20,-1.0 3,-2.3 1,-0.1 4,-1.9 -0.885 37.0-114.2-115.5 144.3 59.1 97.5 54.2 808 185 D E H 3> S+ 0 0 144 -2,-0.4 4,-2.7 1,-0.3 5,-0.2 0.812 114.1 72.0 -49.1 -35.1 59.3 101.0 52.7 809 186 D V H 34 S+ 0 0 83 1,-0.2 -1,-0.3 2,-0.2 4,-0.1 0.890 111.0 32.4 -49.7 -37.3 61.5 99.6 50.0 810 187 D L H X> S+ 0 0 0 -3,-2.3 3,-2.6 -23,-0.2 4,-2.1 0.927 114.5 55.8 -83.8 -52.7 58.2 98.0 48.8 811 188 D K H 3< S+ 0 0 30 -4,-1.9 -2,-0.2 1,-0.3 -3,-0.2 0.735 94.4 70.2 -54.1 -26.0 55.7 100.6 49.9 812 189 D Q T 3< S+ 0 0 149 -4,-2.7 -1,-0.3 -5,-0.2 -2,-0.1 0.711 114.9 26.9 -66.3 -18.1 57.5 103.2 47.9 813 190 D H T <4 S+ 0 0 91 -3,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.658 97.9 109.6-113.3 -27.8 56.3 101.4 44.8 814 191 D A < - 0 0 20 -4,-2.1 -12,-0.2 1,-0.1 3,-0.1 -0.084 58.0-148.7 -51.9 147.6 53.1 99.8 46.1 815 192 D T S S+ 0 0 65 -14,-2.2 2,-0.3 1,-0.2 -13,-0.2 0.759 85.7 21.0 -87.9 -30.0 49.7 101.1 44.8 816 193 D H E S-k 802 0J 86 -15,-1.8 -13,-1.0 2,-0.0 2,-0.4 -0.942 71.3-151.4-135.8 156.0 48.1 100.2 48.1 817 194 D C E -k 803 0J 53 -2,-0.3 2,-0.5 -15,-0.2 -13,-0.2 -0.987 7.5-165.0-133.3 142.7 49.3 99.7 51.7 818 195 D I E +k 804 0J 21 -15,-2.7 -13,-2.3 -2,-0.4 -12,-0.1 -0.853 14.4 168.7-127.3 91.8 48.0 97.6 54.5 819 196 D N + 0 0 115 -2,-0.5 -1,-0.1 -15,-0.2 -15,-0.1 0.470 58.1 91.1 -81.5 -2.3 49.8 98.6 57.7 820 197 D E S S- 0 0 118 2,-0.2 2,-2.9 1,-0.1 5,-0.1 -0.825 84.8-126.5 -98.2 131.9 47.2 96.6 59.6 821 198 D P S S+ 0 0 64 0, 0.0 -122,-0.6 0, 0.0 2,-0.3 -0.232 78.4 100.0 -70.8 52.8 48.1 92.9 60.4 822 199 D D B -n 699 0L 54 -2,-2.9 3,-0.3 -124,-0.1 -2,-0.2 -0.923 53.1-162.5-148.5 119.9 44.9 91.7 58.8 823 200 D L S S+ 0 0 1 -124,-2.1 -122,-0.1 -2,-0.3 -121,-0.1 -0.106 80.2 62.6 -77.7-171.1 44.0 90.2 55.4 824 201 D A S S+ 0 0 29 -123,-0.1 -1,-0.2 1,-0.1 -124,-0.1 0.644 86.9 88.7 63.5 7.9 40.4 90.2 54.4 825 202 D L S S+ 0 0 77 -3,-0.3 -2,-0.1 2,-0.1 -1,-0.1 0.357 80.6 54.9-110.8 -5.2 41.0 94.0 54.7 826 203 D I S > S+ 0 0 9 1,-0.1 3,-2.8 2,-0.1 -3,-0.1 0.544 81.7 89.3 -98.9 -18.7 42.0 94.0 51.0 827 204 D K T 3 S+ 0 0 111 1,-0.3 -1,-0.1 2,-0.2 -2,-0.1 0.893 80.6 61.4 -47.4 -38.0 38.8 92.4 50.2 828 205 D P T 3 0 0 99 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.705 360.0 360.0 -64.5 -20.4 37.5 96.0 49.9 829 206 D L < 0 0 75 -3,-2.8 -2,-0.2 -4,-0.0 -3,-0.1 0.751 360.0 360.0 -89.9 360.0 40.0 96.7 47.1