==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-NOV-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 01-MAY-07 2PQ5 . COMPND 2 MOLECULE: DUAL SPECIFICITY PROTEIN PHOSPHATASE 13; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR E.UGOCHUKWU,E.SALAH,P.SAVITSKY,A.BARR,N.PANTIC,F.NIESEN,N.BU . 675 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27573.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 496 73.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 60 8.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 35 5.2 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 . 57 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 82 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 235 34.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.2 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 2 5 1 3 4 2 2 0 1 8 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 12 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 . 4 1 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 0 ANTIPARALLEL BRIDGES PER LADDER . 1 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 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 25 A P 0 0 164 0, 0.0 2,-0.1 0, 0.0 160,-0.0 0.000 360.0 360.0 360.0 102.2 -31.6 -8.9 -14.3 2 26 A P - 0 0 40 0, 0.0 2,-0.2 0, 0.0 3,-0.0 -0.334 360.0-131.2 -77.0 155.4 -29.0 -9.6 -11.5 3 27 A T > - 0 0 90 1,-0.1 4,-1.1 -2,-0.1 5,-0.1 -0.482 28.6-108.4 -89.0 171.1 -29.2 -12.3 -8.8 4 28 A L H >> S+ 0 0 52 1,-0.2 4,-2.1 2,-0.2 3,-1.5 0.984 119.0 55.4 -62.0 -55.7 -28.6 -11.5 -5.1 5 29 A A H 3> S+ 0 0 63 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.804 103.5 55.5 -41.9 -40.8 -25.3 -13.3 -5.2 6 30 A S H 3> S+ 0 0 47 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.875 110.1 45.3 -67.5 -33.6 -24.1 -11.1 -8.0 7 31 A L H S-B 29 0B 62 3,-1.2 3,-2.9 121,-0.1 -1,-0.5 -0.880 110.5 -59.6-172.8 143.4 -22.9 11.9 -4.7 27 51 A P T 3 S- 0 0 87 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 -0.114 124.0 -6.9 -40.2 111.9 -22.8 15.7 -5.1 28 52 A S T 3 S+ 0 0 44 1,-0.2 82,-2.9 81,-0.1 2,-0.5 0.673 113.6 110.6 73.6 19.4 -24.1 17.3 -1.9 29 53 A L E < -Bc 26 110B 0 -3,-2.9 -4,-2.8 80,-0.2 -3,-1.2 -0.944 47.3-171.5-133.1 113.3 -25.1 13.8 -0.7 30 54 A F E -Bc 24 111B 19 80,-3.5 82,-3.9 -2,-0.5 2,-0.5 -0.865 17.5-154.3-112.9 137.9 -23.3 12.2 2.2 31 55 A L E +Bc 23 112B 0 -8,-3.4 -8,-1.5 -2,-0.4 2,-0.2 -0.957 34.1 166.1-102.8 120.9 -23.5 8.8 3.8 32 56 A G E -Bc 22 113B 0 80,-2.0 82,-1.2 -2,-0.5 -10,-0.3 -0.783 31.4-123.3-132.7 172.0 -22.4 8.9 7.4 33 57 A D > - 0 0 4 -12,-1.9 4,-1.9 -2,-0.2 83,-0.2 -0.485 43.3 -93.8-106.7-178.3 -22.4 7.0 10.7 34 58 A A H > S+ 0 0 12 81,-2.2 4,-1.3 2,-0.2 5,-0.1 0.827 125.2 58.0 -71.5 -28.8 -23.8 7.9 14.1 35 59 A Y H >> S+ 0 0 48 80,-0.5 3,-0.9 2,-0.2 4,-0.8 0.965 110.5 41.0 -54.9 -57.9 -20.4 9.3 15.1 36 60 A A H 34 S+ 0 0 3 1,-0.2 3,-0.4 -15,-0.2 -2,-0.2 0.827 108.9 66.1 -57.5 -33.5 -20.5 11.7 12.2 37 61 A A H 3< S+ 0 0 0 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.824 109.8 33.3 -54.7 -38.7 -24.2 12.1 13.1 38 62 A R H << S+ 0 0 61 -4,-1.3 2,-2.2 -3,-0.9 -1,-0.2 0.432 87.7 107.0-104.4 -2.3 -23.2 13.8 16.4 39 63 A D >X + 0 0 32 -4,-0.8 4,-2.2 -3,-0.4 3,-0.6 -0.401 45.6 175.0 -73.9 58.4 -20.1 15.5 15.0 40 64 A K H 3> S+ 0 0 82 -2,-2.2 4,-1.6 1,-0.3 -1,-0.2 0.715 71.9 55.2 -33.1 -42.5 -21.9 18.8 15.0 41 65 A S H 3> S+ 0 0 92 2,-0.2 4,-2.4 1,-0.2 -1,-0.3 0.956 107.0 43.7 -68.9 -53.5 -18.7 20.5 14.0 42 66 A K H <> S+ 0 0 65 -3,-0.6 4,-3.0 1,-0.3 5,-0.2 0.903 110.0 60.2 -61.6 -34.8 -17.9 18.6 10.8 43 67 A L H X>S+ 0 0 6 -4,-2.2 5,-1.7 2,-0.2 4,-1.1 0.930 106.6 46.3 -48.4 -50.0 -21.6 19.0 10.0 44 68 A I H ><5S+ 0 0 72 -4,-1.6 3,-0.9 -3,-0.2 -2,-0.2 0.946 110.9 52.4 -60.6 -53.5 -20.9 22.7 10.1 45 69 A Q H 3<5S+ 0 0 151 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.909 111.5 45.4 -38.7 -62.2 -17.8 22.3 7.9 46 70 A L H 3<5S- 0 0 51 -4,-3.0 -1,-0.3 -5,-0.1 -2,-0.2 0.626 106.6-127.8 -67.2 -19.9 -19.7 20.4 5.3 47 71 A G T <<5 - 0 0 40 -4,-1.1 62,-0.2 -3,-0.9 -3,-0.2 0.797 36.3-173.4 72.5 32.1 -22.6 22.8 5.3 48 72 A I < + 0 0 11 -5,-1.7 62,-0.2 -6,-0.2 -1,-0.2 -0.339 16.6 179.1 -60.6 134.6 -25.2 20.1 5.8 49 73 A T + 0 0 30 60,-2.9 25,-3.4 1,-0.3 2,-0.3 0.537 67.4 35.1-110.0 -15.6 -28.8 21.4 5.6 50 74 A H E -de 74 110B 33 59,-1.2 61,-3.2 23,-0.2 2,-0.5 -0.997 61.8-160.7-146.9 130.2 -30.6 18.1 6.1 51 75 A V E -de 75 111B 0 23,-2.5 25,-2.6 -2,-0.3 2,-0.7 -0.975 5.2-159.1-118.1 128.6 -29.9 15.1 8.2 52 76 A V E -de 76 112B 0 59,-4.3 61,-3.2 -2,-0.5 2,-0.9 -0.915 6.2-166.1-106.5 106.1 -31.5 11.8 7.5 53 77 A N E > +de 77 113B 0 23,-3.0 25,-3.4 -2,-0.7 3,-0.6 -0.826 14.9 171.5 -91.0 103.3 -31.4 9.6 10.5 54 78 A A T 3 S+ 0 0 0 59,-3.1 26,-0.7 -2,-0.9 60,-0.2 0.469 80.6 55.7 -91.3 -2.9 -32.3 6.1 9.3 55 79 A A B 3 S+F 79 0C 0 58,-0.4 6,-2.4 59,-0.2 -1,-0.2 -0.206 83.5 150.7-111.8 35.6 -31.3 4.7 12.7 56 80 A A < + 0 0 5 22,-1.5 6,-0.2 -3,-0.6 2,-0.1 -0.383 17.5 86.3 -78.0 152.0 -33.7 7.0 14.5 57 81 A G S > S- 0 0 12 4,-0.4 3,-2.6 3,-0.1 6,-0.1 -0.305 80.8 -96.7 133.5 144.9 -35.4 6.1 17.8 58 82 A K T 3 S+ 0 0 33 1,-0.3 4,-0.3 -2,-0.1 -1,-0.1 0.841 126.4 52.6 -52.4 -36.4 -34.8 6.3 21.5 59 83 A F T 3 S+ 0 0 2 2,-0.1 -1,-0.3 435,-0.1 604,-0.3 0.460 122.5 26.0 -81.1 0.0 -33.6 2.7 21.3 60 84 A Q S < S- 0 0 42 -3,-2.6 2,-1.8 602,-0.1 -4,-0.2 -0.148 128.3 -15.6-133.9-134.2 -31.2 3.6 18.5 61 85 A V - 0 0 12 -6,-2.4 2,-2.2 1,-0.1 3,-0.4 -0.576 66.1-168.1 -81.6 86.8 -29.3 6.7 17.4 62 86 A D + 0 0 79 -2,-1.8 -1,-0.1 -4,-0.3 -6,-0.1 -0.441 42.4 123.6 -78.6 68.6 -31.4 9.1 19.5 63 87 A T > + 0 0 7 -2,-2.2 4,-1.4 -6,-0.1 -1,-0.2 0.904 37.3 160.7 -91.5 -56.0 -30.3 12.4 18.0 64 88 A G H > - 0 0 16 -3,-0.4 4,-0.5 1,-0.2 3,-0.2 0.133 61.6 -57.5 63.1 179.6 -33.6 13.9 16.9 65 89 A A H >4 S+ 0 0 70 1,-0.2 3,-0.6 2,-0.2 -1,-0.2 0.790 131.8 60.7 -60.7 -34.7 -34.5 17.4 16.1 66 90 A K H >4 S+ 0 0 107 1,-0.2 3,-2.2 2,-0.2 -1,-0.2 0.847 92.3 63.6 -67.9 -38.3 -33.5 18.6 19.6 67 91 A F H 3< S+ 0 0 43 -4,-1.4 -1,-0.2 1,-0.3 -2,-0.2 0.797 103.9 49.6 -58.1 -26.6 -29.9 17.5 19.2 68 92 A Y T X< S+ 0 0 7 -3,-0.6 3,-1.9 -4,-0.5 -1,-0.3 0.283 80.9 151.1 -98.9 12.6 -29.5 20.0 16.4 69 93 A R T < S+ 0 0 77 -3,-2.2 2,-0.2 1,-0.3 3,-0.1 -0.100 71.4 13.4 -47.5 133.4 -31.0 22.8 18.5 70 94 A G T 3 S+ 0 0 86 1,-0.3 -1,-0.3 3,-0.1 -2,-0.1 -0.123 103.0 114.6 86.6 -36.7 -29.6 26.2 17.4 71 95 A M S < S- 0 0 59 -3,-1.9 2,-1.5 -2,-0.2 -1,-0.3 -0.351 73.9-124.8 -65.3 141.7 -28.1 24.6 14.3 72 96 A S S S+ 0 0 126 -3,-0.1 2,-0.3 -24,-0.1 -1,-0.1 -0.609 71.2 104.6 -92.9 78.8 -29.5 25.8 11.0 73 97 A L - 0 0 28 -2,-1.5 2,-0.3 -5,-0.2 -23,-0.2 -0.994 61.7-125.7-155.2 151.1 -30.5 22.4 9.6 74 98 A E E -d 50 0B 129 -25,-3.4 -23,-2.5 -2,-0.3 2,-0.4 -0.683 24.7-146.4-102.5 155.7 -33.6 20.2 9.0 75 99 A Y E -d 51 0B 52 -2,-0.3 2,-0.4 -25,-0.2 -23,-0.2 -0.931 14.7-170.0-129.4 141.9 -34.1 16.6 10.2 76 100 A Y E -d 52 0B 57 -25,-2.6 -23,-3.0 -2,-0.4 2,-0.5 -0.978 13.2-161.1-131.3 122.3 -35.7 13.4 9.1 77 101 A G E -d 53 0B 22 -2,-0.4 2,-0.5 -25,-0.2 -23,-0.2 -0.890 7.5-175.5-109.1 127.7 -36.0 10.5 11.5 78 102 A I - 0 0 0 -25,-3.4 2,-2.0 -2,-0.5 -22,-1.5 -0.947 17.7-148.2-126.6 112.2 -36.7 6.9 10.3 79 103 A E B +F 55 0C 28 -2,-0.5 2,-0.3 -24,-0.2 -24,-0.1 -0.495 43.4 147.2 -87.7 80.4 -37.2 4.3 13.0 80 104 A A - 0 0 0 -2,-2.0 2,-0.3 -26,-0.7 -2,-0.1 -0.849 39.7-140.6-118.3 149.5 -35.8 1.3 11.2 81 105 A D - 0 0 17 -2,-0.3 2,-1.9 2,-0.1 5,-0.1 -0.800 24.3-122.9-101.7 145.7 -33.9 -1.8 12.2 82 106 A D + 0 0 50 -2,-0.3 509,-0.2 509,-0.3 -27,-0.0 -0.387 69.9 128.9 -83.6 61.0 -31.0 -3.3 10.3 83 107 A N > - 0 0 36 -2,-1.9 3,-2.7 1,-0.1 -2,-0.1 -0.961 66.7-131.7-116.7 137.3 -32.9 -6.6 10.0 84 108 A P T 3 S+ 0 0 12 0, 0.0 -1,-0.1 0, 0.0 74,-0.1 0.751 110.7 53.0 -52.7 -25.3 -33.5 -8.5 6.8 85 109 A F T 3 S+ 0 0 96 2,-0.1 2,-0.5 3,-0.0 -3,-0.1 0.386 85.0 104.1 -95.3 4.1 -37.2 -8.7 7.8 86 110 A F S < S- 0 0 7 -3,-2.7 2,-1.6 -5,-0.1 3,-0.2 -0.749 74.0-131.0 -87.4 128.4 -37.6 -5.0 8.3 87 111 A D > + 0 0 54 -2,-0.5 3,-0.6 1,-0.2 4,-0.1 -0.574 40.9 158.5 -83.5 86.2 -39.4 -3.3 5.5 88 112 A L G > + 0 0 0 -2,-1.6 3,-2.1 1,-0.2 4,-0.4 0.757 62.3 78.5 -70.4 -26.5 -37.2 -0.4 4.6 89 113 A S G >> S+ 0 0 44 1,-0.3 4,-0.6 2,-0.2 3,-0.6 0.684 78.3 68.5 -62.4 -23.7 -38.8 -0.2 1.2 90 114 A V G <4 S+ 0 0 64 -3,-0.6 -1,-0.3 1,-0.2 -2,-0.1 0.703 104.3 46.1 -69.7 -16.0 -41.9 1.6 2.6 91 115 A Y G <> S+ 0 0 23 -3,-2.1 4,-2.2 -4,-0.1 5,-0.4 0.584 89.6 93.2 -94.4 -13.4 -39.5 4.5 3.2 92 116 A F H <> S+ 0 0 8 -3,-0.6 4,-1.7 -4,-0.4 -2,-0.2 0.929 89.2 35.8 -53.5 -58.2 -38.0 4.2 -0.3 93 117 A L H X S+ 0 0 69 -4,-0.6 4,-2.1 1,-0.2 3,-0.5 0.982 116.5 49.1 -67.4 -53.7 -40.1 6.7 -2.1 94 118 A P H > S+ 0 0 50 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.857 113.9 47.8 -54.3 -37.8 -40.8 9.4 0.5 95 119 A V H X S+ 0 0 0 -4,-2.2 4,-3.0 2,-0.2 5,-0.3 0.881 107.7 54.9 -70.0 -35.8 -37.1 9.6 1.4 96 120 A A H X S+ 0 0 0 -4,-1.7 4,-1.5 -3,-0.5 -1,-0.2 0.911 112.1 45.6 -59.7 -40.3 -36.2 9.8 -2.3 97 121 A R H X S+ 0 0 128 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.847 112.2 50.0 -69.4 -42.6 -38.5 12.8 -2.4 98 122 A Y H X S+ 0 0 52 -4,-2.4 4,-1.6 -5,-0.2 -2,-0.2 0.960 114.0 44.3 -60.6 -55.3 -37.1 14.3 0.8 99 123 A I H X S+ 0 0 0 -4,-3.0 4,-2.2 1,-0.2 -2,-0.2 0.821 112.9 54.6 -59.1 -32.7 -33.5 14.0 -0.4 100 124 A R H X S+ 0 0 119 -4,-1.5 4,-1.8 -5,-0.3 -1,-0.2 0.938 106.8 46.5 -69.0 -50.4 -34.6 15.3 -3.8 101 125 A A H < S+ 0 0 59 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.815 113.4 53.3 -65.3 -29.6 -36.2 18.6 -2.7 102 126 A A H >< S+ 0 0 2 -4,-1.6 3,-3.4 -5,-0.2 6,-0.3 0.980 108.1 45.1 -64.9 -59.7 -33.2 19.2 -0.4 103 127 A L H 3< S+ 0 0 42 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.803 103.0 68.5 -62.3 -24.7 -30.6 18.8 -3.1 104 128 A S T 3< S+ 0 0 88 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.565 84.3 89.0 -62.8 -16.2 -32.8 21.0 -5.2 105 129 A V S X S- 0 0 62 -3,-3.4 3,-1.5 1,-0.2 -3,-0.0 -0.822 87.3-130.7 -85.0 128.7 -31.9 23.7 -2.7 106 130 A P T 3 S+ 0 0 136 0, 0.0 -1,-0.2 0, 0.0 -4,-0.0 0.893 113.7 37.3 -39.6 -55.2 -28.7 25.5 -3.8 107 131 A Q T 3 S+ 0 0 64 -3,-0.1 -58,-0.1 2,-0.0 -4,-0.1 0.636 90.2 140.9 -74.4 -9.9 -27.2 25.0 -0.4 108 132 A G < + 0 0 0 -3,-1.5 2,-0.4 -6,-0.3 -60,-0.1 -0.103 15.3 156.9 -45.4 104.2 -28.8 21.6 -0.3 109 133 A R - 0 0 8 -62,-0.2 -60,-2.9 2,-0.0 -59,-1.2 -0.970 22.5-161.2-132.9 113.0 -26.3 19.2 1.2 110 134 A V E -ce 29 50B 0 -82,-2.9 -80,-3.5 -2,-0.4 2,-0.5 -0.811 10.3-158.4-104.1 132.8 -27.9 16.1 2.7 111 135 A L E -ce 30 51B 0 -61,-3.2 -59,-4.3 -2,-0.4 2,-0.6 -0.938 7.1-172.0-105.5 128.3 -26.5 13.6 5.3 112 136 A V E +ce 31 52B 0 -82,-3.9 -80,-2.0 -2,-0.5 2,-0.3 -0.961 20.5 161.3-116.2 116.1 -28.0 10.2 5.4 113 137 A H E +ce 32 53B 0 -61,-3.2 -59,-3.1 -2,-0.6 -58,-0.4 -0.871 22.0 170.3-129.9 164.3 -26.7 8.2 8.3 114 138 A C - 0 0 4 -82,-1.2 -59,-0.2 -2,-0.3 -77,-0.2 -0.292 67.0 -61.5-136.6-129.7 -27.6 5.1 10.4 115 139 A A S S+ 0 0 35 -82,-0.2 -81,-2.2 -2,-0.1 -80,-0.5 0.899 131.3 5.0 -89.0 -43.4 -25.2 3.6 12.9 116 140 A M S S- 0 0 34 -83,-0.2 -83,-0.2 -82,-0.1 -1,-0.0 0.383 92.9-127.4-121.2 0.5 -22.3 2.6 10.6 117 141 A G S S+ 0 0 0 -85,-0.2 -84,-0.1 1,-0.1 -5,-0.1 0.611 83.1 95.0 66.7 21.5 -23.5 4.1 7.4 118 142 A V S S+ 0 0 14 32,-0.1 33,-4.6 33,-0.1 -1,-0.1 0.555 90.2 13.3-115.5 -17.6 -23.1 1.0 5.3 119 143 A S S > S+ 0 0 4 31,-0.2 4,-2.6 33,-0.1 5,-0.2 0.669 122.1 34.3-125.2 -75.7 -26.5 -0.8 5.2 120 144 A R H > S+ 0 0 17 2,-0.2 4,-0.9 1,-0.2 -7,-0.1 0.863 130.9 32.6 -58.2 -45.2 -29.8 0.9 6.3 121 145 A S H > S+ 0 0 0 2,-0.2 4,-1.7 1,-0.1 -1,-0.2 0.826 115.7 59.0 -85.8 -33.8 -28.8 4.4 5.1 122 146 A A H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.884 106.5 49.8 -50.2 -50.2 -26.8 3.0 2.2 123 147 A T H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.840 108.3 50.2 -61.0 -44.0 -30.0 1.4 1.0 124 148 A L H X S+ 0 0 1 -4,-0.9 4,-1.2 1,-0.2 -1,-0.2 0.823 111.6 50.1 -70.9 -30.0 -32.1 4.5 1.2 125 149 A V H X S+ 0 0 0 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.895 109.0 52.4 -70.3 -44.1 -29.4 6.3 -0.7 126 150 A L H >X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 3,-0.7 0.968 107.1 50.5 -53.3 -59.9 -29.4 3.6 -3.4 127 151 A A H 3X S+ 0 0 0 -4,-2.4 4,-3.5 1,-0.3 -1,-0.2 0.828 107.7 55.5 -49.7 -37.5 -33.1 3.8 -3.9 128 152 A F H 3X S+ 0 0 4 -4,-1.2 4,-3.8 2,-0.2 5,-0.5 0.892 108.4 46.8 -63.8 -43.8 -32.9 7.5 -4.3 129 153 A L H - 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0 0 10 -6,-2.5 2,-2.7 -2,-0.1 3,-0.4 -0.594 67.0-165.4 -82.8 83.8 -41.2 7.6 32.4 232 86 B D + 0 0 92 -2,-1.8 -4,-0.1 -4,-0.4 -1,-0.1 -0.398 45.5 121.0 -69.1 66.5 -38.8 10.0 30.8 233 87 B T > + 0 0 4 -2,-2.7 4,-1.2 -6,-0.1 -1,-0.2 0.895 34.5 163.3 -95.9 -61.1 -40.2 13.1 32.5 234 88 B G T 4 - 0 0 13 -3,-0.4 3,-0.4 2,-0.2 4,-0.2 0.061 64.0 -68.3 65.1 177.3 -37.3 14.6 34.5 235 89 B A T >4 S+ 0 0 48 1,-0.2 3,-1.5 2,-0.2 4,-0.4 0.774 131.0 70.4 -72.3 -28.1 -37.1 18.1 35.9 236 90 B K G >4 S+ 0 0 178 1,-0.3 3,-1.0 2,-0.2 -1,-0.2 0.848 92.8 56.1 -54.3 -40.9 -37.0 19.3 32.3 237 91 B F G 3< S+ 0 0 53 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.699 108.8 50.2 -63.8 -17.6 -40.6 18.2 32.0 238 92 B Y G X S+ 0 0 6 -3,-1.5 3,-2.2 -4,-0.2 -1,-0.2 0.452 74.2 136.0-107.7 1.7 -41.3 20.5 34.9 239 93 B R T < S+ 0 0 84 -3,-1.0 3,-0.1 -4,-0.4 -3,-0.0 -0.165 73.8 25.5 -50.4 139.2 -39.7 23.8 33.9 240 94 B G T 3 S+ 0 0 90 1,-0.3 2,-0.3 3,-0.0 -1,-0.3 -0.013 102.7 102.3 91.9 -29.7 -41.9 26.8 34.6 241 95 B M S < S- 0 0 53 -3,-2.2 2,-1.3 2,-0.1 -1,-0.3 -0.642 76.9-128.3 -81.8 143.0 -43.6 24.9 37.4 242 96 B S S S+ 0 0 121 -2,-0.3 2,-0.3 -3,-0.1 -3,-0.1 -0.688 70.7 103.4 -92.7 83.1 -42.7 25.6 41.0 243 97 B L - 0 0 23 -2,-1.3 -23,-0.3 -5,-0.2 2,-0.3 -0.974 64.5-118.6-161.0 148.8 -42.0 22.1 42.1 244 98 B E E -j 220 0E 116 -25,-4.3 -23,-3.8 -2,-0.3 2,-0.4 -0.629 21.4-149.4 -98.3 151.0 -39.1 19.8 42.8 245 99 B Y E +j 221 0E 48 -2,-0.3 2,-0.4 -25,-0.2 -23,-0.2 -0.964 14.4 178.8-123.6 136.0 -38.1 16.6 41.0 246 100 B Y E -j 222 0E 65 -25,-2.7 -23,-4.1 -2,-0.4 2,-0.4 -0.997 14.4-161.6-132.1 127.2 -36.4 13.5 42.2 247 101 B G E -j 223 0E 29 -2,-0.4 2,-0.4 -25,-0.2 -23,-0.2 -0.888 10.1-171.6-115.4 141.4 -35.8 10.6 39.9 248 102 B I - 0 0 3 -25,-3.6 2,-2.3 -2,-0.4 -22,-2.0 -0.956 22.0-141.1-129.7 113.8 -35.0 6.9 40.6 249 103 B E + 0 0 132 -2,-0.4 2,-0.3 -24,-0.2 -24,-0.1 -0.481 48.1 159.8 -72.4 83.8 -34.1 4.6 37.8 250 104 B A - 0 0 0 -2,-2.3 2,-0.4 -26,-0.5 -2,-0.1 -0.869 34.1-145.4-116.1 148.2 -36.0 1.7 39.3 251 105 B D - 0 0 32 -2,-0.3 2,-2.5 2,-0.1 5,-0.1 -0.880 21.9-127.5-108.3 137.4 -37.4 -1.5 37.9 252 106 B D + 0 0 54 -2,-0.4 170,-0.3 170,-0.3 3,-0.0 -0.365 69.0 129.7 -73.7 58.4 -40.6 -3.2 39.0 253 107 B N > - 0 0 44 -2,-2.5 3,-2.0 1,-0.1 -2,-0.1 -0.964 64.2-137.1-124.3 134.3 -38.7 -6.4 39.5 254 108 B P T 3 S+ 0 0 15 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.775 109.4 49.3 -54.1 -30.1 -38.6 -8.7 42.6 255 109 B F T 3 S+ 0 0 159 2,-0.1 2,-0.5 -3,-0.0 -3,-0.1 0.224 88.6 107.1 -98.8 14.6 -34.8 -9.0 42.2 256 110 B F S < S- 0 0 41 -3,-2.0 2,-1.3 -5,-0.1 3,-0.2 -0.843 73.3-130.5 -92.4 128.6 -34.4 -5.3 42.0 257 111 B D + 0 0 89 -2,-0.5 3,-0.2 1,-0.2 4,-0.1 -0.635 44.3 152.4 -87.2 90.3 -33.0 -3.7 45.1 258 112 B L >> + 0 0 0 -2,-1.3 3,-3.9 1,-0.2 4,-0.6 0.867 56.3 80.8 -80.1 -37.0 -35.2 -0.9 46.0 259 113 B S H >> S+ 0 0 40 1,-0.3 3,-0.7 2,-0.2 4,-0.6 0.722 79.3 70.1 -45.5 -30.0 -34.5 -0.9 49.7 260 114 B V H 34 S+ 0 0 85 1,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.750 103.4 44.1 -61.2 -21.1 -31.3 1.1 49.1 261 115 B Y H <> S+ 0 0 71 -3,-3.9 4,-2.2 1,-0.1 5,-0.4 0.624 89.9 91.3 -95.0 -18.3 -33.6 4.0 48.2 262 116 B F H S+ 0 0 45 0, 0.0 4,-2.2 0, 0.0 -2,-0.2 0.817 116.4 47.7 -57.0 -29.8 -32.9 8.7 51.3 265 119 B V H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.828 108.6 53.0 -80.4 -32.5 -36.4 9.0 49.8 266 120 B A H X S+ 0 0 0 -4,-1.0 4,-2.1 -5,-0.4 -1,-0.2 0.881 111.9 47.7 -63.2 -38.0 -38.0 8.7 53.3 267 121 B R H X S+ 0 0 130 -4,-2.3 4,-2.8 2,-0.2 5,-0.3 0.935 111.1 49.8 -65.8 -50.9 -35.6 11.6 54.1 268 122 B Y H X S+ 0 0 60 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.910 112.1 48.6 -53.9 -46.6 -36.6 13.5 51.0 269 123 B I H X S+ 0 0 0 -4,-2.7 4,-3.4 2,-0.2 5,-0.3 0.933 112.5 46.8 -65.4 -42.4 -40.3 13.0 51.8 270 124 B R H X S+ 0 0 129 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.933 114.8 45.4 -67.2 -45.8 -40.0 14.2 55.4 271 125 B A H < S+ 0 0 60 -4,-2.8 4,-0.4 2,-0.2 -1,-0.2 0.827 116.5 50.5 -62.4 -30.2 -37.9 17.2 54.5 272 126 B A H >< S+ 0 0 3 -4,-1.8 3,-1.1 -5,-0.3 -2,-0.2 0.957 115.8 36.6 -70.9 -56.4 -40.4 17.8 51.8 273 127 B L H 3< S+ 0 0 35 -4,-3.4 5,-0.3 1,-0.2 -2,-0.2 0.823 104.8 72.2 -71.9 -26.2 -43.6 17.5 53.8 274 128 B S T 3< S+ 0 0 91 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.711 83.2 87.0 -59.7 -22.8 -41.9 19.3 56.8 275 129 B V S X S- 0 0 66 -3,-1.1 3,-2.4 -4,-0.4 -3,-0.0 -0.627 93.4-120.1 -76.4 139.2 -42.1 22.4 54.7 276 130 B P T 3 S+ 0 0 136 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.901 118.5 41.4 -44.6 -52.0 -45.4 24.3 55.1 277 131 B Q T 3 S+ 0 0 63 -58,-0.0 2,-0.2 2,-0.0 -58,-0.1 0.375 86.5 144.3 -79.9 6.2 -46.2 23.9 51.4 278 132 B G < + 0 0 4 -3,-2.4 2,-0.3 -5,-0.3 -5,-0.1 -0.316 10.7 150.2 -51.5 111.7 -44.9 20.3 51.6 279 133 B R - 0 0 29 -2,-0.2 -60,-2.7 -62,-0.1 -59,-1.2 -0.851 25.4-163.5-148.2 103.5 -47.1 18.2 49.3 280 134 B V E -ik 199 220E 0 -82,-2.3 -80,-2.8 -2,-0.3 2,-0.5 -0.787 14.0-167.2-106.0 132.2 -45.3 15.2 47.7 281 135 B L E -ik 200 221E 0 -61,-3.4 -59,-3.1 -2,-0.4 2,-0.5 -0.961 7.9-171.8-112.0 126.4 -46.2 13.0 44.8 282 136 B V E +ik 201 222E 0 -82,-2.3 -80,-1.0 -2,-0.5 2,-0.3 -0.971 18.0 175.1-115.6 118.4 -44.3 9.8 44.4 283 137 B H E +ik 202 223E 0 -61,-3.6 -59,-3.8 -2,-0.5 -58,-0.5 -0.902 26.8 170.6-133.5 159.6 -44.9 8.0 41.2 284 138 B C - 0 0 4 -82,-1.0 -77,-0.2 -2,-0.3 -59,-0.1 -0.319 64.3 -69.4-127.2-141.6 -44.0 5.0 39.1 285 139 B A S S+ 0 0 35 -82,-0.2 -81,-2.6 -2,-0.2 -80,-0.4 0.917 128.8 9.9 -92.3 -40.2 -45.9 3.9 36.0 286 140 B M S S- 0 0 35 -83,-0.3 -83,-0.2 -82,-0.1 -1,-0.1 0.520 96.5-128.3-110.4 -5.5 -49.2 2.6 37.5 287 141 B G S S+ 0 0 0 1,-0.0 -84,-0.1 -85,-0.0 -94,-0.1 0.760 81.8 92.6 68.1 35.1 -48.5 3.9 41.0 288 142 B V S S+ 0 0 12 32,-0.1 33,-4.2 33,-0.1 -85,-0.1 0.531 89.2 18.1-132.2 -12.4 -49.2 0.6 42.9 289 143 B S S > S+ 0 0 6 31,-0.2 4,-1.9 33,-0.1 5,-0.2 0.640 121.4 35.3-124.9 -70.0 -45.9 -1.3 43.4 290 144 B R H > S+ 0 0 16 1,-0.2 4,-1.1 2,-0.2 -7,-0.1 0.922 128.4 33.2 -54.3 -52.9 -42.6 0.7 43.0 291 145 B S H > S+ 0 0 0 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.878 113.0 60.0 -78.1 -40.2 -43.8 4.0 44.5 292 146 B A H > S+ 0 0 0 1,-0.2 4,-3.3 2,-0.2 -1,-0.2 0.894 105.0 52.0 -46.0 -53.5 -46.2 2.5 47.0 293 147 B T H X S+ 0 0 0 -4,-1.9 4,-3.1 1,-0.2 -1,-0.2 0.872 106.9 51.5 -49.8 -50.6 -43.3 0.6 48.5 294 148 B L H X S+ 0 0 0 -4,-1.1 4,-1.6 2,-0.2 -1,-0.2 0.857 112.4 47.3 -61.4 -35.4 -41.3 3.8 48.8 295 149 B V H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.920 110.8 50.5 -73.8 -46.9 -44.3 5.4 50.6 296 150 B L H >X S+ 0 0 0 -4,-3.3 4,-2.7 1,-0.2 3,-0.5 0.973 110.9 49.6 -48.4 -59.7 -44.7 2.4 52.9 297 151 B A H 3X S+ 0 0 0 -4,-3.1 4,-2.2 1,-0.3 5,-0.2 0.867 108.5 54.3 -48.7 -41.7 -41.0 2.7 53.7 298 152 B F H 3X S+ 0 0 3 -4,-1.6 4,-2.3 -5,-0.2 5,-0.4 0.893 111.1 45.1 -57.5 -44.0 -41.5 6.4 54.4 299 153 B L H - 0 0 59 -2,-0.2 4,-2.6 -3,-0.1 5,-0.2 -0.482 39.1 -94.1 -96.8 172.5 -45.1 -1.1 61.0 307 161 B L H > S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.907 125.2 47.1 -56.4 -48.2 -45.5 -2.8 57.6 308 162 B V H > S+ 0 0 43 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.884 113.0 49.7 -64.8 -40.7 -49.1 -3.8 58.2 309 163 B E H > S+ 0 0 82 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.906 111.6 49.7 -62.8 -45.5 -50.0 -0.4 59.5 310 164 B A H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 5,-0.3 0.961 111.2 48.0 -57.3 -56.4 -48.4 1.2 56.4 311 165 B I H X S+ 0 0 0 -4,-2.8 4,-3.6 1,-0.2 -2,-0.2 0.927 115.3 42.8 -54.8 -49.4 -50.2 -1.1 54.0 312 166 B Q H < S+ 0 0 88 -4,-2.3 4,-0.3 2,-0.2 -1,-0.2 0.851 111.6 54.9 -74.9 -35.2 -53.6 -0.6 55.5 313 167 B T H >< S+ 0 0 44 -4,-2.2 3,-0.8 -5,-0.2 -1,-0.2 0.987 120.8 31.1 -49.7 -60.5 -53.2 3.1 55.9 314 168 B V H >< S+ 0 0 0 -4,-2.4 3,-2.1 1,-0.2 4,-0.3 0.911 110.8 63.5 -69.4 -48.0 -52.3 3.5 52.3 315 169 B Q T 3< S+ 0 0 35 -4,-3.6 -1,-0.2 -5,-0.3 -3,-0.1 0.397 90.9 69.4 -67.2 2.5 -54.4 0.7 50.8 316 170 B A T < S+ 0 0 72 -3,-0.8 -1,-0.3 -4,-0.3 -2,-0.2 0.571 109.0 32.6 -98.3 -13.0 -57.6 2.4 51.9 317 171 B H S < S+ 0 0 114 -3,-2.1 2,-0.2 1,-0.3 -2,-0.2 0.144 131.6 20.0-123.3 14.1 -57.3 5.3 49.4 318 172 B R S S- 0 0 10 -4,-0.3 -1,-0.3 -123,-0.1 -129,-0.1 -0.669 79.5-110.6 178.6 124.1 -55.6 3.4 46.6 319 173 B N - 0 0 14 -131,-0.3 2,-0.3 -2,-0.2 -134,-0.1 -0.330 47.0-179.8 -55.6 133.3 -55.1 -0.2 45.6 320 174 B I + 0 0 3 -139,-0.2 -31,-0.2 -5,-0.1 -32,-0.1 -0.984 20.7 166.7-138.1 152.7 -51.5 -1.1 46.2 321 175 B C - 0 0 51 -33,-4.2 -33,-0.1 -2,-0.3 -31,-0.1 -0.317 16.1-160.7-168.3 81.7 -49.5 -4.1 45.7 322 176 B P - 0 0 2 0, 0.0 -33,-0.1 0, 0.0 5,-0.1 -0.157 42.8 -90.4 -55.7 153.4 -45.7 -4.1 45.8 323 177 B N >> - 0 0 22 1,-0.1 4,-2.0 3,-0.1 3,-1.5 -0.392 40.7-102.3 -72.6 155.6 -44.1 -7.1 44.2 324 178 B S H 3> S+ 0 0 16 75,-0.4 4,-1.7 1,-0.3 -1,-0.1 0.766 125.2 45.1 -43.8 -38.7 -43.4 -10.1 46.4 325 179 B G H 3> S+ 0 0 16 74,-0.4 4,-1.3 2,-0.2 -1,-0.3 0.769 105.9 59.5 -81.3 -28.6 -39.7 -9.2 46.6 326 180 B F H <> S+ 0 0 0 -3,-1.5 4,-0.7 2,-0.2 -2,-0.2 0.815 107.2 50.7 -66.9 -28.7 -40.5 -5.5 47.3 327 181 B L H >X S+ 0 0 0 -4,-2.0 4,-2.6 2,-0.2 3,-2.1 0.982 105.5 51.1 -68.0 -58.1 -42.4 -6.9 50.3 328 182 B R H 3X S+ 0 0 34 -4,-1.7 4,-1.5 1,-0.3 -2,-0.2 0.756 109.0 54.4 -52.2 -28.6 -39.5 -9.0 51.7 329 183 B Q H 3X S+ 0 0 20 -4,-1.3 4,-0.6 2,-0.2 -1,-0.3 0.761 110.0 46.7 -70.7 -32.2 -37.4 -5.9 51.4 330 184 B L H < S+ 0 0 73 -4,-2.1 3,-2.6 2,-0.2 -1,-0.2 0.841 111.5 56.7 -88.9 -46.9 -37.7 -6.0 61.2 336 190 B R H 3< S+ 0 0 190 -4,-1.9 -2,-0.2 1,-0.3 -3,-0.2 0.863 110.5 48.1 -54.5 -32.7 -34.5 -4.1 61.1 337 191 B L T 3< 0 0 92 -4,-3.0 -1,-0.3 1,-0.2 -2,-0.2 0.207 360.0 360.0 -92.7 16.0 -36.5 -1.3 62.7 338 192 B G < 0 0 98 -3,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.968 360.0 360.0 -68.5 360.0 -37.8 -3.9 65.1 339 !* 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 0.0 340 24 C Q 0 0 143 0, 0.0 3,-0.1 0, 0.0 -249,-0.0 0.000 360.0 360.0 360.0 73.7 -46.5 8.1 7.4 341 25 C P - 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