==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 11-JUN-08 2VVT . COMPND 2 MOLECULE: GLUTAMATE RACEMASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROCOCCUS FAECALIS; . AUTHOR B.GENG,G.BREAULT,J.COMITA-PREVOIR,R.PETRICHKO,C.EYERMANN, . 537 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22133.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 377 70.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 81 15.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 0 0.0 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 . 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 . 25 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 59 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 189 35.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.9 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 2 1 2 1 4 1 2 0 2 3 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 3 8 2 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 PARALLEL BRIDGES PER LADDER . 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 2 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 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 -5 A V > 0 0 98 0, 0.0 3,-3.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 158.3 -7.8 21.0 87.7 2 -4 A P T 3 + 0 0 144 0, 0.0 3,-0.1 0, 0.0 4,-0.0 0.763 360.0 63.6 -54.7 -27.6 -9.5 17.8 88.7 3 -3 A R T 3 S- 0 0 158 1,-0.2 2,-0.6 2,-0.0 3,-0.0 0.638 113.4-120.5 -65.1 -19.3 -6.6 15.8 87.1 4 -2 A G S < S+ 0 0 51 -3,-3.1 -1,-0.2 3,-0.0 2,-0.2 -0.950 82.6 13.1 111.1-108.1 -4.4 17.4 89.7 5 -1 A S S S- 0 0 54 -2,-0.6 3,-0.1 1,-0.1 -2,-0.0 -0.517 99.9 -86.7 -87.7 165.3 -1.8 19.3 87.8 6 0 A H - 0 0 81 -2,-0.2 -1,-0.1 1,-0.1 5,-0.1 -0.330 55.0 -86.2 -62.8 156.2 -2.1 20.0 84.1 7 1 A M >> - 0 0 90 1,-0.1 3,-1.5 3,-0.1 4,-0.5 -0.375 45.9-112.4 -57.4 145.8 -0.9 17.5 81.6 8 2 A S G >4 S+ 0 0 96 1,-0.3 3,-1.3 2,-0.2 -1,-0.1 0.907 117.8 48.6 -52.8 -46.9 2.8 18.1 81.0 9 3 A N G 34 S+ 0 0 31 1,-0.3 -1,-0.3 221,-0.1 65,-0.1 0.649 103.2 62.5 -69.5 -16.7 2.2 19.2 77.4 10 4 A Q G <4 S+ 0 0 33 -3,-1.5 -1,-0.3 223,-0.1 -2,-0.2 0.524 81.7 104.5 -87.1 -7.1 -0.7 21.6 78.4 11 5 A E S << S- 0 0 11 -3,-1.3 26,-0.3 -4,-0.5 62,-0.1 -0.300 78.1 -97.6 -71.5 161.1 1.6 23.7 80.6 12 6 A A - 0 0 0 59,-0.3 62,-2.5 24,-0.1 63,-0.7 -0.325 22.2-122.9 -77.7 158.7 2.7 27.1 79.3 13 7 A I E -ab 38 75A 3 24,-2.6 26,-2.4 60,-0.2 2,-0.4 -0.900 31.4-141.3 -93.3 131.1 5.9 28.1 77.6 14 8 A G E -ab 39 76A 0 61,-2.7 63,-3.0 -2,-0.5 2,-0.4 -0.771 15.3-167.6 -98.4 141.4 7.6 30.9 79.6 15 9 A L E -ab 40 77A 4 24,-2.5 26,-2.2 -2,-0.4 2,-0.4 -0.997 3.1-167.4-126.3 132.4 9.4 33.8 78.0 16 10 A I E +ab 41 78A 0 61,-2.3 63,-1.9 -2,-0.4 64,-1.0 -0.945 15.3 155.2-122.9 143.4 11.6 36.2 79.9 17 11 A D E -a 42 0A 0 24,-2.0 26,-2.4 -2,-0.4 27,-0.1 -0.952 53.6-101.9-155.9 164.1 13.0 39.6 78.7 18 12 A S S S- 0 0 0 -2,-0.3 29,-0.3 24,-0.3 28,-0.3 0.608 92.9 -46.0 -70.4 -9.7 14.3 42.9 80.0 19 13 A G S S- 0 0 1 22,-0.2 25,-0.1 23,-0.1 3,-0.1 -0.697 97.5 -30.3-178.4-130.2 11.0 44.6 79.3 20 14 A V S > S+ 0 0 37 -2,-0.2 3,-2.2 1,-0.1 4,-0.2 0.637 109.1 83.6 -91.5 -17.3 8.4 44.9 76.5 21 15 A G T > S+ 0 0 8 1,-0.3 3,-2.2 2,-0.2 4,-0.3 0.862 79.1 67.5 -55.2 -37.6 10.9 44.4 73.6 22 16 A G T >> S+ 0 0 0 1,-0.3 4,-1.9 2,-0.2 3,-1.0 0.581 74.9 86.5 -62.9 -8.5 10.7 40.7 73.9 23 17 A L H <> S+ 0 0 2 -3,-2.2 4,-2.5 1,-0.2 -1,-0.3 0.665 76.2 69.5 -66.6 -11.8 7.1 40.9 72.8 24 18 A T H <> S+ 0 0 12 -3,-2.2 4,-1.2 2,-0.2 -1,-0.2 0.895 103.9 42.6 -67.0 -35.5 8.6 40.7 69.2 25 19 A V H <> S+ 0 0 2 -3,-1.0 4,-1.5 -4,-0.3 -2,-0.2 0.934 113.9 50.5 -74.7 -45.4 9.4 37.1 70.2 26 20 A L H X S+ 0 0 0 -4,-1.9 4,-2.3 1,-0.2 3,-0.2 0.901 106.1 55.5 -59.0 -40.5 6.1 36.5 71.8 27 21 A K H X S+ 0 0 83 -4,-2.5 4,-1.3 1,-0.3 -1,-0.2 0.890 105.6 52.7 -63.2 -34.8 4.3 37.8 68.7 28 22 A E H X S+ 0 0 34 -4,-1.2 4,-2.7 -3,-0.2 5,-0.3 0.849 107.5 51.9 -66.4 -33.0 6.1 35.2 66.7 29 23 A A H X S+ 0 0 6 -4,-1.5 4,-2.2 1,-0.2 7,-0.2 0.877 105.5 54.5 -69.7 -36.9 4.9 32.5 69.1 30 24 A L H < S+ 0 0 39 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.841 116.5 39.7 -60.7 -35.2 1.4 33.7 68.7 31 25 A K H < S+ 0 0 51 -4,-1.3 -2,-0.2 -5,-0.2 -1,-0.2 0.891 127.0 28.9 -79.7 -48.6 1.8 33.3 64.9 32 26 A Q H < S+ 0 0 2 -4,-2.7 -3,-0.2 1,-0.2 -2,-0.2 0.698 133.3 30.9 -91.4 -20.9 3.9 30.1 64.6 33 27 A L >< + 0 0 5 -4,-2.2 3,-1.9 -5,-0.3 -1,-0.2 -0.380 66.1 153.9-134.7 53.1 2.6 28.3 67.8 34 28 A P T 3 S+ 0 0 54 0, 0.0 370,-0.1 0, 0.0 -1,-0.1 0.703 70.2 61.6 -61.4 -22.5 -0.9 29.5 68.2 35 29 A N T 3 S+ 0 0 41 368,-0.6 2,-0.2 -3,-0.1 -5,-0.1 0.648 87.3 93.5 -76.4 -15.8 -1.9 26.4 70.2 36 30 A E S < S- 0 0 6 -3,-1.9 2,-0.4 -7,-0.2 -24,-0.1 -0.579 72.8-132.5 -82.4 141.9 0.6 27.1 73.0 37 31 A R - 0 0 54 -26,-0.3 -24,-2.6 -2,-0.2 2,-0.4 -0.747 28.6-154.6 -86.5 138.3 -0.3 28.9 76.2 38 32 A L E -a 13 0A 2 -2,-0.4 201,-2.2 -26,-0.2 2,-0.4 -0.898 18.6-166.9-119.8 143.4 2.3 31.6 77.0 39 33 A I E -ac 14 239A 0 -26,-2.4 -24,-2.5 -2,-0.4 2,-0.4 -0.993 17.9-169.2-125.8 124.7 3.5 33.3 80.2 40 34 A Y E -ac 15 240A 0 199,-2.5 201,-2.7 -2,-0.4 2,-0.4 -0.917 10.4-174.4-119.4 137.1 5.7 36.4 79.6 41 35 A L E -ac 16 241A 0 -26,-2.2 -24,-2.0 -2,-0.4 2,-0.5 -0.992 2.4-173.4-130.6 124.1 7.7 38.4 82.2 42 36 A G E -ac 17 242A 0 199,-2.2 2,-1.9 -2,-0.4 201,-1.6 -0.976 21.7-143.2-118.7 128.8 9.5 41.6 81.3 43 37 A D >> + 0 0 2 -26,-2.4 3,-2.4 -2,-0.5 4,-0.9 -0.317 37.4 158.4 -84.8 56.2 11.8 43.3 83.8 44 38 A T T 34 + 0 0 43 -2,-1.9 3,-0.4 1,-0.3 -1,-0.2 0.790 64.7 65.3 -55.3 -31.4 10.8 46.8 82.8 45 39 A A T 34 S+ 0 0 68 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.732 114.0 31.0 -64.1 -21.4 12.0 48.3 86.1 46 40 A R T <4 S+ 0 0 38 -3,-2.4 -1,-0.2 -28,-0.3 -2,-0.2 0.386 93.8 157.0-120.3 2.5 15.6 47.4 85.3 47 41 A C < + 0 0 35 -4,-0.9 2,-0.1 -3,-0.4 -28,-0.0 -0.458 40.1 62.4 -62.9 142.7 15.6 47.7 81.5 48 42 A P + 0 0 54 0, 0.0 4,-0.1 0, 0.0 -1,-0.0 0.452 46.1 168.8 -86.1 148.8 18.0 48.2 79.7 49 43 A Y > + 0 0 0 1,-0.1 3,-1.8 2,-0.1 8,-0.1 0.680 60.3 91.3 -84.5 -24.3 20.2 45.2 80.2 50 44 A G T 3 S+ 0 0 5 1,-0.3 76,-1.7 75,-0.1 -1,-0.1 0.822 94.1 32.0 -38.1 -54.1 22.4 46.2 77.1 51 45 A P T 3 S+ 0 0 84 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.447 97.1 109.4 -89.6 -1.8 24.9 48.3 79.0 52 46 A R S < S- 0 0 70 -3,-1.8 -3,-0.0 1,-0.1 2,-0.0 -0.378 77.5 -95.0 -78.7 154.9 25.0 46.4 82.3 53 47 A P >> - 0 0 67 0, 0.0 4,-2.0 0, 0.0 3,-0.8 -0.365 35.8-116.1 -61.5 145.9 27.8 44.3 83.6 54 48 A A H 3> S+ 0 0 56 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.867 113.4 58.2 -51.0 -43.9 27.4 40.5 82.9 55 49 A E H 3> S+ 0 0 128 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.867 106.8 47.2 -58.0 -38.5 27.1 39.7 86.6 56 50 A Q H <> S+ 0 0 53 -3,-0.8 4,-2.8 2,-0.2 5,-0.3 0.920 111.6 50.5 -67.5 -47.0 24.1 41.9 87.0 57 51 A V H X S+ 0 0 2 -4,-2.0 4,-2.5 1,-0.2 5,-0.2 0.923 109.7 50.3 -59.9 -43.6 22.4 40.6 83.9 58 52 A V H X S+ 0 0 24 -4,-2.8 4,-2.3 -5,-0.2 -1,-0.2 0.930 112.0 48.9 -60.3 -44.0 22.9 37.0 85.1 59 53 A Q H X S+ 0 0 89 -4,-1.8 4,-2.0 -5,-0.2 -2,-0.2 0.950 113.6 44.3 -58.1 -50.9 21.4 37.9 88.5 60 54 A F H X S+ 0 0 10 -4,-2.8 4,-1.9 2,-0.2 -1,-0.2 0.866 112.8 52.3 -65.1 -38.2 18.3 39.6 87.1 61 55 A T H X S+ 0 0 0 -4,-2.5 4,-2.6 -5,-0.3 -1,-0.2 0.924 107.6 51.8 -68.2 -39.6 17.8 36.9 84.5 62 56 A W H X S+ 0 0 50 -4,-2.3 4,-2.9 -5,-0.2 5,-0.2 0.900 106.4 54.5 -60.1 -41.0 17.9 34.2 87.2 63 57 A E H X S+ 0 0 40 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.925 110.6 46.0 -61.2 -41.3 15.3 36.2 89.2 64 58 A M H X S+ 0 0 0 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.923 112.7 49.4 -65.2 -42.9 13.0 36.1 86.2 65 59 A A H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.920 109.7 51.6 -64.3 -44.4 13.6 32.4 85.5 66 60 A D H X S+ 0 0 65 -4,-2.9 4,-1.4 1,-0.2 -1,-0.2 0.898 107.8 53.3 -58.1 -42.2 12.9 31.5 89.1 67 61 A F H < S+ 0 0 47 -4,-1.9 3,-0.3 -5,-0.2 4,-0.3 0.943 113.9 41.0 -60.6 -46.6 9.6 33.5 89.0 68 62 A L H ><>S+ 0 0 0 -4,-2.0 3,-1.8 1,-0.2 5,-0.9 0.845 105.5 63.7 -75.2 -31.1 8.3 31.6 86.0 69 63 A L H ><5S+ 0 0 35 -4,-2.6 3,-1.9 1,-0.3 -1,-0.2 0.891 96.3 59.8 -57.8 -34.8 9.5 28.2 87.1 70 64 A K T 3<5S+ 0 0 142 -4,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.644 95.6 64.5 -69.7 -12.3 7.1 28.5 90.0 71 65 A K T < 5S- 0 0 68 -3,-1.8 -59,-0.3 -4,-0.3 -1,-0.3 0.262 114.7-115.2 -95.7 11.0 4.4 28.7 87.4 72 66 A R T < 5 + 0 0 147 -3,-1.9 -3,-0.2 1,-0.2 -2,-0.1 0.738 47.3 178.9 69.5 28.2 5.1 25.2 86.1 73 67 A I < - 0 0 7 -5,-0.9 -60,-0.2 1,-0.1 -1,-0.2 -0.277 27.1-146.9 -60.4 144.7 6.2 26.1 82.7 74 68 A K S S+ 0 0 18 -62,-2.5 2,-0.3 1,-0.3 -61,-0.2 0.570 81.5 14.6 -88.9 -11.8 7.3 23.2 80.4 75 69 A M E -b 13 0A 1 -63,-0.7 -61,-2.7 22,-0.2 2,-0.4 -0.955 67.6-142.3-161.7 143.9 9.9 25.2 78.6 76 70 A L E -bd 14 99A 0 22,-2.4 24,-2.5 -2,-0.3 2,-0.5 -0.972 9.8-165.2-116.6 129.5 11.7 28.6 79.1 77 71 A V E -bd 15 100A 5 -63,-3.0 -61,-2.3 -2,-0.4 2,-1.2 -0.962 13.7-149.4-110.4 122.1 12.6 30.9 76.3 78 72 A I E -bd 16 101A 0 22,-2.8 24,-0.7 -2,-0.5 -61,-0.2 -0.812 19.5-177.6 -87.1 98.6 15.1 33.7 77.1 79 73 A A + 0 0 0 -63,-1.9 2,-0.4 -2,-1.2 -62,-0.2 0.710 54.5 88.4 -72.6 -21.8 13.6 36.2 74.6 80 74 A C > - 0 0 0 -64,-1.0 4,-2.5 1,-0.1 22,-0.3 -0.663 64.1-155.2 -85.5 125.3 16.3 38.8 75.4 81 75 A N H > S+ 0 0 1 -2,-0.4 4,-2.0 2,-0.2 -1,-0.1 0.846 96.8 51.8 -66.1 -34.8 19.5 38.6 73.3 82 76 A T H > S+ 0 0 3 2,-0.2 4,-1.0 1,-0.2 5,-0.2 0.936 112.6 43.8 -69.6 -46.3 21.5 40.4 76.1 83 77 A A H >> S+ 0 0 0 1,-0.2 4,-2.9 2,-0.2 3,-0.6 0.924 113.7 51.9 -63.6 -43.7 20.3 38.0 78.8 84 78 A T H 3X S+ 0 0 8 -4,-2.5 4,-1.4 1,-0.2 5,-0.4 0.927 102.3 61.9 -56.3 -43.2 20.9 35.0 76.5 85 79 A A H 3< S+ 0 0 12 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.809 122.7 15.7 -56.9 -36.6 24.4 36.2 75.8 86 80 A V H << S+ 0 0 44 -4,-1.0 4,-0.2 -3,-0.6 -1,-0.2 0.683 132.5 37.2-111.5 -20.3 25.5 35.9 79.4 87 81 A A H X S+ 0 0 0 -4,-2.9 4,-2.2 -5,-0.2 5,-0.3 0.575 87.5 85.2-110.7 -17.2 22.9 33.8 81.2 88 82 A L H X S+ 0 0 33 -4,-1.4 4,-3.0 -5,-0.5 5,-0.3 0.930 88.7 50.7 -61.3 -48.0 21.7 31.0 78.9 89 83 A E H > S+ 0 0 171 -5,-0.4 4,-2.3 1,-0.2 -1,-0.2 0.915 114.8 43.4 -57.9 -46.0 24.5 28.4 79.5 90 84 A E H > S+ 0 0 99 -4,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.894 116.9 44.5 -68.3 -44.1 24.2 28.6 83.3 91 85 A I H X S+ 0 0 0 -4,-2.2 4,-1.4 2,-0.2 3,-0.3 0.912 113.3 50.9 -68.0 -44.6 20.4 28.6 83.4 92 86 A K H < S+ 0 0 76 -4,-3.0 3,-0.5 -5,-0.3 -2,-0.2 0.935 110.9 49.2 -57.4 -46.1 20.1 25.8 80.8 93 87 A A H < S+ 0 0 87 -4,-2.3 -1,-0.2 -5,-0.3 -2,-0.2 0.786 112.9 47.8 -64.4 -28.6 22.5 23.6 82.8 94 88 A A H < S+ 0 0 61 -4,-1.2 -1,-0.2 -3,-0.3 -2,-0.2 0.655 99.1 75.5 -91.5 -21.6 20.7 24.2 86.1 95 89 A L < - 0 0 28 -4,-1.4 4,-0.1 -3,-0.5 0, 0.0 -0.727 64.0-146.7-102.3 145.9 17.1 23.5 85.0 96 90 A P S S+ 0 0 127 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.555 81.3 75.2 -79.5 -12.4 15.3 20.2 84.3 97 91 A I S S- 0 0 37 1,-0.1 -22,-0.2 -24,-0.0 -2,-0.1 -0.654 100.1 -82.9 -98.0 156.2 13.1 21.7 81.7 98 92 A P - 0 0 30 0, 0.0 -22,-2.4 0, 0.0 2,-0.4 -0.348 45.0-166.2 -51.2 133.6 14.1 22.7 78.1 99 93 A V E +d 76 0A 2 -24,-0.2 2,-0.4 -4,-0.1 -22,-0.2 -0.996 8.2 178.8-128.6 125.4 15.7 26.2 78.0 100 94 A V E -d 77 0A 5 -24,-2.5 -22,-2.8 -2,-0.4 2,-0.2 -0.950 8.3-162.1-124.1 139.7 16.2 28.0 74.7 101 95 A G E -d 78 0A 4 -2,-0.4 -22,-0.1 -24,-0.2 -20,-0.1 -0.684 28.6-114.8-113.2 178.3 17.7 31.4 74.0 102 96 A V S S+ 0 0 0 -24,-0.7 4,-0.5 -22,-0.3 116,-0.1 0.404 98.2 67.3 -95.5 1.7 17.5 33.7 70.9 103 97 A I S > S+ 0 0 7 2,-0.1 4,-2.5 3,-0.1 3,-0.3 0.946 94.1 49.6 -90.0 -54.0 21.2 33.7 69.8 104 98 A L H > S+ 0 0 43 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.896 108.9 52.5 -56.7 -45.4 21.8 30.1 68.6 105 99 A P H > S+ 0 0 2 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.905 111.8 46.4 -61.7 -34.5 18.7 29.9 66.3 106 100 A G H > S+ 0 0 0 -4,-0.5 4,-2.3 -3,-0.3 -2,-0.2 0.905 111.3 52.2 -69.7 -41.5 19.7 33.2 64.6 107 101 A A H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.938 111.9 46.1 -57.3 -46.9 23.3 32.0 64.2 108 102 A R H X S+ 0 0 6 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.899 110.4 51.9 -69.9 -38.8 22.2 28.8 62.6 109 103 A A H X S+ 0 0 4 -4,-2.2 4,-2.3 -5,-0.3 -1,-0.2 0.899 109.0 52.3 -59.7 -41.0 19.7 30.4 60.3 110 104 A A H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.915 107.9 49.9 -62.6 -42.5 22.5 32.8 59.2 111 105 A V H < S+ 0 0 3 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.899 113.1 49.1 -60.9 -39.3 24.8 29.8 58.4 112 106 A K H < S+ 0 0 28 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.894 117.2 38.6 -64.4 -44.0 21.9 28.3 56.4 113 107 A V H < S+ 0 0 39 -4,-2.3 -2,-0.2 -5,-0.1 -1,-0.2 0.772 90.4 99.8 -87.4 -24.4 21.1 31.5 54.4 114 108 A T < + 0 0 0 -4,-2.4 5,-0.1 -5,-0.2 70,-0.0 -0.283 40.2 179.0 -62.8 143.2 24.6 32.9 53.7 115 109 A K S S+ 0 0 177 3,-0.1 -1,-0.2 0, 0.0 -4,-0.0 0.658 83.5 39.6-109.2 -32.2 26.0 32.1 50.2 116 110 A N S S- 0 0 63 2,-0.2 3,-0.1 67,-0.1 -2,-0.1 0.406 104.1-121.3 -99.3 1.5 29.3 34.0 50.5 117 111 A N S S+ 0 0 65 1,-0.2 28,-2.7 27,-0.1 2,-0.5 0.823 73.9 124.0 62.4 35.1 30.1 32.9 54.2 118 112 A K E +f 145 0B 59 26,-0.2 67,-2.1 65,-0.1 68,-1.0 -0.929 35.9 172.6-127.4 104.7 30.2 36.6 55.3 119 113 A I E -fg 146 186B 0 26,-2.7 28,-2.2 -2,-0.5 2,-0.3 -0.889 13.0-165.8-119.0 137.8 27.8 37.1 58.2 120 114 A G E -fg 147 187B 0 66,-2.4 68,-2.7 -2,-0.4 2,-0.3 -0.854 1.8-162.8-116.0 161.6 27.2 40.1 60.5 121 115 A V E -fg 148 188B 0 26,-2.2 28,-2.3 -2,-0.3 2,-0.4 -0.988 1.2-165.4-140.1 140.7 25.3 40.6 63.7 122 116 A I E +fg 149 189B 0 66,-2.0 68,-1.6 -2,-0.3 2,-0.3 -0.955 29.0 122.3-119.6 147.0 24.2 43.7 65.4 123 117 A G E -f 150 0B 0 26,-1.3 28,-2.7 -2,-0.4 68,-0.2 -0.953 56.7 -40.6-175.4-170.1 23.0 44.0 69.0 124 118 A T > - 0 0 7 415,-0.5 4,-2.5 66,-0.5 5,-0.3 -0.174 58.9-102.4 -64.9 165.6 23.5 45.7 72.4 125 119 A L H > S+ 0 0 55 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.932 123.5 49.0 -51.0 -49.8 26.9 46.4 73.9 126 120 A G H > S+ 0 0 18 -76,-1.7 4,-1.5 1,-0.2 -1,-0.2 0.909 110.3 49.5 -62.1 -46.4 26.5 43.4 76.2 127 121 A T H 4>S+ 0 0 1 412,-0.2 5,-0.6 2,-0.2 4,-0.4 0.934 116.4 41.4 -55.6 -47.8 25.4 41.0 73.4 128 122 A I H ><5S+ 0 0 27 -4,-2.5 3,-1.6 1,-0.2 -2,-0.2 0.923 111.9 54.0 -73.9 -41.6 28.3 41.9 71.2 129 123 A K H 3<5S+ 0 0 163 -4,-2.9 -1,-0.2 -5,-0.3 -2,-0.2 0.784 99.8 63.1 -63.1 -26.5 31.0 42.1 73.9 130 124 A S T 3<5S- 0 0 34 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.687 94.5-143.5 -67.7 -22.1 30.0 38.5 75.1 131 125 A A T <>5 + 0 0 31 -3,-1.6 4,-2.4 -4,-0.4 5,-0.2 0.561 54.1 140.0 61.6 15.2 31.2 37.2 71.6 132 126 A S H >< + 0 0 27 -5,-0.6 4,-2.8 1,-0.2 5,-0.2 0.866 66.4 49.8 -54.5 -40.8 28.3 34.7 71.9 133 127 A Y H > S+ 0 0 3 -6,-0.4 4,-2.4 2,-0.2 5,-0.3 0.936 109.1 50.1 -65.3 -45.7 27.4 35.1 68.2 134 128 A E H > S+ 0 0 81 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.935 114.8 46.2 -59.0 -44.0 30.9 34.5 67.0 135 129 A I H X S+ 0 0 110 -4,-2.4 4,-1.6 1,-0.2 -2,-0.2 0.924 112.0 49.6 -62.4 -47.5 31.1 31.4 69.2 136 130 A A H < S+ 0 0 12 -4,-2.8 4,-0.3 -5,-0.2 -1,-0.2 0.827 117.2 41.3 -63.3 -35.5 27.6 30.1 68.0 137 131 A I H >X S+ 0 0 0 -4,-2.4 4,-2.4 -5,-0.2 3,-1.2 0.950 117.1 44.5 -76.3 -52.8 28.5 30.5 64.4 138 132 A K H 3< S+ 0 0 64 -4,-2.7 -2,-0.2 -5,-0.3 -3,-0.2 0.626 97.5 72.6 -75.2 -12.2 32.0 29.3 64.4 139 133 A S T 3< S+ 0 0 41 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.1 0.817 116.4 24.0 -65.8 -31.1 31.3 26.2 66.5 140 134 A K T <4 S+ 0 0 4 -3,-1.2 158,-0.7 -4,-0.3 -2,-0.2 0.754 140.4 23.4-100.7 -35.9 29.6 24.8 63.5 141 135 A A >< + 0 0 3 -4,-2.4 3,-1.9 155,-0.1 -2,-0.2 -0.665 65.5 176.9-135.6 78.3 31.2 26.6 60.6 142 136 A P T 3 S+ 0 0 65 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.613 75.6 59.8 -65.8 -16.3 34.6 27.8 61.8 143 137 A A T 3 S+ 0 0 95 2,-0.1 2,-0.2 -5,-0.0 -5,-0.1 0.479 78.0 108.9 -89.1 -5.4 35.6 29.3 58.4 144 138 A I S < S- 0 0 6 -3,-1.9 2,-0.5 -7,-0.1 -26,-0.2 -0.491 72.2-124.8 -70.8 140.9 32.7 31.7 58.1 145 139 A E E -f 118 0B 104 -28,-2.7 -26,-2.7 -2,-0.2 2,-0.5 -0.790 29.1-166.3 -87.7 124.4 33.7 35.4 58.6 146 140 A V E -f 119 0B 25 -2,-0.5 2,-0.5 -28,-0.2 -26,-0.2 -0.961 10.1-169.7-117.3 129.1 31.7 37.0 61.4 147 141 A T E -f 120 0B 24 -28,-2.2 -26,-2.2 -2,-0.5 2,-0.4 -0.970 7.7-166.4-115.9 128.3 31.5 40.7 62.0 148 142 A S E -f 121 0B 44 -2,-0.5 2,-0.4 -28,-0.2 -26,-0.2 -0.958 7.3-179.4-123.0 128.4 29.9 41.8 65.3 149 143 A L E -f 122 0B 33 -28,-2.3 -26,-1.3 -2,-0.4 2,-0.3 -0.976 22.1-138.1-138.2 118.7 28.8 45.4 65.8 150 144 A A E -f 123 0B 24 -2,-0.4 -26,-0.2 -28,-0.2 -25,-0.1 -0.597 14.5-171.6 -75.4 134.3 27.2 47.0 68.9 151 145 A C > + 0 0 1 -28,-2.7 3,-2.2 -2,-0.3 4,-0.5 -0.552 12.9 168.0-123.8 62.8 24.4 49.5 68.0 152 146 A P T 3 S+ 0 0 73 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.756 71.6 58.7 -55.9 -28.1 23.6 51.1 71.3 153 147 A K T 3> S+ 0 0 123 1,-0.2 4,-1.3 2,-0.1 19,-0.1 0.641 88.6 75.8 -73.8 -14.9 21.5 53.9 69.8 154 148 A F H <> S+ 0 0 0 -3,-2.2 4,-1.6 2,-0.2 3,-0.3 0.912 88.3 54.2 -71.7 -43.2 19.0 51.6 68.2 155 149 A V H > S+ 0 0 9 -4,-0.5 4,-2.5 -3,-0.3 3,-0.4 0.953 108.7 49.5 -56.5 -52.0 17.0 50.5 71.3 156 150 A P H > S+ 0 0 66 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.818 104.5 59.4 -57.2 -30.9 16.3 54.1 72.2 157 151 A I H <>S+ 0 0 6 -4,-1.3 5,-2.3 -3,-0.3 6,-0.3 0.910 110.9 41.9 -60.3 -44.2 15.1 54.9 68.7 158 152 A V H ><5S+ 0 0 18 -4,-1.6 3,-2.0 -3,-0.4 5,-0.3 0.940 112.9 53.2 -68.7 -44.0 12.4 52.2 69.0 159 153 A E H 3<5S+ 0 0 111 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.805 106.8 52.5 -62.1 -33.6 11.5 53.3 72.6 160 154 A S T 3<5S- 0 0 57 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.284 114.6-116.2 -84.8 7.5 11.0 56.9 71.6 161 155 A N T < 5S+ 0 0 131 -3,-2.0 3,-0.2 1,-0.1 -3,-0.2 0.772 84.7 117.2 63.8 29.0 8.6 55.8 68.8 162 156 A Q > < + 0 0 85 -5,-2.3 3,-1.7 -6,-0.2 6,-0.6 0.121 27.4 117.1-110.9 20.4 10.9 57.2 66.2 163 157 A Y T 3 S+ 0 0 39 -6,-0.3 37,-0.2 1,-0.3 -1,-0.1 0.609 81.1 41.1 -75.1 -8.2 11.7 53.9 64.4 164 158 A R T 3 S+ 0 0 190 -3,-0.2 -1,-0.3 -6,-0.1 -2,-0.1 0.298 98.2 109.4-109.2 3.6 10.1 55.1 61.1 165 159 A S S <> S- 0 0 33 -3,-1.7 4,-1.8 1,-0.1 5,-0.1 -0.252 82.0-112.6 -84.8 167.0 11.5 58.6 61.2 166 160 A S H > S+ 0 0 77 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.825 120.4 57.6 -58.4 -36.5 14.2 60.5 59.3 167 161 A V H > S+ 0 0 57 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.926 104.0 51.5 -61.8 -45.2 16.2 60.5 62.5 168 162 A A H > S+ 0 0 0 -6,-0.6 4,-2.9 1,-0.2 5,-0.3 0.927 109.8 49.8 -55.1 -48.3 16.0 56.6 62.6 169 163 A K H X S+ 0 0 105 -4,-1.8 4,-2.3 1,-0.2 -1,-0.2 0.911 112.1 47.1 -61.8 -44.0 17.3 56.4 59.1 170 164 A K H X S+ 0 0 113 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.920 114.0 46.6 -64.6 -44.9 20.2 58.8 59.8 171 165 A I H X S+ 0 0 34 -4,-2.7 4,-1.9 2,-0.2 5,-0.2 0.925 113.3 48.5 -65.0 -45.9 21.3 57.0 63.0 172 166 A V H X S+ 0 0 0 -4,-2.9 4,-2.9 -5,-0.2 5,-0.2 0.941 113.5 46.9 -60.3 -47.1 21.1 53.5 61.4 173 167 A A H X S+ 0 0 44 -4,-2.3 4,-1.2 -5,-0.3 -1,-0.2 0.904 110.8 52.7 -60.8 -40.0 23.1 54.6 58.4 174 168 A E H < S+ 0 0 116 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.879 116.1 39.3 -65.0 -37.8 25.7 56.3 60.6 175 169 A T H >< S+ 0 0 29 -4,-1.9 3,-1.7 1,-0.2 -2,-0.2 0.915 111.7 54.5 -77.5 -46.3 26.2 53.2 62.7 176 170 A L H >< S+ 0 0 4 -4,-2.9 3,-2.5 1,-0.3 4,-0.4 0.646 83.1 83.2 -73.8 -13.0 26.0 50.5 60.0 177 171 A Q G >< S+ 0 0 118 -4,-1.2 3,-1.3 1,-0.3 -1,-0.3 0.782 78.2 73.4 -58.0 -20.7 28.8 52.1 57.8 178 172 A A G < S+ 0 0 63 -3,-1.7 -1,-0.3 1,-0.2 3,-0.2 0.653 98.3 47.6 -65.2 -14.1 31.1 50.2 60.3 179 173 A L G X S+ 0 0 3 -3,-2.5 3,-1.9 1,-0.1 5,-0.4 0.551 84.4 95.2 -93.9 -14.5 29.9 47.0 58.4 180 174 A Q T < S+ 0 0 138 -3,-1.3 3,-0.4 -4,-0.4 -2,-0.1 0.641 78.6 53.0 -70.3 -18.2 30.4 48.2 54.8 181 175 A L T 3 S+ 0 0 158 -4,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.436 92.2 78.1 -89.1 2.6 33.9 46.9 54.1 182 176 A K S < S- 0 0 102 -3,-1.9 -1,-0.2 2,-0.0 -2,-0.1 0.437 90.5-131.4 -99.9 0.7 33.0 43.3 55.1 183 177 A G - 0 0 46 -3,-0.4 -65,-0.1 -4,-0.2 -3,-0.1 0.784 39.5-175.8 62.2 29.1 31.1 42.1 52.0 184 178 A L + 0 0 20 -5,-0.4 -65,-0.2 1,-0.1 -1,-0.2 -0.245 29.2 178.2 -62.1 142.1 28.2 40.8 54.1 185 179 A D S S+ 0 0 24 -67,-2.1 25,-2.6 1,-0.2 2,-0.3 0.484 73.7 41.9-111.7 -5.2 25.3 38.9 52.5 186 180 A T E -gh 119 210B 1 -68,-1.0 -66,-2.4 23,-0.3 2,-0.4 -1.000 59.7-171.7-143.4 137.6 23.5 38.2 55.8 187 181 A L E -gh 120 211B 0 23,-2.5 25,-2.2 -2,-0.3 2,-0.4 -0.985 16.2-143.6-137.3 120.6 22.9 40.3 59.0 188 182 A I E -gh 121 212B 0 -68,-2.7 -66,-2.0 -2,-0.4 2,-1.6 -0.723 12.2-138.8 -84.0 129.0 21.4 38.9 62.2 189 183 A L E -gh 122 213B 0 23,-3.0 2,-1.3 -2,-0.4 25,-0.9 -0.666 27.6-174.9 -85.9 83.2 19.1 41.3 64.0 190 184 A G + 0 0 0 -2,-1.6 -66,-0.5 -68,-1.6 2,-0.3 -0.184 51.2 67.1 -83.1 44.8 20.5 40.4 67.4 191 185 A C S > S- 0 0 1 -2,-1.3 3,-1.1 -68,-0.2 23,-0.2 -0.958 80.0-121.8-162.8 138.6 18.2 42.3 69.7 192 186 A T T 3 S+ 0 0 2 -2,-0.3 4,-0.2 1,-0.2 -168,-0.1 0.727 110.1 52.0 -53.4 -33.2 14.5 42.1 70.5 193 187 A H T > S+ 0 0 12 1,-0.2 3,-1.4 2,-0.1 4,-0.5 0.661 86.3 83.4 -82.6 -18.3 13.8 45.7 69.4 194 188 A Y G X S+ 0 0 0 -3,-1.1 3,-1.1 1,-0.3 4,-0.4 0.749 72.8 71.5 -69.5 -25.3 15.4 45.5 65.9 195 189 A P G > S+ 0 0 26 0, 0.0 3,-1.1 0, 0.0 -1,-0.3 0.857 95.6 57.2 -53.3 -29.3 12.4 43.9 64.1 196 190 A L G < S+ 0 0 30 -3,-1.4 -2,-0.2 1,-0.3 4,-0.2 0.781 110.1 43.9 -71.0 -23.3 10.7 47.3 64.5 197 191 A L G <> S+ 0 0 0 -3,-1.1 4,-2.6 -4,-0.5 3,-0.5 0.352 82.7 111.5 -96.4 4.4 13.7 48.9 62.6 198 192 A R H <> S+ 0 0 94 -3,-1.1 4,-3.0 -4,-0.4 5,-0.2 0.870 75.2 47.9 -54.5 -48.3 13.8 46.1 60.0 199 193 A P H > S+ 0 0 95 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.904 114.3 47.6 -62.5 -34.7 12.7 48.3 57.0 200 194 A V H > S+ 0 0 12 -3,-0.5 4,-2.1 -37,-0.2 -2,-0.2 0.928 114.2 46.0 -68.1 -44.4 15.2 51.0 57.9 201 195 A I H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 5,-0.2 0.906 111.9 52.3 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Y > + 0 0 0 1,-0.1 3,-1.8 2,-0.1 8,-0.1 0.626 59.8 92.2 -86.6 -25.3 9.9 5.5 45.6 313 44 B G T 3 S+ 0 0 4 1,-0.3 76,-1.7 75,-0.1 -1,-0.1 0.813 93.2 33.6 -42.1 -51.6 7.4 8.3 44.5 314 45 B P T 3 S+ 0 0 90 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.450 97.2 108.0 -88.2 0.8 4.9 5.9 42.9 315 46 B R S < S- 0 0 61 -3,-1.8 -3,-0.1 1,-0.1 2,-0.0 -0.378 77.3 -95.6 -80.3 153.7 5.3 3.0 45.2 316 47 B P >> - 0 0 65 0, 0.0 4,-2.2 0, 0.0 3,-0.6 -0.376 33.6-115.9 -63.8 146.6 2.8 1.8 47.9 317 48 B A H 3> S+ 0 0 28 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.859 113.2 55.5 -44.4 -46.2 3.4 3.1 51.4 318 49 B E H 3> S+ 0 0 147 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.884 108.2 47.3 -64.0 -39.1 4.0 -0.4 52.7 319 50 B Q H <> S+ 0 0 66 -3,-0.6 4,-2.5 2,-0.2 5,-0.2 0.921 110.6 51.4 -69.4 -44.8 6.8 -1.1 50.3 320 51 B V H X S+ 0 0 2 -4,-2.2 4,-2.6 1,-0.2 5,-0.2 0.900 108.4 52.9 -60.8 -39.1 8.5 2.2 50.9 321 52 B V H X S+ 0 0 20 -4,-2.5 4,-2.3 -5,-0.2 -1,-0.2 0.926 109.7 48.1 -60.3 -45.3 8.5 1.5 54.7 322 53 B Q H X S+ 0 0 102 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.937 113.8 46.4 -60.3 -46.8 10.1 -1.9 54.2 323 54 B F H X S+ 0 0 9 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.886 111.9 51.0 -64.8 -42.5 12.9 -0.4 51.9 324 55 B T H X S+ 0 0 0 -4,-2.6 4,-2.7 -5,-0.2 -1,-0.2 0.905 108.0 52.7 -63.9 -39.0 13.5 2.5 54.2 325 56 B W H X S+ 0 0 54 -4,-2.3 4,-2.9 -5,-0.2 5,-0.2 0.916 106.3 53.9 -61.7 -40.8 13.9 0.1 57.1 326 57 B E H X S+ 0 0 38 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.917 111.2 45.7 -59.7 -43.8 16.5 -1.9 55.1 327 58 B M H X S+ 0 0 0 -4,-2.0 4,-2.1 2,-0.2 5,-0.2 0.924 112.9 49.1 -64.6 -44.4 18.4 1.3 54.6 328 59 B A H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.929 110.9 50.4 -62.4 -43.8 18.2 2.4 58.2 329 60 B D H X S+ 0 0 79 -4,-2.9 4,-1.4 1,-0.2 -1,-0.2 0.901 108.1 53.9 -62.9 -39.9 19.3 -1.0 59.4 330 61 B F H < S+ 0 0 24 -4,-2.0 4,-0.3 -5,-0.2 -1,-0.2 0.918 112.8 41.6 -61.1 -44.9 22.3 -1.0 57.1 331 62 B L H ><>S+ 0 0 0 -4,-2.1 3,-1.5 1,-0.2 5,-1.0 0.832 105.4 65.3 -75.4 -27.8 23.6 2.4 58.4 332 63 B L H ><5S+ 0 0 46 -4,-2.3 3,-1.8 1,-0.3 -1,-0.2 0.900 95.8 57.9 -56.8 -38.1 22.8 1.5 62.0 333 64 B K T 3<5S+ 0 0 147 -4,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.655 96.6 64.6 -65.5 -17.6 25.4 -1.2 61.7 334 65 B K T < 5S- 0 0 65 -3,-1.5 -59,-0.3 -4,-0.3 -1,-0.3 0.223 114.6-113.7 -94.2 14.0 27.9 1.5 60.9 335 66 B R T < 5 + 0 0 183 -3,-1.8 -3,-0.2 1,-0.2 -2,-0.1 0.700 49.3 176.1 67.5 26.8 27.6 3.2 64.3 336 67 B I < - 0 0 7 -5,-1.0 -60,-0.2 1,-0.1 -1,-0.2 -0.285 27.2-148.5 -60.4 148.8 26.0 6.4 63.2 337 68 B K S S+ 0 0 8 -62,-2.4 2,-0.3 1,-0.2 -61,-0.2 0.512 79.4 15.5 -95.9 -10.3 24.9 8.8 66.0 338 69 B M E -j 276 0C 0 -63,-0.6 -61,-2.8 22,-0.2 2,-0.5 -0.959 67.8-141.0-164.1 144.7 21.9 10.2 64.1 339 70 B L E -jl 277 362C 0 22,-2.4 24,-2.5 -2,-0.3 2,-0.5 -0.979 9.2-166.3-119.4 128.2 19.8 9.3 61.1 340 71 B V E -jl 278 363C 5 -63,-2.6 -61,-2.1 -2,-0.5 2,-1.1 -0.967 13.7-149.5-110.1 120.2 18.4 11.7 58.5 341 72 B I E -jl 279 364C 0 22,-3.0 24,-0.7 -2,-0.5 -61,-0.1 -0.798 19.1-177.8 -86.5 98.5 15.8 10.4 56.2 342 73 B A + 0 0 0 -63,-1.8 2,-0.4 -2,-1.1 -62,-0.2 0.708 54.5 87.9 -75.1 -21.8 16.7 12.6 53.2 343 74 B C > - 0 0 0 -64,-1.0 4,-2.2 1,-0.1 22,-0.3 -0.678 62.8-157.0 -83.8 125.5 13.9 11.3 51.0 344 75 B N H > S+ 0 0 0 -2,-0.4 4,-2.0 2,-0.2 -1,-0.1 0.859 95.0 53.4 -69.1 -35.1 10.6 13.1 51.4 345 76 B T H > S+ 0 0 4 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.931 113.3 42.6 -68.5 -42.6 8.7 10.1 50.0 346 77 B A H >> S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 3,-0.9 0.902 112.2 53.6 -66.3 -42.6 10.3 7.8 52.6 347 78 B T H 3X S+ 0 0 9 -4,-2.2 4,-1.3 1,-0.2 5,-0.3 0.892 99.7 65.1 -57.6 -42.0 9.8 10.3 55.4 348 79 B A H 3< S+ 0 0 13 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.747 121.4 14.5 -55.7 -32.0 6.1 10.5 54.5 349 80 B V H << S+ 0 0 42 -3,-0.9 4,-0.2 -4,-0.6 -1,-0.2 0.667 130.5 40.3-117.5 -25.2 5.5 6.9 55.5 350 81 B A H X S+ 0 0 0 -4,-2.8 4,-2.1 -5,-0.2 5,-0.3 0.624 85.0 86.6-107.9 -17.6 8.5 5.6 57.6 351 82 B L H X S+ 0 0 21 -4,-1.3 4,-2.9 -5,-0.4 5,-0.3 0.912 87.5 50.2 -56.5 -51.8 9.7 8.4 59.9 352 83 B E H > S+ 0 0 171 -5,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.928 114.6 42.7 -58.6 -44.8 7.4 7.8 62.9 353 84 B E H > S+ 0 0 92 -4,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.888 116.5 46.5 -73.4 -35.0 8.1 4.1 63.2 354 85 B I H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.927 113.2 49.7 -69.9 -43.7 11.8 4.3 62.6 355 86 B K H < S+ 0 0 63 -4,-2.9 -2,-0.2 -5,-0.3 -1,-0.2 0.911 111.2 49.9 -58.3 -43.2 12.2 7.2 65.1 356 87 B A H < S+ 0 0 89 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.838 116.7 41.4 -66.4 -32.7 10.2 5.2 67.7 357 88 B A H < S+ 0 0 64 -4,-1.4 -2,-0.2 -5,-0.2 -1,-0.2 0.809 96.2 85.8 -87.4 -34.1 12.3 2.1 67.3 358 89 B L < - 0 0 23 -4,-2.3 4,-0.1 -5,-0.1 -4,-0.0 -0.422 67.2-139.7 -84.0 150.0 15.9 3.4 67.0 359 90 B P S S+ 0 0 116 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.123 86.1 62.5 -86.6 13.4 18.2 4.2 69.9 360 91 B I S S- 0 0 32 -5,-0.1 -22,-0.2 -21,-0.0 -2,-0.1 -0.942 99.7 -83.3-133.7 158.3 19.5 7.3 68.1 361 92 B P - 0 0 23 0, 0.0 -22,-2.4 0, 0.0 2,-0.4 -0.332 42.5-162.3 -61.4 143.7 17.8 10.5 67.0 362 93 B V E -l 339 0C 2 -24,-0.2 2,-0.4 -4,-0.1 -22,-0.2 -1.000 8.5-177.8-132.8 128.1 16.0 10.3 63.7 363 94 B V E -l 340 0C 10 -24,-2.5 -22,-3.0 -2,-0.4 2,-0.2 -0.966 7.0-160.0-126.4 141.9 14.9 13.3 61.6 364 95 B G E -l 341 0C 3 -2,-0.4 -22,-0.1 -24,-0.2 -20,-0.1 -0.632 27.3-116.1-111.7 179.5 13.1 13.5 58.3 365 96 B V S S+ 0 0 0 -24,-0.7 4,-0.4 -22,-0.3 116,-0.1 0.365 97.3 67.6-100.2 2.4 12.8 16.2 55.7 366 97 B I S >> S+ 0 0 3 2,-0.1 4,-2.6 -23,-0.1 3,-0.6 0.934 93.9 49.4 -90.6 -54.1 9.1 17.0 55.9 367 98 B L H 3> S+ 0 0 58 1,-0.3 4,-3.0 2,-0.2 5,-0.3 0.885 107.8 54.7 -58.3 -40.7 8.6 18.6 59.3 368 99 B P H 3> S+ 0 0 2 0, 0.0 4,-2.0 0, 0.0 -1,-0.3 0.887 110.7 46.2 -61.9 -35.2 11.4 21.1 58.9 369 100 B G H <> S+ 0 0 0 -3,-0.6 4,-2.3 -4,-0.4 -2,-0.2 0.903 112.1 50.9 -67.4 -42.8 9.9 22.3 55.6 370 101 B A H X S+ 0 0 4 -4,-2.6 4,-2.3 2,-0.2 5,-0.2 0.941 112.6 46.6 -58.5 -47.0 6.5 22.6 57.2 371 102 B R H X S+ 0 0 23 -4,-3.0 4,-2.0 1,-0.2 -2,-0.2 0.902 111.4 51.1 -66.1 -38.8 7.9 24.6 60.1 372 103 B A H X S+ 0 0 2 -4,-2.0 4,-2.0 -5,-0.3 -1,-0.2 0.887 109.1 51.1 -65.1 -40.0 9.9 26.8 57.8 373 104 B A H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.913 109.2 50.4 -66.0 -40.8 6.7 27.5 55.8 374 105 B V H < S+ 0 0 6 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.896 112.3 49.6 -60.9 -39.7 4.7 28.4 58.9 375 106 B K H < S+ 0 0 33 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.871 116.7 38.4 -66.2 -41.5 7.6 30.8 59.9 376 107 B V H < S+ 0 0 53 -4,-2.0 -2,-0.2 -5,-0.1 -1,-0.2 0.762 89.0 102.1 -89.2 -23.2 7.8 32.6 56.5 377 108 B T < + 0 0 0 -4,-2.3 5,-0.1 -5,-0.2 72,-0.0 -0.288 33.9 171.3 -64.2 138.9 4.2 32.9 55.4 378 109 B K S S+ 0 0 150 3,-0.1 -1,-0.1 0, 0.0 -4,-0.0 0.617 80.8 43.2-112.4 -30.4 2.5 36.3 55.8 379 110 B N S S- 0 0 68 2,-0.2 3,-0.1 67,-0.0 -2,-0.1 0.353 103.4-122.0 -98.6 3.3 -0.7 35.7 54.0 380 111 B N S S+ 0 0 58 1,-0.2 28,-2.8 27,-0.1 2,-0.5 0.783 74.4 121.4 61.5 31.1 -1.4 32.2 55.4 381 112 B K E +n 408 0D 74 26,-0.2 67,-2.3 65,-0.1 68,-1.0 -0.931 35.0 168.7-127.2 106.1 -1.5 30.6 52.0 382 113 B I E -no 409 449D 0 26,-2.5 28,-2.4 -2,-0.5 2,-0.3 -0.922 14.0-165.3-121.5 134.6 1.2 27.8 51.6 383 114 B G E -no 410 450D 0 66,-2.6 68,-2.7 -2,-0.4 2,-0.3 -0.806 1.9-161.2-110.9 162.8 1.6 25.2 48.9 384 115 B V E -no 411 451D 0 26,-2.2 28,-2.5 -2,-0.3 2,-0.4 -0.989 2.6-165.4-140.0 136.9 3.7 22.0 48.8 385 116 B I E +no 412 452D 0 66,-2.1 68,-1.7 -2,-0.3 2,-0.3 -0.931 27.9 124.0-117.3 147.9 4.7 20.0 45.8 386 117 B G E -n 413 0D 0 26,-1.2 28,-2.7 -2,-0.4 68,-0.2 -0.958 56.6 -47.1-177.1-174.4 6.1 16.4 45.9 387 118 B T > - 0 0 6 66,-0.5 4,-2.6 154,-0.4 5,-0.3 -0.239 58.1-101.9 -67.6 164.3 5.7 12.9 44.6 388 119 B L H > S+ 0 0 89 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.906 124.1 51.5 -49.2 -47.3 2.4 11.0 44.5 389 120 B G H > S+ 0 0 10 -76,-1.7 4,-1.6 2,-0.2 -1,-0.2 0.903 109.6 47.6 -58.7 -47.6 3.5 9.2 47.6 390 121 B T H 4>S+ 0 0 1 2,-0.2 5,-0.7 1,-0.2 4,-0.5 0.941 117.2 42.3 -61.2 -47.0 4.5 12.3 49.6 391 122 B I H ><5S+ 0 0 31 -4,-2.6 3,-1.4 1,-0.2 -2,-0.2 0.911 110.4 56.0 -70.2 -41.1 1.2 14.1 48.7 392 123 B K H 3<5S+ 0 0 156 -4,-3.0 -1,-0.2 -5,-0.3 -2,-0.2 0.852 100.6 60.1 -58.2 -35.5 -1.0 11.0 49.2 393 124 B S T 3<5S- 0 0 33 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.725 93.8-146.7 -63.1 -23.3 0.3 10.6 52.8 394 125 B A T <>5 + 0 0 29 -3,-1.4 4,-2.8 -4,-0.5 5,-0.3 0.635 50.1 142.3 57.7 20.7 -1.0 14.1 53.6 395 126 B S H >< + 0 0 26 -5,-0.7 4,-2.3 1,-0.2 5,-0.2 0.854 67.8 48.4 -59.4 -38.7 2.0 14.5 56.0 396 127 B Y H > S+ 0 0 3 -6,-0.3 4,-2.6 2,-0.2 5,-0.3 0.950 112.2 46.5 -67.8 -46.7 2.5 18.1 55.1 397 128 B E H > S+ 0 0 92 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.912 115.5 47.4 -61.2 -42.7 -1.2 19.1 55.5 398 129 B I H X S+ 0 0 107 -4,-2.8 4,-1.9 2,-0.2 -1,-0.2 0.924 112.8 48.2 -64.5 -45.9 -1.3 17.3 58.8 399 130 B A H X S+ 0 0 15 -4,-2.3 4,-0.5 -5,-0.3 -2,-0.2 0.935 116.9 41.4 -60.3 -47.9 1.9 18.8 60.1 400 131 B I H >X S+ 0 0 0 -4,-2.6 4,-3.1 1,-0.2 3,-1.1 0.925 115.2 49.1 -71.1 -45.2 1.0 22.3 59.2 401 132 B K H 3< S+ 0 0 83 -4,-2.7 -1,-0.2 -5,-0.3 -2,-0.2 0.788 106.8 56.6 -68.5 -26.9 -2.6 22.1 60.4 402 133 B S H 3< S+ 0 0 62 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.648 119.7 31.1 -75.4 -13.3 -1.6 20.6 63.7 403 134 B K H << S+ 0 0 12 -3,-1.1 -368,-0.6 -4,-0.5 -2,-0.2 0.775 137.7 12.0-107.6 -46.7 0.6 23.6 64.4 404 135 B A >< + 0 0 4 -4,-3.1 3,-1.9 -5,-0.2 -2,-0.1 -0.691 62.5 178.3-142.3 79.7 -1.0 26.6 62.7 405 136 B P T 3 S+ 0 0 61 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.536 71.2 75.2 -73.7 -4.8 -4.5 25.8 61.6 406 137 B A T 3 S+ 0 0 77 2,-0.1 2,-0.3 -5,-0.0 -5,-0.1 0.658 77.9 98.8 -70.1 -17.5 -5.2 29.3 60.2 407 138 B I S < S- 0 0 4 -3,-1.9 2,-0.6 -7,-0.2 -26,-0.2 -0.565 70.6-139.6 -79.9 133.9 -3.0 28.4 57.2 408 139 B E E -n 381 0D 112 -28,-2.8 -26,-2.5 -2,-0.3 2,-0.5 -0.837 22.1-159.0 -87.0 122.3 -4.6 27.2 54.0 409 140 B V E -n 382 0D 26 -2,-0.6 2,-0.5 -28,-0.2 -26,-0.2 -0.927 11.2-167.7-110.9 125.2 -2.5 24.4 52.6 410 141 B T E -n 383 0D 30 -28,-2.4 -26,-2.2 -2,-0.5 2,-0.4 -0.965 9.5-167.3-110.7 119.6 -2.6 23.4 48.9 411 142 B S E -n 384 0D 45 -2,-0.5 2,-0.4 -28,-0.2 -26,-0.2 -0.905 6.9-179.2-110.1 133.1 -0.8 20.1 48.2 412 143 B L E -n 385 0D 53 -28,-2.5 -26,-1.2 -2,-0.4 2,-0.3 -0.976 22.3-139.4-139.3 118.5 -0.0 19.1 44.6 413 144 B A E -n 386 0D 22 -2,-0.4 -26,-0.2 -28,-0.2 -25,-0.1 -0.624 13.9-168.2 -72.1 136.1 1.6 15.9 43.3 414 145 B C >> + 0 0 0 -28,-2.7 3,-2.4 -2,-0.3 4,-0.5 -0.578 12.3 171.6-124.3 65.4 4.1 16.7 40.5 415 146 B P T 34 S+ 0 0 76 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 0.725 73.1 56.7 -55.9 -27.8 4.9 13.2 39.0 416 147 B K T 3> S+ 0 0 110 1,-0.2 4,-2.0 2,-0.1 19,-0.1 0.628 90.5 75.8 -75.5 -16.7 6.8 14.5 36.0 417 148 B F H <> S+ 0 0 0 -3,-2.4 4,-2.2 2,-0.2 5,-0.2 0.923 91.6 48.6 -69.6 -46.3 9.3 16.5 38.1 418 149 B V H X S+ 0 0 12 -4,-0.5 4,-3.2 -3,-0.2 5,-0.3 0.962 112.2 50.8 -59.2 -50.4 11.5 13.6 39.4 419 150 B P H > S+ 0 0 76 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.888 107.3 54.4 -51.8 -40.1 11.8 12.2 35.8 420 151 B I H <>S+ 0 0 15 -4,-2.0 5,-0.8 2,-0.2 4,-0.3 0.947 114.0 40.5 -57.5 -49.3 12.8 15.6 34.5 421 152 B V H ><5S+ 0 0 18 -4,-2.2 3,-1.8 1,-0.2 5,-0.2 0.932 113.2 53.4 -67.9 -45.5 15.6 15.8 37.0 422 153 B E H 3<5S+ 0 0 107 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.838 102.9 60.3 -56.7 -34.4 16.6 12.1 36.6 423 154 B S T 3<5S- 0 0 63 -4,-2.1 -1,-0.3 -5,-0.3 -2,-0.2 0.582 104.5-131.5 -67.4 -15.1 16.9 12.8 32.8 424 155 B N T < 5S+ 0 0 122 -3,-1.8 2,-0.3 -4,-0.3 3,-0.2 0.400 84.4 102.5 74.5 1.6 19.6 15.4 33.4 425 156 B Q > < + 0 0 137 -5,-0.8 3,-0.9 1,-0.2 6,-0.3 -0.373 34.6 133.4-112.8 53.3 17.7 17.8 31.1 426 157 B Y T 3 + 0 0 32 -2,-0.3 -1,-0.2 1,-0.2 37,-0.2 0.347 69.0 50.8 -92.7 5.0 16.2 19.9 33.9 427 158 B R T 3 S+ 0 0 180 -3,-0.2 -1,-0.2 -7,-0.1 -2,-0.1 0.254 87.4 115.9-118.4 10.6 17.1 23.3 32.3 428 159 B S S <> S- 0 0 35 -3,-0.9 4,-2.3 1,-0.1 5,-0.2 -0.257 78.9-112.4 -80.8 165.8 15.6 22.5 28.9 429 160 B S H > S+ 0 0 88 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.870 120.8 54.6 -60.2 -40.0 12.7 24.2 27.1 430 161 B V H > S+ 0 0 101 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.930 109.2 47.4 -59.2 -46.8 10.8 20.9 27.4 431 162 B A H > S+ 0 0 2 -6,-0.3 4,-2.5 1,-0.2 -2,-0.2 0.920 110.7 50.9 -62.3 -43.3 11.4 21.0 31.2 432 163 B K H X S+ 0 0 105 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.889 109.8 51.1 -64.9 -39.9 10.3 24.6 31.6 433 164 B K H X S+ 0 0 121 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.920 110.6 47.7 -60.8 -45.0 7.1 23.9 29.7 434 165 B I H X S+ 0 0 31 -4,-2.1 4,-2.9 2,-0.2 5,-0.2 0.914 110.9 50.5 -65.2 -43.3 6.2 21.0 31.9 435 166 B V H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.940 112.3 48.0 -60.1 -44.0 6.9 22.9 35.1 436 167 B A H X S+ 0 0 39 -4,-2.2 4,-0.6 -5,-0.2 -2,-0.2 0.926 114.6 46.0 -61.1 -45.9 4.7 25.8 33.8 437 168 B E H >< S+ 0 0 116 -4,-2.6 3,-0.9 1,-0.2 4,-0.4 0.934 113.9 47.8 -61.5 -48.1 1.9 23.4 32.9 438 169 B T H 3< S+ 0 0 35 -4,-2.9 3,-0.3 1,-0.2 4,-0.3 0.890 118.2 39.7 -64.3 -38.9 2.0 21.4 36.1 439 170 B L H 3X S+ 0 0 0 -4,-2.3 4,-2.8 -5,-0.2 -1,-0.2 0.408 85.1 102.7 -95.0 5.8 2.0 24.5 38.3 440 171 B Q H 4 S+ 0 0 5 -4,-0.3 3,-2.1 1,-0.2 5,-0.5 0.907 99.3 61.4 -66.4 -42.7 -1.2 26.4 41.7 443 174 B Q H >< S+ 0 0 85 -4,-2.8 3,-1.0 1,-0.3 -1,-0.2 0.860 100.2 58.3 -45.7 -40.5 0.0 29.8 40.5 444 175 B L T 3< S+ 0 0 127 -4,-1.0 -1,-0.3 -3,-0.4 -2,-0.2 0.610 84.9 78.4 -69.4 -15.5 -3.6 30.9 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