==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 29-OCT-07 3B6P . COMPND 2 MOLECULE: THREE PRIME REPAIR EXONUCLEASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR M.BRUCET,J.QUEROL-AUDI,I.FITA,A.CELADA . 868 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 35636.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 528 60.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 40 4.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 92 10.6 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 . 5 0.6 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 . 39 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 61 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 256 29.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 1.4 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 4 4 4 0 8 4 4 8 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 8 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 . 0 4 2 0 0 4 0 0 4 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 0 0 0 0 0 0 0 0 2 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 9 A G 0 0 76 0, 0.0 200,-0.1 0, 0.0 32,-0.0 0.000 360.0 360.0 360.0 60.3 27.4 8.2 -18.4 2 10 A H + 0 0 94 31,-0.0 2,-0.5 2,-0.0 31,-0.1 0.868 360.0 91.2 -95.4 -42.4 27.8 10.7 -15.5 3 11 A M + 0 0 6 197,-0.2 108,-0.2 1,-0.2 3,-0.1 -0.428 48.4 179.3 -60.7 109.7 28.5 8.7 -12.4 4 12 A Q + 0 0 59 106,-1.5 29,-3.0 -2,-0.5 2,-0.4 0.777 64.6 34.9 -85.7 -30.5 32.3 8.6 -12.2 5 13 A T E -Ab 32 111A 0 105,-1.6 107,-2.1 27,-0.2 2,-0.5 -0.992 59.6-163.5-130.9 130.9 32.6 6.6 -9.0 6 14 A L E -Ab 31 112A 0 25,-2.7 25,-2.3 -2,-0.4 2,-0.8 -0.972 11.2-159.9-108.5 120.8 30.5 3.8 -7.5 7 15 A I E -Ab 30 113A 0 105,-2.9 107,-3.2 -2,-0.5 2,-0.5 -0.876 8.9-148.2-103.3 104.9 31.2 3.2 -3.8 8 16 A F E -Ab 29 114A 0 21,-2.6 21,-1.8 -2,-0.8 2,-0.4 -0.614 26.3-171.9 -73.0 120.9 30.0 -0.3 -2.8 9 17 A L E +A 28 0A 2 105,-3.6 107,-0.4 -2,-0.5 2,-0.3 -0.915 18.7 171.1-125.0 141.6 28.9 0.1 0.8 10 18 A D E -A 27 0A 17 17,-1.5 17,-1.7 -2,-0.4 2,-0.4 -0.981 11.7-159.8-146.9 141.7 27.8 -2.3 3.6 11 19 A L E -A 26 0A 6 -2,-0.3 2,-0.4 15,-0.2 15,-0.2 -0.952 6.6-155.2-119.9 139.1 27.2 -1.7 7.3 12 20 A E E +A 25 0A 13 13,-2.5 12,-3.0 -2,-0.4 13,-1.7 -0.881 27.4 175.8-100.5 146.7 27.1 -4.1 10.2 13 21 A A E -A 23 0A 5 -2,-0.4 10,-0.2 10,-0.3 64,-0.1 -0.861 45.0 -96.3-144.4 176.7 24.9 -3.0 13.2 14 22 A T S S- 0 0 4 8,-1.6 56,-2.9 -2,-0.3 59,-0.3 0.682 90.1 -50.6 -72.4 -21.3 23.6 -4.0 16.6 15 23 A G S S- 0 0 10 54,-0.2 -1,-0.1 7,-0.1 54,-0.0 -0.940 78.0 -30.4 179.5-155.8 20.2 -5.1 15.2 16 24 A L > - 0 0 127 -2,-0.3 3,-1.8 4,-0.1 4,-0.3 -0.424 63.3 -95.5 -88.5 162.4 17.1 -4.5 13.1 17 25 A P G > S+ 0 0 56 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 0.770 120.6 58.6 -45.1 -39.0 15.4 -1.1 12.4 18 26 A S G 3 S+ 0 0 70 1,-0.3 0, 0.0 2,-0.1 0, 0.0 0.753 99.9 56.7 -67.8 -26.6 12.9 -1.5 15.2 19 27 A S G < S- 0 0 54 -3,-1.8 -1,-0.3 0, 0.0 -5,-0.0 0.436 112.8-118.0 -82.5 -0.2 15.6 -1.8 17.9 20 28 A R < - 0 0 121 -3,-1.3 -2,-0.1 -4,-0.3 -4,-0.1 0.995 43.8-148.2 55.0 69.6 17.1 1.6 16.8 21 29 A P - 0 0 0 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.195 11.9-144.3 -74.8 156.6 20.4 0.0 15.8 22 30 A E - 0 0 34 45,-0.1 -8,-1.6 46,-0.1 -7,-0.1 -0.953 29.5-102.1-118.6 142.1 23.9 1.5 15.9 23 31 A V E +A 13 0A 1 -2,-0.4 -10,-0.3 -10,-0.2 69,-0.1 -0.371 36.8 172.1 -65.6 131.3 26.7 0.9 13.3 24 32 A T E + 0 0 0 -12,-3.0 39,-3.4 1,-0.4 2,-0.3 0.594 68.7 13.8-111.2 -23.0 29.4 -1.6 14.4 25 33 A E E -AC 12 62A 7 -13,-1.7 -13,-2.5 37,-0.3 -1,-0.4 -0.985 61.2-169.7-154.0 143.4 31.3 -2.0 11.1 26 34 A L E -AC 11 61A 1 35,-2.5 35,-2.7 -2,-0.3 2,-0.4 -0.987 1.9-170.1-134.0 149.1 31.5 -0.2 7.8 27 35 A C E -AC 10 60A 0 -17,-1.7 -17,-1.5 -2,-0.3 2,-0.4 -0.985 0.8-172.1-138.0 130.3 33.1 -0.9 4.4 28 36 A L E -AC 9 59A 5 31,-3.3 31,-2.6 -2,-0.4 2,-0.5 -0.980 0.4-172.9-119.1 129.9 33.5 1.5 1.5 29 37 A L E -AC 8 58A 2 -21,-1.8 -21,-2.6 -2,-0.4 2,-0.5 -0.865 8.7-160.2-126.5 97.8 34.7 0.2 -1.9 30 38 A A E +AC 7 57A 2 27,-2.4 27,-2.1 -2,-0.5 2,-0.4 -0.656 14.3 175.8 -81.2 122.1 35.4 3.0 -4.4 31 39 A V E -A 6 0A 0 -25,-2.3 -25,-2.7 -2,-0.5 25,-0.1 -0.995 27.2-126.3-129.7 124.0 35.4 1.7 -8.0 32 40 A H E >> -A 5 0A 6 -2,-0.4 3,-1.3 23,-0.4 4,-1.2 -0.377 26.1-113.4 -67.0 146.0 35.8 4.1 -11.0 33 41 A R H >> S+ 0 0 22 -29,-3.0 4,-2.4 1,-0.3 3,-0.5 0.854 115.5 55.2 -42.7 -47.9 33.2 3.8 -13.8 34 42 A R H 3> S+ 0 0 121 1,-0.2 4,-2.0 -30,-0.2 -1,-0.3 0.755 101.0 58.1 -65.2 -28.4 35.8 2.5 -16.3 35 43 A A H <4 S+ 0 0 12 -3,-1.3 -1,-0.2 2,-0.2 -2,-0.2 0.841 111.1 41.9 -70.8 -35.6 36.8 -0.4 -14.0 36 44 A L H X< S+ 0 0 0 -4,-1.2 3,-1.3 -3,-0.5 -2,-0.2 0.883 112.8 54.4 -74.4 -42.4 33.2 -1.7 -14.0 37 45 A E H 3< S+ 0 0 60 -4,-2.4 -2,-0.2 1,-0.2 -3,-0.2 0.906 108.1 49.5 -54.2 -46.4 32.8 -1.0 -17.7 38 46 A N T 3< S+ 0 0 135 -4,-2.0 2,-0.3 -5,-0.1 -1,-0.2 0.320 84.2 109.5 -86.0 7.3 35.8 -3.1 -18.6 39 47 A T S < S- 0 0 19 -3,-1.3 158,-0.1 1,-0.1 2,-0.1 -0.663 83.1-100.1 -75.1 138.2 34.7 -6.1 -16.4 40 48 A S - 0 0 103 -2,-0.3 2,-0.3 1,-0.1 -1,-0.1 -0.356 31.6-116.4 -63.7 135.4 33.7 -9.0 -18.7 41 49 A I - 0 0 99 1,-0.1 154,-0.2 154,-0.1 153,-0.1 -0.609 45.8 -97.4 -71.0 131.0 30.0 -9.5 -19.3 42 50 A S + 0 0 31 152,-1.7 2,-0.3 -2,-0.3 -1,-0.1 -0.255 46.6 179.1 -60.6 127.1 29.1 -12.9 -17.8 43 51 A Q + 0 0 173 5,-0.1 2,-0.1 3,-0.1 -1,-0.0 -0.958 40.5 38.1-126.1 149.6 28.9 -15.9 -20.2 44 52 A G S S- 0 0 44 -2,-0.3 -2,-0.0 3,-0.1 0, 0.0 -0.222 89.1 -69.7 99.5 166.8 28.1 -19.5 -19.4 45 53 A H S S+ 0 0 185 1,-0.6 -1,-0.1 -2,-0.1 126,-0.1 -0.824 130.9 12.8-139.4 97.6 25.7 -21.2 -17.1 46 54 A P S S- 0 0 47 0, 0.0 -1,-0.6 0, 0.0 125,-0.1 0.549 97.9-146.4 -83.1 153.8 26.8 -20.6 -14.4 47 55 A P - 0 0 9 0, 0.0 -3,-0.1 0, 0.0 2,-0.1 -0.446 29.9 -96.7 -71.6 154.2 29.4 -17.9 -15.3 48 56 A P - 0 0 102 0, 0.0 -5,-0.1 0, 0.0 3,-0.1 -0.397 47.3 -90.8 -69.0 151.2 32.6 -17.8 -13.2 49 57 A V - 0 0 45 122,-0.2 142,-0.1 1,-0.1 141,-0.0 -0.504 53.6-114.1 -63.3 120.6 32.7 -15.3 -10.3 50 58 A P - 0 0 19 0, 0.0 -1,-0.1 0, 0.0 143,-0.1 -0.198 23.6-112.9 -61.2 146.5 34.2 -12.1 -11.8 51 59 A R - 0 0 222 142,-0.1 3,-0.1 1,-0.1 0, 0.0 -0.662 33.7-115.4 -77.6 131.6 37.6 -10.8 -10.7 52 60 A P - 0 0 69 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 -0.323 42.8 -87.9 -60.5 150.0 37.5 -7.4 -8.8 53 61 A P - 0 0 21 0, 0.0 -17,-0.0 0, 0.0 -18,-0.0 -0.249 27.3-132.7 -61.2 148.9 39.1 -4.4 -10.5 54 62 A R S S+ 0 0 74 1,-0.2 2,-0.9 -3,-0.1 463,-0.0 0.947 96.0 61.6 -67.0 -51.5 42.8 -3.9 -9.9 55 63 A V S S+ 0 0 4 461,-0.1 -23,-0.4 -23,-0.0 2,-0.3 -0.709 75.6 145.6 -82.8 105.4 42.5 -0.2 -9.2 56 64 A V - 0 0 20 -2,-0.9 2,-0.5 -25,-0.1 -25,-0.2 -0.998 42.7-143.9-144.1 139.4 40.3 0.0 -6.1 57 65 A D E -C 30 0A 0 -27,-2.1 -27,-2.4 -2,-0.3 2,-0.4 -0.946 26.3-171.1-103.5 124.4 40.0 2.2 -3.0 58 66 A K E +CD 29 498A 12 440,-3.3 440,-2.8 -2,-0.5 2,-0.4 -0.952 15.5 176.0-122.9 133.3 39.0 0.3 0.1 59 67 A L E +CD 28 497A 0 -31,-2.6 -31,-3.3 -2,-0.4 2,-0.4 -0.971 6.4 170.1-133.1 120.1 38.0 1.4 3.6 60 68 A S E +CD 27 496A 2 436,-2.9 436,-3.1 -2,-0.4 2,-0.4 -0.997 9.0 174.8-131.1 127.9 36.9 -1.0 6.3 61 69 A L E -C 26 0A 0 -35,-2.7 -35,-2.5 -2,-0.4 2,-0.5 -0.995 26.5-140.4-140.8 135.3 36.4 0.0 9.9 62 70 A C E -C 25 0A 0 -2,-0.4 2,-0.4 -37,-0.2 28,-0.4 -0.822 24.9-164.4 -93.4 131.2 35.2 -1.5 13.2 63 71 A I - 0 0 0 -39,-3.4 28,-0.2 -2,-0.5 22,-0.1 -0.962 17.1-131.2-124.1 128.6 33.1 0.9 15.3 64 72 A A - 0 0 2 26,-1.6 28,-0.4 -2,-0.4 2,-0.1 -0.668 27.6-144.2 -78.1 123.9 32.1 0.5 19.0 65 73 A P - 0 0 2 0, 0.0 4,-0.1 0, 0.0 -41,-0.1 -0.423 15.1-128.9 -83.8 163.1 28.4 1.1 19.5 66 74 A G S S+ 0 0 24 -2,-0.1 2,-0.3 2,-0.1 631,-0.2 0.812 95.9 46.1 -76.5 -34.0 26.7 2.8 22.5 67 75 A K S S- 0 0 75 1,-0.1 -45,-0.1 629,-0.1 629,-0.1 -0.791 97.1 -98.6-109.3 153.5 24.3 -0.1 23.0 68 76 A A - 0 0 44 -2,-0.3 2,-0.1 627,-0.1 -46,-0.1 -0.331 39.6-105.9 -68.9 149.4 25.1 -3.9 22.9 69 77 A C - 0 0 8 1,-0.1 -54,-0.2 -4,-0.1 -55,-0.1 -0.423 38.2-105.2 -68.5 148.8 24.5 -6.0 19.8 70 78 A S > - 0 0 47 -56,-2.9 4,-2.7 1,-0.1 5,-0.2 -0.421 29.7-112.4 -69.1 151.6 21.6 -8.4 19.8 71 79 A P H > S+ 0 0 29 0, 0.0 4,-1.8 0, 0.0 -1,-0.1 0.875 119.4 49.2 -52.3 -40.6 22.4 -12.1 20.3 72 80 A G H > S+ 0 0 37 2,-0.2 4,-1.7 1,-0.2 5,-0.2 0.868 111.5 47.4 -67.4 -40.9 21.3 -12.8 16.7 73 81 A A H > S+ 0 0 11 -59,-0.3 4,-2.3 2,-0.2 6,-0.4 0.882 112.0 50.4 -68.2 -40.5 23.4 -9.9 15.3 74 82 A S H X S+ 0 0 32 -4,-2.7 4,-1.8 -60,-0.2 -2,-0.2 0.874 108.7 53.8 -63.0 -39.5 26.5 -11.0 17.2 75 83 A E H < S+ 0 0 164 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.926 116.5 35.1 -61.3 -48.9 26.0 -14.6 16.0 76 84 A I H < S+ 0 0 83 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.854 124.4 39.9 -78.4 -36.8 25.9 -13.7 12.3 77 85 A T H < S- 0 0 5 -4,-2.3 -3,-0.2 2,-0.2 -2,-0.2 0.754 93.6-134.6 -85.2 -26.8 28.4 -10.8 12.2 78 86 A G < + 0 0 52 -4,-1.8 2,-0.3 -5,-0.3 -4,-0.1 0.525 68.2 116.5 79.7 7.6 31.0 -12.2 14.7 79 87 A L + 0 0 4 -6,-0.4 2,-0.3 -5,-0.1 -1,-0.3 -0.838 39.2 178.2-111.4 145.4 31.1 -8.8 16.4 80 88 A S > - 0 0 34 -2,-0.3 4,-2.4 -3,-0.1 5,-0.2 -0.984 37.5-123.1-139.4 151.6 30.1 -7.8 19.9 81 89 A K H > S+ 0 0 1 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.870 113.1 54.8 -56.8 -41.0 30.3 -4.4 21.8 82 90 A A H > S+ 0 0 8 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.913 111.9 41.8 -59.5 -47.5 32.4 -6.0 24.5 83 91 A E H > S+ 0 0 82 2,-0.2 4,-0.9 1,-0.2 -2,-0.2 0.840 113.8 53.0 -72.0 -34.9 35.0 -7.3 22.0 84 92 A L H <>S+ 0 0 0 -4,-2.4 5,-2.5 2,-0.2 -2,-0.2 0.893 113.4 43.3 -65.2 -40.8 35.0 -4.1 20.0 85 93 A E H ><5S+ 0 0 20 -4,-2.3 3,-1.6 3,-0.2 -2,-0.2 0.864 109.8 54.0 -75.3 -38.3 35.6 -2.0 23.1 86 94 A V H 3<5S+ 0 0 43 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.685 107.8 53.2 -71.1 -17.9 38.3 -4.2 24.6 87 95 A Q T 3<5S- 0 0 11 -4,-0.9 -1,-0.3 -5,-0.1 -2,-0.2 0.113 123.2-108.0-100.9 17.4 40.1 -3.9 21.3 88 96 A G T < 5 + 0 0 23 -3,-1.6 2,-0.2 1,-0.2 -3,-0.2 0.733 55.7 167.9 68.9 30.1 40.0 -0.1 21.5 89 97 A R < - 0 0 14 -5,-2.5 -1,-0.2 -6,-0.1 2,-0.2 -0.551 26.6-134.1 -75.8 138.8 37.4 0.7 18.8 90 98 A Q - 0 0 58 -28,-0.4 -26,-1.6 454,-0.3 -1,-0.1 -0.520 20.3-100.1 -93.0 159.9 36.0 4.3 18.9 91 99 A R - 0 0 118 -28,-0.2 2,-1.5 -2,-0.2 5,-0.2 -0.098 49.4 -82.3 -67.0 169.0 32.4 5.5 18.6 92 100 A F S S+ 0 0 22 -28,-0.4 2,-0.2 -69,-0.1 -1,-0.1 -0.653 82.1 150.6 -72.4 91.5 30.7 6.9 15.5 93 101 A D > - 0 0 47 -2,-1.5 4,-1.3 40,-0.1 3,-0.4 -0.493 62.8 -82.7-123.2-174.6 32.2 10.3 16.1 94 102 A D H > S+ 0 0 55 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.821 122.0 57.8 -62.7 -36.5 33.4 13.5 14.3 95 103 A N H > S+ 0 0 12 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.840 104.9 52.0 -62.7 -35.5 36.9 12.1 13.5 96 104 A L H > S+ 0 0 0 -3,-0.4 4,-2.5 2,-0.2 -1,-0.2 0.850 107.0 52.7 -67.3 -37.0 35.2 9.2 11.6 97 105 A A H X S+ 0 0 2 -4,-1.3 4,-2.0 2,-0.2 -2,-0.2 0.843 109.7 48.7 -66.2 -36.1 33.2 11.8 9.6 98 106 A I H X S+ 0 0 71 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.887 110.2 52.2 -67.4 -42.2 36.5 13.5 8.8 99 107 A L H X S+ 0 0 0 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.929 111.5 45.6 -58.4 -49.6 37.9 10.1 7.7 100 108 A L H X S+ 0 0 7 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.886 110.9 53.7 -63.3 -41.5 35.0 9.4 5.4 101 109 A R H X S+ 0 0 97 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.923 109.6 46.9 -58.7 -48.6 35.1 12.9 3.9 102 110 A A H X S+ 0 0 2 -4,-2.3 4,-0.8 2,-0.2 -1,-0.2 0.831 112.6 50.8 -64.3 -34.4 38.8 12.6 3.0 103 111 A F H < S+ 0 0 0 -4,-1.7 3,-0.4 -5,-0.2 -2,-0.2 0.905 113.4 44.1 -67.1 -44.4 38.2 9.2 1.5 104 112 A L H >< S+ 0 0 8 -4,-2.6 3,-1.2 1,-0.2 -2,-0.2 0.799 106.6 62.0 -69.0 -31.4 35.3 10.5 -0.6 105 113 A Q H 3< S+ 0 0 114 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.756 97.0 58.9 -66.3 -27.2 37.4 13.6 -1.5 106 114 A R T 3< S+ 0 0 0 -4,-0.8 422,-0.3 -3,-0.4 -1,-0.2 0.562 92.6 85.5 -78.6 -10.5 39.9 11.2 -3.2 107 115 A Q S < S- 0 0 2 -3,-1.2 2,-0.1 -4,-0.2 -102,-0.1 -0.772 87.7-110.2 -97.9 136.1 37.2 9.9 -5.6 108 116 A P - 0 0 26 0, 0.0 -104,-0.1 0, 0.0 -103,-0.1 -0.433 54.8 -86.5 -62.6 132.9 36.3 11.6 -8.9 109 117 A Q S S+ 0 0 95 -2,-0.1 2,-0.1 -105,-0.1 33,-0.1 -0.528 99.4 55.2 -89.9 156.9 32.8 13.2 -8.7 110 118 A P S S- 0 0 42 0, 0.0 -105,-1.6 0, 0.0 -106,-1.5 0.556 76.0-169.6 -73.2 151.3 29.9 12.6 -9.1 111 119 A C E -b 5 0A 1 30,-0.4 32,-3.1 -107,-0.2 2,-0.4 -0.839 11.2-163.1-111.4 149.1 29.9 9.7 -6.7 112 120 A C E -be 6 143A 1 -107,-2.1 -105,-2.9 -2,-0.3 2,-0.3 -0.973 13.0-140.8-136.1 122.4 27.2 7.1 -6.0 113 121 A L E -be 7 144A 1 30,-3.1 32,-2.3 -2,-0.4 2,-0.5 -0.617 15.5-159.0 -76.7 132.9 26.9 4.8 -3.0 114 122 A V E +be 8 145A 2 -107,-3.2 -105,-3.6 -2,-0.3 2,-0.4 -0.972 20.4 162.2-117.0 119.5 25.8 1.2 -3.8 115 123 A A E > - e 0 146A 0 30,-1.8 3,-1.5 -2,-0.5 32,-1.4 -1.000 40.1-119.5-140.7 136.9 24.2 -0.8 -1.0 116 124 A H T 3 S- 0 0 20 -107,-0.4 6,-0.2 -2,-0.4 30,-0.1 -0.647 105.9 -0.7 -77.3 122.1 22.1 -3.9 -0.9 117 125 A N T 3>>S+ 0 0 37 -2,-0.5 4,-1.2 4,-0.1 5,-0.7 0.811 93.0 147.9 61.1 34.4 18.8 -3.0 0.8 118 126 A G T <4> + 0 0 0 -3,-1.5 5,-2.5 1,-0.2 -2,-0.1 0.845 58.7 59.4 -66.1 -37.9 20.3 0.5 1.2 119 127 A D T 45S+ 0 0 62 -4,-0.3 -1,-0.2 1,-0.2 -3,-0.1 0.779 116.8 31.2 -65.4 -29.8 17.0 2.3 0.9 120 128 A R T 45S+ 0 0 173 -3,-0.4 -1,-0.2 3,-0.1 -2,-0.2 0.558 139.9 3.0-105.0 -12.8 15.4 0.6 3.9 121 129 A Y T X5S+ 0 0 40 -4,-1.2 4,-2.0 3,-0.0 5,-0.2 0.552 120.8 43.5-134.7 -71.7 18.5 -0.0 6.0 122 130 A D H > S+ 0 0 14 0, 0.0 92,-2.0 0, 0.0 4,-1.5 0.833 114.9 50.3 -63.0 -33.2 18.8 5.8 6.6 125 133 A L H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.926 111.7 46.7 -68.3 -47.0 21.0 4.3 9.4 126 134 A L H X S+ 0 0 5 -4,-2.0 4,-2.0 -5,-0.2 -1,-0.2 0.851 111.0 53.1 -62.8 -36.6 24.1 6.1 8.1 127 135 A Q H X S+ 0 0 24 -4,-2.2 4,-1.0 2,-0.2 -1,-0.2 0.858 109.9 48.9 -64.2 -37.9 22.0 9.3 7.8 128 136 A T H X S+ 0 0 6 -4,-1.5 4,-0.9 2,-0.2 -2,-0.2 0.898 111.2 48.3 -67.6 -44.8 20.9 8.8 11.5 129 137 A E H < S+ 0 0 4 -4,-2.4 4,-0.4 1,-0.2 3,-0.2 0.852 113.5 46.9 -66.2 -37.1 24.5 8.3 12.7 130 138 A L H < S+ 0 0 6 -4,-2.0 3,-0.4 1,-0.2 -1,-0.2 0.713 103.8 63.4 -77.0 -22.7 25.8 11.4 10.8 131 139 A A H < S+ 0 0 73 -4,-1.0 -1,-0.2 1,-0.2 -2,-0.2 0.776 95.2 60.2 -70.7 -29.2 22.9 13.5 12.2 132 140 A R S < S+ 0 0 129 -4,-0.9 -1,-0.2 -3,-0.2 -2,-0.2 0.770 91.4 90.8 -65.2 -28.6 24.2 13.0 15.7 133 141 A L S S- 0 0 24 -4,-0.4 4,-0.1 -3,-0.4 -40,-0.1 -0.376 71.7-141.7 -79.7 148.8 27.5 14.7 14.8 134 142 A S S S+ 0 0 103 -2,-0.1 -1,-0.1 2,-0.1 3,-0.1 0.867 83.5 77.7 -73.4 -40.3 28.2 18.4 15.1 135 143 A T S S- 0 0 48 1,-0.1 -2,-0.1 3,-0.0 -38,-0.0 -0.498 97.4 -95.9 -72.7 139.8 30.2 18.6 11.8 136 144 A P - 0 0 100 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.114 51.2 -84.3 -54.7 152.3 28.1 18.6 8.6 137 145 A S > - 0 0 22 1,-0.1 3,-1.2 -4,-0.1 -10,-0.0 -0.394 26.5-150.7 -64.6 127.6 27.5 15.3 6.7 138 146 A P T 3 S+ 0 0 8 0, 0.0 -1,-0.1 0, 0.0 -34,-0.0 0.520 93.6 67.6 -73.0 -6.7 30.4 14.3 4.4 139 147 A L T > + 0 0 5 2,-0.1 3,-1.3 71,-0.1 2,-0.5 0.349 68.8 113.3 -97.9 3.1 27.8 12.5 2.2 140 148 A D T < S+ 0 0 101 -3,-1.2 3,-0.1 1,-0.2 0, 0.0 -0.668 82.0 27.2 -71.2 124.7 26.1 15.7 1.1 141 149 A G T 3 S+ 0 0 59 -2,-0.5 -30,-0.4 1,-0.4 2,-0.3 0.146 102.8 104.2 103.3 -16.8 26.8 16.0 -2.6 142 150 A T < - 0 0 7 -3,-1.3 68,-2.6 -32,-0.1 -1,-0.4 -0.732 63.2-135.6 -97.8 148.3 27.1 12.2 -3.0 143 151 A F E -eF 112 209A 59 -32,-3.1 -30,-3.1 -2,-0.3 2,-0.3 -0.457 14.1-155.4 -96.2 169.7 24.4 10.0 -4.6 144 152 A C E -eF 113 208A 0 64,-2.5 64,-1.9 -32,-0.3 2,-0.3 -0.991 8.8-176.0-146.6 153.3 23.0 6.7 -3.5 145 153 A V E -e 114 0A 6 -32,-2.3 -30,-1.8 -2,-0.3 2,-0.5 -0.996 25.1-125.6-151.3 143.5 21.3 3.6 -5.0 146 154 A D E > -e 115 0A 10 -2,-0.3 4,-1.2 -32,-0.2 -30,-0.2 -0.820 11.9-155.0 -92.2 125.5 19.8 0.4 -3.9 147 155 A S H > S+ 0 0 0 -32,-1.4 4,-3.2 -2,-0.5 5,-0.2 0.694 92.1 64.2 -74.0 -20.5 21.2 -2.7 -5.6 148 156 A I H > S+ 0 0 25 -33,-0.4 4,-2.4 2,-0.2 -1,-0.2 0.963 106.8 42.1 -63.0 -52.5 18.0 -4.7 -5.0 149 157 A A H > S+ 0 0 41 2,-0.2 4,-1.0 1,-0.2 -2,-0.2 0.789 116.2 52.7 -62.8 -29.9 16.0 -2.3 -7.2 150 158 A A H X S+ 0 0 1 -4,-1.2 4,-1.9 2,-0.2 3,-0.5 0.966 113.1 39.6 -68.5 -56.3 19.0 -2.4 -9.6 151 159 A L H X S+ 0 0 5 -4,-3.2 4,-2.8 1,-0.2 5,-0.3 0.784 109.7 61.9 -66.8 -29.7 19.2 -6.2 -9.9 152 160 A K H X S+ 0 0 88 -4,-2.4 4,-1.3 -5,-0.2 -1,-0.2 0.850 109.4 41.9 -62.2 -36.5 15.4 -6.4 -10.0 153 161 A A H < S+ 0 0 35 -4,-1.0 -2,-0.2 -3,-0.5 -1,-0.2 0.850 116.1 48.3 -77.3 -38.1 15.4 -4.3 -13.2 154 162 A L H < S+ 0 0 15 -4,-1.9 3,-0.5 1,-0.2 -2,-0.2 0.861 114.4 45.2 -71.6 -38.8 18.4 -6.2 -14.7 155 163 A E H < S+ 0 0 89 -4,-2.8 2,-1.2 1,-0.2 -2,-0.2 0.897 112.0 53.3 -69.1 -43.4 17.0 -9.6 -14.0 156 164 A Q < 0 0 132 -4,-1.3 -1,-0.2 -5,-0.3 -2,-0.1 -0.470 360.0 360.0 -93.3 60.9 13.5 -8.7 -15.3 157 165 A A 0 0 113 -2,-1.2 -4,-0.0 -3,-0.5 -3,-0.0 -0.963 360.0 360.0-149.5 360.0 14.7 -7.4 -18.7 158 ! 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 0.0 159 175 A K 0 0 227 0, 0.0 2,-0.2 0, 0.0 6,-0.0 0.000 360.0 360.0 360.0 -25.7 12.0 -15.2 -5.2 160 176 A S - 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0 0 27 -3,-0.5 4,-0.1 -4,-0.4 -40,-0.1 -0.388 68.9-145.0 -80.6 148.4 53.4 18.1 2.2 572 142 C S S S+ 0 0 102 -2,-0.1 -1,-0.1 2,-0.1 3,-0.1 0.853 81.2 80.7 -75.6 -38.8 52.6 21.4 3.9 573 143 C T S S- 0 0 44 1,-0.1 -2,-0.1 0, 0.0 -38,-0.0 -0.397 96.8 -94.9 -67.4 144.4 50.6 19.7 6.6 574 144 C P - 0 0 115 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.227 53.9 -84.0 -57.2 151.4 52.5 18.1 9.6 575 145 C S > - 0 0 35 1,-0.1 3,-1.0 -4,-0.1 -10,-0.0 -0.384 28.0-153.3 -64.3 126.9 53.3 14.4 9.3 576 146 C P T 3 S+ 0 0 7 0, 0.0 -1,-0.1 0, 0.0 -41,-0.0 0.706 95.9 60.6 -69.3 -22.1 50.4 12.1 10.4 577 147 C L T > S+ 0 0 5 2,-0.1 3,-1.3 71,-0.1 2,-0.4 0.350 75.8 114.2 -89.3 3.7 53.0 9.4 11.3 578 148 C D T < S+ 0 0 111 -3,-1.0 3,-0.1 1,-0.2 0, 0.0 -0.650 80.4 26.4 -72.2 127.5 54.6 11.7 13.8 579 149 C G T 3 S+ 0 0 59 1,-0.4 -30,-0.3 -2,-0.4 2,-0.3 0.186 103.2 105.2 99.0 -15.2 54.1 10.1 17.2 580 150 C T < - 0 0 6 -3,-1.3 68,-2.6 -32,-0.1 -1,-0.4 -0.677 63.0-135.5 -95.1 153.6 53.8 6.6 15.7 581 151 C F E -jK 550 647A 56 -32,-3.2 -30,-2.8 -2,-0.3 2,-0.3 -0.516 15.6-156.0-100.0 170.7 56.5 3.9 15.9 582 152 C C E -jK 551 646A 0 64,-2.3 64,-1.7 -32,-0.3 2,-0.3 -0.994 9.9-178.4-149.4 153.2 57.8 1.6 13.1 583 153 C V E -j 552 0A 7 -32,-2.6 -30,-1.6 -2,-0.3 2,-0.5 -0.995 26.8-120.3-152.5 149.0 59.5 -1.8 12.8 584 154 C D E > -j 553 0A 8 -2,-0.3 4,-1.3 -32,-0.2 -30,-0.2 -0.812 12.4-153.1 -94.1 130.0 60.9 -4.1 10.0 585 155 C S H > S+ 0 0 0 -32,-1.9 4,-2.5 -2,-0.5 -31,-0.2 0.677 94.2 61.2 -77.4 -19.1 59.4 -7.6 9.9 586 156 C I H > S+ 0 0 26 -33,-0.4 4,-2.4 2,-0.2 -1,-0.2 0.934 107.4 44.6 -67.9 -47.8 62.5 -9.1 8.3 587 157 C A H > S+ 0 0 42 2,-0.2 4,-1.1 1,-0.2 -2,-0.2 0.819 113.5 53.7 -62.6 -33.3 64.5 -8.1 11.5 588 158 C A H X S+ 0 0 2 -4,-1.3 4,-1.6 2,-0.2 3,-0.4 0.960 112.1 41.1 -63.9 -54.3 61.5 -9.4 13.5 589 159 C L H X S+ 0 0 9 -4,-2.5 4,-3.1 1,-0.2 5,-0.3 0.831 110.6 57.5 -67.1 -35.8 61.5 -12.9 11.8 590 160 C K H X S+ 0 0 94 -4,-2.4 4,-1.1 1,-0.2 -1,-0.2 0.804 110.6 44.5 -63.6 -31.6 65.3 -13.2 11.8 591 161 C A H < S+ 0 0 41 -4,-1.1 -2,-0.2 -3,-0.4 -1,-0.2 0.795 118.1 42.8 -82.5 -31.9 65.3 -12.7 15.6 592 162 C L H < S+ 0 0 37 -4,-1.6 3,-0.4 1,-0.1 -2,-0.2 0.882 116.3 46.5 -79.8 -42.8 62.4 -15.1 16.2 593 163 C E H < S+ 0 0 98 -4,-3.1 2,-1.1 1,-0.3 -3,-0.2 0.893 113.0 51.5 -65.0 -42.9 63.6 -17.8 13.7 594 164 C Q < 0 0 131 -4,-1.1 -1,-0.3 -5,-0.3 -4,-0.0 -0.610 360.0 360.0 -97.8 71.2 67.1 -17.7 15.1 595 165 C A 0 0 123 -2,-1.1 -3,-0.0 -3,-0.4 -4,-0.0 -0.991 360.0 360.0-145.7 360.0 66.3 -18.1 18.8 596 ! 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 0.0 597 175 C K 0 0 228 0, 0.0 2,-0.4 0, 0.0 6,-0.0 0.000 360.0 360.0 360.0 -32.0 68.2 -18.1 3.0 598 176 C S - 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0 0 74 -2,-0.3 -9,-0.1 -3,-0.1 2,-0.1 -0.556 43.1-106.2 -73.5 143.8 52.4 -19.6 -2.7 613 191 C P - 0 0 23 0, 0.0 3,-0.4 0, 0.0 2,-0.3 -0.370 31.6-124.5 -68.9 153.0 51.1 -16.2 -1.6 614 192 C T S S+ 0 0 100 1,-0.2 11,-0.1 7,-0.2 10,-0.1 -0.729 83.5 13.4 -98.2 150.9 48.0 -14.7 -3.4 615 193 C D S > S- 0 0 111 -2,-0.3 3,-1.0 1,-0.1 -1,-0.2 0.902 83.7-165.0 53.0 50.7 47.9 -11.3 -5.0 616 194 C S T 3 + 0 0 53 -3,-0.4 -1,-0.1 1,-0.2 3,-0.1 -0.314 64.7 18.4 -64.8 146.4 51.7 -10.8 -4.8 617 195 C H T 3 S+ 0 0 85 1,-0.2 2,-0.4 2,-0.1 -1,-0.2 0.710 96.3 114.7 61.3 24.6 53.1 -7.2 -5.4 618 196 C T S <> S- 0 0 21 -3,-1.0 4,-2.9 1,-0.1 5,-0.3 -0.959 73.1-125.2-115.7 143.3 49.8 -5.6 -4.6 619 197 C A H > S+ 0 0 0 -2,-0.4 4,-1.4 1,-0.2 -154,-0.2 0.896 109.1 38.3 -56.2 -48.2 49.6 -3.4 -1.5 620 198 C E H > S+ 0 0 33 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.895 116.8 51.5 -70.7 -41.6 46.6 -5.2 0.1 621 199 C G H > S+ 0 0 3 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.891 111.4 46.8 -61.2 -42.8 47.8 -8.7 -1.0 622 200 C D H X S+ 0 0 17 -4,-2.9 4,-1.9 2,-0.2 -1,-0.2 0.795 111.3 51.9 -72.1 -30.7 51.2 -8.2 0.5 623 201 C V H X S+ 0 0 0 -4,-1.4 4,-2.9 -5,-0.3 -2,-0.2 0.913 111.1 46.6 -68.7 -45.3 49.8 -6.8 3.7 624 202 C L H X S+ 0 0 51 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.850 113.3 50.0 -65.1 -36.4 47.5 -9.8 4.2 625 203 C T H X S+ 0 0 6 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.894 112.2 47.7 -65.1 -43.3 50.5 -12.1 3.3 626 204 C L H X S+ 0 0 3 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.903 110.0 52.4 -63.4 -44.1 52.6 -10.2 5.9 627 205 C L H X S+ 0 0 0 -4,-2.9 4,-0.7 1,-0.2 -2,-0.2 0.877 107.8 52.3 -59.4 -40.9 49.7 -10.5 8.5 628 206 C S H >< S+ 0 0 12 -4,-1.8 3,-0.5 1,-0.2 -1,-0.2 0.900 110.6 47.1 -62.1 -43.6 49.6 -14.3 7.9 629 207 C I H >< S+ 0 0 2 -4,-1.8 3,-1.2 1,-0.2 4,-0.4 0.867 110.5 52.2 -66.1 -39.0 53.3 -14.6 8.5 630 208 C C H 3< S+ 0 0 3 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.591 100.3 63.7 -75.3 -11.7 53.2 -12.5 11.7 631 209 C Q T << S+ 0 0 1 -4,-0.7 -151,-0.5 -3,-0.5 -1,-0.2 0.447 81.5 83.3 -87.9 -3.5 50.4 -14.7 13.0 632 210 C W S < S+ 0 0 61 -3,-1.2 -152,-0.5 1,-0.3 -1,-0.2 0.932 116.6 2.6 -65.2 -49.6 52.8 -17.7 13.1 633 211 C K S > S+ 0 0 94 -4,-0.4 4,-1.6 -3,-0.2 -1,-0.3 -0.621 79.4 164.3-136.5 76.4 54.2 -16.7 16.5 634 212 C P H > S+ 0 0 4 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.837 72.1 51.4 -69.4 -38.5 52.2 -13.6 17.5 635 213 C Q H > S+ 0 0 122 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.877 114.8 43.4 -67.0 -39.9 53.1 -13.5 21.3 636 214 C A H > S+ 0 0 31 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.793 113.7 54.0 -72.3 -30.5 56.8 -13.7 20.5 637 215 C L H X S+ 0 0 3 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.935 109.4 45.4 -67.0 -50.1 56.3 -11.2 17.7 638 216 C L H X S+ 0 0 1 -4,-2.8 4,-2.0 1,-0.2 -197,-0.2 0.830 110.4 55.4 -63.9 -34.9 54.6 -8.6 20.0 639 217 C Q H X S+ 0 0 118 -4,-1.5 4,-0.6 1,-0.2 -1,-0.2 0.892 110.6 45.1 -62.6 -42.1 57.3 -9.1 22.6 640 218 C W H X S+ 0 0 25 -4,-1.6 4,-1.6 2,-0.2 3,-0.3 0.841 109.4 56.1 -70.0 -36.5 60.0 -8.3 20.0 641 219 C V H X S+ 0 0 0 -4,-2.1 4,-1.7 1,-0.2 3,-0.2 0.916 105.0 51.0 -62.4 -45.6 58.0 -5.3 18.7 642 220 C D H < S+ 0 0 50 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.713 113.5 48.1 -64.3 -21.8 57.9 -3.7 22.2 643 221 C E H < S+ 0 0 119 -4,-0.6 -1,-0.2 -3,-0.3 -2,-0.2 0.777 123.2 26.8 -87.7 -31.4 61.7 -4.2 22.4 644 222 C H H < S+ 0 0 95 -4,-1.6 2,-0.4 -3,-0.2 -2,-0.2 0.359 80.0 128.0-121.2 2.6 62.7 -2.8 19.0 645 223 C A < - 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0 0 102 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.184 51.3 -78.9 -57.0 150.7 23.9 -26.7 55.2 794 145 D S > - 0 0 30 1,-0.2 3,-1.2 -4,-0.1 -10,-0.0 -0.285 29.8-152.9 -59.1 125.4 25.3 -23.5 53.7 795 146 D P T 3 S+ 0 0 11 0, 0.0 -1,-0.2 0, 0.0 -34,-0.0 0.539 94.2 65.4 -72.8 -8.1 23.7 -22.5 50.3 796 147 D L T > + 0 0 6 2,-0.1 3,-1.2 71,-0.1 2,-0.6 0.359 70.0 113.4 -96.4 2.1 26.9 -20.7 49.5 797 148 D D T < S+ 0 0 113 -3,-1.2 3,-0.1 1,-0.2 0, 0.0 -0.683 82.9 27.1 -72.8 115.6 28.9 -23.9 49.4 798 149 D G T 3 S+ 0 0 51 -2,-0.6 -30,-0.3 1,-0.5 2,-0.2 0.047 102.2 101.8 114.2 -23.1 30.0 -24.2 45.8 799 150 D T < - 0 0 7 -3,-1.2 68,-2.6 -32,-0.1 -1,-0.5 -0.640 64.6-133.5 -91.6 152.1 29.9 -20.4 45.1 800 151 D F E -uV 769 866B 60 -32,-3.0 -30,-3.0 66,-0.3 2,-0.3 -0.471 16.2-157.6 -98.4 171.4 33.0 -18.3 44.9 801 152 D C E -uV 770 865B 0 64,-2.5 64,-2.1 -32,-0.3 2,-0.3 -0.992 9.1-177.6-149.4 153.9 33.8 -14.9 46.5 802 153 D V E -u 771 0B 7 -32,-2.2 -30,-1.6 -2,-0.3 2,-0.5 -0.989 26.7-122.7-154.0 144.9 36.1 -11.9 46.0 803 154 D D E > -u 772 0B 9 -2,-0.3 4,-1.1 -32,-0.2 -30,-0.2 -0.785 13.5-153.1 -89.5 126.3 36.8 -8.6 47.8 804 155 D S H > S+ 0 0 0 -32,-1.3 4,-3.1 -2,-0.5 5,-0.2 0.670 91.1 67.5 -74.6 -18.4 36.4 -5.5 45.5 805 156 D I H > S+ 0 0 26 -33,-0.4 4,-2.5 2,-0.2 -1,-0.2 0.958 105.1 42.2 -61.7 -51.3 38.9 -3.5 47.5 806 157 D A H > S+ 0 0 42 2,-0.2 4,-0.8 1,-0.2 -2,-0.2 0.780 115.0 53.5 -64.8 -29.4 41.7 -5.8 46.3 807 158 D A H X S+ 0 0 1 -4,-1.1 4,-2.2 2,-0.2 3,-0.4 0.947 113.0 40.3 -68.0 -52.1 40.1 -5.7 42.8 808 159 D L H X S+ 0 0 1 -4,-3.1 4,-2.8 1,-0.2 5,-0.4 0.811 110.0 59.6 -69.0 -32.6 40.0 -1.9 42.6 809 160 D K H X S+ 0 0 96 -4,-2.5 4,-0.5 -5,-0.2 -1,-0.2 0.796 111.7 42.1 -63.1 -30.1 43.5 -1.7 44.2 810 161 D A H < S+ 0 0 37 -4,-0.8 -2,-0.2 -3,-0.4 -1,-0.2 0.880 119.3 41.8 -81.8 -43.3 44.7 -3.8 41.2 811 162 D L H >< S+ 0 0 16 -4,-2.2 3,-0.7 1,-0.2 -2,-0.2 0.905 116.8 45.5 -72.6 -45.1 42.7 -2.0 38.5 812 163 D E H 3< S+ 0 0 54 -4,-2.8 2,-0.3 1,-0.3 -1,-0.2 0.775 111.2 54.9 -71.6 -28.2 43.3 1.6 39.7 813 164 D Q T 3< 0 0 134 -4,-0.5 -1,-0.3 -5,-0.4 -2,-0.1 -0.339 360.0 360.0-100.8 49.0 47.0 1.0 40.2 814 165 D A < 0 0 111 -3,-0.7 -4,-0.0 -2,-0.3 0, 0.0 -0.975 360.0 360.0-150.7 360.0 47.7 -0.3 36.7 815 ! 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 0.0 816 175 D K 0 0 233 0, 0.0 2,-0.3 0, 0.0 6,-0.0 0.000 360.0 360.0 360.0 -45.8 44.3 7.2 49.6 817 176 D S - 0 0 58 1,-0.1 0, 0.0 5,-0.1 0, 0.0 -0.635 360.0-165.0 -83.4 136.1 41.1 5.8 51.1 818 177 D Y + 0 0 50 -2,-0.3 2,-0.1 4,-0.1 -1,-0.1 -0.042 42.1 133.3-111.2 29.2 39.5 2.7 49.6 819 178 D S S > S- 0 0 56 1,-0.1 4,-2.1 -46,-0.0 5,-0.3 -0.452 71.8-107.5 -71.2 153.8 36.1 3.0 51.3 820 179 D L H > S+ 0 0 26 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.881 119.1 45.8 -51.9 -46.8 33.1 2.5 49.0 821 180 D G H > S+ 0 0 26 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.905 110.0 53.5 -63.3 -45.4 32.2 6.3 49.0 822 181 D S H > S+ 0 0 37 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.871 110.9 45.3 -60.5 -42.6 35.8 7.5 48.5 823 182 D I H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.882 112.6 51.8 -69.2 -39.8 36.3 5.3 45.4 824 183 D Y H X S+ 0 0 17 -4,-1.7 4,-1.9 -5,-0.3 6,-0.5 0.892 112.0 45.7 -63.1 -42.3 32.9 6.3 43.9 825 184 D T H X S+ 0 0 58 -4,-2.4 4,-1.8 2,-0.2 -1,-0.2 0.836 111.8 52.0 -71.3 -35.3 33.6 10.1 44.4 826 185 D R H < S+ 0 0 83 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.906 116.0 39.6 -65.2 -43.5 37.1 9.7 42.9 827 186 D L H < S+ 0 0 13 -4,-2.1 -2,-0.2 1,-0.1 -1,-0.2 0.829 133.8 19.1 -77.2 -34.7 35.9 8.0 39.8 828 187 D Y H < S- 0 0 2 -4,-1.9 -3,-0.2 2,-0.2 -2,-0.2 0.407 88.8-128.6-122.8 -0.5 32.7 10.0 39.1 829 188 D W S < S+ 0 0 189 -4,-1.8 2,-0.3 1,-0.2 -4,-0.2 0.736 75.4 109.4 55.8 26.2 33.1 13.2 41.1 830 189 D Q S S- 0 0 100 -6,-0.5 -2,-0.2 0, 0.0 -1,-0.2 -0.955 73.9-113.3-130.5 147.8 29.7 12.5 42.7 831 190 D A - 0 0 76 -2,-0.3 2,-0.1 -3,-0.1 -9,-0.1 -0.619 40.9-110.7 -75.8 137.1 28.5 11.5 46.2 832 191 D P - 0 0 23 0, 0.0 3,-0.4 0, 0.0 2,-0.3 -0.369 30.4-124.7 -66.7 149.0 27.0 8.0 46.3 833 192 D T S S+ 0 0 97 1,-0.2 11,-0.2 7,-0.2 10,-0.1 -0.751 82.5 12.6 -99.5 145.5 23.2 7.7 47.0 834 193 D D S > S- 0 0 105 -2,-0.3 3,-1.1 1,-0.1 -1,-0.2 0.922 83.0-162.4 58.1 51.0 21.6 5.7 49.8 835 194 D S T 3 + 0 0 53 -3,-0.4 -1,-0.1 1,-0.2 3,-0.1 -0.336 66.6 16.8 -64.0 141.8 24.9 5.2 51.7 836 195 D H T 3 S+ 0 0 84 1,-0.3 2,-0.4 2,-0.1 -1,-0.2 0.742 95.3 116.5 62.6 27.5 25.0 2.5 54.4 837 196 D T S <> S- 0 0 22 -3,-1.1 4,-2.8 1,-0.1 5,-0.3 -0.961 72.4-125.7-113.9 142.4 21.8 0.8 53.0 838 197 D A H > S+ 0 0 0 -2,-0.4 4,-1.1 1,-0.2 -154,-0.2 0.899 109.2 38.0 -55.7 -47.2 22.3 -2.8 51.7 839 198 D E H > S+ 0 0 32 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.901 115.7 52.5 -72.0 -43.2 20.8 -2.0 48.2 840 199 D G H > S+ 0 0 3 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.883 111.6 46.6 -58.5 -42.0 22.3 1.5 48.0 841 200 D D H X S+ 0 0 13 -4,-2.8 4,-1.8 2,-0.2 -1,-0.2 0.753 110.6 53.5 -73.0 -27.0 25.8 0.2 48.7 842 201 D V H X S+ 0 0 0 -4,-1.1 4,-2.3 -5,-0.3 -2,-0.2 0.885 110.4 46.3 -71.3 -41.4 25.2 -2.7 46.2 843 202 D L H X S+ 0 0 63 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.836 113.1 49.8 -69.9 -35.0 24.3 -0.2 43.4 844 203 D T H X S+ 0 0 4 -4,-1.8 4,-1.7 -5,-0.2 -2,-0.2 0.891 111.2 49.7 -66.4 -42.0 27.3 2.0 44.4 845 204 D L H X S+ 0 0 2 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.884 108.7 52.5 -63.7 -41.8 29.5 -1.1 44.2 846 205 D L H X S+ 0 0 3 -4,-2.3 4,-1.4 2,-0.2 -1,-0.2 0.907 107.7 51.1 -59.4 -45.8 28.1 -2.1 40.8 847 206 D S H < S+ 0 0 15 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.872 111.2 47.7 -60.7 -40.7 28.8 1.4 39.4 848 207 D I H >< S+ 0 0 2 -4,-1.7 3,-1.0 1,-0.2 4,-0.4 0.872 112.1 49.5 -68.3 -39.2 32.4 1.2 40.6 849 208 D C H 3< S+ 0 0 1 -4,-2.1 3,-0.2 1,-0.2 -2,-0.2 0.695 103.4 61.2 -73.1 -20.7 32.8 -2.3 39.1 850 209 D Q T 3< S+ 0 0 0 -4,-1.4 -1,-0.2 1,-0.2 -151,-0.2 0.454 83.4 84.1 -83.1 -1.9 31.4 -1.0 35.8 851 210 D W S < S+ 0 0 48 -3,-1.0 -152,-1.2 1,-0.3 -1,-0.2 0.950 116.5 3.3 -65.7 -53.7 34.3 1.4 35.5 852 211 D K S > S+ 0 0 62 -4,-0.4 4,-1.9 -3,-0.2 -1,-0.3 -0.638 83.4 164.9-128.7 75.5 36.7 -1.2 34.0 853 212 D P H > S+ 0 0 0 0, 0.0 4,-2.0 0, 0.0 -159,-0.1 0.760 71.4 49.1 -73.1 -29.9 34.3 -4.1 33.7 854 213 D Q H > S+ 0 0 24 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.913 115.4 44.1 -71.3 -45.3 36.4 -6.3 31.3 855 214 D A H > S+ 0 0 38 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.782 113.1 53.6 -68.8 -30.0 39.5 -5.9 33.4 856 215 D L H X S+ 0 0 2 -4,-1.9 4,-2.5 -7,-0.2 -2,-0.2 0.940 108.2 48.3 -67.2 -50.5 37.5 -6.5 36.6 857 216 D L H X S+ 0 0 2 -4,-2.0 4,-2.1 1,-0.2 -197,-0.2 0.846 111.3 50.9 -59.3 -38.1 36.0 -9.8 35.3 858 217 D Q H X S+ 0 0 84 -4,-1.8 4,-1.0 2,-0.2 -1,-0.2 0.856 111.7 47.4 -68.1 -37.1 39.5 -11.0 34.3 859 218 D W H X S+ 0 0 33 -4,-1.4 4,-1.9 2,-0.2 -2,-0.2 0.858 110.0 53.5 -70.2 -37.8 40.8 -10.1 37.8 860 219 D V H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.927 106.0 52.6 -61.4 -46.9 37.9 -11.9 39.4 861 220 D D H < S+ 0 0 20 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.812 115.2 42.2 -58.2 -33.6 38.6 -15.1 37.4 862 221 D E H < S+ 0 0 128 -4,-1.0 -1,-0.2 1,-0.1 -2,-0.2 0.792 125.4 30.5 -83.8 -32.0 42.2 -15.1 38.6 863 222 D H H < S+ 0 0 97 -4,-1.9 -2,-0.2 -5,-0.1 -3,-0.2 0.393 84.3 119.1-117.2 0.6 41.6 -14.2 42.2 864 223 D A < - 0 0 23 -4,-2.1 -62,-0.2 -5,-0.1 -95,-0.0 -0.455 41.9-166.8 -69.2 139.8 38.2 -15.6 43.2 865 224 D R E -V 801 0B 89 -64,-2.1 -64,-2.5 -2,-0.1 5,-0.1 -0.936 30.0 -90.5-127.0 151.3 38.2 -18.2 46.0 866 225 D P E > -V 800 0B 50 0, 0.0 3,-1.5 0, 0.0 4,-0.3 -0.329 28.3-133.3 -59.3 139.3 35.5 -20.6 47.2 867 226 D F G > S+ 0 0 1 -68,-2.6 3,-1.4 -71,-0.4 -70,-0.1 0.756 103.4 69.3 -64.8 -26.0 33.3 -19.2 49.9 868 227 D S G 3 S+ 0 0 67 -69,-0.4 -1,-0.3 1,-0.3 -71,-0.1 0.600 91.0 61.2 -69.4 -12.0 33.7 -22.5 51.9 869 228 D T G < S+ 0 0 73 -3,-1.5 2,-0.4 2,-0.1 -1,-0.3 0.606 81.4 105.6 -85.1 -15.4 37.4 -21.4 52.5 870 229 D V < - 0 0 4 -3,-1.4 -3,-0.0 -4,-0.3 -94,-0.0 -0.541 69.7-136.4 -72.3 120.7 36.2 -18.3 54.3 871 230 D K - 0 0 179 -2,-0.4 -87,-0.2 1,-0.1 -86,-0.1 -0.569 28.9-103.9 -74.5 138.7 36.6 -18.6 58.1 872 231 D P - 0 0 61 0, 0.0 -90,-0.2 0, 0.0 3,-0.1 -0.293 20.6-123.4 -64.0 148.9 33.7 -17.3 60.2 873 232 D M S S- 0 0 40 -92,-2.3 2,-0.3 1,-0.2 -91,-0.1 0.905 88.6 -7.9 -57.5 -46.3 33.9 -13.9 61.9 874 233 D Y 0 0 24 -93,-0.3 -1,-0.2 -92,-0.1 0, 0.0 -0.982 360.0 360.0-151.1 158.4 33.2 -15.5 65.3 875 234 D G 0 0 107 -2,-0.3 -2,-0.1 -3,-0.1 0, 0.0 0.154 360.0 360.0 76.4 360.0 32.1 -18.8 66.9