==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 12-MAY-99 4GTU . COMPND 2 MOLECULE: GLUTATHIONE S-TRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Y.V.PATSKOVSKY,L.N.PATSKOVSKA,I.LISTOWSKY . 1736 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 76726.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1312 75.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 60 3.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 86 5.0 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 . 17 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.1 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 . 107 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 274 15.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 710 40.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 19 1.1 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 3 1 1 12 2 5 11 4 3 0 0 4 4 0 0 0 2 0 0 6 1 4 3 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 0 0 1 0 7 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 1 8 7 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 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 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 1 A S 0 0 109 0, 0.0 64,-0.4 0, 0.0 26,-0.2 0.000 360.0 360.0 360.0 144.7 -32.4 93.6 -17.4 2 2 A M E -a 27 0A 6 24,-1.9 26,-1.4 62,-0.2 2,-0.5 -0.608 360.0-130.6 -88.0 149.7 -34.4 91.3 -15.1 3 3 A T E -aB 28 63A 22 60,-1.0 60,-1.5 -2,-0.2 2,-0.6 -0.912 12.5-159.8-109.7 129.5 -38.2 91.8 -14.6 4 4 A L E -aB 29 62A 5 24,-3.2 26,-3.2 -2,-0.5 2,-0.5 -0.916 13.6-172.3-106.1 120.0 -39.9 92.1 -11.2 5 5 A G E +aB 30 61A 0 56,-2.1 56,-1.7 -2,-0.6 2,-0.3 -0.956 22.1 126.6-123.3 126.0 -43.6 91.4 -11.3 6 6 A Y E -a 31 0A 14 24,-1.4 26,-2.2 -2,-0.5 4,-0.1 -0.910 59.9 -72.8-157.2 171.9 -46.1 91.8 -8.4 7 7 A W E -a 32 0A 19 -2,-0.3 26,-0.2 24,-0.2 -1,-0.1 -0.105 55.2 -96.2 -63.1 179.8 -49.4 93.6 -7.8 8 8 A D S S+ 0 0 31 24,-1.4 2,-0.3 23,-0.1 -1,-0.1 0.346 101.9 102.1 -79.4 8.5 -49.4 97.4 -7.4 9 9 A I S S- 0 0 0 23,-0.3 4,-0.2 1,-0.1 198,-0.2 -0.715 77.6-134.2 -95.1 144.2 -49.3 96.5 -3.7 10 10 A R >> + 0 0 4 196,-2.8 4,-0.8 -2,-0.3 3,-0.7 0.982 63.4 128.4 -57.9 -59.8 -46.1 96.7 -1.6 11 11 A G T >4 S- 0 0 18 196,-1.8 3,-1.1 195,-0.5 4,-0.2 0.086 80.0 -19.0 41.8-141.1 -46.7 93.3 -0.1 12 12 A L T >> S+ 0 0 63 1,-0.2 3,-0.9 2,-0.1 4,-0.5 0.743 128.4 68.0 -70.0 -25.9 -44.0 90.7 -0.1 13 13 A A H <> S+ 0 0 0 -3,-0.7 4,-2.3 1,-0.2 5,-0.3 0.671 74.4 91.3 -71.7 -11.6 -42.0 92.3 -2.9 14 14 A H H S+ 0 0 3 -3,-0.9 4,-2.8 -4,-0.2 3,-0.6 0.891 112.0 52.8 -72.0 -36.4 -37.9 93.5 0.5 16 16 A I H 3X S+ 0 0 2 -4,-0.5 4,-2.0 1,-0.2 5,-0.3 0.809 103.3 55.4 -67.4 -36.8 -37.0 92.5 -3.1 17 17 A R H 3< S+ 0 0 2 -4,-2.3 -1,-0.2 2,-0.2 -2,-0.2 0.658 113.7 43.7 -69.7 -20.0 -37.3 96.0 -4.5 18 18 A L H S+ 0 0 0 -4,-2.0 5,-2.2 1,-0.2 -1,-0.3 0.776 115.9 55.4 -63.1 -20.1 -32.1 94.4 -6.1 21 21 A E H >45S+ 0 0 28 -3,-0.4 3,-1.7 -5,-0.3 -2,-0.2 0.972 110.4 44.1 -72.0 -50.3 -32.0 98.2 -5.6 22 22 A Y H 3<5S+ 0 0 24 -4,-3.4 -2,-0.2 1,-0.3 -3,-0.2 0.830 111.6 52.3 -62.5 -38.9 -29.1 97.9 -3.2 23 23 A T T 3<5S- 0 0 21 -4,-2.6 -1,-0.3 -5,-0.3 -2,-0.2 0.319 111.3-121.5 -83.5 10.9 -27.2 95.5 -5.3 24 24 A D T < 5 + 0 0 127 -3,-1.7 2,-0.3 1,-0.2 -3,-0.2 0.743 48.3 175.3 55.7 28.2 -27.6 97.8 -8.3 25 25 A S < - 0 0 17 -5,-2.2 2,-2.1 -6,-0.2 -1,-0.2 -0.473 38.4-120.1 -69.2 125.1 -29.4 95.0 -10.2 26 26 A S + 0 0 80 -2,-0.3 -24,-1.9 -3,-0.1 2,-0.2 -0.437 53.7 164.6 -68.1 82.1 -30.7 96.2 -13.6 27 27 A Y E -a 2 0A 42 -2,-2.1 2,-0.3 -26,-0.2 -24,-0.2 -0.515 29.0-155.3-100.3 167.1 -34.4 95.5 -12.9 28 28 A E E -a 3 0A 125 -26,-1.4 -24,-3.2 -2,-0.2 2,-0.5 -0.987 21.4-122.4-139.5 142.6 -37.6 96.6 -14.6 29 29 A E E -a 4 0A 60 -2,-0.3 2,-0.7 -26,-0.2 -24,-0.2 -0.806 20.6-176.8-100.6 125.8 -41.1 96.7 -12.9 30 30 A K E -a 5 0A 73 -26,-3.2 -24,-1.4 -2,-0.5 2,-0.4 -0.900 16.3-171.3-113.2 94.5 -44.2 94.8 -14.1 31 31 A K E -a 6 0A 124 -2,-0.7 2,-0.4 -26,-0.2 -24,-0.2 -0.779 7.8-160.2 -93.2 131.7 -47.0 96.0 -11.8 32 32 A Y E -a 7 0A 4 -26,-2.2 -24,-1.4 -2,-0.4 2,-0.4 -0.898 15.6-140.0-105.6 139.5 -50.3 94.1 -12.1 33 33 A T - 0 0 66 -2,-0.4 11,-0.3 -26,-0.2 2,-0.3 -0.836 5.8-140.2-107.0 141.1 -53.3 96.0 -10.7 34 34 A M - 0 0 5 -2,-0.4 8,-0.2 8,-0.1 2,-0.2 -0.693 14.3-140.3 -96.5 150.7 -56.1 94.6 -8.6 35 35 A G - 0 0 20 6,-2.7 2,-0.1 -2,-0.3 175,-0.1 -0.468 6.7-146.5-100.6 174.8 -59.8 95.5 -9.0 36 36 A D > + 0 0 93 4,-0.2 5,-0.8 -2,-0.2 -1,-0.2 0.136 48.5 100.7-111.6-131.9 -62.5 96.1 -6.4 37 37 A A T 5S- 0 0 60 1,-0.2 3,-0.2 3,-0.1 -2,-0.0 -0.086 100.9 -55.3 67.8 179.1 -66.2 95.4 -6.6 38 38 A P T 5S+ 0 0 123 0, 0.0 2,-0.9 0, 0.0 -1,-0.2 0.914 140.3 47.4 -57.9 -41.2 -67.6 92.3 -4.9 39 39 A D T 5S- 0 0 142 -3,-0.1 2,-1.1 2,-0.0 -3,-0.1 -0.852 90.6-140.1-102.4 97.6 -65.2 90.1 -7.0 40 40 A Y T 5 - 0 0 90 -2,-0.9 2,-0.2 -3,-0.2 -4,-0.2 -0.412 27.1-136.5 -60.5 96.4 -61.8 91.8 -6.7 41 41 A D < + 0 0 89 -2,-1.1 -6,-2.7 -5,-0.8 3,-0.1 -0.395 35.4 169.9 -64.9 129.1 -60.7 91.3 -10.3 42 42 A R >> + 0 0 115 -2,-0.2 4,-2.0 -8,-0.2 3,-1.1 -0.090 29.0 135.0-127.0 30.8 -57.2 90.2 -10.9 43 43 A S H 3> + 0 0 40 1,-0.2 4,-2.9 2,-0.2 5,-0.4 0.847 61.3 67.9 -50.9 -43.7 -57.5 89.5 -14.7 44 44 A Q H 3> S+ 0 0 106 -11,-0.3 4,-1.3 1,-0.2 -1,-0.2 0.889 112.1 34.8 -46.2 -42.6 -54.2 91.2 -15.6 45 45 A W H <> S+ 0 0 14 -3,-1.1 4,-3.1 -12,-0.2 -2,-0.2 0.962 114.9 53.8 -75.8 -57.4 -52.4 88.4 -13.8 46 46 A L H X S+ 0 0 72 -4,-2.0 4,-0.6 1,-0.2 -2,-0.2 0.883 110.2 49.0 -44.4 -49.3 -54.7 85.5 -14.5 47 47 A N H < S+ 0 0 105 -4,-2.9 4,-0.3 -5,-0.2 -1,-0.2 0.917 122.1 32.9 -59.0 -50.0 -54.5 86.2 -18.3 48 48 A E H >X S+ 0 0 78 -4,-1.3 3,-3.2 -5,-0.4 4,-0.6 0.981 95.8 91.4 -71.6 -60.3 -50.7 86.4 -18.2 49 49 A K H ><>S+ 0 0 53 -4,-3.1 3,-0.6 1,-0.3 5,-0.5 0.448 94.1 32.0 3.6 -76.3 -49.9 83.9 -15.5 50 50 A F G ><5S+ 0 0 127 -4,-0.6 3,-0.9 1,-0.2 -1,-0.3 0.748 110.1 68.4 -72.0 -24.7 -49.4 80.6 -17.4 51 51 A K G <45S+ 0 0 176 -3,-3.2 -1,-0.2 -4,-0.3 -2,-0.2 0.804 88.3 65.6 -64.4 -33.0 -48.0 82.4 -20.5 52 52 A L G <<5S- 0 0 25 -4,-0.6 -1,-0.2 -3,-0.6 -2,-0.2 0.687 103.1-125.2 -65.4 -23.4 -44.8 83.4 -18.7 53 53 A G T < 5 + 0 0 49 -3,-0.9 2,-0.4 -4,-0.3 15,-0.1 0.767 46.2 164.2 83.5 26.6 -43.6 79.8 -18.2 54 54 A L < - 0 0 11 -5,-0.5 -1,-0.2 1,-0.1 15,-0.1 -0.639 42.1-135.0 -78.2 132.2 -43.1 79.7 -14.5 55 55 A D S S+ 0 0 66 -2,-0.4 -1,-0.1 13,-0.4 302,-0.1 0.790 108.5 21.0 -53.9 -32.2 -42.8 76.1 -13.2 56 56 A F S S- 0 0 16 2,-0.1 -1,-0.3 301,-0.1 2,-0.1 -0.646 95.2-141.6-136.8 73.4 -45.1 77.3 -10.4 57 57 A P + 0 0 19 0, 0.0 2,-0.3 0, 0.0 -7,-0.1 -0.138 45.9 137.4 -43.9 99.3 -46.9 80.4 -11.8 58 58 A N - 0 0 62 -2,-0.1 13,-0.1 -9,-0.1 -2,-0.1 -0.970 47.6 -92.6-143.9 160.9 -47.2 82.8 -8.9 59 59 A L S S+ 0 0 12 -2,-0.3 -53,-0.2 11,-0.1 2,-0.1 -0.946 98.7 49.1-122.7 136.9 -46.7 86.4 -8.2 60 60 A P S S+ 0 0 2 0, 0.0 11,-1.4 0, 0.0 2,-0.3 0.564 82.8 160.4 -70.6 155.8 -44.3 88.0 -7.2 61 61 A Y E -BC 5 70A 1 -56,-1.7 -56,-2.1 9,-0.2 2,-0.4 -0.939 29.7-145.0-141.6 163.8 -42.0 86.4 -9.8 62 62 A L E -BC 4 69A 0 7,-2.8 7,-1.2 -2,-0.3 2,-0.5 -0.999 6.2-169.6-138.5 132.5 -38.6 87.1 -11.3 63 63 A I E -BC 3 68A 20 -60,-1.5 2,-2.2 -2,-0.4 -60,-1.0 -0.795 4.0-171.7-122.8 82.0 -37.4 86.4 -14.8 64 64 A D - 0 0 28 3,-2.9 2,-1.8 -2,-0.5 -62,-0.2 -0.548 62.2 -82.4 -74.4 78.1 -33.7 87.1 -15.0 65 65 A G S S+ 0 0 64 -2,-2.2 -1,-0.1 -64,-0.4 -63,-0.0 -0.339 126.7 12.3 61.4 -86.2 -33.5 86.7 -18.8 66 66 A A S S+ 0 0 86 -2,-1.8 2,-0.3 1,-0.1 -1,-0.3 -0.206 119.6 85.0-110.6 37.2 -33.3 82.9 -18.8 67 67 A H - 0 0 64 2,-0.1 -3,-2.9 0, 0.0 2,-1.0 -0.841 50.1-175.5-143.6 105.0 -34.3 82.6 -15.1 68 68 A K E +C 63 0A 79 -2,-0.3 2,-0.5 -5,-0.3 -13,-0.4 -0.605 16.5 178.5-101.8 74.7 -37.9 82.5 -14.0 69 69 A I E -C 62 0A 2 -7,-1.2 -7,-2.8 -2,-1.0 2,-0.2 -0.654 6.4-169.7 -79.4 123.3 -37.5 82.5 -10.2 70 70 A T E +C 61 0A 1 -2,-0.5 -9,-0.2 -9,-0.2 4,-0.2 -0.648 45.2 49.9-108.1 166.7 -40.8 82.5 -8.4 71 71 A Q S >> S- 0 0 20 -11,-1.4 4,-2.0 -2,-0.2 3,-0.5 0.838 80.3-109.0 70.3 113.2 -41.6 83.0 -4.7 72 72 A S H 3> S+ 0 0 12 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.780 115.4 51.2 -32.2 -55.4 -40.1 85.9 -2.7 73 73 A N H 3> S+ 0 0 8 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.945 111.2 46.6 -54.3 -54.9 -37.7 83.7 -0.6 74 74 A A H <> S+ 0 0 1 -3,-0.5 4,-1.6 1,-0.2 -1,-0.2 0.821 112.8 51.9 -58.2 -33.3 -36.3 81.9 -3.7 75 75 A I H X S+ 0 0 2 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.952 109.0 49.6 -68.5 -46.1 -35.9 85.3 -5.3 76 76 A L H X S+ 0 0 4 -4,-3.1 4,-2.4 1,-0.2 5,-0.3 0.947 109.9 50.3 -58.5 -49.5 -34.1 86.7 -2.3 77 77 A C H X S+ 0 0 25 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.851 110.4 53.0 -55.6 -37.9 -31.7 83.7 -2.3 78 78 A Y H X S+ 0 0 1 -4,-1.6 4,-1.6 -5,-0.2 -1,-0.2 0.900 113.6 38.0 -66.0 -48.0 -31.0 84.3 -6.0 79 79 A I H X S+ 0 0 1 -4,-2.1 4,-0.6 2,-0.2 -2,-0.2 0.963 116.7 51.2 -69.6 -53.0 -30.1 88.0 -5.9 80 80 A A H ><>S+ 0 0 0 -4,-2.4 3,-2.4 -5,-0.2 5,-1.5 0.932 107.2 55.0 -48.8 -56.1 -28.2 87.7 -2.6 81 81 A R H ><5S+ 0 0 43 -4,-2.1 3,-2.6 -5,-0.3 -1,-0.2 0.900 105.5 50.3 -42.5 -60.3 -26.1 84.8 -4.0 82 82 A K H 3<5S+ 0 0 112 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.515 120.8 36.6 -61.5 -7.0 -25.0 86.7 -7.1 83 83 A H T <<5S- 0 0 71 -3,-2.4 -1,-0.3 -4,-0.6 -2,-0.2 0.090 110.8-121.8-129.9 17.2 -23.9 89.6 -4.8 84 84 A N T < 5 + 0 0 107 -3,-2.6 -3,-0.2 1,-0.2 2,-0.2 0.761 64.3 140.8 41.1 44.0 -22.7 87.4 -1.9 85 85 A L < + 0 0 16 -5,-1.5 69,-2.3 -6,-0.1 70,-0.3 -0.337 44.7 104.7-101.0 46.0 -25.0 88.8 0.7 86 86 A C S S- 0 0 28 -6,-0.2 2,-0.5 67,-0.2 7,-0.1 -0.720 88.4 -69.4-119.7 171.9 -25.5 85.3 2.2 87 87 A G + 0 0 12 -2,-0.2 6,-0.1 1,-0.2 -2,-0.1 -0.513 48.0 179.1 -65.4 114.6 -24.3 83.5 5.2 88 88 A E + 0 0 103 -2,-0.5 2,-0.3 -4,-0.1 -1,-0.2 0.922 63.1 51.6 -82.7 -52.2 -20.6 82.9 4.6 89 89 A T S >> S- 0 0 67 1,-0.1 4,-2.5 4,-0.0 3,-1.3 -0.682 91.3-115.1 -89.1 144.8 -19.5 81.2 7.8 90 90 A E H 3> S+ 0 0 73 -2,-0.3 4,-1.5 1,-0.3 -1,-0.1 0.767 118.8 52.9 -46.2 -35.1 -21.5 78.2 9.1 91 91 A E H 3> S+ 0 0 144 2,-0.2 4,-1.6 1,-0.2 -1,-0.3 0.873 110.3 47.9 -70.7 -35.0 -22.6 80.1 12.1 92 92 A E H <> S+ 0 0 20 -3,-1.3 4,-3.0 2,-0.2 -2,-0.2 0.903 105.3 59.4 -70.1 -39.0 -23.8 82.9 9.9 93 93 A K H X S+ 0 0 78 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.891 105.8 48.4 -57.3 -39.5 -25.6 80.3 7.7 94 94 A I H X S+ 0 0 24 -4,-1.5 4,-2.5 2,-0.2 -1,-0.2 0.912 111.1 49.7 -67.7 -41.2 -27.6 79.3 10.7 95 95 A R H X S+ 0 0 33 -4,-1.6 4,-2.6 1,-0.2 5,-0.2 0.910 112.0 49.2 -63.9 -40.0 -28.4 82.9 11.6 96 96 A V H X S+ 0 0 6 -4,-3.0 4,-2.1 2,-0.2 5,-0.3 0.900 111.7 47.8 -65.8 -43.1 -29.5 83.4 8.0 97 97 A D H X S+ 0 0 20 -4,-2.3 4,-1.6 -5,-0.2 5,-0.3 0.931 115.6 44.9 -63.7 -47.2 -31.8 80.3 7.9 98 98 A I H X S+ 0 0 4 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.941 116.4 43.5 -63.7 -51.0 -33.4 81.2 11.2 99 99 A L H X S+ 0 0 0 -4,-2.6 4,-3.4 -5,-0.2 5,-0.3 0.949 111.6 52.5 -62.2 -53.2 -34.0 84.9 10.5 100 100 A E H X S+ 0 0 5 -4,-2.1 4,-1.7 -5,-0.2 -2,-0.2 0.941 118.0 36.9 -46.3 -59.9 -35.3 84.5 6.9 101 101 A N H X S+ 0 0 9 -4,-1.6 4,-2.4 -5,-0.3 -1,-0.2 0.914 117.0 51.2 -62.7 -45.5 -37.9 81.9 7.9 102 102 A Q H X S+ 0 0 29 -4,-2.6 4,-2.5 -5,-0.3 5,-0.2 0.921 111.3 47.8 -60.5 -44.1 -38.8 83.6 11.2 103 103 A A H X S+ 0 0 0 -4,-3.4 4,-1.6 1,-0.2 -1,-0.2 0.846 113.6 49.1 -65.5 -32.8 -39.3 86.9 9.5 104 104 A M H X S+ 0 0 31 -4,-1.7 4,-1.7 -5,-0.3 -2,-0.2 0.824 109.2 53.7 -74.6 -30.7 -41.4 85.1 7.0 105 105 A D H X S+ 0 0 49 -4,-2.4 4,-1.6 2,-0.2 -2,-0.2 0.949 112.0 41.7 -67.5 -52.9 -43.3 83.4 9.8 106 106 A V H X S+ 0 0 6 -4,-2.5 4,-2.1 2,-0.2 5,-0.2 0.857 111.1 57.2 -65.4 -35.5 -44.3 86.6 11.6 107 107 A S H X S+ 0 0 23 -4,-1.6 4,-2.0 -5,-0.2 -1,-0.2 0.930 111.5 41.4 -62.3 -47.3 -45.1 88.5 8.3 108 108 A N H X S+ 0 0 48 -4,-1.7 4,-1.4 2,-0.2 -1,-0.2 0.810 110.0 60.5 -70.4 -27.2 -47.6 85.8 7.3 109 109 A Q H X S+ 0 0 77 -4,-1.6 4,-1.5 2,-0.3 -2,-0.2 0.879 108.8 41.2 -66.8 -38.6 -48.8 85.8 10.9 110 110 A L H X S+ 0 0 1 -4,-2.1 4,-2.6 1,-0.2 5,-0.2 0.874 113.3 56.6 -72.8 -34.3 -49.7 89.5 10.6 111 111 A A H < S+ 0 0 15 -4,-2.0 4,-0.4 -5,-0.2 -2,-0.3 0.740 101.5 55.8 -66.7 -24.1 -51.0 88.5 7.1 112 112 A R H >< S+ 0 0 100 -4,-1.4 3,-0.6 2,-0.2 4,-0.4 0.948 110.6 45.8 -71.4 -46.5 -53.3 86.0 8.8 113 113 A V H >< S+ 0 0 15 -4,-1.5 3,-1.7 1,-0.2 -2,-0.2 0.954 112.9 45.8 -60.3 -58.9 -54.8 88.7 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0.937 112.1 49.0 -60.1 -46.2 -22.3 129.1 32.1 768 114 D C H 3< S+ 0 0 0 -4,-2.4 99,-1.2 1,-0.3 100,-0.7 0.627 106.1 57.8 -70.8 -14.7 -19.8 126.2 32.3 769 115 D Y T << S+ 0 0 104 -4,-1.2 -1,-0.3 -3,-0.7 -2,-0.2 0.246 89.6 95.7 -98.0 12.4 -16.9 128.7 32.3 770 116 D S S X S- 0 0 29 -3,-1.6 3,-1.2 -5,-0.1 6,-0.1 -0.888 71.3-142.1-108.4 133.1 -18.2 130.4 35.4 771 117 D P T 3 S+ 0 0 120 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.691 101.5 67.2 -62.4 -18.8 -17.0 129.6 38.9 772 118 D D T >> + 0 0 68 1,-0.2 3,-2.3 2,-0.1 4,-2.1 0.015 65.3 138.9 -92.1 27.5 -20.6 130.1 40.1 773 119 D F H <> + 0 0 12 -3,-1.2 4,-2.4 1,-0.3 -1,-0.2 0.861 65.3 51.9 -35.1 -64.6 -21.6 127.0 38.1 774 120 D E H 34 S+ 0 0 146 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.655 114.2 45.7 -53.4 -20.7 -24.0 125.5 40.7 775 121 D K H <> S+ 0 0 147 -3,-2.3 4,-0.9 2,-0.1 -1,-0.2 0.875 117.0 40.3 -88.3 -47.3 -25.8 128.9 40.9 776 122 D L H X S+ 0 0 41 -4,-2.1 4,-2.5 2,-0.2 5,-0.2 0.637 102.1 71.9 -78.2 -18.7 -26.1 129.6 37.2 777 123 D K H X S+ 0 0 59 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70.4 51.1 956 84 E N T < 5 + 0 0 96 -3,-0.7 2,-2.8 1,-0.2 -3,-0.2 0.564 65.0 148.0 60.7 10.3 49.1 72.6 47.9 957 85 E L < + 0 0 22 -5,-2.2 69,-1.6 -6,-0.3 2,-0.3 -0.288 45.7 81.7 -74.1 60.9 45.7 71.0 47.0 958 86 E C S S- 0 0 29 -2,-2.8 7,-0.1 67,-0.2 6,-0.1 -0.937 92.5 -57.3-154.1 168.9 44.6 74.2 45.3 959 87 E G - 0 0 16 -2,-0.3 3,-0.1 5,-0.2 -3,-0.0 -0.195 33.3-170.8 -56.7 140.5 45.0 75.9 41.9 960 88 E E S S+ 0 0 121 1,-0.1 2,-0.3 -3,-0.0 -1,-0.1 0.273 73.3 43.5-113.9 6.2 48.5 76.7 40.7 961 89 E T S > S- 0 0 59 1,-0.1 4,-2.8 0, 0.0 3,-0.3 -0.979 88.9-111.8-149.3 145.0 47.5 78.8 37.7 962 90 E E H > S+ 0 0 56 -2,-0.3 4,-2.3 1,-0.2 -1,-0.1 0.891 116.8 58.7 -43.1 -50.1 44.9 81.6 37.4 963 91 E E H > S+ 0 0 138 1,-0.3 4,-1.4 2,-0.2 3,-0.4 0.924 112.5 37.8 -45.3 -57.0 42.9 79.3 35.1 964 92 E E H > S+ 0 0 22 -3,-0.3 4,-2.0 1,-0.2 -1,-0.3 0.858 110.5 64.6 -65.8 -33.2 42.6 76.6 37.8 965 93 E K H X S+ 0 0 63 -4,-2.8 4,-1.3 1,-0.2 -1,-0.2 0.868 101.9 48.0 -58.7 -41.8 42.2 79.4 40.4 966 94 E I H X S+ 0 0 17 -4,-2.3 4,-2.4 -3,-0.4 3,-0.2 0.971 114.5 41.4 -68.1 -53.9 38.9 80.5 38.9 967 95 E R H X S+ 0 0 38 -4,-1.4 4,-2.2 2,-0.2 5,-0.2 0.769 108.0 61.4 -66.8 -25.7 37.1 77.2 38.6 968 96 E V H X S+ 0 0 5 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.943 110.4 42.3 -61.7 -46.9 38.4 75.9 41.9 969 97 E D H X S+ 0 0 15 -4,-1.3 4,-2.2 -5,-0.2 5,-0.3 0.948 109.4 58.6 -62.7 -52.2 36.5 78.8 43.5 970 98 E I H >X S+ 0 0 3 -4,-2.4 4,-3.4 1,-0.2 3,-0.9 0.932 110.9 40.5 -41.2 -66.4 33.5 78.3 41.2 971 99 E L H 3X>S+ 0 0 1 -4,-2.2 4,-3.3 1,-0.3 5,-0.6 0.886 109.6 59.8 -52.2 -47.7 32.9 74.8 42.5 972 100 E E H 3X5S+ 0 0 11 -4,-2.1 4,-0.6 1,-0.2 -1,-0.3 0.842 117.7 31.7 -51.5 -39.5 33.7 75.6 46.1 973 101 E N H XX S+ 0 0 1 -4,-1.4 4,-2.2 2,-0.2 3,-0.6 0.929 116.2 50.5 -80.4 -49.1 19.1 70.6 49.2 983 111 E A H 3X S+ 0 0 14 -4,-2.6 4,-1.2 1,-0.3 5,-0.3 0.911 104.2 58.6 -54.8 -45.7 19.5 71.0 53.0 984 112 E R H 3X S+ 0 0 119 -4,-2.7 4,-0.6 1,-0.2 3,-0.3 0.859 109.1 46.8 -51.6 -39.8 17.1 74.0 53.1 985 113 E V H X< S+ 0 0 16 -3,-0.6 3,-1.6 -4,-0.6 -1,-0.2 0.963 109.4 51.5 -67.4 -53.8 14.5 71.6 51.5 986 114 E C H 3< S+ 0 0 0 -4,-2.2 100,-1.0 1,-0.3 99,-1.0 0.565 110.1 51.0 -63.2 -11.0 15.2 68.7 54.0 987 115 E Y H 3< S+ 0 0 128 -4,-1.2 -1,-0.3 -3,-0.3 -2,-0.2 0.575 90.1 101.6 -98.0 -16.4 14.8 71.1 56.9 988 116 E S S << S- 0 0 28 -3,-1.6 3,-0.5 -4,-0.6 6,-0.1 -0.550 71.6-139.2 -74.9 131.1 11.4 72.4 55.5 989 117 E P S S+ 0 0 113 0, 0.0 2,-1.4 0, 0.0 3,-0.3 0.847 99.7 62.2 -54.7 -42.3 8.3 71.0 57.2 990 118 E D >> + 0 0 74 1,-0.2 4,-2.0 2,-0.1 3,-0.9 -0.302 65.3 151.6 -85.5 54.2 6.5 70.7 53.8 991 119 E F H 3> + 0 0 16 -2,-1.4 4,-2.7 -3,-0.5 3,-0.2 0.919 65.7 57.3 -47.2 -57.7 9.0 68.2 52.6 992 120 E E H 34 S+ 0 0 138 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.789 109.2 46.3 -47.3 -37.8 6.6 66.4 50.3 993 121 E K H <> S+ 0 0 144 -3,-0.9 4,-0.8 1,-0.2 -1,-0.2 0.899 117.1 41.8 -75.2 -42.9 5.8 69.7 48.4 994 122 E L H X S+ 0 0 51 -4,-2.0 4,-1.9 -3,-0.2 -2,-0.2 0.722 102.0 69.6 -80.3 -20.7 9.4 70.8 48.1 995 123 E K H X S+ 0 0 64 -4,-2.7 4,-2.6 -5,-0.2 5,-0.2 0.970 103.1 39.3 -63.8 -57.4 10.9 67.4 47.1 996 124 E P H > S+ 0 0 71 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.896 111.1 62.3 -60.2 -36.1 9.4 67.0 43.6 997 125 E E H X S+ 0 0 129 -4,-0.8 4,-0.6 1,-0.2 3,-0.5 0.943 110.7 37.6 -50.0 -55.7 10.0 70.7 43.0 998 126 E Y H >X S+ 0 0 14 -4,-1.9 4,-2.9 1,-0.2 3,-1.5 0.910 111.4 59.1 -65.1 -43.7 13.7 70.2 43.4 999 127 E L H 3< S+ 0 0 39 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.756 104.3 53.3 -57.9 -24.8 13.7 66.9 41.6 1000 128 E E H 3< S+ 0 0 150 -4,-1.8 -1,-0.3 -3,-0.5 4,-0.2 0.673 116.1 37.6 -82.8 -21.0 12.2 68.7 38.6 1001 129 E E H S+ 0 0 65 0, 0.0 4,-0.9 0, 0.0 3,-0.3 0.972 108.0 41.5 -62.9 -55.9 18.5 67.4 36.0 1004 132 E T H > S+ 0 0 52 1,-0.2 4,-1.1 -4,-0.2 -2,-0.2 0.755 113.6 57.6 -64.5 -21.8 19.5 70.6 34.1 1005 133 E M H X S+ 0 0 26 -4,-1.2 4,-0.9 1,-0.2 -1,-0.2 0.903 106.7 46.7 -71.3 -42.9 21.4 71.6 37.3 1006 134 E M H X S+ 0 0 0 -4,-1.8 4,-1.8 -3,-0.3 -2,-0.2 0.578 101.2 71.5 -75.2 -12.6 23.4 68.4 37.0 1007 135 E Q H X S+ 0 0 81 -4,-0.9 4,-1.9 2,-0.2 -1,-0.2 0.962 95.8 47.0 -68.0 -53.2 23.9 69.2 33.3 1008 136 E H H X S+ 0 0 22 -4,-1.1 4,-2.6 1,-0.2 5,-0.2 0.856 108.2 58.9 -57.0 -37.2 26.3 72.1 33.9 1009 137 E F H X S+ 0 0 6 -4,-0.9 4,-2.1 1,-0.2 3,-0.3 0.966 107.9 44.4 -55.3 -53.0 28.1 69.9 36.3 1010 138 E S H X S+ 0 0 24 -4,-1.8 4,-1.9 1,-0.2 -1,-0.2 0.782 115.0 49.3 -62.6 -31.0 28.8 67.4 33.5 1011 139 E Q H < S+ 0 0 114 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.798 108.6 53.0 -79.2 -28.4 29.7 70.3 31.2 1012 140 E F H < S+ 0 0 2 -4,-2.6 -2,-0.2 -3,-0.3 -3,-0.2 0.874 116.0 38.3 -72.8 -42.5 32.1 71.8 33.8 1013 141 E L H < S+ 0 0 0 -4,-2.1 -2,-0.2 -5,-0.2 -3,-0.2 0.975 88.7 133.5 -70.0 -59.2 34.0 68.5 34.2 1014 142 E G < + 0 0 29 -4,-1.9 2,-1.5 -5,-0.2 -1,-0.1 -0.218 68.9 14.3 51.3-122.0 33.8 67.7 30.6 1015 143 E K S S+ 0 0 202 -4,-0.2 -1,-0.2 -3,-0.1 3,-0.1 -0.457 113.1 67.1 -89.0 67.3 37.0 66.5 29.1 1016 144 E R S S- 0 0 79 -2,-1.5 6,-0.1 1,-0.1 3,-0.1 -0.939 75.0-122.3-176.1 149.7 39.2 65.8 32.1 1017 145 E P S S+ 0 0 56 0, 0.0 2,-0.4 0, 0.0 5,-0.1 0.810 100.3 42.7 -68.8 -31.2 39.5 63.4 35.1 1018 146 E W B > S-V 1021 0L 35 3,-1.2 3,-1.2 -5,-0.1 5,-0.1 -0.969 80.1-129.0-123.5 136.6 39.3 66.3 37.7 1019 147 E F T 3 S+ 0 0 0 -2,-0.4 3,-0.1 1,-0.3 -1,-0.1 0.687 110.3 50.2 -48.5 -30.4 37.0 69.3 37.7 1020 148 E V T 3 S- 0 0 3 3,-0.3 2,-0.3 1,-0.2 -1,-0.3 0.778 120.9-100.7 -81.5 -32.6 39.9 71.7 38.1 1021 149 E G B < S-V 1018 0L 8 -3,-1.2 -3,-1.2 2,-0.2 -1,-0.2 -0.968 77.9 -9.7 153.4-130.9 41.9 70.2 35.3 1022 150 E D S S+ 0 0 150 -2,-0.3 2,-0.4 -5,-0.1 -3,-0.1 0.652 121.2 61.9 -78.7 -16.2 44.8 67.8 35.1 1023 151 E K S S- 0 0 44 -5,-0.1 -3,-0.3 -6,-0.0 -2,-0.2 -0.904 80.8-121.4-119.9 143.0 45.3 67.9 38.9 1024 152 E I + 0 0 28 -2,-0.4 2,-0.3 -4,-0.1 -66,-0.1 -0.441 34.0 173.4 -77.4 149.1 43.1 67.0 41.9 1025 153 E T >> - 0 0 0 -2,-0.1 3,-1.1 -68,-0.1 4,-0.7 -0.852 48.2 -88.7-144.0 178.7 42.2 69.5 44.5 1026 154 E F H >> S+ 0 0 3 -69,-1.6 4,-1.5 -2,-0.3 3,-1.2 0.866 117.8 67.0 -63.3 -36.2 40.0 69.9 47.6 1027 155 E V H 3> S+ 0 0 0 1,-0.3 4,-3.0 -70,-0.2 -1,-0.3 0.753 92.7 62.1 -57.2 -24.0 37.0 71.1 45.5 1028 156 E D H <> S+ 0 0 0 -3,-1.1 4,-2.9 2,-0.2 -1,-0.3 0.903 100.7 52.1 -69.3 -36.7 36.9 67.6 44.0 1029 157 E F H X S+ 0 0 14 -4,-1.5 4,-2.3 2,-0.2 3,-0.8 0.963 111.1 51.7 -60.8 -54.4 33.3 68.7 47.9 1031 159 E A H 3X S+ 0 0 0 -4,-3.0 4,-2.5 1,-0.3 -2,-0.2 0.909 106.9 55.4 -48.6 -48.7 32.0 67.9 44.4 1032 160 E Y H 3X S+ 0 0 8 -4,-2.9 4,-2.7 1,-0.2 -1,-0.3 0.824 107.6 48.2 -55.3 -40.8 32.1 64.2 45.3 1033 161 E D H X S+ 0 0 12 -4,-2.2 4,-2.1 2,-0.2 3,-1.3 0.966 112.7 42.1 -67.2 -51.5 24.2 62.8 48.4 1038 166 E H H 3X S+ 0 0 2 -4,-1.3 4,-3.7 -3,-0.3 -2,-0.2 0.897 103.7 71.7 -59.9 -36.6 21.9 63.2 45.4 1039 167 E R H 3< S+ 0 0 70 -4,-2.6 -1,-0.3 1,-0.2 -2,-0.2 0.774 107.9 33.0 -48.3 -35.9 23.1 59.8 44.3 1040 168 E I H << S+ 0 0 94 -3,-1.3 -1,-0.2 -4,-0.7 -2,-0.2 0.836 118.6 52.9 -90.3 -39.4 21.1 58.3 47.2 1041 169 E F H < S+ 0 0 17 -4,-2.1 -2,-0.2 1,-0.3 -3,-0.2 0.905 134.1 6.7 -60.8 -49.4 18.2 60.9 47.1 1042 170 E E S >< S- 0 0 55 -4,-3.7 3,-1.6 1,-0.1 -1,-0.3 -0.758 73.9-170.5-138.6 87.0 17.6 60.4 43.4 1043 171 E P G > S+ 0 0 74 0, 0.0 3,-1.5 0, 0.0 4,-0.4 0.890 81.7 54.2 -43.4 -55.8 19.7 57.5 42.1 1044 172 E N G 3> S+ 0 0 103 1,-0.3 4,-0.9 2,-0.2 3,-0.5 0.634 80.3 87.8 -61.9 -17.9 19.0 58.0 38.4 1045 173 E C G <4 S+ 0 0 13 -3,-1.6 -1,-0.3 1,-0.2 -6,-0.1 0.692 92.9 49.5 -58.0 -15.5 20.1 61.7 38.3 1046 174 E L T X4 S+ 0 0 4 -3,-1.5 3,-2.3 -4,-0.3 7,-0.3 0.848 92.9 72.8 -89.7 -38.8 23.6 60.3 37.6 1047 175 E D T 34 S+ 0 0 91 -3,-0.5 -2,-0.2 -4,-0.4 -1,-0.1 0.825 90.0 58.4 -44.7 -48.2 22.8 57.8 34.8 1048 176 E A T 3< S+ 0 0 79 -4,-0.9 -1,-0.3 1,-0.2 -2,-0.1 0.627 104.5 57.6 -62.4 -13.1 22.3 60.5 32.2 1049 177 E F X> - 0 0 29 -3,-2.3 4,-1.5 1,-0.2 3,-0.7 -0.772 62.1-178.3-126.0 94.0 25.8 61.8 32.7 1050 178 E P H >> S+ 0 0 84 0, 0.0 4,-2.4 0, 0.0 3,-0.5 0.914 80.6 55.3 -53.4 -58.3 28.6 59.3 32.2 1051 179 E N H 3> S+ 0 0 33 1,-0.3 4,-1.8 2,-0.2 5,-0.1 0.808 106.1 53.6 -49.3 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D H X S+ 0 0 16 -4,-2.7 4,-2.0 2,-0.2 5,-0.3 0.972 118.1 42.8 -57.0 -61.0 38.5 82.2 54.7 1188 98 F I H X S+ 0 0 2 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.945 119.7 41.8 -51.7 -57.0 36.6 82.4 58.0 1189 99 F L H X S+ 0 0 1 -4,-2.9 4,-3.5 -5,-0.3 5,-0.3 0.953 108.7 62.9 -59.1 -47.8 35.3 86.0 57.5 1190 100 F E H X S+ 0 0 11 -4,-2.9 4,-1.5 -5,-0.4 -2,-0.2 0.882 113.7 30.9 -40.3 -66.5 34.6 85.2 53.8 1191 101 F N H X S+ 0 0 11 -4,-2.0 4,-2.5 1,-0.2 -1,-0.3 0.824 118.2 58.1 -66.2 -33.2 32.0 82.5 54.5 1192 102 F Q H X S+ 0 0 25 -4,-2.3 4,-1.8 -5,-0.3 -2,-0.2 0.920 103.4 50.6 -66.1 -42.7 30.9 84.2 57.8 1193 103 F A H X S+ 0 0 1 -4,-3.5 4,-1.1 1,-0.2 -1,-0.2 0.917 111.1 51.9 -60.3 -42.3 30.0 87.5 56.0 1194 104 F M H >X S+ 0 0 27 -4,-1.5 4,-2.7 -5,-0.3 3,-1.1 0.952 105.3 53.2 -59.4 -52.0 27.9 85.4 53.6 1195 105 F D H 3X S+ 0 0 46 -4,-2.5 4,-2.9 1,-0.3 5,-0.2 0.837 105.3 54.4 -54.0 -38.2 26.0 83.5 56.3 1196 106 F V H 3X S+ 0 0 13 -4,-1.8 4,-1.0 1,-0.2 -1,-0.3 0.796 112.9 43.2 -68.1 -29.4 24.9 86.8 58.0 1197 107 F S H X S+ 0 0 100 -4,-2.8 3,-1.2 1,-0.3 4,-0.9 0.918 109.2 49.3 -55.1 -45.0 15.8 84.3 54.5 1203 113 F V H 3< S+ 0 0 16 -4,-1.5 3,-0.4 1,-0.3 -1,-0.3 0.849 111.2 49.0 -64.6 -35.4 14.0 86.5 57.1 1204 114 F C H 3< S+ 0 0 0 -4,-2.3 99,-2.0 1,-0.2 100,-0.9 0.533 115.2 46.5 -81.3 -4.3 13.3 89.1 54.5 1205 115 F Y H << S+ 0 0 94 -3,-1.2 -2,-0.2 -4,-0.8 -1,-0.2 0.418 87.4 97.9-112.7 -6.2 12.0 86.3 52.3 1206 116 F S >< - 0 0 23 -4,-0.9 3,-1.6 -3,-0.4 6,-0.1 -0.779 67.8-145.0 -86.5 124.9 9.8 84.5 54.8 1207 117 F P T 3 S+ 0 0 110 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.813 100.2 64.7 -57.4 -29.9 6.1 85.5 54.4 1208 118 F D T > + 0 0 101 1,-0.2 3,-1.8 2,-0.1 5,-0.1 0.837 69.2 143.0 -61.2 -32.6 5.8 85.1 58.2 1209 119 F F G X> + 0 0 19 -3,-1.6 4,-2.9 1,-0.3 3,-0.6 0.020 63.1 53.4 29.6 -84.2 8.3 88.0 58.5 1210 120 F E G 34 S+ 0 0 129 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.678 109.1 53.3 -45.7 -24.8 6.8 89.7 61.6 1211 121 F K G <> S+ 0 0 157 -3,-1.8 4,-0.5 2,-0.1 -1,-0.2 0.933 119.8 26.9 -79.8 -50.1 7.0 86.3 63.4 1212 122 F L H <> S+ 0 0 50 -3,-0.6 4,-1.7 1,-0.1 -2,-0.2 0.653 106.5 77.5 -88.6 -15.1 10.6 85.4 63.0 1213 123 F K H X S+ 0 0 42 -4,-2.9 4,-1.8 1,-0.2 -3,-0.1 0.945 95.2 46.1 -60.1 -51.4 11.9 89.0 62.6 1214 124 F P H 4 S+ 0 0 63 0, 0.0 4,-0.4 0, 0.0 -1,-0.2 0.857 111.4 51.4 -62.6 -36.4 11.8 89.8 66.4 1215 125 F E H >X S+ 0 0 100 -4,-0.5 4,-1.0 1,-0.2 3,-1.0 0.859 105.9 57.4 -68.9 -29.2 13.4 86.5 67.4 1216 126 F Y H 3X S+ 0 0 13 -4,-1.7 4,-2.1 1,-0.3 3,-0.4 0.929 99.6 57.1 -63.1 -45.1 16.1 87.4 64.8 1217 127 F L H 3< S+ 0 0 52 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.649 97.9 67.0 -60.4 -15.4 16.8 90.6 66.7 1218 128 F E H <4 S+ 0 0 137 -3,-1.0 4,-0.4 -4,-0.4 -1,-0.2 0.971 113.0 24.5 -70.9 -54.9 17.4 88.4 69.8 1219 129 F E H X S+ 0 0 89 -4,-1.0 4,-2.3 -3,-0.4 5,-0.2 0.654 102.5 88.6 -85.2 -17.1 20.6 86.7 68.5 1220 130 F L H X S+ 0 0 5 -4,-2.1 4,-2.1 1,-0.2 5,-0.2 0.912 86.9 49.4 -46.3 -53.9 21.5 89.5 66.2 1221 131 F P H > S+ 0 0 51 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.913 111.2 46.6 -55.6 -48.9 23.5 91.5 68.8 1222 132 F T H > S+ 0 0 64 -4,-0.4 4,-1.9 2,-0.2 -2,-0.2 0.870 109.7 56.4 -63.4 -33.0 25.6 88.6 70.1 1223 133 F M H X S+ 0 0 40 -4,-2.3 4,-0.8 1,-0.2 -1,-0.2 0.937 111.8 42.5 -62.2 -41.5 26.3 87.7 66.4 1224 134 F M H X S+ 0 0 13 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.775 103.7 66.3 -74.3 -27.9 27.6 91.3 66.1 1225 135 F Q H X S+ 0 0 95 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.942 101.4 50.8 -57.4 -43.6 29.5 91.0 69.4 1226 136 F H H X S+ 0 0 32 -4,-1.9 4,-1.8 1,-0.2 -1,-0.2 0.788 108.0 50.5 -67.0 -31.2 31.6 88.4 67.7 1227 137 F F H X S+ 0 0 14 -4,-0.8 4,-2.0 2,-0.2 5,-0.2 0.909 106.6 55.8 -73.7 -39.6 32.4 90.6 64.7 1228 138 F S H X S+ 0 0 17 -4,-2.5 4,-3.3 1,-0.2 3,-0.2 0.943 110.0 45.3 -56.5 -49.5 33.4 93.4 67.0 1229 139 F Q H < S+ 0 0 143 -4,-2.0 -1,-0.2 1,-0.2 4,-0.2 0.921 107.9 56.9 -60.1 -46.4 36.0 91.2 68.7 1230 140 F F H < S+ 0 0 9 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.858 116.5 36.5 -53.6 -40.1 37.3 89.8 65.4 1231 141 F L H >< S+ 0 0 0 -4,-2.0 3,-1.6 -3,-0.2 2,-0.3 0.954 84.1 137.9 -76.6 -56.6 38.0 93.4 64.3 1232 142 F G T 3< S- 0 0 26 -4,-3.3 -1,-0.1 1,-0.3 -2,-0.1 -0.269 81.3 -11.6 52.4-108.2 39.1 94.6 67.7 1233 143 F K T 3 S+ 0 0 202 -2,-0.3 -1,-0.3 -4,-0.2 -2,-0.1 0.681 108.3 96.9 -97.4 -24.9 42.2 96.8 67.2 1234 144 F R < - 0 0 82 -3,-1.6 5,-0.1 -4,-0.2 6,-0.1 -0.581 66.9-143.6 -72.6 125.6 43.2 96.1 63.6 1235 145 F P S S+ 0 0 50 0, 0.0 2,-0.5 0, 0.0 5,-0.2 0.962 89.2 43.4 -50.5 -63.9 41.8 98.8 61.3 1236 146 F W B > S-A 1239 0O 24 3,-1.5 3,-3.8 1,-0.1 5,-0.1 -0.777 97.3-116.7 -90.6 126.5 41.0 96.5 58.4 1237 147 F F T 3 S+ 0 0 2 -2,-0.5 -1,-0.1 1,-0.3 -3,-0.1 0.645 116.2 51.9 -28.6 -33.7 39.4 93.2 59.4 1238 148 F V T 3 S- 0 0 2 3,-0.5 2,-0.5 1,-0.2 3,-0.3 0.226 122.7 -99.2 -97.0 16.9 42.4 91.4 58.1 1239 149 F G B < S-A 1236 0O 12 -3,-3.8 -3,-1.5 1,-0.2 -1,-0.2 -0.930 83.3 -12.4 111.5-131.6 44.9 93.5 60.0 1240 150 F D S S+ 0 0 139 -2,-0.5 2,-0.2 -5,-0.2 -1,-0.2 0.764 121.2 73.4 -79.6 -30.8 46.9 96.4 58.6 1241 151 F K S S- 0 0 34 -3,-0.3 -3,-0.5 -5,-0.1 2,-0.4 -0.559 78.6-127.8 -90.9 152.6 46.0 95.5 55.1 1242 152 F I + 0 0 25 -2,-0.2 2,-0.3 -5,-0.1 -2,-0.1 -0.780 33.4 176.8 -95.1 138.1 42.7 96.0 53.3 1243 153 F T >> - 0 0 0 -2,-0.4 3,-2.1 1,-0.0 4,-0.5 -0.853 48.2 -93.5-134.8 173.0 41.2 92.9 51.6 1244 154 F F H >> S+ 0 0 1 -69,-2.6 4,-1.9 1,-0.3 3,-1.6 0.855 120.8 67.6 -58.8 -29.3 38.1 92.0 49.6 1245 155 F V H 3> S+ 0 0 1 -70,-0.3 4,-2.2 1,-0.3 -1,-0.3 0.741 89.5 64.7 -63.4 -20.1 36.7 90.7 52.9 1246 156 F D H <> S+ 0 0 0 -3,-2.1 4,-1.8 2,-0.2 -1,-0.3 0.784 104.0 45.4 -74.1 -24.8 36.6 94.4 54.0 1247 157 F F H X S+ 0 0 15 -4,-1.7 4,-2.1 -5,-0.3 3,-0.9 0.994 110.4 32.8 -61.3 -62.3 22.6 96.2 55.9 1256 166 F H H 3X S+ 0 0 8 -4,-1.6 4,-3.5 1,-0.3 7,-0.2 0.802 109.1 71.3 -63.5 -30.6 21.7 95.7 59.6 1257 167 F R H 3< S+ 0 0 88 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.901 110.2 31.6 -52.5 -41.1 22.6 99.4 60.1 1258 168 F I H << S+ 0 0 108 -4,-1.5 -2,-0.2 -3,-0.9 -1,-0.2 0.809 117.4 54.8 -87.9 -34.3 19.4 100.1 58.2 1259 169 F F H < S- 0 0 20 -4,-2.1 -2,-0.2 1,-0.3 -3,-0.2 0.874 137.9 -4.5 -66.0 -37.9 17.4 97.1 59.3 1260 170 F E >< - 0 0 52 -4,-3.5 3,-0.9 -5,-0.2 4,-0.4 -0.616 64.4-164.0-159.3 93.9 18.0 98.1 62.9 1261 171 F P T 3> S+ 0 0 84 0, 0.0 4,-1.0 0, 0.0 3,-0.1 0.667 82.5 72.0 -54.5 -20.8 20.3 101.1 63.6 1262 172 F N H 3> S+ 0 0 104 1,-0.2 4,-1.3 2,-0.1 3,-0.2 0.945 82.1 68.1 -63.1 -51.2 20.7 100.0 67.2 1263 173 F C H <4 S+ 0 0 9 -3,-0.9 3,-0.4 1,-0.2 4,-0.2 0.798 105.6 35.9 -38.0 -58.7 22.9 96.9 66.7 1264 174 F L H >4 S+ 0 0 4 -4,-0.4 3,-2.5 1,-0.2 7,-0.5 0.881 107.5 68.3 -68.1 -38.2 26.2 98.6 65.5 1265 175 F D H 3< S+ 0 0 91 -4,-1.0 -1,-0.2 1,-0.3 -2,-0.2 0.805 94.5 57.4 -50.2 -34.6 25.7 101.6 67.8 1266 176 F A T 3< S+ 0 0 71 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.594 105.2 54.7 -75.0 -12.8 26.4 99.3 70.8 1267 177 F F X> - 0 0 38 -3,-2.5 4,-1.9 -4,-0.2 3,-0.9 -0.768 64.1-178.4-126.0 88.4 29.7 98.3 69.4 1268 178 F P H 3> S+ 0 0 85 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.833 79.9 66.9 -52.0 -40.3 31.7 101.5 68.7 1269 179 F N H 3> S+ 0 0 37 1,-0.2 4,-1.2 2,-0.2 -5,-0.0 0.920 106.7 39.0 -48.8 -50.5 34.6 99.4 67.3 1270 180 F L H <> S+ 0 0 0 -3,-0.9 4,-1.8 1,-0.2 3,-0.3 0.914 111.3 58.6 -69.9 -41.1 32.4 98.3 64.3 1271 181 F K H X S+ 0 0 83 -4,-1.9 4,-1.5 -7,-0.5 -1,-0.2 0.848 106.2 49.7 -57.2 -34.9 30.9 101.8 64.0 1272 182 F D H X S+ 0 0 69 -4,-2.5 4,-1.8 2,-0.2 -1,-0.3 0.838 103.6 61.0 -74.9 -29.8 34.3 103.2 63.5 1273 183 F F H >X S+ 0 0 0 -4,-1.2 4,-0.7 -3,-0.3 3,-0.6 0.983 107.1 43.1 -58.4 -59.1 35.1 100.6 60.8 1274 184 F I H >X S+ 0 0 6 -4,-1.8 4,-1.9 1,-0.3 3,-1.1 0.858 110.7 54.6 -56.3 -38.2 32.3 101.7 58.5 1275 185 F S H 3X S+ 0 0 14 -4,-1.5 4,-0.6 1,-0.3 -1,-0.3 0.866 104.6 57.0 -64.0 -32.4 33.1 105.4 59.0 1276 186 F R H << S+ 0 0 69 -4,-1.8 -1,-0.3 -3,-0.6 4,-0.2 0.670 106.0 51.2 -71.3 -17.6 36.7 104.5 58.0 1277 187 F F H X< S+ 0 0 0 -3,-1.1 3,-2.1 -4,-0.7 -2,-0.2 0.936 101.9 56.0 -83.9 -51.6 35.3 103.1 54.7 1278 188 F E H 3< S+ 0 0 46 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.1 0.602 103.1 57.8 -56.2 -17.4 33.1 106.1 53.6 1279 189 F G T 3< S+ 0 0 3 -4,-0.6 -1,-0.3 214,-0.1 218,-0.2 0.661 76.6 117.2 -88.2 -17.9 36.2 108.4 53.8 1280 190 F L S X> S- 0 0 16 -3,-2.1 4,-2.6 -4,-0.2 3,-0.7 -0.317 71.8-124.8 -56.3 123.6 38.2 106.3 51.3 1281 191 F E H 3> S+ 0 0 69 216,-1.2 4,-1.5 1,-0.3 5,-0.2 0.801 105.3 38.4 -34.8 -66.4 38.9 108.4 48.2 1282 192 F K H 3> S+ 0 0 35 1,-0.2 4,-1.8 215,-0.2 -1,-0.3 0.840 118.2 51.1 -62.2 -32.3 37.5 106.1 45.4 1283 193 F I H <> S+ 0 0 0 -3,-0.7 4,-2.3 2,-0.2 5,-0.2 0.852 103.2 58.3 -74.1 -34.0 34.5 105.1 47.6 1284 194 F S H X S+ 0 0 40 -4,-2.6 4,-1.0 1,-0.2 -2,-0.2 0.907 110.5 43.5 -61.4 -42.4 33.6 108.8 48.5 1285 195 F A H < S+ 0 0 59 -4,-1.5 3,-0.4 -5,-0.2 -2,-0.2 0.930 112.1 52.2 -69.5 -47.4 33.2 109.5 44.8 1286 196 F Y H >< S+ 0 0 1 -4,-1.8 3,-1.2 1,-0.2 6,-0.4 0.883 110.4 46.9 -57.8 -45.5 31.3 106.3 43.9 1287 197 F M H 3< S+ 0 0 30 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.751 114.2 47.8 -70.9 -23.2 28.7 106.8 46.7 1288 198 F K T 3< S+ 0 0 178 -4,-1.0 -1,-0.3 -3,-0.4 2,-0.2 0.102 103.5 89.4-101.8 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52.8 125.5 -46.0 120.5 31.0 134.6 67.2 1584 58 H N - 0 0 56 -9,-0.1 -2,-0.1 13,-0.0 13,-0.0 -0.969 52.3 -72.9-172.8 163.3 33.9 136.9 67.9 1585 59 H L S S+ 0 0 18 -2,-0.3 13,-0.1 11,-0.1 -53,-0.1 -0.942 97.8 38.2-117.8 139.2 35.1 140.5 68.0 1586 60 H P S S+ 0 0 0 0, 0.0 11,-1.4 0, 0.0 2,-0.3 0.600 75.3 166.7 -83.8 166.8 35.8 142.4 65.8 1587 61 H Y E -GH15311596R 0 -56,-1.6 -56,-2.5 9,-0.2 2,-0.5 -0.999 23.1-153.3-145.7 141.6 33.3 141.6 63.0 1588 62 H L E -GH15301595R 1 7,-1.9 7,-1.9 -2,-0.3 2,-0.7 -0.964 5.1-160.6-119.9 122.1 32.3 143.3 59.8 1589 63 H I E +GH15291594R 19 -60,-1.9 -60,-1.8 -2,-0.5 2,-0.6 -0.896 10.1 178.8-104.2 113.8 28.8 142.8 58.3 1590 64 H D E > - H 01593R 44 3,-3.2 3,-1.9 -2,-0.7 2,-1.0 -0.691 61.8 -81.4-112.2 73.4 28.7 143.7 54.6 1591 65 H G T 3 S+ 0 0 63 -2,-0.6 -1,-0.0 -64,-0.3 -62,-0.0 -0.529 119.6 3.6 70.4-101.0 25.1 143.0 53.8 1592 66 H A T 3 S+ 0 0 94 -2,-1.0 2,-0.5 -3,-0.1 -1,-0.3 0.713 117.4 88.4 -88.0 -25.4 25.1 139.2 53.3 1593 67 H H E < +H 1590 0R 63 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C H >X S+ 0 0 22 -4,-3.0 4,-2.8 1,-0.2 3,-0.6 0.938 112.8 51.7 -49.8 -51.1 42.0 141.0 53.6 1604 78 H Y H 3X S+ 0 0 3 -4,-2.8 4,-2.0 1,-0.3 -1,-0.2 0.935 110.0 45.9 -50.8 -59.0 38.4 141.4 52.5 1605 79 H I H 3< S+ 0 0 2 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.758 115.9 49.5 -59.3 -22.1 38.4 145.2 52.5 1606 80 H A H X<>S+ 0 0 0 -4,-1.8 5,-2.1 -3,-0.6 3,-1.4 0.844 103.5 59.3 -84.0 -34.2 41.8 144.9 50.7 1607 81 H R H ><5S+ 0 0 40 -4,-2.8 3,-1.9 1,-0.3 2,-0.5 0.960 102.8 51.4 -58.9 -51.6 40.4 142.5 48.1 1608 82 H K T 3<5S+ 0 0 114 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.1 0.048 118.2 38.9 -78.6 29.7 37.8 144.9 46.9 1609 83 H H T < 5S- 0 0 80 -3,-1.4 -1,-0.3 -2,-0.5 -2,-0.2 0.144 109.3-117.9-158.4 11.4 40.5 147.6 46.5 1610 84 H N T < 5 + 0 0 116 -3,-1.9 2,-1.9 1,-0.2 -3,-0.2 0.609 63.3 147.3 50.0 23.9 43.2 145.3 45.1 1611 85 H L < + 0 0 22 -5,-2.1 69,-1.6 -6,-0.2 70,-0.2 -0.302 44.4 87.7 -84.4 56.6 45.4 146.1 48.1 1612 86 H C S S- 0 0 30 -2,-1.9 2,-0.4 67,-0.2 7,-0.0 -0.462 90.2 -61.3-130.1-161.5 47.1 142.7 48.1 1613 87 H G + 0 0 18 -2,-0.2 6,-0.1 1,-0.1 3,-0.1 -0.763 37.5 179.0 -95.0 140.3 50.0 141.1 46.3 1614 88 H E + 0 0 123 -2,-0.4 2,-0.3 1,-0.1 -1,-0.1 0.642 68.5 48.2-109.9 -27.5 50.1 140.9 42.6 1615 89 H T S > S- 0 0 50 1,-0.1 4,-2.8 0, 0.0 5,-0.2 -0.782 92.2-108.2-109.9 160.6 53.5 139.2 42.0 1616 90 H E H > S+ 0 0 76 -2,-0.3 4,-2.2 1,-0.2 5,-0.1 0.891 121.1 40.6 -55.8 -43.8 54.7 136.0 43.7 1617 91 H E H > S+ 0 0 103 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.902 113.6 53.5 -72.1 -38.1 57.3 137.9 45.8 1618 92 H E H > S+ 0 0 18 1,-0.2 4,-0.6 2,-0.2 -2,-0.2 0.884 111.8 47.2 -62.0 -36.2 54.9 140.8 46.4 1619 93 H K H >X S+ 0 0 75 -4,-2.8 4,-2.7 2,-0.2 3,-0.7 0.920 109.2 53.0 -71.6 -43.6 52.5 138.2 47.7 1620 94 H I H 3X S+ 0 0 17 -4,-2.2 4,-2.5 1,-0.3 5,-0.3 0.884 106.5 51.7 -60.1 -40.4 55.1 136.5 49.9 1621 95 H R H 3X S+ 0 0 41 -4,-2.5 4,-0.9 1,-0.2 -1,-0.3 0.740 111.3 51.1 -69.0 -19.8 56.0 139.8 51.5 1622 96 H V H X S+ 0 0 0 -4,-1.7 4,-1.8 2,-0.2 3,-1.7 0.975 109.9 53.7 -68.7 -54.5 53.1 142.4 73.4 1637 111 H A H 3X S+ 0 0 19 -4,-2.5 4,-1.1 1,-0.3 5,-0.3 0.812 97.0 69.3 -50.5 -31.9 49.5 142.2 74.5 1638 112 H R H 3< S+ 0 0 109 -4,-0.8 4,-0.4 1,-0.2 -1,-0.3 0.880 108.4 34.6 -54.2 -44.1 50.4 138.9 76.2 1639 113 H V H << S+ 0 0 14 -3,-1.7 3,-0.3 -4,-0.7 -1,-0.2 0.830 110.7 62.3 -81.9 -33.7 52.5 140.8 78.8 1640 114 H C H < S+ 0 0 0 -4,-1.8 100,-2.1 1,-0.3 99,-1.0 0.612 111.0 40.3 -68.4 -13.8 50.2 143.9 79.0 1641 115 H Y S < S+ 0 0 81 -4,-1.1 -1,-0.3 97,-0.3 -2,-0.2 0.547 94.8 106.0-105.4 -15.4 47.4 141.7 80.3 1642 116 H S S > S- 0 0 31 -4,-0.4 3,-1.0 -3,-0.3 4,-0.1 -0.426 70.7-138.3 -68.6 134.8 49.7 139.7 82.5 1643 117 H P T 3 S+ 0 0 105 0, 0.0 2,-0.6 0, 0.0 3,-0.4 0.893 104.8 55.5 -60.4 -38.8 49.4 140.4 86.2 1644 118 H D T >> S+ 0 0 83 1,-0.2 4,-1.6 2,-0.1 3,-0.8 -0.172 70.3 142.2 -89.7 44.1 53.2 140.3 86.6 1645 119 H F H X> + 0 0 25 -3,-1.0 4,-2.9 -2,-0.6 3,-1.2 0.931 67.8 50.6 -46.3 -60.6 53.6 142.9 83.8 1646 120 H E H 34 S+ 0 0 165 -3,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.729 107.0 53.8 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