==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 29-JAN-10 3LLR . COMPND 2 MOLECULE: DNA (CYTOSINE-5)-METHYLTRANSFERASE 3A; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR W.QIU,L.DOMBROVSKI,S.NI,J.WEIGELT,C.BOUTRA,C.H.ARROWSMITH, . 670 9 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33339.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 411 61.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 101 15.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 37 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 75 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 175 26.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 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 5 0 5 0 0 0 0 0 0 2 2 1 0 0 5 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 0 0 5 9 6 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 0 5 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 9 A E 0 0 106 0, 0.0 9,-0.2 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 137.4 29.5 -15.4 20.2 2 10 A Y + 0 0 31 37,-0.2 2,-1.1 1,-0.2 3,-0.4 0.699 360.0 141.5 62.7 25.5 27.1 -15.0 23.2 3 11 A E + 0 0 188 1,-0.2 -1,-0.2 2,-0.1 38,-0.0 -0.430 30.6 110.2 -93.2 59.1 26.6 -18.8 23.5 4 12 A D S S- 0 0 37 -2,-1.1 -1,-0.2 3,-0.2 -2,-0.1 0.292 90.1-110.9-115.3 5.3 26.5 -18.7 27.3 5 13 A G S S+ 0 0 79 -3,-0.4 -2,-0.1 2,-0.1 -3,-0.0 0.549 90.6 110.7 76.5 10.1 22.8 -19.5 27.8 6 14 A R - 0 0 111 1,-0.3 2,-0.2 -4,-0.2 -3,-0.1 0.484 69.2-143.8 -94.3 -4.0 22.0 -16.1 29.1 7 15 A G + 0 0 42 -5,-0.3 -1,-0.3 1,-0.1 -3,-0.2 -0.482 60.6 116.7 82.4-149.4 20.0 -15.0 26.0 8 16 A F - 0 0 33 -2,-0.2 3,-0.1 1,-0.1 -1,-0.1 0.906 52.0-172.4 44.7 58.3 19.9 -11.5 24.4 9 17 A G > - 0 0 22 1,-0.2 3,-1.7 2,-0.1 19,-0.3 -0.188 35.3 -58.0 -73.4 170.0 21.4 -12.6 21.1 10 18 A I T 3 S+ 0 0 85 1,-0.2 19,-0.2 -9,-0.2 -1,-0.2 -0.157 121.3 20.8 -51.8 133.0 22.6 -10.3 18.3 11 19 A G T 3 S+ 0 0 5 17,-3.0 2,-0.3 1,-0.3 -1,-0.2 0.292 84.5 138.5 92.4 -8.8 19.9 -8.0 16.8 12 20 A E < - 0 0 70 -3,-1.7 16,-2.2 118,-0.1 2,-0.4 -0.527 53.5-128.7 -74.3 131.9 17.6 -8.1 19.8 13 21 A L E +A 27 0A 10 116,-0.4 52,-1.9 -2,-0.3 2,-0.3 -0.687 42.9 171.8 -80.6 130.1 16.0 -4.8 20.8 14 22 A V E -AB 26 64A 0 12,-3.3 12,-2.6 -2,-0.4 2,-0.4 -0.861 41.1-122.4-138.0 163.0 16.5 -4.2 24.5 15 23 A W E -AB 25 63A 0 48,-3.3 48,-2.2 -2,-0.3 2,-0.4 -0.949 35.9-163.7-101.3 135.2 16.3 -1.9 27.5 16 24 A G E -AB 24 62A 1 8,-2.4 8,-2.3 -2,-0.4 2,-0.5 -0.969 7.4-153.4-127.5 140.0 19.7 -1.4 29.1 17 25 A K + 0 0 51 44,-2.2 2,-0.3 -2,-0.4 41,-0.2 -0.936 14.1 174.3-122.0 115.0 20.6 -0.1 32.5 18 26 A L > - 0 0 61 -2,-0.5 3,-1.7 4,-0.3 2,-0.2 -0.831 46.4 -86.9-109.4 155.2 23.8 1.6 33.5 19 27 A R T 3 S+ 0 0 230 -2,-0.3 3,-0.1 1,-0.2 -1,-0.0 -0.419 113.5 17.5 -63.2 126.8 24.5 3.2 36.9 20 28 A G T 3 S+ 0 0 69 1,-0.2 2,-0.3 -2,-0.2 -1,-0.2 0.464 112.7 84.0 92.6 4.3 23.3 6.9 37.0 21 29 A F S < S- 0 0 137 -3,-1.7 -1,-0.2 3,-0.0 -3,-0.2 -0.970 77.4-108.1-138.1 150.9 21.0 6.6 34.0 22 30 A S - 0 0 38 -2,-0.3 -4,-0.3 1,-0.2 -6,-0.1 -0.263 57.4 -72.4 -67.9 160.3 17.5 5.5 33.3 23 31 A W - 0 0 62 48,-0.3 50,-0.2 -6,-0.1 -6,-0.2 -0.377 63.2-159.8 -50.4 128.4 16.6 2.3 31.4 24 32 A W E -A 16 0A 31 -8,-2.3 -8,-2.4 -3,-0.1 2,-0.1 -0.960 17.0-110.5-128.6 136.8 17.6 3.2 27.8 25 33 A P E +A 15 0A 0 0, 0.0 24,-2.2 0, 0.0 2,-0.3 -0.408 51.2 143.9 -66.4 137.1 16.6 1.6 24.4 26 34 A G E -AC 14 48A 0 -12,-2.6 -12,-3.3 22,-0.3 2,-0.4 -0.935 39.7-122.4-155.4 175.7 19.4 -0.3 22.5 27 35 A R E -AC 13 47A 44 20,-2.0 20,-2.6 -2,-0.3 2,-0.3 -0.995 29.2-112.7-130.1 143.6 20.1 -3.2 20.3 28 36 A I E - C 0 46A 1 -16,-2.2 -17,-3.0 -2,-0.4 2,-0.3 -0.556 41.3-179.1 -70.5 127.1 22.5 -6.1 20.9 29 37 A V E - C 0 45A 4 16,-2.4 16,-0.6 -2,-0.3 2,-0.1 -0.859 30.9 -99.8-122.5 162.1 25.4 -6.1 18.4 30 38 A S > - 0 0 3 -2,-0.3 3,-1.6 1,-0.1 4,-0.4 -0.459 37.8-112.0 -72.5 155.1 28.5 -8.2 17.8 31 39 A W G >>>S+ 0 0 66 1,-0.3 3,-1.1 2,-0.2 5,-1.0 0.773 113.4 63.4 -61.5 -29.6 31.8 -7.1 19.3 32 40 A W G 345S+ 0 0 110 1,-0.2 -1,-0.3 2,-0.2 6,-0.0 0.551 94.7 60.9 -77.4 -6.7 33.3 -6.3 15.8 33 41 A M G <45S+ 0 0 45 -3,-1.6 -1,-0.2 1,-0.1 -2,-0.2 0.622 99.9 57.4 -83.6 -17.2 30.7 -3.6 15.2 34 42 A T T <45S- 0 0 15 -3,-1.1 -2,-0.2 -4,-0.4 -1,-0.1 0.675 102.5-125.1 -89.6 -21.8 31.9 -1.7 18.2 35 43 A G T <5S+ 0 0 70 -4,-0.5 2,-0.1 1,-0.2 -3,-0.1 0.821 83.8 86.3 72.0 33.4 35.6 -1.2 17.2 36 44 A R S - 0 0 70 -2,-0.2 3,-1.5 1,-0.2 -1,-0.1 -0.208 50.2 -72.8 -65.9 163.0 33.0 -11.2 28.9 41 49 A E T 3 S+ 0 0 169 1,-0.3 -1,-0.2 17,-0.0 3,-0.1 -0.305 122.1 24.5 -57.2 139.8 30.7 -14.1 29.7 42 50 A G T 3 S+ 0 0 8 1,-0.3 17,-2.3 -3,-0.1 18,-0.3 0.588 109.9 93.8 77.0 11.4 27.3 -13.0 31.0 43 51 A T E < - D 0 58A 16 -3,-1.5 2,-0.3 15,-0.3 -1,-0.3 -0.910 55.2-156.4-131.7 161.5 27.6 -9.6 29.2 44 52 A R E - D 0 57A 0 13,-2.7 13,-2.9 -2,-0.3 2,-0.6 -0.962 21.6-120.8-134.8 149.8 26.6 -8.1 25.9 45 53 A W E -CD 29 56A 4 -16,-0.6 -16,-2.4 -2,-0.3 2,-0.4 -0.840 35.5-171.2 -83.8 121.7 27.6 -5.2 23.6 46 54 A V E -CD 28 55A 0 9,-2.6 9,-1.9 -2,-0.6 2,-0.6 -0.959 18.6-149.9-114.9 137.6 24.7 -2.9 23.2 47 55 A M E -CD 27 54A 6 -20,-2.6 -20,-2.0 -2,-0.4 7,-0.2 -0.942 26.6-136.7 -99.0 114.9 24.5 0.0 20.7 48 56 A W E > -C 26 0A 18 5,-2.6 4,-0.9 -2,-0.6 -22,-0.3 -0.459 9.5-127.2 -72.1 141.7 22.3 2.6 22.3 49 57 A F T 4 S+ 0 0 2 -24,-2.2 2,-0.8 2,-0.1 37,-0.3 -0.467 89.3 46.1 -77.2 162.9 19.7 4.4 20.2 50 58 A G T 4 S+ 0 0 5 615,-0.4 -1,-0.1 35,-0.3 33,-0.1 -0.603 133.3 10.5 100.5 -70.4 19.8 8.2 20.4 51 59 A D T 4 S- 0 0 55 -2,-0.8 -2,-0.1 2,-0.1 -1,-0.1 0.429 95.2-122.8-122.9 -5.4 23.5 8.7 19.9 52 60 A G < + 0 0 3 -4,-0.9 -3,-0.1 1,-0.2 -2,-0.1 0.670 49.7 161.2 73.8 19.4 24.8 5.2 18.9 53 61 A K - 0 0 129 -4,-0.1 -5,-2.6 -6,-0.1 2,-0.4 -0.310 32.9-129.0 -67.7 155.3 27.3 4.8 21.7 54 62 A F E +D 47 0A 44 -7,-0.2 2,-0.3 -20,-0.1 -7,-0.2 -0.874 29.1 171.3-109.1 141.5 28.6 1.3 22.6 55 63 A S E -D 46 0A 27 -9,-1.9 -9,-2.6 -2,-0.4 2,-0.5 -0.995 34.4-125.4-147.1 143.2 28.6 -0.3 26.1 56 64 A V E -D 45 0A 62 -2,-0.3 2,-0.4 -11,-0.2 -11,-0.2 -0.789 38.5-177.2 -80.4 124.7 29.3 -3.7 27.7 57 65 A V E -D 44 0A 4 -13,-2.9 -13,-2.7 -2,-0.5 2,-0.1 -0.996 26.1-121.8-131.5 130.6 26.2 -4.5 29.8 58 66 A C E > -D 43 0A 61 -2,-0.4 3,-2.2 -15,-0.3 -15,-0.3 -0.404 27.1-119.8 -63.8 145.2 25.6 -7.5 32.1 59 67 A V G > S+ 0 0 11 -17,-2.3 3,-1.6 1,-0.3 -1,-0.1 0.764 112.4 67.7 -60.8 -25.8 22.5 -9.5 31.2 60 68 A E G 3 S+ 0 0 123 -18,-0.3 -1,-0.3 1,-0.3 -17,-0.1 0.654 100.7 49.3 -65.8 -18.2 21.1 -8.7 34.7 61 69 A K G < S+ 0 0 97 -3,-2.2 -44,-2.2 2,-0.0 2,-0.4 0.007 99.6 89.5-109.8 24.6 20.9 -5.1 33.5 62 70 A L E < +B 16 0A 10 -3,-1.6 -46,-0.2 -46,-0.2 -54,-0.0 -0.964 46.9 176.0-122.1 140.1 19.1 -6.1 30.3 63 71 A M E -B 15 0A 40 -48,-2.2 -48,-3.3 -2,-0.4 -3,-0.0 -0.980 36.3-105.5-132.8 147.7 15.4 -6.5 29.5 64 72 A P E > -B 14 0A 48 0, 0.0 3,-1.8 0, 0.0 -50,-0.3 -0.301 35.5-109.0 -64.2 158.8 13.7 -7.2 26.2 65 73 A L G > S+ 0 0 3 -52,-1.9 3,-0.7 1,-0.3 6,-0.1 0.841 115.6 72.6 -57.0 -34.0 11.9 -4.3 24.5 66 74 A S G 3 S+ 0 0 48 1,-0.3 3,-0.5 -53,-0.2 -1,-0.3 0.674 79.4 73.4 -56.2 -22.0 8.6 -6.0 25.3 67 75 A S G X> + 0 0 37 -3,-1.8 4,-1.6 1,-0.2 3,-0.8 -0.023 64.1 131.7 -80.3 31.8 9.2 -5.0 29.0 68 76 A F H <> + 0 0 1 -3,-0.7 4,-3.1 1,-0.2 -1,-0.2 0.853 61.7 54.8 -52.2 -47.1 8.3 -1.5 27.8 69 77 A C H 34 S+ 0 0 88 -3,-0.5 -1,-0.2 1,-0.2 -2,-0.1 0.784 111.8 44.5 -64.8 -29.8 5.7 -0.8 30.5 70 78 A S H <4 S+ 0 0 103 -3,-0.8 -1,-0.2 1,-0.1 -2,-0.2 0.788 122.3 36.2 -80.5 -31.4 8.3 -1.5 33.3 71 79 A A H < S+ 0 0 5 -4,-1.6 -48,-0.3 -6,-0.1 -2,-0.2 0.818 87.8 100.7 -95.9 -36.3 11.2 0.4 31.7 72 80 A F < - 0 0 30 -4,-3.1 2,-0.6 -5,-0.2 -48,-0.1 -0.331 54.6-161.8 -59.4 125.4 9.5 3.4 30.1 73 81 A H > - 0 0 98 -50,-0.2 4,-2.0 1,-0.1 3,-0.2 -0.939 10.8-164.0-118.3 109.1 10.0 6.5 32.3 74 82 A Q H > S+ 0 0 106 -2,-0.6 4,-2.2 1,-0.2 5,-0.2 0.857 89.2 55.9 -59.3 -41.2 7.7 9.4 31.5 75 83 A A H > S+ 0 0 37 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.903 109.1 46.9 -60.0 -44.1 9.8 12.0 33.5 76 84 A T H > S+ 0 0 9 1,-0.2 4,-2.2 2,-0.2 7,-0.2 0.909 109.6 54.7 -63.2 -44.3 12.8 11.2 31.4 77 85 A Y H < S+ 0 0 16 -4,-2.0 7,-0.2 1,-0.2 -2,-0.2 0.895 109.1 48.0 -56.0 -44.9 10.8 11.4 28.2 78 86 A N H < S+ 0 0 94 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.862 120.8 34.3 -63.4 -38.8 9.6 14.9 29.1 79 87 A K H < S+ 0 0 165 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.638 108.8 63.8 -98.4 -18.2 13.0 16.3 30.0 80 88 A Q >X - 0 0 83 -4,-2.2 4,-1.5 -5,-0.1 3,-0.7 -0.901 51.3-170.1-121.3 105.3 15.4 14.6 27.6 81 89 A P H 3> S+ 0 0 33 0, 0.0 4,-1.8 0, 0.0 -1,-0.1 0.793 91.6 57.0 -57.6 -32.3 15.2 15.1 23.7 82 90 A M H 3> S+ 0 0 42 2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.790 103.1 54.2 -72.2 -27.7 17.7 12.3 23.1 83 91 A Y H <> S+ 0 0 0 -3,-0.7 4,-2.5 -7,-0.2 -1,-0.2 0.900 107.9 49.3 -69.0 -42.3 15.4 9.8 25.0 84 92 A R H X S+ 0 0 40 -4,-1.5 4,-2.3 -7,-0.2 -2,-0.2 0.889 112.0 49.7 -61.7 -39.9 12.5 10.8 22.8 85 93 A K H X S+ 0 0 70 -4,-1.8 4,-2.5 2,-0.2 -35,-0.3 0.908 110.7 48.9 -63.0 -45.1 14.8 10.2 19.8 86 94 A A H X S+ 0 0 0 -4,-2.3 4,-2.6 -37,-0.3 5,-0.2 0.890 112.0 48.6 -62.8 -42.1 15.9 6.8 21.2 87 95 A I H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 5,-0.2 0.929 111.8 50.4 -60.4 -48.1 12.2 5.8 21.7 88 96 A Y H X S+ 0 0 24 -4,-2.3 4,-1.6 1,-0.2 -2,-0.2 0.918 113.7 44.9 -54.9 -49.2 11.4 7.0 18.2 89 97 A E H X S+ 0 0 6 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.941 112.8 47.2 -65.5 -50.8 14.3 4.9 16.7 90 98 A V H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.831 115.8 46.2 -64.5 -32.6 13.7 1.6 18.6 91 99 A L H X S+ 0 0 0 -4,-2.0 4,-2.4 -5,-0.2 -1,-0.2 0.757 108.1 55.5 -82.6 -27.3 10.0 1.7 17.9 92 100 A Q H X S+ 0 0 27 -4,-1.6 4,-1.5 -5,-0.2 -2,-0.2 0.917 113.9 42.0 -64.2 -44.9 10.5 2.5 14.2 93 101 A V H X S+ 0 0 0 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.921 115.8 49.4 -67.0 -45.8 12.8 -0.6 14.0 94 102 A A H X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.897 110.8 48.9 -59.9 -44.9 10.3 -2.7 16.1 95 103 A S H X>S+ 0 0 8 -4,-2.4 5,-2.0 1,-0.2 4,-1.0 0.826 108.0 55.1 -67.8 -32.8 7.3 -1.7 14.0 96 104 A S H <5S+ 0 0 41 -4,-1.5 -1,-0.2 2,-0.2 -2,-0.2 0.899 110.4 45.5 -63.5 -43.9 9.1 -2.5 10.8 97 105 A R H <5S+ 0 0 37 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.868 116.2 45.3 -65.7 -40.1 9.8 -6.0 12.1 98 106 A A H <5S- 0 0 25 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.612 107.8-123.1 -80.7 -13.9 6.3 -6.6 13.3 99 107 A G T <5 + 0 0 52 -4,-1.0 2,-0.7 1,-0.3 -3,-0.2 0.742 57.0 155.1 71.7 25.0 4.7 -5.2 10.2 100 108 A K < - 0 0 66 -5,-2.0 2,-0.3 -6,-0.2 -1,-0.3 -0.777 26.6-159.4 -87.7 116.9 2.8 -2.6 12.3 101 109 A L - 0 0 112 -2,-0.7 -5,-0.0 -3,-0.1 0, 0.0 -0.764 8.5-162.9-101.3 141.3 2.0 0.5 10.1 102 110 A F 0 0 60 -2,-0.3 7,-0.0 1,-0.1 11,-0.0 -0.948 360.0 360.0-119.5 144.1 1.2 4.0 11.3 103 111 A P 0 0 181 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.018 360.0 360.0 -43.7 360.0 -0.5 6.7 9.2 104 ! 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 0.0 105 124 A A > 0 0 96 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -39.1 7.8 15.8 14.5 106 125 A V H > + 0 0 52 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.926 360.0 50.1 -68.5 -46.6 9.4 13.1 16.8 107 126 A E H > S+ 0 0 101 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.858 113.2 47.8 -58.8 -38.8 7.0 13.9 19.6 108 127 A V H >4 S+ 0 0 106 1,-0.2 3,-0.9 2,-0.2 -2,-0.2 0.975 114.3 42.0 -67.3 -58.2 4.0 13.6 17.2 109 128 A Q H 3X S+ 0 0 69 -4,-2.1 4,-0.9 1,-0.2 -2,-0.2 0.755 107.2 65.0 -64.7 -26.8 4.9 10.3 15.5 110 129 A N H 3X S+ 0 0 0 -4,-2.0 4,-3.2 1,-0.2 5,-0.3 0.829 86.6 71.2 -62.4 -36.4 5.9 8.8 18.9 111 130 A K H S+ 0 0 55 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.865 118.0 50.9 -65.3 -33.4 0.8 6.1 18.3 113 132 A M H X S+ 0 0 3 -4,-0.9 4,-2.2 2,-0.2 -2,-0.2 0.877 110.5 47.4 -70.1 -39.8 4.0 4.1 18.5 114 133 A I H X S+ 0 0 20 -4,-3.2 4,-3.1 2,-0.2 5,-0.2 0.920 111.5 51.2 -65.8 -44.4 4.1 4.4 22.3 115 134 A E H X S+ 0 0 142 -4,-2.2 4,-2.2 -5,-0.3 -2,-0.2 0.894 108.9 52.1 -57.3 -43.4 0.4 3.5 22.6 116 135 A W H <>S+ 0 0 12 -4,-2.0 5,-2.2 2,-0.2 6,-0.5 0.947 112.3 45.2 -55.7 -52.1 1.2 0.4 20.4 117 136 A A H ><5S+ 0 0 3 -4,-2.2 3,-1.4 1,-0.2 -2,-0.2 0.912 113.6 49.1 -57.9 -47.4 4.0 -0.5 22.8 118 137 A L H 3<5S+ 0 0 87 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.820 105.4 58.7 -64.6 -32.8 1.9 0.1 25.9 119 138 A G T 3<5S- 0 0 49 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.325 129.2 -90.9 -82.3 7.4 -1.0 -2.0 24.5 120 139 A G T < 5 - 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