==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 15-MAY-08 2VTT . COMPND 2 MOLECULE: CELL DIVISION PROTEIN KINASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR P.G.WYATT,A.J.WOODHEAD,J.A.BOULSTRIDGE,V.BERDINI,M.G.CARR,D. . 272 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14278.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 169 62.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 37 13.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 18 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 73 26.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 2 1 0 1 1 0 1 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 1 1 0 1 3 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 1 1 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 M > 0 0 57 0, 0.0 3,-3.1 0, 0.0 59,-0.0 0.000 360.0 360.0 360.0 121.7 13.8 6.0 75.3 2 2 A E T 3 + 0 0 152 1,-0.3 0, 0.0 3,-0.0 0, 0.0 0.821 360.0 47.6 -37.2 -46.3 13.3 4.5 78.8 3 3 A N T 3 S+ 0 0 57 20,-0.1 21,-2.2 21,-0.0 2,-0.4 0.406 103.6 75.9 -85.2 2.0 16.0 1.8 78.2 4 4 A F E < -A 23 0A 19 -3,-3.1 2,-0.6 19,-0.2 19,-0.2 -0.935 58.0-156.7-125.6 139.4 18.6 4.2 76.9 5 5 A Q E -A 22 0A 84 17,-1.9 17,-2.6 -2,-0.4 2,-0.2 -0.947 25.1-132.4-109.1 117.0 20.9 6.8 78.5 6 6 A K E +A 21 0A 105 -2,-0.6 15,-0.2 15,-0.2 3,-0.1 -0.476 26.9 174.8 -70.5 135.4 22.2 9.5 76.1 7 7 A V E - 0 0 54 13,-3.0 2,-0.3 1,-0.4 14,-0.2 0.799 59.8 -34.5-106.9 -45.0 25.9 10.2 76.2 8 8 A E E -A 20 0A 109 12,-1.4 12,-3.0 0, 0.0 2,-0.5 -0.944 59.3 -93.5-174.0 153.2 26.4 12.6 73.4 9 9 A K E +A 19 0A 131 -2,-0.3 10,-0.3 10,-0.2 3,-0.1 -0.660 40.9 166.3 -77.4 124.4 25.3 13.7 69.9 10 10 A I E + 0 0 67 8,-2.5 2,-0.3 -2,-0.5 9,-0.2 0.327 60.3 22.2-117.7 0.0 27.5 12.0 67.3 11 11 A G E +A 18 0A 22 7,-1.4 7,-3.4 2,-0.0 -1,-0.3 -0.944 52.1 169.7-173.5 135.8 25.5 12.6 64.2 12 12 A E + 0 0 165 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.838 21.8 117.1-137.6-176.1 22.9 14.7 62.6 13 13 A G - 0 0 46 1,-0.3 -2,-0.0 -2,-0.3 0, 0.0 -0.970 64.8 -19.1 149.5-164.4 21.5 15.2 59.2 14 14 A T S S+ 0 0 123 -2,-0.3 -1,-0.3 1,-0.1 0, 0.0 0.879 123.1 3.1 -36.0 -91.9 18.5 14.9 57.0 15 15 A Y S S+ 0 0 202 -3,-0.1 2,-0.1 20,-0.0 -2,-0.1 0.950 121.9 25.6 -77.1 -55.2 16.0 12.6 58.7 16 16 A G - 0 0 7 19,-0.1 2,-0.4 -4,-0.1 19,-0.2 -0.429 61.6-127.7-109.6 173.9 17.3 11.5 62.1 17 17 A V E - B 0 34A 37 17,-1.5 17,-3.2 -5,-0.2 2,-0.5 -0.955 26.1-146.0-114.0 141.6 19.7 12.6 64.9 18 18 A V E -AB 11 33A 32 -7,-3.4 -8,-2.5 -2,-0.4 -7,-1.4 -0.952 17.0-176.6-111.7 128.2 22.3 10.1 66.1 19 19 A Y E -AB 9 32A 44 13,-2.6 13,-3.1 -2,-0.5 2,-0.4 -0.920 31.4-124.6-115.4 149.6 23.5 9.7 69.6 20 20 A K E +AB 8 31A 43 -12,-3.0 -13,-3.0 -2,-0.4 -12,-1.4 -0.763 50.2 174.0 -75.4 134.1 26.1 7.7 71.4 21 21 A A E -AB 6 30A 0 9,-3.0 9,-3.3 -2,-0.4 2,-0.5 -0.960 31.8-130.6-146.3 162.1 24.0 6.0 74.1 22 22 A R E -AB 5 29A 97 -17,-2.6 -17,-1.9 -2,-0.3 7,-0.2 -0.963 21.0-132.1-121.6 118.3 24.2 3.4 76.9 23 23 A N E > -A 4 0A 22 5,-2.9 4,-0.8 -2,-0.5 -19,-0.2 -0.411 16.6-140.6 -64.9 141.8 21.6 0.5 77.3 24 24 A K T 4 S+ 0 0 133 -21,-2.2 -1,-0.1 2,-0.2 -20,-0.1 0.688 91.5 27.7 -88.3 -17.3 20.5 0.3 80.9 25 25 A L T 4 S+ 0 0 138 -22,-0.3 -1,-0.1 3,-0.1 -2,-0.0 0.705 127.7 39.3-111.9 -29.7 20.2 -3.5 81.5 26 26 A T T 4 S- 0 0 79 2,-0.1 -2,-0.2 1,-0.0 3,-0.1 0.692 91.8-137.6 -91.5 -16.6 22.8 -4.8 79.0 27 27 A G < + 0 0 50 -4,-0.8 -3,-0.1 1,-0.3 -1,-0.0 0.334 48.8 157.3 73.0 -4.2 25.4 -2.0 79.6 28 28 A E - 0 0 88 -6,-0.1 -5,-2.9 1,-0.1 2,-0.5 -0.182 41.0-138.7 -54.4 134.0 25.9 -2.0 75.9 29 29 A V E +B 22 0A 60 -7,-0.2 43,-0.7 -3,-0.1 2,-0.3 -0.881 38.9 167.3 -92.8 129.3 27.3 1.2 74.3 30 30 A V E -BC 21 71A 0 -9,-3.3 -9,-3.0 -2,-0.5 2,-0.5 -0.852 43.1-113.7-139.6 162.2 25.3 1.9 71.1 31 31 A A E -BC 20 70A 13 39,-2.1 39,-3.5 -2,-0.3 2,-0.6 -0.949 33.7-160.3 -95.9 126.5 24.6 4.4 68.4 32 32 A L E -BC 19 69A 1 -13,-3.1 -13,-2.6 -2,-0.5 2,-0.6 -0.950 3.5-161.6-113.1 112.3 20.9 5.4 68.6 33 33 A K E -BC 18 68A 30 35,-3.0 35,-2.5 -2,-0.6 2,-0.5 -0.876 8.8-156.4 -90.8 122.5 19.3 7.0 65.5 34 34 A K E BC 17 67A 45 -17,-3.2 -17,-1.5 -2,-0.6 33,-0.2 -0.892 360.0 360.0-100.2 126.0 16.1 8.9 66.3 35 35 A I 0 0 84 31,-3.1 31,-1.9 -2,-0.5 -19,-0.1 -0.905 360.0 360.0-114.7 360.0 13.5 9.4 63.5 36 ! 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 37 47 A T > 0 0 132 0, 0.0 4,-2.2 0, 0.0 3,-0.5 0.000 360.0 360.0 360.0 -48.6 6.3 0.5 54.2 38 48 A A H > + 0 0 64 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.933 360.0 48.8 -51.0 -50.8 9.1 2.0 56.3 39 49 A I H > S+ 0 0 86 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.785 111.7 49.5 -64.6 -28.3 8.6 -0.4 59.1 40 50 A R H > S+ 0 0 179 -3,-0.5 4,-0.9 2,-0.2 -1,-0.2 0.855 114.2 43.4 -80.8 -32.1 8.6 -3.4 56.8 41 51 A E H X S+ 0 0 112 -4,-2.2 4,-1.2 2,-0.2 -2,-0.2 0.808 111.4 54.7 -82.9 -29.5 11.8 -2.4 55.0 42 52 A I H >X S+ 0 0 16 -4,-2.5 3,-1.0 -5,-0.3 4,-0.9 0.966 105.5 52.4 -66.1 -46.6 13.6 -1.5 58.2 43 53 A S H 3< S+ 0 0 40 -4,-1.5 3,-0.4 1,-0.3 4,-0.3 0.796 103.4 58.3 -62.9 -29.9 12.9 -4.9 59.7 44 54 A L H >X S+ 0 0 94 -4,-0.9 3,-1.7 1,-0.2 4,-0.7 0.861 98.1 60.0 -62.6 -34.1 14.4 -6.4 56.5 45 55 A L H X< S+ 0 0 27 -4,-1.2 3,-0.5 -3,-1.0 11,-0.3 0.782 92.3 69.0 -63.0 -28.4 17.6 -4.5 57.4 46 56 A K T 3< S+ 0 0 62 -4,-0.9 -1,-0.3 -3,-0.4 -2,-0.2 0.709 102.7 43.6 -58.9 -26.3 17.6 -6.4 60.6 47 57 A E T <4 S+ 0 0 155 -3,-1.7 2,-2.1 -4,-0.3 -1,-0.2 0.571 86.0 95.3 -99.6 -5.7 18.4 -9.5 58.6 48 58 A L << + 0 0 14 -4,-0.7 2,-0.5 -3,-0.5 8,-0.2 -0.476 58.6 166.4 -83.6 72.5 21.0 -7.9 56.4 49 59 A N + 0 0 77 -2,-2.1 5,-0.1 6,-0.1 6,-0.1 -0.790 4.4 142.7-101.0 127.9 24.0 -9.0 58.6 50 60 A H > - 0 0 46 -2,-0.5 3,-2.0 3,-0.4 54,-0.0 -0.982 57.4-114.1-157.3 149.5 27.6 -8.8 57.4 51 61 A P T 3 S+ 0 0 88 0, 0.0 4,-0.1 0, 0.0 53,-0.0 0.756 118.4 48.3 -63.2 -18.4 31.0 -8.0 58.9 52 62 A N T 3 S+ 0 0 11 80,-0.1 81,-2.9 48,-0.1 2,-0.4 0.108 98.4 79.8-108.5 24.0 31.2 -4.9 56.7 53 63 A I B < S-e 133 0B 7 -3,-2.0 -3,-0.4 79,-0.3 81,-0.2 -0.998 91.1-110.8-125.8 122.7 27.7 -3.6 57.5 54 64 A V - 0 0 9 79,-3.1 2,-0.4 -2,-0.4 -2,-0.1 -0.317 44.5-112.0 -53.9 135.3 27.1 -1.8 60.8 55 65 A K - 0 0 85 -4,-0.1 16,-2.1 -2,-0.1 2,-0.8 -0.469 17.1-142.5 -86.1 119.9 25.0 -4.1 62.7 56 66 A L E +D 70 0A 8 -2,-0.4 14,-0.2 -11,-0.3 3,-0.1 -0.736 21.5 179.4 -75.2 109.9 21.4 -3.1 63.4 57 67 A L E - 0 0 32 12,-2.3 2,-0.3 -2,-0.8 13,-0.2 0.914 58.9 -11.0 -80.5 -37.3 20.9 -4.4 67.0 58 68 A D E -D 69 0A 84 11,-1.6 11,-3.0 2,-0.0 2,-0.4 -0.989 47.0-143.3-162.6 157.7 17.3 -3.3 67.4 59 69 A V E -D 68 0A 37 -2,-0.3 2,-0.6 9,-0.2 9,-0.2 -0.994 16.8-168.2-131.8 116.3 14.3 -1.3 66.1 60 70 A I E -D 67 0A 40 7,-2.8 7,-2.7 -2,-0.4 2,-0.6 -0.935 2.2-172.5-110.3 109.7 12.0 0.4 68.6 61 71 A H E +D 66 0A 116 -2,-0.6 2,-0.3 5,-0.2 5,-0.2 -0.911 28.8 141.5 -98.1 117.0 8.8 1.8 67.2 62 72 A T E > -D 65 0A 45 3,-2.4 3,-3.9 -2,-0.6 -2,-0.1 -0.992 56.8 -5.2-157.6 148.0 7.0 3.8 70.0 63 73 A E T 3 S- 0 0 168 1,-0.3 3,-0.1 -2,-0.3 -2,-0.0 0.704 124.2 -55.6 35.7 38.8 4.9 7.0 70.5 64 74 A N T 3 S+ 0 0 156 1,-0.3 2,-0.4 0, 0.0 -1,-0.3 0.745 117.4 111.5 67.6 20.7 5.3 8.1 66.8 65 75 A K E < - D 0 62A 98 -3,-3.9 -3,-2.4 2,-0.0 2,-0.5 -0.939 55.3-152.5-114.8 148.7 9.1 7.9 67.1 66 76 A L E - D 0 61A 34 -31,-1.9 -31,-3.1 -2,-0.4 2,-0.5 -0.990 11.9-169.9-117.4 118.4 11.3 5.4 65.4 67 77 A Y E -CD 34 60A 17 -7,-2.7 -7,-2.8 -2,-0.5 2,-0.5 -0.954 6.1-162.2-105.9 127.7 14.6 4.5 67.1 68 78 A L E -CD 33 59A 9 -35,-2.5 -35,-3.0 -2,-0.5 2,-0.6 -0.934 9.1-154.2-103.7 124.5 17.2 2.4 65.3 69 79 A V E -CD 32 58A 2 -11,-3.0 -12,-2.3 -2,-0.5 -11,-1.6 -0.881 19.4-179.4-101.4 120.8 19.8 0.9 67.7 70 80 A F E -CD 31 56A 33 -39,-3.5 -39,-2.1 -2,-0.6 -14,-0.2 -0.805 37.0 -95.2-116.3 158.9 23.2 0.2 66.0 71 81 A E E -C 30 0A 46 -16,-2.1 2,-0.4 -2,-0.3 -41,-0.2 -0.408 51.9-117.0 -61.2 142.0 26.6 -1.2 67.1 72 82 A F - 0 0 36 -43,-0.7 2,-0.4 -42,-0.1 -1,-0.1 -0.748 30.6-172.7 -89.4 130.4 28.8 1.7 68.0 73 83 A L - 0 0 15 -2,-0.4 53,-0.1 1,-0.1 52,-0.0 -0.988 19.2-141.4-117.8 150.8 32.0 2.4 66.1 74 84 A H S S+ 0 0 101 -2,-0.4 2,-0.3 51,-0.2 52,-0.1 0.688 75.0 32.5 -85.2 -22.8 34.4 5.1 67.2 75 85 A Q E -F 125 0B 40 50,-1.5 50,-2.7 199,-0.0 2,-0.3 -0.908 59.3-151.5-134.0 155.9 35.5 6.7 64.0 76 86 A D E > -F 124 0B 17 -2,-0.3 4,-2.1 48,-0.3 48,-0.2 -0.899 31.0-114.2-122.8 160.1 34.2 7.5 60.5 77 87 A L H > S+ 0 0 0 46,-2.7 4,-2.5 43,-1.0 44,-0.2 0.771 111.1 58.0 -64.6 -33.1 36.1 7.7 57.2 78 88 A K H > S+ 0 0 70 42,-1.0 4,-2.5 45,-0.3 -1,-0.2 0.968 111.2 41.5 -61.3 -51.3 35.5 11.4 56.7 79 89 A K H > S+ 0 0 109 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.900 115.1 52.2 -60.7 -41.0 37.1 12.4 60.1 80 90 A F H X S+ 0 0 12 -4,-2.1 4,-1.2 2,-0.2 -1,-0.2 0.897 109.6 49.1 -63.8 -42.4 39.9 9.8 59.5 81 91 A M H < S+ 0 0 20 -4,-2.5 3,-0.3 2,-0.2 -2,-0.2 0.912 111.6 48.6 -59.1 -47.7 40.6 11.3 56.0 82 92 A D H >< S+ 0 0 100 -4,-2.5 3,-1.4 1,-0.2 4,-0.2 0.937 112.1 49.6 -58.3 -48.2 40.7 14.9 57.5 83 93 A A H 3< S+ 0 0 80 -4,-2.6 3,-0.3 1,-0.2 -1,-0.2 0.762 114.2 46.0 -62.5 -20.6 43.0 13.6 60.3 84 94 A S T 3X S+ 0 0 16 -4,-1.2 4,-4.0 -3,-0.3 3,-0.4 0.201 79.8 107.5-105.8 8.5 45.3 11.9 57.6 85 95 A A T <4 S+ 0 0 43 -3,-1.4 -1,-0.2 1,-0.2 -2,-0.1 0.814 75.0 52.4 -62.0 -33.0 45.4 14.9 55.2 86 96 A L T 4 S+ 0 0 168 -3,-0.3 -1,-0.2 -4,-0.2 -2,-0.1 0.840 129.8 17.2 -75.1 -27.3 49.1 15.9 55.9 87 97 A T T 4 S- 0 0 113 -3,-0.4 -2,-0.2 -4,-0.1 -1,-0.1 0.759 102.0-131.9-113.6 -36.8 50.4 12.4 55.3 88 98 A G < - 0 0 14 -4,-4.0 -3,-0.1 -7,-0.2 85,-0.1 0.217 35.2 -69.8 86.5 141.5 47.6 10.6 53.4 89 99 A I - 0 0 14 83,-0.5 5,-0.1 1,-0.1 -8,-0.0 -0.449 61.2-105.0 -58.2 131.3 46.2 7.1 54.2 90 100 A P >> - 0 0 80 0, 0.0 4,-2.3 0, 0.0 3,-0.8 -0.318 27.7-119.3 -64.2 146.4 48.8 4.5 53.4 91 101 A L H 3> S+ 0 0 70 1,-0.3 4,-3.3 2,-0.2 5,-0.2 0.852 112.2 54.7 -56.0 -42.4 48.0 2.6 50.2 92 102 A P H 3> S+ 0 0 66 0, 0.0 4,-2.2 0, 0.0 174,-0.4 0.897 111.0 47.3 -66.3 -29.5 47.7 -0.8 51.8 93 103 A L H <> S+ 0 0 7 -3,-0.8 4,-2.5 2,-0.2 5,-0.2 0.917 111.9 49.7 -69.1 -42.5 45.1 0.7 54.2 94 104 A I H X S+ 0 0 5 -4,-2.3 4,-2.4 1,-0.2 5,-0.2 0.929 112.5 48.5 -55.4 -51.3 43.3 2.3 51.3 95 105 A K H X S+ 0 0 12 -4,-3.3 4,-2.2 1,-0.2 -2,-0.2 0.902 110.9 49.5 -59.8 -41.6 43.3 -1.0 49.5 96 106 A S H X S+ 0 0 4 -4,-2.2 4,-2.6 -5,-0.2 -1,-0.2 0.910 112.3 47.5 -63.3 -46.4 42.0 -2.9 52.5 97 107 A Y H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 5,-0.2 0.915 112.5 49.5 -61.1 -42.2 39.2 -0.5 53.1 98 108 A L H X S+ 0 0 0 -4,-2.4 4,-2.3 -5,-0.2 -2,-0.2 0.918 112.4 47.7 -64.6 -45.6 38.2 -0.5 49.4 99 109 A F H X S+ 0 0 48 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.935 111.9 50.2 -60.1 -45.7 38.2 -4.4 49.4 100 110 A Q H X S+ 0 0 13 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.890 111.1 47.8 -61.2 -41.2 36.1 -4.6 52.6 101 111 A L H X S+ 0 0 1 -4,-2.1 4,-2.8 2,-0.2 -1,-0.2 0.878 109.0 54.2 -72.4 -39.0 33.5 -2.2 51.3 102 112 A L H X S+ 0 0 0 -4,-2.3 4,-2.9 2,-0.2 -2,-0.2 0.909 107.9 50.4 -54.8 -42.0 33.3 -4.1 48.0 103 113 A Q H X S+ 0 0 70 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.951 111.1 49.6 -60.9 -44.9 32.6 -7.3 50.1 104 114 A G H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.913 114.7 42.9 -59.6 -45.3 29.9 -5.4 51.9 105 115 A L H X S+ 0 0 0 -4,-2.8 4,-3.3 2,-0.2 5,-0.3 0.878 108.0 58.6 -70.7 -40.5 28.3 -4.1 48.7 106 116 A A H X S+ 0 0 23 -4,-2.9 4,-2.0 -5,-0.2 -1,-0.2 0.928 110.9 45.8 -53.6 -41.1 28.7 -7.6 47.0 107 117 A F H X S+ 0 0 47 -4,-2.1 4,-1.6 -5,-0.2 -2,-0.2 0.978 114.9 43.9 -63.8 -59.2 26.6 -8.9 49.9 108 118 A C H <>S+ 0 0 0 -4,-2.4 5,-3.0 1,-0.2 3,-0.4 0.925 115.5 49.6 -46.9 -57.2 23.9 -6.1 49.8 109 119 A H H ><5S+ 0 0 13 -4,-3.3 3,-2.2 1,-0.2 -1,-0.2 0.871 104.2 56.4 -55.6 -44.9 23.7 -6.2 46.1 110 120 A S H 3<5S+ 0 0 78 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.845 109.1 49.5 -57.7 -32.1 23.3 -10.0 46.0 111 121 A H T 3<5S- 0 0 103 -4,-1.6 -1,-0.3 -3,-0.4 -2,-0.2 0.247 121.4-111.9 -90.4 15.9 20.2 -9.5 48.2 112 122 A R T < 5S+ 0 0 176 -3,-2.2 2,-0.5 1,-0.2 -3,-0.2 0.739 73.3 139.2 60.9 24.3 18.9 -6.8 45.9 113 123 A V < - 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