==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 12-JUN-12 4AXC . COMPND 2 MOLECULE: INOSITOL-PENTAKISPHOSPHATE 2-KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ARABIDOPSIS THALIANA; . AUTHOR J.I BANOS-SANZ,J.SANZ-APARICIO,B.GONZALEZ . 394 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20286.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 269 68.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 57 14.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 20 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 49 12.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 131 33.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.5 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 0 0 1 0 1 1 3 0 1 1 0 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 0 1 3 4 0 0 0 1 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 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 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 3 A M 0 0 140 0, 0.0 93,-0.4 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 124.0 -4.4 5.1 -7.0 2 4 A I - 0 0 74 91,-0.1 2,-0.3 2,-0.0 93,-0.2 -0.889 360.0-143.7-151.1 121.2 -4.3 1.3 -7.6 3 5 A L B +a 95 0A 3 91,-2.0 93,-1.7 -2,-0.3 96,-0.3 -0.676 29.6 165.6 -83.7 141.8 -7.2 -1.0 -7.0 4 6 A E >> - 0 0 96 -2,-0.3 3,-2.0 91,-0.1 4,-0.8 -0.868 48.2 -62.0-147.9-171.3 -6.5 -4.5 -5.7 5 7 A E T 34 S+ 0 0 107 1,-0.3 4,-0.4 -2,-0.2 3,-0.2 0.661 124.5 46.8 -51.7 -35.6 -8.0 -7.6 -4.1 6 8 A K T >4 S+ 0 0 162 1,-0.2 3,-0.6 2,-0.2 -1,-0.3 0.772 108.7 57.4 -79.9 -25.0 -9.3 -6.2 -0.9 7 9 A D G X4 S+ 0 0 55 -3,-2.0 3,-1.6 1,-0.2 -1,-0.2 0.699 91.1 72.4 -71.4 -23.5 -10.9 -3.3 -2.8 8 10 A A G >< S+ 0 0 8 -4,-0.8 3,-1.1 1,-0.3 -1,-0.2 0.724 85.2 65.3 -67.3 -22.6 -12.8 -5.9 -4.9 9 11 A S G < S+ 0 0 102 -3,-0.6 -1,-0.3 -4,-0.4 -2,-0.2 0.664 93.7 65.4 -71.6 -12.5 -15.1 -6.6 -1.9 10 12 A D G < S+ 0 0 49 -3,-1.6 16,-3.7 -4,-0.1 17,-1.1 0.376 91.9 72.0 -84.9 -1.8 -16.2 -2.9 -2.3 11 13 A W E < -B 25 0B 5 -3,-1.1 2,-0.3 14,-0.2 14,-0.2 -0.970 60.0-161.5-126.4 131.3 -17.9 -3.4 -5.7 12 14 A I E -B 24 0B 93 12,-2.5 12,-2.9 -2,-0.4 95,-0.0 -0.870 33.7 -96.6-109.0 146.7 -21.2 -5.1 -6.7 13 15 A Y E +B 23 0B 39 -2,-0.3 10,-0.2 10,-0.2 3,-0.1 -0.262 44.2 165.8 -53.7 132.3 -22.3 -6.4 -10.1 14 16 A R E - 0 0 84 8,-2.7 2,-0.3 1,-0.4 9,-0.2 0.719 51.8 -59.9-115.8 -51.8 -24.6 -3.9 -11.8 15 17 A G E -B 22 0B 20 7,-1.7 7,-2.7 96,-0.0 -1,-0.4 -0.962 42.6-142.3-175.4-176.9 -24.8 -4.9 -15.4 16 18 A E E -B 21 0B 32 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.972 5.1-154.5-162.1 156.2 -23.0 -5.5 -18.7 17 19 A G - 0 0 35 3,-2.2 5,-0.0 -2,-0.3 -2,-0.0 -0.380 56.2 -77.0-106.4-162.3 -23.0 -5.2 -22.5 18 20 A G S S+ 0 0 66 -2,-0.2 101,-0.2 1,-0.2 3,-0.1 0.846 128.6 25.7 -66.8 -35.4 -21.1 -7.4 -25.0 19 21 A A S S+ 0 0 62 1,-0.1 22,-2.9 21,-0.1 2,-0.3 0.677 118.8 46.0-104.0 -26.1 -17.7 -5.7 -24.4 20 22 A N E - C 0 40B 44 20,-0.2 -3,-2.2 101,-0.1 2,-0.3 -0.961 55.7-147.6-131.5 143.7 -17.9 -4.2 -20.8 21 23 A L E -BC 16 39B 0 18,-3.1 18,-2.5 -2,-0.3 2,-0.4 -0.779 16.4-154.0 -95.1 147.4 -18.9 -5.1 -17.1 22 24 A V E -BC 15 38B 37 -7,-2.7 -8,-2.7 -2,-0.3 -7,-1.7 -0.992 11.6-177.1-125.8 125.5 -20.3 -2.4 -14.8 23 25 A L E -BC 13 37B 2 14,-2.3 14,-2.9 -2,-0.4 2,-0.3 -0.962 17.1-138.8-118.8 142.6 -19.9 -2.7 -11.0 24 26 A A E -BC 12 36B 5 -12,-2.9 -12,-2.5 -2,-0.4 2,-0.4 -0.708 27.6-100.8 -97.3 152.1 -21.4 -0.2 -8.5 25 27 A Y E +B 11 0B 35 10,-2.1 -14,-0.2 -2,-0.3 9,-0.2 -0.554 38.7 170.0 -72.5 126.0 -19.6 1.1 -5.4 26 28 A A + 0 0 61 -16,-3.7 -15,-0.2 -2,-0.4 -1,-0.2 0.520 51.8 90.6-108.4 -9.1 -20.8 -0.6 -2.2 27 29 A G S S- 0 0 26 -17,-1.1 -20,-0.0 -20,-0.1 -2,-0.0 0.385 77.7-117.9 -77.6-152.6 -18.1 0.8 0.0 28 30 A S + 0 0 111 5,-0.1 5,-0.1 0, 0.0 -1,-0.1 0.543 61.3 125.6-130.0 -21.1 -17.7 3.8 2.2 29 31 A S >> - 0 0 41 1,-0.2 3,-1.5 3,-0.1 4,-1.2 -0.231 60.0-135.8 -55.2 127.8 -14.8 5.8 0.7 30 32 A P T 34 S+ 0 0 130 0, 0.0 -1,-0.2 0, 0.0 0, 0.0 0.570 101.0 67.9 -63.0 -2.3 -15.7 9.4 -0.1 31 33 A L T 34 S+ 0 0 101 1,-0.1 -2,-0.1 4,-0.0 0, 0.0 0.800 110.7 24.4 -84.9 -31.8 -13.8 8.9 -3.3 32 34 A F T X4 S+ 0 0 14 -3,-1.5 3,-1.5 3,-0.1 -7,-0.3 0.349 80.9 132.8-122.0 -2.2 -16.1 6.4 -5.0 33 35 A V T 3< S+ 0 0 92 -4,-1.2 3,-0.1 1,-0.3 100,-0.1 -0.386 86.0 11.8 -50.3 125.4 -19.4 7.1 -3.3 34 36 A G T 3 S+ 0 0 27 1,-0.2 99,-2.0 -9,-0.2 2,-0.3 0.862 107.2 122.0 66.7 38.8 -21.9 7.4 -6.2 35 37 A K E < - D 0 132B 50 -3,-1.5 -10,-2.1 97,-0.3 2,-0.3 -0.934 45.2-157.5-128.9 152.8 -19.5 5.9 -8.7 36 38 A V E -CD 24 131B 12 95,-2.9 95,-2.1 -2,-0.3 2,-0.4 -0.853 14.2-136.4-120.7 161.3 -19.5 2.9 -11.0 37 39 A I E -CD 23 130B 0 -14,-2.9 -14,-2.3 -2,-0.3 2,-0.6 -0.984 7.5-150.4-123.9 134.5 -16.6 1.0 -12.5 38 40 A R E -CD 22 129B 72 91,-3.1 91,-1.8 -2,-0.4 2,-0.5 -0.902 16.3-171.9-110.1 115.3 -16.4 -0.1 -16.1 39 41 A I E -C 21 0B 2 -18,-2.5 -18,-3.1 -2,-0.6 2,-0.2 -0.906 22.1-121.8-115.3 127.0 -14.3 -3.2 -16.7 40 42 A Q E -C 20 0B 35 -2,-0.5 82,-2.8 87,-0.4 -20,-0.2 -0.400 23.7-141.0 -67.0 131.0 -13.3 -4.6 -20.2 41 43 A K B -F 121 0C 10 -22,-2.9 80,-0.3 80,-0.3 79,-0.1 -0.589 26.5 -99.8 -86.2 154.3 -14.3 -8.2 -20.9 42 44 A A - 0 0 40 78,-2.7 2,-0.3 -2,-0.2 -1,-0.1 -0.406 40.7-158.8 -63.6 146.8 -12.1 -10.7 -22.8 43 45 A R 0 0 219 -2,-0.1 -24,-0.0 76,-0.0 -1,-0.0 -0.916 360.0 360.0-126.9 159.4 -12.8 -11.2 -26.5 44 46 A R 0 0 281 -2,-0.3 -2,-0.0 0, 0.0 0, 0.0 -0.988 360.0 360.0 155.5 360.0 -12.0 -13.9 -29.1 45 ! 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 46 61 A L 0 0 69 0, 0.0 2,-0.1 0, 0.0 20,-0.0 0.000 360.0 360.0 360.0 140.9 -7.9 0.8 -35.3 47 62 A T > - 0 0 78 1,-0.1 4,-2.7 4,-0.0 5,-0.2 -0.319 360.0-106.2 -73.4 166.9 -7.5 -0.6 -38.9 48 63 A S H > S+ 0 0 95 2,-0.2 4,-3.2 1,-0.2 5,-0.3 0.945 120.7 53.7 -64.3 -48.6 -5.5 1.5 -41.3 49 64 A D H > S+ 0 0 63 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.947 112.9 44.3 -46.1 -54.9 -8.6 2.7 -43.2 50 65 A E H > S+ 0 0 20 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.897 111.2 53.2 -58.6 -43.6 -10.1 3.9 -39.9 51 66 A Q H X S+ 0 0 82 -4,-2.7 4,-0.7 1,-0.2 -1,-0.2 0.887 112.8 45.1 -58.6 -40.6 -6.7 5.5 -38.9 52 67 A H H < S+ 0 0 63 -4,-3.2 -2,-0.2 2,-0.2 -1,-0.2 0.848 113.3 50.6 -66.2 -39.2 -6.8 7.3 -42.2 53 68 A L H < S+ 0 0 4 -4,-2.6 3,-0.3 -5,-0.3 -2,-0.2 0.859 120.4 33.8 -68.5 -36.2 -10.5 8.2 -41.6 54 69 A W H >< S+ 0 0 2 -4,-3.0 3,-2.2 1,-0.2 7,-0.2 0.428 79.6 119.8-102.1 1.1 -9.8 9.6 -38.1 55 70 A R T 3< + 0 0 118 -4,-0.7 -1,-0.2 1,-0.3 -2,-0.1 0.697 63.8 72.0 -35.0 -35.5 -6.3 11.0 -38.9 56 71 A E T 3 S+ 0 0 151 -3,-0.3 2,-0.9 1,-0.2 -1,-0.3 0.900 97.2 49.7 -50.6 -48.4 -7.6 14.4 -38.0 57 72 A N S <> S- 0 0 38 -3,-2.2 4,-1.3 1,-0.2 3,-0.5 -0.823 72.4-176.4 -97.0 97.1 -7.7 13.5 -34.3 58 73 A N H > S+ 0 0 113 -2,-0.9 4,-1.9 1,-0.2 -1,-0.2 0.889 76.6 59.9 -63.0 -45.4 -4.2 12.0 -33.6 59 74 A E H 4 S+ 0 0 107 1,-0.2 -1,-0.2 2,-0.2 13,-0.1 0.839 104.5 53.3 -51.0 -36.9 -4.8 10.9 -30.0 60 75 A L H >4 S+ 0 0 1 -3,-0.5 3,-1.4 1,-0.2 -1,-0.2 0.949 110.0 44.5 -67.0 -50.6 -7.6 8.7 -31.1 61 76 A I H 3< S+ 0 0 32 -4,-1.3 -1,-0.2 1,-0.3 -2,-0.2 0.761 111.7 55.6 -64.2 -25.8 -5.6 6.8 -33.7 62 77 A S T 3< S+ 0 0 77 -4,-1.9 -1,-0.3 -11,-0.0 -2,-0.2 0.241 76.7 127.2 -95.0 12.3 -2.7 6.5 -31.3 63 78 A S < - 0 0 22 -3,-1.4 -3,-0.0 -5,-0.1 3,-0.0 -0.581 51.8-150.2 -74.0 131.2 -4.8 4.8 -28.6 64 79 A P S S+ 0 0 109 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.592 73.0 15.6 -81.6 -17.1 -3.3 1.5 -27.4 65 80 A N S > S- 0 0 49 1,-0.0 4,-2.3 0, 0.0 3,-0.3 -0.977 81.4-101.6-153.4 163.7 -6.5 -0.3 -26.4 66 81 A K H > S+ 0 0 120 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.796 115.4 59.1 -60.2 -33.3 -10.3 -0.1 -26.9 67 82 A E H > S+ 0 0 22 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.943 111.0 40.3 -57.5 -52.2 -10.9 1.4 -23.5 68 83 A V H > S+ 0 0 15 -3,-0.3 4,-2.4 2,-0.2 5,-0.2 0.891 113.0 57.3 -65.3 -41.3 -8.7 4.4 -24.2 69 84 A L H X S+ 0 0 10 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.937 109.2 43.9 -54.1 -52.5 -10.1 4.6 -27.7 70 85 A E H X S+ 0 0 42 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.884 112.3 52.8 -64.0 -40.1 -13.7 4.9 -26.5 71 86 A Q H X S+ 0 0 34 -4,-1.9 4,-3.1 1,-0.2 -1,-0.2 0.918 112.1 44.0 -62.9 -44.6 -12.8 7.4 -23.8 72 87 A R H X>S+ 0 0 70 -4,-2.4 4,-4.1 2,-0.2 5,-0.7 0.820 110.6 55.3 -72.7 -33.2 -11.0 9.7 -26.2 73 88 A Y H X>S+ 0 0 0 -4,-2.1 5,-2.6 -5,-0.2 4,-1.9 0.966 114.2 40.9 -59.8 -50.5 -13.8 9.4 -28.9 74 89 A V H <>S+ 0 0 14 -4,-2.6 5,-2.8 3,-0.2 -2,-0.2 0.957 123.8 40.0 -60.6 -48.8 -16.2 10.5 -26.2 75 90 A Q H <5S+ 0 0 93 -4,-3.1 -2,-0.2 -5,-0.2 -3,-0.2 0.874 128.8 26.1 -67.7 -43.7 -13.8 13.2 -24.9 76 91 A N H <5S+ 0 0 55 -4,-4.1 -3,-0.2 3,-0.1 -2,-0.2 0.755 134.3 24.6-100.3 -30.5 -12.3 14.5 -28.2 77 92 A V T <>< - 0 0 9 -4,-2.9 3,-1.4 -5,-0.4 4,-0.2 0.480 21.8 -94.2 79.7 138.5 -21.0 19.8 -24.8 84 99 A P G > S+ 0 0 84 0, 0.0 3,-0.8 0, 0.0 -1,-0.1 0.593 108.2 80.6 -60.4 -18.4 -19.4 18.6 -21.4 85 100 A K G 3 S+ 0 0 135 1,-0.2 282,-0.2 -6,-0.1 -2,-0.1 0.786 105.2 26.9 -63.2 -30.8 -22.6 19.3 -19.4 86 101 A H G < S+ 0 0 26 -3,-1.4 283,-2.9 -4,-0.2 2,-0.4 0.165 110.8 75.4-122.4 12.3 -24.4 16.1 -20.4 87 102 A V < - 0 0 8 -3,-0.8 2,-0.6 281,-0.2 283,-0.1 -0.974 52.6-169.7-132.8 119.9 -21.5 13.8 -21.1 88 103 A D - 0 0 40 -2,-0.4 3,-0.1 281,-0.4 -3,-0.0 -0.939 2.2-176.2-106.6 112.7 -19.3 12.1 -18.5 89 104 A A - 0 0 9 -2,-0.6 -1,-0.1 1,-0.2 -14,-0.1 0.641 39.9-127.4 -83.5 -17.7 -16.2 10.5 -20.2 90 105 A G - 0 0 10 39,-0.1 2,-0.5 1,-0.0 41,-0.2 0.018 11.2 -91.7 92.3 161.0 -14.9 9.0 -17.0 91 106 A V E -E 130 0B 101 39,-3.0 39,-2.7 -3,-0.1 2,-0.2 -0.969 36.3-128.3-116.7 122.1 -11.6 9.0 -15.1 92 107 A R E -E 129 0B 112 -2,-0.5 2,-0.4 37,-0.2 37,-0.2 -0.484 27.2-168.9 -67.5 133.6 -9.2 6.2 -15.9 93 108 A V E -E 128 0B 9 35,-2.9 35,-2.5 -2,-0.2 2,-0.2 -0.950 23.6-112.4-125.3 148.3 -7.9 4.4 -12.8 94 109 A S E -E 127 0B 51 -93,-0.4 -91,-2.0 -2,-0.4 2,-0.3 -0.540 35.7-171.9 -75.8 141.2 -5.0 1.9 -12.5 95 110 A V B -a 3 0A 4 31,-3.2 2,-0.3 -93,-0.2 -91,-0.1 -0.979 17.0-127.7-137.4 145.2 -6.0 -1.7 -11.6 96 111 A S >> - 0 0 13 -93,-1.7 4,-2.1 -2,-0.3 3,-0.6 -0.672 22.2-121.1 -93.5 153.0 -4.0 -4.8 -10.7 97 112 A K H 3> S+ 0 0 113 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.844 116.1 54.7 -53.4 -37.4 -4.3 -8.2 -12.3 98 113 A E H 3> S+ 0 0 96 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.768 104.4 52.4 -72.4 -31.2 -5.3 -9.6 -8.9 99 114 A F H <> S+ 0 0 0 -3,-0.6 4,-2.5 -96,-0.3 -2,-0.2 0.943 112.9 46.2 -60.8 -49.7 -8.1 -7.1 -8.6 100 115 A L H X S+ 0 0 3 -4,-2.1 4,-2.2 1,-0.3 -2,-0.2 0.865 109.0 53.1 -65.5 -40.7 -9.4 -8.2 -12.0 101 116 A E H X S+ 0 0 82 -4,-2.5 4,-1.4 2,-0.2 -1,-0.3 0.839 111.7 48.3 -62.1 -33.9 -9.0 -11.9 -11.2 102 117 A C H X S+ 0 0 43 -4,-1.2 4,-2.1 2,-0.2 -2,-0.2 0.908 108.5 51.3 -72.2 -44.6 -11.1 -11.2 -8.1 103 118 A V H X S+ 0 0 6 -4,-2.5 4,-2.9 1,-0.2 -2,-0.2 0.872 105.7 60.0 -57.1 -38.9 -13.8 -9.3 -10.0 104 119 A D H X S+ 0 0 23 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.942 106.2 43.5 -53.6 -55.8 -13.9 -12.3 -12.4 105 120 A K H X S+ 0 0 125 -4,-1.4 4,-1.4 1,-0.2 -1,-0.2 0.893 114.0 52.3 -62.1 -39.9 -14.9 -14.8 -9.7 106 121 A K H X S+ 0 0 51 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.921 108.9 49.5 -61.1 -45.9 -17.4 -12.3 -8.3 107 122 A V H X S+ 0 0 0 -4,-2.9 4,-2.6 1,-0.2 -2,-0.2 0.946 108.6 51.6 -62.1 -46.8 -19.1 -11.7 -11.7 108 123 A T H < S+ 0 0 58 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.827 114.9 44.5 -61.6 -28.6 -19.5 -15.5 -12.5 109 124 A K H < S+ 0 0 180 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.824 122.9 34.3 -81.1 -32.1 -21.1 -16.0 -9.1 110 125 A Q H < S+ 0 0 122 -4,-2.0 -2,-0.2 -5,-0.2 -3,-0.2 0.586 84.7 116.8-103.5 -12.1 -23.4 -12.9 -9.2 111 126 A R < - 0 0 15 -4,-2.6 5,-0.1 -5,-0.2 -96,-0.0 -0.311 68.4-112.9 -60.6 137.8 -24.4 -12.6 -12.9 112 127 A P > - 0 0 67 0, 0.0 3,-1.9 0, 0.0 4,-0.3 -0.182 35.6 -96.4 -61.1 164.6 -28.1 -13.1 -13.7 113 128 A L G > S+ 0 0 155 1,-0.3 3,-1.4 2,-0.2 4,-0.3 0.856 122.8 63.1 -56.9 -41.6 -29.2 -16.1 -15.7 114 129 A A G 3 S+ 0 0 91 1,-0.2 -1,-0.3 2,-0.1 3,-0.2 0.790 113.7 36.1 -44.8 -33.5 -29.2 -14.2 -19.0 115 130 A R G X S+ 0 0 84 -3,-1.9 3,-2.1 1,-0.1 -1,-0.2 0.268 77.1 114.8-115.1 8.7 -25.4 -13.7 -18.5 116 131 A V T < S+ 0 0 82 -3,-1.4 -1,-0.1 -4,-0.3 -2,-0.1 0.790 87.4 39.2 -54.9 -32.5 -24.2 -17.0 -16.9 117 132 A N T 3 S+ 0 0 166 -4,-0.3 -1,-0.3 -3,-0.2 3,-0.1 0.229 89.2 132.9-102.3 15.3 -22.1 -17.9 -19.9 118 133 A A < - 0 0 21 -3,-2.1 -3,-0.1 1,-0.1 -100,-0.1 -0.154 66.7 -76.9 -62.4 158.5 -20.8 -14.4 -20.6 119 134 A A - 0 0 40 -101,-0.2 -1,-0.1 1,-0.1 3,-0.1 -0.207 49.3-107.8 -58.4 140.8 -17.1 -13.6 -21.3 120 135 A N - 0 0 92 1,-0.1 -78,-2.7 -3,-0.1 -1,-0.1 -0.230 43.6 -88.9 -54.1 154.9 -14.6 -13.5 -18.4 121 136 A V B -F 41 0C 4 -80,-0.3 2,-1.0 -21,-0.2 -80,-0.3 -0.392 47.3-108.5 -59.2 144.7 -13.2 -10.2 -17.3 122 137 A D > - 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