==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 01-MAY-07 2UZR . COMPND 2 MOLECULE: RAC-ALPHA SERINE/THREONINE-PROTEIN KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.D.CARPTEN,A.L.FABER,C.HORN,G.P.DONOHO,S.L.BRIGGS, . 113 2 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7941.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 75 66.4 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 . 40 35.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.9 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 . 7 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 4 3.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 24 21.2 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+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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 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 1 0 2 0 1 0 1 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 0 0 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 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 D 0 0 194 0, 0.0 2,-0.5 0, 0.0 28,-0.1 0.000 360.0 360.0 360.0 174.4 31.0 1.8 -6.1 2 4 A V + 0 0 78 26,-0.1 2,-0.3 28,-0.0 26,-0.0 -0.671 360.0 173.2 -88.6 121.8 28.4 1.2 -3.4 3 5 A A - 0 0 47 -2,-0.5 26,-2.3 0, 0.0 2,-0.3 -0.865 39.4 -96.8-123.1 155.2 27.6 4.1 -1.0 4 6 A I E -A 28 0A 80 -2,-0.3 24,-0.3 24,-0.2 3,-0.1 -0.570 32.4-175.3 -68.5 130.7 25.1 4.6 1.7 5 7 A V E - 0 0 64 22,-3.7 2,-0.3 1,-0.4 23,-0.2 0.831 67.8 -5.4 -92.6 -45.8 22.1 6.7 0.4 6 8 A K E -A 27 0A 45 21,-1.4 21,-3.5 2,-0.0 -1,-0.4 -0.988 60.7-177.8-153.7 140.2 20.2 7.1 3.6 7 9 A E E +A 26 0A 81 -2,-0.3 2,-0.3 19,-0.2 19,-0.2 -0.981 24.9 105.6-137.9 152.7 20.4 5.9 7.2 8 10 A G E -A 25 0A 13 17,-2.2 17,-2.5 -2,-0.3 2,-0.3 -0.897 61.7 -50.7 159.8 172.9 18.3 6.4 10.3 9 11 A W E +A 24 0A 111 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.515 46.9 176.6 -75.7 133.0 15.8 5.0 12.8 10 12 A L E -A 23 0A 0 13,-2.8 13,-2.9 -2,-0.3 2,-0.8 -0.975 32.7-124.3-130.9 147.1 12.6 3.4 11.6 11 13 A H E -AB 22 83A 54 72,-2.3 72,-2.8 -2,-0.3 2,-0.4 -0.856 36.3-163.1 -88.8 112.5 9.8 1.7 13.5 12 14 A K E -AB 21 82A 12 9,-3.1 9,-2.6 -2,-0.8 2,-0.3 -0.850 13.5-138.5-104.4 132.7 9.6 -1.8 12.0 13 15 A R E -A 20 0A 64 68,-2.3 68,-0.5 -2,-0.4 7,-0.2 -0.703 33.3-110.2 -82.9 138.0 6.7 -4.2 12.3 14 16 A G - 0 0 25 5,-2.8 -1,-0.1 -2,-0.3 6,-0.0 -0.250 10.2-134.0 -70.2 154.8 7.7 -7.8 12.9 15 17 A K S S+ 0 0 71 3,-0.1 3,-0.1 65,-0.0 -1,-0.1 0.947 102.2 13.5 -67.5 -54.4 7.3 -10.6 10.4 16 18 A Y S S+ 0 0 227 1,-0.3 2,-0.6 3,-0.0 -2,-0.0 0.903 132.9 44.7 -96.7 -53.6 5.9 -13.2 12.7 17 19 A I S S- 0 0 121 1,-0.1 2,-0.3 2,-0.1 -1,-0.3 -0.868 81.9-145.8 -84.6 123.6 5.0 -11.2 15.8 18 20 A K + 0 0 136 -2,-0.6 2,-0.1 -5,-0.1 -1,-0.1 -0.045 56.0 126.5 -85.9 36.0 3.3 -8.1 14.3 19 21 A T - 0 0 71 -2,-0.3 -5,-2.8 -6,-0.1 2,-0.4 -0.467 60.1-116.5 -83.2 163.1 4.7 -5.9 17.1 20 22 A W E +A 13 0A 49 -7,-0.2 -7,-0.2 -2,-0.1 -9,-0.1 -0.871 33.3 174.7-108.1 134.8 6.7 -2.7 16.3 21 23 A R E -A 12 0A 150 -9,-2.6 -9,-3.1 -2,-0.4 2,-0.2 -0.995 34.8-107.6-137.8 142.8 10.3 -2.1 17.3 22 24 A P E +A 11 0A 66 0, 0.0 2,-0.4 0, 0.0 -11,-0.2 -0.510 41.6 178.6 -67.5 132.0 12.9 0.6 16.6 23 25 A R E -A 10 0A 49 -13,-2.9 -13,-2.8 -2,-0.2 2,-0.8 -0.997 29.5-130.3-137.4 140.7 15.5 -0.4 14.1 24 26 A Y E -AC 9 36A 3 12,-2.7 12,-2.7 -2,-0.4 2,-0.3 -0.828 34.7-167.9 -92.6 110.9 18.5 1.5 12.6 25 27 A F E -AC 8 35A 0 -17,-2.5 -17,-2.2 -2,-0.8 2,-0.4 -0.739 15.0-163.6-105.1 146.4 18.4 1.1 8.8 26 28 A L E -AC 7 34A 10 8,-2.4 8,-2.4 -2,-0.3 2,-0.5 -0.997 5.5-159.1-127.2 127.2 20.9 1.8 6.1 27 29 A L E -AC 6 33A 0 -21,-3.5 -22,-3.7 -2,-0.4 -21,-1.4 -0.923 10.7-164.8-104.5 128.6 19.9 2.1 2.4 28 30 A K E > -A 4 0A 45 4,-2.9 3,-2.0 -2,-0.5 -24,-0.2 -0.791 31.5-114.9-110.9 155.4 22.7 1.6 -0.1 29 31 A N T 3 S+ 0 0 69 -26,-2.3 -25,-0.1 -2,-0.3 -27,-0.0 0.534 113.1 65.2 -71.6 -5.0 22.7 2.5 -3.8 30 32 A D T 3 S- 0 0 69 -27,-0.2 -1,-0.3 2,-0.1 22,-0.2 0.388 125.7 -99.8 -89.0 1.8 23.0 -1.2 -4.8 31 33 A G S < S+ 0 0 0 -3,-2.0 20,-2.4 1,-0.3 21,-0.2 0.322 73.8 149.0 99.0 -6.3 19.6 -1.7 -3.2 32 34 A T E - D 0 50A 35 18,-0.2 -4,-2.9 19,-0.1 2,-0.5 -0.424 23.5-174.6 -60.6 127.0 20.8 -3.1 0.0 33 35 A F E +CD 27 49A 0 16,-1.9 16,-2.0 -6,-0.2 2,-0.4 -0.950 9.7 179.8-127.4 106.7 18.5 -2.2 2.9 34 36 A I E -CD 26 48A 15 -8,-2.4 -8,-2.4 -2,-0.5 2,-0.4 -0.928 10.7-159.8-117.9 133.1 20.1 -3.4 6.2 35 37 A G E -CD 25 47A 0 12,-2.7 11,-2.9 -2,-0.4 12,-1.9 -0.938 6.9-171.4-120.1 131.7 18.6 -3.1 9.7 36 38 A Y E -C 24 0A 44 -12,-2.7 -12,-2.7 -2,-0.4 3,-0.0 -0.819 32.3-128.3-118.0 155.9 20.3 -3.2 13.1 37 39 A K S S+ 0 0 145 7,-0.4 2,-0.3 -2,-0.3 -1,-0.1 0.889 99.0 21.6 -64.4 -40.9 19.2 -3.3 16.7 38 40 A E S S- 0 0 128 -14,-0.1 -1,-0.1 -15,-0.1 -14,-0.1 -0.866 101.4 -83.9-125.8 158.7 21.6 -0.4 17.5 39 41 A R 0 0 142 -2,-0.3 -2,-0.0 1,-0.1 -14,-0.0 -0.492 360.0 360.0 -59.7 122.0 23.3 2.3 15.4 40 42 A P 0 0 99 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.280 360.0 360.0 -80.7 360.0 26.4 0.6 14.1 41 ! 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 42 48 A R 0 0 294 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -39.9 30.5 -5.7 14.4 43 49 A E - 0 0 166 -3,-0.1 -5,-0.0 2,-0.0 0, 0.0 0.692 360.0-106.6 71.5 118.2 27.1 -7.2 15.5 44 50 A A - 0 0 74 1,-0.1 -7,-0.4 -8,-0.0 2,-0.1 -0.213 34.4-101.2 -68.4 157.8 25.1 -8.7 12.7 45 51 A P - 0 0 44 0, 0.0 -9,-0.3 0, 0.0 -1,-0.1 -0.435 13.7-148.7 -75.0 157.7 22.0 -7.1 11.2 46 52 A L S S+ 0 0 96 -11,-2.9 2,-0.3 1,-0.2 -10,-0.2 0.655 87.2 35.0 -93.8 -23.9 18.5 -8.2 12.2 47 53 A N E +D 35 0A 23 -12,-1.9 -12,-2.7 2,-0.0 2,-0.3 -0.988 61.4 166.9-133.9 144.5 17.1 -7.4 8.7 48 54 A N E +D 34 0A 111 -2,-0.3 2,-0.3 -14,-0.2 -14,-0.2 -0.798 18.1 135.3-162.5 103.8 18.8 -7.6 5.3 49 55 A F E -D 33 0A 18 -16,-2.0 -16,-1.9 -2,-0.3 2,-0.3 -0.992 46.8-110.6-153.4 155.1 16.9 -7.4 1.9 50 56 A S E -D 32 0A 51 -2,-0.3 -18,-0.2 -18,-0.2 -19,-0.1 -0.693 9.1-157.8 -88.8 139.3 17.2 -5.8 -1.5 51 57 A V > + 0 0 0 -20,-2.4 3,-1.8 -2,-0.3 -1,-0.1 0.408 55.6 124.4 -91.1 -0.7 14.8 -3.0 -2.5 52 58 A A T 3 S+ 0 0 23 1,-0.3 3,-0.1 -21,-0.2 -2,-0.1 -0.386 82.9 4.8 -62.0 133.4 15.5 -3.8 -6.2 53 59 A Q T 3 S+ 0 0 148 48,-0.3 19,-0.5 1,-0.2 -1,-0.3 0.679 103.2 137.8 63.3 19.7 12.2 -4.5 -8.1 54 60 A a E < -E 71 0A 18 -3,-1.8 2,-0.4 17,-0.2 17,-0.2 -0.605 49.0-131.6 -98.0 159.8 10.2 -3.7 -5.0 55 61 A Q E -E 70 0A 104 15,-3.3 15,-3.1 -2,-0.2 2,-0.5 -0.886 12.8-140.0-111.1 136.5 7.0 -1.7 -4.8 56 62 A L E -E 69 0A 37 -2,-0.4 2,-0.4 13,-0.2 13,-0.2 -0.866 21.4-177.8-100.0 128.3 6.4 1.1 -2.3 57 63 A M E -E 68 0A 48 11,-2.8 11,-3.1 -2,-0.5 2,-0.4 -0.965 13.3-150.0-124.8 141.5 3.0 1.4 -0.6 58 64 A K E +E 67 0A 91 -2,-0.4 2,-0.3 9,-0.2 9,-0.2 -0.911 21.0 170.3-109.5 136.7 1.7 4.0 1.9 59 65 A T E -E 66 0A 50 7,-2.6 7,-2.2 -2,-0.4 -2,-0.0 -0.954 31.8-156.3-142.0 164.3 -0.9 3.2 4.6 60 66 A E + 0 0 78 -2,-0.3 -1,-0.1 5,-0.2 7,-0.0 0.353 56.8 119.7-118.2 0.8 -2.5 4.9 7.6 61 67 A R S S- 0 0 205 1,-0.2 -1,-0.1 5,-0.1 5,-0.0 -0.986 83.8 -7.1-133.0 138.5 -3.7 1.8 9.5 62 68 A P S S+ 0 0 82 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 -0.978 144.8 23.9 -74.4 -16.0 -3.1 0.6 12.1 63 69 A R S S- 0 0 80 1,-0.0 3,-0.5 0, 0.0 -4,-0.1 -0.907 81.3-120.9-112.2 136.5 -0.4 3.4 12.4 64 70 A P S S+ 0 0 72 0, 0.0 20,-0.3 0, 0.0 -4,-0.2 -0.280 95.0 28.0 -62.1 157.4 -0.4 6.7 10.5 65 71 A N S S+ 0 0 19 1,-0.2 19,-1.7 18,-0.1 2,-0.4 0.857 84.7 156.1 56.2 42.2 2.6 7.4 8.2 66 72 A T E -EF 59 83A 1 -7,-2.2 -7,-2.6 -3,-0.5 2,-0.4 -0.788 23.0-167.5 -95.5 139.3 3.3 3.7 7.5 67 73 A F E -EF 58 82A 0 15,-2.9 15,-3.2 -2,-0.4 2,-0.4 -0.985 4.0-157.6-124.9 145.3 5.1 2.5 4.4 68 74 A I E -EF 57 81A 26 -11,-3.1 -11,-2.8 -2,-0.4 2,-0.6 -0.970 6.5-153.1-120.2 133.0 5.4 -1.0 3.0 69 75 A I E -EF 56 80A 0 11,-2.5 11,-2.1 -2,-0.4 2,-0.5 -0.942 18.7-166.7-102.0 117.0 8.1 -2.3 0.7 70 76 A R E -EF 55 79A 97 -15,-3.1 -15,-3.3 -2,-0.6 2,-0.4 -0.937 8.0-179.1-112.5 125.7 6.7 -5.2 -1.3 71 77 A a E -EF 54 78A 3 7,-2.9 7,-3.3 -2,-0.5 2,-0.7 -0.983 18.2-148.9-127.3 122.3 8.9 -7.6 -3.3 72 78 A L E + F 0 77A 121 -19,-0.5 2,-0.5 -2,-0.4 5,-0.2 -0.816 22.6 178.0 -90.9 113.9 7.7 -10.5 -5.5 73 79 A Q E > - F 0 76A 80 3,-2.7 3,-1.2 -2,-0.7 2,-0.3 -0.946 55.9 -53.8-125.6 110.3 10.4 -13.2 -5.4 74 80 A W T 3 S- 0 0 238 -2,-0.5 -2,-0.0 1,-0.3 0, 0.0 -0.490 119.3 -25.9 62.7-119.9 9.8 -16.5 -7.3 75 81 A T T 3 S+ 0 0 139 -2,-0.3 -1,-0.3 -3,-0.0 2,-0.1 0.748 127.2 87.3 -85.6 -29.7 6.5 -17.8 -6.0 76 82 A T E < - F 0 73A 71 -3,-1.2 -3,-2.7 -4,-0.1 2,-0.5 -0.338 63.8-150.6 -78.1 147.7 7.0 -15.9 -2.6 77 83 A V E - F 0 72A 85 -5,-0.2 2,-0.4 -2,-0.1 -5,-0.2 -0.984 11.7-158.0-116.6 127.1 6.0 -12.3 -1.8 78 84 A I E - F 0 71A 32 -7,-3.3 -7,-2.9 -2,-0.5 2,-0.4 -0.866 8.5-173.4-104.9 135.5 8.0 -10.4 0.8 79 85 A E E - F 0 70A 68 -2,-0.4 2,-0.4 -9,-0.2 -9,-0.2 -0.998 8.1-170.4-130.3 134.0 6.7 -7.4 2.7 80 86 A R E - F 0 69A 46 -11,-2.1 -11,-2.5 -2,-0.4 2,-0.5 -0.988 13.5-156.1-124.5 121.7 8.5 -5.1 5.1 81 87 A T E + F 0 68A 24 -68,-0.5 -68,-2.3 -2,-0.4 2,-0.3 -0.845 13.4 179.3-109.7 127.2 6.4 -2.6 7.1 82 88 A F E -BF 12 67A 0 -15,-3.2 -15,-2.9 -2,-0.5 2,-0.4 -0.939 11.9-161.7-130.3 148.3 7.8 0.6 8.5 83 89 A H E -BF 11 66A 15 -72,-2.8 -72,-2.3 -2,-0.3 2,-0.3 -0.978 7.3-178.3-127.3 140.0 6.4 3.5 10.6 84 90 A V - 0 0 3 -19,-1.7 6,-0.1 -2,-0.4 -74,-0.1 -0.913 36.5-113.3-130.4 163.3 7.8 7.0 11.0 85 91 A E S S+ 0 0 145 -2,-0.3 -19,-0.1 4,-0.1 -20,-0.0 0.749 93.2 35.6 -72.6 -25.9 6.4 9.9 13.1 86 92 A T S > S- 0 0 46 -21,-0.1 4,-1.5 1,-0.1 3,-0.2 -0.932 71.4-127.6-129.9 151.9 5.5 12.3 10.3 87 93 A P H > S+ 0 0 59 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.795 113.9 57.6 -62.9 -26.9 4.1 12.1 6.7 88 94 A E H > S+ 0 0 135 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.854 104.2 49.8 -70.3 -38.4 7.1 14.2 5.7 89 95 A E H > S+ 0 0 71 2,-0.2 4,-1.9 -3,-0.2 -1,-0.2 0.809 109.1 52.9 -68.5 -32.6 9.6 11.7 7.1 90 96 A R H X S+ 0 0 20 -4,-1.5 4,-3.3 2,-0.2 5,-0.2 0.910 109.8 47.4 -65.9 -43.3 7.7 8.9 5.2 91 97 A E H X S+ 0 0 102 -4,-1.8 4,-2.2 2,-0.2 5,-0.3 0.861 108.3 56.9 -65.1 -37.8 8.1 10.9 2.0 92 98 A E H X S+ 0 0 99 -4,-1.9 4,-1.3 2,-0.2 -1,-0.2 0.923 115.4 36.2 -54.0 -50.3 11.8 11.4 2.9 93 99 A W H X S+ 0 0 8 -4,-1.9 4,-2.6 2,-0.2 5,-0.2 0.908 116.4 50.6 -74.3 -45.8 12.3 7.6 3.1 94 100 A T H X S+ 0 0 9 -4,-3.3 4,-2.7 1,-0.2 -3,-0.2 0.875 110.1 51.0 -64.8 -37.6 10.0 6.5 0.3 95 101 A T H X S+ 0 0 76 -4,-2.2 4,-2.5 -5,-0.2 -1,-0.2 0.934 112.0 47.4 -61.8 -47.4 11.6 9.0 -2.2 96 102 A A H X S+ 0 0 15 -4,-1.3 4,-1.5 -5,-0.3 -2,-0.2 0.920 115.1 44.8 -60.3 -47.6 15.0 7.8 -1.3 97 103 A I H X S+ 0 0 3 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.903 113.4 51.7 -63.8 -42.0 14.0 4.1 -1.6 98 104 A Q H X S+ 0 0 72 -4,-2.7 4,-2.7 -5,-0.2 -2,-0.2 0.913 107.3 51.2 -62.0 -44.4 12.2 4.8 -4.9 99 105 A T H X S+ 0 0 86 -4,-2.5 4,-1.8 2,-0.2 -1,-0.2 0.850 111.7 47.7 -64.9 -34.3 15.1 6.6 -6.5 100 106 A V H X S+ 0 0 11 -4,-1.5 4,-2.1 2,-0.2 -1,-0.2 0.931 113.0 47.9 -68.6 -47.6 17.4 3.7 -5.7 101 107 A A H X S+ 0 0 7 -4,-2.4 4,-1.9 1,-0.2 -48,-0.3 0.872 111.0 52.0 -58.9 -39.9 14.9 1.2 -7.0 102 108 A D H X S+ 0 0 75 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.873 106.8 52.9 -66.3 -39.9 14.5 3.3 -10.2 103 109 A G H X S+ 0 0 34 -4,-1.8 4,-1.6 1,-0.2 -2,-0.2 0.918 112.0 45.1 -58.1 -45.8 18.3 3.3 -10.7 104 110 A L H X S+ 0 0 34 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.796 111.0 53.4 -71.1 -30.3 18.4 -0.4 -10.5 105 111 A K H X S+ 0 0 107 -4,-1.9 4,-2.9 2,-0.2 5,-0.2 0.920 107.3 51.1 -68.4 -44.6 15.3 -0.7 -12.8 106 112 A K H X S+ 0 0 115 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.880 111.2 49.6 -57.3 -40.8 17.0 1.5 -15.5 107 113 A Q H X S+ 0 0 105 -4,-1.6 4,-0.8 2,-0.2 -1,-0.2 0.912 111.6 47.5 -64.4 -45.8 20.1 -0.8 -15.2 108 114 A E H >X S+ 0 0 73 -4,-2.1 4,-2.7 1,-0.2 3,-0.8 0.921 111.5 50.7 -61.2 -46.6 17.9 -4.0 -15.6 109 115 A E H 3X S+ 0 0 83 -4,-2.9 4,-2.3 1,-0.3 -1,-0.2 0.851 105.8 55.3 -62.0 -38.0 16.1 -2.5 -18.6 110 116 A E H 3< S+ 0 0 144 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.708 116.2 39.3 -68.3 -20.2 19.3 -1.6 -20.3 111 117 A E H << S+ 0 0 125 -3,-0.8 -2,-0.2 -4,-0.8 -1,-0.2 0.821 124.0 35.2 -93.3 -39.3 20.4 -5.2 -20.0 112 118 A M H < S+ 0 0 136 -4,-2.7 2,-0.4 -5,-0.1 -3,-0.2 0.758 92.0 93.1 -94.8 -28.9 17.1 -7.0 -20.7 113 119 A D < 0 0 97 -4,-2.3 -4,-0.0 -5,-0.3 0, 0.0 -0.567 360.0 360.0 -73.4 123.8 15.4 -4.8 -23.4 114 120 A F 0 0 256 -2,-0.4 -1,-0.3 0, 0.0 -2,-0.1 0.831 360.0 360.0 57.3 360.0 16.3 -6.0 -26.9