==== 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 12-MAR-07 2UVM . COMPND 2 MOLECULE: RAC-ALPHA SERINE/THREONINE-PROTEIN KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR D.KOMANDER,S.J.MILLS,M.N.TRUSSELLE,S.T.SAFRANY, . 115 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7216.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 78 67.8 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 . 39 33.9 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 . 10 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 8 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 21 18.3 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 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 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 1 0 2 1 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 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 1 A M > 0 0 199 0, 0.0 3,-2.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -49.4 21.6 -2.7 -10.4 2 2 A S G > + 0 0 99 1,-0.3 3,-0.9 2,-0.2 29,-0.2 0.524 360.0 78.0 -65.8 -1.6 22.7 -5.3 -7.9 3 3 A D G 3 S+ 0 0 45 1,-0.2 -1,-0.3 27,-0.1 29,-0.2 0.808 95.8 44.1 -73.3 -30.7 24.4 -2.3 -6.3 4 4 A V G < S+ 0 0 72 -3,-2.2 -1,-0.2 27,-0.2 -2,-0.2 0.064 92.0 128.3-100.6 22.3 21.0 -1.4 -5.0 5 5 A A < - 0 0 36 -3,-0.9 26,-2.5 1,-0.1 2,-0.5 -0.430 68.8-104.4 -79.1 154.4 20.3 -5.0 -3.9 6 6 A I E +A 30 0A 64 24,-0.2 24,-0.3 1,-0.2 3,-0.1 -0.701 35.6 177.8 -81.1 122.7 19.2 -5.9 -0.4 7 7 A V E - 0 0 57 22,-3.3 2,-0.3 -2,-0.5 23,-0.2 0.778 68.2 -6.3 -94.1 -34.0 22.1 -7.4 1.5 8 8 A K E +A 29 0A 43 21,-1.2 21,-2.9 2,-0.0 -1,-0.4 -0.954 61.6 175.9-164.1 142.9 20.2 -7.9 4.8 9 9 A E E +A 28 0A 84 -2,-0.3 2,-0.3 19,-0.2 19,-0.2 -0.993 21.0 109.3-149.8 152.9 16.9 -7.1 6.4 10 10 A G E -A 27 0A 16 17,-1.8 17,-2.7 -2,-0.3 2,-0.2 -0.943 58.5 -55.6 162.6-179.2 15.0 -7.7 9.6 11 11 A W E +A 26 0A 129 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.562 50.3 150.8 -90.8 149.4 13.7 -6.2 12.8 12 12 A L E -A 25 0A 5 13,-2.3 13,-2.3 -2,-0.2 2,-0.5 -0.942 41.8-104.5-161.8 170.4 15.6 -4.3 15.4 13 13 A H E -AB 24 89A 52 76,-2.7 76,-2.0 -2,-0.3 2,-0.5 -0.931 24.7-149.8-109.8 134.6 15.1 -1.6 18.0 14 14 A K E -AB 23 88A 21 9,-2.8 9,-3.2 -2,-0.5 74,-0.2 -0.900 21.2-125.1-103.5 129.7 16.4 1.9 17.4 15 15 A R E -A 22 0A 49 72,-3.3 72,-0.3 -2,-0.5 7,-0.2 -0.455 19.4-113.3 -77.6 142.9 17.4 3.9 20.5 16 16 A G - 0 0 9 5,-3.1 -1,-0.1 -2,-0.2 5,-0.1 -0.350 19.8-152.5 -66.7 151.8 16.1 7.3 21.4 17 17 A E S S+ 0 0 86 3,-0.1 -1,-0.1 69,-0.0 -2,-0.0 0.909 88.6 4.7 -91.1 -59.0 18.7 10.1 21.3 18 18 A Y S S+ 0 0 239 2,-0.0 2,-0.4 1,-0.0 -2,-0.1 0.483 129.0 60.5-104.9 -6.4 17.4 12.6 23.8 19 19 A I S S- 0 0 103 2,-0.1 2,-1.0 -4,-0.0 -3,-0.1 -0.940 88.4-119.3-120.1 141.0 14.5 10.6 25.1 20 20 A K + 0 0 188 -2,-0.4 2,-0.3 -5,-0.1 -3,-0.1 -0.739 68.6 105.3 -86.2 108.1 15.0 7.2 26.7 21 21 A T - 0 0 56 -2,-1.0 -5,-3.1 -5,-0.1 2,-0.5 -0.965 60.3-128.0-171.5 162.4 13.1 4.8 24.6 22 22 A W E -A 15 0A 46 -2,-0.3 -7,-0.2 -7,-0.2 66,-0.1 -0.996 22.0-154.1-124.7 122.2 13.5 2.0 22.0 23 23 A R E -A 14 0A 88 -9,-3.2 -9,-2.8 -2,-0.5 2,-0.2 -0.841 18.0-124.8-100.5 129.5 11.5 2.3 18.7 24 24 A P E +A 13 0A 70 0, 0.0 2,-0.3 0, 0.0 -11,-0.2 -0.520 40.3 170.0 -71.0 140.9 10.7 -0.8 16.8 25 25 A R E -A 12 0A 33 -13,-2.3 -13,-2.3 -2,-0.2 2,-0.6 -0.996 34.9-139.2-151.3 149.5 11.9 -0.7 13.2 26 26 A Y E -AC 11 38A 19 12,-2.5 12,-1.6 -2,-0.3 2,-0.3 -0.957 32.4-163.8-109.8 120.9 12.3 -2.9 10.2 27 27 A F E -AC 10 37A 0 -17,-2.7 -17,-1.8 -2,-0.6 2,-0.4 -0.828 14.9-164.0-112.8 147.6 15.6 -2.2 8.4 28 28 A L E -AC 9 36A 3 8,-2.5 8,-2.3 -2,-0.3 2,-0.5 -0.989 8.2-155.2-125.4 134.9 17.0 -3.0 5.0 29 29 A L E -AC 8 35A 0 -21,-2.9 -22,-3.3 -2,-0.4 -21,-1.2 -0.961 14.7-159.0-110.5 123.6 20.7 -2.7 4.2 30 30 A K E > -A 6 0A 46 4,-3.2 3,-1.8 -2,-0.5 -24,-0.2 -0.711 28.5-112.7-103.2 156.4 21.4 -2.2 0.5 31 31 A N T 3 S+ 0 0 68 -26,-2.5 -27,-0.2 1,-0.3 -25,-0.1 0.613 112.7 63.2 -62.4 -13.6 24.7 -2.8 -1.4 32 32 A D T 3 S- 0 0 62 -27,-0.2 -1,-0.3 -29,-0.2 26,-0.1 0.175 125.2 -96.9 -95.8 17.3 25.3 0.9 -2.0 33 33 A G S < S+ 0 0 0 -3,-1.8 24,-2.7 1,-0.3 2,-0.3 0.444 76.5 145.0 86.6 1.2 25.6 1.5 1.7 34 34 A T E - D 0 56A 29 22,-0.2 -4,-3.2 23,-0.1 2,-0.5 -0.595 27.4-171.5 -78.0 132.4 22.0 2.6 2.3 35 35 A F E +CD 29 55A 0 20,-2.6 20,-2.5 -2,-0.3 2,-0.4 -0.946 13.4 179.8-126.5 103.7 20.5 1.6 5.6 36 36 A I E -CD 28 54A 16 -8,-2.3 -8,-2.5 -2,-0.5 2,-0.3 -0.889 11.0-159.4-117.6 141.2 16.8 2.4 5.8 37 37 A G E -CD 27 53A 0 16,-1.7 15,-2.4 -2,-0.4 16,-1.7 -0.869 7.2-177.3-120.2 151.0 14.2 1.8 8.5 38 38 A Y E -C 26 0A 10 -12,-1.6 -12,-2.5 -2,-0.3 3,-0.1 -0.910 38.9-117.9-137.1 161.9 10.4 1.6 8.6 39 39 A K S S+ 0 0 36 -2,-0.3 2,-0.3 -14,-0.2 -1,-0.1 0.794 103.4 7.9 -72.8 -25.0 7.7 1.2 11.3 40 40 A E S S- 0 0 147 -14,-0.1 -14,-0.2 -15,-0.1 -1,-0.1 -0.931 102.6 -73.3-147.0 165.3 6.7 -2.1 9.6 41 41 A R - 0 0 137 -2,-0.3 2,-0.1 1,-0.1 7,-0.1 -0.495 57.5-111.7 -68.3 124.4 8.1 -4.2 6.8 42 42 A P - 0 0 7 0, 0.0 -1,-0.1 0, 0.0 6,-0.1 -0.366 27.3-164.9 -59.0 125.7 7.3 -2.4 3.5 43 43 A Q + 0 0 67 -2,-0.1 2,-0.2 -3,-0.0 -2,-0.0 0.773 64.1 0.8 -85.5 -28.7 4.7 -4.4 1.5 44 44 A D S > S- 0 0 68 1,-0.1 4,-1.0 0, 0.0 5,-0.1 -0.701 87.9 -75.6-142.5-165.6 5.2 -2.7 -1.8 45 45 A V H > S+ 0 0 91 -2,-0.2 4,-1.6 2,-0.2 3,-0.3 0.918 125.0 50.3 -66.1 -44.6 7.1 -0.1 -3.9 46 46 A D H 4 S+ 0 0 117 1,-0.2 4,-0.4 2,-0.2 3,-0.2 0.906 109.7 49.3 -61.3 -45.3 5.2 2.8 -2.3 47 47 A Q H 4 S+ 0 0 85 1,-0.2 3,-0.4 2,-0.2 -1,-0.2 0.757 110.3 54.0 -66.6 -22.0 5.8 1.6 1.2 48 48 A R H < S+ 0 0 113 -4,-1.0 -1,-0.2 -3,-0.3 -2,-0.2 0.789 100.7 58.1 -80.9 -30.3 9.5 1.3 0.2 49 49 A E S < S+ 0 0 143 -4,-1.6 -1,-0.2 -3,-0.2 -2,-0.2 0.513 100.1 62.5 -78.8 -2.7 9.8 4.9 -1.0 50 50 A A + 0 0 69 -4,-0.4 -1,-0.2 -3,-0.4 2,-0.1 -0.428 68.0 167.7-121.1 58.9 8.7 6.3 2.3 51 51 A P - 0 0 41 0, 0.0 -13,-0.2 0, 0.0 3,-0.1 -0.367 32.3-147.9 -71.8 152.4 11.3 5.3 4.9 52 52 A L S S+ 0 0 110 -15,-2.4 2,-0.3 1,-0.2 -14,-0.2 0.825 86.6 30.4 -83.0 -36.0 11.4 6.8 8.4 53 53 A N E +D 37 0A 23 -16,-1.7 -16,-1.7 2,-0.0 2,-0.3 -0.943 62.3 177.1-126.3 148.1 15.2 6.5 8.7 54 54 A N E +D 36 0A 81 -2,-0.3 2,-0.3 -18,-0.2 -18,-0.2 -0.852 9.9 164.1-155.5 110.7 17.9 6.6 6.1 55 55 A F E -D 35 0A 10 -20,-2.5 -20,-2.6 -2,-0.3 2,-0.5 -0.795 31.2-131.4-123.1 165.4 21.6 6.4 6.8 56 56 A S E -D 34 0A 44 22,-0.3 22,-0.3 -2,-0.3 -22,-0.2 -0.978 10.2-164.3-116.3 129.2 24.7 5.7 4.7 57 57 A V > + 0 0 0 -24,-2.7 3,-1.2 -2,-0.5 2,-0.2 0.231 43.0 132.2 -99.1 15.9 27.1 3.2 6.2 58 58 A A T 3 S- 0 0 33 1,-0.3 20,-0.5 -25,-0.2 -2,-0.1 -0.482 84.6 -1.6 -66.7 134.6 30.1 4.1 4.0 59 59 A Q T 3 S+ 0 0 174 48,-0.2 -1,-0.3 -2,-0.2 2,-0.1 0.871 99.5 159.4 53.7 42.6 33.2 4.5 6.1 60 60 A C < - 0 0 11 -3,-1.2 2,-0.4 43,-0.1 17,-0.2 -0.447 40.8-126.0 -94.8 170.3 31.3 3.9 9.4 61 61 A Q E -E 76 0A 120 15,-2.3 15,-1.9 -2,-0.1 2,-0.5 -0.884 21.1-155.1-107.6 142.2 32.5 2.8 12.8 62 62 A L E +E 75 0A 42 -2,-0.4 2,-0.3 13,-0.2 13,-0.2 -0.954 14.6 177.6-127.4 116.9 30.8 -0.3 14.3 63 63 A M E -E 74 0A 67 11,-2.8 11,-3.0 -2,-0.5 2,-0.4 -0.881 15.5-150.8-117.4 149.8 30.7 -0.8 18.1 64 64 A K E +E 73 0A 100 -2,-0.3 2,-0.3 9,-0.3 9,-0.2 -0.974 22.1 167.6-120.4 132.2 29.1 -3.5 20.1 65 65 A T E -E 72 0A 45 7,-2.4 7,-2.0 -2,-0.4 6,-0.1 -0.880 34.3-155.0-137.0 169.4 27.8 -3.0 23.7 66 66 A E + 0 0 87 -2,-0.3 7,-0.1 4,-0.2 -1,-0.0 0.308 57.3 124.7-123.8 -0.1 25.7 -4.7 26.3 67 67 A R S S- 0 0 208 1,-0.2 -1,-0.0 5,-0.1 5,-0.0 -0.955 83.5 -8.1-121.2 137.4 24.5 -1.6 28.2 68 68 A P S S+ 0 0 86 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 -0.970 145.8 23.1 -79.7 -15.4 21.9 -0.7 28.8 69 69 A R S > S- 0 0 114 1,-0.0 3,-0.5 0, 0.0 -4,-0.1 -0.895 80.6-120.8-112.0 138.0 20.6 -3.5 26.6 70 70 A P T 3 S+ 0 0 67 0, 0.0 -4,-0.2 0, 0.0 20,-0.1 -0.327 95.9 30.9 -68.7 158.7 22.4 -6.7 25.7 71 71 A N T 3 S+ 0 0 25 1,-0.2 19,-2.1 -6,-0.1 2,-0.3 0.848 86.4 149.2 60.8 38.9 23.0 -7.3 22.0 72 72 A T E < -EF 65 89A 1 -7,-2.0 -7,-2.4 -3,-0.5 2,-0.4 -0.745 25.6-170.8-101.3 146.7 23.3 -3.6 21.2 73 73 A F E -EF 64 88A 0 15,-3.3 15,-3.1 -2,-0.3 2,-0.4 -0.993 8.5-149.9-137.0 148.8 25.4 -2.2 18.4 74 74 A I E -EF 63 87A 25 -11,-3.0 -11,-2.8 -2,-0.4 2,-0.5 -0.925 2.9-158.0-118.9 142.0 26.3 1.4 17.6 75 75 A I E -EF 62 86A 2 11,-2.6 11,-2.2 -2,-0.4 2,-0.6 -0.978 0.4-163.4-120.6 125.9 27.1 2.9 14.2 76 76 A R E +EF 61 85A 9 -15,-1.9 -15,-2.3 -2,-0.5 2,-0.3 -0.957 33.6 150.6-106.7 120.2 29.0 6.1 13.9 77 77 A C E - F 0 84A 6 7,-2.8 7,-3.3 -2,-0.6 2,-0.7 -0.921 47.9 -95.1-146.8 174.4 28.5 7.5 10.4 78 78 A L E - F 0 83A 74 -20,-0.5 2,-1.0 -22,-0.3 -22,-0.3 -0.825 22.6-170.4 -98.9 114.0 28.3 10.5 8.1 79 79 A Q E > S- F 0 82A 77 3,-3.3 3,-1.4 -2,-0.7 2,-1.3 -0.803 74.2 -57.1-102.5 90.5 24.9 11.9 7.4 80 80 A W T 3 S- 0 0 221 -2,-1.0 -2,-0.1 1,-0.3 3,-0.0 -0.626 123.2 -18.2 76.7 -95.6 25.8 14.4 4.6 81 81 A T T 3 S+ 0 0 104 -2,-1.3 2,-0.4 2,-0.0 -1,-0.3 0.303 121.6 87.3-124.3 7.6 28.4 16.5 6.4 82 82 A T E < - F 0 79A 83 -3,-1.4 -3,-3.3 2,-0.0 2,-0.4 -0.916 69.3-136.5-113.8 131.8 27.6 15.6 10.0 83 83 A V E + F 0 78A 108 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.2 -0.698 33.7 178.1 -82.9 131.7 29.1 12.6 11.9 84 84 A I E - F 0 77A 26 -7,-3.3 -7,-2.8 -2,-0.4 2,-0.4 -0.926 25.0-140.5-134.0 160.0 26.3 10.9 13.9 85 85 A E E - F 0 76A 111 -2,-0.3 2,-0.4 -9,-0.2 -9,-0.2 -0.977 17.7-174.8-120.0 133.7 25.9 7.9 16.2 86 86 A R E - F 0 75A 76 -11,-2.2 -11,-2.6 -2,-0.4 2,-0.4 -0.990 11.9-147.8-127.6 141.5 22.8 5.7 16.1 87 87 A T E + F 0 74A 37 -2,-0.4 -72,-3.3 -72,-0.3 2,-0.3 -0.923 18.1 173.7-117.0 130.8 22.2 2.8 18.5 88 88 A F E -BF 14 73A 0 -15,-3.1 -15,-3.3 -2,-0.4 2,-0.4 -0.922 10.8-163.5-131.0 154.8 20.3 -0.4 17.7 89 89 A H E -BF 13 72A 3 -76,-2.0 -76,-2.7 -2,-0.3 -17,-0.2 -0.993 4.3-170.6-139.8 147.3 19.7 -3.7 19.6 90 90 A V - 0 0 3 -19,-2.1 -78,-0.1 -2,-0.4 6,-0.0 -0.644 37.2 -98.9-122.8-178.2 18.5 -7.1 18.4 91 91 A E S S+ 0 0 127 -2,-0.2 -19,-0.1 1,-0.1 -79,-0.0 0.837 95.5 22.2 -78.1 -33.9 17.4 -10.2 20.2 92 92 A T > - 0 0 51 -21,-0.1 4,-2.0 1,-0.1 3,-0.2 -0.935 69.3-121.3-135.3 156.7 20.5 -12.3 20.1 93 93 A P H > S+ 0 0 57 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.801 113.1 62.2 -66.7 -21.8 24.2 -11.9 19.8 94 94 A E H > S+ 0 0 125 1,-0.2 4,-1.4 2,-0.2 5,-0.1 0.916 107.2 42.1 -66.8 -42.4 24.0 -14.2 16.7 95 95 A E H > S+ 0 0 46 -3,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.837 109.6 57.4 -75.0 -28.9 21.8 -11.7 14.9 96 96 A R H X S+ 0 0 20 -4,-2.0 4,-2.8 1,-0.2 5,-0.2 0.926 106.9 49.9 -63.7 -41.5 23.8 -8.8 16.1 97 97 A E H X S+ 0 0 88 -4,-1.9 4,-2.2 1,-0.2 5,-0.2 0.843 106.9 54.5 -63.5 -35.9 26.9 -10.4 14.4 98 98 A E H X S+ 0 0 102 -4,-1.4 4,-1.8 2,-0.2 -1,-0.2 0.873 112.5 44.7 -66.0 -38.3 24.9 -10.9 11.2 99 99 A W H X S+ 0 0 5 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.903 115.6 43.6 -73.0 -44.5 24.1 -7.2 11.2 100 100 A T H X S+ 0 0 8 -4,-2.8 4,-2.1 2,-0.2 -2,-0.2 0.860 116.1 48.8 -72.6 -29.1 27.6 -5.9 12.0 101 101 A T H X S+ 0 0 75 -4,-2.2 4,-2.2 -5,-0.2 -2,-0.2 0.914 112.8 47.6 -73.8 -40.4 29.2 -8.3 9.6 102 102 A A H X S+ 0 0 12 -4,-1.8 4,-1.8 -5,-0.2 -2,-0.2 0.924 113.1 48.6 -65.0 -44.2 26.8 -7.4 6.8 103 103 A I H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.953 112.5 46.6 -61.6 -50.1 27.3 -3.7 7.4 104 104 A Q H X S+ 0 0 70 -4,-2.1 4,-3.2 1,-0.2 5,-0.2 0.920 109.8 54.3 -58.2 -45.8 31.1 -3.9 7.5 105 105 A T H X S+ 0 0 85 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.879 109.3 48.3 -55.7 -40.9 31.2 -6.0 4.3 106 106 A V H X S+ 0 0 2 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.933 111.4 49.3 -68.2 -43.5 29.1 -3.4 2.5 107 107 A A H X S+ 0 0 8 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.926 111.6 49.2 -60.9 -44.6 31.4 -0.6 3.7 108 108 A D H X S+ 0 0 92 -4,-3.2 4,-2.5 1,-0.2 -1,-0.2 0.875 109.8 53.1 -62.5 -37.0 34.4 -2.6 2.6 109 109 A G H X S+ 0 0 37 -4,-2.1 4,-1.0 -5,-0.2 -1,-0.2 0.862 107.5 49.6 -66.5 -37.3 32.8 -3.2 -0.8 110 110 A L H X S+ 0 0 38 -4,-2.1 4,-0.7 2,-0.2 -2,-0.2 0.937 111.9 49.3 -66.9 -44.3 32.1 0.5 -1.4 111 111 A K H >< S+ 0 0 69 -4,-2.2 3,-2.1 1,-0.2 -2,-0.2 0.966 112.4 45.7 -57.9 -55.1 35.7 1.3 -0.5 112 112 A K H >< S+ 0 0 75 -4,-2.5 3,-1.0 1,-0.3 -1,-0.2 0.724 104.2 66.5 -61.0 -20.1 37.1 -1.3 -2.9 113 113 A Q H 3< S+ 0 0 127 -4,-1.0 -1,-0.3 1,-0.3 -2,-0.2 0.717 75.3 78.8 -74.8 -20.7 34.6 -0.0 -5.4 114 114 A E T << 0 0 92 -3,-2.1 -1,-0.3 -4,-0.7 -2,-0.2 0.553 360.0 360.0 -61.3 0.6 36.6 3.3 -5.5 115 115 A E < 0 0 129 -3,-1.0 -1,-0.2 -5,-0.2 -2,-0.1 0.475 360.0 360.0 -0.6 360.0 38.5 0.7 -7.7