==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 15-SEP-03 1UNR . COMPND 2 MOLECULE: RAC-ALPHA SERINE/THREONINE KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.C.MILBURN,M.DEAK,S.M.KELLY,N.C.PRICE,D.R.ALESSI, . 113 2 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7880.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 77 68.1 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 . 8 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 5 4.4 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 0 204 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 163.1 31.6 1.8 -5.3 2 4 A V - 0 0 77 26,-0.0 2,-0.3 28,-0.0 26,-0.0 -0.537 360.0-170.2 -85.1 133.0 28.5 1.7 -3.1 3 5 A A - 0 0 46 -2,-0.3 26,-2.5 0, 0.0 2,-0.3 -0.882 28.8-104.8-120.2 152.4 27.4 4.7 -1.1 4 6 A I E -A 28 0A 82 -2,-0.3 24,-0.3 24,-0.2 3,-0.1 -0.617 28.8-176.5 -72.6 129.7 24.9 5.3 1.7 5 7 A V E - 0 0 61 22,-3.1 2,-0.3 1,-0.4 23,-0.2 0.800 68.2 -9.5 -91.6 -43.0 21.8 7.1 0.3 6 8 A K E -A 27 0A 42 21,-1.4 21,-3.0 2,-0.0 -1,-0.4 -0.969 60.5-177.8-157.6 141.0 19.9 7.5 3.6 7 9 A E E +A 26 0A 82 -2,-0.3 2,-0.3 19,-0.2 19,-0.2 -0.980 24.5 109.6-140.2 154.8 20.2 6.2 7.2 8 10 A G E -A 25 0A 14 17,-2.2 17,-2.8 -2,-0.3 2,-0.3 -0.931 61.4 -53.0 162.8 177.3 18.1 6.6 10.3 9 11 A W E +A 24 0A 109 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.617 46.8 177.6 -81.9 137.8 15.7 5.1 12.8 10 12 A L E -A 23 0A 1 13,-2.8 13,-2.9 -2,-0.3 2,-0.6 -0.940 32.1-124.2-128.4 151.9 12.6 3.3 11.7 11 13 A H E -AB 22 83A 59 72,-2.5 72,-2.5 -2,-0.3 2,-0.5 -0.909 34.7-162.3 -89.3 118.8 9.9 1.5 13.6 12 14 A K E -AB 21 82A 14 9,-3.1 9,-2.5 -2,-0.6 2,-0.4 -0.899 12.1-134.7-107.1 132.8 9.7 -2.0 12.0 13 15 A R E -A 20 0A 58 68,-2.7 68,-0.5 -2,-0.5 7,-0.2 -0.664 29.2-112.7 -83.0 133.9 6.8 -4.3 12.4 14 16 A G - 0 0 23 5,-3.1 -1,-0.1 3,-0.4 6,-0.0 -0.324 12.9-140.3 -64.0 149.0 7.7 -7.9 13.2 15 17 A E S S+ 0 0 88 3,-0.1 3,-0.2 2,-0.1 -1,-0.1 0.863 100.0 19.4 -80.0 -40.4 7.0 -10.5 10.5 16 18 A Y S S+ 0 0 226 1,-0.3 2,-0.9 3,-0.1 -2,-0.1 0.897 134.0 39.3 -90.9 -60.3 5.8 -13.2 13.0 17 19 A I S S- 0 0 112 1,-0.1 2,-1.3 2,-0.1 -3,-0.4 -0.851 83.2-147.0 -91.8 108.2 5.0 -11.1 16.0 18 20 A K + 0 0 135 -2,-0.9 2,-0.2 -3,-0.2 -1,-0.1 -0.043 54.5 126.4 -73.2 30.0 3.4 -8.0 14.6 19 21 A T - 0 0 69 -2,-1.3 -5,-3.1 -6,-0.1 2,-0.5 -0.513 62.1-114.0 -82.9 161.4 4.8 -5.7 17.3 20 22 A W E +A 13 0A 48 -7,-0.2 -7,-0.2 -2,-0.2 62,-0.1 -0.840 34.0 179.2-102.4 128.9 6.8 -2.6 16.4 21 23 A R E -A 12 0A 146 -9,-2.5 -9,-3.1 -2,-0.5 2,-0.3 -0.969 31.8-110.3-129.7 145.1 10.5 -2.3 17.3 22 24 A P E +A 11 0A 66 0, 0.0 2,-0.3 0, 0.0 -11,-0.2 -0.563 39.8 176.9 -73.2 133.9 13.0 0.5 16.6 23 25 A R E -A 10 0A 47 -13,-2.9 -13,-2.8 -2,-0.3 2,-0.7 -0.997 29.4-131.7-137.7 139.4 15.7 -0.4 14.1 24 26 A Y E -AC 9 36A 4 12,-2.8 12,-2.4 -2,-0.3 2,-0.3 -0.861 34.2-165.7 -93.7 113.7 18.5 1.7 12.6 25 27 A F E -AC 8 35A 0 -17,-2.8 -17,-2.2 -2,-0.7 2,-0.4 -0.789 16.3-163.4-108.3 144.0 18.4 1.3 8.8 26 28 A L E -AC 7 34A 13 8,-2.6 8,-2.4 -2,-0.3 2,-0.5 -0.998 5.9-160.5-121.2 126.6 20.9 2.1 6.1 27 29 A L E -AC 6 33A 0 -21,-3.0 -22,-3.1 -2,-0.4 -21,-1.4 -0.946 11.6-163.9-102.8 125.7 19.9 2.3 2.4 28 30 A K E > -A 4 0A 38 4,-2.6 3,-2.1 -2,-0.5 -24,-0.2 -0.757 30.5-116.6-111.5 157.0 22.7 2.0 -0.1 29 31 A N T 3 S+ 0 0 75 -26,-2.5 -25,-0.1 1,-0.3 -1,-0.0 0.513 112.5 64.8 -80.4 -0.2 22.6 2.9 -3.7 30 32 A D T 3 S- 0 0 68 -27,-0.2 -1,-0.3 2,-0.1 22,-0.1 0.379 125.3-100.6 -87.9 2.0 23.2 -0.7 -4.8 31 33 A G S < S+ 0 0 0 -3,-2.1 20,-2.3 1,-0.3 21,-0.2 0.298 73.7 148.1 98.5 -6.2 19.8 -1.5 -3.2 32 34 A T E - D 0 50A 37 18,-0.2 -4,-2.6 19,-0.1 2,-0.5 -0.414 24.4-173.1 -59.9 130.4 21.0 -2.9 0.1 33 35 A F E +CD 27 49A 0 16,-1.4 16,-2.4 -6,-0.2 2,-0.4 -0.958 10.8 176.0-128.7 111.7 18.7 -2.1 2.9 34 36 A I E -CD 26 48A 18 -8,-2.4 -8,-2.6 -2,-0.5 2,-0.4 -0.950 11.5-163.4-127.3 134.4 20.1 -3.2 6.2 35 37 A G E -CD 25 47A 0 12,-2.4 11,-2.1 -2,-0.4 12,-2.0 -0.955 3.8-168.8-125.9 139.0 18.7 -2.7 9.8 36 38 A Y E -C 24 0A 21 -12,-2.4 -12,-2.8 -2,-0.4 3,-0.1 -0.845 32.5-127.3-123.5 154.0 20.4 -3.0 13.1 37 39 A K S S+ 0 0 154 -2,-0.3 2,-0.3 -14,-0.2 -1,-0.1 0.856 100.8 22.2 -64.8 -34.2 19.2 -3.1 16.7 38 40 A E S S- 0 0 127 -14,-0.1 -1,-0.1 -15,-0.1 -14,-0.1 -0.941 101.8 -82.4-133.1 155.7 21.6 -0.2 17.4 39 41 A R 0 0 146 -2,-0.3 -2,-0.0 1,-0.1 -14,-0.0 -0.382 360.0 360.0 -53.0 116.3 23.3 2.5 15.4 40 42 A P 0 0 99 0, 0.0 -1,-0.1 0, 0.0 3,-0.0 0.537 360.0 360.0 -60.3 360.0 26.4 0.8 13.9 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 0 265 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -28.5 30.2 -5.6 13.3 43 49 A E - 0 0 155 2,-0.1 0, 0.0 -3,-0.0 0, 0.0 0.475 360.0 -97.0 78.7 115.6 27.3 -7.2 15.0 44 50 A A - 0 0 81 1,-0.1 2,-0.1 -2,-0.1 3,-0.0 -0.205 40.3-110.0 -52.2 143.2 25.1 -8.8 12.4 45 51 A P - 0 0 44 0, 0.0 -9,-0.3 0, 0.0 -1,-0.1 -0.454 11.7-139.9 -72.0 155.6 22.1 -6.8 11.2 46 52 A L S S+ 0 0 94 -11,-2.1 2,-0.4 1,-0.2 -10,-0.2 0.756 90.3 32.6 -83.0 -26.6 18.7 -8.0 12.2 47 53 A N E +D 35 0A 26 -12,-2.0 -12,-2.4 2,-0.0 2,-0.2 -0.981 62.2 165.6-133.0 144.1 17.3 -7.2 8.7 48 54 A N E +D 34 0A 113 -2,-0.4 2,-0.3 -14,-0.2 -14,-0.2 -0.746 17.8 135.2-162.7 102.2 19.0 -7.4 5.3 49 55 A F E -D 33 0A 27 -16,-2.4 -16,-1.4 -2,-0.2 2,-0.3 -0.996 47.0-112.1-153.5 150.5 17.3 -7.3 2.0 50 56 A S E -D 32 0A 54 -2,-0.3 -18,-0.2 -18,-0.2 -19,-0.1 -0.639 9.9-156.1 -81.8 139.8 17.5 -5.7 -1.4 51 57 A V > + 0 0 0 -20,-2.3 3,-2.0 -2,-0.3 -1,-0.1 0.392 53.5 126.7 -92.2 -2.1 15.0 -3.1 -2.5 52 58 A A T 3 S+ 0 0 24 1,-0.3 3,-0.1 -21,-0.2 49,-0.1 -0.354 81.6 6.7 -44.9 125.7 15.7 -3.8 -6.2 53 59 A Q T 3 S+ 0 0 140 48,-0.3 19,-0.5 1,-0.2 -1,-0.3 0.647 103.6 133.1 64.4 17.2 12.6 -4.7 -8.1 54 60 A a E < -E 71 0A 18 -3,-2.0 2,-0.3 17,-0.2 17,-0.2 -0.559 48.9-134.4 -96.6 165.4 10.4 -3.8 -5.1 55 61 A Q E -E 70 0A 108 15,-2.9 15,-3.0 -2,-0.2 2,-0.4 -0.893 11.7-138.0-114.4 141.5 7.2 -1.7 -4.8 56 62 A L E -E 69 0A 34 -2,-0.3 2,-0.3 13,-0.2 13,-0.2 -0.895 19.5-176.1-103.1 136.5 6.4 0.9 -2.2 57 63 A M E -E 68 0A 49 11,-2.4 11,-2.6 -2,-0.4 2,-0.4 -0.936 11.6-150.4-124.3 147.8 3.0 1.2 -0.6 58 64 A K E +E 67 0A 86 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.947 20.7 167.6-115.6 141.9 1.7 3.8 1.9 59 65 A T E -E 66 0A 50 7,-2.1 7,-1.9 -2,-0.4 6,-0.1 -0.961 31.7-153.6-146.2 163.9 -1.0 3.1 4.5 60 66 A E + 0 0 80 -2,-0.3 -1,-0.0 4,-0.2 7,-0.0 0.311 56.4 119.7-118.2 2.6 -2.4 4.8 7.6 61 67 A R S S- 0 0 206 1,-0.2 -1,-0.1 5,-0.1 4,-0.0 -0.989 83.3 -4.9-134.2 141.1 -3.7 1.8 9.5 62 68 A P S S+ 0 0 86 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 -0.983 145.2 22.9 -73.1 -13.8 -3.2 0.6 12.1 63 69 A R S > S- 0 0 79 1,-0.0 3,-0.6 -4,-0.0 -4,-0.1 -0.923 80.8-123.2-113.0 134.3 -0.5 3.3 12.4 64 70 A P T 3 S+ 0 0 72 0, 0.0 20,-0.3 0, 0.0 -4,-0.2 -0.284 94.5 31.8 -61.7 155.6 -0.4 6.6 10.4 65 71 A N T 3 S+ 0 0 20 1,-0.2 19,-1.6 18,-0.1 2,-0.3 0.871 84.0 153.5 64.5 37.3 2.7 7.2 8.3 66 72 A T E < -EF 59 83A 4 -7,-1.9 -7,-2.1 -3,-0.6 2,-0.4 -0.741 22.5-171.4 -92.6 142.8 3.3 3.6 7.5 67 73 A F E -EF 58 82A 0 15,-2.6 15,-2.9 -2,-0.3 2,-0.4 -0.987 6.3-155.2-131.8 150.9 5.1 2.4 4.4 68 74 A I E -EF 57 81A 25 -11,-2.6 -11,-2.4 -2,-0.4 2,-0.6 -0.976 7.0-150.9-125.6 132.2 5.5 -1.1 3.1 69 75 A I E -EF 56 80A 1 11,-2.8 11,-2.1 -2,-0.4 2,-0.5 -0.932 18.7-167.4 -98.5 121.7 8.2 -2.5 0.8 70 76 A R E -EF 55 79A 93 -15,-3.0 -15,-2.9 -2,-0.6 2,-0.5 -0.962 6.5-176.3-116.9 127.5 6.9 -5.4 -1.3 71 77 A a E -EF 54 78A 2 7,-2.4 7,-2.4 -2,-0.5 2,-0.6 -0.984 16.0-150.2-125.6 121.7 9.2 -7.7 -3.2 72 78 A L E + F 0 77A 121 -19,-0.5 2,-0.4 -2,-0.5 5,-0.2 -0.890 26.9 171.9 -97.4 118.9 7.9 -10.4 -5.5 73 79 A Q E > - F 0 76A 76 3,-2.7 3,-2.0 -2,-0.6 2,-0.9 -0.906 55.6 -49.0-142.2 98.9 10.5 -13.2 -5.5 74 80 A W T 3 S- 0 0 250 -2,-0.4 3,-0.0 1,-0.3 -2,-0.0 -0.619 122.5 -26.7 74.2-103.3 10.1 -16.6 -7.1 75 81 A T T 3 S+ 0 0 136 -2,-0.9 2,-0.5 1,-0.0 -1,-0.3 0.622 125.9 85.4-106.9 -14.2 6.7 -17.7 -5.7 76 82 A T E < - F 0 73A 67 -3,-2.0 -3,-2.7 -4,-0.0 2,-0.7 -0.662 60.1-155.6 -96.8 127.2 6.9 -15.6 -2.6 77 83 A V E - F 0 72A 70 -2,-0.5 2,-0.3 -5,-0.2 -5,-0.2 -0.920 18.7-156.0 -94.6 125.9 6.0 -12.0 -2.2 78 84 A I E - F 0 71A 35 -7,-2.4 -7,-2.4 -2,-0.7 2,-0.4 -0.717 6.8-166.0 -92.1 133.3 7.9 -10.5 0.8 79 85 A E E - F 0 70A 68 -2,-0.3 2,-0.4 -9,-0.2 -9,-0.2 -0.993 5.8-169.3-127.1 136.9 6.5 -7.5 2.6 80 86 A R E - F 0 69A 58 -11,-2.1 -11,-2.8 -2,-0.4 2,-0.4 -0.997 13.9-154.5-129.1 124.5 8.5 -5.3 5.1 81 87 A T E + F 0 68A 18 -68,-0.5 -68,-2.7 -2,-0.4 2,-0.3 -0.890 14.4 177.6-116.4 130.7 6.5 -2.8 7.1 82 88 A F E -BF 12 67A 0 -15,-2.9 -15,-2.6 -2,-0.4 2,-0.3 -0.912 11.7-161.6-134.1 148.9 7.8 0.4 8.6 83 89 A H E -BF 11 66A 12 -72,-2.5 -72,-2.5 -2,-0.3 2,-0.3 -0.986 6.6-178.8-132.5 142.3 6.5 3.4 10.6 84 90 A V - 0 0 5 -19,-1.6 6,-0.1 -2,-0.3 -74,-0.1 -0.882 37.8-110.0-132.6 168.2 7.8 6.9 11.2 85 91 A E S S+ 0 0 145 -2,-0.3 -19,-0.1 2,-0.0 3,-0.0 0.724 92.4 29.3 -80.3 -20.3 6.4 9.8 13.2 86 92 A T S > S- 0 0 44 -21,-0.1 4,-2.0 1,-0.1 5,-0.1 -0.936 71.3-122.4-136.9 158.6 5.4 12.2 10.4 87 93 A P H > S+ 0 0 62 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.852 113.1 59.0 -67.4 -29.0 4.2 12.1 6.8 88 94 A E H > S+ 0 0 130 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.925 106.8 46.3 -64.1 -45.9 7.2 14.3 5.8 89 95 A E H > S+ 0 0 77 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.924 110.0 55.0 -57.1 -48.0 9.7 11.7 7.2 90 96 A R H X S+ 0 0 20 -4,-2.0 4,-3.0 1,-0.2 5,-0.2 0.923 106.7 49.7 -63.1 -43.0 7.7 9.0 5.4 91 97 A E H X S+ 0 0 102 -4,-2.3 4,-2.6 1,-0.2 5,-0.3 0.863 106.4 56.8 -60.1 -36.4 8.1 10.8 2.1 92 98 A E H X S+ 0 0 102 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.944 113.2 40.5 -58.8 -45.8 11.9 11.2 2.8 93 99 A W H X S+ 0 0 10 -4,-2.0 4,-2.6 2,-0.2 5,-0.2 0.937 116.0 47.2 -70.4 -45.7 12.2 7.4 3.1 94 100 A T H X S+ 0 0 10 -4,-3.0 4,-2.8 1,-0.2 5,-0.2 0.902 112.8 49.8 -68.6 -36.2 9.9 6.4 0.3 95 101 A T H X S+ 0 0 75 -4,-2.6 4,-2.5 -5,-0.2 -1,-0.2 0.916 112.3 48.4 -61.6 -44.9 11.5 8.9 -2.2 96 102 A A H X S+ 0 0 12 -4,-1.9 4,-2.1 -5,-0.3 -2,-0.2 0.949 114.9 44.2 -61.7 -48.1 14.9 7.6 -1.3 97 103 A I H X S+ 0 0 4 -4,-2.6 4,-2.8 1,-0.2 5,-0.2 0.935 114.2 49.4 -64.7 -45.1 13.9 4.0 -1.7 98 104 A Q H X S+ 0 0 72 -4,-2.8 4,-2.8 -5,-0.2 -1,-0.2 0.893 109.4 52.2 -62.1 -39.2 12.0 4.6 -4.9 99 105 A T H X S+ 0 0 83 -4,-2.5 4,-2.2 -5,-0.2 -1,-0.2 0.935 111.3 46.9 -64.1 -41.1 15.0 6.6 -6.4 100 106 A V H X S+ 0 0 11 -4,-2.1 4,-2.1 -5,-0.2 -2,-0.2 0.949 113.4 48.3 -64.9 -45.6 17.4 3.7 -5.6 101 107 A A H X S+ 0 0 6 -4,-2.8 4,-2.4 1,-0.2 -48,-0.3 0.906 111.1 51.0 -60.7 -40.3 14.9 1.1 -7.1 102 108 A D H X S+ 0 0 71 -4,-2.8 4,-2.2 2,-0.2 -1,-0.2 0.880 107.2 53.0 -68.0 -35.9 14.5 3.3 -10.2 103 109 A G H X S+ 0 0 39 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.929 112.7 45.2 -60.3 -44.0 18.2 3.6 -10.7 104 110 A L H X S+ 0 0 30 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.853 109.9 54.3 -71.2 -34.4 18.5 -0.2 -10.5 105 111 A K H X S+ 0 0 110 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.902 106.8 51.7 -65.8 -39.2 15.5 -0.7 -12.8 106 112 A K H X S+ 0 0 114 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.949 110.3 49.1 -59.6 -47.0 17.1 1.6 -15.4 107 113 A Q H X S+ 0 0 100 -4,-1.9 4,-0.9 2,-0.2 -2,-0.2 0.921 109.5 51.9 -57.6 -43.0 20.3 -0.6 -15.2 108 114 A E H >X S+ 0 0 64 -4,-2.2 4,-2.3 1,-0.2 3,-1.0 0.941 109.0 50.0 -61.1 -45.9 18.2 -3.8 -15.6 109 115 A E H 3X S+ 0 0 89 -4,-2.5 4,-1.7 1,-0.3 -1,-0.2 0.870 105.1 57.6 -61.7 -36.4 16.5 -2.4 -18.7 110 116 A E H 3< S+ 0 0 132 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.751 114.7 39.2 -66.3 -19.7 19.9 -1.5 -20.2 111 117 A E H << S+ 0 0 130 -3,-1.0 -2,-0.2 -4,-0.9 -1,-0.2 0.859 120.7 38.0 -96.3 -38.4 20.9 -5.2 -19.8 112 118 A M H < S+ 0 0 125 -4,-2.3 -3,-0.2 -5,-0.1 -2,-0.1 0.831 92.0 92.1 -87.0 -40.6 17.8 -7.1 -20.8 113 119 A D < 0 0 94 -4,-1.7 -4,-0.0 1,-0.3 0, 0.0 -0.362 360.0 360.0 -67.7 129.9 16.3 -5.1 -23.6 114 120 A F 0 0 256 -2,-0.1 -1,-0.3 0, 0.0 -2,-0.1 0.782 360.0 360.0 53.5 360.0 17.3 -6.0 -27.2