==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-MAR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 14-MAY-12 4AU8 . COMPND 2 MOLECULE: CYCLIN-DEPENDENT KINASE 5; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.MALMSTROM,J.VIKLUND,C.SLIVO,A.COSTA,M.MAUDET,C.SANDELIN,G. . 553 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26300.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 344 62.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 80 14.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.7 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 . 26 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 67 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 147 26.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.3 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 2 1 0 1 0 3 0 2 1 0 2 0 0 0 0 2 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 4 2 1 4 1 2 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 . 1 1 2 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 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 0 A G > 0 0 79 0, 0.0 3,-1.0 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0-115.0 -11.8 21.9 -2.3 2 1 A S G > + 0 0 28 1,-0.2 3,-1.6 2,-0.2 61,-0.0 0.894 360.0 58.5 -65.3 -42.2 -8.2 20.4 -2.5 3 2 A Q G 3 S+ 0 0 170 1,-0.3 -1,-0.2 3,-0.0 22,-0.0 0.389 82.2 86.1 -70.5 0.7 -8.6 20.1 -6.4 4 3 A K G < S+ 0 0 84 -3,-1.0 21,-3.6 20,-0.1 2,-0.5 0.638 85.1 68.8 -71.9 -16.5 -9.2 23.9 -6.5 5 4 A Y E < S-A 24 0A 25 -3,-1.6 2,-0.6 19,-0.2 19,-0.2 -0.912 72.3-149.8-112.3 132.3 -5.3 24.1 -6.6 6 5 A E E -A 23 0A 97 17,-3.0 17,-2.2 -2,-0.5 2,-0.3 -0.859 24.1-130.6 -94.6 122.0 -3.0 23.0 -9.5 7 6 A K E +A 22 0A 98 -2,-0.6 15,-0.2 15,-0.2 3,-0.1 -0.584 27.9 178.5 -74.9 127.5 0.4 21.9 -8.1 8 7 A L E - 0 0 66 13,-3.1 2,-0.3 1,-0.4 14,-0.2 0.849 56.1 -29.1 -97.4 -46.2 3.2 23.6 -10.1 9 8 A E E -A 21 0A 111 12,-1.2 12,-3.2 0, 0.0 2,-0.4 -0.929 61.1 -95.2-169.9 154.4 6.4 22.4 -8.4 10 9 A K E +A 20 0A 136 -2,-0.3 10,-0.3 10,-0.2 3,-0.1 -0.616 41.1 170.3 -73.6 121.9 8.0 21.2 -5.2 11 10 A I E - 0 0 58 8,-2.7 2,-0.3 -2,-0.4 9,-0.2 0.537 52.4 -26.6-112.5 -15.8 9.5 24.2 -3.5 12 11 A G E -A 19 0A 27 7,-1.8 7,-2.3 9,-0.0 2,-0.4 -0.986 47.6-104.1-173.6-174.6 10.4 22.8 -0.1 13 12 A E E -A 18 0A 124 -2,-0.3 5,-0.2 5,-0.3 2,-0.1 -0.994 29.3-168.3-134.3 129.3 10.2 20.6 3.0 14 13 A G - 0 0 21 3,-2.9 3,-0.2 -2,-0.4 5,-0.0 -0.309 47.4 -82.8 -99.8-168.4 8.7 21.8 6.3 15 14 A T S S+ 0 0 28 1,-0.2 25,-0.1 -2,-0.1 3,-0.1 0.675 128.2 25.0 -72.5 -15.3 8.8 20.1 9.7 16 15 A Y S S- 0 0 34 1,-0.2 2,-0.3 24,-0.1 -1,-0.2 0.269 125.2 -35.0-135.3 11.4 5.9 17.8 8.7 17 16 A G S S- 0 0 19 -3,-0.2 -3,-2.9 19,-0.1 2,-0.3 -0.993 77.0 -34.3 167.7-158.6 5.8 17.5 4.9 18 17 A T E -A 13 0A 35 17,-0.5 17,-1.1 -2,-0.3 2,-0.4 -0.719 38.0-146.3-100.4 141.6 6.2 18.9 1.4 19 18 A V E -AB 12 34A 19 -7,-2.3 -8,-2.7 -2,-0.3 -7,-1.8 -0.915 17.9-167.5-109.0 134.1 5.7 22.5 0.2 20 19 A F E -AB 10 33A 38 13,-2.6 13,-3.1 -2,-0.4 2,-0.4 -0.926 25.4-129.3-118.9 145.8 4.4 23.2 -3.3 21 20 A K E +AB 9 32A 48 -12,-3.2 -13,-3.1 -2,-0.4 -12,-1.2 -0.737 47.6 174.7 -82.5 134.4 4.2 26.3 -5.4 22 21 A A E -AB 7 31A 0 9,-2.6 9,-3.0 -2,-0.4 2,-0.4 -0.971 30.3-134.5-145.2 161.9 0.5 26.1 -6.6 23 22 A K E -AB 6 30A 57 -17,-2.2 -17,-3.0 -2,-0.3 2,-0.4 -0.980 23.3-125.0-121.4 130.4 -2.1 28.1 -8.6 24 23 A N E > -A 5 0A 17 5,-2.7 4,-2.4 -2,-0.4 -19,-0.2 -0.620 21.7-147.0 -67.8 122.6 -5.7 28.6 -7.5 25 24 A R T 4 S+ 0 0 157 -21,-3.6 -1,-0.1 -2,-0.4 -20,-0.1 0.802 92.7 47.0 -68.1 -28.4 -7.7 27.3 -10.5 26 25 A E T 4 S+ 0 0 161 -22,-0.3 -1,-0.2 1,-0.1 -21,-0.1 0.745 131.4 16.1 -80.6 -33.5 -10.6 29.8 -10.1 27 26 A T T 4 S- 0 0 94 2,-0.1 -2,-0.2 -3,-0.1 -1,-0.1 0.490 89.6-129.4-120.1 -12.0 -8.5 33.0 -9.6 28 27 A H < + 0 0 119 -4,-2.4 2,-0.2 1,-0.2 -3,-0.1 0.583 50.8 156.7 66.3 14.1 -5.0 32.0 -10.8 29 28 A E - 0 0 107 -5,-0.1 -5,-2.7 -6,-0.1 2,-0.4 -0.509 42.2-127.7 -67.6 137.5 -3.5 33.4 -7.6 30 29 A I E +B 23 0A 60 -7,-0.2 43,-0.5 -2,-0.2 2,-0.3 -0.747 38.1 169.5 -87.3 132.5 -0.1 31.8 -6.9 31 30 A V E -BC 22 72A 1 -9,-3.0 -9,-2.6 -2,-0.4 2,-0.5 -0.858 38.3-116.6-133.6 170.2 0.2 30.2 -3.4 32 31 A A E -BC 21 71A 9 39,-2.6 39,-3.6 -2,-0.3 2,-0.5 -0.954 36.7-158.2-108.8 128.9 2.6 28.0 -1.3 33 32 A L E -BC 20 70A 1 -13,-3.1 -13,-2.6 -2,-0.5 2,-0.5 -0.949 14.2-168.6-117.2 129.6 0.7 24.8 -0.4 34 33 A K E -BC 19 69A 3 35,-2.7 35,-3.3 -2,-0.5 2,-0.4 -0.974 13.3-167.5-114.9 120.1 1.5 22.4 2.5 35 34 A R E C 0 68A 46 -17,-1.1 -17,-0.5 -2,-0.5 33,-0.2 -0.916 360.0 360.0-113.0 142.2 -0.4 19.1 2.4 36 35 A V 0 0 58 31,-2.3 31,-2.7 -2,-0.4 -19,-0.1 -0.976 360.0 360.0-143.8 360.0 -0.6 16.5 5.2 37 ! 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 38 45 A P > 0 0 99 0, 0.0 4,-2.1 0, 0.0 3,-0.4 0.000 360.0 360.0 360.0 146.7 -0.3 15.9 13.2 39 46 A S H > + 0 0 40 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.766 360.0 58.0 -57.7 -37.1 0.7 18.2 16.1 40 47 A S H > S+ 0 0 6 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.882 109.9 42.7 -66.2 -39.3 3.0 20.3 13.8 41 48 A A H > S+ 0 0 0 -3,-0.4 4,-2.1 2,-0.2 -2,-0.2 0.910 115.6 48.5 -71.7 -47.3 0.2 21.2 11.4 42 49 A L H X S+ 0 0 56 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.914 112.8 48.9 -59.9 -42.4 -2.3 21.9 14.2 43 50 A R H X S+ 0 0 2 -4,-2.5 4,-2.4 1,-0.2 5,-0.2 0.894 109.0 52.1 -66.1 -39.5 0.2 24.0 16.0 44 51 A E H X S+ 0 0 0 -4,-1.8 4,-2.9 2,-0.2 5,-0.2 0.916 111.7 46.4 -63.3 -40.6 1.1 26.1 12.9 45 52 A I H X S+ 0 0 28 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.940 112.3 51.0 -65.2 -48.3 -2.6 26.8 12.3 46 53 A C H < S+ 0 0 13 -4,-2.4 4,-0.5 2,-0.2 -2,-0.2 0.876 117.7 38.4 -56.9 -43.5 -3.2 27.7 15.9 47 54 A L H >X S+ 0 0 0 -4,-2.4 4,-1.5 2,-0.2 3,-1.4 0.939 114.7 50.9 -74.9 -49.5 -0.3 30.2 16.0 48 55 A L H 3< S+ 0 0 2 -4,-2.9 11,-0.3 1,-0.3 -2,-0.2 0.786 100.8 63.2 -65.3 -21.0 -0.6 31.7 12.6 49 56 A K T 3< S+ 0 0 135 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.817 116.4 32.3 -70.6 -20.2 -4.2 32.5 13.1 50 57 A E T <4 S+ 0 0 94 -3,-1.4 2,-0.8 -4,-0.5 -2,-0.2 0.565 106.0 74.7-109.0 -13.6 -3.0 34.8 15.9 51 58 A L < + 0 0 2 -4,-1.5 2,-0.6 2,-0.0 -1,-0.1 -0.805 54.5 163.3-107.6 91.3 0.4 36.0 14.6 52 59 A K + 0 0 117 -2,-0.8 2,-0.3 -3,-0.1 5,-0.1 -0.947 15.2 136.1-111.8 114.2 -0.3 38.5 11.8 53 60 A H > - 0 0 44 -2,-0.6 3,-2.0 3,-0.4 51,-0.0 -0.978 62.4-116.2-155.7 146.4 2.7 40.6 10.9 54 61 A K T 3 S+ 0 0 160 -2,-0.3 4,-0.1 1,-0.3 50,-0.1 0.707 117.6 50.4 -59.7 -21.3 4.3 41.8 7.6 55 62 A N T 3 S+ 0 0 7 77,-0.1 78,-2.5 2,-0.1 2,-0.4 0.158 98.8 78.7-103.6 19.2 7.5 39.8 8.5 56 63 A I B < S-e 133 0B 2 -3,-2.0 -3,-0.4 76,-0.3 78,-0.2 -0.995 92.3-105.1-125.6 133.1 5.5 36.5 9.2 57 64 A V - 0 0 5 76,-2.8 2,-0.4 -2,-0.4 -4,-0.1 -0.210 38.3-120.4 -55.3 138.9 4.3 34.3 6.4 58 65 A R - 0 0 128 -4,-0.1 14,-2.0 -6,-0.1 2,-0.7 -0.721 11.5-147.9 -86.8 136.1 0.5 34.6 5.9 59 66 A L E +D 71 0A 16 -2,-0.4 12,-0.2 -11,-0.3 3,-0.1 -0.912 20.4 178.5 -99.3 106.8 -1.7 31.6 6.3 60 67 A H E - 0 0 79 10,-2.7 2,-0.3 -2,-0.7 11,-0.2 0.898 55.4 -10.6 -77.6 -47.7 -4.5 32.3 3.8 61 68 A D E -D 70 0A 79 9,-1.6 9,-3.0 2,-0.0 2,-0.4 -0.965 45.8-141.4-154.9 163.3 -6.6 29.2 4.1 62 69 A V E -D 69 0A 31 -2,-0.3 2,-0.4 7,-0.2 7,-0.2 -0.998 18.8-163.7-128.1 126.7 -7.0 25.6 5.5 63 70 A L E D 68 0A 21 5,-2.8 5,-3.1 -2,-0.4 -2,-0.0 -0.948 360.0 360.0-112.7 136.5 -8.8 22.9 3.4 64 71 A H 0 0 169 -2,-0.4 3,-0.3 3,-0.2 -62,-0.1 -0.857 360.0 360.0-105.1 360.0 -10.0 19.7 5.0 65 ! 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 66 75 A K 0 0 190 0, 0.0 2,-0.4 0, 0.0 -64,-0.0 0.000 360.0 360.0 360.0 142.2 -6.3 15.3 3.8 67 76 A L - 0 0 33 -31,-2.7 -31,-2.3 -3,-0.3 2,-0.5 -0.986 360.0-168.4-122.3 122.9 -5.3 18.7 5.3 68 77 A T E -CD 35 63A 0 -5,-3.1 -5,-2.8 -2,-0.4 2,-0.5 -0.963 6.6-160.4-117.2 127.1 -4.1 21.5 3.1 69 78 A L E -CD 34 62A 0 -35,-3.3 -35,-2.7 -2,-0.5 2,-0.7 -0.924 10.2-154.1-105.8 123.3 -2.5 24.7 4.4 70 79 A V E -CD 33 61A 1 -9,-3.0 -10,-2.7 -2,-0.5 -9,-1.6 -0.884 20.0-179.5-102.9 111.8 -2.6 27.6 1.9 71 80 A F E -CD 32 59A 10 -39,-3.6 -39,-2.6 -2,-0.7 -12,-0.2 -0.701 35.5 -88.7-108.2 162.1 0.2 30.2 2.3 72 81 A E E -C 31 0A 6 -14,-2.0 2,-0.5 -2,-0.2 -41,-0.2 -0.351 48.1-123.4 -52.4 140.3 1.4 33.4 0.8 73 82 A F - 0 0 40 -43,-0.5 2,-0.4 -42,-0.1 -43,-0.1 -0.845 28.4-178.5-100.4 127.5 3.9 32.7 -2.1 74 83 A C - 0 0 11 -2,-0.5 52,-0.2 52,-0.1 51,-0.0 -0.954 30.5-129.5-117.2 141.1 7.4 34.3 -2.0 75 84 A D S S+ 0 0 75 -2,-0.4 2,-0.3 49,-0.1 51,-0.2 0.745 83.7 17.1 -64.4 -27.2 9.7 33.6 -5.0 76 85 A Q E -F 125 0B 58 49,-1.5 49,-3.0 4,-0.0 2,-0.2 -0.966 60.7-136.9-141.5 159.2 12.7 32.4 -2.9 77 86 A D E > -F 124 0B 21 -2,-0.3 4,-2.1 47,-0.3 47,-0.3 -0.618 48.7 -98.7 -99.0 170.3 13.8 31.2 0.6 78 87 A L H > S+ 0 0 0 45,-2.2 4,-2.8 42,-1.4 43,-0.2 0.805 123.7 58.2 -64.1 -30.2 17.0 32.8 1.9 79 88 A K H > S+ 0 0 89 41,-0.5 4,-2.1 44,-0.2 -1,-0.2 0.940 110.5 42.6 -62.5 -46.6 19.1 29.7 0.8 80 89 A K H > S+ 0 0 104 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.854 112.4 54.7 -66.2 -37.9 17.9 30.2 -2.8 81 90 A Y H X S+ 0 0 43 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.933 108.9 47.7 -60.5 -47.8 18.5 34.0 -2.4 82 91 A F H X S+ 0 0 12 -4,-2.8 4,-1.5 2,-0.2 5,-0.4 0.896 109.3 53.3 -59.7 -44.2 22.1 33.3 -1.3 83 92 A D H < S+ 0 0 101 -4,-2.1 3,-0.3 1,-0.2 -1,-0.2 0.916 112.0 45.7 -56.0 -44.6 22.7 30.8 -4.3 84 93 A S H < S+ 0 0 91 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.782 106.4 58.0 -70.1 -32.1 21.5 33.6 -6.7 85 94 A C H < S- 0 0 44 -4,-1.9 -1,-0.2 -5,-0.1 -2,-0.2 0.806 83.2-168.8 -67.5 -32.9 23.6 36.3 -5.0 86 95 A N < + 0 0 146 -4,-1.5 2,-0.3 -3,-0.3 -3,-0.1 0.863 61.7 0.9 45.3 52.6 26.7 34.1 -5.7 87 96 A G S S+ 0 0 33 101,-0.4 101,-0.1 -5,-0.4 -2,-0.0 -0.840 114.9 9.4 132.3-172.8 29.0 36.2 -3.5 88 97 A D - 0 0 95 -2,-0.3 2,-0.3 1,-0.1 98,-0.1 0.031 60.5-138.8 -42.1 134.0 28.8 39.3 -1.3 89 98 A L - 0 0 10 96,-0.4 99,-0.1 97,-0.1 -1,-0.1 -0.763 36.9 -94.2 -88.5 149.1 25.4 40.7 -0.5 90 99 A D >> - 0 0 86 -2,-0.3 4,-2.0 1,-0.1 3,-1.5 -0.425 34.3-124.9 -60.4 129.3 25.1 44.5 -0.5 91 100 A P H 3> S+ 0 0 73 0, 0.0 4,-1.9 0, 0.0 -1,-0.1 0.770 111.8 57.4 -49.0 -27.6 25.7 45.7 3.1 92 101 A E H 3> S+ 0 0 86 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.822 105.9 47.9 -73.1 -31.2 22.3 47.5 2.9 93 102 A I H <> S+ 0 0 52 -3,-1.5 4,-3.0 2,-0.2 5,-0.2 0.890 108.9 54.7 -73.3 -39.8 20.5 44.3 2.0 94 103 A V H X S+ 0 0 5 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.921 112.6 43.5 -54.8 -50.5 22.3 42.6 4.9 95 104 A K H X S+ 0 0 8 -4,-1.9 4,-2.7 2,-0.2 -2,-0.2 0.903 114.1 49.2 -62.7 -49.2 20.9 45.3 7.3 96 105 A S H X S+ 0 0 29 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.913 112.8 47.4 -59.0 -48.5 17.4 45.3 5.8 97 106 A F H X S+ 0 0 4 -4,-3.0 4,-2.3 2,-0.2 -2,-0.2 0.926 115.0 45.6 -64.4 -41.4 17.1 41.4 6.0 98 107 A L H X S+ 0 0 0 -4,-2.4 4,-2.6 -5,-0.2 -2,-0.2 0.923 111.8 52.3 -65.9 -42.4 18.4 41.4 9.6 99 108 A F H X S+ 0 0 50 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.931 113.1 44.7 -54.5 -50.3 16.1 44.4 10.6 100 109 A Q H X S+ 0 0 22 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.872 111.6 51.9 -64.4 -41.6 13.0 42.5 9.1 101 110 A L H X S+ 0 0 0 -4,-2.3 4,-2.8 1,-0.2 -1,-0.2 0.932 112.2 46.4 -60.7 -46.7 14.0 39.1 10.7 102 111 A L H X S+ 0 0 0 -4,-2.6 4,-2.8 2,-0.2 -2,-0.2 0.819 110.4 53.8 -65.6 -32.9 14.3 40.9 14.2 103 112 A K H X S+ 0 0 86 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.913 112.6 43.6 -66.1 -43.9 10.9 42.7 13.6 104 113 A G H X S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.910 117.7 44.6 -66.0 -47.4 9.2 39.3 12.9 105 114 A L H X S+ 0 0 0 -4,-2.8 4,-3.1 2,-0.2 5,-0.2 0.905 111.1 54.6 -62.1 -43.3 11.0 37.7 15.9 106 115 A G H X S+ 0 0 17 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.869 107.8 50.0 -55.8 -43.7 10.2 40.7 18.1 107 116 A F H X S+ 0 0 32 -4,-1.8 4,-0.8 2,-0.2 -1,-0.2 0.911 114.2 44.6 -61.6 -47.7 6.5 40.3 17.3 108 117 A C H ><>S+ 0 0 0 -4,-1.9 5,-2.5 1,-0.2 3,-1.0 0.952 113.7 48.7 -62.3 -51.3 6.6 36.6 18.1 109 118 A H H ><5S+ 0 0 25 -4,-3.1 3,-1.8 1,-0.3 -2,-0.2 0.866 106.4 56.1 -62.2 -35.3 8.6 37.0 21.3 110 119 A S H 3<5S+ 0 0 75 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.757 109.4 48.6 -69.2 -21.8 6.3 39.8 22.6 111 120 A R T <<5S- 0 0 95 -3,-1.0 -1,-0.3 -4,-0.8 -2,-0.2 0.128 124.1-107.1-101.2 18.2 3.4 37.3 22.1 112 121 A N T < 5S+ 0 0 29 -3,-1.8 30,-3.2 1,-0.2 2,-0.5 0.793 76.6 134.1 62.5 32.7 5.4 34.6 24.0 113 122 A V E < -H 141 0C 0 -5,-2.5 2,-0.4 28,-0.2 28,-0.2 -0.957 37.7-164.8-113.4 127.1 6.1 32.5 20.9 114 123 A L E -H 140 0C 4 26,-2.5 26,-1.9 -2,-0.5 57,-0.1 -0.919 12.3-150.5-105.5 140.1 9.6 31.1 20.2 115 124 A H - 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