==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 23-AUG-06 2I50 . COMPND 2 MOLECULE: UBIQUITIN CARBOXYL-TERMINAL HYDROLASE 16; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.-T.PAI . 122 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7526.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 72 59.0 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 . 16 13.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 2.5 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 . 0 0.0 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 . 12 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 9 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 30 24.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.8 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 0 0 1 1 0 0 0 0 1 0 0 0 0 0 0 0 0 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 0 4 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 5 A P 0 0 169 0, 0.0 2,-0.3 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 -43.8 6.2 -22.7 -7.2 2 6 A V - 0 0 50 100,-0.0 2,-0.3 102,-0.0 102,-0.1 -0.903 360.0 -64.8-168.4-179.3 4.6 -19.6 -6.1 3 7 A C - 0 0 5 100,-0.4 3,-0.2 -2,-0.3 95,-0.0 -0.672 33.5-166.1 -85.4 140.1 3.8 -17.7 -2.9 4 8 A R S S+ 0 0 168 -2,-0.3 3,-0.2 1,-0.1 4,-0.2 0.255 77.4 80.8-110.5 11.6 1.4 -19.5 -0.6 5 9 A H > + 0 0 56 1,-0.2 4,-1.7 2,-0.1 5,-0.2 0.122 60.2 115.5 -99.2 19.2 0.8 -16.5 1.6 6 10 A I H >> S+ 0 0 15 1,-0.2 4,-1.0 -3,-0.2 3,-0.8 0.961 80.0 34.9 -56.0 -59.6 -1.7 -15.4 -1.1 7 11 A R H 34 S+ 0 0 188 1,-0.3 -1,-0.2 -3,-0.2 -2,-0.1 0.810 115.3 59.4 -66.9 -29.1 -4.8 -15.6 1.0 8 12 A K H 34 S+ 0 0 95 1,-0.2 74,-1.1 -4,-0.2 -1,-0.3 0.791 120.3 27.0 -69.9 -27.2 -2.8 -14.5 4.0 9 13 A G H << S+ 0 0 0 -4,-1.7 2,-0.4 -3,-0.8 75,-0.3 0.343 120.1 59.0-117.6 0.7 -1.9 -11.3 2.2 10 14 A L < + 0 0 3 -4,-1.0 2,-0.4 -5,-0.2 45,-0.3 -0.984 50.3 174.1-134.5 121.7 -4.9 -11.0 -0.1 11 15 A E > - 0 0 78 43,-1.4 4,-1.5 -2,-0.4 3,-0.4 -0.812 9.0-170.8-128.1 92.7 -8.5 -10.7 1.1 12 16 A Q H > S+ 0 0 80 -2,-0.4 4,-2.0 1,-0.2 -1,-0.1 0.841 80.1 60.2 -53.1 -39.0 -10.7 -10.0 -1.9 13 17 A G H > S+ 0 0 39 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.929 110.8 35.8 -58.6 -52.8 -13.8 -9.4 0.2 14 18 A N H > S+ 0 0 50 -3,-0.4 4,-1.4 1,-0.2 -1,-0.2 0.713 110.5 66.9 -77.5 -16.8 -12.5 -6.4 2.2 15 19 A L H X S+ 0 0 0 -4,-1.5 4,-2.6 2,-0.2 3,-0.3 0.944 97.3 52.6 -63.8 -48.5 -10.6 -5.2 -0.9 16 20 A K H X S+ 0 0 111 -4,-2.0 4,-0.8 1,-0.3 -2,-0.2 0.930 111.4 46.0 -55.1 -44.7 -13.8 -4.5 -2.8 17 21 A K H < S+ 0 0 166 -4,-1.1 4,-0.4 1,-0.2 -1,-0.3 0.778 113.9 49.3 -73.7 -27.4 -15.0 -2.3 0.1 18 22 A A H < S+ 0 0 30 -4,-1.4 3,-0.4 -3,-0.3 -1,-0.2 0.906 109.8 47.7 -78.8 -40.8 -11.8 -0.5 0.5 19 23 A L H < S+ 0 0 6 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.539 88.7 90.8 -83.5 -6.1 -11.2 0.4 -3.1 20 24 A V S < S- 0 0 98 -4,-0.8 -1,-0.2 1,-0.2 -2,-0.1 0.958 113.6 -0.4 -50.9 -62.8 -14.8 1.7 -3.5 21 25 A N S S+ 0 0 152 -4,-0.4 -1,-0.2 -3,-0.4 -2,-0.1 -0.002 103.3 138.4-121.7 25.6 -14.1 5.4 -2.6 22 26 A V - 0 0 24 -4,-0.2 2,-0.4 -3,-0.1 -3,-0.1 -0.141 56.7-112.7 -66.0 162.9 -10.5 4.9 -1.9 23 27 A E - 0 0 65 3,-0.2 2,-0.5 36,-0.0 3,-0.4 -0.821 30.5-135.0 -96.4 135.9 -7.9 7.3 -3.0 24 28 A W S S- 0 0 53 -2,-0.4 3,-0.1 1,-0.2 -5,-0.0 -0.884 78.9 -0.2-105.4 131.9 -5.5 6.1 -5.5 25 29 A N S S+ 0 0 73 -2,-0.5 2,-0.6 1,-0.2 -1,-0.2 0.679 104.3 115.8 66.2 26.6 -1.8 6.5 -5.4 26 30 A I S S- 0 0 69 -3,-0.4 2,-0.9 21,-0.0 -3,-0.2 -0.960 70.3-134.3-125.4 103.7 -2.4 8.2 -2.2 27 31 A C >> - 0 0 6 -2,-0.6 3,-1.7 1,-0.2 4,-1.1 -0.540 17.6-160.0 -55.2 102.9 -0.9 6.6 0.8 28 32 A Q H 3> S+ 0 0 44 -2,-0.9 4,-2.6 31,-0.5 -1,-0.2 0.813 87.3 64.6 -61.1 -28.2 -4.0 7.0 3.0 29 33 A D H 34 S+ 0 0 53 30,-1.6 -1,-0.3 1,-0.2 31,-0.1 0.713 99.1 54.9 -72.0 -16.4 -1.8 6.5 6.1 30 34 A C H X4 S+ 0 0 29 -3,-1.7 3,-0.7 29,-0.3 -1,-0.2 0.887 113.1 41.9 -74.3 -38.1 -0.1 9.8 5.1 31 35 A K H 3< S+ 0 0 77 -4,-1.1 -2,-0.2 1,-0.3 -3,-0.1 0.796 109.0 55.9 -80.9 -33.8 -3.5 11.5 5.0 32 36 A T T 3< S+ 0 0 88 -4,-2.6 2,-1.9 1,-0.1 -1,-0.3 0.384 77.7 106.6 -84.7 6.7 -4.9 10.0 8.1 33 37 A D X + 0 0 38 -3,-0.7 3,-1.1 1,-0.2 -1,-0.1 -0.577 41.5 171.2 -86.4 73.2 -1.9 11.3 10.0 34 38 A N T 3 + 0 0 139 -2,-1.9 -1,-0.2 1,-0.2 -2,-0.1 0.591 59.2 87.0 -60.8 -13.3 -3.8 14.0 11.8 35 39 A K T 3 S+ 0 0 183 -3,-0.1 -1,-0.2 2,-0.0 2,-0.2 0.915 90.4 45.6 -51.7 -49.6 -0.6 14.6 13.9 36 40 A V S < S- 0 0 69 -3,-1.1 -3,-0.0 1,-0.1 0, 0.0 -0.627 74.1-136.2-105.0 158.7 0.8 17.0 11.4 37 41 A K S S+ 0 0 170 -2,-0.2 -1,-0.1 1,-0.0 -2,-0.0 0.878 96.6 43.8 -78.7 -38.6 -0.6 19.8 9.4 38 42 A D + 0 0 58 1,-0.1 -1,-0.0 3,-0.0 3,-0.0 1.000 52.9 172.9 -75.6 -73.9 0.9 19.0 6.1 39 43 A K S S+ 0 0 64 -7,-0.0 2,-0.2 2,-0.0 -1,-0.1 0.560 88.4 45.6 67.4 10.2 0.6 15.3 5.3 40 44 A A S S- 0 0 43 -9,-0.0 2,-1.4 -10,-0.0 3,-0.1 -0.566 86.7-145.9 179.6 98.9 2.0 16.6 2.0 41 45 A E >> - 0 0 81 1,-0.2 4,-2.5 -2,-0.2 3,-2.2 -0.691 10.9-167.1 -87.6 92.1 4.8 19.0 2.2 42 46 A E T 34 S+ 0 0 166 -2,-1.4 -1,-0.2 1,-0.3 -4,-0.0 0.743 81.1 67.8 -48.4 -34.7 4.1 21.2 -0.7 43 47 A E T 34 S+ 0 0 173 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.795 117.2 25.2 -59.1 -31.2 7.5 22.8 -0.4 44 48 A T T <4 S- 0 0 86 -3,-2.2 -2,-0.2 2,-0.0 -1,-0.2 0.740 94.3-152.1-102.1 -29.6 9.0 19.6 -1.5 45 49 A E < - 0 0 152 -4,-2.5 2,-0.3 1,-0.1 -3,-0.2 0.990 23.5-158.9 46.9 76.4 6.0 18.2 -3.4 46 50 A E - 0 0 82 -5,-0.2 -1,-0.1 1,-0.0 19,-0.0 -0.599 28.1-175.7 -91.3 140.7 6.7 14.6 -2.9 47 51 A K + 0 0 177 -2,-0.3 3,-0.1 17,-0.1 -21,-0.0 -0.744 20.1 179.0-132.9 84.3 5.5 11.7 -4.8 48 52 A P - 0 0 25 0, 0.0 2,-0.2 0, 0.0 17,-0.1 -0.223 40.9 -77.0 -76.2 174.0 6.7 8.5 -3.1 49 53 A S - 0 0 5 1,-0.0 13,-2.6 13,-0.0 2,-0.6 -0.465 46.2-144.1 -71.1 143.6 6.1 5.0 -4.2 50 54 A V E -A 61 0A 3 11,-0.3 38,-3.2 -2,-0.2 2,-0.5 -0.952 15.6-173.3-123.8 116.1 2.7 3.8 -3.2 51 55 A W E -AB 60 87A 46 9,-3.0 9,-3.1 -2,-0.6 2,-0.6 -0.923 11.4-150.8-110.0 125.7 2.1 0.3 -2.2 52 56 A L E -AB 59 86A 0 34,-2.9 34,-2.3 -2,-0.5 2,-0.5 -0.885 20.9-120.9-102.8 125.1 -1.3 -1.0 -1.6 53 57 A C E > - B 0 85A 1 5,-3.3 4,-3.1 -2,-0.6 3,-0.3 -0.507 17.9-159.5 -61.7 111.8 -2.0 -3.7 0.9 54 58 A L T 4 S+ 0 0 0 30,-2.4 -43,-1.4 -2,-0.5 -1,-0.2 0.528 90.3 60.8 -72.5 -7.0 -3.6 -6.5 -1.2 55 59 A K T 4 S- 0 0 14 29,-0.8 -1,-0.2 -45,-0.3 -41,-0.2 0.866 128.4 -3.0 -86.8 -44.4 -4.8 -7.7 2.0 56 60 A C T 4 S- 0 0 25 -3,-0.3 -2,-0.2 2,-0.2 3,-0.1 0.466 91.2-107.1-131.5 -5.2 -7.0 -4.8 3.2 57 61 A G < + 0 0 1 -4,-3.1 2,-0.5 1,-0.3 -3,-0.1 0.634 63.9 153.7 84.0 11.8 -6.7 -2.0 0.6 58 62 A H - 0 0 22 -5,-0.3 -5,-3.3 -31,-0.1 2,-0.5 -0.653 34.1-147.3 -74.4 124.8 -4.5 0.1 3.0 59 63 A Q E +A 52 0A 0 -2,-0.5 -30,-1.6 -7,-0.2 -31,-0.5 -0.843 23.7 170.2-105.5 126.7 -2.4 2.3 0.9 60 64 A G E -A 51 0A 0 -9,-3.1 -9,-3.0 -2,-0.5 2,-0.4 -0.865 35.1-109.9-132.4 161.9 1.0 3.2 2.0 61 65 A C E -A 50 0A 1 -2,-0.3 9,-2.4 -11,-0.3 10,-0.5 -0.752 37.2-150.8 -94.0 139.3 4.0 4.8 0.8 62 66 A G > - 0 0 0 -13,-2.6 3,-1.4 -2,-0.4 6,-0.4 0.160 48.3 -42.1 -92.3-148.5 7.0 2.6 0.3 63 67 A R T 3 S+ 0 0 189 1,-0.3 -2,-0.1 5,-0.1 -13,-0.0 0.726 123.2 68.4 -53.6 -28.7 10.7 2.9 0.3 64 68 A N T 3 S+ 0 0 113 3,-0.0 2,-0.3 2,-0.0 -1,-0.3 0.208 91.8 76.0 -85.6 18.1 10.7 6.3 -1.5 65 69 A S S < S- 0 0 26 -3,-1.4 -16,-0.0 -17,-0.1 0, 0.0 -0.813 82.3-125.2-120.5 166.4 9.1 8.0 1.5 66 70 A Q S S+ 0 0 170 -2,-0.3 -1,-0.1 1,-0.1 -3,-0.0 0.862 112.6 38.0 -73.4 -38.7 10.4 9.2 4.8 67 71 A E S S- 0 0 68 -3,-0.1 5,-0.2 -5,-0.0 -1,-0.1 0.879 81.4-157.7 -85.3 -35.6 7.8 7.2 6.7 68 72 A Q >> - 0 0 39 -6,-0.4 4,-1.7 3,-0.1 3,-1.4 0.929 18.6-179.9 51.3 50.1 7.7 4.1 4.5 69 73 A H H 3> S+ 0 0 7 1,-0.3 4,-2.3 2,-0.2 -7,-0.2 0.724 70.1 66.4 -54.9 -29.9 4.2 3.6 6.0 70 74 A A H 3> S+ 0 0 2 -9,-2.4 4,-1.5 2,-0.2 -1,-0.3 0.915 106.3 42.1 -60.8 -39.4 3.7 0.4 4.0 71 75 A L H <> S+ 0 0 56 -3,-1.4 4,-3.1 -10,-0.5 -2,-0.2 0.889 109.8 55.6 -77.8 -39.2 6.4 -1.2 6.0 72 76 A K H X S+ 0 0 98 -4,-1.7 4,-0.6 1,-0.2 -2,-0.2 0.888 106.9 53.5 -54.7 -35.4 5.2 0.3 9.2 73 77 A H H < S+ 0 0 17 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.860 111.4 44.4 -70.3 -35.2 1.9 -1.4 8.3 74 78 A Y H < S+ 0 0 71 -4,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.899 112.9 50.7 -72.2 -38.7 3.7 -4.7 7.9 75 79 A L H < S+ 0 0 123 -4,-3.1 -2,-0.2 -5,-0.1 -1,-0.2 0.552 85.8 109.7 -77.5 -6.2 5.7 -4.1 11.1 76 80 A T S < S- 0 0 53 -4,-0.6 2,-0.5 -5,-0.2 -3,-0.0 -0.569 79.8-120.0 -67.8 124.2 2.4 -3.4 12.8 77 81 A P + 0 0 129 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 -0.595 55.7 142.9 -71.7 120.2 1.8 -6.3 15.2 78 82 A R - 0 0 107 -2,-0.5 0, 0.0 -4,-0.2 0, 0.0 -0.966 61.0-110.4-155.3 159.7 -1.5 -7.8 14.1 79 83 A S S S+ 0 0 126 -2,-0.3 -1,-0.1 3,-0.0 3,-0.0 0.919 104.4 52.5 -66.6 -47.9 -3.2 -11.2 13.7 80 84 A E S S- 0 0 86 1,-0.1 -2,-0.1 -3,-0.1 -71,-0.1 -0.682 83.8-134.2 -87.5 148.5 -3.2 -11.3 9.9 81 85 A P - 0 0 42 0, 0.0 -72,-0.1 0, 0.0 -1,-0.1 0.904 17.0-164.6 -71.8 -41.2 0.2 -10.6 8.3 82 86 A H + 0 0 20 -74,-1.1 -73,-0.2 1,-0.1 -27,-0.1 0.848 34.7 149.8 57.1 42.0 -1.1 -8.1 5.6 83 87 A C + 0 0 0 -75,-0.2 13,-2.3 -78,-0.1 2,-0.6 0.168 33.4 91.6 -97.4 14.7 2.2 -8.8 4.0 84 88 A L E + C 0 95A 0 -75,-0.3 -30,-2.4 11,-0.2 -29,-0.8 -0.965 43.6 161.3-120.2 120.8 1.1 -8.2 0.5 85 89 A V E -BC 53 94A 3 9,-2.2 9,-3.2 -2,-0.6 2,-0.4 -0.980 22.9-149.7-134.4 143.1 1.4 -5.0 -1.2 86 90 A L E -BC 52 93A 0 -34,-2.3 -34,-2.9 -2,-0.4 2,-0.4 -0.896 23.0-118.7-110.8 149.6 1.4 -4.1 -4.8 87 91 A S E > -B 51 0A 2 5,-2.9 4,-0.7 -2,-0.4 -36,-0.2 -0.728 8.3-157.1 -89.1 134.4 3.1 -1.2 -6.2 88 92 A L T 4 S+ 0 0 17 -38,-3.2 -37,-0.1 -2,-0.4 -1,-0.1 0.176 93.3 57.7 -89.6 17.4 1.1 1.5 -7.9 89 93 A D T 4 S+ 0 0 87 -39,-0.2 -1,-0.1 3,-0.1 -38,-0.1 0.793 127.6 2.5-110.9 -62.5 4.3 2.4 -9.7 90 94 A N T 4 S- 0 0 122 2,-0.1 -2,-0.1 0, 0.0 3,-0.1 0.471 95.3-119.6-108.3 -4.7 5.6 -0.7 -11.6 91 95 A W < + 0 0 65 -4,-0.7 2,-0.2 1,-0.2 -3,-0.1 0.902 63.2 145.4 61.3 45.3 2.6 -2.9 -10.6 92 96 A S - 0 0 10 11,-0.0 -5,-2.9 22,-0.0 2,-0.4 -0.602 45.1-127.1-100.0 170.5 4.7 -5.4 -8.8 93 97 A V E -CD 86 102A 0 9,-0.9 9,-2.2 -7,-0.3 2,-0.4 -0.932 16.6-160.8-117.2 142.8 3.8 -7.3 -5.8 94 98 A W E -CD 85 101A 76 -9,-3.2 -9,-2.2 -2,-0.4 2,-0.6 -0.990 4.6-164.6-124.1 132.7 5.8 -7.4 -2.7 95 99 A C E >>> -CD 84 100A 0 5,-2.5 4,-2.7 -2,-0.4 5,-1.2 -0.954 2.9-165.7-116.9 110.0 5.5 -10.1 -0.1 96 100 A Y T 345S+ 0 0 21 -13,-2.3 -1,-0.1 -2,-0.6 -12,-0.1 0.793 89.9 50.8 -66.6 -28.5 7.2 -9.0 3.0 97 101 A V T 345S+ 0 0 62 -14,-0.4 -1,-0.3 1,-0.2 -13,-0.1 0.716 116.0 40.6 -86.0 -19.9 7.2 -12.4 4.5 98 102 A C T <45S- 0 0 41 -3,-0.5 -2,-0.2 -15,-0.2 -1,-0.2 0.770 102.5-145.5 -86.1 -30.3 8.6 -13.9 1.4 99 103 A D T <5 + 0 0 124 -4,-2.7 2,-0.3 1,-0.3 -3,-0.2 0.930 63.9 80.2 61.2 51.2 10.9 -10.9 1.3 100 104 A N E - 0 0 66 -2,-0.3 3,-0.6 0, 0.0 6,-0.4 -0.735 40.9 -86.8-134.2-177.1 -0.7 -15.4 -13.3 106 110 A S T 3 S+ 0 0 109 1,-0.2 9,-0.0 -2,-0.2 6,-0.0 0.724 125.7 44.1 -69.7 -25.1 -4.3 -15.3 -14.6 107 111 A S T 3 S+ 0 0 101 4,-0.0 2,-0.5 5,-0.0 -1,-0.2 0.514 95.2 93.0 -97.3 -6.5 -5.4 -18.3 -12.5 108 112 A N S X> S- 0 0 26 -3,-0.6 4,-2.2 1,-0.1 3,-0.7 -0.764 78.3-134.4 -90.9 131.8 -3.6 -17.1 -9.4 109 113 A Q H 3> S+ 0 0 47 -2,-0.5 4,-2.7 1,-0.3 5,-0.2 0.801 104.6 59.1 -56.5 -32.2 -5.8 -15.0 -7.1 110 114 A L H 3> S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 -1,-0.3 0.916 107.9 44.5 -66.2 -40.3 -3.0 -12.5 -6.7 111 115 A G H <> S+ 0 0 6 -3,-0.7 4,-2.7 -6,-0.4 -2,-0.2 0.921 112.4 52.7 -68.0 -43.1 -3.0 -11.8 -10.4 112 116 A Q H X S+ 0 0 98 -4,-2.2 4,-2.3 -7,-0.3 -2,-0.2 0.899 113.8 42.6 -58.5 -41.7 -6.7 -11.7 -10.5 113 117 A V H X S+ 0 0 4 -4,-2.7 4,-3.7 2,-0.2 5,-0.3 0.930 111.5 52.3 -77.2 -43.9 -6.8 -9.1 -7.8 114 118 A V H X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.919 112.0 49.3 -53.6 -39.9 -3.9 -7.1 -9.1 115 119 A D H X S+ 0 0 82 -4,-2.7 4,-1.8 2,-0.2 -2,-0.2 0.941 114.1 45.2 -65.0 -43.9 -5.8 -7.0 -12.4 116 120 A Y H X S+ 0 0 46 -4,-2.3 4,-1.3 2,-0.2 -2,-0.2 0.945 114.6 46.7 -64.6 -47.5 -9.0 -6.0 -10.5 117 121 A V H X S+ 0 0 0 -4,-3.7 4,-2.6 1,-0.3 5,-0.2 0.841 108.8 55.6 -69.2 -29.5 -7.2 -3.4 -8.4 118 122 A R H X S+ 0 0 83 -4,-2.3 4,-2.3 -5,-0.3 -1,-0.3 0.880 106.3 50.7 -69.9 -34.7 -5.6 -2.1 -11.5 119 123 A K H < S+ 0 0 131 -4,-1.8 -2,-0.2 2,-0.2 -1,-0.2 0.751 110.4 53.0 -68.3 -25.7 -9.1 -1.7 -13.0 120 124 A Q H < S+ 0 0 67 -4,-1.3 -2,-0.2 1,-0.1 -1,-0.2 0.948 116.7 34.0 -72.9 -49.9 -9.9 0.2 -9.8 121 125 A A H < 0 0 28 -4,-2.6 -2,-0.2 1,-0.1 -3,-0.2 0.736 360.0 360.0 -78.5 -30.9 -7.1 2.6 -10.0 122 126 A S < 0 0 140 -4,-2.3 -3,-0.1 -5,-0.2 -2,-0.1 0.977 360.0 360.0 -44.8 360.0 -7.1 2.8 -13.8