==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 13-NOV-05 2F0P . COMPND 2 MOLECULE: STAPHYLOCOCCAL NUCLEASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS; . AUTHOR J.Z.LU,J.SAKON,W.E.STITES . 135 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7528.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 92 68.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 3.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 32 23.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 2 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 2.2 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 . 11 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 27 20.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.5 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 1 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 1 2 0 2 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 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 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 7 A L 0 0 100 0, 0.0 2,-0.4 0, 0.0 70,-0.1 0.000 360.0 360.0 360.0 142.0 60.6 24.7 -6.6 2 8 A H - 0 0 120 68,-0.2 68,-0.5 69,-0.1 2,-0.2 -0.941 360.0-126.2-128.3 152.0 62.1 27.8 -5.0 3 9 A K E -A 69 0A 84 -2,-0.4 66,-0.2 66,-0.2 83,-0.1 -0.642 22.6-166.6 -90.3 158.6 60.6 30.3 -2.7 4 10 A E E -A 68 0A 20 64,-2.0 64,-3.3 -2,-0.2 2,-0.1 -0.989 25.0-104.6-140.0 147.3 60.8 34.1 -3.5 5 11 A P E +A 67 0A 94 0, 0.0 17,-0.5 0, 0.0 2,-0.3 -0.343 39.1 172.2 -74.8 152.6 60.1 37.0 -1.2 6 12 A A E -A 66 0A 11 60,-2.0 60,-0.6 15,-0.1 2,-0.4 -0.925 24.2-128.7-149.7 167.5 56.9 39.1 -1.4 7 13 A T E -B 20 0A 96 13,-1.4 13,-3.2 -2,-0.3 2,-0.0 -0.988 26.9-112.4-130.2 135.2 55.2 41.8 0.5 8 14 A L E +B 19 0A 46 -2,-0.4 11,-0.2 11,-0.2 3,-0.1 -0.279 34.9 166.6 -63.3 136.8 51.7 41.9 1.8 9 15 A I E - 0 0 74 9,-2.5 2,-0.3 1,-0.2 10,-0.2 0.658 68.4 -31.3-107.6 -57.4 49.3 44.4 0.3 10 16 A K E -B 18 0A 119 8,-2.1 8,-3.3 0, 0.0 2,-0.3 -0.937 49.4-125.4-162.0 135.8 46.0 43.1 1.6 11 17 A A E -B 17 0A 20 -2,-0.3 6,-0.2 6,-0.2 3,-0.1 -0.632 26.4-179.5 -75.2 139.8 44.4 39.8 2.5 12 18 A I - 0 0 41 4,-2.3 2,-0.3 1,-0.4 5,-0.2 0.704 55.7 -28.3-114.5 -25.5 41.1 39.3 0.6 13 19 A D S S- 0 0 3 3,-1.8 -1,-0.4 40,-0.1 3,-0.2 -0.950 78.0 -71.4-176.3 178.0 39.6 36.0 1.7 14 20 A G S S+ 0 0 0 22,-0.3 23,-0.1 -2,-0.3 83,-0.1 0.872 132.2 26.6 -54.9 -41.5 40.6 32.6 3.1 15 21 A D S S+ 0 0 3 20,-0.1 15,-2.7 21,-0.1 2,-0.4 0.357 116.2 66.3-107.9 -4.2 42.1 31.5 -0.3 16 22 A T E + C 0 29A 10 -3,-0.2 -4,-2.3 13,-0.2 -3,-1.8 -0.951 49.4 167.4-131.8 133.9 43.1 34.9 -1.8 17 23 A V E -BC 11 28A 0 11,-2.3 11,-3.4 -2,-0.4 2,-0.5 -0.993 29.2-131.5-137.8 148.2 45.6 37.5 -0.9 18 24 A K E +BC 10 27A 83 -8,-3.3 -9,-2.5 -2,-0.3 -8,-2.1 -0.911 35.1 174.1 -99.7 123.3 47.1 40.5 -2.7 19 25 A L E -BC 8 26A 0 7,-2.6 7,-2.9 -2,-0.5 2,-0.7 -0.869 37.3-119.3-127.4 156.7 50.9 40.7 -2.6 20 26 A M E +BC 7 25A 63 -13,-3.2 -13,-1.4 -2,-0.3 2,-0.4 -0.885 42.1 178.3 -92.4 111.2 53.6 42.9 -4.1 21 27 A Y E > - C 0 24A 35 3,-3.0 3,-2.7 -2,-0.7 -15,-0.1 -0.975 63.4 -12.3-127.5 129.9 55.7 40.5 -6.2 22 28 A K T 3 S- 0 0 121 -17,-0.5 -1,-0.2 -2,-0.4 -16,-0.1 0.896 130.0 -57.5 49.7 41.2 58.7 41.3 -8.3 23 29 A G T 3 S+ 0 0 66 -3,-0.2 -1,-0.3 1,-0.2 -17,-0.0 0.474 118.0 111.1 71.6 2.1 57.6 44.9 -7.7 24 30 A Q E < S-C 21 0A 113 -3,-2.7 -3,-3.0 2,-0.0 2,-0.3 -0.899 72.2-118.6-114.7 138.4 54.2 44.3 -9.2 25 31 A P E +C 20 0A 59 0, 0.0 2,-0.4 0, 0.0 -5,-0.2 -0.525 46.3 170.7 -65.7 127.8 50.8 44.3 -7.4 26 32 A M E -C 19 0A 40 -7,-2.9 -7,-2.6 -2,-0.3 2,-0.4 -0.998 34.4-131.5-145.5 140.7 49.4 40.8 -7.9 27 33 A T E -C 18 0A 40 -2,-0.4 55,-2.4 53,-0.3 2,-0.4 -0.798 27.7-157.9 -88.4 134.2 46.4 38.8 -6.6 28 34 A F E -Cd 17 82A 0 -11,-3.4 -11,-2.3 -2,-0.4 2,-0.4 -0.943 9.3-155.2-118.2 138.1 47.4 35.3 -5.5 29 35 A R E -Cd 16 83A 35 53,-2.8 55,-1.5 -2,-0.4 2,-0.4 -0.911 31.8-113.6-102.9 129.3 45.1 32.2 -5.1 30 36 A L E > - d 0 84A 1 -15,-2.7 3,-1.0 -2,-0.4 55,-0.2 -0.586 35.8-118.1 -71.0 123.5 46.3 29.6 -2.6 31 37 A L T 3 S- 0 0 12 53,-2.6 55,-0.1 -2,-0.4 -1,-0.1 -0.352 82.9 -0.0 -60.0 134.9 47.3 26.4 -4.5 32 38 A L T 3 S+ 0 0 11 75,-0.2 74,-2.1 80,-0.1 2,-0.4 0.400 104.2 100.8 71.0 11.6 45.4 23.1 -3.7 33 39 A V E < -H 105 0B 0 -3,-1.0 2,-0.5 72,-0.3 72,-0.2 -0.985 48.8-162.5-130.7 140.2 42.9 24.4 -1.1 34 40 A D E -H 104 0B 67 70,-2.1 70,-2.3 -2,-0.4 3,-0.0 -0.963 17.3-173.5-109.1 114.1 39.3 25.3 -1.1 35 41 A T - 0 0 8 -2,-0.5 68,-0.2 68,-0.2 -20,-0.1 -0.690 38.3 -94.2 -99.8 161.3 38.2 27.4 1.9 36 42 A P - 0 0 13 0, 0.0 2,-0.3 0, 0.0 -22,-0.3 -0.482 55.6-136.5 -61.6 149.5 34.7 28.4 2.7 37 43 A E - 0 0 45 2,-0.1 9,-1.5 1,-0.1 12,-0.2 -0.831 30.8-156.7-118.0 154.0 34.4 31.9 1.2 38 44 A T S S+ 0 0 39 -2,-0.3 2,-0.3 11,-0.2 -1,-0.1 0.458 82.7 82.5 -95.2 -8.0 32.9 35.3 2.2 39 45 A K + 0 0 105 3,-0.0 5,-0.4 10,-0.0 7,-0.2 -0.740 61.0 59.8-100.2 149.5 32.7 36.0 -1.6 40 46 A H - 0 0 97 -2,-0.3 4,-0.1 3,-0.2 -3,-0.1 0.671 49.1-150.0 104.1 110.9 30.1 35.0 -4.1 41 47 A P S S+ 0 0 130 0, 0.0 2,-2.0 0, 0.0 4,-0.1 0.748 102.1 78.3 -68.7 -23.8 26.4 36.0 -3.9 42 48 A K S S- 0 0 151 2,-0.1 2,-0.3 0, 0.0 -3,-0.0 -0.665 127.5 -9.7 -71.4 67.8 26.3 32.7 -5.7 43 49 A K S S- 0 0 106 -2,-2.0 2,-0.3 -5,-0.0 -3,-0.2 -0.982 90.0-157.6 127.7-120.3 26.8 31.6 -2.1 44 50 A G - 0 0 22 -5,-0.4 2,-0.6 -2,-0.3 -2,-0.1 -0.933 62.3 -7.3 152.5-117.4 27.6 34.5 0.3 45 51 A V S S- 0 0 98 -2,-0.3 -7,-0.2 -4,-0.1 3,-0.2 -0.673 80.3-161.9-107.0 69.3 29.3 34.2 3.7 46 52 A E > - 0 0 71 -9,-1.5 3,-1.8 -2,-0.6 2,-0.4 0.024 33.8 -71.1 -54.0 166.2 29.5 30.4 4.0 47 53 A K T 3 S+ 0 0 168 1,-0.3 -1,-0.2 2,-0.2 -10,-0.0 -0.490 122.1 9.3 -68.6 116.6 30.0 28.6 7.2 48 54 A Y T 3> S+ 0 0 39 -2,-0.4 4,-3.3 -3,-0.2 -1,-0.3 0.325 97.1 115.5 87.6 3.5 33.6 29.0 8.5 49 55 A G H <> S+ 0 0 0 -3,-1.8 4,-2.7 2,-0.2 -11,-0.2 0.973 76.9 44.2 -60.1 -58.4 34.2 31.6 5.8 50 56 A P H > S+ 0 0 62 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.917 116.7 50.0 -55.9 -40.4 34.8 34.4 8.3 51 57 A E H > S+ 0 0 97 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.926 111.1 45.3 -63.1 -47.5 36.9 32.0 10.2 52 58 A A H X S+ 0 0 0 -4,-3.3 4,-2.3 1,-0.2 5,-0.2 0.912 114.1 51.7 -65.2 -37.0 39.1 30.8 7.3 53 59 A S H X S+ 0 0 25 -4,-2.7 4,-2.0 -5,-0.3 -1,-0.2 0.897 110.2 46.0 -68.2 -38.9 39.4 34.4 6.2 54 60 A A H X S+ 0 0 46 -4,-2.2 4,-2.6 -5,-0.2 5,-0.3 0.828 109.9 57.1 -72.9 -29.8 40.6 35.7 9.6 55 61 A F H X S+ 0 0 56 -4,-2.2 4,-2.1 -5,-0.2 5,-0.3 0.964 110.3 41.7 -63.1 -48.7 43.0 32.8 9.9 56 62 A T H X S+ 0 0 0 -4,-2.3 4,-2.8 1,-0.2 5,-0.4 0.940 115.7 51.4 -64.0 -43.0 44.7 33.7 6.6 57 63 A K H X S+ 0 0 74 -4,-2.0 4,-3.0 -5,-0.2 5,-0.2 0.955 112.1 43.9 -58.3 -50.0 44.7 37.4 7.5 58 64 A K H X S+ 0 0 92 -4,-2.6 4,-2.8 1,-0.2 -1,-0.2 0.961 115.4 48.4 -63.4 -50.2 46.2 37.1 10.9 59 65 A M H < S+ 0 0 38 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.929 119.0 37.6 -57.9 -47.7 48.8 34.6 9.9 60 66 A I H >< S+ 0 0 2 -4,-2.8 3,-1.2 -5,-0.3 -1,-0.2 0.890 117.1 52.4 -75.9 -33.2 49.9 36.7 6.9 61 67 A E H 3< S+ 0 0 81 -4,-3.0 -2,-0.2 -5,-0.4 -1,-0.2 0.888 109.5 48.1 -69.0 -30.9 49.5 40.0 8.6 62 68 A N T 3< S+ 0 0 131 -4,-2.8 -1,-0.2 -5,-0.2 2,-0.2 0.209 89.7 114.7 -94.8 15.2 51.6 39.0 11.6 63 69 A A < - 0 0 24 -3,-1.2 3,-0.2 1,-0.1 -3,-0.0 -0.527 55.5-153.0 -95.5 153.2 54.6 37.6 9.8 64 70 A K S S+ 0 0 186 1,-0.3 2,-0.4 -2,-0.2 -1,-0.1 0.909 87.5 22.9 -76.7 -48.1 58.2 38.8 9.5 65 71 A K - 0 0 143 -58,-0.0 24,-3.0 2,-0.0 2,-0.4 -0.986 63.1-164.1-130.0 127.6 58.8 37.2 6.1 66 72 A I E -AE 6 88A 19 -60,-0.6 -60,-2.0 -2,-0.4 2,-0.4 -0.915 13.6-178.1-109.4 138.1 56.4 36.2 3.3 67 73 A E E -AE 5 87A 59 20,-2.2 20,-2.9 -2,-0.4 2,-0.4 -0.990 14.7-149.3-133.5 139.8 57.5 33.9 0.5 68 74 A V E -AE 4 86A 0 -64,-3.3 -64,-2.0 -2,-0.4 2,-0.4 -0.899 7.4-165.8-111.4 143.4 55.8 32.6 -2.6 69 75 A E E -AE 3 85A 10 16,-1.9 16,-2.5 -2,-0.4 -66,-0.2 -0.959 9.9-151.0-128.7 107.0 56.5 29.2 -4.1 70 76 A F E - E 0 84A 20 -68,-0.5 -68,-0.2 -2,-0.4 14,-0.2 -0.466 16.4-129.6 -74.9 148.3 55.2 28.5 -7.6 71 77 A D - 0 0 3 12,-0.7 41,-0.1 3,-0.2 -1,-0.1 -0.167 32.9 -94.1 -85.4-169.3 54.4 24.9 -8.5 72 78 A K S S+ 0 0 114 39,-0.6 40,-0.2 -2,-0.0 3,-0.1 0.472 101.8 57.5 -94.0 4.7 55.8 23.3 -11.7 73 79 A G S S- 0 0 14 1,-0.3 37,-0.0 38,-0.1 -2,-0.0 -0.048 107.9 -21.0-106.1-147.7 52.8 23.9 -14.0 74 80 A Q - 0 0 135 1,-0.1 -1,-0.3 -2,-0.1 -3,-0.2 -0.285 51.6-153.0 -61.2 144.2 51.0 27.1 -15.0 75 81 A R S S+ 0 0 127 -3,-0.1 8,-2.7 -5,-0.1 2,-0.3 0.512 72.9 44.3-102.6 -4.3 51.6 30.0 -12.6 76 82 A T B S-F 82 0A 65 6,-0.3 6,-0.2 -48,-0.1 2,-0.1 -0.975 72.8-135.1-134.1 154.9 48.4 32.0 -13.2 77 83 A D > - 0 0 25 4,-2.0 3,-2.4 -2,-0.3 -2,-0.0 -0.393 42.7 -85.2 -98.0-176.5 44.8 31.0 -13.5 78 84 A K T 3 S+ 0 0 171 1,-0.3 -1,-0.0 2,-0.1 -2,-0.0 0.698 128.3 54.6 -64.2 -15.1 42.1 32.2 -16.0 79 85 A Y T 3 S- 0 0 156 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.429 121.1-104.6 -99.2 5.6 41.4 35.2 -13.8 80 86 A G S < S+ 0 0 45 -3,-2.4 2,-0.4 1,-0.3 -53,-0.3 0.556 72.5 143.7 88.5 6.3 45.0 36.4 -13.7 81 87 A R - 0 0 59 -55,-0.1 -4,-2.0 -53,-0.1 -1,-0.3 -0.652 54.1-116.8 -81.7 135.4 45.7 35.2 -10.2 82 88 A G E -dF 28 76A 0 -55,-2.4 -53,-2.8 -2,-0.4 2,-0.6 -0.394 25.2-139.8 -61.1 141.6 49.1 33.8 -9.3 83 89 A L E +d 29 0A 24 -8,-2.7 -12,-0.7 -55,-0.2 2,-0.3 -0.931 43.9 129.5-112.7 114.0 48.9 30.2 -8.3 84 90 A A E -dE 30 70A 0 -55,-1.5 -53,-2.6 -2,-0.6 2,-0.5 -0.942 61.3-102.6-156.8 168.9 51.2 29.4 -5.4 85 91 A Y E - E 0 69A 0 -16,-2.5 -16,-1.9 -2,-0.3 2,-0.5 -0.878 42.4-149.9 -93.9 123.0 52.1 28.0 -2.0 86 92 A I E - E 0 68A 0 -2,-0.5 7,-3.4 -18,-0.2 8,-0.6 -0.917 8.8-160.7-108.5 131.6 52.3 30.9 0.4 87 93 A Y E -GE 92 67A 19 -20,-2.9 -20,-2.2 -2,-0.5 2,-0.5 -0.932 8.2-163.5-111.0 129.9 54.7 30.8 3.4 88 94 A A E > S-GE 91 66A 3 3,-3.2 3,-2.4 -2,-0.4 -22,-0.2 -0.971 83.5 -26.3-110.5 115.4 54.5 33.0 6.5 89 95 A D T 3 S- 0 0 59 -24,-3.0 -1,-0.2 -2,-0.5 -23,-0.1 0.897 130.3 -45.5 41.5 51.5 57.8 32.9 8.4 90 96 A G T 3 S+ 0 0 52 -25,-0.3 2,-0.5 1,-0.2 -1,-0.3 0.379 116.0 113.5 84.1 -7.3 58.5 29.5 7.0 91 97 A K E < -G 88 0A 121 -3,-2.4 -3,-3.2 4,-0.0 2,-0.5 -0.902 68.1-125.5-105.1 130.5 55.1 28.0 7.6 92 98 A M E > -G 87 0A 17 -2,-0.5 4,-2.4 -5,-0.3 -5,-0.3 -0.553 12.4-156.3 -71.9 118.2 52.9 27.2 4.6 93 99 A I H > S+ 0 0 1 -7,-3.4 4,-2.4 -2,-0.5 5,-0.2 0.857 92.1 58.8 -64.3 -32.2 49.6 29.0 4.9 94 100 A N H > S+ 0 0 0 -8,-0.6 4,-1.3 1,-0.2 -1,-0.2 0.928 109.6 41.8 -64.8 -43.5 48.0 26.4 2.6 95 101 A E H > S+ 0 0 44 2,-0.2 4,-3.3 1,-0.2 -1,-0.2 0.908 111.5 56.2 -66.6 -43.1 48.9 23.5 4.9 96 102 A A H X S+ 0 0 17 -4,-2.4 4,-2.2 1,-0.2 6,-0.2 0.939 105.9 50.7 -57.6 -46.6 48.0 25.4 8.1 97 103 A L H <>S+ 0 0 0 -4,-2.4 5,-2.7 1,-0.2 6,-0.6 0.906 115.2 43.0 -55.4 -43.0 44.4 26.1 6.8 98 104 A V H ><5S+ 0 0 0 -4,-1.3 3,-1.4 4,-0.2 -1,-0.2 0.878 110.3 55.2 -72.5 -40.3 44.0 22.4 6.1 99 105 A R H 3<5S+ 0 0 69 -4,-3.3 -1,-0.2 1,-0.2 -2,-0.2 0.850 108.9 49.6 -59.5 -36.9 45.6 21.3 9.3 100 106 A Q T 3<5S- 0 0 81 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.241 116.0-112.6 -86.5 5.7 43.1 23.5 11.3 101 107 A G T < 5S+ 0 0 0 -3,-1.4 32,-2.1 2,-0.2 33,-0.2 0.767 88.5 114.6 70.6 22.6 40.0 22.1 9.4 102 108 A L S - 0 0 160 3,-0.5 3,-2.1 -2,-0.4 -36,-0.1 -0.973 32.8 -97.5-118.8 113.4 45.5 19.3 -11.6 110 116 A K T 3 S+ 0 0 180 -2,-0.5 0, 0.0 1,-0.3 0, 0.0 -0.396 102.3 25.7 -64.6 152.4 48.8 17.9 -12.7 111 117 A P T 3 S+ 0 0 63 0, 0.0 2,-1.5 0, 0.0 -39,-0.6 -0.927 112.2 71.1 -92.5 20.7 51.5 19.0 -12.8 112 118 A N S < S+ 0 0 16 -3,-2.1 -3,-0.5 1,-0.2 -80,-0.1 -0.493 76.2 91.6 -89.3 66.2 50.5 21.5 -10.1 113 119 A N > + 0 0 25 -2,-1.5 3,-1.9 -5,-0.1 4,-0.3 0.077 34.9 129.0-144.6 22.7 50.4 18.9 -7.4 114 120 A T T 3 S+ 0 0 59 -3,-0.3 3,-0.5 1,-0.3 4,-0.3 0.931 84.9 33.7 -56.9 -49.2 53.8 18.9 -5.8 115 121 A H T 3> S+ 0 0 37 1,-0.2 4,-2.3 2,-0.1 -1,-0.3 0.223 86.5 111.3 -89.7 20.2 52.6 19.3 -2.1 116 122 A E H <> S+ 0 0 54 -3,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.872 76.6 47.8 -63.8 -34.9 49.4 17.3 -2.7 117 123 A Q H > S+ 0 0 153 -3,-0.5 4,-2.4 -4,-0.3 5,-0.2 0.959 111.2 51.8 -70.9 -46.9 50.4 14.3 -0.5 118 124 A H H > S+ 0 0 75 -4,-0.3 4,-2.1 1,-0.2 -2,-0.2 0.933 112.7 44.6 -49.1 -54.5 51.5 16.5 2.3 119 125 A L H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.883 109.9 54.7 -63.4 -39.3 48.3 18.5 2.4 120 126 A R H X S+ 0 0 95 -4,-2.1 4,-2.3 -5,-0.3 -1,-0.2 0.924 106.7 52.9 -63.0 -36.6 46.2 15.3 2.1 121 127 A K H X S+ 0 0 120 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.926 110.5 46.3 -61.9 -45.4 48.0 14.0 5.2 122 128 A S H X S+ 0 0 5 -4,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.893 110.6 54.1 -64.8 -33.2 47.2 17.1 7.1 123 129 A E H X S+ 0 0 21 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.904 105.3 52.1 -69.0 -38.8 43.6 17.0 5.9 124 130 A A H X S+ 0 0 46 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.884 110.5 49.7 -60.6 -41.3 43.2 13.4 7.2 125 131 A Q H X S+ 0 0 58 -4,-1.9 4,-3.0 2,-0.2 5,-0.2 0.955 108.2 51.7 -60.6 -51.0 44.5 14.6 10.6 126 132 A A H <>S+ 0 0 0 -4,-2.6 5,-2.1 1,-0.2 4,-0.4 0.876 112.1 47.9 -55.4 -36.1 42.1 17.5 10.7 127 133 A K H ><5S+ 0 0 87 -4,-1.9 3,-1.0 2,-0.2 -1,-0.2 0.936 110.5 50.3 -70.1 -46.3 39.3 15.1 10.0 128 134 A K H 3<5S+ 0 0 146 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.857 113.0 47.0 -54.1 -42.3 40.4 12.6 12.6 129 135 A E T 3<5S- 0 0 88 -4,-3.0 -1,-0.3 -5,-0.2 -2,-0.2 0.545 106.6-133.2 -86.1 -1.6 40.6 15.5 15.1 130 136 A K T < 5 + 0 0 134 -3,-1.0 2,-0.3 -4,-0.4 -3,-0.2 0.866 39.8 176.5 56.5 43.4 37.1 16.6 14.0 131 137 A L > < - 0 0 46 -5,-2.1 3,-2.9 3,-0.1 -1,-0.2 -0.633 46.1 -57.5 -85.4 135.7 38.2 20.3 13.7 132 138 A N G > S+ 0 0 48 -2,-0.3 3,-3.5 1,-0.3 -30,-0.2 -0.045 134.4 29.8 46.7-112.2 35.9 23.1 12.4 133 139 A I G 3 S+ 0 0 43 -32,-2.1 -1,-0.3 1,-0.3 -31,-0.1 0.799 125.0 51.8 -45.5 -34.7 34.7 22.1 8.9 134 140 A W G < 0 0 66 -3,-2.9 -1,-0.3 -33,-0.2 -2,-0.2 0.343 360.0 360.0 -89.3 5.3 35.0 18.4 10.0 135 141 A S < 0 0 108 -3,-3.5 -2,-0.2 -34,-0.2 -1,-0.1 0.787 360.0 360.0-107.1 360.0 32.9 18.9 13.1