==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER NUCLEASE 24-JAN-98 1A3V . COMPND 2 MOLECULE: STAPHYLOCOCCAL NUCLEASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS; . AUTHOR R.WYNN,P.C.HARKINS,F.M.RICHARDS,R.O.FOX . 135 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7359.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 97 71.9 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 . 34 25.2 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 . 13 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 28 20.7 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 1 2 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 99 0, 0.0 2,-0.4 0, 0.0 70,-0.1 0.000 360.0 360.0 360.0 158.1 0.6 36.8 20.9 2 8 A H - 0 0 136 68,-0.4 68,-0.5 69,-0.1 2,-0.2 -0.980 360.0-136.8-126.5 132.7 4.0 38.3 20.0 3 9 A K E -A 69 0A 78 -2,-0.4 66,-0.2 66,-0.2 83,-0.1 -0.603 19.0-168.9 -86.0 153.1 6.5 36.9 17.5 4 10 A E E -A 68 0A 35 64,-1.5 64,-2.8 -2,-0.2 -2,-0.0 -0.987 25.3-104.1-139.6 147.1 10.3 36.9 18.2 5 11 A P E +A 67 0A 100 0, 0.0 17,-0.3 0, 0.0 2,-0.3 -0.289 40.1 169.1 -69.4 158.4 13.3 36.1 16.0 6 12 A A E -A 66 0A 13 60,-1.8 60,-0.6 15,-0.1 2,-0.4 -0.952 25.4-129.6-159.4 165.3 15.2 32.9 16.1 7 13 A T E -B 20 0A 97 13,-1.7 13,-3.0 -2,-0.3 2,-0.2 -0.991 24.1-117.1-129.6 134.4 17.8 31.1 14.0 8 14 A L E +B 19 0A 43 -2,-0.4 11,-0.2 11,-0.2 3,-0.1 -0.431 34.5 166.2 -71.0 130.9 17.7 27.6 12.7 9 15 A I E - 0 0 73 9,-2.5 2,-0.3 1,-0.2 10,-0.2 0.718 68.4 -18.5-105.3 -54.6 20.4 25.3 14.0 10 16 A K E -B 18 0A 109 8,-1.9 8,-3.0 0, 0.0 2,-0.4 -0.929 52.0-134.2-161.3 129.5 19.1 21.9 12.9 11 17 A A E -B 17 0A 16 -2,-0.3 6,-0.2 6,-0.2 3,-0.1 -0.711 22.7-179.7 -83.8 129.6 15.8 20.3 11.8 12 18 A I E - 0 0 52 4,-1.8 2,-0.3 -2,-0.4 5,-0.2 0.890 56.9 -34.6 -96.1 -56.6 15.2 17.0 13.6 13 19 A D E > S-B 16 0A 13 3,-2.0 3,-0.8 39,-0.1 -1,-0.4 -0.860 84.5 -59.1-150.9-169.9 11.9 15.7 12.3 14 20 A G T 3 S+ 0 0 0 35,-0.3 83,-0.1 22,-0.3 23,-0.1 0.744 131.6 16.8 -50.8 -31.3 8.5 17.1 11.2 15 21 A D T 3 S+ 0 0 8 21,-0.1 15,-2.0 20,-0.1 2,-0.4 0.310 114.6 67.1-128.9 9.2 7.7 18.8 14.5 16 22 A T E < +BC 13 29A 12 -3,-0.8 -3,-2.0 13,-0.2 -4,-1.8 -0.998 51.8 152.3-135.6 138.7 11.0 19.1 16.5 17 23 A X E -BC 11 28A 0 11,-1.8 11,-3.2 -2,-0.4 2,-0.5 -0.969 41.3-109.3-156.4 166.7 14.1 21.2 15.8 18 24 A K E +BC 10 27A 68 -8,-3.0 -9,-2.5 -2,-0.3 -8,-1.9 -0.912 39.9 175.3-106.5 123.8 17.0 23.0 17.4 19 25 A L E -BC 8 26A 0 7,-3.5 7,-2.7 -2,-0.5 2,-0.7 -0.897 34.7-122.8-126.6 157.2 16.9 26.8 17.3 20 26 A M E +BC 7 25A 79 -13,-3.0 -13,-1.7 -2,-0.3 2,-0.5 -0.895 38.1 176.6 -98.8 115.8 19.0 29.6 18.6 21 27 A Y E > - C 0 24A 34 3,-3.2 3,-1.4 -2,-0.7 -15,-0.1 -0.983 68.8 -4.8-126.3 122.6 16.7 31.7 20.7 22 28 A K T 3 S- 0 0 133 -2,-0.5 -1,-0.2 -17,-0.3 -16,-0.1 0.983 129.5 -60.6 58.4 46.6 17.9 34.6 22.7 23 29 A G T 3 S+ 0 0 71 -3,-0.2 -1,-0.3 1,-0.1 -17,-0.0 0.512 121.1 110.8 55.6 12.9 21.5 33.7 21.6 24 30 A Q E < S-C 21 0A 122 -3,-1.4 -3,-3.2 2,-0.0 2,-0.2 -0.891 72.1-118.9-116.8 137.4 20.9 30.3 23.4 25 31 A P E +C 20 0A 51 0, 0.0 2,-0.3 0, 0.0 -5,-0.2 -0.531 41.0 166.3 -72.5 137.4 20.4 26.8 21.7 26 32 A M E -C 19 0A 46 -7,-2.7 -7,-3.5 -2,-0.2 2,-0.4 -0.996 36.7-129.6-152.3 147.2 17.1 25.1 22.3 27 33 A T E -C 18 0A 50 -2,-0.3 55,-2.8 53,-0.3 2,-0.3 -0.822 32.4-162.2 -96.0 134.5 15.1 22.3 21.0 28 34 A F E -Cd 17 82A 0 -11,-3.2 -11,-1.8 -2,-0.4 2,-0.4 -0.921 10.2-155.8-117.4 154.6 11.5 23.4 20.2 29 35 A R E -Cd 16 83A 21 53,-3.6 55,-1.4 -2,-0.3 -13,-0.2 -0.990 28.7-110.8-130.7 131.3 8.3 21.4 19.6 30 36 A L E > - d 0 84A 2 -15,-2.0 3,-0.6 -2,-0.4 55,-0.2 -0.349 32.3-119.6 -63.6 138.4 5.4 22.7 17.6 31 37 A L T 3 S+ 0 0 12 53,-2.3 55,-0.1 1,-0.2 77,-0.1 -0.536 84.8 3.7 -79.0 147.3 2.2 23.5 19.5 32 38 A L T 3 S+ 0 0 3 75,-0.5 74,-0.5 -2,-0.2 2,-0.3 0.547 109.8 88.2 57.0 18.5 -1.1 21.7 18.7 33 39 A V E < -H 105 0B 0 -3,-0.6 2,-0.3 72,-0.3 72,-0.2 -0.946 51.8-160.3-141.0 163.8 0.2 19.3 16.1 34 40 A D E -H 104 0B 32 70,-1.6 70,-2.0 -2,-0.3 3,-0.1 -0.921 7.4-165.1-148.1 110.8 1.8 15.8 15.8 35 41 A T - 0 0 3 -2,-0.3 68,-0.2 68,-0.2 14,-0.1 -0.638 42.5 -85.9 -89.4 154.4 3.7 14.6 12.8 36 42 A P - 0 0 2 0, 0.0 -22,-0.3 0, 0.0 -21,-0.1 -0.275 50.3 -97.7 -63.9 150.0 4.4 10.9 12.5 37 43 A E + 0 0 47 1,-0.1 9,-1.6 6,-0.1 12,-0.2 -0.305 40.6 164.2 -69.8 147.2 7.3 9.3 14.3 38 44 A T S S+ 0 0 21 7,-0.2 -1,-0.1 11,-0.1 7,-0.1 0.372 77.2 36.6-135.3 -12.2 10.7 8.4 12.7 39 45 A K S S+ 0 0 135 5,-0.2 5,-0.1 1,-0.1 4,-0.1 0.850 82.2 83.0-108.6 -74.7 12.7 7.9 15.9 40 46 A H > - 0 0 86 1,-0.1 4,-2.3 2,-0.1 3,-0.2 -0.149 60.5-149.4 -44.9 115.9 11.2 6.3 19.0 41 47 A P T 4 S+ 0 0 108 0, 0.0 2,-2.0 0, 0.0 -1,-0.1 0.840 94.1 63.5 -55.1 -42.8 11.4 2.5 18.6 42 48 A K T 4 S+ 0 0 174 1,-0.2 -2,-0.1 2,-0.1 -3,-0.0 -0.374 117.5 30.2 -83.8 54.8 8.3 1.9 20.8 43 49 A K T 4 S- 0 0 118 -2,-2.0 -1,-0.2 -3,-0.2 -6,-0.1 -0.058 102.0-157.1-173.4 -42.6 6.4 3.8 18.0 44 50 A G < - 0 0 25 -4,-2.3 2,-1.2 -5,-0.1 -5,-0.2 -0.158 41.2 -43.3 77.7-177.1 8.5 3.0 15.0 45 51 A V - 0 0 103 -7,-0.1 -7,-0.2 -4,-0.1 -1,-0.1 -0.785 69.5-157.9 -90.7 94.3 8.9 4.7 11.7 46 52 A E > - 0 0 52 -9,-1.6 3,-1.7 -2,-1.2 -2,-0.1 -0.355 25.9 -88.3 -73.7 152.0 5.3 5.6 10.9 47 53 A K T 3 S+ 0 0 142 1,-0.3 -1,-0.1 2,-0.1 -10,-0.1 -0.289 113.8 19.9 -60.4 142.6 4.0 6.4 7.5 48 54 A Y T 3> S+ 0 0 52 -3,-0.1 4,-3.1 -13,-0.1 -1,-0.3 0.314 94.4 109.3 76.6 -2.6 4.3 10.0 6.4 49 55 A G H <> S+ 0 0 0 -3,-1.7 4,-2.1 -12,-0.2 -35,-0.3 0.963 80.5 42.1 -65.5 -54.3 6.9 10.5 9.0 50 56 A P H > S+ 0 0 62 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.804 116.2 51.9 -62.6 -30.2 9.8 10.8 6.5 51 57 A E H > S+ 0 0 80 2,-0.2 4,-2.6 1,-0.2 3,-0.2 0.963 108.1 48.5 -71.1 -50.7 7.5 13.0 4.4 52 58 A A H X S+ 0 0 0 -4,-3.1 4,-2.2 1,-0.2 5,-0.2 0.874 110.9 53.8 -57.8 -37.8 6.6 15.4 7.2 53 59 A S H X S+ 0 0 24 -4,-2.1 4,-2.7 -5,-0.2 -1,-0.2 0.898 110.7 44.1 -64.0 -42.2 10.3 15.7 8.0 54 60 A A H X S+ 0 0 35 -4,-1.5 4,-2.6 -3,-0.2 5,-0.2 0.871 111.7 52.3 -72.4 -36.6 11.3 16.6 4.5 55 61 A F H X S+ 0 0 64 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.977 115.9 41.6 -61.7 -50.9 8.4 19.1 4.1 56 62 A T H X S+ 0 0 0 -4,-2.2 4,-2.7 -5,-0.2 5,-0.3 0.920 113.5 52.2 -61.1 -48.1 9.5 20.8 7.4 57 63 A K H X S+ 0 0 93 -4,-2.7 4,-2.4 1,-0.2 5,-0.2 0.926 111.7 46.8 -56.7 -47.6 13.2 20.6 6.6 58 64 A K H X S+ 0 0 115 -4,-2.6 4,-1.5 1,-0.2 -1,-0.2 0.928 113.1 49.6 -60.4 -47.0 12.7 22.3 3.2 59 65 A M H < S+ 0 0 41 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.919 117.3 37.1 -61.4 -49.4 10.5 25.0 4.6 60 66 A V H >< S+ 0 0 3 -4,-2.7 3,-0.8 1,-0.2 -1,-0.2 0.853 115.1 52.5 -77.3 -32.5 12.7 26.0 7.5 61 67 A E H 3< S+ 0 0 89 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.745 110.4 47.2 -76.0 -23.5 16.1 25.7 5.8 62 68 A N T 3< S+ 0 0 127 -4,-1.5 2,-0.2 -5,-0.2 -1,-0.2 0.280 90.6 113.4 -98.4 9.9 15.1 27.8 2.8 63 69 A A < - 0 0 24 -3,-0.8 3,-0.1 1,-0.1 -3,-0.0 -0.563 55.0-157.3 -85.5 145.5 13.7 30.6 4.9 64 70 A K S S+ 0 0 181 1,-0.3 2,-0.4 -2,-0.2 -1,-0.1 0.809 85.2 28.2 -84.6 -33.9 15.1 34.1 5.2 65 71 A K - 0 0 138 -58,-0.0 24,-2.9 -60,-0.0 2,-0.4 -0.991 60.8-171.2-136.2 136.4 13.4 34.6 8.5 66 72 A I E -AE 6 88A 14 -60,-0.6 -60,-1.8 -2,-0.4 2,-0.4 -0.980 12.1-177.5-124.8 131.9 12.3 32.3 11.3 67 73 A E E -AE 5 87A 55 20,-2.1 20,-2.7 -2,-0.4 2,-0.4 -0.982 14.9-145.5-131.4 144.7 10.1 33.6 14.2 68 74 A V E -AE 4 86A 0 -64,-2.8 -64,-1.5 -2,-0.4 2,-0.5 -0.919 8.0-167.6-112.0 136.6 8.8 31.9 17.4 69 75 A E E -AE 3 85A 11 16,-2.6 16,-2.4 -2,-0.4 -66,-0.2 -0.948 8.7-157.1-126.6 107.1 5.4 32.7 18.9 70 76 A F E - E 0 84A 20 -68,-0.5 -68,-0.4 -2,-0.5 14,-0.2 -0.490 17.9-129.1 -77.9 152.4 4.8 31.3 22.4 71 77 A D - 0 0 2 12,-0.6 41,-0.1 3,-0.2 -1,-0.1 -0.148 33.6 -86.7 -88.6-164.0 1.2 30.9 23.5 72 78 A K S S+ 0 0 130 39,-0.5 40,-0.2 -2,-0.1 3,-0.1 0.478 105.0 52.3 -86.7 -2.8 -0.4 32.2 26.7 73 79 A G S S- 0 0 17 1,-0.3 2,-0.1 38,-0.1 37,-0.0 0.007 108.0 -21.0-107.8-144.4 0.4 29.2 29.0 74 80 A Q - 0 0 141 1,-0.1 -1,-0.3 -2,-0.1 -3,-0.2 -0.362 48.6-151.4 -68.6 144.1 3.6 27.4 29.8 75 81 A R S S+ 0 0 125 -3,-0.1 8,-3.3 -5,-0.1 2,-0.3 0.509 73.6 45.7 -94.9 -7.7 6.5 27.7 27.2 76 82 A T B S-F 82 0A 67 6,-0.3 6,-0.2 -48,-0.1 2,-0.1 -0.958 70.6-137.3-135.1 150.6 8.3 24.4 27.8 77 83 A D > - 0 0 28 4,-1.6 3,-2.2 -2,-0.3 4,-0.1 -0.396 46.4 -82.1 -93.8-178.9 7.1 20.8 28.1 78 84 A K T 3 S+ 0 0 182 1,-0.3 -1,-0.0 2,-0.1 -2,-0.0 0.709 128.7 58.1 -58.5 -22.9 8.3 18.1 30.6 79 85 A Y T 3 S- 0 0 164 2,-0.1 -1,-0.3 3,-0.0 3,-0.1 0.241 120.1-107.1 -90.2 8.3 11.4 17.4 28.3 80 86 A G S < S+ 0 0 46 -3,-2.2 2,-0.3 1,-0.2 -53,-0.3 0.674 70.8 148.9 74.8 16.3 12.5 21.0 28.5 81 87 A R - 0 0 63 -55,-0.1 -4,-1.6 1,-0.1 -53,-0.3 -0.641 51.9-114.0 -86.0 137.9 11.4 21.6 24.9 82 88 A G E -dF 28 76A 0 -55,-2.8 -53,-3.6 -2,-0.3 2,-0.6 -0.485 26.8-145.5 -68.4 140.1 10.2 25.1 23.8 83 89 A L E +d 29 0A 23 -8,-3.3 -12,-0.6 -55,-0.2 2,-0.3 -0.902 39.7 128.7-113.1 110.2 6.5 25.1 22.9 84 90 A A E -dE 30 70A 0 -55,-1.4 -53,-2.3 -2,-0.6 2,-0.5 -0.886 60.8-104.9-152.7 175.1 5.6 27.5 20.1 85 91 A Y E - E 0 69A 0 -16,-2.4 -16,-2.6 -2,-0.3 2,-0.5 -0.926 45.0-152.6-101.0 126.1 4.0 28.4 16.8 86 92 A I E - E 0 68A 0 -2,-0.5 7,-3.3 -18,-0.2 8,-0.5 -0.921 8.2-159.1-114.6 132.5 6.9 28.7 14.3 87 93 A Y E -GE 92 67A 19 -20,-2.7 -20,-2.1 -2,-0.5 2,-0.6 -0.944 6.1-163.5-113.9 132.6 6.8 30.9 11.3 88 94 A A E > S-GE 91 66A 2 3,-2.9 3,-2.1 -2,-0.4 -22,-0.2 -0.962 86.2 -22.1-112.5 111.6 9.1 30.5 8.2 89 95 A D T 3 S- 0 0 49 -24,-2.9 -1,-0.2 -2,-0.6 -23,-0.1 0.908 131.1 -49.1 51.2 43.1 9.0 33.7 6.1 90 96 A G T 3 S+ 0 0 48 -25,-0.3 2,-0.5 1,-0.2 -1,-0.3 0.444 114.5 118.8 80.4 -2.0 5.7 34.5 7.8 91 97 A K E < -G 88 0A 120 -3,-2.1 -3,-2.9 4,-0.0 2,-0.4 -0.892 66.7-126.3 -99.6 123.3 4.1 31.1 7.1 92 98 A M E > -G 87 0A 20 -2,-0.5 4,-2.1 -5,-0.3 -5,-0.3 -0.538 13.9-156.0 -69.8 118.7 3.2 29.2 10.2 93 99 A V H > S+ 0 0 0 -7,-3.3 4,-2.1 -2,-0.4 5,-0.2 0.859 90.3 58.6 -62.1 -38.9 4.8 25.7 10.0 94 100 A N H > S+ 0 0 0 -8,-0.5 4,-1.4 1,-0.2 -1,-0.2 0.910 110.9 40.8 -58.2 -46.7 2.2 24.1 12.3 95 101 A E H > S+ 0 0 46 2,-0.2 4,-3.4 1,-0.2 5,-0.2 0.915 110.5 57.3 -68.7 -45.7 -0.7 25.1 10.0 96 102 A A H X S+ 0 0 18 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.903 108.0 47.9 -52.4 -44.8 1.2 24.3 6.8 97 103 A L H <>S+ 0 0 0 -4,-2.1 5,-3.1 2,-0.2 6,-0.6 0.889 114.1 46.7 -63.7 -42.0 1.8 20.7 8.0 98 104 A V H ><5S+ 0 0 0 -4,-1.4 3,-2.0 4,-0.2 5,-0.2 0.951 109.6 52.9 -66.6 -48.6 -1.8 20.3 8.9 99 105 A R H 3<5S+ 0 0 69 -4,-3.4 -2,-0.2 1,-0.3 -1,-0.2 0.855 109.9 50.0 -57.0 -35.1 -3.1 21.8 5.7 100 106 A Q T 3<5S- 0 0 79 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.422 115.0-114.9 -83.5 -1.4 -1.0 19.2 3.7 101 107 A G T < 5S+ 0 0 0 -3,-2.0 32,-2.3 -4,-0.2 -3,-0.2 0.841 84.0 120.4 70.9 29.7 -2.2 16.3 5.7 102 108 A L S - 0 0 160 -2,-1.4 3,-1.8 3,-0.3 -77,-0.1 -0.861 36.0-105.8-100.8 113.3 -3.8 21.6 26.5 110 116 A K T 3 S+ 0 0 126 -2,-0.7 -2,-0.0 1,-0.3 0, 0.0 -0.423 100.3 32.9 -68.1 154.6 -5.5 24.9 27.3 111 117 A P T 3 S+ 0 0 67 0, 0.0 2,-1.6 0, 0.0 -39,-0.5 -0.935 111.6 70.1 -86.7 15.3 -4.6 27.7 27.7 112 118 A N S < S+ 0 0 11 -3,-1.8 -3,-0.3 1,-0.2 -80,-0.2 -0.407 78.7 87.6 -85.8 61.3 -2.0 26.9 25.0 113 119 A N > + 0 0 31 -2,-1.6 3,-2.0 -5,-0.1 4,-0.4 0.129 35.0 130.4-147.9 30.4 -4.6 26.7 22.2 114 120 A T T 3 S+ 0 0 56 -3,-0.4 3,-0.3 1,-0.3 4,-0.2 0.836 85.3 39.2 -54.8 -39.8 -5.1 30.2 20.8 115 121 A H T 3> S+ 0 0 42 1,-0.2 4,-2.1 2,-0.1 -1,-0.3 0.261 83.6 112.3 -97.5 14.8 -4.7 28.9 17.2 116 122 A E H <> S+ 0 0 19 -3,-2.0 4,-2.2 1,-0.2 5,-0.2 0.926 76.8 45.8 -51.5 -53.3 -6.7 25.7 17.8 117 123 A Q H > S+ 0 0 131 -4,-0.4 4,-2.3 -3,-0.3 -1,-0.2 0.904 110.2 52.3 -61.3 -44.9 -9.7 26.7 15.6 118 124 A H H > S+ 0 0 67 1,-0.2 4,-1.9 -4,-0.2 -1,-0.2 0.947 113.3 46.4 -54.6 -49.0 -7.6 28.0 12.6 119 125 A L H X S+ 0 0 1 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.841 108.9 53.1 -61.2 -42.4 -5.7 24.7 12.7 120 126 A R H X S+ 0 0 91 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.898 107.9 52.4 -65.0 -36.1 -8.8 22.5 13.0 121 127 A K H X S+ 0 0 135 -4,-2.3 4,-1.6 1,-0.2 -2,-0.2 0.917 110.0 48.8 -63.8 -43.0 -10.2 24.3 9.9 122 128 A S H X S+ 0 0 5 -4,-1.9 4,-1.6 1,-0.2 -1,-0.2 0.880 110.8 50.0 -66.1 -35.9 -7.1 23.5 8.0 123 129 A E H X S+ 0 0 16 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.884 107.3 53.6 -69.5 -38.4 -7.2 19.9 9.1 124 130 A A H X S+ 0 0 30 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.853 107.6 52.5 -63.2 -35.6 -10.8 19.5 8.0 125 131 A Q H X S+ 0 0 64 -4,-1.6 4,-1.5 1,-0.2 -1,-0.2 0.894 109.3 47.7 -68.0 -40.9 -9.8 20.8 4.6 126 132 A A H <>S+ 0 0 0 -4,-1.6 5,-2.8 2,-0.2 -2,-0.2 0.842 111.5 52.4 -67.3 -35.9 -7.0 18.3 4.2 127 133 A K H ><5S+ 0 0 81 -4,-2.1 3,-1.4 3,-0.2 -2,-0.2 0.947 110.0 46.0 -65.2 -50.8 -9.4 15.5 5.3 128 134 A K H 3<5S+ 0 0 131 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.806 114.1 49.7 -63.8 -29.3 -12.0 16.4 2.7 129 135 A E T 3<5S- 0 0 87 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.481 109.1-131.4 -86.6 -1.2 -9.2 16.6 0.1 130 136 A K T < 5 - 0 0 125 -3,-1.4 2,-0.3 1,-0.2 -3,-0.2 0.892 39.0-178.5 54.4 44.9 -8.0 13.2 1.4 131 137 A L > < - 0 0 44 -5,-2.8 3,-3.5 3,-0.1 -1,-0.2 -0.617 44.3 -63.6 -83.3 134.6 -4.5 14.4 1.7 132 138 A N G > S+ 0 0 48 -2,-0.3 3,-2.7 1,-0.3 -30,-0.2 -0.002 134.2 31.6 35.1-102.6 -1.7 12.0 2.8 133 139 A I G 3 S+ 0 0 39 -32,-2.3 -1,-0.3 1,-0.3 -31,-0.1 0.763 122.2 55.4 -50.7 -27.2 -2.5 11.0 6.3 134 140 A W G < 0 0 75 -3,-3.5 -1,-0.3 -33,-0.2 -2,-0.2 0.186 360.0 360.0 -94.6 14.5 -6.1 11.3 5.3 135 141 A S < 0 0 107 -3,-2.7 -2,-0.2 -4,-0.2 -1,-0.1 0.641 360.0 360.0-123.8 360.0 -5.9 8.9 2.4