==== 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 09-NOV-05 2EY5 . 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) . 7584.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 94 69.6 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 . 28 20.7 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+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 0 105 0, 0.0 2,-0.4 0, 0.0 70,-0.1 0.000 360.0 360.0 360.0 145.9 0.5 36.8 21.3 2 8 A H - 0 0 124 68,-0.3 68,-0.5 69,-0.1 2,-0.3 -0.985 360.0-123.3-137.4 147.6 3.7 38.1 19.7 3 9 A K E -A 69 0A 87 -2,-0.4 66,-0.2 66,-0.2 83,-0.0 -0.629 23.9-167.3 -81.7 140.4 6.4 36.8 17.3 4 10 A E E -A 68 0A 33 64,-2.5 64,-3.1 -2,-0.3 2,-0.1 -0.970 25.5-107.4-126.3 144.0 10.1 36.8 18.4 5 11 A P E +A 67 0A 92 0, 0.0 17,-0.4 0, 0.0 2,-0.3 -0.343 41.0 167.5 -73.4 148.1 13.1 36.2 16.1 6 12 A A E -A 66 0A 12 60,-2.0 60,-0.7 15,-0.1 2,-0.4 -0.961 26.5-126.8-151.8 165.9 15.1 33.0 16.2 7 13 A T E -B 20 0A 98 13,-2.0 13,-3.7 -2,-0.3 2,-0.1 -0.983 26.0-113.1-127.0 135.7 17.7 31.2 14.1 8 14 A L E +B 19 0A 44 -2,-0.4 11,-0.2 11,-0.2 3,-0.1 -0.297 36.3 165.3 -59.1 132.7 17.7 27.7 12.7 9 15 A I E - 0 0 69 9,-2.6 2,-0.3 1,-0.2 10,-0.2 0.698 67.4 -25.1-108.9 -54.1 20.2 25.4 14.2 10 16 A K E -B 18 0A 130 8,-2.0 8,-3.2 0, 0.0 2,-0.4 -0.944 49.8-128.7-159.4 133.9 18.9 22.0 13.0 11 17 A A E +B 17 0A 16 -2,-0.3 6,-0.2 6,-0.2 3,-0.1 -0.687 28.7 175.8 -76.4 136.6 15.6 20.4 11.9 12 18 A I - 0 0 40 4,-2.1 2,-0.3 1,-0.4 5,-0.2 0.776 55.8 -17.7-111.4 -39.9 15.2 17.2 13.9 13 19 A D S S- 0 0 5 3,-2.7 3,-0.5 39,-0.1 -1,-0.4 -0.895 77.4 -80.6-154.2 178.7 11.8 15.8 13.0 14 20 A G S S+ 0 0 0 22,-0.4 23,-0.1 -2,-0.3 83,-0.1 0.862 131.9 24.6 -56.8 -35.9 8.5 16.7 11.4 15 21 A D S S+ 0 0 8 20,-0.1 15,-2.7 21,-0.1 2,-0.4 0.291 115.9 70.3-117.9 10.7 7.4 18.3 14.7 16 22 A T E + C 0 29A 13 -3,-0.5 -3,-2.7 13,-0.2 -4,-2.1 -0.986 50.5 168.8-138.0 126.3 10.7 19.1 16.3 17 23 A V E -BC 11 28A 2 11,-1.9 11,-3.6 -2,-0.4 2,-0.5 -0.987 28.0-133.3-135.7 143.7 13.3 21.7 15.5 18 24 A K E +BC 10 27A 82 -8,-3.2 -9,-2.6 -2,-0.3 -8,-2.0 -0.876 33.6 176.8 -97.8 123.7 16.4 23.1 17.2 19 25 A L E -BC 8 26A 0 7,-2.7 7,-2.6 -2,-0.5 2,-0.7 -0.879 36.1-121.6-126.3 155.5 16.6 26.9 17.2 20 26 A M E +BC 7 25A 69 -13,-3.7 -13,-2.0 -2,-0.3 2,-0.5 -0.893 41.4 176.1 -92.4 115.4 18.8 29.6 18.6 21 27 A Y E > - C 0 24A 33 3,-3.1 3,-1.6 -2,-0.7 -15,-0.1 -0.971 63.5 -13.8-129.7 119.9 16.5 31.7 20.7 22 28 A K T 3 S- 0 0 114 -2,-0.5 -1,-0.2 -17,-0.4 -16,-0.1 0.923 128.9 -54.5 56.4 44.0 17.6 34.7 22.9 23 29 A G T 3 S+ 0 0 59 1,-0.2 -1,-0.3 -3,-0.1 -17,-0.0 0.445 119.7 105.6 71.4 -0.4 21.2 33.5 22.4 24 30 A Q E < S-C 21 0A 133 -3,-1.6 -3,-3.1 2,-0.0 2,-0.3 -0.912 72.1-123.8-115.2 138.9 20.5 30.0 23.7 25 31 A P E +C 20 0A 75 0, 0.0 2,-0.3 0, 0.0 -5,-0.2 -0.624 43.3 169.9 -74.6 135.9 20.2 26.8 21.7 26 32 A M E -C 19 0A 45 -7,-2.6 -7,-2.7 -2,-0.3 2,-0.5 -0.999 34.5-126.4-149.7 141.3 16.8 25.3 22.5 27 33 A T E -C 18 0A 40 -2,-0.3 55,-1.9 53,-0.3 2,-0.4 -0.814 26.8-158.2 -92.0 127.4 14.7 22.5 21.1 28 34 A F E -Cd 17 82A 0 -11,-3.6 -11,-1.9 -2,-0.5 2,-0.4 -0.853 7.0-153.3-106.3 140.4 11.2 23.5 20.1 29 35 A R E -Cd 16 83A 34 53,-3.3 55,-1.5 -2,-0.4 2,-0.5 -0.934 31.3-113.6-103.2 131.0 8.2 21.1 19.8 30 36 A L E > - d 0 84A 1 -15,-2.7 3,-1.1 -2,-0.4 55,-0.2 -0.584 34.9-119.2 -73.1 121.3 5.5 22.3 17.4 31 37 A L T 3 S+ 0 0 13 53,-2.2 55,-0.1 -2,-0.5 -1,-0.1 -0.299 82.8 1.1 -59.0 138.9 2.3 23.2 19.2 32 38 A L T 3 S+ 0 0 9 75,-0.2 74,-2.6 80,-0.1 2,-0.4 0.346 104.2 106.7 67.6 7.3 -1.0 21.4 18.5 33 39 A V E < -H 105 0B 0 -3,-1.1 2,-0.5 72,-0.3 72,-0.2 -0.960 48.9-163.6-126.0 141.8 0.4 19.0 15.9 34 40 A D E -H 104 0B 61 70,-2.4 70,-2.7 -2,-0.4 3,-0.0 -0.966 18.1-174.4-116.7 102.2 1.2 15.3 15.8 35 41 A S - 0 0 8 -2,-0.5 68,-0.2 68,-0.3 -20,-0.1 -0.664 37.2 -95.5 -92.2 143.2 3.4 14.4 12.9 36 42 A P - 0 0 12 0, 0.0 -22,-0.4 0, 0.0 2,-0.3 -0.377 52.9-122.2 -60.8 145.8 4.4 10.8 12.0 37 43 A E - 0 0 35 1,-0.1 9,-1.5 2,-0.1 12,-0.3 -0.665 30.6-170.3 -99.6 147.4 7.7 10.1 13.7 38 44 A T S S+ 0 0 33 -2,-0.3 2,-0.1 11,-0.2 -1,-0.1 0.523 82.1 57.1 -95.7 -17.5 11.1 9.1 12.4 39 45 A K > + 0 0 101 3,-0.1 5,-0.9 6,-0.0 7,-0.2 -0.478 69.5 66.2-106.6 179.4 12.2 8.6 16.0 40 46 A H T >5 - 0 0 109 3,-0.2 4,-0.6 -2,-0.1 3,-0.2 0.766 58.9-132.3 77.9 120.9 11.1 6.6 19.1 41 47 A P T 45S+ 0 0 113 0, 0.0 2,-1.8 0, 0.0 4,-0.1 0.768 101.2 80.7 -69.7 -21.8 11.3 2.8 19.3 42 48 A K T 45S- 0 0 172 2,-0.1 2,-0.2 1,-0.0 -3,-0.1 -0.233 127.7 -9.0 -79.8 50.0 7.7 2.9 20.6 43 49 A K T 45S- 0 0 113 -2,-1.8 2,-0.4 -3,-0.2 -3,-0.2 -0.733 89.6-160.8 155.7 -96.8 6.9 3.3 16.9 44 50 A G << - 0 0 21 -5,-0.9 2,-0.5 -4,-0.6 -2,-0.1 -0.971 65.1 -6.4 134.7-116.1 10.1 3.8 14.9 45 51 A V S S- 0 0 101 -2,-0.4 -7,-0.2 -4,-0.1 3,-0.1 -0.714 83.8-167.2-111.7 74.9 10.0 5.3 11.4 46 52 A E > - 0 0 70 -9,-1.5 3,-1.4 -2,-0.5 2,-0.2 0.003 33.9 -69.5 -62.8 167.9 6.3 5.4 10.9 47 53 A K T 3 S+ 0 0 161 1,-0.3 -1,-0.2 2,-0.2 -10,-0.1 -0.438 120.8 8.0 -68.6 129.2 4.5 6.1 7.6 48 54 A Y T 3> S+ 0 0 38 -2,-0.2 4,-3.5 -3,-0.1 5,-0.4 0.172 96.1 116.3 81.4 -8.2 4.9 9.6 6.2 49 55 A G H <> S+ 0 0 0 -3,-1.4 4,-2.5 -12,-0.3 -11,-0.2 0.939 77.5 44.1 -48.9 -53.8 7.4 10.2 9.0 50 56 A P H > S+ 0 0 66 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.864 115.5 50.5 -66.0 -29.6 10.2 10.8 6.5 51 57 A E H > S+ 0 0 102 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.871 111.4 45.4 -69.4 -44.2 7.9 12.9 4.4 52 58 A A H X S+ 0 0 0 -4,-3.5 4,-2.3 1,-0.2 5,-0.3 0.895 113.2 53.2 -65.7 -39.7 6.8 15.1 7.3 53 59 A S H X S+ 0 0 25 -4,-2.5 4,-2.0 -5,-0.4 -2,-0.2 0.917 109.0 46.2 -62.4 -44.4 10.4 15.4 8.3 54 60 A A H X S+ 0 0 45 -4,-1.9 4,-2.6 -5,-0.2 5,-0.3 0.874 110.7 55.0 -70.3 -32.3 11.6 16.6 4.9 55 61 A F H X S+ 0 0 56 -4,-2.0 4,-2.3 2,-0.2 5,-0.2 0.972 110.3 43.1 -66.1 -48.6 8.8 19.1 4.7 56 62 A T H X S+ 0 0 0 -4,-2.3 4,-2.8 1,-0.2 5,-0.4 0.964 115.0 51.5 -59.6 -43.4 9.6 20.8 8.0 57 63 A K H X S+ 0 0 90 -4,-2.0 4,-2.5 -5,-0.3 -2,-0.2 0.943 111.9 43.5 -63.5 -44.6 13.3 20.8 7.2 58 64 A K H X S+ 0 0 136 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.934 113.2 54.6 -65.6 -41.2 13.0 22.3 3.7 59 65 A M H < S+ 0 0 39 -4,-2.3 -2,-0.2 -5,-0.3 -1,-0.2 0.927 116.7 34.0 -60.8 -44.9 10.5 24.8 5.1 60 66 A V H >< S+ 0 0 3 -4,-2.8 3,-0.8 -5,-0.2 -1,-0.2 0.845 117.2 54.8 -80.2 -29.7 12.8 26.1 7.9 61 67 A E H 3< S+ 0 0 94 -4,-2.5 -2,-0.2 -5,-0.4 -1,-0.2 0.866 109.8 45.5 -69.9 -33.2 16.0 25.7 5.9 62 68 A N T 3< S+ 0 0 128 -4,-2.5 -1,-0.2 -5,-0.2 2,-0.2 0.336 90.3 111.6 -92.2 3.8 14.9 27.8 3.0 63 69 A A < - 0 0 22 -3,-0.8 3,-0.2 -4,-0.2 -3,-0.0 -0.511 56.1-155.1 -82.1 148.1 13.5 30.6 5.0 64 70 A K S S+ 0 0 165 1,-0.3 2,-0.4 -2,-0.2 -1,-0.1 0.848 87.2 23.1 -77.4 -40.5 15.0 34.1 5.2 65 71 A K - 0 0 135 -58,-0.0 24,-3.1 2,-0.0 2,-0.4 -0.995 64.4-165.9-133.4 129.9 13.4 34.7 8.6 66 72 A I E -AE 6 88A 17 -60,-0.7 -60,-2.0 -2,-0.4 2,-0.4 -0.926 13.0-175.1-110.4 137.0 12.2 32.3 11.4 67 73 A E E -AE 5 87A 55 20,-2.1 20,-2.5 -2,-0.4 2,-0.4 -0.987 14.6-144.9-132.0 144.1 10.0 33.5 14.2 68 74 A V E -AE 4 86A 0 -64,-3.1 -64,-2.5 -2,-0.4 2,-0.4 -0.860 8.8-167.5-108.8 143.7 8.7 31.8 17.3 69 75 A E E -AE 3 85A 14 16,-2.0 16,-3.1 -2,-0.4 -66,-0.2 -0.954 9.8-154.4-129.7 106.3 5.3 32.6 18.8 70 76 A F E - E 0 84A 21 -68,-0.5 -68,-0.3 -2,-0.4 14,-0.2 -0.460 15.5-131.3 -74.7 153.9 4.6 31.2 22.3 71 77 A D - 0 0 1 12,-0.7 41,-0.1 3,-0.2 -1,-0.1 -0.129 31.4 -92.6 -92.9-163.4 0.9 30.6 23.3 72 78 A K S S+ 0 0 126 39,-0.6 40,-0.2 -2,-0.1 3,-0.1 0.651 101.8 63.4 -87.5 -18.0 -0.8 31.8 26.6 73 79 A G S S- 0 0 13 1,-0.3 37,-0.1 38,-0.1 -3,-0.0 0.243 107.5 -30.5 -87.2-154.8 -0.1 28.6 28.6 74 80 A Q - 0 0 121 1,-0.1 -1,-0.3 -4,-0.0 -3,-0.2 -0.314 50.2-152.2 -64.1 150.2 3.1 27.0 29.8 75 81 A R S S+ 0 0 123 -3,-0.1 8,-2.5 -5,-0.1 2,-0.3 0.476 74.3 48.6-109.7 -1.4 6.0 27.6 27.3 76 82 A T B S-F 82 0A 74 6,-0.3 6,-0.2 -48,-0.1 2,-0.1 -0.971 71.5-141.5-129.9 146.4 8.1 24.4 28.1 77 83 A D > - 0 0 35 4,-2.0 3,-2.0 -2,-0.3 -2,-0.1 -0.418 43.8 -86.4 -97.2-176.2 7.0 20.8 28.3 78 84 A K T 3 S+ 0 0 170 1,-0.3 -1,-0.0 -2,-0.1 -2,-0.0 0.748 126.1 58.3 -66.4 -15.7 8.4 18.3 30.8 79 85 A Y T 3 S- 0 0 159 2,-0.1 -1,-0.3 1,-0.0 0, 0.0 0.419 120.3-104.4 -94.4 5.5 11.3 17.4 28.5 80 86 A G S < S+ 0 0 47 -3,-2.0 2,-0.4 1,-0.3 -53,-0.3 0.552 74.2 141.0 90.9 4.6 12.6 21.0 28.4 81 87 A R - 0 0 67 -55,-0.1 -4,-2.0 -53,-0.1 -1,-0.3 -0.653 54.6-115.9 -86.5 137.7 11.3 21.7 25.0 82 88 A G E -dF 28 76A 0 -55,-1.9 -53,-3.3 -2,-0.4 2,-0.7 -0.357 22.2-141.5 -59.7 143.6 9.8 25.1 24.0 83 89 A L E +d 29 0A 25 -8,-2.5 -12,-0.7 -55,-0.2 2,-0.3 -0.899 43.8 135.9-112.5 104.9 6.1 24.9 23.0 84 90 A A E -dE 30 70A 0 -55,-1.5 -53,-2.2 -2,-0.7 2,-0.5 -0.915 59.5-108.5-147.3 167.2 5.5 27.3 20.1 85 91 A Y E - E 0 69A 0 -16,-3.1 -16,-2.0 -2,-0.3 2,-0.4 -0.889 42.4-148.3 -92.3 126.1 4.0 28.2 16.8 86 92 A I E - E 0 68A 1 -2,-0.5 7,-2.8 -18,-0.2 8,-0.8 -0.921 10.5-162.2-109.8 135.0 6.8 28.4 14.3 87 93 A Y E -GE 92 67A 15 -20,-2.5 -20,-2.1 -2,-0.4 2,-0.5 -0.940 8.5-164.1-118.0 129.4 6.8 30.7 11.3 88 94 A A E > S-GE 91 66A 4 3,-3.5 3,-2.2 -2,-0.4 -22,-0.2 -0.978 83.0 -26.7-115.7 114.8 9.0 30.6 8.2 89 95 A D T 3 S- 0 0 48 -24,-3.1 -1,-0.2 -2,-0.5 -23,-0.1 0.866 130.0 -45.2 42.1 48.1 8.9 33.9 6.3 90 96 A G T 3 S+ 0 0 48 -25,-0.3 2,-0.5 1,-0.2 -1,-0.3 0.407 116.8 113.3 87.1 -4.7 5.5 34.6 7.7 91 97 A K E < -G 88 0A 119 -3,-2.2 -3,-3.5 4,-0.0 2,-0.6 -0.909 68.6-124.8-106.7 130.0 4.0 31.2 7.1 92 98 A M E > -G 87 0A 18 -2,-0.5 4,-2.4 -5,-0.3 -5,-0.3 -0.539 12.7-159.1 -74.3 116.4 3.2 29.0 10.1 93 99 A V H > S+ 0 0 1 -7,-2.8 4,-2.2 -2,-0.6 5,-0.2 0.892 91.8 59.1 -60.5 -37.7 5.0 25.6 9.8 94 100 A N H > S+ 0 0 0 -8,-0.8 4,-1.2 1,-0.2 -1,-0.2 0.923 110.2 41.2 -60.5 -43.0 2.4 24.1 12.2 95 101 A E H > S+ 0 0 44 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.911 110.6 56.6 -69.8 -45.1 -0.5 24.9 9.8 96 102 A A H X S+ 0 0 17 -4,-2.4 4,-2.0 1,-0.2 6,-0.2 0.920 106.0 51.2 -52.9 -46.2 1.4 24.0 6.6 97 103 A L H <>S+ 0 0 0 -4,-2.2 5,-3.1 1,-0.2 6,-0.5 0.903 113.9 43.8 -58.5 -41.3 2.1 20.5 7.9 98 104 A V H ><5S+ 0 0 0 -4,-1.2 3,-1.8 -5,-0.2 -1,-0.2 0.894 109.9 55.0 -74.5 -40.4 -1.6 20.0 8.7 99 105 A R H 3<5S+ 0 0 73 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.877 108.0 51.2 -60.1 -34.1 -2.8 21.5 5.5 100 106 A Q T 3<5S- 0 0 84 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.286 116.4-113.4 -85.1 7.3 -0.6 19.0 3.5 101 107 A G T < 5S+ 0 0 0 -3,-1.8 32,-2.4 2,-0.1 33,-0.2 0.864 86.1 119.6 64.7 30.1 -2.0 16.0 5.4 102 108 A L S - 0 0 170 -2,-0.5 3,-2.2 3,-0.4 -36,-0.1 -0.857 33.7-107.3-106.6 107.9 -4.4 21.5 26.4 110 116 A K T 3 S+ 0 0 146 -2,-0.7 0, 0.0 1,-0.3 0, 0.0 -0.414 98.5 30.0 -63.9 152.0 -6.0 24.8 27.2 111 117 A P T 3 S+ 0 0 52 0, 0.0 2,-1.8 0, 0.0 -39,-0.6 -0.946 111.0 70.5 -93.2 20.2 -5.0 27.5 27.5 112 118 A N S < S+ 0 0 9 -3,-2.2 -3,-0.4 1,-0.2 -80,-0.1 -0.518 77.9 92.1 -87.7 71.0 -2.4 26.6 24.9 113 119 A N > + 0 0 18 -2,-1.8 3,-1.7 -5,-0.1 4,-0.4 0.192 33.0 129.2-152.6 19.2 -4.9 26.5 22.1 114 120 A T T 3 S+ 0 0 54 -3,-0.4 3,-0.5 1,-0.3 4,-0.2 0.899 84.4 36.4 -50.0 -48.8 -5.1 29.9 20.5 115 121 A H T 3> S+ 0 0 37 1,-0.2 4,-2.2 2,-0.1 5,-0.3 0.288 85.1 112.1 -93.7 17.0 -4.8 28.6 16.9 116 122 A E H <> S+ 0 0 34 -3,-1.7 4,-2.1 1,-0.2 -1,-0.2 0.905 76.1 46.7 -56.6 -43.7 -6.7 25.5 17.4 117 123 A Q H > S+ 0 0 123 -3,-0.5 4,-1.9 -4,-0.4 -1,-0.2 0.940 109.8 54.3 -68.0 -41.1 -9.7 26.4 15.3 118 124 A H H > S+ 0 0 73 -4,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.903 111.9 43.8 -57.5 -46.2 -7.5 27.6 12.4 119 125 A L H X S+ 0 0 0 -4,-2.2 4,-3.2 2,-0.2 -1,-0.2 0.866 108.3 56.4 -69.9 -36.2 -5.6 24.3 12.3 120 126 A R H X S+ 0 0 91 -4,-2.1 4,-2.0 -5,-0.3 -1,-0.2 0.894 107.2 52.3 -64.6 -33.0 -8.7 22.2 12.6 121 127 A K H X S+ 0 0 142 -4,-1.9 4,-1.5 2,-0.2 -1,-0.2 0.862 111.1 45.6 -61.5 -46.7 -10.0 24.0 9.5 122 128 A S H X S+ 0 0 7 -4,-1.7 4,-2.6 1,-0.2 -2,-0.2 0.895 111.3 53.5 -69.5 -33.4 -6.8 23.2 7.7 123 129 A E H X S+ 0 0 19 -4,-3.2 4,-2.2 1,-0.2 -2,-0.2 0.884 106.2 51.4 -70.9 -34.3 -7.0 19.6 8.8 124 130 A A H X S+ 0 0 48 -4,-2.0 4,-2.8 2,-0.2 -1,-0.2 0.853 110.5 50.1 -65.6 -34.0 -10.6 19.2 7.6 125 131 A Q H X S+ 0 0 77 -4,-1.5 4,-3.1 2,-0.2 5,-0.2 0.968 109.6 49.5 -69.5 -51.5 -9.5 20.5 4.1 126 132 A A H <>S+ 0 0 0 -4,-2.6 5,-2.1 1,-0.2 4,-0.3 0.921 114.5 45.6 -53.0 -42.1 -6.5 18.1 3.9 127 133 A K H ><5S+ 0 0 88 -4,-2.2 3,-1.4 -5,-0.2 -1,-0.2 0.948 111.9 51.2 -67.4 -42.4 -8.9 15.2 4.9 128 134 A K H 3<5S+ 0 0 136 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.870 113.0 46.1 -58.6 -36.2 -11.5 16.5 2.4 129 135 A E T 3<5S- 0 0 74 -4,-3.1 -1,-0.3 -5,-0.1 -2,-0.2 0.462 109.1-131.8 -86.8 1.4 -8.7 16.5 -0.2 130 136 A K T < 5 + 0 0 140 -3,-1.4 2,-0.3 -4,-0.3 -3,-0.2 0.851 41.4 177.6 52.2 44.8 -7.6 13.1 1.0 131 137 A L > < - 0 0 50 -5,-2.1 3,-3.2 -6,-0.1 -1,-0.2 -0.604 46.1 -55.3 -85.5 137.4 -3.9 14.2 1.2 132 138 A N G > S+ 0 0 52 1,-0.3 3,-2.8 -2,-0.3 -30,-0.2 -0.059 137.1 29.5 37.5-104.9 -1.1 11.9 2.5 133 139 A I G 3 S+ 0 0 43 -32,-2.4 -1,-0.3 1,-0.3 -31,-0.1 0.847 127.3 49.2 -37.2 -43.6 -2.2 10.7 6.0 134 140 A W G < 0 0 70 -3,-3.2 -1,-0.3 -33,-0.2 -2,-0.2 0.352 360.0 360.0 -89.9 7.5 -5.7 11.0 4.7 135 141 A S < 0 0 112 -3,-2.8 -4,-0.1 -34,-0.2 -5,-0.1 -0.529 360.0 360.0 -77.1 360.0 -5.2 9.1 1.5