==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 15-APR-10 2KWP . COMPND 2 MOLECULE: TRANSCRIPTION ELONGATION PROTEIN NUSA; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR K.SCHWEIMER,M.JURK,P.ROESCH . 129 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9564.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 90 69.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 3.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 13 10.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 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 . 3 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 54 41.9 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 0 0 0 0 1 0 0 0 0 0 1 0 0 1 0 0 1 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 . 0 0 0 0 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 . 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 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 1 A M 0 0 170 0, 0.0 2,-0.7 0, 0.0 54,-0.2 0.000 360.0 360.0 360.0 101.3 -4.5 -34.1 -30.8 2 2 A N > - 0 0 28 52,-3.1 4,-1.0 1,-0.2 3,-0.1 -0.798 360.0-171.7 -94.2 114.7 -4.4 -32.1 -27.6 3 3 A K H > S+ 0 0 178 -2,-0.7 4,-2.3 1,-0.2 5,-0.2 0.831 84.2 64.3 -73.8 -29.2 -7.4 -32.9 -25.4 4 4 A E H > S+ 0 0 96 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.905 98.4 54.9 -61.4 -38.0 -6.5 -30.0 -23.0 5 5 A I H > S+ 0 0 1 49,-0.3 4,-1.3 1,-0.2 -1,-0.2 0.931 111.4 43.5 -62.5 -42.4 -7.2 -27.5 -25.9 6 6 A L H X S+ 0 0 37 -4,-1.0 4,-1.2 1,-0.2 -1,-0.2 0.842 113.0 53.3 -72.4 -30.3 -10.7 -28.9 -26.4 7 7 A A H X S+ 0 0 53 -4,-2.3 4,-1.4 1,-0.2 -2,-0.2 0.908 106.5 51.2 -71.6 -39.4 -11.2 -29.0 -22.6 8 8 A V H X S+ 0 0 22 -4,-2.6 4,-2.0 1,-0.2 5,-0.2 0.849 105.7 57.1 -67.0 -30.4 -10.3 -25.4 -22.2 9 9 A V H X S+ 0 0 1 -4,-1.3 4,-2.2 -5,-0.2 -1,-0.2 0.874 104.1 52.2 -69.1 -33.9 -12.8 -24.4 -24.9 10 10 A E H X S+ 0 0 125 -4,-1.2 4,-1.5 1,-0.2 5,-0.2 0.855 111.3 47.0 -71.1 -31.9 -15.6 -26.1 -23.0 11 11 A A H X S+ 0 0 63 -4,-1.4 4,-1.6 2,-0.2 -2,-0.2 0.854 116.4 43.4 -78.1 -33.4 -14.8 -24.1 -19.9 12 12 A V H X S+ 0 0 15 -4,-2.0 4,-2.5 2,-0.2 6,-0.5 0.828 111.3 54.8 -81.0 -30.6 -14.5 -20.8 -21.8 13 13 A S H X S+ 0 0 4 -4,-2.2 4,-1.0 -5,-0.2 5,-0.5 0.944 115.7 37.1 -68.4 -45.1 -17.7 -21.5 -23.9 14 14 A N H < S+ 0 0 142 -4,-1.5 -2,-0.2 -5,-0.2 -1,-0.2 0.898 121.7 45.6 -74.2 -38.6 -19.8 -22.0 -20.8 15 15 A E H < S+ 0 0 138 -4,-1.6 -2,-0.2 -5,-0.2 -3,-0.2 0.890 126.4 31.0 -72.1 -36.6 -18.1 -19.3 -18.8 16 16 A K H < S- 0 0 52 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.544 96.3-139.7 -97.0 -7.4 -18.2 -16.8 -21.7 17 17 A A < + 0 0 86 -4,-1.0 -3,-0.2 -5,-0.2 -4,-0.2 0.777 61.8 129.7 56.3 21.0 -21.4 -18.3 -23.1 18 18 A L - 0 0 47 -6,-0.5 -1,-0.2 -5,-0.5 -2,-0.1 -0.648 68.7 -85.9-104.3 164.7 -19.8 -17.8 -26.5 19 19 A P > - 0 0 83 0, 0.0 4,-1.5 0, 0.0 3,-0.4 -0.384 32.0-125.4 -68.0 141.3 -19.4 -20.3 -29.4 20 20 A R H > S+ 0 0 110 1,-0.2 4,-2.2 2,-0.2 5,-0.3 0.918 110.3 61.8 -54.6 -42.0 -16.4 -22.6 -29.2 21 21 A E H > S+ 0 0 141 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.937 100.5 53.2 -51.4 -47.1 -15.4 -21.5 -32.7 22 22 A K H > S+ 0 0 73 -3,-0.4 4,-1.6 1,-0.2 -1,-0.2 0.934 106.4 53.5 -55.9 -44.6 -15.0 -17.9 -31.4 23 23 A I H >X S+ 0 0 8 -4,-1.5 4,-2.5 1,-0.2 3,-0.6 0.971 105.7 51.5 -56.3 -53.8 -12.6 -19.2 -28.6 24 24 A F H 3X S+ 0 0 12 -4,-2.2 4,-2.9 1,-0.3 5,-0.2 0.879 103.7 61.5 -52.6 -34.8 -10.3 -21.0 -31.1 25 25 A E H 3X S+ 0 0 84 -4,-1.8 4,-2.0 -5,-0.3 -1,-0.3 0.949 107.3 42.5 -58.8 -46.3 -10.2 -17.6 -33.0 26 26 A A H X S+ 0 0 16 -4,-3.4 3,-1.0 -5,-0.3 4,-0.8 0.963 103.4 46.6 -61.0 -50.3 4.7 -17.8 -33.4 36 36 A K H 3X S+ 0 0 51 -4,-2.8 4,-2.9 1,-0.2 5,-0.5 0.805 99.4 72.3 -63.6 -24.7 6.1 -14.7 -35.3 37 37 A K H 3< S+ 0 0 132 -4,-0.8 -1,-0.2 -5,-0.3 -2,-0.2 0.905 91.2 57.3 -58.3 -37.9 8.0 -13.9 -32.1 38 38 A K H << S+ 0 0 162 -4,-1.0 -1,-0.2 -3,-1.0 -2,-0.2 0.927 111.6 41.2 -60.3 -41.9 10.3 -16.8 -32.9 39 39 A Y H < S- 0 0 60 -4,-0.8 -2,-0.2 -3,-0.2 -1,-0.2 0.914 85.6-162.0 -73.3 -40.7 11.2 -15.3 -36.3 40 40 A E < + 0 0 149 -4,-2.9 -3,-0.1 1,-0.1 -1,-0.1 0.678 60.6 110.6 68.0 12.2 11.4 -11.8 -34.9 41 41 A Q S S- 0 0 100 -5,-0.5 -1,-0.1 31,-0.1 -4,-0.1 0.118 91.9-114.3-104.2 22.4 11.0 -10.6 -38.6 42 42 A E + 0 0 148 -6,-0.3 2,-0.3 1,-0.2 -5,-0.1 0.944 57.5 169.6 46.9 52.8 7.5 -9.2 -38.0 43 43 A I - 0 0 1 -7,-0.2 2,-0.7 30,-0.1 30,-0.2 -0.717 39.9-114.0 -96.7 147.7 6.1 -11.8 -40.4 44 44 A D + 0 0 24 28,-0.5 17,-2.2 17,-0.4 2,-0.4 -0.673 41.5 177.9 -81.2 116.2 2.3 -12.4 -40.7 45 45 A V E -A 60 0A 4 -2,-0.7 2,-0.4 15,-0.2 15,-0.3 -0.961 12.8-166.1-122.8 136.5 1.5 -15.9 -39.3 46 46 A R E -A 59 0A 132 13,-3.5 13,-2.6 -2,-0.4 2,-0.4 -0.965 5.0-160.1-121.7 132.1 -1.9 -17.5 -39.0 47 47 A V E -A 58 0A 1 -2,-0.4 2,-0.4 11,-0.3 11,-0.2 -0.918 2.4-158.1-113.8 135.0 -2.6 -20.6 -36.9 48 48 A Q E -A 57 0A 84 9,-2.2 9,-2.1 -2,-0.4 2,-0.4 -0.897 6.9-153.5-110.9 137.5 -5.7 -22.9 -37.4 49 49 A I E -A 56 0A 17 -2,-0.4 2,-0.6 7,-0.3 7,-0.3 -0.856 5.9-144.7-110.3 145.5 -7.0 -25.2 -34.7 50 50 A D E >> -A 55 0A 94 5,-3.7 4,-3.2 -2,-0.4 5,-1.1 -0.902 9.1-170.8-110.6 112.4 -9.0 -28.4 -35.2 51 51 A R T 45S+ 0 0 129 -2,-0.6 -1,-0.2 3,-0.2 -45,-0.1 0.949 87.3 54.0 -66.1 -46.4 -11.6 -29.1 -32.6 52 52 A K T 45S+ 0 0 176 1,-0.2 -1,-0.2 2,-0.1 -2,-0.1 0.978 125.0 24.5 -51.9 -60.8 -12.3 -32.6 -33.9 53 53 A S T 45S- 0 0 40 2,-0.1 -2,-0.2 -52,-0.0 -1,-0.2 0.917 103.8-131.9 -72.8 -41.5 -8.6 -33.6 -33.6 54 54 A G T <5 + 0 0 0 -4,-3.2 -52,-3.1 1,-0.3 2,-0.3 0.825 67.2 105.1 93.3 36.3 -7.9 -31.0 -30.9 55 55 A D E < -A 50 0A 66 -5,-1.1 -5,-3.7 -54,-0.2 2,-0.4 -0.987 52.7-149.7-145.5 155.1 -4.7 -29.6 -32.6 56 56 A F E -A 49 0A 3 -2,-0.3 2,-0.4 -7,-0.3 -7,-0.3 -0.971 8.0-146.4-129.0 143.6 -3.7 -26.4 -34.5 57 57 A D E -A 48 0A 35 -9,-2.1 -9,-2.2 -2,-0.4 2,-0.3 -0.891 19.9-124.9-110.0 136.6 -1.1 -25.9 -37.2 58 58 A T E -A 47 0A 0 -2,-0.4 39,-1.9 39,-0.3 2,-0.3 -0.596 32.5-174.6 -78.8 134.2 0.9 -22.7 -37.6 59 59 A F E -AB 46 96A 27 -13,-2.6 -13,-3.5 -2,-0.3 2,-0.4 -0.930 13.7-147.5-128.8 154.2 0.6 -21.1 -41.0 60 60 A R E -AB 45 95A 40 35,-4.1 35,-2.3 -2,-0.3 2,-0.3 -0.926 11.8-166.0-121.1 146.1 2.3 -18.1 -42.6 61 61 A R E - B 0 94A 68 -17,-2.2 -17,-0.4 -2,-0.4 2,-0.3 -0.927 1.2-165.6-129.6 155.7 0.8 -15.7 -45.3 62 62 A W E - B 0 93A 41 31,-1.7 31,-3.9 -2,-0.3 2,-0.4 -0.968 19.2-124.0-138.2 155.0 2.3 -13.1 -47.6 63 63 A L E -cB 74 92A 43 10,-0.7 12,-3.3 -2,-0.3 2,-0.4 -0.807 32.2-110.0-101.0 139.8 0.9 -10.3 -49.7 64 64 A V E -c 75 0A 1 27,-3.0 26,-1.2 -2,-0.4 2,-0.4 -0.495 43.6-177.9 -67.2 120.9 1.7 -10.1 -53.5 65 65 A V E > -c 76 0A 16 10,-3.6 12,-1.4 -2,-0.4 3,-0.8 -0.975 31.6-152.8-125.7 133.9 4.0 -7.1 -54.0 66 66 A D T 3 S+ 0 0 116 -2,-0.4 -1,-0.1 1,-0.3 12,-0.1 0.794 106.4 17.8 -72.6 -23.6 5.4 -5.8 -57.3 67 67 A E T 3 S- 0 0 149 8,-0.1 -1,-0.3 -3,-0.1 9,-0.1 -0.308 87.7-155.3-141.5 53.5 8.4 -4.5 -55.3 68 68 A V < - 0 0 29 -3,-0.8 8,-0.1 1,-0.2 6,-0.0 0.015 9.5-172.3 -32.9 115.5 8.3 -6.4 -52.0 69 69 A T S S+ 0 0 110 1,-0.3 -1,-0.2 2,-0.0 5,-0.0 0.664 78.6 23.7 -90.5 -16.3 10.1 -4.0 -49.6 70 70 A Q >> - 0 0 81 1,-0.1 3,-1.6 5,-0.0 4,-0.6 -0.786 60.5-165.9-152.7 103.6 10.1 -6.6 -46.9 71 71 A P T 34 S+ 0 0 91 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.504 80.7 83.8 -67.7 -2.2 9.8 -10.4 -47.6 72 72 A T T 34 S+ 0 0 34 1,-0.2 -28,-0.5 -29,-0.1 -31,-0.1 0.764 118.8 2.0 -73.8 -21.1 9.1 -11.0 -43.9 73 73 A K T <4 S+ 0 0 90 -3,-1.6 -10,-0.7 -30,-0.2 2,-0.4 0.177 126.9 67.5-148.3 16.2 5.4 -10.1 -44.6 74 74 A E E < -c 63 0A 42 -4,-0.6 2,-0.4 -12,-0.2 -10,-0.2 -0.998 59.5-154.3-143.0 138.2 5.3 -9.5 -48.4 75 75 A I E -c 64 0A 11 -12,-3.3 -10,-3.6 -2,-0.4 -8,-0.1 -0.920 23.8-119.2-114.7 137.0 5.8 -11.8 -51.3 76 76 A T E > -c 65 0A 52 -2,-0.4 4,-2.5 -12,-0.2 -10,-0.2 -0.276 26.5-114.8 -67.0 158.4 7.0 -10.7 -54.8 77 77 A L H > S+ 0 0 38 -12,-1.4 4,-2.9 2,-0.2 5,-0.2 0.966 116.9 51.7 -60.5 -50.1 4.6 -11.2 -57.7 78 78 A E H > S+ 0 0 97 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.954 110.4 48.7 -52.2 -50.5 7.0 -13.7 -59.4 79 79 A A H > S+ 0 0 29 1,-0.2 4,-2.2 2,-0.2 5,-0.3 0.944 110.1 52.0 -56.8 -45.4 7.3 -15.7 -56.1 80 80 A A H X S+ 0 0 0 -4,-2.5 4,-3.7 1,-0.2 7,-0.3 0.945 105.3 55.2 -57.5 -46.0 3.5 -15.7 -55.9 81 81 A R H X S+ 0 0 93 -4,-2.9 4,-0.5 1,-0.2 -1,-0.2 0.923 106.7 51.3 -54.6 -42.5 3.2 -17.0 -59.4 82 82 A Y H < S+ 0 0 175 -4,-2.0 3,-0.2 -5,-0.2 -1,-0.2 0.944 116.1 39.8 -61.9 -45.0 5.5 -19.9 -58.4 83 83 A E H < S- 0 0 108 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.856 146.5 -12.3 -73.2 -32.1 3.3 -20.7 -55.4 84 84 A D H >< - 0 0 93 -4,-3.7 3,-3.8 -5,-0.3 -1,-0.2 -0.563 52.5-155.8-170.5 99.1 0.1 -20.0 -57.4 85 85 A E T 3< S+ 0 0 160 -4,-0.5 -4,-0.1 1,-0.3 -3,-0.1 0.806 97.1 71.7 -50.2 -24.9 -0.0 -18.4 -60.8 86 86 A S T 3 S+ 0 0 97 -5,-0.2 -1,-0.3 -6,-0.1 2,-0.2 0.623 80.2 97.7 -68.6 -7.2 -3.6 -17.5 -59.8 87 87 A L < + 0 0 18 -3,-3.8 2,-0.2 -7,-0.3 -3,-0.1 -0.579 52.4 168.9 -82.0 144.0 -2.0 -15.0 -57.4 88 88 A N > - 0 0 77 -2,-0.2 3,-1.9 -8,-0.1 2,-0.3 -0.723 46.2 -48.5-138.9-170.3 -1.7 -11.4 -58.5 89 89 A L T 3 S+ 0 0 85 1,-0.3 -24,-0.1 -2,-0.2 3,-0.1 -0.490 128.3 21.2 -67.8 125.5 -0.9 -7.9 -57.1 90 90 A G T 3 S+ 0 0 42 -26,-1.2 -1,-0.3 1,-0.3 2,-0.1 0.430 98.9 121.4 97.4 -1.4 -2.9 -7.4 -53.8 91 91 A D < - 0 0 42 -3,-1.9 -27,-3.0 -28,-0.0 2,-0.4 -0.387 58.5-127.1 -88.3 172.0 -3.4 -11.2 -53.3 92 92 A Y E -B 63 0A 131 -29,-0.2 2,-0.3 -2,-0.1 -29,-0.3 -0.970 13.6-146.4-124.0 133.6 -2.3 -13.1 -50.3 93 93 A V E -B 62 0A 6 -31,-3.9 -31,-1.7 -2,-0.4 2,-0.4 -0.683 11.0-146.7 -96.0 151.3 -0.1 -16.3 -50.3 94 94 A E E +B 61 0A 130 -2,-0.3 2,-0.3 -33,-0.2 -33,-0.2 -0.919 21.4 167.2-118.3 143.6 -0.5 -19.1 -47.8 95 95 A D E -B 60 0A 62 -35,-2.3 -35,-4.1 -2,-0.4 2,-0.5 -0.998 32.0-122.0-152.0 149.7 2.3 -21.4 -46.4 96 96 A Q E -B 59 0A 123 -2,-0.3 2,-0.3 -37,-0.3 -37,-0.2 -0.795 31.8-176.6 -96.3 132.3 2.7 -23.9 -43.5 97 97 A I - 0 0 12 -39,-1.9 -39,-0.3 -2,-0.5 -2,-0.0 -0.853 40.5 -70.2-124.1 161.8 5.4 -23.1 -41.0 98 98 A E - 0 0 141 -2,-0.3 2,-0.3 -41,-0.1 -1,-0.2 -0.051 54.6-149.5 -44.4 150.1 6.7 -25.1 -37.9 99 99 A S - 0 0 59 -3,-0.1 2,-0.4 -42,-0.1 -1,-0.1 -0.866 9.5-118.8-125.1 161.0 4.1 -25.0 -35.1 100 100 A V - 0 0 48 -2,-0.3 -44,-0.2 -44,-0.0 2,-0.1 -0.826 30.3-115.9-101.5 136.2 4.5 -25.1 -31.3 101 101 A T >> - 0 0 93 -2,-0.4 3,-0.9 1,-0.2 4,-0.5 -0.446 16.4-134.5 -68.1 136.8 3.0 -28.0 -29.3 102 102 A F G >4 S+ 0 0 12 1,-0.3 3,-1.6 2,-0.2 -1,-0.2 0.892 105.7 63.9 -60.3 -35.9 0.2 -26.8 -26.9 103 103 A D G 34 S+ 0 0 111 1,-0.3 -1,-0.3 4,-0.0 -2,-0.1 0.864 86.1 73.5 -57.5 -32.0 1.7 -29.0 -24.2 104 104 A R G <4 S+ 0 0 191 -3,-0.9 2,-0.3 2,-0.0 -1,-0.3 0.878 106.8 35.4 -50.8 -35.5 4.8 -26.7 -24.4 105 105 A I S << S- 0 0 50 -3,-1.6 2,-0.1 -4,-0.5 0, 0.0 -0.833 90.0-116.1-118.2 158.4 2.7 -24.1 -22.6 106 106 A T >> - 0 0 74 -2,-0.3 4,-0.8 1,-0.1 3,-0.6 -0.449 26.0-114.8 -87.4 165.5 0.0 -24.4 -19.9 107 107 A T H 3> S+ 0 0 52 1,-0.2 4,-1.9 2,-0.2 3,-0.1 0.776 110.3 73.5 -71.3 -22.4 -3.7 -23.5 -20.5 108 108 A Q H 3> S+ 0 0 142 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.905 91.6 55.9 -58.6 -38.2 -3.2 -20.7 -17.9 109 109 A T H X> S+ 0 0 86 -3,-0.6 4,-1.0 1,-0.2 3,-0.6 0.924 108.7 46.3 -61.8 -41.2 -1.2 -18.7 -20.4 110 110 A A H 3X S+ 0 0 12 -4,-0.8 4,-2.4 1,-0.2 -1,-0.2 0.813 100.8 68.3 -71.6 -26.6 -4.1 -18.9 -22.9 111 111 A K H 3X S+ 0 0 135 -4,-1.9 4,-1.6 1,-0.2 -1,-0.2 0.849 96.5 55.0 -61.7 -29.9 -6.6 -17.9 -20.1 112 112 A Q H X S+ 0 0 115 -4,-2.0 3,-0.8 1,-0.2 4,-0.7 0.870 105.2 59.0 -67.3 -33.0 -13.1 -6.0 -25.2 121 121 A A H >< S+ 0 0 20 -4,-1.2 3,-0.8 1,-0.2 -1,-0.2 0.841 91.2 70.5 -65.5 -29.1 -16.6 -7.6 -25.9 122 122 A E H 3< S+ 0 0 140 -4,-1.4 -1,-0.2 -3,-0.4 -2,-0.2 0.889 89.4 62.2 -56.0 -36.1 -17.8 -6.0 -22.6 123 123 A R H << S- 0 0 209 -3,-0.8 2,-0.3 -4,-0.7 -1,-0.3 0.908 128.5 -18.7 -58.0 -38.7 -17.6 -2.6 -24.4 124 124 A A << - 0 0 76 -3,-0.8 2,-0.4 -4,-0.7 -1,-0.2 -0.974 60.9-146.2-165.4 151.1 -20.3 -3.9 -26.9 125 125 A M - 0 0 120 -2,-0.3 -3,-0.0 -3,-0.1 -4,-0.0 -0.956 21.0-131.8-126.1 144.6 -21.7 -7.2 -28.1 126 126 A L S S+ 0 0 177 -2,-0.4 -1,-0.1 1,-0.3 -5,-0.0 0.893 108.6 30.2 -60.8 -36.2 -23.0 -8.1 -31.6 127 127 A V S S- 0 0 119 -3,-0.1 -1,-0.3 0, 0.0 2,-0.1 -0.724 83.5-167.1-127.3 85.0 -26.2 -9.5 -30.1 128 128 A P 0 0 87 0, 0.0 -4,-0.0 0, 0.0 -2,-0.0 -0.389 360.0 360.0 -69.7 143.7 -27.0 -7.6 -26.8 129 129 A R 0 0 290 -2,-0.1 -4,-0.0 0, 0.0 0, 0.0 0.691 360.0 360.0 63.1 360.0 -29.6 -9.2 -24.5