==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 09-JUL-12 4G0L . COMPND 2 MOLECULE: PROTEIN YQJG; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR A.R.GREEN,R.P.HAYES,L.XUN,C.KANG . 653 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26852.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 424 64.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 17 2.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 47 7.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.6 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 . 6 0.9 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 . 48 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 76 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 198 30.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 17 2.6 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 4 0 3 0 1 0 2 3 3 2 2 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 0 0 2 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 . 6 3 3 2 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 . 1 4 0 2 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 2 A G 0 0 13 0, 0.0 2,-0.3 0, 0.0 129,-0.3 0.000 360.0 360.0 360.0-166.5 -55.1 34.2 21.3 2 3 A Q E -A 9 0A 9 7,-1.2 7,-1.6 127,-0.1 2,-0.3 -0.891 360.0-117.6-168.6 138.5 -58.7 34.1 20.3 3 4 A L E -AB 8 128A 0 125,-1.7 125,-1.7 -2,-0.3 2,-0.4 -0.618 28.4-173.2 -75.5 130.2 -61.2 32.1 18.2 4 5 A I E > S-A 7 0A 28 3,-3.8 3,-3.6 -2,-0.3 123,-0.2 -0.990 70.2 -26.3-126.9 126.5 -62.8 34.0 15.4 5 6 A D T 3 S- 0 0 70 -2,-0.4 122,-0.2 1,-0.3 121,-0.2 0.858 129.0 -46.4 36.8 50.1 -65.6 32.3 13.3 6 7 A G T 3 S+ 0 0 17 120,-2.4 2,-0.5 1,-0.2 -1,-0.3 0.371 121.2 111.0 81.6 -5.7 -64.1 28.9 14.3 7 8 A V E < -A 4 0A 82 -3,-3.6 -3,-3.8 119,-0.2 -1,-0.2 -0.906 63.1-135.3-110.7 126.8 -60.6 30.0 13.4 8 9 A W E -A 3 0A 27 -2,-0.5 2,-0.5 -5,-0.3 -5,-0.2 -0.492 13.3-154.7 -74.4 140.8 -57.9 30.5 16.1 9 10 A H E -A 2 0A 36 -7,-1.6 2,-1.2 -2,-0.2 -7,-1.2 -0.975 21.5-128.0-125.7 122.0 -55.7 33.6 15.9 10 11 A D S S- 0 0 58 -2,-0.5 84,-0.1 1,-0.3 3,-0.1 0.278 81.5 -57.8 -57.8 12.2 -52.2 33.5 17.4 11 12 A T S S+ 0 0 65 -2,-1.2 2,-2.0 -9,-0.2 -1,-0.3 0.171 111.8 115.3 124.5 -3.4 -53.0 36.7 19.4 12 13 A W - 0 0 145 -10,-0.1 2,-0.7 1,-0.1 3,-0.3 -0.561 51.8-177.2 -78.7 68.7 -53.8 38.8 16.4 13 14 A Y - 0 0 84 -2,-2.0 2,-0.1 1,-0.4 -1,-0.1 -0.657 68.4 -28.4-111.7 77.3 -57.3 38.9 17.8 14 15 A D - 0 0 48 -2,-0.7 2,-2.6 -12,-0.1 -1,-0.4 0.593 65.4-104.4-116.2-150.7 -58.0 40.4 15.5 15 16 A T S S- 0 0 111 -3,-0.3 2,-0.9 2,-0.1 -3,-0.1 -0.498 98.9 -61.9 -73.5 72.4 -56.3 42.7 13.0 16 17 A K S S- 0 0 178 -2,-2.6 -1,-0.0 1,-0.1 0, 0.0 -0.779 77.0-102.3 77.7-104.1 -58.3 45.4 14.9 17 18 A S - 0 0 51 -2,-0.9 -2,-0.1 3,-0.1 -1,-0.1 0.031 30.9-168.7-171.4 -53.6 -61.8 44.2 14.2 18 19 A T S S+ 0 0 146 1,-0.0 -2,-0.1 0, 0.0 -3,-0.0 0.688 88.6 50.1 49.8 19.4 -63.7 46.2 11.6 19 20 A G S S- 0 0 64 3,-0.0 2,-0.1 4,-0.0 4,-0.0 0.287 92.4-178.9 136.1 88.7 -66.6 44.2 13.0 20 21 A G + 0 0 42 2,-0.1 -3,-0.1 3,-0.1 3,-0.1 -0.031 36.5 59.1 138.0 98.7 -66.8 44.3 15.8 21 22 A K S S- 0 0 172 1,-0.1 5,-0.1 -2,-0.1 -4,-0.0 0.947 89.4 -96.0 70.9 54.4 -67.9 43.8 19.4 22 23 A F - 0 0 55 3,-0.1 -1,-0.1 2,-0.1 -2,-0.1 -0.124 63.0-155.7 -42.7 126.0 -67.5 40.0 19.3 23 24 A Q + 0 0 62 3,-0.1 3,-0.3 -3,-0.1 -3,-0.1 0.598 30.9 9.7-169.2-144.8 -69.8 38.3 18.7 24 25 A R S S+ 0 0 162 1,-0.2 -2,-0.1 2,-0.1 104,-0.1 0.248 125.4 50.2 -92.2 7.4 -72.7 35.9 18.2 25 26 A S S > S+ 0 0 5 102,-0.4 3,-0.9 2,-0.1 -1,-0.2 0.073 79.7 90.0-127.5 13.0 -70.7 33.9 20.6 26 27 A A T 3 S+ 0 0 58 -3,-0.3 -2,-0.1 1,-0.2 -3,-0.1 0.540 72.7 77.8 -76.9 -13.4 -70.3 36.7 23.1 27 28 A S T 3 S- 0 0 86 1,-0.1 -1,-0.2 -4,-0.0 3,-0.2 0.576 88.1-177.2 -63.8 -9.9 -73.5 34.9 24.2 28 29 A A < - 0 0 30 -3,-0.9 2,-0.7 99,-0.2 -1,-0.1 0.198 40.4 -54.1 37.0-159.8 -70.8 32.6 25.7 29 30 A F + 0 0 23 1,-0.1 117,-1.8 -3,-0.1 118,-0.2 -0.915 65.5 155.9-115.1 108.6 -71.9 29.4 27.4 30 31 A R B +C 145 0B 86 -2,-0.7 115,-0.2 -3,-0.2 2,-0.2 -0.315 18.4 135.6-133.5 47.1 -74.4 30.2 30.2 31 32 A N - 0 0 23 113,-2.2 2,-0.4 112,-0.1 12,-0.2 -0.547 45.9-128.8 -85.6 163.3 -76.4 27.1 30.8 32 33 A W - 0 0 37 12,-0.5 2,-0.6 10,-0.3 15,-0.4 -0.952 1.2-139.4-120.7 133.8 -77.2 25.9 34.3 33 34 A L + 0 0 4 -2,-0.4 2,-0.3 6,-0.1 15,-0.2 -0.774 38.0 179.4 -80.7 123.3 -76.7 22.5 35.9 34 35 A T B -g 48 0C 25 13,-2.1 15,-2.4 -2,-0.6 3,-0.1 -0.795 41.5-111.5-127.2 169.2 -79.8 22.1 38.1 35 36 A A S S+ 0 0 65 -2,-0.3 13,-0.1 13,-0.2 -1,-0.1 0.817 116.6 26.3 -70.4 -30.3 -81.2 19.4 40.4 36 37 A D S S- 0 0 120 2,-0.1 -1,-0.2 12,-0.1 12,-0.2 0.328 110.0-107.1-117.8 4.5 -84.1 18.5 38.1 37 38 A G S S+ 0 0 13 10,-0.3 9,-3.6 1,-0.3 10,-0.4 0.445 70.9 142.4 83.4 -1.8 -82.8 19.5 34.7 38 39 A A - 0 0 41 7,-0.2 -1,-0.3 8,-0.1 9,-0.2 -0.319 60.3 -95.9 -61.4 155.3 -85.0 22.6 34.4 39 40 A P - 0 0 81 0, 0.0 6,-0.2 0, 0.0 4,-0.1 -0.508 33.8-129.2 -76.3 146.7 -83.2 25.5 32.7 40 41 A G - 0 0 20 2,-0.5 -8,-0.1 4,-0.4 -6,-0.0 -0.031 49.4 -72.5 -73.4-169.5 -81.5 28.2 34.8 41 42 A P S S+ 0 0 113 0, 0.0 2,-0.3 0, 0.0 -10,-0.1 0.556 121.2 27.1 -70.1 -7.0 -82.2 31.9 34.2 42 43 A T S S+ 0 0 64 -12,-0.2 -2,-0.5 2,-0.1 -10,-0.3 -0.935 108.2 21.6-142.3 167.4 -80.2 31.7 30.9 43 44 A G S S- 0 0 47 -2,-0.3 2,-0.2 -12,-0.2 -12,-0.1 -0.367 91.4 -59.8 75.7-155.7 -79.3 29.0 28.4 44 45 A T - 0 0 88 1,-0.1 -12,-0.5 -2,-0.1 -4,-0.4 -0.753 47.0-104.0-126.1 173.7 -81.5 25.8 28.0 45 46 A G S S+ 0 0 31 -2,-0.2 -7,-0.2 -6,-0.2 -1,-0.1 -0.081 75.6 80.9 -88.5-174.6 -82.6 22.9 30.1 46 47 A G + 0 0 39 -9,-3.6 2,-1.1 1,-0.1 -1,-0.2 0.386 55.4 115.4 99.7 -3.1 -81.5 19.3 30.3 47 48 A F + 0 0 10 -15,-0.4 -13,-2.1 -10,-0.4 -10,-0.3 -0.568 44.2 172.2 -98.6 70.2 -78.4 19.6 32.4 48 49 A I B -g 34 0C 61 -2,-1.1 -13,-0.2 -15,-0.2 2,-0.1 -0.549 40.4 -99.8 -82.4 140.9 -79.6 17.6 35.4 49 50 A A + 0 0 8 -15,-2.4 2,-0.3 109,-0.2 -1,-0.1 -0.395 63.5 135.8 -56.6 127.4 -77.3 16.8 38.2 50 51 A E > - 0 0 72 -2,-0.1 3,-0.6 30,-0.1 4,-0.5 -0.976 51.3 -87.2-164.3 168.1 -76.0 13.2 38.0 51 52 A K T 3 S+ 0 0 121 -2,-0.3 29,-0.2 1,-0.2 30,-0.1 -0.336 100.0 13.6 -75.5 161.0 -72.9 11.0 38.3 52 53 A D T 3 S+ 0 0 136 27,-0.5 -1,-0.2 1,-0.2 29,-0.1 0.675 106.5 87.8 51.6 24.5 -70.4 10.3 35.5 53 54 A R S < S+ 0 0 8 -3,-0.6 85,-3.0 27,-0.4 86,-0.4 0.720 70.6 64.8-116.1 -37.7 -71.8 13.1 33.3 54 55 A Y E -dE 81 137B 1 26,-0.6 28,-1.4 -4,-0.5 2,-0.3 -0.728 53.0-176.7-106.9 141.6 -70.0 16.3 34.1 55 56 A H E -dE 82 136B 0 81,-2.6 81,-3.0 -2,-0.3 2,-0.5 -0.913 14.7-143.4-132.2 155.9 -66.4 17.3 33.7 56 57 A L E -dE 83 135B 0 26,-2.0 28,-2.5 -2,-0.3 2,-0.6 -0.972 3.8-161.0-129.0 118.1 -64.3 20.4 34.6 57 58 A Y E +dE 84 134B 0 77,-3.1 77,-2.0 -2,-0.5 2,-0.3 -0.889 32.0 156.1 -96.5 118.9 -61.5 21.9 32.5 58 59 A V E -d 85 0B 0 26,-2.8 28,-2.5 -2,-0.6 2,-0.4 -0.818 42.1-131.4-133.0 171.2 -59.3 24.1 34.6 59 60 A S > - 0 0 0 -2,-0.3 3,-1.0 26,-0.2 28,-0.1 -0.984 17.9-142.1-117.6 140.3 -56.0 25.7 35.0 60 61 A L T 3 S+ 0 0 24 26,-0.4 227,-0.5 -2,-0.4 231,-0.2 0.558 101.7 58.2 -75.4 -5.3 -54.4 25.4 38.5 61 62 A A T 3 S+ 0 0 0 229,-0.2 -1,-0.2 230,-0.1 234,-0.1 0.540 84.5 94.7 -96.4 -11.6 -53.1 29.0 37.9 62 63 A C <> - 0 0 14 -3,-1.0 4,-2.6 1,-0.1 -3,-0.1 -0.746 58.1-156.7 -98.1 122.6 -56.4 30.7 37.4 63 64 A P H > S+ 0 0 3 0, 0.0 4,-1.0 0, 0.0 -1,-0.1 0.824 98.4 49.3 -64.5 -30.7 -58.2 32.4 40.3 64 65 A W H >> S+ 0 0 51 2,-0.2 4,-0.8 1,-0.2 3,-0.6 0.948 113.8 43.6 -69.9 -50.7 -61.5 32.1 38.5 65 66 A A H >> S+ 0 0 0 1,-0.2 4,-1.3 67,-0.2 3,-0.7 0.853 107.5 63.6 -59.3 -34.1 -61.0 28.4 37.7 66 67 A H H 3X S+ 0 0 2 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.834 91.3 64.1 -62.8 -33.9 -59.8 28.1 41.3 67 68 A R H S+ 0 0 43 -4,-2.2 5,-2.6 2,-0.2 6,-0.4 0.854 111.2 42.1 -61.8 -37.7 -65.9 21.1 44.5 73 74 A K H ><5S+ 0 0 31 -4,-1.5 3,-1.5 3,-0.2 -2,-0.2 0.970 113.8 49.0 -72.6 -54.8 -64.0 20.3 47.6 74 75 A L H 3<5S+ 0 0 22 -4,-2.8 -2,-0.2 1,-0.3 -3,-0.2 0.821 116.9 42.8 -56.2 -34.5 -66.3 22.0 50.2 75 76 A K T 3<5S- 0 0 1 -4,-2.1 90,-2.3 -5,-0.2 -1,-0.3 0.477 109.2-121.4 -94.0 -3.1 -69.4 20.4 48.7 76 77 A G T < 5 + 0 0 7 -3,-1.5 -3,-0.2 -4,-0.4 -4,-0.1 0.931 60.2 146.7 66.4 49.2 -67.9 17.0 48.3 77 78 A L >>< + 0 0 0 -5,-2.6 4,-2.5 1,-0.2 3,-1.7 0.277 30.4 108.2-102.4 11.5 -68.4 16.7 44.6 78 79 A E T 34 S+ 0 0 62 -6,-0.4 -1,-0.2 1,-0.3 -5,-0.1 0.851 78.4 56.4 -57.0 -36.9 -65.3 14.7 43.6 79 80 A P T 34 S+ 0 0 73 0, 0.0 -27,-0.5 0, 0.0 -1,-0.3 0.680 118.0 33.8 -64.3 -19.2 -67.6 11.6 43.0 80 81 A F T <4 S+ 0 0 10 -3,-1.7 -26,-0.6 1,-0.2 2,-0.6 0.678 113.5 56.5-110.7 -25.4 -69.6 13.7 40.4 81 82 A I E < -d 54 0B 1 -4,-2.5 -26,-0.2 -9,-0.1 -1,-0.2 -0.911 61.5-165.6-120.7 109.3 -67.0 16.0 38.8 82 83 A S E -d 55 0B 41 -28,-1.4 -26,-2.0 -2,-0.6 2,-0.4 -0.458 18.4-141.0 -83.3 163.2 -63.9 14.7 37.1 83 84 A V E -d 56 0B 37 -28,-0.2 2,-0.4 -2,-0.1 -26,-0.2 -0.971 19.3-167.6-138.4 139.6 -61.1 17.2 36.3 84 85 A S E -d 57 0B 0 -28,-2.5 -26,-2.8 -2,-0.4 2,-0.7 -0.994 14.5-153.1-122.9 131.3 -58.6 18.0 33.6 85 86 A V E -d 58 0B 14 -2,-0.4 20,-2.0 21,-0.3 21,-0.8 -0.900 11.8-146.6-107.1 111.0 -55.7 20.4 34.3 86 87 A V - 0 0 0 -28,-2.5 -26,-0.4 -2,-0.7 11,-0.2 -0.216 36.5 -82.9 -63.6 160.9 -54.4 22.3 31.3 87 88 A N E -H 96 0D 5 9,-2.7 9,-0.6 1,-0.1 -1,-0.1 -0.469 33.0-130.8 -64.9 137.6 -50.7 23.2 31.0 88 89 A P E S+ 0 0 0 0, 0.0 2,-0.8 0, 0.0 -1,-0.1 0.735 85.4 90.8 -59.3 -30.9 -49.7 26.4 32.9 89 90 A L E - 0 0 38 9,-0.1 2,-1.0 1,-0.1 7,-0.2 -0.620 58.9-170.8 -76.2 108.6 -47.8 27.8 29.9 90 91 A M E + 0 0 58 -2,-0.8 5,-0.2 204,-0.3 -1,-0.1 -0.765 25.1 150.2-104.6 91.3 -50.4 29.8 27.9 91 92 A L E > -H 94 0D 72 -2,-1.0 3,-1.3 3,-0.6 -1,-0.0 0.372 62.0 -39.2-100.2-135.8 -48.6 30.7 24.7 92 93 A E T 3 S+ 0 0 102 1,-0.3 3,-0.1 2,-0.0 -2,-0.1 0.626 135.1 47.7 -76.6 -12.2 -49.5 31.4 21.0 93 94 A N T 3 S- 0 0 40 1,-0.4 23,-0.3 -92,-0.1 -1,-0.3 0.326 105.4-131.2-102.6 4.0 -52.1 28.6 21.0 94 95 A G E < S+H 91 0D 4 -3,-1.3 -3,-0.6 -84,-0.1 -1,-0.4 -0.333 70.3 9.4 73.4-162.5 -53.8 29.6 24.2 95 96 A W E S- 0 0 18 35,-0.5 20,-2.0 -5,-0.2 21,-0.5 -0.208 80.2-158.0 -54.6 137.8 -54.6 27.0 26.9 96 97 A T E -HI 87 114D 23 -9,-0.6 -9,-2.7 18,-0.2 18,-0.2 -0.844 28.8-140.8-126.4 149.8 -52.9 23.7 26.0 97 98 A F + 0 0 9 16,-2.7 2,-0.4 -2,-0.3 10,-0.2 0.290 54.5 140.1 -95.6 11.0 -53.3 20.1 26.9 98 99 A D - 0 0 82 15,-0.3 3,-0.3 -9,-0.1 8,-0.2 -0.363 33.3-168.4 -47.2 106.6 -49.5 19.6 27.1 99 100 A D + 0 0 98 -2,-0.4 2,-0.5 6,-0.2 6,-0.2 0.007 55.4 91.0 -76.7-157.4 -48.9 17.3 30.0 100 101 A S + 0 0 99 4,-0.4 -1,-0.1 1,-0.3 -2,-0.0 -0.298 65.7 94.8 97.5 -49.1 -45.3 17.0 31.1 101 102 A F S > S- 0 0 36 -2,-0.5 3,-1.9 -3,-0.3 -1,-0.3 -0.646 96.2-103.5 -66.6 128.9 -45.5 19.8 33.6 102 103 A P T 3 S+ 0 0 99 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.370 108.8 24.8 -59.0 131.3 -46.3 18.1 36.9 103 104 A G T 3 S+ 0 0 37 1,-0.4 2,-0.3 -2,-0.1 -18,-0.2 -0.023 93.8 112.0 99.3 -30.1 -50.1 18.6 37.7 104 105 A A < - 0 0 13 -3,-1.9 -1,-0.4 1,-0.1 -4,-0.4 -0.619 43.5-177.7 -71.8 136.9 -51.0 19.0 34.0 105 106 A T - 0 0 65 -20,-2.0 -6,-0.2 -2,-0.3 -19,-0.1 0.459 27.7-129.9-117.7 -6.0 -53.0 16.0 33.0 106 107 A G - 0 0 10 -21,-0.8 2,-1.1 -8,-0.2 -21,-0.3 -0.101 60.0 -38.8 67.0 178.2 -53.7 16.5 29.3 107 108 A D > - 0 0 5 5,-0.5 4,-2.2 -10,-0.2 -1,-0.1 -0.631 59.4-169.3 -77.2 99.8 -57.3 16.1 28.1 108 109 A T T 4 S+ 0 0 81 -2,-1.1 -1,-0.2 1,-0.2 -2,-0.0 0.544 80.2 44.0 -71.4 -8.9 -58.5 13.2 30.1 109 110 A L T 4 S- 0 0 32 -3,-0.0 -1,-0.2 3,-0.0 -2,-0.1 0.830 137.6 -3.3-100.6 -45.1 -61.7 12.8 28.1 110 111 A Y T 4 S- 0 0 61 2,-0.0 -2,-0.2 0, 0.0 -3,-0.1 0.265 84.1-125.4-135.7 8.0 -60.7 13.1 24.4 111 112 A Q < + 0 0 145 -4,-2.2 -3,-0.1 1,-0.1 -14,-0.0 0.870 45.4 172.6 35.7 56.2 -57.0 13.9 24.5 112 113 A N - 0 0 48 1,-0.1 -5,-0.5 2,-0.0 3,-0.1 -0.146 36.6-130.2 -68.5 178.3 -57.2 17.0 22.4 113 114 A E S S+ 0 0 130 1,-0.3 -16,-2.7 -7,-0.1 2,-0.3 0.763 83.7 30.3 -98.4 -35.2 -54.3 19.3 21.9 114 115 A F B >> -I 96 0D 22 -18,-0.2 3,-1.4 -17,-0.1 4,-0.6 -0.950 67.2-130.2-133.3 144.0 -55.9 22.7 22.7 115 116 A L H >> S+ 0 0 0 -20,-2.0 3,-1.6 -2,-0.3 4,-1.1 0.893 108.5 65.4 -52.4 -41.3 -58.6 24.0 25.0 116 117 A Y H 3> S+ 0 0 35 -21,-0.5 4,-2.1 -23,-0.3 -1,-0.3 0.698 88.1 67.8 -64.4 -17.0 -60.0 25.8 22.0 117 118 A Q H <> S+ 0 0 64 -3,-1.4 4,-2.0 2,-0.2 -1,-0.3 0.865 97.6 52.8 -66.8 -34.7 -60.8 22.5 20.3 118 119 A L H < - 0 0 51 -4,-2.1 3,-2.2 -5,-0.2 -1,-0.3 -0.706 67.8-159.4-153.2 91.7 -69.7 25.6 18.4 124 125 A P T 3 S+ 0 0 85 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 0.649 96.8 36.2 -54.0 -21.0 -67.8 24.9 15.1 125 126 A H T 3 S+ 0 0 107 -119,-0.1 -120,-0.3 -5,-0.1 2,-0.1 -0.263 85.7 157.1-127.7 43.9 -67.8 28.6 14.3 126 127 A Y < - 0 0 8 -3,-2.2 -120,-2.4 -121,-0.2 2,-0.5 -0.420 24.3-162.4 -69.5 140.4 -67.4 30.1 17.8 127 128 A S + 0 0 2 -123,-0.2 -102,-0.4 -122,-0.2 2,-0.3 -0.955 46.0 66.3-129.4 114.0 -66.0 33.6 18.1 128 129 A G B S-B 3 0A 7 -125,-1.7 -125,-1.7 -2,-0.5 2,-0.3 -0.980 84.3 -41.9 167.3-172.4 -64.7 34.6 21.5 129 130 A R - 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