==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-APR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 26-JUL-10 2L18 . COMPND 2 MOLECULE: ARSENATE REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SYNECHOCYSTIS; . AUTHOR C.YU,B.XIA,C.JIN . 131 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6385.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 89 67.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 21 16.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 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 . 1 0.8 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 . 7 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 40 30.5 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 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 1 1 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 PARALLEL BRIDGES PER LADDER . 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 0 155 0, 0.0 2,-0.4 0, 0.0 29,-0.2 0.000 360.0 360.0 360.0 147.8 2.2 0.3 -2.8 2 2 A K E -a 30 0A 56 27,-1.0 29,-1.5 71,-0.0 2,-0.6 -0.964 360.0-133.3-123.5 142.4 6.0 0.1 -2.1 3 3 A K E -a 31 0A 72 -2,-0.4 72,-2.5 27,-0.2 71,-1.2 -0.890 20.5-159.2-100.3 123.1 8.0 2.9 -0.4 4 4 A V E -ab 32 75A 0 27,-2.4 29,-1.4 -2,-0.6 2,-0.4 -0.799 5.0-166.0-102.9 144.7 11.2 4.0 -2.0 5 5 A M E -ab 33 76A 0 70,-2.1 72,-2.7 -2,-0.3 2,-0.4 -0.968 6.5-162.0-124.2 142.7 14.1 5.8 -0.3 6 6 A F E -ab 34 77A 0 27,-1.4 29,-3.0 -2,-0.4 2,-0.4 -0.997 13.2-174.3-124.2 124.3 17.1 7.5 -1.9 7 7 A V E +ab 35 78A 0 70,-2.7 72,-2.4 -2,-0.4 29,-0.3 -0.973 4.9 176.0-127.6 121.6 20.1 8.2 0.4 8 8 A C E -ab 36 79A 0 27,-1.3 29,-2.3 -2,-0.4 30,-0.6 -0.769 47.7-106.2-118.6 165.7 23.2 10.2 -0.6 9 9 A K S S+ 0 0 105 70,-0.6 71,-0.1 -2,-0.3 27,-0.1 0.696 125.0 9.1 -56.3 -21.0 26.4 11.4 1.1 10 10 A R S S- 0 0 82 25,-0.2 2,-2.5 27,-0.1 30,-0.3 0.392 85.5-143.0-139.5 -2.7 24.7 14.9 1.0 11 11 A N S >S+ 0 0 0 24,-0.2 5,-1.7 28,-0.2 4,-0.3 -0.263 77.6 99.1 60.3 -47.2 21.0 14.3 -0.2 12 12 A S T 5S+ 0 0 0 -2,-2.5 31,-2.4 3,-0.2 -1,-0.1 0.457 93.6 8.9 -44.0 -25.6 21.2 17.6 -2.2 13 13 A C T >5S+ 0 0 0 29,-0.2 4,-2.2 3,-0.1 5,-0.3 0.660 126.7 36.5-126.9 -72.5 21.9 16.2 -5.7 14 14 A R H >5S+ 0 0 9 1,-0.2 4,-1.8 2,-0.2 -2,-0.1 0.941 126.2 36.2 -64.0 -49.6 21.8 12.5 -6.4 15 15 A S H >5S+ 0 0 0 -4,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.890 113.9 56.9 -70.2 -42.1 18.8 11.7 -4.1 16 16 A Q H >X S+ 0 0 2 -4,-2.6 3,-2.8 -5,-0.3 4,-2.5 0.385 74.1 135.7-133.8 3.5 5.3 6.5 -9.8 27 27 A A B 3< S+c 30 0A 73 -4,-2.4 4,-0.1 1,-0.3 -4,-0.1 -0.448 81.7 38.7 -54.9 112.5 3.4 8.9 -7.5 28 28 A G T 34 S+ 0 0 71 2,-0.9 -1,-0.3 -2,-0.4 3,-0.1 -0.039 125.3 36.2 126.7 -24.2 0.2 6.9 -7.1 29 29 A K T <4 S+ 0 0 83 -3,-2.8 -27,-1.0 1,-0.4 2,-0.3 0.521 124.4 30.7-130.5 -19.3 1.8 3.4 -6.9 30 30 A I E < -ac 2 27A 6 -4,-2.5 -2,-0.9 -29,-0.2 2,-0.4 -0.940 67.7-145.2-131.7 156.3 5.0 4.2 -5.0 31 31 A A E -a 3 0A 31 -29,-1.5 -27,-2.4 -2,-0.3 2,-0.3 -0.991 22.6-160.2-120.2 130.5 5.7 6.8 -2.3 32 32 A V E +a 4 0A 22 -2,-0.4 2,-0.3 -29,-0.2 -27,-0.2 -0.822 18.4 172.8-113.1 151.2 9.2 8.3 -2.4 33 33 A T E -a 5 0A 29 -29,-1.4 -27,-1.4 -2,-0.3 2,-0.3 -0.946 16.9-151.8-147.8 135.9 11.3 10.2 0.1 34 34 A S E +a 6 0A 3 -2,-0.3 2,-0.2 -29,-0.2 -27,-0.2 -0.808 22.3 162.1-102.4 156.6 15.0 11.2 -0.3 35 35 A C E -a 7 0A 0 -29,-3.0 -27,-1.3 -2,-0.3 2,-0.3 -0.802 22.8-135.2-148.5-175.3 17.4 11.6 2.6 36 36 A G E -a 8 0A 0 27,-0.3 29,-2.8 -29,-0.3 30,-0.3 -0.976 30.5-114.7-149.9 154.7 21.2 11.7 3.1 37 37 A L S S+ 0 0 77 -29,-2.3 2,-0.3 -2,-0.3 -28,-0.2 0.806 118.1 4.1 -49.0 -34.4 23.7 10.3 5.4 38 38 A E S S- 0 0 140 -30,-0.6 -1,-0.2 25,-0.1 2,-0.1 -0.945 92.7-117.4-146.5 148.4 24.0 14.0 6.2 39 39 A S + 0 0 49 -2,-0.3 2,-0.3 -3,-0.1 -28,-0.2 -0.426 30.5 171.3 -83.0 162.8 21.8 16.8 4.7 40 40 A S - 0 0 41 -30,-0.3 23,-0.1 -2,-0.1 3,-0.1 -0.926 47.6 -70.8-160.0 160.3 22.8 19.8 2.5 41 41 A R - 0 0 123 -2,-0.3 2,-0.1 1,-0.1 20,-0.1 -0.254 59.7 -97.8 -52.9 138.1 20.8 22.4 0.5 42 42 A V - 0 0 34 18,-0.1 -29,-0.2 1,-0.1 -1,-0.1 -0.436 51.6-110.3 -57.8 130.1 19.0 21.0 -2.5 43 43 A H > - 0 0 19 -31,-2.4 4,-0.5 1,-0.1 -1,-0.1 -0.419 18.6-140.4 -74.3 142.8 21.4 22.0 -5.3 44 44 A P H >> S+ 0 0 79 0, 0.0 3,-1.5 0, 0.0 4,-0.7 0.930 97.3 54.7 -77.5 -42.3 20.2 24.7 -7.8 45 45 A T H >> S+ 0 0 46 1,-0.3 4,-1.5 2,-0.2 3,-0.6 0.833 96.1 71.1 -62.8 -25.0 21.5 23.4 -11.1 46 46 A A H 3> S+ 0 0 0 1,-0.3 4,-2.1 2,-0.2 -1,-0.3 0.870 91.9 58.4 -51.7 -40.2 19.6 20.1 -10.3 47 47 A I H S+ 0 0 0 -4,-2.1 5,-2.7 1,-0.2 4,-1.9 0.905 107.2 59.2 -65.6 -35.5 14.8 18.2 -14.1 51 51 A E H <5S+ 0 0 125 -4,-2.6 -1,-0.2 3,-0.3 -2,-0.2 0.786 98.2 60.1 -62.7 -26.5 13.4 21.1 -16.0 52 52 A E H <5S+ 0 0 93 -4,-1.1 -1,-0.2 -3,-0.4 -2,-0.2 0.898 109.9 40.6 -65.7 -39.9 14.9 19.5 -19.1 53 53 A V H <5S- 0 0 60 -4,-1.2 -2,-0.2 -3,-0.4 -1,-0.2 0.792 127.6-103.7 -76.7 -25.4 12.7 16.5 -18.5 54 54 A G T <5S+ 0 0 65 -4,-1.9 -3,-0.3 1,-0.4 2,-0.2 0.642 86.3 105.9 108.5 25.9 9.8 18.8 -17.5 55 55 A I < - 0 0 28 -5,-2.7 -1,-0.4 -8,-0.2 2,-0.3 -0.633 53.4-142.3-122.9 178.8 10.0 18.4 -13.7 56 56 A D - 0 0 62 -2,-0.2 -9,-0.1 -6,-0.1 -8,-0.1 -0.969 21.8-176.9-143.1 156.1 11.2 20.7 -10.8 57 57 A I S > S+ 0 0 0 -2,-0.3 3,-2.1 -13,-0.1 -1,-0.1 0.459 72.6 87.2-128.1 -15.6 13.0 20.4 -7.5 58 58 A S T 3 S+ 0 0 72 1,-0.3 -16,-0.1 -14,-0.1 -11,-0.0 0.815 85.2 60.8 -45.8 -38.1 12.9 24.2 -6.4 59 59 A G T 3 S+ 0 0 74 2,-0.0 -1,-0.3 0, 0.0 2,-0.2 0.501 104.1 55.2 -76.8 -6.6 9.4 23.4 -4.8 60 60 A Q S < S- 0 0 23 -3,-2.1 2,-0.2 -44,-0.0 -18,-0.1 -0.762 71.3-139.7-125.2 169.6 10.9 20.8 -2.4 61 61 A T - 0 0 111 -2,-0.2 2,-0.2 -20,-0.1 -20,-0.1 -0.709 20.8 -98.9-127.1 169.9 13.6 20.7 0.3 62 62 A S - 0 0 32 -2,-0.2 -23,-0.1 -20,-0.1 -27,-0.1 -0.530 33.4-171.8 -92.7 160.2 16.4 18.4 1.6 63 63 A D - 0 0 47 -2,-0.2 -27,-0.3 -25,-0.1 2,-0.2 -0.990 21.0-117.4-154.8 138.7 16.2 16.2 4.7 64 64 A P > - 0 0 33 0, 0.0 3,-1.8 0, 0.0 4,-0.2 -0.572 24.5-121.1 -80.9 152.9 18.6 14.0 6.8 65 65 A I G > S+ 0 0 18 -29,-2.8 3,-2.1 1,-0.3 -28,-0.1 0.828 108.7 73.5 -52.4 -34.9 18.3 10.2 7.2 66 66 A E G 3 S+ 0 0 173 -30,-0.3 -1,-0.3 1,-0.3 -29,-0.1 0.666 85.6 63.8 -57.8 -23.6 18.0 10.9 11.0 67 67 A N G < S+ 0 0 103 -3,-1.8 -1,-0.3 2,-0.0 2,-0.2 0.521 105.2 45.7 -83.4 -6.7 14.4 12.2 10.6 68 68 A F S < S- 0 0 68 -3,-2.1 2,-0.4 -4,-0.2 3,-0.0 -0.626 73.2-122.6-128.6-176.9 13.0 8.9 9.3 69 69 A N > - 0 0 100 -2,-0.2 3,-1.5 1,-0.1 4,-0.3 -1.000 14.7-137.6-135.6 132.5 12.9 5.1 10.0 70 70 A A G > S+ 0 0 5 -2,-0.4 3,-1.8 1,-0.3 -1,-0.1 0.754 96.0 75.0 -60.3 -30.0 13.9 2.3 7.6 71 71 A D G 3 S+ 0 0 147 1,-0.3 -1,-0.3 22,-0.1 19,-0.0 0.689 91.9 55.3 -61.3 -21.2 11.0 0.2 8.6 72 72 A D G < S+ 0 0 69 -3,-1.5 2,-0.5 1,-0.0 -1,-0.3 0.646 96.8 76.8 -85.9 -15.3 8.6 2.4 6.5 73 73 A Y < - 0 0 5 -3,-1.8 21,-0.2 -4,-0.3 -69,-0.2 -0.853 55.1-170.3-107.8 122.0 10.6 2.0 3.3 74 74 A D S S+ 0 0 27 -71,-1.2 21,-1.2 -2,-0.5 20,-0.6 0.875 79.7 32.3 -71.8 -38.3 10.4 -1.1 1.2 75 75 A V E -bd 4 95A 0 -72,-2.5 -70,-2.1 19,-0.2 2,-0.5 -0.973 66.4-163.4-131.5 133.2 13.3 -0.2 -1.0 76 76 A V E -bd 5 96A 0 19,-2.4 21,-1.4 -2,-0.4 2,-0.7 -0.974 1.5-170.1-124.2 123.1 16.5 1.8 -0.2 77 77 A I E -bd 6 97A 0 -72,-2.7 -70,-2.7 -2,-0.5 21,-0.2 -0.912 8.0-165.4-113.4 97.1 18.7 3.3 -3.0 78 78 A S E +bd 7 98A 0 19,-2.9 21,-2.9 -2,-0.7 -70,-0.2 -0.507 11.9 179.5 -72.7 156.5 21.9 4.6 -1.6 79 79 A L E +b 8 0A 0 -72,-2.4 -70,-0.6 19,-0.3 -65,-0.2 -0.396 37.6 126.7-155.0 54.7 23.8 6.8 -3.9 80 80 A C - 0 0 4 4,-0.4 5,-0.1 -72,-0.3 2,-0.1 0.804 62.3-136.9 -82.9 -34.2 26.8 7.7 -1.7 81 81 A G S > S+ 0 0 7 3,-0.3 3,-2.8 21,-0.1 -1,-0.1 -0.216 77.4 58.1 92.3 169.5 29.3 6.6 -4.4 82 82 A C T 3 S- 0 0 122 1,-0.3 3,-0.1 -2,-0.1 18,-0.0 0.709 128.1 -71.8 39.1 33.3 32.6 4.5 -4.1 83 83 A G T 3 S+ 0 0 50 1,-0.2 -1,-0.3 15,-0.1 2,-0.1 0.681 84.2 163.4 58.2 22.8 30.4 1.7 -2.6 84 84 A V < - 0 0 53 -3,-2.8 -4,-0.4 1,-0.0 -3,-0.3 -0.427 17.6-171.7 -62.3 144.6 30.0 3.6 0.6 85 85 A N - 0 0 69 -5,-0.1 -1,-0.0 -3,-0.1 13,-0.0 -0.744 25.2 -98.1-141.0 178.8 27.0 2.1 2.5 86 86 A L - 0 0 4 -2,-0.2 5,-0.3 1,-0.1 -8,-0.0 -0.934 14.9-158.0-114.3 111.2 24.7 2.5 5.6 87 87 A P S S+ 0 0 123 0, 0.0 -1,-0.1 0, 0.0 4,-0.0 0.845 71.7 78.6 -50.6 -41.2 25.4 0.6 8.8 88 88 A P S > S- 0 0 53 0, 0.0 3,-2.2 0, 0.0 4,-0.2 -0.035 106.8 -76.5 -74.3-179.7 21.7 0.9 10.0 89 89 A E G > S+ 0 0 129 1,-0.3 3,-1.4 2,-0.2 4,-0.1 0.539 112.7 86.8 -52.2 -16.6 18.5 -1.0 9.1 90 90 A W G > S+ 0 0 15 1,-0.3 3,-0.5 2,-0.2 -1,-0.3 0.767 87.9 52.0 -57.5 -24.9 18.3 1.0 5.8 91 91 A V G < S+ 0 0 47 -3,-2.2 -1,-0.3 -5,-0.3 -2,-0.2 0.618 104.0 58.9 -87.3 -10.0 20.6 -1.7 4.2 92 92 A T G < S+ 0 0 102 -3,-1.4 -1,-0.2 -4,-0.2 -2,-0.2 0.081 78.0 112.7-113.4 19.9 18.4 -4.6 5.4 93 93 A Q S < S- 0 0 46 -3,-0.5 -19,-0.1 2,-0.2 -18,-0.1 -0.280 89.0 -83.5 -81.7 175.7 15.1 -3.6 3.7 94 94 A E S S+ 0 0 139 -20,-0.6 2,-0.4 -21,-0.2 -19,-0.2 0.778 115.1 23.4 -57.8 -32.7 13.5 -5.7 0.9 95 95 A I E +d 75 0A 44 -21,-1.2 -19,-2.4 2,-0.0 2,-0.3 -0.996 68.0 176.1-135.2 139.1 15.7 -4.1 -1.9 96 96 A F E +d 76 0A 55 -2,-0.4 2,-0.3 -21,-0.2 -19,-0.2 -0.990 7.5 156.1-141.9 137.8 19.1 -2.3 -1.5 97 97 A E E -d 77 0A 81 -21,-1.4 -19,-2.9 -2,-0.3 2,-0.5 -0.957 31.5-141.9-146.7 158.7 21.4 -0.8 -4.1 98 98 A D E -d 78 0A 36 -2,-0.3 2,-1.2 -21,-0.2 -19,-0.3 -0.953 20.0-149.0-121.9 101.4 24.2 1.8 -4.1 99 99 A W - 0 0 11 -21,-2.9 2,-0.4 -2,-0.5 20,-0.0 -0.654 9.4-145.4 -75.4 95.8 24.0 3.8 -7.4 100 100 A Q + 0 0 142 -2,-1.2 2,-0.3 -19,-0.1 -2,-0.0 -0.548 37.9 159.5 -59.9 118.5 27.5 4.9 -8.1 101 101 A L - 0 0 12 -2,-0.4 2,-1.9 17,-0.0 -87,-0.1 -0.981 53.1-103.3-153.4 146.2 26.9 8.3 -9.7 102 102 A E - 0 0 124 -2,-0.3 13,-0.2 9,-0.2 5,-0.1 -0.518 47.1-125.6 -83.8 72.8 29.1 11.4 -10.2 103 103 A D - 0 0 15 -2,-1.9 -1,-0.1 1,-0.2 9,-0.1 0.151 14.0-143.1 -23.6 100.9 27.6 13.6 -7.4 104 104 A P > + 0 0 0 0, 0.0 3,-2.1 0, 0.0 2,-0.6 0.450 54.3 134.2 -61.0 -2.6 26.5 16.8 -9.3 105 105 A D T 3 S- 0 0 46 1,-0.3 -92,-0.0 -60,-0.0 -93,-0.0 -0.331 90.7 -14.9 -52.3 100.5 27.5 19.1 -6.3 106 106 A G T 3 S+ 0 0 61 -2,-0.6 -1,-0.3 1,-0.2 2,-0.1 0.652 107.9 137.6 83.7 20.5 29.4 21.9 -8.1 107 107 A Q < - 0 0 94 -3,-2.1 -1,-0.2 1,-0.1 2,-0.1 -0.238 57.3 -85.0 -97.0 179.2 29.9 20.1 -11.4 108 108 A S >> - 0 0 82 1,-0.1 4,-2.2 -2,-0.1 3,-0.7 -0.460 41.6-110.1 -76.4 154.9 29.7 20.8 -15.2 109 109 A L H 3> S+ 0 0 89 1,-0.3 4,-3.1 2,-0.2 5,-0.2 0.812 119.6 59.6 -58.6 -31.8 26.4 20.5 -17.0 110 110 A E H 3> S+ 0 0 154 2,-0.2 4,-2.5 1,-0.2 -1,-0.3 0.907 106.4 45.8 -63.4 -41.1 27.7 17.4 -18.8 111 111 A V H <> S+ 0 0 27 -3,-0.7 4,-2.8 2,-0.2 5,-0.3 0.949 114.0 49.7 -65.6 -46.8 28.1 15.7 -15.4 112 112 A F H X S+ 0 0 2 -4,-2.2 4,-3.2 1,-0.2 -2,-0.2 0.940 113.1 45.5 -54.6 -53.8 24.7 16.9 -14.4 113 113 A R H X S+ 0 0 111 -4,-3.1 4,-2.3 2,-0.2 -1,-0.2 0.884 113.0 51.0 -59.7 -42.0 23.1 15.6 -17.6 114 114 A T H X S+ 0 0 61 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.975 116.1 39.8 -61.5 -54.4 24.9 12.3 -17.4 115 115 A V H X S+ 0 0 0 -4,-2.8 4,-3.3 2,-0.2 5,-0.3 0.913 112.8 55.7 -63.0 -43.2 23.8 11.7 -13.7 116 116 A R H X S+ 0 0 35 -4,-3.2 4,-2.3 -5,-0.3 -1,-0.2 0.908 113.1 42.4 -57.7 -43.8 20.2 13.0 -14.4 117 117 A G H X S+ 0 0 34 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.953 115.7 48.3 -64.3 -50.2 19.8 10.5 -17.2 118 118 A Q H X S+ 0 0 54 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.920 114.0 47.1 -58.0 -51.4 21.5 7.6 -15.2 119 119 A V H X S+ 0 0 0 -4,-3.3 4,-2.9 2,-0.2 -1,-0.2 0.926 112.1 49.3 -50.8 -55.9 19.3 8.4 -12.1 120 120 A K H X S+ 0 0 58 -4,-2.3 4,-2.4 -5,-0.3 -2,-0.2 0.931 112.3 47.8 -59.3 -46.9 16.0 8.6 -14.2 121 121 A E H X S+ 0 0 102 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.874 113.1 49.2 -57.1 -42.1 16.8 5.3 -16.0 122 122 A R H X S+ 0 0 72 -4,-2.1 4,-2.8 -5,-0.2 -2,-0.2 0.918 108.3 52.1 -72.2 -41.0 17.6 3.7 -12.6 123 123 A V H X S+ 0 0 0 -4,-2.9 4,-2.8 2,-0.2 5,-0.2 0.930 110.9 49.7 -54.5 -46.2 14.3 5.0 -11.0 124 124 A E H X S+ 0 0 87 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.914 111.9 47.9 -62.2 -40.9 12.4 3.5 -13.9 125 125 A N H X S+ 0 0 92 -4,-2.2 4,-1.2 2,-0.2 -1,-0.2 0.908 111.7 49.7 -62.6 -44.2 14.3 0.2 -13.4 126 126 A L H >X S+ 0 0 3 -4,-2.8 4,-1.3 1,-0.2 3,-0.8 0.954 110.9 48.8 -64.3 -47.6 13.6 0.2 -9.7 127 127 A I H 3X S+ 0 0 16 -4,-2.8 4,-2.8 1,-0.2 -1,-0.2 0.876 105.0 60.6 -54.3 -41.5 9.8 0.9 -10.3 128 128 A A H 3< S+ 0 0 71 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.828 104.0 49.9 -62.7 -31.5 9.8 -2.0 -12.9 129 129 A K H << S+ 0 0 122 -4,-1.2 -1,-0.2 -3,-0.8 -2,-0.2 0.901 120.2 34.2 -66.2 -45.9 10.9 -4.5 -10.1 130 130 A I H < 0 0 26 -4,-1.3 -2,-0.2 -3,-0.2 -1,-0.1 0.705 360.0 360.0 -89.2 -27.0 8.1 -3.3 -7.6 131 131 A S < 0 0 111 -4,-2.8 -1,-0.2 -5,-0.2 -3,-0.1 0.864 360.0 360.0 -46.1 360.0 5.3 -2.5 -10.1