==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL-BINDING PROTEIN 04-APR-07 2UYD . COMPND 2 MOLECULE: HEMOPHORE HASA; . SOURCE 2 ORGANISM_SCIENTIFIC: SERRATIA MARCESCENS; . AUTHOR M.CZJZEK,C.CAILLET-SAGUY,A.FOURNELLE,B.GUIGLIARELLI, . 174 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8505.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 115 66.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 43 24.7 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 1.1 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 . 7 4.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 34 19.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.1 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 1 0 0 1 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 1 0 1 2 0 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 X M 0 0 173 0, 0.0 3,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 62.7 30.8 26.3 22.0 2 2 X A - 0 0 81 1,-0.4 2,-0.2 116,-0.1 115,-0.1 0.278 360.0 -13.5 -91.4 7.0 32.2 25.1 18.7 3 3 X F + 0 0 10 2,-0.0 -1,-0.4 152,-0.0 2,-0.3 -0.546 67.8 162.2 162.8 148.4 35.3 27.0 19.9 4 4 X S E -A 116 0A 27 112,-1.7 112,-2.3 -2,-0.2 2,-0.3 -0.963 16.4-151.4-163.3 148.9 36.6 29.4 22.5 5 5 X V E -A 115 0A 13 -2,-0.3 2,-0.3 110,-0.2 110,-0.2 -0.975 7.6-175.8-124.0 151.9 39.9 30.7 24.1 6 6 X N E +A 114 0A 119 108,-1.9 108,-2.3 -2,-0.3 2,-0.3 -0.986 16.2 169.4-134.2 149.6 40.8 32.1 27.5 7 7 X Y E -A 113 0A 59 -2,-0.3 106,-0.2 106,-0.2 105,-0.1 -0.978 42.5 -99.2-161.3 141.9 44.2 33.4 28.6 8 8 X D > - 0 0 75 104,-2.2 3,-1.9 -2,-0.3 4,-0.1 -0.332 50.3-117.2 -45.9 137.1 46.4 35.3 31.1 9 9 X S G > S+ 0 0 112 1,-0.3 3,-1.2 2,-0.2 4,-0.3 0.654 107.8 77.5 -68.9 -14.0 46.7 38.7 29.6 10 10 X S G 3 S+ 0 0 64 1,-0.2 3,-0.3 2,-0.1 -1,-0.3 0.772 94.6 51.1 -63.0 -25.1 50.4 38.3 29.3 11 11 X F G X S+ 0 0 16 -3,-1.9 3,-1.2 101,-0.2 155,-0.6 0.366 72.8 105.2 -97.6 3.3 49.8 36.1 26.2 12 12 X G T < S+ 0 0 3 -3,-1.2 155,-2.1 1,-0.3 154,-0.6 0.883 90.3 40.2 -48.1 -46.2 47.4 38.3 24.2 13 13 X G T 3 S+ 0 0 62 -3,-0.3 -1,-0.3 -4,-0.3 2,-0.2 0.544 95.5 101.4 -81.6 -9.7 50.3 39.1 21.8 14 14 X Y S < S- 0 0 75 -3,-1.2 152,-1.4 151,-0.1 153,-0.2 -0.553 73.2-126.0 -70.4 141.4 51.7 35.5 21.7 15 15 X S B > -F 165 0B 11 150,-0.2 4,-2.1 -2,-0.2 150,-0.2 -0.469 26.1-114.4 -68.3 156.8 50.8 33.4 18.7 16 16 X I H > S+ 0 0 0 148,-1.6 4,-2.4 146,-0.8 147,-0.2 0.914 119.2 52.7 -61.9 -40.7 49.2 30.0 19.7 17 17 X H H > S+ 0 0 72 145,-2.4 4,-1.2 1,-0.2 -1,-0.2 0.819 108.7 51.2 -61.2 -33.5 52.3 28.2 18.3 18 18 X D H > S+ 0 0 89 144,-0.3 4,-2.1 -3,-0.2 -2,-0.2 0.885 110.2 46.1 -77.0 -42.1 54.6 30.4 20.4 19 19 X Y H X S+ 0 0 3 -4,-2.1 4,-3.0 2,-0.2 -2,-0.2 0.926 113.5 50.2 -59.6 -47.8 52.8 29.8 23.7 20 20 X L H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.800 110.5 50.2 -63.2 -29.8 52.6 26.0 23.0 21 21 X G H X S+ 0 0 35 -4,-1.2 4,-1.4 2,-0.2 -1,-0.2 0.898 111.4 47.3 -75.7 -42.8 56.4 26.0 22.2 22 22 X Q H X S+ 0 0 104 -4,-2.1 4,-1.4 2,-0.2 -2,-0.2 0.933 114.5 48.4 -59.1 -46.1 57.1 27.9 25.4 23 23 X W H X S+ 0 0 4 -4,-3.0 4,-2.0 1,-0.2 5,-0.2 0.903 112.7 46.8 -63.3 -44.5 54.8 25.4 27.3 24 24 X A H X S+ 0 0 14 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.779 106.0 59.9 -69.7 -25.9 56.4 22.3 25.7 25 25 X S H < S+ 0 0 97 -4,-1.4 -1,-0.2 -3,-0.2 -2,-0.2 0.899 115.6 31.6 -73.8 -37.6 59.9 23.5 26.4 26 26 X T H < S+ 0 0 67 -4,-1.4 -2,-0.2 -3,-0.2 -1,-0.2 0.727 115.7 57.2 -94.8 -23.8 59.5 23.7 30.1 27 27 X F H < S+ 0 0 1 -4,-2.0 34,-0.5 -5,-0.2 2,-0.4 0.957 88.8 179.7 -64.5 -50.1 57.0 20.8 30.5 28 28 X G < - 0 0 22 -4,-1.8 2,-0.4 -5,-0.2 -1,-0.2 -0.712 37.7 -42.7 91.2-134.7 59.6 18.7 28.8 29 29 X D - 0 0 84 -2,-0.4 112,-0.2 -3,-0.1 111,-0.1 -0.963 34.5-156.3-146.6 119.4 59.0 15.0 28.2 30 30 X V - 0 0 3 110,-1.8 111,-0.1 -2,-0.4 3,-0.1 0.740 35.2-133.8 -71.9 -25.5 57.4 12.8 30.7 31 31 X N + 0 0 68 109,-0.3 2,-2.1 1,-0.2 110,-0.1 0.928 31.6 178.8 72.2 48.5 59.1 9.8 29.1 32 32 X H + 0 0 42 108,-0.2 2,-0.2 105,-0.1 -1,-0.2 -0.487 37.7 120.9 -81.5 70.1 56.1 7.5 29.0 33 33 X T S >> S- 0 0 60 -2,-2.1 3,-1.5 -3,-0.1 4,-0.7 -0.787 70.4 -65.4-129.4 169.4 58.0 4.7 27.2 34 34 X N T 34 S+ 0 0 160 1,-0.2 -2,-0.0 -2,-0.2 -1,-0.0 -0.378 118.3 15.8 -71.0 131.0 58.9 1.0 28.0 35 35 X G T 34 S+ 0 0 85 -2,-0.2 -1,-0.2 2,-0.0 0, 0.0 0.000 122.3 67.4 95.0 -21.2 61.2 0.3 31.0 36 36 X N T <4 + 0 0 79 -3,-1.5 -2,-0.2 -5,-0.1 5,-0.1 0.456 62.9 117.4-117.2 -7.6 60.5 3.9 32.2 37 37 X V < + 0 0 75 -4,-0.7 2,-0.2 -5,-0.1 5,-0.1 -0.207 33.6 154.8 -61.2 156.4 56.8 4.3 33.3 38 38 X T - 0 0 74 1,-0.1 3,-0.1 0, 0.0 -2,-0.0 -0.902 62.3 -84.8-158.0 179.4 55.9 5.1 37.0 39 39 X D S >> S+ 0 0 153 -2,-0.2 3,-0.8 1,-0.2 4,-0.5 0.854 125.7 59.9 -57.1 -37.9 53.3 6.6 39.4 40 40 X A T 34 S+ 0 0 65 1,-0.2 18,-0.3 2,-0.1 -1,-0.2 0.765 108.3 36.0 -65.4 -34.5 55.2 9.9 38.4 41 41 X N T 34 S+ 0 0 8 1,-0.1 -1,-0.2 -5,-0.1 -2,-0.1 -0.112 100.3 73.4-121.6 37.2 54.7 10.0 34.6 42 42 X S T <4 S- 0 0 47 -3,-0.8 2,-0.1 1,-0.2 -1,-0.1 0.643 73.8-152.5-118.9 -34.2 51.3 8.5 34.0 43 43 X G < - 0 0 29 -4,-0.5 2,-0.3 -3,-0.1 14,-0.2 -0.473 15.1-114.7 84.6-157.5 48.8 11.2 35.1 44 44 X G E -B 56 0A 17 12,-1.1 12,-1.8 -2,-0.1 2,-0.3 -0.968 10.2-116.7-174.5 156.2 45.3 10.3 36.3 45 45 X F E -B 55 0A 24 3,-0.5 2,-0.8 -2,-0.3 3,-0.5 -0.756 21.2-128.1-105.1 154.3 41.6 10.7 35.4 46 46 X Y E S+B 54 0A 62 8,-2.1 7,-2.4 -2,-0.3 8,-0.5 -0.931 97.7 23.9 -99.7 109.0 39.0 12.5 37.4 47 47 X G S S+ 0 0 58 -2,-0.8 -1,-0.2 54,-0.3 2,-0.2 0.764 123.0 14.7 107.5 37.8 36.2 10.0 37.9 48 48 X G S S- 0 0 40 -3,-0.5 -3,-0.5 1,-0.1 -1,-0.1 -0.612 77.9 -98.0 145.2 154.8 37.8 6.6 37.6 49 49 X S S S+ 0 0 122 -2,-0.2 -4,-0.1 1,-0.1 -1,-0.1 0.721 120.1 1.7 -63.5 -20.8 41.2 4.7 37.6 50 50 X L S S+ 0 0 75 1,-0.2 2,-0.2 -3,-0.1 25,-0.1 0.494 129.0 46.6-151.5 -31.3 41.2 4.6 33.7 51 51 X S + 0 0 50 23,-0.2 2,-0.3 -4,-0.1 23,-0.3 -0.703 67.5 124.9-112.1 177.6 38.1 6.5 32.3 52 52 X G - 0 0 15 21,-0.5 21,-2.2 -2,-0.2 -5,-0.2 -0.942 66.5 -76.9 158.2 179.0 36.8 9.9 33.4 53 53 X S S S+ 0 0 68 -7,-2.4 18,-0.4 -2,-0.3 2,-0.3 0.479 109.0 10.4 -88.7 -8.5 35.7 13.5 32.7 54 54 X Q E -B 46 0A 28 -8,-0.5 -8,-2.1 16,-0.2 2,-0.3 -0.892 60.4-148.7-167.1 144.4 39.2 14.8 32.4 55 55 X Y E +BC 45 69A 12 14,-1.4 14,-2.2 -2,-0.3 2,-0.3 -0.911 24.7 176.3-113.2 145.7 42.8 13.5 32.2 56 56 X A E +BC 44 68A 2 -12,-1.8 -12,-1.1 -2,-0.3 2,-0.3 -0.998 10.2 177.9-153.9 146.4 45.8 15.5 33.6 57 57 X I E - C 0 67A 3 10,-1.3 10,-1.5 -2,-0.3 2,-0.3 -0.987 17.9-137.4-149.6 152.5 49.5 15.3 34.2 58 58 X S E - C 0 66A 37 -2,-0.3 8,-0.2 -18,-0.3 7,-0.1 -0.809 36.4 -96.2-108.8 156.1 52.4 17.3 35.5 59 59 X S > - 0 0 2 6,-2.7 4,-0.6 -2,-0.3 -31,-0.1 -0.364 19.9-152.4 -67.2 141.6 55.9 17.7 34.1 60 60 X T T 4 S+ 0 0 50 -33,-0.3 -1,-0.1 2,-0.1 -32,-0.1 0.155 93.1 61.6 -97.8 14.8 58.5 15.4 35.5 61 61 X A T 4 S+ 0 0 67 -34,-0.5 -1,-0.1 -35,-0.1 -33,-0.1 0.724 124.6 8.6-104.9 -37.0 61.1 17.9 34.7 62 62 X N T 4 S- 0 0 61 -35,-0.3 -2,-0.1 3,-0.1 -35,-0.1 0.261 86.8-131.6-131.2 12.0 59.9 20.8 36.8 63 63 X Q S < S+ 0 0 139 -4,-0.6 -3,-0.1 1,-0.2 -36,-0.1 0.447 92.1 62.7 64.5 1.8 57.1 19.3 38.9 64 64 X V + 0 0 60 33,-0.1 33,-2.0 32,-0.1 34,-0.5 0.805 67.1 86.6-129.2 -62.2 54.9 22.2 38.0 65 65 X T E + D 0 96A 4 31,-0.2 -6,-2.7 -39,-0.2 2,-0.3 -0.182 58.1 158.8 -54.4 146.0 53.9 22.8 34.4 66 66 X A E -CD 58 95A 0 29,-2.4 29,-1.6 -8,-0.2 2,-0.3 -0.968 31.7-145.3-160.3 161.3 50.8 20.8 33.5 67 67 X F E -CD 57 94A 0 -10,-1.5 -10,-1.3 -2,-0.3 2,-0.3 -0.942 6.6-155.3-131.6 166.4 47.9 20.3 31.2 68 68 X V E -CD 56 93A 5 25,-1.8 25,-1.7 -2,-0.3 2,-0.3 -0.917 3.8-161.9-138.8 117.3 44.4 19.1 31.7 69 69 X A E -CD 55 92A 0 -14,-2.2 -14,-1.4 -2,-0.3 2,-0.3 -0.728 17.6-172.5 -83.1 147.1 42.3 17.6 28.9 70 70 X G E + D 0 91A 8 21,-1.9 21,-0.6 -2,-0.3 20,-0.5 -0.839 37.8 73.4-154.2 111.8 38.5 17.5 29.6 71 71 X G E S- D 0 89A 27 -18,-0.4 18,-0.2 -2,-0.3 -17,-0.1 0.068 101.3 -30.4-165.4 -63.4 35.4 16.0 27.9 72 72 X N E + D 0 88A 95 16,-2.0 16,-2.4 2,-0.1 2,-0.8 -0.415 66.5 177.8-177.5 77.0 34.8 12.3 28.0 73 73 X L E + D 0 87A 1 -21,-2.2 -21,-0.5 14,-0.2 2,-0.2 -0.791 6.1 176.3-111.1 99.6 38.0 10.3 28.2 74 74 X T E - D 0 86A 38 12,-1.0 12,-1.4 -2,-0.8 -23,-0.2 -0.645 13.4-161.6 -90.0 153.7 37.9 6.5 28.4 75 75 X Y - 0 0 58 -2,-0.2 10,-0.1 10,-0.2 -25,-0.1 -0.721 16.8-147.9-122.8-179.2 41.3 4.7 28.3 76 76 X T - 0 0 4 -2,-0.2 7,-1.4 1,-0.1 8,-0.5 -0.413 14.8-178.5-148.3 66.9 42.3 1.0 27.6 77 77 X L S S- 0 0 85 1,-0.3 6,-0.2 6,-0.2 -1,-0.1 0.799 87.3 -10.2 -41.0 -59.1 45.4 0.2 29.7 78 78 X F S S+ 0 0 180 4,-0.2 -1,-0.3 5,-0.1 4,-0.1 0.416 110.1 121.1-116.1 -5.4 45.9 -3.4 28.5 79 79 X N S S- 0 0 92 2,-0.1 4,-0.1 3,-0.1 -3,-0.1 0.419 83.0 -53.6 -60.5-163.6 42.5 -3.8 26.6 80 80 X E S S+ 0 0 162 1,-0.2 2,-0.9 2,-0.1 45,-0.0 0.841 133.8 40.5 -50.0 -65.7 41.9 -4.6 22.9 81 81 X P S > S- 0 0 29 0, 0.0 3,-0.8 0, 0.0 2,-0.3 -0.774 106.8-118.6 -77.0 107.6 44.1 -1.8 21.4 82 82 X A T 3 S- 0 0 74 -2,-0.9 -4,-0.2 1,-0.2 46,-0.2 -0.296 79.4 -14.7 -58.5 108.8 47.1 -2.0 23.7 83 83 X A T 3 S+ 0 0 45 -7,-1.4 2,-0.4 -2,-0.3 -1,-0.2 0.927 90.0 147.0 73.4 53.4 47.6 1.3 25.6 84 84 X T < - 0 0 3 -3,-0.8 2,-0.3 -8,-0.5 -1,-0.2 -0.876 42.2-140.9-135.9 107.7 45.4 3.8 23.7 85 85 X L + 0 0 12 -2,-0.4 2,-0.3 -10,-0.1 -10,-0.2 -0.393 35.0 169.7 -55.6 115.4 43.5 6.8 25.0 86 86 X Y E +D 74 0A 42 -12,-1.4 -12,-1.0 -2,-0.3 2,-0.5 -0.820 22.7 57.0-121.7 165.6 40.2 7.1 23.2 87 87 X G E S-DE 73 122A 11 35,-2.4 35,-1.8 -2,-0.3 2,-0.4 -0.953 82.6 -16.3 136.4-118.8 37.0 9.0 23.5 88 88 X Q E -DE 72 121A 33 -16,-2.4 -16,-2.0 -2,-0.5 2,-0.5 -0.986 39.9-167.6-137.5 135.3 36.1 12.6 23.5 89 89 X L E +DE 71 120A 0 31,-1.5 31,-1.9 -2,-0.4 -18,-0.2 -0.986 18.2 158.1-127.9 115.5 38.2 15.8 24.0 90 90 X D E + 0 0 69 -20,-0.5 28,-1.9 -2,-0.5 27,-1.2 0.699 63.2 24.0-105.1 -29.2 36.4 19.1 24.6 91 91 X S E -DE 70 116A 34 -21,-0.6 -21,-1.9 25,-0.2 2,-0.4 -0.986 47.5-165.5-145.2 142.2 39.0 21.2 26.3 92 92 X L E -DE 69 115A 0 23,-2.0 23,-3.4 -2,-0.3 2,-0.4 -0.998 13.6-175.0-124.9 134.6 42.7 21.7 26.9 93 93 X S E -DE 68 114A 33 -25,-1.7 -25,-1.8 -2,-0.4 2,-0.3 -0.997 5.0-168.3-129.7 131.1 44.1 23.9 29.7 94 94 X F E +DE 67 113A 1 19,-2.8 18,-2.3 -2,-0.4 19,-1.1 -0.839 30.5 86.1-119.1 150.8 47.8 24.7 30.2 95 95 X G E -DE 66 111A 0 -29,-1.6 -29,-2.4 -2,-0.3 2,-0.4 -0.967 65.4 -47.2 157.3-161.2 49.7 26.3 33.0 96 96 X D E S+DE 65 110A 53 14,-1.9 14,-2.4 -2,-0.3 -31,-0.2 -0.877 89.5 29.2-112.2 137.7 51.4 25.8 36.3 97 97 X G E - 0 0 18 -33,-2.0 12,-2.0 -2,-0.4 2,-0.3 0.951 59.2-150.4 96.0 79.1 50.5 23.9 39.5 98 98 X L E + E 0 108A 39 -34,-0.5 2,-0.3 10,-0.2 10,-0.2 -0.596 25.7 164.6 -80.4 131.5 48.2 20.9 39.2 99 99 X S E + E 0 107A 71 8,-1.8 8,-1.8 -2,-0.3 2,-0.0 -0.889 40.1 17.2-134.2 171.8 45.9 20.3 42.2 100 100 X G + 0 0 43 -2,-0.3 6,-0.3 6,-0.2 -2,-0.0 -0.332 45.0 146.5 69.1-149.7 42.8 18.2 43.0 101 101 X G + 0 0 5 3,-1.6 -54,-0.3 4,-0.4 5,-0.2 0.396 63.4 70.4 96.4 -2.4 41.7 15.4 40.6 102 102 X D S S- 0 0 152 3,-0.2 -55,-0.2 2,-0.2 -54,-0.1 0.762 122.1 -8.5-107.9 -82.5 40.2 13.0 43.3 103 103 X T S S+ 0 0 134 2,-0.1 -57,-0.0 -57,-0.1 -3,-0.0 0.277 138.6 48.3-102.4 5.5 36.9 14.2 44.8 104 104 X S S S- 0 0 55 3,-0.0 -3,-1.6 0, 0.0 -2,-0.2 -0.968 98.7 -91.8-133.0 156.3 37.4 17.6 43.1 105 105 X P - 0 0 68 0, 0.0 -4,-0.4 0, 0.0 2,-0.3 -0.223 47.0 -95.2 -55.8 150.0 38.2 18.4 39.5 106 106 X Y - 0 0 38 -6,-0.3 2,-0.3 -5,-0.2 -6,-0.2 -0.599 51.8-174.9 -58.6 128.3 41.8 18.9 38.4 107 107 X S E - E 0 99A 66 -8,-1.8 -8,-1.8 -2,-0.3 2,-0.5 -0.994 22.0-130.3-137.5 140.0 42.4 22.7 38.5 108 108 X I E - E 0 98A 21 -2,-0.3 -10,-0.2 -10,-0.2 -11,-0.2 -0.797 7.7-152.3 -98.8 132.1 45.5 24.7 37.5 109 109 X Q E S+ 0 0 155 -12,-2.0 -12,-0.2 -2,-0.5 -1,-0.1 0.867 90.7 24.3 -69.4 -39.4 46.9 27.2 40.0 110 110 X V E S- E 0 96A 58 -14,-2.4 -14,-1.9 -13,-0.0 -1,-0.3 -0.772 84.2-159.0-132.1 82.2 48.3 29.6 37.5 111 111 X P E + E 0 95A 77 0, 0.0 -16,-0.2 0, 0.0 3,-0.1 -0.372 17.9 173.9 -66.6 140.6 46.5 29.3 34.2 112 112 X D E - 0 0 26 -18,-2.3 -104,-2.2 1,-0.4 2,-0.3 0.738 63.6 -6.2-100.2 -57.6 48.2 30.5 31.0 113 113 X V E -AE 7 94A 2 -19,-1.1 -19,-2.8 -106,-0.2 -1,-0.4 -0.984 56.9-167.9-152.2 145.8 46.0 29.5 28.2 114 114 X S E -AE 6 93A 37 -108,-2.3 -108,-1.9 -2,-0.3 2,-0.5 -0.974 5.6-161.6-151.1 126.7 42.8 27.5 27.6 115 115 X F E -AE 5 92A 0 -23,-3.4 -23,-2.0 -2,-0.3 2,-0.3 -0.928 13.8-178.0-111.1 132.7 40.9 26.1 24.6 116 116 X G E +AE 4 91A 15 -112,-2.3 -112,-1.7 -2,-0.5 -25,-0.2 -0.939 56.7 35.9-125.1 155.1 37.3 25.0 24.7 117 117 X G E + 0 0 8 -27,-1.2 -26,-0.2 -2,-0.3 -1,-0.2 0.894 59.8 151.7 77.3 46.2 34.9 23.4 22.2 118 118 X L E - 0 0 4 -28,-1.9 -28,-0.2 -3,-0.2 -27,-0.1 0.844 31.6-160.9 -77.5 -35.3 37.4 21.3 20.4 119 119 X N E + 0 0 121 1,-0.2 2,-0.6 -30,-0.2 -29,-0.2 0.920 27.4 160.0 52.4 53.4 34.9 18.6 19.3 120 120 X L E - E 0 89A 27 -31,-1.9 -31,-1.5 2,-0.0 2,-0.4 -0.900 15.7-175.6-114.2 114.1 37.5 15.9 18.7 121 121 X S E + E 0 88A 66 -2,-0.6 2,-0.4 -33,-0.2 -33,-0.2 -0.899 14.2 170.3-110.5 129.5 36.4 12.2 18.6 122 122 X S E - E 0 87A 1 -35,-1.8 -35,-2.4 -2,-0.4 2,-0.2 -0.990 22.5-148.0-127.0 130.4 38.4 9.0 18.2 123 123 X L > - 0 0 117 -2,-0.4 3,-0.9 -37,-0.2 -2,-0.0 -0.642 31.0-106.5 -95.8 154.2 36.6 5.7 18.8 124 124 X Q T 3 S+ 0 0 69 1,-0.2 -1,-0.1 -2,-0.2 4,-0.1 0.616 113.0 71.9 -65.2 -12.6 38.6 2.8 20.3 125 125 X A T 3 S+ 0 0 97 2,-0.1 2,-0.6 -45,-0.0 -1,-0.2 0.964 88.4 68.1 -59.3 -54.5 38.7 0.9 16.9 126 126 X Q S < S- 0 0 97 -3,-0.9 4,-0.2 1,-0.1 5,-0.1 -0.591 88.5-162.6 -62.1 113.9 41.2 3.5 15.8 127 127 X G > - 0 0 19 -2,-0.6 3,-0.8 2,-0.2 6,-0.2 0.317 50.1 -23.7 -79.7-158.2 44.1 2.7 18.0 128 128 X H T 3 S+ 0 0 122 1,-0.3 -1,-0.1 -46,-0.2 -2,-0.1 0.190 138.1 56.9 -31.6 5.9 47.3 4.4 19.1 129 129 X D T 3 S+ 0 0 116 -2,-0.1 -1,-0.3 -45,-0.0 -2,-0.2 -0.319 75.7 110.0-132.6 62.5 46.7 6.4 15.8 130 130 X G S < S- 0 0 12 -3,-0.8 -3,-0.1 -4,-0.2 -2,-0.1 0.911 80.4-107.6 -88.2 -89.9 43.2 7.7 16.5 131 131 X V S > S+ 0 0 39 -5,-0.1 4,-2.5 -4,-0.1 5,-0.2 -0.121 110.1 48.5-166.6 -54.6 43.4 11.5 17.1 132 132 X V H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 5,-0.4 0.838 113.1 54.7 -62.3 -30.9 42.8 12.3 20.7 133 133 X H H > S+ 0 0 18 -6,-0.2 4,-2.6 1,-0.2 5,-0.4 0.956 109.6 45.6 -63.0 -48.2 45.3 9.6 21.4 134 134 X Q H > S+ 0 0 101 3,-0.2 4,-1.1 2,-0.2 12,-0.3 0.816 116.5 45.5 -63.7 -37.7 47.8 11.4 19.1 135 135 X V H X S+ 0 0 2 -4,-2.5 4,-2.8 11,-0.2 12,-0.3 0.983 119.3 37.4 -65.5 -65.4 47.1 14.9 20.7 136 136 X V H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.929 119.6 46.8 -57.2 -50.2 47.2 13.9 24.3 137 137 X Y H X S+ 0 0 77 -4,-2.6 4,-0.8 -5,-0.4 -1,-0.2 0.914 111.5 54.3 -61.8 -40.3 50.0 11.4 24.0 138 138 X G H ><>S+ 0 0 10 -4,-1.1 5,-2.4 -5,-0.4 3,-1.5 0.940 107.9 48.7 -51.1 -51.9 51.9 14.0 22.0 139 139 X L H ><5S+ 0 0 0 -4,-2.8 3,-1.4 1,-0.3 -2,-0.2 0.866 105.1 57.8 -60.7 -38.4 51.4 16.5 24.8 140 140 X M H 3<5S+ 0 0 15 -4,-2.4 -110,-1.8 1,-0.3 -109,-0.3 0.696 111.0 45.4 -65.5 -17.6 52.7 14.0 27.3 141 141 X S T <<5S- 0 0 35 -3,-1.5 -1,-0.3 -4,-0.8 -2,-0.2 0.326 118.8-106.4-105.9 1.6 55.9 13.9 25.2 142 142 X G T < 5S+ 0 0 25 -3,-1.4 2,-0.7 -4,-0.3 -3,-0.2 0.686 81.9 127.6 81.8 20.6 56.4 17.7 24.6 143 143 X D < + 0 0 94 -5,-2.4 3,-0.3 -6,-0.2 4,-0.3 -0.915 31.6 174.6-117.7 102.2 55.3 17.4 21.1 144 144 X T > + 0 0 15 -2,-0.7 4,-2.6 1,-0.2 3,-0.4 0.465 51.8 106.1 -87.4 -3.7 52.5 19.8 20.2 145 145 X G H > S+ 0 0 31 1,-0.2 4,-2.3 2,-0.2 3,-0.2 0.895 80.3 45.7 -37.8 -59.0 52.5 18.8 16.5 146 146 X A H > S+ 0 0 28 -3,-0.3 4,-1.9 -12,-0.3 -1,-0.2 0.873 114.3 47.9 -63.3 -37.9 49.3 16.9 16.7 147 147 X L H > S+ 0 0 1 -3,-0.4 4,-1.8 -4,-0.3 -1,-0.2 0.849 111.5 50.5 -68.3 -34.2 47.5 19.6 18.7 148 148 X E H X S+ 0 0 30 -4,-2.6 4,-2.1 -3,-0.2 14,-0.2 0.868 109.4 50.9 -75.2 -37.1 48.6 22.4 16.3 149 149 X T H X S+ 0 0 105 -4,-2.3 4,-1.7 -5,-0.3 -2,-0.2 0.958 112.4 45.9 -60.7 -52.0 47.5 20.5 13.3 150 150 X A H X S+ 0 0 21 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.865 111.8 52.8 -56.7 -38.5 44.0 19.9 14.8 151 151 X L H X S+ 0 0 0 -4,-1.8 4,-3.3 2,-0.2 5,-0.2 0.918 104.2 54.0 -68.0 -42.3 43.8 23.6 15.9 152 152 X N H X S+ 0 0 57 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.892 106.8 55.5 -57.4 -38.9 44.6 24.8 12.3 153 153 X G H X S+ 0 0 37 -4,-1.7 4,-0.7 1,-0.2 -2,-0.2 0.955 114.6 37.0 -53.8 -55.9 41.7 22.6 11.3 154 154 X I H < S+ 0 0 26 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.822 122.0 46.3 -63.2 -35.1 39.4 24.4 13.8 155 155 X L H ><>S+ 0 0 1 -4,-3.3 5,-1.6 1,-0.2 3,-1.5 0.759 97.3 67.1 -87.6 -25.9 41.0 27.8 13.2 156 156 X D H ><5S+ 0 0 103 -4,-2.6 3,-1.3 1,-0.3 -1,-0.2 0.787 90.9 64.7 -74.9 -22.1 41.1 27.9 9.4 157 157 X D T 3<5S+ 0 0 139 -4,-0.7 -1,-0.3 1,-0.2 -2,-0.2 0.725 105.0 47.3 -62.6 -22.2 37.3 28.0 9.2 158 158 X Y T < 5S- 0 0 91 -3,-1.5 -1,-0.2 -4,-0.2 -2,-0.2 0.345 124.4-107.0 -95.3 4.3 37.8 31.4 10.9 159 159 X G T < 5S+ 0 0 66 -3,-1.3 2,-0.2 1,-0.3 -3,-0.2 0.875 88.2 99.1 70.5 37.8 40.5 32.4 8.4 160 160 X L < - 0 0 33 -5,-1.6 -1,-0.3 -8,-0.2 2,-0.3 -0.737 51.4-159.7-135.6-177.5 43.3 32.0 11.1 161 161 X S > - 0 0 38 -2,-0.2 3,-1.9 -3,-0.1 -145,-0.3 -0.916 46.2 -85.4-153.2 179.2 45.9 29.5 12.2 162 162 X V T 3 S+ 0 0 3 1,-0.3 -145,-2.4 -2,-0.3 -146,-0.8 0.680 121.6 71.1 -66.0 -16.8 48.0 28.7 15.3 163 163 X N T 3 S+ 0 0 108 -147,-0.2 -1,-0.3 -148,-0.2 2,-0.3 0.388 85.1 88.5 -82.7 8.4 50.4 31.3 13.9 164 164 X S S < S- 0 0 11 -3,-1.9 -148,-1.6 1,-0.1 -147,-0.2 -0.759 86.2 -96.4 -99.9 156.2 47.9 34.1 14.8 165 165 X T B > -F 15 0B 36 -2,-0.3 4,-1.9 -150,-0.2 -150,-0.2 -0.045 22.0-120.1 -69.8 165.4 47.7 35.9 18.2 166 166 X F H > S+ 0 0 0 -152,-1.4 4,-2.6 -155,-0.6 -154,-0.2 0.931 116.9 52.5 -71.9 -47.5 45.4 35.0 21.1 167 167 X D H > S+ 0 0 90 -155,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.921 110.1 51.2 -47.3 -47.4 43.8 38.5 21.0 168 168 X Q H > S+ 0 0 93 -156,-0.4 4,-1.9 1,-0.2 -2,-0.2 0.911 110.0 46.4 -59.7 -46.9 43.2 37.8 17.3 169 169 X V H < S+ 0 0 1 -4,-1.9 4,-0.4 2,-0.2 -1,-0.2 0.853 109.6 57.1 -65.0 -33.2 41.5 34.4 17.9 170 170 X A H >< S+ 0 0 31 -4,-2.6 3,-1.7 1,-0.2 -2,-0.2 0.962 105.0 50.4 -61.1 -50.7 39.5 36.0 20.6 171 171 X A H 3< S+ 0 0 79 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.918 106.0 55.1 -52.8 -49.1 38.1 38.6 18.2 172 172 X A T 3< S+ 0 0 43 -4,-1.9 2,-0.4 -5,-0.1 -1,-0.3 0.496 103.5 63.6 -69.3 -4.1 37.1 35.9 15.7 173 173 X T < 0 0 31 -3,-1.7 -168,-0.1 -4,-0.4 -169,-0.0 -0.987 360.0 360.0-118.9 127.5 35.0 34.1 18.4 174 174 X A 0 0 155 -2,-0.4 -2,-0.1 -170,-0.0 -3,-0.1 -0.179 360.0 360.0-168.2 360.0 32.0 36.1 19.8