==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 23-OCT-03 1O65 . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN YIIM; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR STRUCTURAL GENOMIX . 652 9 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 31533.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 436 66.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 1.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 129 19.8 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 . 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 . 32 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 88 13.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 135 20.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 2.0 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 1 4 1 0 5 7 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 3 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 . 4 9 6 8 0 3 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 3 0 0 0 0 1 2 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 3 A K 0 0 58 0, 0.0 2,-0.6 0, 0.0 3,-0.5 0.000 360.0 360.0 360.0 149.4 73.5 59.4 69.2 2 4 A F > + 0 0 114 1,-0.2 3,-1.0 2,-0.1 4,-0.4 -0.119 360.0 121.1 -98.2 47.8 72.2 61.3 66.2 3 5 A L G > + 0 0 26 -2,-0.6 3,-1.0 1,-0.2 4,-0.3 0.738 64.4 75.5 -81.4 -10.9 72.2 65.0 67.2 4 6 A V G > >S+ 0 0 10 -3,-0.5 3,-1.3 1,-0.3 5,-0.5 0.803 82.2 70.2 -64.4 -28.4 74.6 65.7 64.3 5 7 A E G X 5S+ 0 0 67 -3,-1.0 3,-0.5 1,-0.3 -1,-0.3 0.879 101.4 45.2 -56.1 -36.2 71.5 65.5 62.1 6 8 A R G < 5S+ 0 0 208 -3,-1.0 -1,-0.3 -4,-0.4 -2,-0.2 0.458 91.4 79.1 -89.7 -0.4 70.3 68.7 63.6 7 9 A E G < 5S- 0 0 45 -3,-1.3 -1,-0.2 -4,-0.3 3,-0.2 0.338 95.0-126.9 -87.3 0.1 73.5 70.8 63.4 8 10 A Q T < 5 - 0 0 135 -3,-0.5 2,-0.4 -4,-0.2 -3,-0.1 0.938 27.7-158.5 54.7 51.3 73.0 71.6 59.7 9 11 A M < - 0 0 42 -5,-0.5 148,-1.7 148,-0.3 2,-0.4 -0.535 13.8-174.8 -62.5 122.7 76.5 70.4 58.8 10 12 A R E -A 156 0A 136 -2,-0.4 146,-0.2 146,-0.2 -1,-0.0 -0.959 10.4-169.4-126.0 130.6 77.2 72.0 55.4 11 13 A Y E -A 155 0A 25 144,-2.3 144,-2.9 -2,-0.4 76,-0.1 -0.932 19.3-135.6-129.9 110.1 80.3 71.4 53.3 12 14 A P - 0 0 102 0, 0.0 74,-0.4 0, 0.0 2,-0.4 -0.342 32.2-156.3 -54.7 140.6 81.2 73.5 50.3 13 15 A V - 0 0 3 138,-0.5 2,-0.4 137,-0.2 72,-0.2 -0.977 20.8-148.9-137.5 136.0 82.2 71.3 47.4 14 16 A D E -B 84 0A 53 70,-3.0 70,-3.1 -2,-0.4 2,-0.4 -0.824 25.0-147.4 -93.0 137.0 84.3 71.4 44.3 15 17 A V E -BC 83 25A 0 10,-0.5 10,-2.5 -2,-0.4 2,-0.4 -0.875 15.9-177.2-112.6 132.2 83.1 69.1 41.5 16 18 A Y E + C 0 24A 23 66,-2.3 2,-0.3 -2,-0.4 8,-0.2 -0.984 4.9 170.2-132.2 138.5 85.2 67.3 38.9 17 19 A T E + C 0 23A 18 6,-1.9 6,-3.1 -2,-0.4 2,-0.3 -0.967 8.5 140.4-142.2 161.0 84.2 65.1 35.9 18 20 A G 0 0 10 -2,-0.3 22,-3.3 4,-0.3 4,-0.1 -0.954 360.0 360.0-178.5 178.5 86.0 63.5 32.9 19 21 A K 0 0 111 2,-0.3 20,-0.0 -2,-0.3 -2,-0.0 -0.694 360.0 360.0-107.8 360.0 86.2 60.4 30.7 20 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 21 34 A A 0 0 118 0, 0.0 2,-0.3 0, 0.0 -2,-0.3 0.000 360.0 360.0 360.0 133.9 92.6 63.7 34.7 22 35 A K - 0 0 38 55,-0.2 2,-0.4 -4,-0.1 -4,-0.3 -0.725 360.0-129.4 -95.6 151.0 89.1 65.1 35.4 23 36 A I E -C 17 0A 120 -6,-3.1 -6,-1.9 -2,-0.3 -1,-0.0 -0.803 24.1-105.6-107.5 138.0 88.2 68.8 34.8 24 37 A Q E -C 16 0A 80 -2,-0.4 2,-0.5 -8,-0.2 -8,-0.2 -0.265 28.4-146.1 -59.9 134.4 86.5 71.1 37.3 25 38 A V E -C 15 0A 29 -10,-2.5 -10,-0.5 1,-0.1 126,-0.1 -0.914 15.8-177.6-103.2 130.1 82.8 71.9 36.6 26 39 A D + 0 0 124 -2,-0.5 -1,-0.1 2,-0.1 126,-0.1 0.733 60.9 47.8-103.8 -27.1 81.6 75.4 37.5 27 40 A G S S- 0 0 40 1,-0.2 124,-0.7 124,-0.1 2,-0.1 -0.202 96.6 -67.7-100.3-164.5 77.9 75.4 36.7 28 41 A E E +I 150 0B 122 122,-0.2 2,-0.3 -2,-0.1 122,-0.2 -0.493 48.3 176.3 -90.2 153.5 75.1 73.0 37.5 29 42 A L E -I 149 0B 22 120,-2.1 120,-2.4 -2,-0.1 2,-0.3 -0.978 34.2 -94.5-153.1 156.5 74.7 69.5 36.1 30 43 A M E -I 148 0B 75 -2,-0.3 7,-2.5 118,-0.2 2,-0.7 -0.544 27.0-152.2 -77.8 126.4 72.4 66.5 36.4 31 44 A L E -IJ 147 36B 0 116,-2.5 116,-1.9 -2,-0.3 5,-0.2 -0.949 22.3-174.2-101.5 113.2 73.3 63.8 38.8 32 45 A T E > - J 0 35B 50 3,-2.5 3,-1.4 -2,-0.7 113,-0.1 -0.531 42.4 -88.2 -99.5 176.2 71.9 60.5 37.6 33 46 A E T 3 S+ 0 0 111 1,-0.3 110,-0.5 -2,-0.2 18,-0.2 0.842 126.9 40.2 -46.3 -47.3 71.8 57.0 39.2 34 47 A L T 3 S- 0 0 104 1,-0.2 2,-0.3 108,-0.1 -1,-0.3 0.510 125.1 -71.5 -86.1 -11.0 75.2 56.1 37.7 35 48 A G E < S-J 32 0B 5 -3,-1.4 -3,-2.5 17,-0.0 2,-0.4 -0.926 71.8 -26.8 147.8-176.4 77.0 59.4 38.1 36 49 A L E > S-J 31 0B 0 15,-0.5 3,-3.3 -2,-0.3 -5,-0.2 -0.597 70.3 -99.8 -76.1 126.3 77.4 63.0 37.0 37 50 A E T 3 S+ 0 0 97 -7,-2.5 -1,-0.1 -2,-0.4 3,-0.1 -0.234 113.2 20.8 -43.8 124.6 76.3 63.8 33.5 38 51 A G T 3 S+ 0 0 43 1,-0.3 2,-0.3 -3,-0.1 -1,-0.3 0.224 97.6 117.0 96.2 -15.5 79.6 63.9 31.4 39 52 A D S < S- 0 0 15 -3,-3.3 -1,-0.3 1,-0.2 -20,-0.2 -0.651 90.8 -58.7 -87.0 146.6 81.6 61.8 33.9 40 53 A E S S+ 0 0 114 -22,-3.3 -1,-0.2 -2,-0.3 -21,-0.1 0.163 81.1 155.1 -31.3 98.8 83.0 58.4 32.8 41 54 A Q 0 0 99 -3,-0.1 -1,-0.1 -6,-0.1 -4,-0.0 0.330 360.0 360.0-100.1-137.9 79.8 56.7 31.9 42 55 A A 0 0 140 -2,-0.0 0, 0.0 0, 0.0 0, 0.0 0.879 360.0 360.0 -64.3 360.0 79.1 53.8 29.5 43 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 44 59 A V 0 0 133 0, 0.0 3,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 84.0 82.2 44.9 36.9 45 60 A H + 0 0 186 1,-0.2 150,-0.0 2,-0.1 0, 0.0 -0.045 360.0 84.1 -79.4-170.9 78.6 45.4 38.2 46 61 A G > + 0 0 20 148,-0.0 3,-1.0 149,-0.0 4,-0.2 0.560 48.5 147.0 87.4 15.4 77.7 47.5 41.2 47 62 A G G > + 0 0 18 1,-0.3 3,-1.9 2,-0.2 -2,-0.1 0.823 65.3 57.7 -51.5 -47.2 77.7 50.7 39.2 48 63 A P G > S+ 0 0 53 0, 0.0 3,-1.0 0, 0.0 95,-0.6 0.908 102.2 57.9 -56.8 -35.9 74.9 52.4 41.2 49 64 A D G < S+ 0 0 22 -3,-1.0 -2,-0.2 1,-0.2 60,-0.2 0.468 111.0 41.4 -72.6 -5.6 77.1 51.9 44.3 50 65 A R G < + 0 0 114 -3,-1.9 -1,-0.2 -4,-0.2 92,-0.2 -0.093 69.8 126.7-135.5 39.7 80.0 53.9 42.8 51 66 A A S < S+ 0 0 4 -3,-1.0 -15,-0.5 90,-1.0 2,-0.4 0.822 78.0 28.5 -63.9 -35.1 78.2 56.8 41.1 52 67 A L E -D 141 0A 0 89,-1.2 89,-2.0 -17,-0.1 2,-0.4 -0.997 66.0-155.0-136.2 138.3 80.4 59.4 43.0 53 68 A C E -D 140 0A 15 -2,-0.4 29,-2.7 87,-0.2 30,-2.3 -0.907 11.9-162.1-113.1 132.9 83.9 59.4 44.4 54 69 A H E -De 139 83A 0 85,-2.8 85,-1.4 -2,-0.4 30,-0.2 -0.936 8.6-178.4-116.8 137.4 85.0 61.7 47.3 55 70 A Y E - e 0 84A 0 28,-2.1 30,-0.8 -2,-0.4 2,-0.3 -0.986 25.8-129.0-136.5 124.2 88.5 62.6 48.3 56 71 A P E > - e 0 85A 0 0, 0.0 3,-1.2 0, 0.0 4,-0.3 -0.555 8.4-142.9 -68.2 129.3 89.3 64.9 51.3 57 72 A R T >> S+ 0 0 59 28,-2.4 3,-1.7 -2,-0.3 4,-0.9 0.782 95.3 78.3 -60.8 -27.8 91.7 67.7 50.4 58 73 A E H >> S+ 0 0 28 27,-0.4 4,-1.1 1,-0.3 3,-0.8 0.898 86.5 60.8 -47.5 -36.6 93.2 67.2 53.9 59 74 A H H <> S+ 0 0 11 -3,-1.2 4,-2.4 1,-0.3 -1,-0.3 0.698 90.7 65.3 -68.8 -22.7 95.1 64.2 52.4 60 75 A Y H <> S+ 0 0 18 -3,-1.7 4,-3.3 -4,-0.3 5,-0.3 0.875 97.7 56.0 -65.5 -38.5 97.0 66.2 49.8 61 76 A L H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 3,-0.7 0.946 110.6 51.7 -66.7 -43.0 101.0 63.3 50.5 64 79 A A H 3< S+ 0 0 29 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.883 112.0 48.2 -59.1 -37.6 102.8 66.5 49.5 65 80 A R H 3< S+ 0 0 135 -4,-2.2 -1,-0.3 -5,-0.3 -2,-0.2 0.660 113.4 47.5 -74.8 -21.1 104.7 66.2 52.8 66 81 A E H << S+ 0 0 89 -4,-1.1 -2,-0.2 -3,-0.7 -1,-0.2 0.730 127.7 25.3 -87.9 -27.4 105.5 62.6 52.2 67 82 A F >< + 0 0 43 -4,-2.4 3,-1.9 -5,-0.2 -1,-0.2 -0.475 66.8 162.2-135.9 67.0 106.6 63.2 48.6 68 83 A P G > S+ 0 0 86 0, 0.0 3,-1.8 0, 0.0 4,-0.2 0.853 72.0 68.3 -55.1 -37.1 107.9 66.8 48.4 69 84 A E G 3 S+ 0 0 169 1,-0.3 3,-0.1 -3,-0.1 -5,-0.1 0.690 114.3 28.5 -53.6 -31.4 109.7 66.0 45.1 70 85 A Q G X S+ 0 0 50 -3,-1.9 3,-1.9 -6,-0.2 4,-0.5 -0.036 77.9 133.4-125.7 41.3 106.4 65.6 43.4 71 86 A A G X + 0 0 38 -3,-1.8 3,-0.7 1,-0.3 -7,-0.1 0.702 64.2 67.9 -61.1 -25.3 104.2 67.9 45.5 72 87 A E G 3 S+ 0 0 131 1,-0.2 -1,-0.3 -4,-0.2 3,-0.1 0.687 93.7 59.4 -68.6 -26.2 102.6 69.5 42.3 73 88 A L G < S+ 0 0 67 -3,-1.9 2,-1.8 1,-0.2 -1,-0.2 0.737 85.7 81.9 -72.7 -24.6 100.9 66.2 41.6 74 89 A F < + 0 0 7 -3,-0.7 2,-0.3 -4,-0.5 -1,-0.2 -0.444 67.0 107.4 -87.8 69.9 99.0 66.2 44.9 75 90 A V S > S- 0 0 87 -2,-1.8 3,-2.7 -3,-0.1 4,-0.1 -0.972 73.2 -54.3-139.5 143.2 96.1 68.5 44.0 76 91 A A T 3 S+ 0 0 21 1,-0.3 8,-0.0 -2,-0.3 -2,-0.0 -0.376 118.8 21.7 -56.0 141.2 92.4 67.7 43.3 77 92 A P T > S+ 0 0 20 0, 0.0 3,-3.1 0, 0.0 -1,-0.3 -0.678 84.3 112.5-108.8 57.8 91.4 65.7 41.5 78 93 A A T < S+ 0 0 18 -3,-2.7 -2,-0.1 1,-0.3 -4,-0.1 0.778 81.5 55.2 -53.5 -32.0 94.6 63.6 41.2 79 94 A F T 3 S- 0 0 1 -4,-0.1 -1,-0.3 1,-0.0 -3,-0.1 0.379 121.3-104.1 -86.3 8.8 92.9 60.7 43.0 80 95 A G < + 0 0 32 -3,-3.1 -27,-0.2 1,-0.2 -2,-0.1 0.456 65.7 160.6 85.1 8.4 90.0 60.6 40.4 81 96 A E - 0 0 0 1,-0.1 -1,-0.2 -4,-0.1 -27,-0.2 -0.115 37.1-163.4 -66.8 151.0 87.5 62.2 42.8 82 97 A N S S+ 0 0 6 -29,-2.7 -66,-2.3 1,-0.2 2,-0.5 0.773 82.2 50.1 -94.5 -34.6 84.3 63.9 41.7 83 98 A L E -Be 15 54A 0 -30,-2.3 -28,-2.1 -68,-0.2 2,-0.4 -0.921 64.8-175.1-114.5 127.2 83.8 65.7 45.0 84 99 A S E +Be 14 55A 0 -70,-3.1 -70,-3.0 -2,-0.5 2,-0.3 -0.968 19.3 144.3-124.8 129.1 86.5 67.8 46.7 85 100 A T E - e 0 56A 0 -30,-0.8 -28,-2.4 -2,-0.4 -27,-0.4 -0.910 40.6-124.7-146.3 178.2 86.1 69.3 50.2 86 101 A D S S+ 0 0 38 -74,-0.4 3,-0.1 -2,-0.3 -2,-0.0 -0.860 88.8 37.0-121.6 154.8 87.5 70.4 53.6 87 102 A G S S+ 0 0 34 -2,-0.3 2,-0.5 1,-0.1 -1,-0.1 0.343 92.4 94.9 87.5 -8.4 86.0 69.2 56.9 88 103 A L + 0 0 3 -3,-0.0 2,-0.2 -33,-0.0 -30,-0.2 -0.970 45.8 154.7-123.4 118.5 85.0 65.7 55.9 89 104 A T >> - 0 0 24 -2,-0.5 3,-1.3 -33,-0.1 4,-0.9 -0.797 58.4 -92.3-131.6 176.0 87.3 62.7 56.5 90 105 A E T 34 S+ 0 0 13 1,-0.3 77,-2.4 -2,-0.2 76,-0.5 0.814 122.7 55.5 -58.7 -31.5 87.2 58.9 57.0 91 106 A S T 34 S+ 0 0 18 1,-0.2 -1,-0.3 75,-0.2 74,-0.1 0.603 116.3 31.9 -81.1 -13.6 86.9 59.5 60.8 92 107 A N T <4 S+ 0 0 11 -3,-1.3 2,-0.5 2,-0.0 -1,-0.2 0.232 101.9 84.6-122.5 8.0 83.8 61.8 60.7 93 108 A V < - 0 0 0 -4,-0.9 73,-2.6 -3,-0.2 74,-0.4 -0.968 67.8-153.6-106.5 125.2 82.0 60.4 57.7 94 109 A Y B > -K 165 0C 23 -2,-0.5 3,-2.2 71,-0.3 71,-0.3 -0.774 23.5-100.3-102.5 150.1 79.8 57.4 58.6 95 110 A M T 3 S+ 0 0 0 69,-3.2 69,-0.3 -2,-0.3 95,-0.2 -0.420 112.0 23.3 -60.7 133.9 78.7 54.5 56.4 96 111 A G T 3 S+ 0 0 0 12,-1.8 -1,-0.3 1,-0.3 95,-0.1 0.376 83.7 157.5 88.5 -3.7 75.1 55.1 55.2 97 112 A D < - 0 0 0 -3,-2.2 11,-2.5 63,-0.1 2,-0.5 -0.323 29.9-151.0 -57.9 135.9 75.4 58.9 55.7 98 113 A I E -FG 107 159A 34 61,-2.1 60,-2.8 9,-0.2 61,-1.8 -0.974 13.3-170.7-114.4 124.2 72.8 60.5 53.5 99 114 A F E -FG 106 157A 1 7,-2.6 7,-2.6 -2,-0.5 2,-0.4 -0.905 19.1-137.3-115.6 140.2 73.6 64.0 52.2 100 115 A R E -FG 105 156A 126 56,-2.9 56,-2.8 -2,-0.4 2,-0.3 -0.846 23.6-178.2 -91.8 132.4 71.2 66.4 50.4 101 116 A W E > -F 104 0A 0 3,-2.0 3,-3.2 -2,-0.4 2,-0.2 -0.899 57.7 -61.9-138.3 97.5 73.0 68.1 47.5 102 117 A G T 3 S- 0 0 24 52,-0.5 47,-0.2 -2,-0.3 -1,-0.1 -0.389 122.4 -15.0 61.2-117.6 71.0 70.6 45.6 103 118 A E T 3 S+ 0 0 139 45,-3.3 -1,-0.3 -2,-0.2 46,-0.2 0.446 125.6 88.3 -94.1 3.0 68.1 68.5 44.2 104 119 A A E < -F 101 0A 1 -3,-3.2 -3,-2.0 44,-0.4 2,-0.4 -0.463 59.6-150.3-102.8 169.7 69.9 65.2 44.9 105 120 A L E -FH 100 145A 59 40,-1.9 40,-2.2 -5,-0.2 39,-2.1 -0.993 20.9-177.6-137.0 119.5 70.2 62.7 47.7 106 121 A I E -FH 99 143A 0 -7,-2.6 -7,-2.6 -2,-0.4 2,-0.4 -0.909 10.1-155.5-123.8 152.0 73.4 60.7 48.0 107 122 A Q E -FH 98 142A 25 35,-2.5 35,-2.9 -2,-0.3 2,-0.3 -0.997 24.3-116.7-132.8 134.2 74.5 58.0 50.4 108 123 A V E + H 0 141A 0 -11,-2.5 -12,-1.8 -2,-0.4 33,-0.3 -0.471 36.8 172.4 -67.3 123.1 77.9 56.8 51.5 109 124 A S E - 0 0 0 31,-2.1 84,-2.5 1,-0.4 32,-0.2 0.671 54.0 -21.3-110.9 -22.6 78.2 53.2 50.3 110 125 A Q E - H 0 140A 13 30,-0.9 30,-3.0 82,-0.2 -1,-0.4 -0.955 67.0 -87.9-176.7 158.9 81.8 52.2 50.9 111 126 A P E - H 0 139A 0 0, 0.0 2,-0.4 0, 0.0 28,-0.3 -0.372 59.6 -98.0 -69.2 149.3 85.4 53.4 51.5 112 127 A R - 0 0 33 26,-2.3 -59,-0.0 -58,-0.1 26,-0.0 -0.706 35.6-131.9 -74.1 134.7 87.2 53.9 48.2 113 128 A S - 0 0 38 -2,-0.4 26,-0.0 -3,-0.0 15,-0.0 -0.783 17.8-127.2 -90.0 103.3 89.4 50.8 47.3 114 129 A P - 0 0 0 0, 0.0 2,-0.3 0, 0.0 23,-0.0 -0.101 29.1-163.7 -51.7 136.4 93.0 51.8 46.3 115 130 A C > - 0 0 42 101,-0.1 3,-1.7 102,-0.1 4,-0.4 -0.941 30.7-115.4-126.8 145.7 93.9 50.2 43.0 116 131 A Y T >> S+ 0 0 71 99,-2.6 3,-0.9 -2,-0.3 4,-0.7 0.655 105.4 78.6 -54.5 -23.3 97.3 49.7 41.3 117 132 A K H >> S+ 0 0 121 1,-0.3 3,-1.4 98,-0.2 4,-1.3 0.920 87.8 61.7 -54.3 -38.9 96.4 52.0 38.4 118 133 A L H <> S+ 0 0 17 -3,-1.7 4,-2.0 1,-0.3 6,-0.4 0.851 91.6 65.1 -51.6 -40.3 97.2 54.8 41.0 119 134 A N H <4>S+ 0 0 7 -3,-0.9 5,-0.8 -4,-0.4 -1,-0.3 0.780 108.7 38.8 -57.3 -29.7 100.8 53.5 41.2 120 135 A Y H <<5S+ 0 0 146 -3,-1.4 -1,-0.2 -4,-0.7 -2,-0.2 0.620 110.6 60.2 -93.7 -18.4 101.4 54.5 37.5 121 136 A H H <5S+ 0 0 106 -4,-1.3 -2,-0.2 -3,-0.2 -3,-0.1 0.881 118.2 27.6 -78.0 -38.3 99.4 57.7 37.7 122 137 A F T <5S- 0 0 2 -4,-2.0 -1,-0.2 2,-0.2 -2,-0.1 0.432 104.9-125.9 -96.6 -8.5 101.5 59.4 40.4 123 138 A D T 5S+ 0 0 133 -5,-0.3 2,-0.5 1,-0.2 -3,-0.2 0.882 70.3 130.4 62.7 34.2 104.6 57.4 39.3 124 139 A I > < - 0 0 12 -5,-0.8 3,-1.7 -6,-0.4 4,-0.3 -0.971 54.4-147.3-119.7 107.5 104.9 56.2 42.9 125 140 A S T 3 S+ 0 0 89 -2,-0.5 -6,-0.1 1,-0.3 3,-0.1 0.706 92.1 29.4 -49.2 -34.4 105.3 52.5 42.9 126 141 A D T 3> S+ 0 0 54 1,-0.1 4,-2.6 2,-0.1 -1,-0.3 0.050 77.4 118.7-119.8 29.9 103.5 51.8 46.2 127 142 A I H <> S+ 0 0 0 -3,-1.7 4,-3.4 1,-0.2 5,-0.2 0.930 78.3 53.3 -64.4 -39.3 101.0 54.6 46.5 128 143 A A H > S+ 0 0 0 -4,-0.3 4,-2.4 1,-0.2 -1,-0.2 0.938 110.9 46.5 -62.3 -41.5 98.0 52.2 46.5 129 144 A Q H > S+ 0 0 45 87,-0.3 4,-2.9 2,-0.2 5,-0.2 0.962 112.8 51.1 -61.5 -47.9 99.6 50.2 49.3 130 145 A L H X S+ 0 0 40 -4,-2.6 4,-2.5 2,-0.2 5,-0.3 0.954 109.2 49.2 -54.6 -53.3 100.3 53.6 51.1 131 146 A M H X>S+ 0 0 0 -4,-3.4 4,-1.7 1,-0.2 5,-0.7 0.946 114.1 45.8 -53.7 -51.0 96.6 54.8 50.8 132 147 A Q H <5S+ 0 0 5 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.914 113.1 50.1 -59.6 -43.3 95.3 51.5 52.1 133 148 A N H <5S+ 0 0 88 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.891 116.4 39.4 -63.7 -38.6 97.8 51.4 55.0 134 149 A T H <5S- 0 0 52 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.692 103.9-127.0 -86.4 -18.2 97.0 54.9 56.2 135 150 A G T <5 + 0 0 10 -4,-1.7 2,-2.1 -5,-0.3 3,-0.5 0.523 65.5 138.1 84.7 4.9 93.3 54.7 55.5 136 151 A K < + 0 0 50 -5,-0.7 -1,-0.2 -6,-0.3 -4,-0.1 -0.462 27.0 119.0 -84.1 74.2 93.5 57.9 53.5 137 152 A V - 0 0 0 -2,-2.1 -1,-0.2 1,-0.2 2,-0.1 0.702 58.4-141.6-117.1 -20.2 91.2 56.5 50.8 138 153 A G - 0 0 0 -3,-0.5 -26,-2.3 -83,-0.1 2,-0.3 -0.481 24.9-105.2 81.4-174.2 88.1 58.6 50.5 139 154 A W E -DH 54 111A 0 -85,-1.4 -85,-2.8 -28,-0.3 2,-0.2 -0.981 15.5-122.3-153.0 166.6 84.7 57.0 49.9 140 155 A L E -DH 53 110A 19 -30,-3.0 -31,-2.1 -2,-0.3 -30,-0.9 -0.698 19.5-143.5-112.9 166.2 82.0 56.4 47.2 141 156 A Y E -DH 52 108A 0 -89,-2.0 -89,-1.2 -33,-0.3 -90,-1.0 -0.931 5.5-143.6-127.0 150.2 78.3 57.3 47.1 142 157 A S E - H 0 107A 14 -35,-2.9 -35,-2.5 -2,-0.3 2,-0.8 -0.778 32.8-116.9 -98.7 152.7 75.2 55.7 45.8 143 158 A V E + H 0 106A 19 -95,-0.6 -37,-0.3 -110,-0.5 -93,-0.0 -0.851 32.6 177.7 -95.7 112.5 72.6 58.1 44.3 144 159 A I E S+ 0 0 81 -39,-2.1 -38,-0.2 -2,-0.8 -1,-0.2 0.897 76.7 13.3 -78.1 -46.0 69.4 57.9 46.4 145 160 A A E S- H 0 105A 32 -40,-2.2 -40,-1.9 -113,-0.1 -1,-0.3 -0.950 79.7-137.2-136.3 116.4 67.6 60.7 44.4 146 161 A P + 0 0 66 0, 0.0 2,-0.3 0, 0.0 -114,-0.2 -0.259 43.6 126.6 -66.9 150.2 68.8 61.9 41.1 147 162 A G E -I 31 0B 7 -116,-1.9 -116,-2.5 -43,-0.1 2,-0.2 -0.966 59.7 -55.8 175.1 173.1 68.7 65.7 40.5 148 163 A K E +I 30 0B 99 -2,-0.3 -45,-3.3 -118,-0.2 -44,-0.4 -0.541 55.3 168.5 -71.3 136.4 70.4 68.9 39.5 149 164 A V E -I 29 0B 3 -120,-2.4 -120,-2.1 -47,-0.2 2,-0.3 -0.813 8.0-174.8-136.6 174.1 73.5 69.6 41.7 150 165 A S E > -I 28 0B 12 3,-0.3 3,-0.6 -2,-0.3 -122,-0.2 -0.988 44.5-100.6-168.6 168.8 76.3 72.1 41.4 151 166 A A T 3 S+ 0 0 22 -124,-0.7 -138,-0.5 -2,-0.3 -124,-0.1 0.738 120.9 57.9 -66.3 -21.4 79.6 73.5 42.7 152 167 A D T 3 S+ 0 0 136 -126,-0.1 -1,-0.3 -140,-0.1 -138,-0.0 0.776 90.5 76.9 -80.9 -34.8 77.5 76.2 44.3 153 168 A A S < S- 0 0 20 -3,-0.6 -3,-0.3 -141,-0.1 -140,-0.1 -0.728 78.5-137.2 -80.9 128.6 75.2 73.9 46.4 154 169 A P - 0 0 41 0, 0.0 -52,-0.5 0, 0.0 2,-0.4 -0.332 21.8-101.9 -79.4 156.1 76.9 72.5 49.5 155 170 A L E -A 11 0A 0 -144,-2.9 -144,-2.3 -54,-0.1 2,-0.5 -0.711 39.8-162.6 -75.2 129.0 76.8 68.9 50.8 156 171 A E E -AG 10 100A 37 -56,-2.8 -56,-2.9 -2,-0.4 2,-0.4 -0.951 14.2-136.2-120.3 117.2 74.3 68.8 53.7 157 172 A L E + G 0 99A 8 -148,-1.7 -148,-0.3 -2,-0.5 -58,-0.2 -0.522 34.3 161.5 -70.4 126.5 74.2 65.9 56.1 158 173 A V E + 0 0 63 -60,-2.8 2,-0.4 -2,-0.4 -59,-0.2 0.718 58.1 30.2-118.4 -34.2 70.6 64.9 56.7 159 174 A S E - G 0 98A 36 -61,-1.8 -61,-2.1 -63,-0.0 2,-0.6 -0.993 48.8-169.7-135.6 133.8 70.7 61.4 58.1 160 175 A R + 0 0 30 -2,-0.4 -63,-0.1 -63,-0.2 -155,-0.1 -0.975 22.0 162.0-111.2 109.7 73.2 59.5 60.2 161 176 A V + 0 0 66 -2,-0.6 29,-0.5 -66,-0.2 2,-0.3 0.146 51.7 40.9-125.8 19.6 72.0 55.9 60.2 162 177 A S - 0 0 13 27,-0.1 27,-0.1 29,-0.0 -68,-0.0 -0.957 62.2-137.2-149.5 167.5 74.9 53.7 61.3 163 178 A D S S+ 0 0 101 -2,-0.3 2,-0.6 2,-0.1 26,-0.0 -0.087 74.8 100.7-117.8 27.4 77.7 53.9 63.9 164 179 A V - 0 0 2 -69,-0.3 -69,-3.2 22,-0.1 2,-0.1 -0.959 60.7-152.3-115.5 116.8 80.4 52.6 61.6 165 180 A T B > -K 94 0C 6 -2,-0.6 4,-2.5 -71,-0.3 -71,-0.3 -0.405 29.7-109.2 -75.2 163.9 82.7 55.3 60.2 166 181 A V H > S+ 0 0 0 -73,-2.6 4,-3.3 -76,-0.5 5,-0.2 0.897 121.5 56.9 -58.2 -39.7 84.5 55.0 56.9 167 182 A Q H > S+ 0 0 44 -77,-2.4 4,-2.8 -74,-0.4 -1,-0.2 0.942 107.9 46.4 -60.4 -48.9 87.7 54.7 58.9 168 183 A E H > S+ 0 0 34 -78,-0.3 4,-2.9 2,-0.2 5,-0.3 0.923 112.9 48.6 -60.0 -47.8 86.3 51.7 60.8 169 184 A A H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.943 112.5 49.2 -59.3 -46.0 85.1 50.0 57.6 170 185 A A H X S+ 0 0 0 -4,-3.3 4,-2.5 1,-0.2 5,-0.3 0.941 114.1 46.0 -58.0 -44.4 88.4 50.6 55.9 171 186 A A H X>S+ 0 0 10 -4,-2.8 5,-2.4 1,-0.3 4,-2.1 0.822 110.7 51.7 -66.5 -41.9 90.2 49.1 59.0 172 187 A I H <5S+ 0 0 2 -4,-2.9 -1,-0.3 -5,-0.2 -2,-0.2 0.859 115.3 43.6 -62.0 -38.8 87.8 46.2 59.2 173 188 A A H <5S+ 0 0 2 -4,-2.1 -2,-0.2 -5,-0.3 -1,-0.2 0.913 134.5 7.9 -75.1 -41.5 88.5 45.4 55.5 174 189 A W H <5S+ 0 0 25 -4,-2.5 -3,-0.2 -5,-0.2 -2,-0.2 0.494 124.3 43.7-124.4 -10.0 92.3 45.9 55.4 175 190 A H T <5S+ 0 0 55 -4,-2.1 -3,-0.2 -5,-0.3 -4,-0.1 0.773 93.8 68.4-108.8 -37.1 94.0 46.4 58.8 176 191 A M S - 0 0 58 -3,-0.1 4,-2.0 -7,-0.1 5,-0.2 -0.824 23.9-164.9-143.3 106.4 87.1 38.8 63.1 180 195 A D H > S+ 0 0 54 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.863 92.2 54.3 -57.7 -42.4 83.6 37.4 62.4 181 196 A D H > S+ 0 0 118 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.887 107.9 49.0 -59.3 -42.9 82.0 39.8 64.8 182 197 A Q H > S+ 0 0 27 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.902 111.2 50.6 -64.6 -39.3 83.6 42.8 63.1 183 198 A Y H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.917 109.3 50.7 -67.2 -37.1 82.4 41.4 59.7 184 199 A H H X S+ 0 0 100 -4,-2.7 4,-0.8 1,-0.2 -2,-0.2 0.933 110.6 50.9 -65.1 -38.4 78.9 41.0 61.1 185 200 A R H >< S+ 0 0 35 -4,-2.3 3,-1.1 2,-0.2 4,-0.5 0.945 110.1 47.2 -64.1 -44.7 79.1 44.6 62.3 186 201 A L H >< S+ 0 0 0 -4,-2.5 3,-1.5 1,-0.3 -1,-0.2 0.918 107.7 56.4 -66.0 -38.2 80.2 46.0 58.9 187 202 A L H 3< S+ 0 0 41 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.691 102.6 58.9 -67.1 -14.8 77.4 44.0 57.1 188 203 A S T << S+ 0 0 79 -3,-1.1 2,-0.4 -4,-0.8 -1,-0.3 0.535 77.5 109.5 -89.2 -17.1 74.9 45.8 59.4 189 204 A A S X S- 0 0 7 -3,-1.5 3,-1.2 -4,-0.5 -93,-0.1 -0.529 76.3-115.4 -66.6 124.3 75.8 49.3 58.3 190 205 A A T 3 S+ 0 0 39 -29,-0.5 -93,-0.1 -2,-0.4 -1,-0.1 -0.109 93.3 22.8 -53.9 150.5 73.0 50.8 56.3 191 206 A G T 3 S+ 0 0 24 1,-0.2 -1,-0.2 -95,-0.1 -95,-0.2 0.449 77.7 164.0 74.2 0.9 73.8 51.7 52.6 192 207 A L < - 0 0 20 -3,-1.2 -1,-0.2 -6,-0.1 -82,-0.2 -0.274 43.4-108.2 -55.7 132.4 76.7 49.2 52.2 193 208 A S > - 0 0 0 -84,-2.5 4,-2.5 1,-0.1 3,-0.4 -0.345 23.1-119.2 -62.4 150.9 77.6 48.6 48.5 194 209 A K H > S+ 0 0 156 1,-0.3 4,-2.8 2,-0.2 5,-0.2 0.886 114.3 54.4 -58.5 -40.1 76.7 45.2 47.2 195 210 A S H > S+ 0 0 56 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.883 109.1 46.4 -65.8 -38.1 80.4 44.4 46.4 196 211 A W H > S+ 0 0 12 -3,-0.4 4,-2.5 2,-0.2 5,-0.2 0.903 111.8 52.2 -72.0 -34.4 81.4 45.2 50.1 197 212 A T H X S+ 0 0 55 -4,-2.5 4,-3.4 2,-0.2 5,-0.2 0.938 111.0 48.6 -59.9 -46.1 78.5 43.1 51.3 198 213 A R H X S+ 0 0 158 -4,-2.8 4,-3.4 2,-0.2 5,-0.2 0.962 111.7 47.3 -58.6 -52.7 79.7 40.2 49.1 199 214 A T H X S+ 0 0 44 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.937 116.0 44.5 -57.0 -49.5 83.3 40.5 50.2 200 215 A M H X S+ 0 0 1 -4,-2.5 4,-1.8 2,-0.2 3,-0.2 0.950 114.1 48.9 -65.6 -42.0 82.4 40.6 53.9 201 216 A Q H X S+ 0 0 74 -4,-3.4 4,-1.8 1,-0.2 5,-0.2 0.908 108.6 54.6 -63.8 -39.0 79.9 37.8 53.5 202 217 A K H X S+ 0 0 110 -4,-3.4 4,-2.2 -5,-0.2 6,-0.3 0.881 106.3 53.0 -60.4 -34.3 82.5 35.7 51.6 203 218 A R H X>S+ 0 0 2 -4,-2.0 4,-2.4 -3,-0.2 5,-0.6 0.913 105.8 52.3 -68.0 -39.2 84.8 36.2 54.6 204 219 A R H <5S+ 0 0 80 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.908 115.8 40.3 -62.2 -41.2 82.3 34.9 57.2 205 220 A L H <5S+ 0 0 136 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.823 120.9 40.8 -78.3 -32.8 81.7 31.7 55.2 206 221 A S H <5S- 0 0 68 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.758 95.6-135.1 -86.9 -25.6 85.2 31.0 54.1 207 222 A G T <5S+ 0 0 42 -4,-2.4 2,-0.3 1,-0.3 -3,-0.2 0.705 71.8 97.7 77.3 20.1 86.8 31.9 57.5 208 223 A K S + 0 0 40 -2,-0.2 4,-2.4 1,-0.1 5,-0.3 0.536 59.8 99.5-106.9 -5.4 94.8 41.9 48.1 213 228 A S H > S+ 0 0 52 1,-0.2 4,-2.1 2,-0.2 5,-0.3 0.821 82.9 43.8 -53.9 -50.6 97.9 41.4 45.9 214 229 A R H > S+ 0 0 185 3,-0.2 4,-2.6 2,-0.2 -98,-0.2 0.911 115.2 48.3 -64.7 -45.1 96.4 41.9 42.4 215 230 A R H 4 S+ 0 0 63 -4,-0.2 -99,-2.6 1,-0.2 -2,-0.2 0.968 120.0 36.5 -60.1 -49.8 94.3 44.9 43.3 216 231 A L H < S+ 0 0 4 -4,-2.4 -87,-0.3 -101,-0.2 -88,-0.2 0.782 135.6 20.2 -73.6 -35.1 97.2 46.8 45.1 217 232 A W H < S- 0 0 81 -4,-2.1 -3,-0.2 -5,-0.3 -2,-0.2 0.473 79.7-166.1-117.2 -3.1 100.0 45.7 42.8 218 233 A G S < S+ 0 0 9 -4,-2.6 2,-3.0 -5,-0.3 -1,-0.2 -0.267 80.6 15.9 50.5-133.9 98.4 44.6 39.5 219 234 A K 0 0 98 1,-0.2 -1,-0.2 -103,-0.0 -5,-0.1 -0.347 360.0 360.0 -68.5 71.9 101.1 42.7 37.5 220 235 A E 0 0 105 -2,-3.0 -1,-0.2 -7,-0.1 -2,-0.2 -0.227 360.0 360.0 168.2 360.0 103.3 42.3 40.5 221 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 222 3 B K 0 0 129 0, 0.0 2,-0.4 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 124.6 66.4 54.1 -15.3 223 4 B F > + 0 0 112 1,-0.2 3,-0.5 2,-0.1 4,-0.5 -0.364 360.0 130.6-105.1 55.2 67.3 56.9 -13.0 224 5 B L T 3 + 0 0 115 -2,-0.4 4,-0.3 1,-0.2 3,-0.3 0.693 60.1 76.1 -82.7 -14.9 64.1 57.1 -11.0 225 6 B V T > >S+ 0 0 38 -3,-0.3 3,-1.3 1,-0.2 5,-0.6 0.857 88.0 60.3 -61.9 -32.7 66.1 57.0 -7.8 226 7 B E G X 5S+ 0 0 67 -3,-0.5 3,-1.1 1,-0.3 -1,-0.2 0.928 103.0 51.3 -59.9 -40.3 66.9 60.7 -8.5 227 8 B R G 3 5S+ 0 0 182 -4,-0.5 -1,-0.3 -3,-0.3 -2,-0.2 0.440 92.8 76.3 -79.6 -0.9 63.2 61.5 -8.4 228 9 B E G < 5S- 0 0 113 -3,-1.3 -1,-0.2 -4,-0.3 -2,-0.2 0.506 93.2-134.2 -87.1 -8.8 62.8 59.8 -5.0 229 10 B Q T < 5 - 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