==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 03-MAR-04 1UZ2 . COMPND 2 MOLECULE: BETA-LACTOGLOBULIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR I.MCNAE,D.JAYAT,T.HAERTLE,C.HOLT,L.SAWYER . 158 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8815.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 105 66.5 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 . 60 38.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 . 17 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 8 5.1 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+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 1 0 0 0 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 . 0 2 0 1 1 2 2 0 1 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 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 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 L 0 0 48 0, 0.0 2,-0.2 0, 0.0 142,-0.0 0.000 360.0 360.0 360.0 168.3 7.2 20.4 35.3 2 2 X I > - 0 0 101 1,-0.1 3,-0.9 4,-0.0 4,-0.4 -0.713 360.0-106.9-106.6 163.5 8.7 17.4 37.3 3 3 X V G > S+ 0 0 99 1,-0.3 3,-1.0 -2,-0.2 -1,-0.1 0.788 116.4 58.5 -59.0 -30.6 12.3 16.3 37.6 4 4 X T G 3 S+ 0 0 111 1,-0.2 -1,-0.3 3,-0.0 4,-0.1 0.871 97.6 62.8 -69.3 -29.6 11.8 13.2 35.4 5 5 X Q G < S+ 0 0 72 -3,-0.9 -1,-0.2 2,-0.1 -2,-0.2 0.659 96.9 72.4 -72.5 -11.2 10.7 15.5 32.6 6 6 X T S < S- 0 0 17 -3,-1.0 2,-0.3 -4,-0.4 89,-0.3 -0.523 98.2 -75.6-102.3 170.9 14.1 17.2 32.4 7 7 X M > - 0 0 28 87,-2.6 3,-0.6 73,-0.2 2,-0.4 -0.445 37.4-144.8 -75.1 128.3 17.4 16.0 31.1 8 8 X K T 3 S+ 0 0 205 -2,-0.3 -1,-0.1 1,-0.2 72,-0.0 -0.740 81.4 9.9 -81.7 128.2 19.4 13.6 33.3 9 9 X G T 3 S- 0 0 65 -2,-0.4 -1,-0.2 1,-0.2 2,-0.1 0.707 81.0-179.9 85.0 22.2 23.2 14.0 33.1 10 10 X L < - 0 0 30 -3,-0.6 2,-0.7 84,-0.1 -1,-0.2 -0.342 19.4-157.2 -64.1 128.7 23.4 17.3 31.2 11 11 X D > - 0 0 64 1,-0.1 3,-1.6 -2,-0.1 4,-0.4 -0.877 5.2-165.0 -97.7 102.1 26.8 18.8 30.4 12 12 X I G > S+ 0 0 19 -2,-0.7 3,-1.5 1,-0.3 4,-0.3 0.784 81.6 65.4 -61.9 -34.7 26.1 22.5 29.9 13 13 X Q G > S+ 0 0 90 1,-0.2 3,-1.2 2,-0.2 -1,-0.3 0.834 94.1 61.1 -57.0 -31.6 29.5 23.1 28.3 14 14 X K G < S+ 0 0 123 -3,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.597 92.3 64.5 -74.3 -10.7 28.6 20.9 25.3 15 15 X V G < S+ 0 0 1 -3,-1.5 31,-0.3 -4,-0.4 -1,-0.2 0.517 76.3 128.8 -87.3 -3.4 25.6 23.1 24.3 16 16 X A < + 0 0 48 -3,-1.2 31,-0.2 -4,-0.3 2,-0.2 -0.135 49.4 28.2 -50.4 143.5 27.9 26.1 23.5 17 17 X G E S-A 46 0A 23 29,-2.7 29,-2.2 2,-0.0 2,-0.1 -0.552 92.8 -1.5 112.7-166.9 27.6 27.8 20.1 18 18 X T E +A 45 0A 77 27,-0.2 2,-0.3 -2,-0.2 27,-0.3 -0.358 54.1 170.3 -64.4 134.0 25.1 28.6 17.3 19 19 X W - 0 0 2 25,-1.6 2,-0.4 139,-0.1 105,-0.2 -0.947 21.8-145.1-136.9 163.2 21.5 27.4 17.3 20 20 X Y E -D 123 0B 76 103,-2.3 103,-2.3 -2,-0.3 2,-0.8 -0.992 22.0-125.3-127.2 136.9 18.3 28.0 15.4 21 21 X S E +D 122 0B 0 22,-0.5 101,-0.2 137,-0.4 136,-0.1 -0.732 34.4 171.4 -77.3 107.6 14.8 28.1 16.8 22 22 X L E + 0 0 25 99,-2.5 129,-2.2 -2,-0.8 2,-0.3 0.769 60.5 0.6 -90.2 -29.2 12.9 25.5 14.6 23 23 X A E -DE 121 150B 2 98,-1.2 98,-1.7 127,-0.2 2,-0.3 -0.978 58.9-163.8-156.9 156.1 9.5 25.2 16.4 24 24 X M E -DE 120 149B 0 125,-2.3 125,-3.0 -2,-0.3 2,-0.3 -0.971 5.5-178.0-141.5 154.4 7.7 26.7 19.5 25 25 X A E -DE 119 148B 0 94,-2.0 94,-2.6 -2,-0.3 2,-0.3 -0.983 4.0-169.8-149.8 155.4 4.7 25.8 21.6 26 26 X A E -DE 118 147B 0 121,-2.1 120,-2.1 -2,-0.3 121,-1.4 -0.996 32.2-127.6-149.3 155.8 2.9 27.3 24.5 27 27 X S S S+ 0 0 6 90,-2.2 2,-0.4 -2,-0.3 91,-0.1 0.599 100.3 37.7 -75.9 -12.8 0.2 26.5 27.1 28 28 X D S > S- 0 0 50 89,-0.3 3,-1.8 1,-0.1 4,-0.3 -0.992 74.7-136.1-143.0 128.3 -1.7 29.7 26.3 29 29 X I G > S+ 0 0 87 -2,-0.4 3,-1.5 1,-0.3 4,-0.2 0.814 103.7 61.4 -49.7 -40.0 -2.2 31.4 22.9 30 30 X S G 3 S+ 0 0 79 1,-0.3 4,-0.4 2,-0.2 -1,-0.3 0.602 88.7 72.1 -68.6 -15.2 -1.5 34.8 24.3 31 31 X L G < S+ 0 0 23 -3,-1.8 8,-0.5 1,-0.2 -1,-0.3 0.722 117.9 17.1 -71.3 -21.9 2.1 33.8 25.3 32 32 X L S < S+ 0 0 2 -3,-1.5 -1,-0.2 -4,-0.3 -2,-0.2 0.098 102.0 96.8-135.2 14.3 3.2 33.8 21.6 33 33 X D S S+ 0 0 111 -3,-0.2 2,-0.3 -4,-0.2 -3,-0.1 0.962 72.3 58.6 -77.5 -60.0 0.4 35.9 19.9 34 34 X A S > S- 0 0 60 -4,-0.4 3,-3.9 1,-0.2 6,-0.2 -0.594 83.6-130.8 -75.1 126.5 1.8 39.4 19.7 35 35 X Q T 3 S+ 0 0 99 -2,-0.3 26,-0.5 1,-0.3 -1,-0.2 0.846 114.1 54.8 -44.1 -30.4 5.1 39.4 17.7 36 36 X S T 3 S+ 0 0 59 24,-0.1 -1,-0.3 3,-0.0 -2,-0.1 0.370 77.0 140.7 -84.8 7.2 6.3 41.4 20.8 37 37 X A X - 0 0 3 -3,-3.9 3,-1.3 1,-0.1 24,-0.1 -0.170 59.9-126.0 -53.3 136.0 5.2 38.7 23.3 38 38 X P T 3 S+ 0 0 109 0, 0.0 -1,-0.1 0, 0.0 -6,-0.1 0.903 108.7 42.0 -53.4 -43.7 7.9 38.5 26.0 39 39 X L T 3 S+ 0 0 15 -8,-0.5 2,-1.1 1,-0.1 -2,-0.1 0.387 88.3 98.1 -91.0 5.0 8.4 34.8 25.5 40 40 X R < + 0 0 39 -3,-1.3 21,-0.4 -6,-0.2 2,-0.3 -0.797 56.3 138.5 -85.8 93.5 8.3 34.9 21.7 41 41 X V - 0 0 7 -2,-1.1 2,-0.5 19,-0.1 19,-0.2 -0.932 49.1-135.1-135.6 152.7 12.1 35.0 21.1 42 42 X Y E - B 0 59A 16 17,-2.8 17,-2.9 -2,-0.3 2,-0.3 -0.969 23.3-133.4-110.8 124.7 14.4 33.3 18.6 43 43 X V E + B 0 58A 1 -2,-0.5 -22,-0.5 15,-0.2 15,-0.2 -0.613 30.4 167.5 -74.6 134.1 17.7 31.7 20.0 44 44 X E E + 0 0 48 13,-2.8 -25,-1.6 1,-0.4 2,-0.3 0.673 63.9 3.7-113.7 -30.5 20.9 32.6 18.1 45 45 X E E -AB 18 57A 66 12,-1.8 12,-2.9 -27,-0.3 2,-0.4 -0.991 50.8-147.9-158.2 143.0 23.6 31.4 20.5 46 46 X L E -AB 17 56A 10 -29,-2.2 -29,-2.7 -2,-0.3 10,-0.2 -0.966 15.0-175.1-109.5 135.1 24.2 29.7 23.8 47 47 X K E - B 0 55A 64 8,-3.1 8,-1.6 -2,-0.4 -34,-0.1 -0.775 6.2-165.2-134.8 78.7 27.3 30.8 25.9 48 48 X P E - B 0 54A 17 0, 0.0 6,-0.2 0, 0.0 -31,-0.0 -0.426 19.3-133.9 -59.8 145.3 27.8 28.7 29.0 49 49 X T > - 0 0 29 4,-2.1 3,-1.9 1,-0.1 -36,-0.0 -0.562 20.9-107.4-103.7 164.1 30.3 30.3 31.4 50 50 X P T 3 S+ 0 0 126 0, 0.0 -1,-0.1 0, 0.0 -37,-0.1 0.805 119.9 59.6 -60.7 -26.6 33.2 28.8 33.3 51 51 X E T 3 S- 0 0 132 2,-0.0 24,-0.1 1,-0.0 0, 0.0 0.401 121.4-104.6 -79.4 -3.6 31.1 29.1 36.5 52 52 X G S < S+ 0 0 19 -3,-1.9 2,-0.2 1,-0.3 -40,-0.1 0.500 77.5 128.6 94.2 7.5 28.3 26.9 35.1 53 53 X D - 0 0 27 21,-0.1 -4,-2.1 22,-0.1 2,-0.6 -0.472 55.8-123.6 -84.7 162.1 25.7 29.5 34.3 54 54 X L E -BC 48 73A 6 19,-3.3 19,-3.1 -6,-0.2 2,-0.4 -0.890 17.3-163.8-115.2 108.5 24.0 29.8 30.8 55 55 X E E -BC 47 72A 30 -8,-1.6 -8,-3.1 -2,-0.6 2,-0.5 -0.713 11.6-160.2 -86.6 134.3 24.1 33.0 28.8 56 56 X I E -BC 46 71A 13 15,-2.6 15,-2.2 -2,-0.4 2,-0.5 -0.979 9.3-158.7-120.6 121.7 21.5 33.1 26.0 57 57 X L E +BC 45 70A 23 -12,-2.9 -13,-2.8 -2,-0.5 -12,-1.8 -0.869 26.4 173.9-100.4 127.3 21.7 35.4 22.9 58 58 X L E -BC 43 69A 11 11,-2.4 11,-2.1 -2,-0.5 2,-0.3 -0.895 26.7-139.5-129.0 158.0 18.3 35.9 21.4 59 59 X Q E -BC 42 68A 34 -17,-2.9 -17,-2.8 -2,-0.3 2,-0.3 -0.916 23.2-179.7-115.0 147.2 16.6 37.9 18.7 60 60 X K E - C 0 67A 30 7,-2.1 7,-2.4 -2,-0.3 2,-0.2 -0.987 31.1-105.3-141.4 150.0 13.1 39.5 19.0 61 61 X W E + C 0 66A 82 -26,-0.5 2,-0.2 -21,-0.4 5,-0.2 -0.520 38.1 173.0 -70.7 145.9 10.7 41.6 16.9 62 62 X E E > - C 0 65A 77 3,-1.6 3,-2.1 -2,-0.2 2,-0.4 -0.729 64.7 -41.4-163.6 96.0 10.5 45.3 17.8 63 63 X N T 3 S- 0 0 120 1,-0.3 3,-0.1 -2,-0.2 -2,-0.1 0.069 124.9 -37.0 75.1 -22.4 8.5 47.9 15.8 64 64 X D T 3 S+ 0 0 120 -2,-0.4 -1,-0.3 1,-0.4 2,-0.1 0.031 123.3 89.1 150.6 -28.1 9.7 46.5 12.4 65 65 X E E < S-C 62 0A 94 -3,-2.1 -3,-1.6 1,-0.0 2,-0.6 -0.326 75.2-115.7-100.9 178.4 13.3 45.5 13.4 66 66 X C E -C 61 0A 66 -5,-0.2 2,-0.4 -2,-0.1 -5,-0.2 -0.922 34.0-166.2-121.1 97.5 15.2 42.6 14.8 67 67 X A E -C 60 0A 13 -7,-2.4 -7,-2.1 -2,-0.6 2,-0.3 -0.712 11.9-138.0 -90.3 135.0 16.7 43.4 18.2 68 68 X Q E -C 59 0A 128 -2,-0.4 2,-0.3 -9,-0.2 -9,-0.2 -0.686 21.2-176.4 -84.0 143.8 19.3 41.3 20.0 69 69 X K E -C 58 0A 100 -11,-2.1 -11,-2.4 -2,-0.3 2,-0.4 -0.962 13.7-152.0-134.2 150.8 19.0 40.6 23.8 70 70 X K E -C 57 0A 115 -2,-0.3 2,-0.3 -13,-0.2 -13,-0.2 -0.995 17.7-179.5-126.2 120.3 21.4 38.8 26.1 71 71 X I E -C 56 0A 40 -15,-2.2 -15,-2.6 -2,-0.4 2,-0.6 -0.913 20.8-135.2-123.7 152.7 20.0 37.1 29.2 72 72 X I E -C 55 0A 66 -2,-0.3 2,-0.6 -17,-0.2 13,-0.5 -0.924 11.1-167.3-111.9 116.7 21.7 35.1 32.0 73 73 X A E -C 54 0A 0 -19,-3.1 -19,-3.3 -2,-0.6 11,-0.3 -0.913 20.5-148.5-101.7 112.6 20.2 31.9 33.2 74 74 X E E -F 83 0B 85 9,-3.3 9,-2.7 -2,-0.6 -21,-0.1 -0.588 18.5-103.1 -91.0 146.4 22.0 31.0 36.5 75 75 X K E -F 82 0B 112 7,-0.2 2,-0.2 -2,-0.2 7,-0.2 -0.188 37.7-164.0 -55.5 151.1 22.6 27.4 37.7 76 76 X T - 0 0 50 5,-0.8 5,-0.1 2,-0.5 4,-0.1 -0.728 39.7 -91.6-126.2-174.8 20.4 26.0 40.4 77 77 X K S S+ 0 0 212 -2,-0.2 -2,-0.0 2,-0.1 0, 0.0 0.547 109.7 75.6 -76.6 -9.9 20.6 23.1 42.8 78 78 X I S > S- 0 0 79 3,-0.2 3,-1.5 0, 0.0 -2,-0.5 -0.907 89.3-122.4-108.0 124.0 18.7 21.0 40.2 79 79 X P T 3 S+ 0 0 90 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 -0.323 94.7 19.9 -65.4 149.9 20.6 19.9 37.2 80 80 X A T 3 S+ 0 0 5 -70,-0.2 14,-2.9 1,-0.1 2,-0.4 0.467 103.6 104.3 69.8 6.9 19.3 21.0 33.8 81 81 X V E < - G 0 93B 18 -3,-1.5 -5,-0.8 12,-0.2 2,-0.3 -0.983 46.4-179.5-123.0 130.9 17.3 23.9 35.5 82 82 X F E -FG 75 92B 11 10,-2.9 10,-2.6 -2,-0.4 2,-0.5 -0.912 16.6-140.7-132.7 147.7 18.4 27.5 35.3 83 83 X K E -FG 74 91B 59 -9,-2.7 -9,-3.3 -2,-0.3 2,-0.9 -0.943 5.3-151.9-119.0 126.4 16.9 30.7 36.7 84 84 X I E - G 0 90B 20 6,-3.2 6,-1.4 -2,-0.5 2,-1.3 -0.903 20.0-157.3 -89.3 105.5 16.7 34.0 35.0 85 85 X D E + G 0 89B 100 -2,-0.9 4,-0.1 -13,-0.5 2,-0.1 -0.388 41.4 136.1 -94.5 57.7 16.8 36.1 38.2 86 86 X A S S- 0 0 54 -2,-1.3 -2,-0.0 2,-0.5 4,-0.0 -0.181 77.8 -86.6 -84.0 177.2 15.2 39.1 36.7 87 87 X L S S+ 0 0 178 1,-0.2 2,-0.6 -2,-0.1 -2,-0.0 0.873 128.0 47.9 -58.3 -40.1 12.4 41.2 38.2 88 88 X N S S- 0 0 132 2,-0.0 -2,-0.5 22,-0.0 2,-0.3 -0.931 100.5-130.1 -96.2 113.9 9.9 38.8 36.6 89 89 X E E +G 85 0B 81 -2,-0.6 21,-0.5 -4,-0.1 22,-0.4 -0.527 31.5 174.2 -74.9 133.2 11.2 35.3 37.5 90 90 X N E -GH 84 109B 23 -6,-1.4 -6,-3.2 -2,-0.3 2,-0.3 -0.991 17.2-151.2-131.1 137.7 11.5 32.7 34.7 91 91 X K E -GH 83 108B 54 17,-1.4 17,-2.3 -2,-0.4 2,-0.5 -0.773 5.8-151.8 -99.2 144.7 13.0 29.2 34.8 92 92 X V E -GH 82 107B 6 -10,-2.6 -10,-2.9 -2,-0.3 2,-0.5 -0.991 13.9-167.9-116.0 126.2 14.6 27.6 31.8 93 93 X L E -GH 81 106B 12 13,-2.5 13,-2.2 -2,-0.5 2,-0.7 -0.968 15.0-144.5-122.5 121.3 14.4 23.8 31.8 94 94 X V E - H 0 105B 5 -14,-2.9 -87,-2.6 -2,-0.5 11,-0.2 -0.775 17.3-178.5 -87.5 118.2 16.5 21.6 29.4 95 95 X L E - 0 0 19 9,-2.1 2,-0.3 -2,-0.7 -87,-0.2 0.851 60.4 -27.0 -84.3 -39.8 14.3 18.6 28.5 96 96 X D E + H 0 104B 50 8,-1.2 8,-2.6 -89,-0.1 -1,-0.3 -0.947 55.8 172.5-173.4 148.5 16.8 16.8 26.2 97 97 X T E - H 0 103B 5 -2,-0.3 6,-0.2 6,-0.2 -82,-0.0 -0.942 28.7-158.1-157.4 156.3 19.7 17.2 23.8 98 98 X D - 0 0 37 4,-1.5 2,-2.1 -2,-0.3 5,-0.1 0.170 43.4-134.9-111.7 11.1 22.2 15.2 21.9 99 99 X Y S S+ 0 0 50 3,-0.6 4,-0.0 1,-0.2 -3,-0.0 -0.109 91.7 61.6 67.2 -36.5 24.5 18.2 21.8 100 100 X K S S+ 0 0 149 -2,-2.1 -1,-0.2 2,-0.1 3,-0.1 0.517 120.7 5.7-102.0 -11.9 25.4 17.9 18.1 101 101 X K S S+ 0 0 36 1,-0.4 23,-2.1 23,-0.1 24,-0.3 0.590 118.2 22.8-134.8 -54.6 22.0 18.3 16.4 102 102 X Y E - I 0 123B 6 21,-0.2 -4,-1.5 22,-0.1 -3,-0.6 -0.912 41.6-174.8-130.1 156.7 19.0 19.2 18.7 103 103 X L E -HI 97 122B 6 19,-1.8 19,-3.0 -2,-0.3 2,-0.4 -0.955 10.1-160.2-151.7 129.2 18.1 20.7 22.0 104 104 X L E +HI 96 121B 2 -8,-2.6 -9,-2.1 -2,-0.3 -8,-1.2 -0.923 22.2 161.1-105.5 128.7 14.6 21.0 23.6 105 105 X F E -HI 94 120B 16 15,-2.1 15,-2.9 -2,-0.4 2,-0.4 -0.972 23.7-149.0-144.1 164.0 13.8 23.5 26.3 106 106 X a E -HI 93 119B 0 -13,-2.2 -13,-2.5 -2,-0.3 2,-0.5 -0.972 7.0-148.8-124.9 151.2 11.0 25.3 28.1 107 107 X M E -HI 92 118B 12 11,-3.8 11,-2.5 -2,-0.4 2,-0.4 -0.968 20.8-163.1-109.1 128.3 10.6 28.7 29.8 108 108 X E E -HI 91 117B 40 -17,-2.3 -17,-1.4 -2,-0.5 2,-1.1 -0.909 20.7-138.3-115.3 143.3 8.2 28.7 32.7 109 109 X N E -H 90 0B 38 7,-2.3 3,-0.4 -2,-0.4 7,-0.2 -0.847 27.7-172.6 -98.0 91.9 6.6 31.8 34.3 110 110 X S S S+ 0 0 33 -2,-1.1 -1,-0.2 -21,-0.5 -20,-0.1 0.915 70.8 55.3 -60.2 -51.4 7.0 30.6 37.8 111 111 X A S S+ 0 0 82 -22,-0.4 -1,-0.2 -3,-0.1 -21,-0.1 0.824 86.6 96.2 -50.7 -40.9 5.1 33.3 39.7 112 112 X E - 0 0 118 -3,-0.4 4,-0.2 1,-0.1 -3,-0.0 -0.143 69.3-140.3 -58.5 144.2 1.7 32.9 37.8 113 113 X P S S+ 0 0 127 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.959 86.0 70.6 -66.8 -56.0 -1.1 30.6 39.2 114 114 X E S S- 0 0 122 1,-0.1 2,-0.4 2,-0.0 0, 0.0 -0.232 106.1 -96.4 -46.1 146.1 -2.1 29.1 35.7 115 115 X Q - 0 0 76 -88,-0.1 2,-0.4 -7,-0.0 -1,-0.1 -0.665 49.2-171.0 -66.0 127.8 0.6 26.7 34.3 116 116 X S + 0 0 12 -2,-0.4 -7,-2.3 -7,-0.2 2,-0.4 -0.937 14.7 157.5-136.0 100.9 2.5 29.1 32.0 117 117 X L E - I 0 108B 0 -2,-0.4 -90,-2.2 -9,-0.2 2,-0.4 -0.993 24.6-174.0-135.6 133.6 5.0 27.4 29.6 118 118 X V E -DI 26 107B 0 -11,-2.5 -11,-3.8 -2,-0.4 2,-0.3 -0.998 18.5-174.8-124.6 129.0 6.7 28.2 26.4 119 119 X a E -DI 25 106B 0 -94,-2.6 -94,-2.0 -2,-0.4 2,-0.3 -0.862 3.3-164.8-124.6 150.5 8.9 25.4 24.9 120 120 X Q E -DI 24 105B 0 -15,-2.9 -15,-2.1 -2,-0.3 2,-0.5 -0.975 19.5-141.8-131.8 156.1 11.2 25.3 21.8 121 121 X S E -DI 23 104B 0 -98,-1.7 -99,-2.5 -2,-0.3 -98,-1.2 -0.979 27.8-167.1-105.3 121.6 13.0 22.9 19.5 122 122 X L E -DI 21 103B 0 -19,-3.0 -19,-1.8 -2,-0.5 2,-0.3 -0.829 3.4-163.4-107.8 144.9 16.5 24.2 18.6 123 123 X V E -DI 20 102B 12 -103,-2.3 -103,-2.3 -2,-0.3 -21,-0.2 -0.954 23.1-136.1-126.1 153.6 18.7 22.8 15.8 124 124 X R S S+ 0 0 55 -23,-2.1 -1,-0.1 -2,-0.3 -22,-0.1 0.850 90.1 10.2 -73.9 -35.2 22.5 23.3 15.1 125 125 X T S S- 0 0 70 -24,-0.3 -1,-0.2 2,-0.1 -105,-0.1 -0.966 78.0-109.8-139.8 158.0 22.0 23.9 11.4 126 126 X P + 0 0 78 0, 0.0 3,-0.1 0, 0.0 30,-0.1 0.316 66.1 145.3 -71.5 14.7 19.1 24.4 9.0 127 127 X E - 0 0 108 1,-0.1 2,-0.7 0, 0.0 -2,-0.1 -0.029 61.5-103.2 -51.2 151.0 19.6 20.9 7.5 128 128 X V S S+ 0 0 150 2,-0.0 2,-0.2 0, 0.0 -1,-0.1 -0.750 76.1 117.0 -72.9 111.8 16.7 18.8 6.3 129 129 X D - 0 0 60 -2,-0.7 3,-0.2 -3,-0.1 4,-0.2 -0.722 48.6-155.7-173.9 128.9 16.3 16.2 9.1 130 130 X D > + 0 0 95 -2,-0.2 4,-2.5 1,-0.1 5,-0.2 0.274 65.2 104.3-104.6 18.5 13.1 15.9 11.3 131 131 X E H > S+ 0 0 57 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.883 80.7 55.5 -60.6 -40.3 14.5 14.3 14.5 132 132 X A H > S+ 0 0 2 -3,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.872 111.9 42.8 -57.3 -42.8 14.4 17.6 16.3 133 133 X L H > S+ 0 0 48 2,-0.2 4,-2.1 -3,-0.2 -2,-0.2 0.863 113.0 50.4 -77.8 -33.3 10.7 17.9 15.5 134 134 X E H X S+ 0 0 116 -4,-2.5 4,-2.2 2,-0.2 5,-0.2 0.921 112.4 47.9 -66.7 -46.7 9.8 14.3 16.3 135 135 X K H X S+ 0 0 79 -4,-2.4 4,-2.1 -5,-0.2 -2,-0.2 0.895 112.2 50.5 -61.5 -39.2 11.6 14.5 19.7 136 136 X F H X S+ 0 0 3 -4,-1.5 4,-2.5 -5,-0.2 -2,-0.2 0.937 110.5 47.9 -68.2 -42.8 9.8 17.9 20.4 137 137 X D H < S+ 0 0 75 -4,-2.1 4,-0.4 1,-0.2 -2,-0.2 0.890 112.0 50.1 -69.8 -35.6 6.3 16.5 19.6 138 138 X K H >< S+ 0 0 143 -4,-2.2 3,-0.9 2,-0.2 4,-0.5 0.895 111.5 48.2 -61.7 -48.4 6.9 13.4 21.8 139 139 X A H >< S+ 0 0 31 -4,-2.1 3,-0.8 1,-0.2 -2,-0.2 0.919 109.7 52.9 -62.4 -36.2 8.1 15.6 24.6 140 140 X L G >< S+ 0 0 2 -4,-2.5 3,-1.0 1,-0.2 5,-0.3 0.526 86.9 82.8 -78.3 -7.2 5.0 17.9 24.3 141 141 X K G < S+ 0 0 148 -3,-0.9 -1,-0.2 -4,-0.4 -2,-0.1 0.864 89.9 52.7 -66.5 -33.5 2.4 14.9 24.4 142 142 X A G < S+ 0 0 76 -3,-0.8 -1,-0.3 -4,-0.5 -2,-0.2 0.599 104.6 71.6 -71.9 -13.4 2.7 15.0 28.2 143 143 X L S < S- 0 0 21 -3,-1.0 2,-1.3 -4,-0.2 -3,-0.0 -0.773 83.2-120.2-114.7 146.0 1.9 18.8 28.3 144 144 X P + 0 0 68 0, 0.0 2,-0.4 0, 0.0 -3,-0.1 -0.659 42.4 174.4 -82.3 95.5 -1.3 20.8 27.7 145 145 X M - 0 0 23 -2,-1.3 -118,-0.3 -5,-0.3 3,-0.1 -0.894 19.6-175.8-102.8 134.5 -0.2 23.1 24.8 146 146 X H S S+ 0 0 131 -120,-2.1 2,-0.4 -2,-0.4 -119,-0.2 0.430 71.3 39.6-103.2 -3.9 -2.7 25.4 23.0 147 147 X I E -E 26 0B 40 -121,-1.4 -121,-2.1 -119,-0.1 2,-0.4 -0.982 59.8-176.5-145.9 142.0 -0.5 26.8 20.3 148 148 X R E -E 25 0B 123 -2,-0.4 2,-0.3 -123,-0.2 -123,-0.2 -0.995 6.0-178.1-141.3 123.6 2.1 25.1 18.1 149 149 X L E -E 24 0B 40 -125,-3.0 -125,-2.3 -2,-0.4 2,-0.3 -0.961 7.7-170.0-127.7 147.5 4.3 26.9 15.5 150 150 X S E -E 23 0B 89 -2,-0.3 2,-0.4 -127,-0.2 -127,-0.2 -0.999 26.7-119.5-137.6 137.1 7.1 25.6 13.0 151 151 X F - 0 0 40 -129,-2.2 6,-0.2 -2,-0.3 4,-0.1 -0.602 23.8-142.7 -92.9 126.3 9.4 27.9 10.9 152 152 X N > - 0 0 104 -2,-0.4 4,-0.7 4,-0.3 -1,-0.1 -0.184 37.6 -79.4 -82.3 172.1 9.3 27.6 7.1 153 153 X P T 4 S+ 0 0 112 0, 0.0 2,-0.7 0, 0.0 4,-0.1 0.758 92.0 100.1 -44.0 -50.1 12.3 27.9 4.8 154 154 X T T 4 S- 0 0 83 1,-0.3 -2,-0.2 2,-0.2 0, 0.0 -0.787 120.8 -37.2 -96.3 110.1 13.0 31.7 4.5 155 155 X Q T 4 S- 0 0 158 -2,-0.7 3,-0.3 -4,-0.1 -1,-0.3 -0.696 81.4-118.1-134.4 52.9 15.2 32.1 6.4 156 156 X L < - 0 0 16 -4,-0.7 -4,-0.3 1,-0.2 -2,-0.2 -0.797 50.6 -95.7 -80.0 -53.9 13.9 30.0 8.2 157 157 X E 0 0 94 -2,-0.2 -1,-0.2 -6,-0.2 -136,-0.1 0.159 360.0 360.0-175.5 91.3 13.6 32.4 10.7 158 158 X E 0 0 45 -3,-0.3 -137,-0.4 -138,-0.1 -136,-0.1 0.244 360.0 360.0 70.1 360.0 16.3 32.6 13.3