==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 15-JAN-02 1KT3 . COMPND 2 MOLECULE: PLASMA RETINOL-BINDING PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR V.CALDERONE,R.BERNI,G.ZANOTTI . 175 1 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10543.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 109 62.3 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 . 66 37.7 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 . 4 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 . 12 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 13 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 . 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 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 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 1 1 3 1 1 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 . 1 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 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 E 0 0 227 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -28.7 3.0 33.3 58.0 2 2 A R - 0 0 133 1,-0.0 2,-0.8 2,-0.0 156,-0.0 -0.538 360.0-126.5 -77.4 145.4 6.0 32.3 56.0 3 3 A D + 0 0 75 -2,-0.2 157,-0.0 1,-0.1 -1,-0.0 -0.840 31.4 171.2 -92.4 109.6 6.3 28.7 54.9 4 4 A a + 0 0 46 -2,-0.8 125,-0.4 156,-0.0 2,-0.3 0.252 34.4 127.8-101.2 12.5 9.7 27.3 56.0 5 5 A R > - 0 0 129 123,-0.2 3,-2.0 1,-0.1 4,-0.4 -0.581 60.9-137.4 -64.7 123.5 8.8 23.6 55.1 6 6 A V G > S+ 0 0 14 121,-1.9 3,-1.1 -2,-0.3 -1,-0.1 0.809 100.7 61.3 -57.6 -36.2 11.7 22.2 52.8 7 7 A S G 3 S+ 0 0 107 120,-0.4 -1,-0.3 1,-0.2 121,-0.1 0.629 99.6 55.8 -68.1 -14.2 9.1 20.5 50.5 8 8 A S G < S+ 0 0 42 -3,-2.0 -1,-0.2 2,-0.1 2,-0.2 0.577 79.2 117.2 -91.6 -11.7 7.5 23.9 49.6 9 9 A F < - 0 0 13 -3,-1.1 2,-0.2 -4,-0.4 150,-0.1 -0.369 61.9-131.6 -64.0 124.2 10.8 25.7 48.3 10 10 A R - 0 0 194 -2,-0.2 2,-0.2 148,-0.0 -1,-0.1 -0.516 25.0-165.8 -72.8 144.0 10.8 26.7 44.6 11 11 A V - 0 0 30 -2,-0.2 2,-0.2 1,-0.0 96,-0.2 -0.695 37.6 -58.9-122.4 173.3 13.9 25.7 42.5 12 12 A K > - 0 0 54 94,-2.1 3,-0.9 -2,-0.2 2,-0.2 -0.383 56.0-124.5 -59.4 119.8 15.3 26.8 39.0 13 13 A E T 3 S- 0 0 150 1,-0.2 -1,-0.1 -2,-0.2 -3,-0.0 -0.402 84.1 -5.1 -66.0 134.5 12.8 26.1 36.1 14 14 A N T 3 S- 0 0 132 -2,-0.2 -1,-0.2 1,-0.1 -2,-0.0 0.876 88.2-150.9 50.1 46.0 14.0 23.9 33.2 15 15 A F < - 0 0 18 -3,-0.9 2,-0.5 1,-0.1 -1,-0.1 -0.199 4.8-149.8 -49.6 137.9 17.6 23.6 34.6 16 16 A D > - 0 0 77 1,-0.1 4,-1.2 68,-0.0 3,-0.3 -0.910 11.2-170.9-117.7 101.1 20.4 23.2 31.9 17 17 A K H >> S+ 0 0 56 -2,-0.5 4,-0.7 1,-0.2 3,-0.6 0.898 85.2 53.4 -58.0 -45.7 23.6 21.2 32.9 18 18 A A H >4 S+ 0 0 69 1,-0.3 3,-0.9 2,-0.2 -1,-0.2 0.903 107.2 51.7 -64.6 -37.0 25.7 21.9 29.9 19 19 A R H 34 S+ 0 0 121 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.2 0.747 103.7 59.0 -68.0 -27.3 25.2 25.7 30.2 20 20 A F H << S+ 0 0 2 -4,-1.2 -1,-0.2 -3,-0.6 25,-0.2 0.581 82.6 114.2 -77.6 -12.8 26.4 25.6 34.0 21 21 A A << + 0 0 36 -3,-0.9 2,-0.2 -4,-0.7 25,-0.2 -0.130 50.1 47.4 -58.2 157.1 29.8 24.1 33.1 22 22 A G E S-A 45 0A 22 23,-2.1 23,-2.1 2,-0.0 2,-0.3 -0.696 92.7 -11.5 112.2-160.5 33.1 26.0 33.7 23 23 A T E -A 44 0A 52 -2,-0.2 2,-0.4 21,-0.2 21,-0.2 -0.623 49.5-179.0 -88.7 132.6 34.8 28.1 36.5 24 24 A W E -A 43 0A 0 19,-2.4 19,-2.1 -2,-0.3 2,-0.4 -0.989 11.9-155.9-130.4 122.0 32.9 29.3 39.6 25 25 A Y E -AB 42 138A 76 113,-2.7 113,-2.2 -2,-0.4 2,-0.4 -0.814 19.1-130.2 -98.0 128.4 34.5 31.4 42.5 26 26 A A E + B 0 137A 0 15,-1.7 15,-0.2 -2,-0.4 111,-0.2 -0.666 31.5 169.1 -82.0 131.2 32.9 31.2 46.0 27 27 A M E + 0 0 45 109,-2.5 141,-1.8 -2,-0.4 2,-0.3 0.667 62.4 9.5-115.3 -23.5 32.2 34.7 47.5 28 28 A A E -CB 167 136A 11 108,-1.0 108,-2.1 139,-0.3 -1,-0.4 -0.974 63.3-171.3-153.0 153.3 29.9 34.0 50.6 29 29 A K E -CB 166 135A 5 137,-1.7 137,-2.0 -2,-0.3 2,-0.4 -0.996 23.4-142.7-148.5 151.7 28.7 30.9 52.6 30 30 A K E - B 0 134A 31 104,-2.3 104,-1.6 -2,-0.3 135,-0.1 -0.983 37.0-136.8-106.5 123.5 26.4 29.7 55.4 31 31 A D - 0 0 55 -2,-0.4 101,-0.2 133,-0.3 2,-0.1 -0.454 10.2-150.1 -86.1 151.1 28.2 26.9 57.5 32 32 A P - 0 0 18 0, 0.0 2,-0.2 0, 0.0 101,-0.1 -0.327 45.1 -66.9 -95.0-170.8 26.8 23.5 58.8 33 33 A E S S+ 0 0 133 -2,-0.1 2,-0.0 2,-0.0 98,-0.0 -0.543 96.4 5.7 -75.1 147.9 27.9 21.7 62.0 34 34 A G S S+ 0 0 72 -2,-0.2 2,-0.0 -3,-0.1 0, 0.0 -0.222 107.4 0.4 84.2-168.0 31.6 20.3 62.0 35 35 A L + 0 0 74 -2,-0.0 2,-0.3 26,-0.0 28,-0.1 -0.331 68.3 157.9 -61.7 139.2 34.7 20.4 59.7 36 36 A F - 0 0 27 26,-0.2 26,-0.3 -5,-0.0 -2,-0.0 -0.986 48.3 -78.0-156.7 157.3 34.1 22.5 56.5 37 37 A L - 0 0 37 -2,-0.3 24,-0.2 1,-0.1 23,-0.1 -0.366 39.6-162.7 -60.2 142.6 36.3 24.4 53.9 38 38 A Q - 0 0 86 22,-2.0 2,-0.2 1,-0.3 23,-0.2 0.954 46.6 -38.4 -98.0 -54.1 37.4 27.8 55.2 39 39 A D E S+ D 0 60A 22 21,-1.0 21,-2.3 129,-0.1 -1,-0.3 -0.916 98.6 63.8-164.9-177.2 38.6 30.1 52.3 40 40 A N E S+ 0 0 13 129,-2.2 2,-0.5 -2,-0.2 130,-0.1 0.882 71.5 172.5 51.2 44.5 40.5 30.6 48.9 41 41 A I E + 0 0 6 128,-0.3 -15,-1.7 -15,-0.2 2,-0.3 -0.740 14.2 168.6 -93.9 121.0 37.7 28.3 47.4 42 42 A V E -AD 25 58A 39 16,-1.6 16,-2.2 -2,-0.5 2,-0.3 -0.997 12.8-161.8-130.9 136.3 37.4 27.6 43.5 43 43 A A E -AD 24 57A 9 -19,-2.1 -19,-2.4 -2,-0.3 2,-0.4 -0.909 6.8-160.7-117.6 143.1 35.2 25.0 41.7 44 44 A E E -AD 23 56A 75 12,-2.1 12,-1.8 -2,-0.3 2,-0.3 -0.961 12.7-161.6-127.7 108.4 35.4 23.6 38.2 45 45 A F E -AD 22 55A 11 -23,-2.1 -23,-2.1 -2,-0.4 2,-0.3 -0.674 10.4-177.9 -92.4 140.0 32.2 21.9 36.8 46 46 A S E - D 0 54A 63 8,-2.7 8,-2.1 -2,-0.3 2,-0.4 -0.973 15.1-158.5-135.0 152.0 32.2 19.4 33.7 47 47 A V E - D 0 53A 49 -2,-0.3 6,-0.2 6,-0.2 2,-0.0 -0.994 16.1-144.6-128.7 131.4 29.6 17.4 31.6 48 48 A D > - 0 0 89 4,-1.9 3,-1.6 -2,-0.4 -30,-0.0 -0.291 35.6 -90.4 -89.2 177.3 30.5 14.3 29.5 49 49 A E T 3 S+ 0 0 199 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.790 123.8 50.5 -55.0 -28.7 29.0 13.1 26.1 50 50 A N T 3 S- 0 0 160 2,-0.1 -1,-0.2 1,-0.0 -2,-0.0 0.332 122.8 -98.2-100.8 12.2 26.2 11.0 27.8 51 51 A G S < S+ 0 0 24 -3,-1.6 2,-0.5 1,-0.2 -2,-0.1 0.552 71.4 145.6 95.4 4.9 25.0 13.8 30.1 52 52 A H - 0 0 68 26,-0.0 -4,-1.9 -35,-0.0 2,-0.3 -0.665 36.0-148.3 -79.2 121.3 26.8 12.9 33.4 53 53 A M E +D 47 0A 3 -2,-0.5 24,-2.0 24,-0.4 2,-0.2 -0.715 25.0 161.3 -87.7 137.5 27.8 16.1 35.5 54 54 A S E -DE 46 76A 46 -8,-2.1 -8,-2.7 -2,-0.3 2,-0.3 -0.876 14.3-160.9-141.1 171.5 31.0 16.1 37.8 55 55 A A E -DE 45 75A 15 20,-2.1 20,-2.5 -2,-0.2 2,-0.3 -0.992 13.6-149.4-153.7 154.1 33.3 18.7 39.6 56 56 A T E -DE 44 74A 59 -12,-1.8 -12,-2.1 -2,-0.3 2,-0.3 -0.843 21.4-172.6-109.4 160.7 36.8 19.3 41.2 57 57 A A E -DE 43 73A 24 16,-1.9 16,-3.1 -2,-0.3 2,-0.3 -0.974 9.4-166.3-154.7 143.2 37.4 21.9 44.1 58 58 A K E +DE 42 72A 76 -16,-2.2 -16,-1.6 -2,-0.3 2,-0.2 -0.910 22.6 136.9-126.0 147.7 40.3 23.4 46.0 59 59 A G E - E 0 71A 0 12,-1.5 12,-2.3 -2,-0.3 2,-0.2 -0.913 50.0 -90.9-178.8 157.7 40.5 25.5 49.2 60 60 A R E +DE 39 70A 50 -21,-2.3 -22,-2.0 -2,-0.2 -21,-1.0 -0.595 43.8 176.5 -81.6 148.5 42.4 25.9 52.5 61 61 A V E - E 0 69A 14 8,-1.9 8,-1.9 -2,-0.2 2,-0.6 -0.994 28.4-130.4-150.4 146.7 41.2 24.0 55.6 62 62 A R E - E 0 68A 121 -26,-0.3 6,-0.2 -2,-0.3 -26,-0.2 -0.885 30.2-148.2 -99.8 113.9 42.3 23.5 59.2 63 63 A L > - 0 0 27 4,-1.8 3,-2.9 -2,-0.6 34,-0.0 -0.102 37.5 -82.0 -75.8 176.8 42.4 19.8 60.3 64 64 A L T 3 S+ 0 0 146 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.721 134.1 47.2 -47.4 -28.2 41.8 18.2 63.7 65 65 A N T 3 S- 0 0 83 2,-0.1 -1,-0.3 0, 0.0 3,-0.1 0.024 116.6-113.5-108.1 22.5 45.4 19.2 64.6 66 66 A N < + 0 0 99 -3,-2.9 -2,-0.1 1,-0.2 -5,-0.0 0.319 63.7 153.0 62.0 -6.2 45.1 22.8 63.3 67 67 A W - 0 0 158 -5,-0.1 -4,-1.8 1,-0.1 2,-0.7 -0.229 44.3-128.8 -45.0 140.1 47.6 22.1 60.5 68 68 A D E +E 62 0A 70 -6,-0.2 2,-0.3 -3,-0.1 -6,-0.2 -0.890 39.8 163.6-104.4 105.0 46.9 24.4 57.6 69 69 A V E -E 61 0A 33 -8,-1.9 -8,-1.9 -2,-0.7 2,-0.7 -0.841 42.5-119.6-124.4 157.7 46.7 22.6 54.2 70 70 A b E -E 60 0A 42 -2,-0.3 2,-0.3 -10,-0.2 -10,-0.2 -0.869 35.9-150.3 -91.1 114.0 45.4 23.1 50.7 71 71 A A E -E 59 0A 2 -12,-2.3 -12,-1.5 -2,-0.7 2,-0.5 -0.716 8.0-157.6 -85.7 135.6 42.7 20.4 50.1 72 72 A D E -E 58 0A 65 -2,-0.3 21,-2.3 -14,-0.2 22,-0.3 -0.954 23.0-174.6-111.3 105.8 42.1 19.0 46.5 73 73 A M E -EF 57 92A 32 -16,-3.1 -16,-1.9 -2,-0.5 2,-0.3 -0.614 15.4-158.9-106.7 158.7 38.5 17.5 46.3 74 74 A V E -EF 56 91A 47 17,-2.5 17,-1.8 -18,-0.2 2,-0.3 -0.998 10.2-176.4-135.5 137.6 36.4 15.5 43.7 75 75 A G E -EF 55 90A 8 -20,-2.5 -20,-2.1 -2,-0.3 2,-0.4 -0.988 11.8-159.8-135.7 146.0 32.5 15.1 43.3 76 76 A T E -EF 54 89A 40 13,-2.1 13,-2.0 -2,-0.3 2,-0.4 -0.993 14.8-145.4-122.6 140.3 30.0 13.1 41.1 77 77 A F E - F 0 88A 4 -24,-2.0 2,-0.5 -2,-0.4 -24,-0.4 -0.871 3.9-157.7-112.0 127.7 26.2 14.0 40.6 78 78 A T E - F 0 87A 90 9,-2.3 9,-1.7 -2,-0.4 -26,-0.0 -0.901 24.0-124.4-101.0 123.5 23.2 11.6 40.1 79 79 A D E - F 0 86A 80 -2,-0.5 2,-0.2 7,-0.2 7,-0.2 -0.297 27.2-170.4 -65.5 151.7 19.9 13.0 38.4 80 80 A T - 0 0 70 5,-0.7 5,-0.1 2,-0.5 -1,-0.1 -0.642 44.8 -78.4-127.8-175.2 16.3 12.8 40.0 81 81 A E S S+ 0 0 193 -2,-0.2 -2,-0.0 1,-0.1 3,-0.0 0.583 119.5 60.6 -70.6 -7.7 12.6 13.4 39.0 82 82 A D S > S- 0 0 44 3,-0.3 3,-1.9 1,-0.1 -2,-0.5 -0.989 83.7-143.1-110.9 118.2 13.1 17.3 39.4 83 83 A P T 3 S+ 0 0 80 0, 0.0 -2,-0.1 0, 0.0 -1,-0.1 0.681 98.2 51.2 -61.5 -14.1 15.9 18.5 36.9 84 84 A A T 3 S+ 0 0 0 -72,-0.1 22,-2.0 -5,-0.0 2,-0.4 0.389 96.4 79.8 -97.5 0.4 17.4 21.0 39.5 85 85 A K E < + G 0 105A 47 -3,-1.9 -5,-0.7 20,-0.2 -3,-0.3 -0.952 58.6 169.4-115.4 123.3 17.7 18.5 42.4 86 86 A F E -FG 79 104A 4 18,-2.0 18,-2.0 -2,-0.4 2,-0.5 -0.863 35.0-125.8-126.8 160.8 20.8 16.0 42.5 87 87 A K E -FG 78 103A 101 -9,-1.7 -9,-2.3 -2,-0.3 2,-0.5 -0.977 30.0-157.4-101.5 123.7 22.6 13.5 44.9 88 88 A M E -FG 77 102A 29 14,-2.6 14,-1.9 -2,-0.5 2,-0.4 -0.891 9.5-166.9-105.1 115.9 26.4 14.3 45.3 89 89 A K E -FG 76 101A 120 -13,-2.0 -13,-2.1 -2,-0.5 2,-0.3 -0.847 22.8-176.7 -90.7 131.5 29.1 11.6 46.3 90 90 A Y E +FG 75 100A 30 10,-2.2 10,-1.7 -2,-0.4 2,-0.2 -0.950 17.1 154.1-138.4 155.3 32.5 13.3 47.3 91 91 A W E -F 74 0A 103 -17,-1.8 -17,-2.5 -2,-0.3 2,-0.3 -0.956 30.1-108.0-159.5 172.3 36.2 12.6 48.4 92 92 A G E -F 73 0A 13 5,-0.3 -19,-0.2 -2,-0.2 5,-0.0 -0.769 19.9-123.1-113.7 164.0 39.9 14.0 48.4 93 93 A V S S+ 0 0 119 -21,-2.3 2,-0.3 -2,-0.3 -20,-0.1 0.902 102.6 61.6 -64.0 -40.9 43.3 13.3 46.7 94 94 A A S > S- 0 0 34 -22,-0.3 3,-1.3 1,-0.1 -2,-0.2 -0.672 87.6-132.7 -86.8 141.8 44.9 12.8 50.1 95 95 A S T 3 S+ 0 0 125 -2,-0.3 -1,-0.1 1,-0.3 -3,-0.1 0.675 99.5 64.4 -75.1 -16.6 43.5 9.9 52.2 96 96 A F T 3 S+ 0 0 134 2,-0.0 -1,-0.3 0, 0.0 2,-0.1 0.560 82.2 97.8 -83.7 -2.8 43.2 11.9 55.4 97 97 A L S < S- 0 0 22 -3,-1.3 -5,-0.3 1,-0.1 -34,-0.0 -0.483 83.6 -88.0 -82.2 154.9 40.5 14.3 54.0 98 98 A Q - 0 0 92 -2,-0.1 2,-0.3 -7,-0.1 -1,-0.1 -0.223 38.1-164.0 -63.7 149.3 36.6 13.8 54.6 99 99 A K + 0 0 158 -8,-0.1 2,-0.3 2,-0.0 -8,-0.2 -0.939 24.5 114.3-129.1 151.6 34.3 11.7 52.4 100 100 A G E -G 90 0A 20 -10,-1.7 -10,-2.2 -2,-0.3 2,-0.3 -0.977 51.7 -88.8 177.5-164.1 30.4 11.5 52.1 101 101 A N E +G 89 0A 118 -2,-0.3 2,-0.3 -12,-0.2 -12,-0.2 -0.891 38.4 172.5-143.9 106.6 26.9 11.9 50.3 102 102 A D E -G 88 0A 15 -14,-1.9 -14,-2.6 -2,-0.3 19,-0.1 -0.894 36.8-109.2-119.4 144.1 24.8 15.2 50.3 103 103 A D E -G 87 0A 52 -2,-0.3 2,-0.3 17,-0.3 -16,-0.2 -0.386 34.2-161.6 -55.9 145.0 21.6 16.6 48.6 104 104 A H E -G 86 0A 12 -18,-2.0 -18,-2.0 15,-0.1 2,-0.4 -0.891 10.4-178.5-139.1 104.2 22.7 19.4 46.0 105 105 A W E -GH 85 118A 27 13,-2.4 13,-1.8 -2,-0.3 2,-0.8 -0.910 24.5-144.9-111.7 133.9 19.9 21.9 44.8 106 106 A I E + H 0 117A 2 -22,-2.0 -94,-2.1 -2,-0.4 11,-0.2 -0.856 19.8 179.4 -93.0 99.4 20.2 24.8 42.3 107 107 A I E - 0 0 6 9,-1.6 2,-0.3 -2,-0.8 -1,-0.2 0.902 65.4 -23.7 -71.5 -40.7 17.7 27.4 43.9 108 108 A D E + H 0 116A 25 8,-1.2 8,-2.2 -96,-0.1 -1,-0.3 -0.966 63.6 164.2-164.1 155.1 18.4 30.0 41.1 109 109 A T E - H 0 115A 2 -2,-0.3 6,-0.2 6,-0.2 -89,-0.0 -0.954 30.5-154.3-164.3 154.3 21.1 31.0 38.4 110 110 A D - 0 0 52 4,-1.6 2,-1.1 -2,-0.3 5,-0.1 0.252 41.7-132.4-112.2 9.6 21.5 33.2 35.2 111 111 A Y S S+ 0 0 22 3,-0.6 4,-0.1 1,-0.2 0, 0.0 0.049 94.7 53.8 67.7 -27.4 24.4 31.0 34.0 112 112 A E S S+ 0 0 137 -2,-1.1 -1,-0.2 2,-0.1 3,-0.1 0.697 120.3 14.3-117.3 -12.9 26.6 34.0 33.1 113 113 A T S S+ 0 0 56 1,-0.3 26,-1.5 26,-0.1 27,-0.4 0.708 116.3 5.6-120.6 -54.2 26.8 36.1 36.4 114 114 A F E - I 0 138A 10 24,-0.2 -4,-1.6 25,-0.1 -3,-0.6 -0.896 43.3-168.5-137.8 160.0 25.6 34.3 39.6 115 115 A A E -HI 109 137A 2 22,-1.4 22,-2.3 -2,-0.3 2,-0.4 -0.958 10.5-153.0-146.9 146.4 24.3 31.1 41.2 116 116 A V E -HI 108 136A 0 -8,-2.2 -9,-1.6 -2,-0.3 -8,-1.2 -0.998 18.7-171.4-116.7 118.0 22.7 30.2 44.6 117 117 A Q E -H 106 0A 6 18,-2.2 18,-0.5 -2,-0.4 2,-0.3 -0.777 2.1-172.5-109.0 153.6 23.2 26.5 45.9 118 118 A Y E -H 105 0A 6 -13,-1.8 -13,-2.4 -2,-0.3 2,-0.3 -0.999 10.6-176.8-148.4 143.6 21.5 24.7 49.0 119 119 A S E -J 133 0B 0 14,-2.0 14,-1.9 -2,-0.3 2,-0.6 -0.957 10.3-160.7-136.1 123.4 21.8 21.4 51.0 120 120 A c E -J 132 0B 17 -2,-0.3 -17,-0.3 12,-0.2 12,-0.2 -0.956 8.0-178.2-101.6 114.4 19.6 20.1 53.9 121 121 A R E S+ 0 0 75 10,-2.5 2,-0.3 -2,-0.6 11,-0.2 0.590 70.4 20.1 -83.2 -19.3 21.6 17.3 55.8 122 122 A L E -J 131 0B 105 9,-0.8 8,-3.3 2,-0.0 9,-0.8 -0.928 68.3-140.7-158.2 129.0 18.7 16.7 58.4 123 123 A L E -J 129 0B 112 -2,-0.3 6,-0.2 6,-0.2 2,-0.1 -0.694 16.1-133.6 -92.7 141.9 14.8 17.3 58.7 124 124 A N > - 0 0 80 4,-2.7 3,-1.6 -2,-0.3 6,-0.0 -0.410 33.0-104.9 -78.6 163.1 12.8 18.4 61.8 125 125 A L T 3 S+ 0 0 192 1,-0.3 -1,-0.1 -2,-0.1 -2,-0.0 0.804 120.6 54.4 -62.6 -29.3 9.5 16.6 62.7 126 126 A D T 3 S- 0 0 94 2,-0.0 -1,-0.3 1,-0.0 -121,-0.0 0.390 123.2-102.3 -88.6 3.5 7.4 19.5 61.5 127 127 A G S < S+ 0 0 26 -3,-1.6 -121,-1.9 1,-0.3 -120,-0.4 0.332 84.1 117.5 93.4 -9.7 9.1 19.5 58.0 128 128 A T S S- 0 0 35 -123,-0.3 -4,-2.7 -122,-0.1 2,-0.4 -0.307 72.3 -89.1 -77.5 174.5 11.6 22.5 58.4 129 129 A c E -J 123 0B 32 -125,-0.4 -6,-0.2 -6,-0.2 3,-0.2 -0.741 30.3-174.5 -91.9 133.9 15.5 21.9 58.2 130 130 A A E S+ 0 0 46 -8,-3.3 2,-0.3 -2,-0.4 -7,-0.2 0.649 78.8 22.0 -94.6 -21.0 17.7 21.1 61.3 131 131 A D E S+J 122 0B 25 -9,-0.8 -10,-2.5 -99,-0.0 -9,-0.8 -0.831 77.2 161.3-150.9 108.1 21.3 21.2 59.6 132 132 A S E -J 120 0B 11 -2,-0.3 2,-0.3 -101,-0.2 -12,-0.2 -0.858 20.9-167.0-126.3 158.6 21.9 23.2 56.4 133 133 A Y E -J 119 0B 13 -14,-1.9 -14,-2.0 -2,-0.3 2,-0.3 -0.977 9.7-175.8-137.0 159.9 24.7 24.7 54.2 134 134 A S E -B 30 0A 1 -104,-1.6 -104,-2.3 -2,-0.3 2,-0.4 -0.968 9.4-156.4-155.9 136.0 24.6 27.2 51.2 135 135 A F E -B 29 0A 22 -18,-0.5 -18,-2.2 -2,-0.3 2,-0.5 -0.929 7.6-153.2-114.9 140.4 27.2 28.9 48.7 136 136 A V E -BI 28 116A 5 -108,-2.1 -109,-2.5 -2,-0.4 -108,-1.0 -0.974 27.2-165.4-103.3 117.3 26.9 32.1 46.6 137 137 A F E -BI 26 115A 15 -22,-2.3 -22,-1.4 -2,-0.5 2,-0.3 -0.823 10.2-163.7-110.5 152.7 29.1 31.7 43.5 138 138 A A E -BI 25 114A 1 -113,-2.2 -113,-2.7 -2,-0.3 -24,-0.2 -0.956 22.3-151.8-129.6 146.1 30.4 34.2 40.9 139 139 A R S S+ 0 0 67 -26,-1.5 -1,-0.1 -2,-0.3 -25,-0.1 0.874 97.2 44.2 -77.8 -39.0 31.9 33.9 37.3 140 140 A D S S- 0 0 101 -27,-0.4 2,-2.2 2,-0.1 -1,-0.2 -0.939 86.1-133.9-107.6 113.3 34.0 37.2 37.9 141 141 A P S S+ 0 0 69 0, 0.0 2,-0.2 0, 0.0 29,-0.1 -0.001 77.8 100.7 -69.6 39.4 35.7 37.5 41.3 142 142 A S S S- 0 0 68 -2,-2.2 -2,-0.1 0, 0.0 -3,-0.0 -0.525 86.2 -82.4-107.1 172.8 34.3 41.1 41.5 143 143 A G - 0 0 59 -2,-0.2 6,-0.0 1,-0.1 -116,-0.0 0.316 47.5-117.0 -67.3 -9.7 31.3 42.5 43.4 144 144 A F - 0 0 56 -4,-0.2 -1,-0.1 4,-0.1 -6,-0.0 0.463 34.3 -97.8 77.0 117.9 27.9 42.1 41.7 145 145 A S > - 0 0 60 1,-0.1 4,-2.2 4,-0.0 3,-0.2 -0.269 40.0 -96.5 -64.5 159.5 25.9 45.1 40.6 146 146 A P H > S+ 0 0 110 0, 0.0 4,-1.4 0, 0.0 -1,-0.1 0.867 121.2 52.3 -49.6 -47.8 23.1 46.5 42.8 147 147 A E H > S+ 0 0 130 1,-0.2 4,-1.4 2,-0.2 -3,-0.0 0.876 110.5 46.8 -66.0 -37.5 20.3 44.7 40.9 148 148 A V H > S+ 0 0 20 -3,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.889 106.7 58.0 -69.8 -38.2 21.9 41.3 41.2 149 149 A Q H X S+ 0 0 75 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.872 105.7 52.1 -53.4 -35.9 22.6 41.8 44.9 150 150 A K H X S+ 0 0 113 -4,-1.4 4,-1.8 2,-0.2 -2,-0.2 0.895 107.7 48.5 -73.8 -42.6 18.8 42.3 45.4 151 151 A I H X S+ 0 0 52 -4,-1.4 4,-1.7 2,-0.2 -1,-0.2 0.884 109.8 54.1 -59.1 -39.1 17.7 39.1 43.7 152 152 A V H X S+ 0 0 8 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.941 108.4 49.4 -63.5 -47.1 20.4 37.1 45.8 153 153 A R H X S+ 0 0 138 -4,-1.9 4,-1.8 1,-0.2 -1,-0.2 0.858 107.4 54.0 -60.6 -39.1 18.8 38.5 49.0 154 154 A Q H X S+ 0 0 116 -4,-1.8 4,-1.5 1,-0.2 -1,-0.2 0.893 109.4 48.2 -63.2 -38.7 15.2 37.6 47.9 155 155 A R H X S+ 0 0 81 -4,-1.7 4,-1.4 2,-0.2 -2,-0.2 0.875 106.8 55.9 -67.4 -38.3 16.4 33.9 47.4 156 156 A Q H <>S+ 0 0 12 -4,-1.9 5,-2.0 1,-0.2 6,-0.4 0.876 107.6 51.0 -62.3 -36.2 18.1 33.9 50.9 157 157 A E H ><5S+ 0 0 88 -4,-1.8 3,-1.2 4,-0.2 -2,-0.2 0.886 103.2 57.2 -68.4 -39.3 14.7 34.9 52.4 158 158 A E H 3<5S+ 0 0 26 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.848 106.6 51.0 -50.8 -44.2 12.8 32.0 50.6 159 159 A L T 3<5S- 0 0 5 -4,-1.4 -1,-0.2 -3,-0.1 -2,-0.2 0.425 113.6-119.0 -76.5 -2.3 15.3 29.5 52.3 160 160 A a T < 5S+ 0 0 42 -3,-1.2 -3,-0.2 -4,-0.2 -2,-0.1 0.869 87.1 112.0 60.8 37.4 14.6 31.1 55.8 161 161 A L > < + 0 0 8 -5,-2.0 3,-1.7 -6,-0.1 -4,-0.2 0.237 33.6 147.4-124.7 13.0 18.4 32.0 55.9 162 162 A A T 3 S+ 0 0 16 -6,-0.4 -9,-0.0 1,-0.3 -8,-0.0 -0.281 73.3 9.6 -51.1 135.3 18.4 35.8 55.7 163 163 A R T 3 S+ 0 0 220 1,-0.1 -1,-0.3 0, 0.0 -6,-0.0 0.523 99.9 103.6 67.8 14.2 21.4 37.4 57.6 164 164 A Q < + 0 0 110 -3,-1.7 -133,-0.3 -8,-0.0 2,-0.2 0.375 57.2 93.0-106.4 10.9 23.2 34.1 58.3 165 165 A Y - 0 0 39 -4,-0.2 2,-0.3 -135,-0.1 -135,-0.2 -0.621 53.0-154.5 -98.7 159.6 26.1 34.3 55.6 166 166 A R E -C 29 0A 143 -137,-2.0 -137,-1.7 -2,-0.2 2,-0.1 -0.981 23.9-109.7-128.7 147.7 29.8 35.5 55.7 167 167 A L E -C 28 0A 153 -2,-0.3 -139,-0.3 -139,-0.2 -140,-0.1 -0.481 30.1-140.3 -73.4 144.3 32.2 36.9 53.0 168 168 A I - 0 0 18 -141,-1.8 -129,-0.1 -2,-0.1 -1,-0.0 -0.894 11.8-129.9-108.7 123.9 35.2 34.7 51.8 169 169 A P - 0 0 62 0, 0.0 -129,-2.2 0, 0.0 2,-0.4 -0.351 5.1-147.9 -75.0 160.0 38.8 35.9 51.0 170 170 A H + 0 0 73 -130,-0.1 -143,-0.0 -131,-0.1 -2,-0.0 -0.977 32.2 153.8-129.6 111.1 40.9 35.2 47.9 171 171 A N - 0 0 97 -2,-0.4 -1,-0.1 3,-0.0 -132,-0.0 0.380 56.5-111.6-126.6 -14.6 44.6 35.1 48.8 172 172 A G S S+ 0 0 64 2,-0.1 -2,-0.0 1,-0.0 0, 0.0 0.365 76.9 126.3 89.3 -15.7 46.8 33.0 46.6 173 173 A Y S S+ 0 0 112 -113,-0.0 2,-0.3 0, 0.0 -103,-0.1 0.879 70.5 47.5 -52.3 -42.0 47.4 30.5 49.4 174 174 A b 0 0 18 1,-0.1 -2,-0.1 -116,-0.1 -114,-0.1 -0.815 360.0 360.0-103.7 152.6 46.3 27.6 47.3 175 175 A D 0 0 189 -2,-0.3 -1,-0.1 -105,-0.0 -117,-0.0 0.837 360.0 360.0 -26.5 360.0 47.6 27.1 43.7