==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-NOV-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SUGAR BINDING PROTEIN, VIRAL PROTEIN 04-AUG-11 3TB0 . COMPND 2 MOLECULE: OUTER CAPSID PROTEIN VP4; . SOURCE 2 ORGANISM_SCIENTIFIC: RHESUS ROTAVIRUS; . AUTHOR X.YU,H.BLANCHARD . 161 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7890.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 107 66.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 3 1.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 70 43.5 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 . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 1.9 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 . 14 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 8 5.0 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+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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 0 1 1 3 1 3 1 1 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 0 0 0 1 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 64 A V 0 0 182 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -28.4 -10.1 26.7 14.2 2 65 A L - 0 0 64 1,-0.1 2,-1.1 143,-0.0 143,-0.1 -0.419 360.0-135.5 -63.7 122.4 -9.3 23.7 12.1 3 66 A D E -A 144 0A 71 141,-0.6 141,-2.4 -2,-0.2 3,-0.2 -0.675 49.1 -50.0 -94.8 90.5 -12.5 21.6 11.5 4 67 A G E - 0 0 31 -2,-1.1 139,-0.2 139,-0.2 2,-0.1 -0.956 11.8-124.9 158.2-170.4 -11.7 17.9 12.0 5 68 A P E - 0 0 68 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.508 47.9-177.2 -82.1 145.5 -10.6 15.1 12.0 6 69 A Y E -A 142 0A 100 136,-2.9 136,-1.7 -3,-0.2 3,-0.1 -0.849 26.8-114.1-103.4 144.7 -13.8 13.2 10.9 7 70 A Q - 0 0 127 -2,-0.3 131,-0.1 134,-0.2 133,-0.1 -0.342 48.5 -72.9 -76.4 156.7 -13.9 9.4 10.6 8 71 A P S S+ 0 0 67 0, 0.0 2,-0.3 0, 0.0 131,-0.2 -0.202 74.3 134.7 -51.2 135.5 -14.4 7.6 7.3 9 72 A T E -F 138 0B 70 129,-0.5 129,-2.4 131,-0.2 2,-0.5 -0.966 54.6-107.2-168.2 168.5 -18.1 7.9 6.0 10 73 A T E +F 137 0B 77 -2,-0.3 2,-0.3 127,-0.2 127,-0.2 -0.966 52.0 143.8-108.8 127.5 -20.3 8.7 3.0 11 74 A F E -F 136 0B 59 125,-2.1 125,-2.9 -2,-0.5 -2,-0.0 -0.927 54.1-102.6-152.3 175.7 -22.1 12.1 3.2 12 75 A N - 0 0 83 -2,-0.3 123,-0.2 123,-0.2 122,-0.1 -0.845 40.4-152.0-108.3 91.5 -23.3 15.0 1.0 13 76 A P - 0 0 6 0, 0.0 3,-0.1 0, 0.0 121,-0.1 -0.258 21.6-105.8 -64.4 148.2 -20.7 17.9 1.5 14 77 A P > - 0 0 67 0, 0.0 3,-0.5 0, 0.0 92,-0.4 -0.377 42.3 -98.7 -67.2 153.5 -21.9 21.5 1.1 15 78 A V T 3 S+ 0 0 45 1,-0.2 92,-0.2 90,-0.1 132,-0.1 -0.274 103.9 30.9 -65.0 159.1 -20.8 23.3 -2.1 16 79 A D T 3 S+ 0 0 54 90,-3.2 131,-2.4 1,-0.2 2,-0.4 0.811 93.2 112.5 59.9 36.3 -17.7 25.6 -1.9 17 80 A Y E < -B 146 0A 92 -3,-0.5 89,-0.5 89,-0.3 2,-0.4 -0.996 62.0-132.1-134.1 132.8 -16.0 23.6 0.9 18 81 A W E -BC 145 105A 0 127,-3.4 127,-2.8 -2,-0.4 2,-0.7 -0.711 8.9-150.4 -79.4 131.7 -12.7 21.7 0.6 19 82 A M E -BC 144 104A 4 85,-2.6 85,-1.4 -2,-0.4 2,-0.6 -0.926 17.1-155.8 -98.3 104.2 -12.7 18.2 2.1 20 83 A L E -BC 143 103A 0 123,-2.4 123,-2.3 -2,-0.7 2,-0.4 -0.771 9.1-154.6 -90.8 120.7 -9.0 17.8 3.1 21 84 A L E -BC 142 102A 0 81,-3.3 81,-1.8 -2,-0.6 121,-0.2 -0.804 15.4-167.9-107.7 137.0 -8.0 14.1 3.3 22 85 A A - 0 0 23 119,-2.4 119,-0.4 -2,-0.4 79,-0.1 -0.630 16.0-176.7-121.3 69.6 -5.3 12.6 5.4 23 86 A P - 0 0 12 0, 0.0 117,-0.1 0, 0.0 3,-0.1 -0.311 15.6-168.9 -69.9 152.2 -4.7 8.9 4.2 24 87 A T + 0 0 120 1,-0.1 2,-0.3 2,-0.1 116,-0.1 0.677 69.2 43.8-106.8 -29.5 -2.1 6.7 6.0 25 88 A A S S- 0 0 64 3,-0.1 19,-0.1 1,-0.1 -1,-0.1 -0.824 90.4 -96.3-119.1 154.6 -1.9 3.8 3.5 26 89 A A S S+ 0 0 41 -2,-0.3 2,-0.3 -3,-0.1 19,-0.2 -0.295 80.8 57.7 -62.5 153.6 -1.6 3.5 -0.3 27 90 A G E S+G 44 0B 16 17,-2.1 17,-2.7 -4,-0.0 2,-0.2 -0.788 91.3 2.5 123.6-164.5 -4.9 2.9 -2.2 28 91 A V E +G 43 0B 33 -2,-0.3 15,-0.2 15,-0.2 3,-0.1 -0.404 51.0 177.1 -67.5 127.5 -8.3 4.5 -2.7 29 92 A V E - 0 0 3 13,-3.4 110,-2.5 1,-0.4 2,-0.3 0.841 61.3 -14.0 -97.7 -44.9 -8.6 7.8 -0.8 30 93 A V E -GH 42 138B 1 12,-0.8 12,-2.5 108,-0.2 -1,-0.4 -0.974 56.5-160.6-160.9 146.3 -12.1 9.1 -1.7 31 94 A E E +GH 41 137B 19 106,-2.0 106,-3.4 -2,-0.3 2,-0.3 -0.987 9.9 174.6-136.9 154.2 -14.8 8.5 -4.2 32 95 A G E +GH 40 136B 2 8,-2.4 8,-2.6 -2,-0.3 2,-0.3 -0.985 0.1 173.2-156.0 143.7 -17.8 10.4 -5.6 33 96 A T E -GH 39 135B 21 102,-0.9 102,-0.8 -2,-0.3 6,-0.2 -0.991 32.3-155.2-150.0 152.7 -20.4 10.1 -8.3 34 97 A N - 0 0 16 4,-1.7 5,-0.1 -2,-0.3 -1,-0.1 0.273 48.4-125.9-101.9 3.2 -23.6 11.8 -9.6 35 98 A N S S+ 0 0 120 3,-0.5 50,-0.1 1,-0.1 4,-0.1 0.517 93.5 59.9 66.2 8.6 -24.7 8.4 -11.0 36 99 A T S S- 0 0 76 2,-0.2 49,-0.4 93,-0.2 -1,-0.1 0.650 120.6 -9.4-128.2 -64.8 -25.2 9.9 -14.5 37 100 A D S S+ 0 0 57 92,-0.2 2,-0.3 1,-0.2 47,-0.0 0.248 115.4 61.8-131.5 14.9 -22.1 11.5 -16.2 38 101 A R + 0 0 27 91,-0.1 -4,-1.7 90,-0.1 -3,-0.5 -0.900 40.7 164.3-150.9 120.7 -19.4 11.6 -13.5 39 102 A W E +GI 33 82B 7 43,-2.2 43,-1.6 -2,-0.3 2,-0.4 -0.999 13.9 178.3-126.3 133.1 -17.4 9.1 -11.4 40 103 A L E +GI 32 81B 2 -8,-2.6 -8,-2.4 -2,-0.4 2,-0.4 -0.994 8.2 172.2-138.3 129.7 -14.2 10.1 -9.6 41 104 A A E -GI 31 80B 0 39,-2.1 39,-3.4 -2,-0.4 2,-0.6 -0.995 21.5-144.4-134.7 129.5 -12.0 8.1 -7.4 42 105 A T E -GI 30 79B 0 -12,-2.5 -13,-3.4 -2,-0.4 -12,-0.8 -0.849 14.4-163.8 -94.9 126.4 -8.6 9.3 -6.1 43 106 A I E -GI 28 78B 2 35,-3.0 35,-2.7 -2,-0.6 2,-0.6 -0.923 12.0-142.9-109.6 127.8 -5.9 6.6 -5.7 44 107 A L E -GI 27 77B 0 -17,-2.7 -17,-2.1 -2,-0.5 2,-0.4 -0.828 21.3-161.7 -89.1 117.1 -2.8 7.2 -3.6 45 108 A V E - I 0 76B 0 31,-3.3 31,-2.3 -2,-0.6 3,-0.1 -0.874 17.6-114.2-106.1 131.9 0.3 5.6 -5.3 46 109 A E - 0 0 67 -2,-0.4 3,-0.2 29,-0.2 28,-0.1 -0.096 42.2 -87.3 -47.1 149.2 3.6 4.8 -3.6 47 110 A P S S+ 0 0 42 0, 0.0 25,-0.2 0, 0.0 -1,-0.1 -0.322 102.9 16.0 -54.1 142.8 6.8 6.5 -4.6 48 111 A N S S+ 0 0 104 23,-2.9 2,-0.5 26,-0.4 22,-0.2 0.952 72.8 161.7 60.2 75.4 8.8 4.9 -7.5 49 112 A V E -L 69 0C 14 20,-2.0 20,-2.8 -3,-0.2 2,-0.2 -0.976 28.7-145.6-129.9 116.1 6.5 2.5 -9.4 50 113 A T E - 0 0 123 -2,-0.5 17,-0.1 18,-0.2 20,-0.0 -0.553 54.0 -67.4 -74.3 146.1 7.3 1.3 -12.9 51 114 A S E S+ 0 0 84 -2,-0.2 2,-0.3 15,-0.1 17,-0.2 -0.031 74.1 151.2 -37.7 119.6 4.2 0.7 -15.1 52 115 A E E -L 67 0C 88 15,-2.1 15,-3.1 -3,-0.1 2,-0.4 -0.988 45.2-112.6-150.9 154.1 2.2 -2.2 -13.7 53 116 A T E -L 66 0C 94 -2,-0.3 2,-0.3 13,-0.3 13,-0.3 -0.780 37.7-179.6 -92.8 133.5 -1.5 -3.4 -13.6 54 117 A R E -L 65 0C 47 11,-3.2 11,-2.7 -2,-0.4 2,-0.5 -0.792 24.5-123.6-123.0 166.0 -3.2 -3.4 -10.3 55 118 A S E +L 64 0C 59 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.974 30.0 175.6-114.7 129.8 -6.6 -4.3 -8.9 56 119 A Y E -L 63 0C 24 7,-2.7 7,-3.1 -2,-0.5 2,-0.7 -0.943 32.4-125.5-127.6 148.6 -8.7 -1.7 -7.0 57 120 A T E +L 62 0C 88 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.884 35.8 179.0 -89.7 118.1 -12.2 -1.8 -5.6 58 121 A L E > -L 61 0C 2 3,-2.7 3,-1.6 -2,-0.7 -17,-0.1 -0.993 68.3 -12.0-125.6 124.8 -13.9 1.2 -7.0 59 122 A F T 3 S- 0 0 50 -2,-0.4 -1,-0.2 1,-0.3 3,-0.1 0.904 130.9 -54.4 51.3 43.8 -17.6 1.9 -6.2 60 123 A G T 3 S+ 0 0 68 1,-0.1 2,-0.4 -3,-0.1 -1,-0.3 0.448 119.6 96.2 76.0 1.8 -17.8 -1.6 -4.7 61 124 A T E < S-L 58 0C 87 -3,-1.6 -3,-2.7 -5,-0.0 2,-0.2 -0.965 77.7-108.0-125.7 143.5 -16.6 -3.5 -7.8 62 125 A Q E -L 57 0C 134 -2,-0.4 2,-0.4 -5,-0.2 -5,-0.2 -0.465 38.8-175.8 -70.2 133.7 -13.1 -4.8 -8.7 63 126 A E E -L 56 0C 56 -7,-3.1 -7,-2.7 -2,-0.2 2,-0.5 -0.992 22.7-136.0-133.1 139.2 -11.3 -2.9 -11.4 64 127 A Q E +L 55 0C 108 -2,-0.4 2,-0.4 -9,-0.2 -9,-0.2 -0.850 30.2 177.5 -93.8 127.6 -7.9 -3.5 -13.2 65 128 A I E -L 54 0C 13 -11,-2.7 -11,-3.2 -2,-0.5 2,-0.6 -0.995 29.0-131.6-133.2 134.6 -5.9 -0.3 -13.6 66 129 A T E -L 53 0C 81 -2,-0.4 2,-0.3 -13,-0.3 -13,-0.3 -0.783 36.7-176.7 -83.5 121.4 -2.5 0.4 -15.1 67 130 A I E +L 52 0C 4 -15,-3.1 -15,-2.1 -2,-0.6 2,-0.3 -0.910 14.3 168.1-124.9 147.7 -0.5 2.6 -12.7 68 131 A A E - 0 0 34 -2,-0.3 2,-0.3 -17,-0.2 -18,-0.2 -0.978 16.2-164.8-146.4 156.8 3.0 4.3 -12.6 69 132 A N E -L 49 0C 1 -20,-2.8 -20,-2.0 -2,-0.3 -21,-0.1 -0.798 0.9-170.9-143.5 107.6 4.8 6.8 -10.5 70 133 A A + 0 0 99 -2,-0.3 2,-0.3 -22,-0.2 -1,-0.1 0.692 57.9 102.8 -69.4 -18.9 8.0 8.3 -12.0 71 134 A S - 0 0 17 3,-0.2 -23,-2.9 1,-0.1 -22,-0.1 -0.481 59.3-156.0 -72.6 130.7 8.9 10.1 -8.8 72 135 A Q S S+ 0 0 155 -2,-0.3 -1,-0.1 -25,-0.2 -2,-0.0 0.861 91.7 12.4 -64.8 -38.8 11.7 8.5 -6.7 73 136 A T S S+ 0 0 102 -26,-0.1 2,-0.3 2,-0.1 -1,-0.1 0.579 107.7 83.7-123.2 -20.1 10.6 10.1 -3.5 74 137 A Q - 0 0 23 -28,-0.1 -26,-0.4 1,-0.1 24,-0.2 -0.721 69.6-120.3 -99.2 143.8 7.1 11.7 -3.8 75 138 A W E - J 0 97B 53 22,-2.2 22,-1.9 -2,-0.3 2,-0.4 -0.300 23.6-138.9 -60.4 158.2 3.6 10.1 -3.6 76 139 A K E -IJ 45 96B 35 -31,-2.3 -31,-3.3 20,-0.2 2,-0.6 -0.969 9.5-162.4-129.5 115.8 1.3 10.3 -6.6 77 140 A F E -IJ 44 95B 0 18,-2.9 18,-2.0 -2,-0.4 2,-0.4 -0.882 16.2-171.5 -93.8 121.4 -2.4 11.1 -6.2 78 141 A I E -I 43 0B 5 -35,-2.7 -35,-3.0 -2,-0.6 2,-0.6 -0.962 17.7-144.7-117.6 127.8 -4.3 10.1 -9.3 79 142 A D E -IJ 42 92B 0 13,-0.7 13,-1.0 -2,-0.4 2,-0.6 -0.824 14.4-160.7 -86.7 120.1 -7.9 10.8 -10.1 80 143 A V E -IJ 41 91B 2 -39,-3.4 -39,-2.1 -2,-0.6 2,-0.3 -0.920 19.8-179.8-103.4 122.7 -9.5 7.9 -12.0 81 144 A V E -IJ 40 90B 3 9,-2.7 9,-3.0 -2,-0.6 2,-0.3 -0.921 21.8-174.6-128.3 144.9 -12.6 9.1 -13.8 82 145 A K E -I 39 0B 19 -43,-1.6 -43,-2.2 -2,-0.3 7,-0.1 -0.957 14.0-155.6-131.1 158.7 -15.4 7.7 -16.0 83 146 A T S S+ 0 0 79 -2,-0.3 2,-0.3 5,-0.3 3,-0.1 0.362 77.3 37.9-117.9 0.1 -18.2 9.7 -17.7 84 147 A T S > S- 0 0 77 4,-0.1 3,-1.1 1,-0.1 -47,-0.1 -0.964 88.4-106.0-141.6 158.9 -20.8 6.9 -18.2 85 148 A Q T 3 S+ 0 0 109 -49,-0.4 -1,-0.1 -2,-0.3 -48,-0.1 0.874 120.0 29.5 -47.4 -48.8 -21.9 4.0 -16.0 86 149 A N T 3 S+ 0 0 152 -3,-0.1 -1,-0.3 2,-0.0 0, 0.0 0.372 96.6 118.8-100.4 3.2 -20.2 1.4 -18.2 87 150 A G < - 0 0 26 -3,-1.1 2,-0.1 1,-0.1 -5,-0.0 -0.147 68.2 -98.7 -68.1 162.7 -17.4 3.5 -19.5 88 151 A S - 0 0 102 1,-0.1 2,-0.4 -6,-0.0 -5,-0.3 -0.452 38.8-104.3 -81.3 156.0 -13.7 2.8 -19.0 89 152 A Y - 0 0 36 -2,-0.1 2,-0.3 -7,-0.1 -7,-0.2 -0.666 37.0-167.7 -84.4 131.6 -11.6 4.6 -16.3 90 153 A S E -J 81 0B 46 -9,-3.0 -9,-2.7 -2,-0.4 2,-0.4 -0.866 12.8-135.2-117.9 156.4 -9.2 7.4 -17.4 91 154 A Q E -J 80 0B 80 -2,-0.3 2,-0.3 -11,-0.2 -11,-0.2 -0.900 21.1-179.3-113.4 135.1 -6.4 9.3 -15.7 92 155 A Y E -J 79 0B 131 -13,-1.0 -13,-0.7 -2,-0.4 -2,-0.0 -0.987 51.0 -27.2-136.7 144.4 -5.8 13.1 -15.8 93 156 A G E - 0 0 35 -2,-0.3 -14,-0.3 -15,-0.1 -1,-0.2 0.733 67.8-142.3 17.5 112.7 -3.2 15.4 -14.2 94 157 A P E - 0 0 50 0, 0.0 22,-2.2 0, 0.0 2,-0.5 -0.297 6.7-127.6 -87.2 172.9 -1.7 14.0 -11.0 95 158 A L E -Jk 77 116B 0 -18,-2.0 -18,-2.9 20,-0.3 2,-0.5 -0.995 16.4-156.6-114.0 120.4 -0.6 15.6 -7.8 96 159 A Q E -Jk 76 117B 40 20,-3.2 22,-2.5 -2,-0.5 2,-0.4 -0.889 26.5-174.9 -90.8 126.3 3.0 14.7 -6.7 97 160 A S E -J 75 0B 0 -22,-1.9 -22,-2.2 -2,-0.5 61,-0.1 -0.971 39.2-178.6-136.1 133.3 3.1 15.1 -3.0 98 161 A T S S+ 0 0 93 -2,-0.4 -1,-0.1 -24,-0.2 60,-0.1 0.861 91.8 52.3 -85.6 -47.4 5.5 15.0 -0.1 99 162 A P S S- 0 0 33 0, 0.0 62,-0.2 0, 0.0 59,-0.1 0.622 99.4-131.1 -71.5 -11.9 3.0 15.8 2.8 100 163 A K + 0 0 57 1,-0.2 2,-0.3 57,-0.1 57,-0.1 0.769 61.5 130.0 73.9 25.8 0.6 13.0 1.7 101 164 A L + 0 0 7 56,-0.3 2,-0.3 -79,-0.1 -1,-0.2 -0.892 30.6 178.1-115.7 146.7 -2.5 15.3 1.8 102 165 A Y E -C 21 0A 0 -81,-1.8 -81,-3.3 -2,-0.3 2,-0.3 -0.907 8.3-158.4-138.4 163.9 -5.2 15.8 -0.8 103 166 A A E -C 20 0A 0 -2,-0.3 11,-1.0 -83,-0.3 2,-0.3 -0.997 4.4-167.4-149.6 150.6 -8.5 17.8 -1.1 104 167 A V E -CD 19 113A 2 -85,-1.4 -85,-2.6 -2,-0.3 2,-0.3 -0.986 9.0-176.3-138.1 142.7 -11.7 17.8 -3.2 105 168 A M E -CD 18 112A 3 7,-2.1 7,-3.3 -2,-0.3 2,-0.6 -1.000 25.5-135.3-144.5 141.2 -14.5 20.4 -3.6 106 169 A K E + D 0 111A 3 -89,-0.5 -90,-3.2 -92,-0.4 2,-0.3 -0.866 45.0 153.9 -92.2 117.9 -17.9 20.8 -5.3 107 170 A H E > - D 0 110A 19 3,-2.4 3,-1.2 -2,-0.6 -2,-0.1 -0.958 53.7 -17.5-154.6 126.0 -17.9 24.2 -7.0 108 171 A N T 3 S- 0 0 102 -2,-0.3 3,-0.1 1,-0.3 -1,-0.0 0.820 124.8 -43.0 53.1 48.4 -19.6 25.9 -10.0 109 172 A G T 3 S+ 0 0 28 1,-0.2 19,-2.9 18,-0.1 2,-0.3 0.623 125.0 82.6 75.9 16.1 -20.9 22.8 -11.8 110 173 A K E < S-DE 107 127A 40 -3,-1.2 -3,-2.4 17,-0.3 2,-0.5 -0.908 74.6-121.2-142.4 163.3 -17.6 20.9 -11.3 111 174 A I E -DE 106 126A 0 15,-2.3 15,-2.1 -2,-0.3 2,-0.4 -0.965 33.0-157.0-106.2 130.1 -15.5 18.8 -8.9 112 175 A Y E +DE 105 125A 34 -7,-3.3 -7,-2.1 -2,-0.5 2,-0.3 -0.851 15.3 173.0-105.3 142.7 -12.1 20.5 -8.1 113 176 A T E -DE 104 124A 0 11,-2.1 11,-2.4 -2,-0.4 -9,-0.2 -0.928 36.6 -91.3-136.8 167.9 -9.0 18.6 -6.8 114 177 A Y E - E 0 123A 1 -11,-1.0 2,-0.3 -2,-0.3 9,-0.3 -0.428 44.7-171.6 -82.5 161.4 -5.4 19.7 -6.2 115 178 A N E + E 0 122A 36 7,-2.5 7,-2.8 -2,-0.1 2,-0.4 -0.978 31.4 26.1-154.2 148.7 -2.8 19.4 -8.9 116 179 A G E S-k 95 0B 25 -22,-2.2 -20,-3.2 -2,-0.3 2,-0.4 -0.754 89.6 -37.0 103.2-140.1 1.0 19.6 -9.7 117 180 A E E > -k 96 0B 113 3,-0.4 3,-2.5 -2,-0.4 -20,-0.2 -0.986 68.9 -90.2-134.1 123.5 4.0 19.1 -7.4 118 181 A T T 3 S+ 0 0 10 -22,-2.5 40,-0.1 -2,-0.4 41,-0.1 -0.421 106.9 33.0 -61.3 143.6 4.3 20.2 -3.8 119 182 A P T 3 S+ 0 0 77 0, 0.0 -1,-0.3 0, 0.0 39,-0.1 -0.820 126.4 43.8 -98.9 34.8 5.3 22.7 -2.6 120 183 A N S < S+ 0 0 136 -3,-2.5 -3,-0.4 38,-0.1 -2,-0.2 -0.319 79.0 166.8-129.0 53.2 3.9 24.6 -5.6 121 184 A V - 0 0 16 33,-0.2 2,-0.2 -5,-0.2 -5,-0.2 -0.146 14.9-175.5 -72.4 159.6 0.4 23.2 -6.2 122 185 A T E -E 115 0A 84 -7,-2.8 -7,-2.5 -9,-0.0 2,-0.3 -0.670 25.1-107.2-128.7-171.4 -2.5 24.4 -8.3 123 186 A T E -E 114 0A 52 -9,-0.3 2,-0.3 -2,-0.2 -9,-0.2 -0.881 23.9-169.3-121.1 159.5 -6.1 23.2 -8.8 124 187 A K E -E 113 0A 27 -11,-2.4 -11,-2.1 -2,-0.3 2,-0.3 -0.882 10.9-145.6-136.8 167.0 -7.9 21.4 -11.7 125 188 A Y E -E 112 0A 136 -2,-0.3 2,-0.4 -13,-0.2 -13,-0.2 -0.949 11.7-153.3-141.9 160.1 -11.6 20.6 -12.3 126 189 A Y E -E 111 0A 17 -15,-2.1 -15,-2.3 -2,-0.3 2,-0.0 -0.980 31.4-120.7-133.7 117.8 -14.0 18.1 -13.9 127 190 A S E -E 110 0A 78 -2,-0.4 2,-0.4 -17,-0.2 -17,-0.3 -0.360 36.4-174.8 -62.4 134.3 -17.4 19.2 -15.2 128 191 A T > - 0 0 6 -19,-2.9 3,-1.1 -90,-0.1 2,-0.1 -0.977 22.3-132.2-141.9 117.7 -20.2 17.4 -13.3 129 192 A T T 3 S+ 0 0 70 -2,-0.4 -92,-0.2 1,-0.3 -93,-0.2 -0.464 97.6 11.0 -70.7 142.6 -23.9 17.5 -13.9 130 193 A N T > S+ 0 0 94 -2,-0.1 3,-1.9 1,-0.1 4,-0.3 0.846 83.5 170.8 53.1 38.8 -26.0 18.0 -10.6 131 194 A Y G X + 0 0 54 -3,-1.1 3,-1.3 1,-0.3 -2,-0.1 0.773 63.6 63.0 -47.4 -36.2 -22.6 18.8 -9.0 132 195 A D G 3 S+ 0 0 89 1,-0.3 -1,-0.3 -4,-0.1 -117,-0.1 0.717 101.2 48.6 -71.6 -22.5 -24.3 20.0 -5.8 133 196 A S G < S+ 0 0 60 -3,-1.9 2,-0.3 2,-0.1 -1,-0.3 0.324 77.2 131.8-100.5 6.8 -25.8 16.7 -4.8 134 197 A V < - 0 0 1 -3,-1.3 2,-0.3 -4,-0.3 -100,-0.2 -0.448 48.9-144.9 -63.2 120.0 -22.7 14.6 -5.3 135 198 A N E - H 0 33B 75 -102,-0.8 -102,-0.9 -2,-0.3 2,-0.4 -0.668 11.7-148.3 -81.8 141.2 -22.1 12.3 -2.3 136 199 A M E -FH 11 32B 3 -125,-2.9 -125,-2.1 -2,-0.3 2,-0.6 -0.944 5.4-153.5-115.2 137.2 -18.5 11.7 -1.3 137 200 A T E -FH 10 31B 26 -106,-3.4 -106,-2.0 -2,-0.4 2,-0.5 -0.936 11.6-161.0-106.5 112.6 -17.1 8.6 0.3 138 201 A A E -FH 9 30B 3 -129,-2.4 -129,-0.5 -2,-0.6 -108,-0.2 -0.809 11.1-170.5 -93.1 130.4 -13.9 9.2 2.4 139 202 A F S S+ 0 0 98 -110,-2.5 2,-0.3 -2,-0.5 -109,-0.1 0.180 74.3 31.9-103.2 14.2 -11.7 6.1 3.2 140 203 A C S S- 0 0 15 -111,-0.3 -131,-0.2 -131,-0.1 -134,-0.1 -0.914 104.8 -63.7-153.8 172.8 -9.6 8.0 5.7 141 204 A D - 0 0 53 -119,-0.4 -119,-2.4 -2,-0.3 2,-0.3 -0.362 57.4-173.0 -64.4 146.9 -9.9 10.8 8.3 142 205 A F E -AB 6 21A 6 -136,-1.7 -136,-2.9 -121,-0.2 2,-0.3 -0.926 19.6-146.0-141.7 164.8 -10.8 14.3 6.8 143 206 A Y E - B 0 20A 31 -123,-2.3 -123,-2.4 -2,-0.3 2,-0.4 -0.870 18.2-130.2-126.9 159.6 -11.2 17.9 7.6 144 207 A I E +AB 3 19A 22 -141,-2.4 -141,-0.6 -2,-0.3 -125,-0.2 -0.947 24.4 178.9-118.0 129.4 -13.6 20.6 6.2 145 208 A I E - B 0 18A 7 -127,-2.8 -127,-3.4 -2,-0.4 -143,-0.0 -0.990 27.2-122.4-135.1 125.0 -12.4 24.0 5.0 146 209 A P E > - B 0 17A 27 0, 0.0 3,-1.8 0, 0.0 -129,-0.2 -0.347 22.8-122.0 -65.3 146.4 -14.5 26.8 3.5 147 210 A R G > S+ 0 0 110 -131,-2.4 3,-2.1 1,-0.3 4,-0.2 0.809 112.7 67.4 -55.0 -32.4 -13.5 28.0 0.0 148 211 A E G 3 S+ 0 0 165 -132,-0.3 3,-0.3 1,-0.3 -1,-0.3 0.792 103.3 46.2 -58.3 -29.1 -13.0 31.5 1.5 149 212 A E G X> S+ 0 0 90 -3,-1.8 3,-1.5 1,-0.2 4,-1.4 -0.050 73.4 130.0-102.1 30.3 -10.1 30.0 3.4 150 213 A E H <> + 0 0 56 -3,-2.1 4,-2.7 1,-0.3 5,-0.2 0.822 66.1 63.5 -51.9 -35.2 -8.7 28.2 0.3 151 214 A S H 3> S+ 0 0 92 -3,-0.3 4,-1.6 1,-0.2 -1,-0.3 0.808 101.1 51.1 -64.4 -30.1 -5.2 29.6 1.1 152 215 A T H <> S+ 0 0 56 -3,-1.5 4,-2.0 2,-0.2 -1,-0.2 0.914 110.1 48.6 -70.1 -44.4 -5.1 27.7 4.3 153 216 A C H X S+ 0 0 0 -4,-1.4 4,-2.5 1,-0.2 -2,-0.2 0.913 109.9 53.2 -59.7 -43.1 -6.0 24.4 2.5 154 217 A T H X S+ 0 0 35 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.880 106.2 52.7 -61.9 -38.2 -3.3 25.2 -0.1 155 218 A E H X S+ 0 0 112 -4,-1.6 4,-2.7 2,-0.2 5,-0.3 0.915 110.0 48.3 -63.0 -43.5 -0.7 25.6 2.7 156 219 A Y H X S+ 0 0 49 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.900 111.2 49.8 -62.5 -43.6 -1.7 22.2 4.1 157 220 A I H < S+ 0 0 0 -4,-2.5 -56,-0.3 1,-0.2 -59,-0.2 0.942 119.2 39.0 -58.5 -46.5 -1.4 20.5 0.7 158 221 A N H < S+ 0 0 23 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.845 135.4 14.7 -70.0 -37.3 2.0 22.1 0.2 159 222 A N H < S- 0 0 98 -4,-2.7 -3,-0.2 1,-0.2 -2,-0.2 0.453 98.2-120.7-127.5 -8.2 3.5 21.7 3.7 160 223 A G < 0 0 17 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.1 -0.119 360.0 360.0 87.0 173.4 1.4 19.3 5.8 161 224 A L 0 0 141 -62,-0.2 -1,-0.2 -4,-0.1 -5,-0.1 0.698 360.0 360.0 -72.4 360.0 -0.5 19.6 9.1