==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRUS 18-JUN-02 1M1C . COMPND 2 MOLECULE: MAJOR COAT PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE VIRUS L-A . AUTHOR H.NAITOW,J.TANG,M.CANADY,R.B.WICKNER,J.E.JOHNSON . 1302 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 49852.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 766 58.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 41 3.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 174 13.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 10 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 128 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 97 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 263 20.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 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 1 4 0 0 0 1 3 1 3 3 3 1 0 1 1 0 0 0 0 0 1 0 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 1 5 0 2 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 . 14 14 5 2 4 0 0 0 1 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 7 10 2 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 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 M > 0 0 5 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -55.8 139.9 -81.3 296.8 2 2 A L H > + 0 0 12 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.909 360.0 54.5 -69.8 -43.2 137.0 -83.4 295.4 3 3 A R H 4 S+ 0 0 143 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.806 110.6 50.9 -59.5 -27.7 137.0 -81.4 292.1 4 4 A F H >> S+ 0 0 8 2,-0.2 4,-1.4 1,-0.2 3,-1.1 0.955 106.6 48.4 -75.1 -54.2 140.7 -82.4 292.0 5 5 A V H 3< S+ 0 0 4 -4,-2.1 4,-0.4 1,-0.3 -2,-0.2 0.821 113.1 49.5 -57.8 -33.5 140.4 -86.2 292.6 6 6 A T T 3<>S+ 0 0 9 -4,-1.9 5,-1.6 1,-0.2 -1,-0.3 0.654 105.1 58.7 -80.8 -16.0 137.6 -86.4 289.9 7 7 A K T X45S+ 0 0 80 -3,-1.1 3,-1.9 -4,-0.4 -2,-0.2 0.805 94.7 63.6 -80.8 -31.3 139.7 -84.5 287.4 8 8 A N T 3<5S+ 0 0 4 -4,-1.4 -1,-0.2 1,-0.3 -2,-0.2 0.720 99.9 54.2 -64.6 -22.0 142.6 -87.0 287.6 9 9 A S T > 5S- 0 0 27 -4,-0.4 3,-2.1 -3,-0.1 -1,-0.3 0.237 121.3-109.0 -95.7 14.1 140.2 -89.6 286.2 10 10 A Q T < 5 - 0 0 141 -3,-1.9 -3,-0.2 1,-0.3 -2,-0.2 0.801 65.0 -75.6 61.9 26.5 139.4 -87.3 283.2 11 11 A D T 3 S-B 41 0B 28 3,-1.3 3,-2.1 -2,-0.4 549,-0.1 -0.920 76.6 -7.0-158.1 132.6 154.0 -98.7 262.7 39 39 A D T 3 S- 0 0 71 547,-0.3 3,-0.1 -2,-0.3 548,-0.1 0.870 133.1 -51.4 44.5 44.6 153.0 -98.7 259.0 40 40 A N T 3 S+ 0 0 161 1,-0.2 2,-0.5 0, 0.0 -1,-0.3 0.603 108.1 130.5 72.6 15.2 149.5 -99.6 260.2 41 41 A L E < -B 38 0B 83 -3,-2.1 -3,-1.3 2,-0.0 2,-0.4 -0.880 36.8-167.5-104.0 127.7 150.6 -102.5 262.4 42 42 A V E +B 37 0B 75 -2,-0.5 2,-0.4 -5,-0.2 -5,-0.2 -0.949 9.9 178.9-120.6 132.6 149.2 -102.6 266.0 43 43 A F E -B 36 0B 81 -7,-1.2 -7,-0.8 -2,-0.4 2,-0.4 -0.967 9.9-162.2-133.8 117.0 150.4 -104.8 268.9 44 44 A N E -B 35 0B 89 -2,-0.4 2,-0.4 -9,-0.2 -9,-0.2 -0.790 3.8-169.5-102.3 141.1 148.9 -104.6 272.4 45 45 A R E -B 34 0B 28 -11,-1.7 -11,-1.5 -2,-0.4 2,-0.4 -0.970 5.2-162.0-131.7 116.4 150.5 -105.9 275.6 46 46 A V E +B 33 0B 85 -2,-0.4 2,-0.3 -13,-0.2 -13,-0.2 -0.787 18.5 165.2 -98.9 140.4 148.6 -106.2 278.8 47 47 A Y E -B 32 0B 12 -15,-2.1 -15,-1.6 -2,-0.4 2,-0.6 -0.889 38.6 -99.3-144.6 173.8 150.4 -106.5 282.1 48 48 A G E -B 31 0B 41 -2,-0.3 2,-0.3 -17,-0.2 494,-0.2 -0.893 36.0-170.4-104.1 121.0 149.9 -106.3 285.9 49 49 A V E +B 30 0B 1 -19,-0.9 -19,-1.8 -2,-0.6 2,-0.3 -0.837 7.6 174.0-110.2 147.6 151.0 -103.1 287.5 50 50 A S E -B 29 0B 31 492,-1.1 2,-0.3 -2,-0.3 -21,-0.2 -0.993 15.8-174.0-151.5 155.2 151.3 -102.4 291.2 51 51 A Q E -B 28 0B 11 -23,-1.6 -23,-2.5 -2,-0.3 2,-0.2 -0.914 16.5-147.6-153.3 120.8 152.5 -99.8 293.7 52 52 A K E -B 27 0B 72 252,-0.4 252,-1.3 -2,-0.3 -25,-0.3 -0.555 12.3-166.2 -91.5 156.4 152.6 -100.1 297.5 53 53 A F E -BD 26 303B 1 -27,-3.8 -27,-1.1 250,-0.3 2,-0.3 -0.685 10.7-138.7-128.0-178.7 152.1 -97.4 300.1 54 54 A T E - D 0 302B 2 248,-1.4 248,-2.1 -29,-0.2 -29,-0.2 -0.890 10.6-164.8-153.1 117.6 152.7 -96.9 303.8 55 55 A L + 0 0 11 -2,-0.3 173,-3.7 246,-0.2 174,-0.4 0.655 66.6 104.8 -72.7 -15.6 150.5 -95.2 306.4 56 56 A V B +G 227 0C 11 -32,-0.8 171,-0.3 171,-0.3 2,-0.3 -0.437 41.0 123.6 -72.2 138.6 153.5 -95.2 308.8 57 57 A G - 0 0 14 169,-2.8 173,-0.2 -2,-0.2 260,-0.1 -0.931 53.3-127.7 179.4 163.2 155.4 -91.9 309.3 58 58 A N - 0 0 78 -2,-0.3 170,-0.1 258,-0.1 259,-0.1 -0.512 30.2-170.2-127.9 65.9 156.5 -89.6 312.1 59 59 A P - 0 0 12 0, 0.0 2,-1.2 0, 0.0 260,-0.2 -0.277 24.7-127.8 -58.6 134.1 155.2 -86.1 311.2 60 60 A T E -h 319 0D 70 258,-1.9 260,-1.5 171,-0.1 2,-0.7 -0.732 30.5-162.7 -86.0 96.9 156.6 -83.2 313.3 61 61 A V E -h 320 0D 29 -2,-1.2 2,-0.3 171,-0.2 260,-0.2 -0.748 6.0-168.9 -89.6 115.7 153.3 -81.5 314.3 62 62 A C E -h 321 0D 8 258,-3.0 260,-3.3 -2,-0.7 2,-0.5 -0.788 8.0-151.3-102.8 145.4 153.6 -78.0 315.6 63 63 A F E +h 322 0D 43 -2,-0.3 2,-0.3 258,-0.2 258,-0.1 -0.953 24.7 159.2-122.7 115.6 150.8 -76.1 317.3 64 64 A N E -h 323 0D 14 258,-1.5 260,-1.4 -2,-0.5 2,-0.1 -0.939 46.9 -86.3-133.9 155.4 150.6 -72.3 317.1 65 65 A E - 0 0 59 -2,-0.3 2,-0.1 258,-0.2 260,-0.1 -0.353 50.9-176.0 -60.8 130.5 148.0 -69.6 317.5 66 66 A G - 0 0 7 258,-0.2 778,-0.5 1,-0.2 2,-0.2 -0.258 29.9 -64.2-112.0-159.7 146.1 -68.9 314.2 67 67 A S - 0 0 15 357,-0.3 2,-0.6 -2,-0.1 682,-0.2 -0.526 49.6-106.0 -90.2 158.8 143.5 -66.5 313.0 68 68 A S - 0 0 1 680,-3.6 2,-0.7 -2,-0.2 51,-0.1 -0.748 31.3-167.5 -88.3 121.3 139.9 -66.3 314.2 69 69 A Y + 0 0 9 49,-2.0 679,-0.1 -2,-0.6 219,-0.1 -0.879 21.6 161.9-114.8 101.8 137.4 -67.8 311.7 70 70 A L > + 0 0 10 -2,-0.7 2,-1.7 677,-0.2 3,-1.3 -0.058 33.9 128.5-104.1 28.9 133.8 -67.0 312.5 71 71 A E T 3 + 0 0 18 1,-0.2 216,-0.4 271,-0.1 273,-0.2 -0.510 65.6 51.2 -86.7 69.3 132.7 -67.8 309.0 72 72 A G T 3 S+ 0 0 0 -2,-1.7 -1,-0.2 267,-0.1 2,-0.2 0.216 84.6 104.3-176.9 -4.5 129.9 -70.2 309.9 73 73 A I S < S- 0 0 4 -3,-1.3 268,-1.2 268,-0.2 263,-0.2 -0.477 84.7 -69.2 -90.0 162.2 127.9 -68.1 312.4 74 74 A A B > -J 340 0E 0 261,-2.0 3,-1.5 266,-0.2 266,-0.2 -0.157 35.5-129.0 -52.5 139.8 124.6 -66.4 311.7 75 75 A K G > S+ 0 0 101 264,-1.5 3,-0.7 1,-0.3 -1,-0.2 0.685 106.1 69.6 -63.1 -17.2 124.7 -63.4 309.4 76 76 A K G 3 S+ 0 0 113 1,-0.2 -1,-0.3 263,-0.2 -2,-0.1 0.740 103.3 37.9 -74.3 -25.2 122.8 -61.6 312.1 77 77 A Y G < S+ 0 0 5 -3,-1.5 8,-1.8 258,-0.2 2,-0.3 0.021 105.4 76.4-117.7 28.3 125.7 -61.5 314.5 78 78 A L B < S-L 84 0F 22 -3,-0.7 6,-0.2 6,-0.3 5,-0.1 -0.987 73.3-122.8-137.8 146.3 128.6 -60.9 312.1 79 79 A T - 0 0 54 4,-2.7 6,-0.1 2,-0.6 -2,-0.1 -0.072 51.2 -81.5 -74.5-177.0 129.8 -57.8 310.3 80 80 A L S S+ 0 0 170 2,-0.0 2,-0.3 0, 0.0 -1,-0.1 0.690 122.9 32.8 -60.9 -14.9 130.2 -57.6 306.5 81 81 A D S S- 0 0 49 2,-0.1 -2,-0.6 665,-0.0 261,-0.0 -0.810 119.1 -65.6-132.6 172.6 133.5 -59.4 307.3 82 82 A G S S+ 0 0 7 -2,-0.3 665,-0.2 665,-0.2 -3,-0.2 0.729 91.1 116.3 -24.8 -54.6 134.7 -61.9 309.9 83 83 A G S S- 0 0 5 -5,-0.1 -4,-2.7 1,-0.1 2,-0.5 0.252 70.4-116.0 -25.6 137.4 134.3 -59.5 312.8 84 84 A L B -L 78 0F 18 667,-0.3 2,-1.7 -6,-0.2 669,-0.7 -0.717 16.7-133.1 -87.1 125.8 131.8 -60.4 315.4 85 85 A A > + 0 0 9 -8,-1.8 4,-1.3 -2,-0.5 3,-0.3 -0.586 33.4 170.2 -79.3 86.0 128.8 -58.0 315.8 86 86 A I H > S+ 0 0 25 -2,-1.7 4,-3.0 1,-0.2 3,-0.3 0.909 72.2 58.1 -63.5 -45.9 128.8 -57.6 319.6 87 87 A D H > S+ 0 0 105 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.813 108.1 47.7 -55.7 -33.1 126.3 -54.8 319.7 88 88 A N H > S+ 0 0 78 -3,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.814 113.3 47.3 -78.2 -31.6 123.8 -57.1 317.9 89 89 A V H X S+ 0 0 2 -4,-1.3 4,-1.0 -3,-0.3 -2,-0.2 0.850 111.9 50.0 -76.7 -36.4 124.4 -60.0 320.3 90 90 A L H X S+ 0 0 25 -4,-3.0 4,-1.1 2,-0.2 3,-0.3 0.903 113.3 45.9 -67.8 -42.0 124.2 -57.8 323.3 91 91 A N H X S+ 0 0 77 -4,-1.6 4,-2.6 -5,-0.3 5,-0.3 0.890 106.7 59.6 -66.9 -40.0 120.9 -56.3 322.1 92 92 A E H X>S+ 0 0 19 -4,-1.7 4,-1.6 1,-0.2 5,-1.0 0.785 101.1 56.7 -59.2 -29.2 119.6 -59.8 321.3 93 93 A L H <5S+ 0 0 3 -4,-1.0 6,-0.3 -3,-0.3 4,-0.3 0.909 115.2 33.4 -71.0 -43.9 120.1 -60.8 324.9 94 94 A R H <5S+ 0 0 103 -4,-1.1 5,-0.2 -3,-0.2 -2,-0.2 0.774 124.6 45.5 -83.0 -28.0 117.8 -58.1 326.4 95 95 A S H <5S+ 0 0 67 -4,-2.6 -3,-0.2 -5,-0.2 -2,-0.2 0.950 124.0 23.6 -81.6 -54.4 115.4 -58.1 323.4 96 96 A T T <5S+ 0 0 88 -4,-1.6 -3,-0.2 -5,-0.3 -2,-0.1 0.943 122.8 39.4 -80.8 -51.0 114.7 -61.7 322.6 97 97 A C S - 0 0 66 0, 0.0 4,-2.1 0, 0.0 5,-0.2 -0.200 22.8-119.1 -64.6 156.4 117.7 -57.1 332.5 101 101 A G H > S+ 0 0 47 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.822 116.9 49.6 -65.0 -31.3 119.4 -54.1 331.0 102 102 A N H > S+ 0 0 125 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.820 109.4 52.0 -76.0 -32.3 121.8 -53.9 334.0 103 103 A A H > S+ 0 0 30 2,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.880 114.7 41.0 -70.9 -39.5 122.6 -57.6 333.7 104 104 A V H X S+ 0 0 1 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.829 113.5 54.3 -76.9 -33.2 123.5 -57.3 330.0 105 105 A A H X S+ 0 0 56 -4,-1.7 4,-1.4 -5,-0.2 -2,-0.2 0.873 110.0 46.8 -67.5 -38.0 125.3 -54.0 330.6 106 106 A S H X S+ 0 0 80 -4,-1.8 4,-1.7 2,-0.2 -1,-0.2 0.887 111.8 50.3 -70.7 -40.0 127.5 -55.6 333.3 107 107 A H H X S+ 0 0 10 -4,-1.5 4,-2.5 1,-0.2 -2,-0.2 0.845 108.7 53.0 -66.4 -34.4 128.2 -58.6 331.1 108 108 A A H < S+ 0 0 25 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.844 107.8 51.3 -69.3 -33.8 129.2 -56.3 328.3 109 109 A Y H >< S+ 0 0 187 -4,-1.4 3,-0.6 1,-0.2 -2,-0.2 0.845 114.1 43.1 -70.9 -35.2 131.6 -54.5 330.6 110 110 A N H 3< S+ 0 0 78 -4,-1.7 4,-0.4 1,-0.2 3,-0.3 0.873 105.7 62.6 -76.6 -38.8 133.2 -57.8 331.6 111 111 A I T 3< S+ 0 0 7 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.405 81.0 105.8 -67.3 4.2 133.3 -59.1 328.0 112 112 A T S < S+ 0 0 92 -3,-0.6 -1,-0.2 1,-0.2 -2,-0.1 0.950 80.6 25.0 -55.1 -76.0 135.6 -56.2 327.1 113 113 A S S S+ 0 0 95 -3,-0.3 -1,-0.2 638,-0.1 -2,-0.1 0.854 90.0 133.3 -62.7 -32.8 139.2 -57.3 326.6 114 114 A W - 0 0 15 -4,-0.4 2,-0.6 1,-0.1 -3,-0.0 0.278 52.8-138.5 -21.0 125.8 138.1 -60.8 325.7 115 115 A R - 0 0 160 636,-0.1 2,-1.3 2,-0.0 636,-0.1 -0.855 7.1-147.9 -97.0 124.1 139.8 -62.3 322.6 116 116 A W + 0 0 6 -2,-0.6 2,-0.5 634,-0.1 635,-0.2 -0.565 28.1 170.1 -95.1 72.8 137.3 -64.2 320.5 117 117 A Y - 0 0 38 -2,-1.3 2,-0.5 633,-0.1 210,-0.3 -0.724 8.1-179.0 -87.0 124.2 139.5 -66.9 319.0 118 118 A D + 0 0 0 -2,-0.5 -49,-2.0 208,-0.1 2,-0.3 -0.922 19.1 140.7-129.9 107.1 137.7 -69.6 317.1 119 119 A N B +M 326 0G 0 207,-1.3 207,-2.6 -2,-0.5 3,-0.3 -0.850 11.7 165.3-149.1 106.9 139.7 -72.5 315.6 120 120 A H > + 0 0 0 -2,-0.3 4,-3.1 205,-0.2 5,-0.3 0.346 51.2 104.6-103.1 4.6 138.4 -76.1 315.6 121 121 A V H > S+ 0 0 0 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.825 80.8 51.9 -54.6 -34.7 140.9 -77.4 313.0 122 122 A A H > S+ 0 0 0 201,-0.3 4,-1.1 -3,-0.3 -1,-0.2 0.894 114.6 40.3 -71.0 -41.4 142.9 -79.1 315.7 123 123 A L H > S+ 0 0 0 -3,-0.3 4,-2.4 2,-0.2 3,-0.3 0.922 114.6 51.3 -73.1 -46.1 140.0 -80.9 317.3 124 124 A L H X S+ 0 0 1 -4,-3.1 4,-2.0 1,-0.2 5,-0.2 0.866 105.7 58.7 -58.1 -36.2 138.4 -81.8 314.0 125 125 A M H X S+ 0 0 3 -4,-1.5 4,-2.3 -5,-0.3 -1,-0.2 0.898 108.6 44.2 -59.7 -42.6 141.7 -83.2 313.0 126 126 A N H X S+ 0 0 1 -4,-1.1 4,-3.1 -3,-0.3 5,-0.3 0.937 111.0 51.6 -68.9 -49.5 141.7 -85.6 315.9 127 127 A M H X S+ 0 0 0 -4,-2.4 4,-0.6 1,-0.2 -1,-0.2 0.843 114.7 45.3 -57.3 -35.4 138.1 -86.7 315.5 128 128 A L H X S+ 0 0 13 -4,-2.0 4,-1.8 -5,-0.2 3,-0.4 0.942 116.5 41.8 -74.9 -50.1 138.8 -87.5 311.9 129 129 A R H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.829 111.7 56.2 -67.4 -31.7 142.1 -89.3 312.3 130 130 A A H X S+ 0 0 0 -4,-3.1 4,-1.6 1,-0.2 -1,-0.2 0.781 106.0 53.4 -69.1 -25.5 140.7 -91.1 315.4 131 131 A Y H X S+ 0 0 29 -4,-0.6 4,-2.5 -3,-0.4 -2,-0.2 0.911 106.6 49.6 -73.1 -44.8 137.9 -92.3 313.0 132 132 A H H X S+ 0 0 2 -4,-1.8 4,-1.4 1,-0.2 -2,-0.2 0.899 111.6 50.8 -59.5 -41.1 140.4 -93.7 310.5 133 133 A L H X S+ 0 0 8 -4,-2.1 4,-1.7 1,-0.2 -1,-0.2 0.860 110.7 47.3 -65.5 -38.2 142.1 -95.4 313.4 134 134 A Q H X S+ 0 0 21 -4,-1.6 4,-2.4 2,-0.2 -1,-0.2 0.858 107.3 57.4 -71.8 -35.6 138.9 -97.0 314.6 135 135 A V H X S+ 0 0 15 -4,-2.5 4,-1.5 1,-0.2 -1,-0.2 0.847 108.5 46.8 -62.9 -34.6 138.0 -98.0 311.1 136 136 A L H <>S+ 0 0 18 -4,-1.4 5,-3.3 2,-0.2 6,-0.8 0.873 113.3 46.8 -75.2 -38.5 141.3 -100.0 311.0 137 137 A T H <5S+ 0 0 19 -4,-1.7 3,-0.3 4,-0.3 -2,-0.2 0.823 112.1 53.4 -70.1 -30.3 140.6 -101.6 314.4 138 138 A E H <5S+ 0 0 90 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.838 109.7 46.0 -71.5 -35.0 137.1 -102.3 313.1 139 139 A Q T <5S- 0 0 76 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.465 117.2-116.0 -85.7 -2.6 138.5 -104.0 310.1 140 140 A G T 5S+ 0 0 59 -3,-0.3 -3,-0.2 -4,-0.3 -2,-0.1 0.703 89.8 111.4 74.9 19.6 140.9 -105.9 312.3 141 141 A Q < + 0 0 32 -5,-3.3 2,-0.5 -6,-0.2 -118,-0.3 0.217 36.5 124.0-108.1 12.4 143.8 -104.2 310.6 142 142 A Y + 0 0 16 -6,-0.8 2,-0.2 28,-0.3 -9,-0.0 -0.646 33.6 141.6 -78.4 121.5 144.9 -102.0 313.5 143 143 A S - 0 0 23 -2,-0.5 83,-0.1 3,-0.0 23,-0.1 -0.730 65.4 -91.2-142.3-169.8 148.6 -102.6 314.4 144 144 A A - 0 0 0 21,-0.6 82,-1.6 -2,-0.2 19,-0.1 0.552 68.2-127.4 -87.8 -9.2 151.7 -100.8 315.5 145 145 A G - 0 0 0 20,-0.2 -121,-0.3 80,-0.2 2,-0.3 0.279 28.6-162.6 78.6 153.2 152.8 -100.2 311.9 146 146 A D - 0 0 53 -123,-1.3 -90,-0.2 18,-0.1 -91,-0.1 -0.981 20.0-110.1-167.2 159.1 156.0 -101.0 310.1 147 147 A I - 0 0 20 12,-0.4 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10.8-139.8 -58.7 135.5 163.7 -52.3 291.4 997 345 B A H > S+ 0 0 11 281,-2.0 4,-1.2 1,-0.2 -1,-0.1 0.758 104.8 49.3 -66.5 -25.8 164.5 -54.0 288.1 998 346 B T H > S+ 0 0 20 280,-0.3 4,-2.4 2,-0.2 5,-0.2 0.901 106.6 52.6 -79.7 -44.3 168.2 -53.6 288.9 999 347 B A H > S+ 0 0 0 1,-0.2 4,-1.5 2,-0.2 -2,-0.2 0.764 111.9 48.9 -62.4 -25.3 168.0 -55.0 292.4 1000 348 B L H X S+ 0 0 19 -4,-1.3 4,-2.6 2,-0.2 -1,-0.2 0.856 107.2 53.9 -81.3 -38.5 166.3 -58.0 290.9 1001 349 B E H X S+ 0 0 50 -4,-1.2 4,-1.3 1,-0.2 -2,-0.2 0.927 114.5 41.4 -59.9 -47.0 168.9 -58.4 288.2 1002 350 B D H X S+ 0 0 4 -4,-2.4 4,-4.2 2,-0.2 5,-0.4 0.890 113.0 52.5 -69.3 -42.2 171.7 -58.5 290.8 1003 351 B W H X S+ 0 0 9 -4,-1.5 4,-1.7 1,-0.2 5,-0.2 0.921 113.8 43.7 -60.6 -43.7 169.8 -60.7 293.2 1004 352 B S H X S+ 0 0 32 -4,-2.6 4,-0.8 2,-0.2 -1,-0.2 0.779 119.9 45.2 -71.1 -26.3 169.2 -63.2 290.5 1005 353 B A H X S+ 0 0 1 -4,-1.3 4,-2.8 -5,-0.2 -2,-0.2 0.931 117.0 39.2 -81.8 -51.7 172.8 -62.8 289.4 1006 354 B I H < S+ 0 0 8 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-0.079 68.0 138.5 -88.7 34.4 186.6 -25.0 288.2 1045 393 B S T 3 + 0 0 81 1,-0.3 -1,-0.2 -2,-0.1 -10,-0.1 0.484 49.0 88.1 -59.7 -0.3 184.4 -25.8 285.2 1046 394 B Y T 3 S- 0 0 28 -11,-0.3 251,-0.3 -3,-0.2 -1,-0.3 0.606 79.8-148.5 -77.0 -11.6 184.8 -29.5 285.9 1047 395 B E < + 0 0 101 -3,-1.5 250,-0.8 249,-0.2 3,-0.3 0.904 37.7 156.7 42.7 62.8 181.8 -29.7 288.3 1048 396 B D > + 0 0 11 -4,-0.2 3,-2.6 1,-0.2 4,-0.2 0.252 29.6 127.1 -94.4 10.7 183.2 -32.5 290.5 1049 397 B G G > + 0 0 31 1,-0.3 3,-0.7 2,-0.1 4,-0.3 0.506 54.2 73.7 -46.7 -8.0 180.8 -31.1 293.1 1050 398 B A G > S+ 0 0 9 -3,-0.3 3,-0.7 1,-0.2 -1,-0.3 0.775 74.3 78.0 -80.0 -26.7 179.3 -34.6 293.6 1051 399 B F G < S+ 0 0 0 -3,-2.6 -1,-0.2 1,-0.2 -2,-0.1 0.610 82.3 73.4 -57.9 -10.5 182.3 -35.9 295.5 1052 400 B L G < S+ 0 0 108 -3,-0.7 -1,-0.2 -4,-0.2 -2,-0.2 0.974 79.1 73.2 -69.3 -57.2 180.9 -33.9 298.5 1053 401 B Q S <> S- 0 0 96 -3,-0.7 4,-1.4 -4,-0.3 3,-0.0 -0.414 79.0-138.7 -63.6 128.2 178.0 -36.2 299.4 1054 402 B P H > S+ 0 0 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287.0 1064 412 B C H < S+ 0 0 0 -4,-0.9 -1,-0.2 -5,-0.2 -2,-0.2 0.866 113.5 35.6 -80.5 -38.8 185.6 -40.4 286.8 1065 413 B C H < S+ 0 0 6 -4,-1.6 2,-0.4 -3,-0.2 -2,-0.2 0.662 125.8 37.6 -88.7 -18.8 188.0 -43.1 285.8 1066 414 B T S < S- 0 0 22 -4,-2.0 226,-0.2 2,-0.2 4,-0.2 -0.992 74.0-129.2-137.0 143.6 185.6 -45.0 283.6 1067 415 B G S S+ 0 0 44 61,-0.4 225,-0.2 -2,-0.4 -4,-0.1 0.536 76.2 119.8 -65.1 -3.2 182.8 -44.0 281.2 1068 416 B Q S S- 0 0 47 -6,-0.2 2,-1.1 1,-0.1 224,-0.2 -0.283 75.5-115.0 -63.5 147.1 180.7 -46.5 283.2 1069 417 B D - 0 0 66 222,-0.1 222,-0.2 1,-0.0 -1,-0.1 -0.754 35.3-126.6 -88.4 100.4 177.6 -45.2 285.0 1070 418 B A E -T 1290 0a 0 220,-1.4 220,-1.1 -2,-1.1 2,-0.2 -0.234 23.7-117.3 -52.1 120.6 178.5 -45.8 288.7 1071 419 B P E -T 1289 0a 10 0, 0.0 218,-0.2 0, 0.0 -1,-0.1 -0.397 27.3-131.9 -64.6 124.5 175.7 -47.8 290.5 1072 420 B L - 0 0 2 216,-1.8 -16,-0.1 -2,-0.2 215,-0.1 -0.050 20.8-109.3 -67.5 176.4 174.0 -45.9 293.3 1073 421 B N - 0 0 1 2,-0.2 -127,-0.2 5,-0.1 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303.0 1083 431 B P G > S+ 0 0 72 0, 0.0 3,-1.1 0, 0.0 4,-0.2 0.688 76.6 73.4 -60.5 -18.7 185.9 -38.1 304.5 1084 432 B D G 3 S+ 0 0 127 1,-0.3 -114,-0.0 2,-0.1 -2,-0.0 0.296 98.7 46.8 -80.0 11.2 189.6 -37.4 304.9 1085 433 B L G < + 0 0 6 -3,-1.5 -1,-0.3 5,-0.0 5,-0.1 0.042 67.7 119.4-139.3 25.8 189.9 -36.9 301.2 1086 434 B L S < S+ 0 0 69 -3,-1.1 2,-0.9 1,-0.2 -2,-0.1 0.825 73.0 62.9 -61.9 -32.0 186.9 -34.6 300.5 1087 435 B E S > S- 0 0 133 -4,-0.2 3,-3.6 1,-0.1 28,-0.2 -0.847 80.7-151.4 -98.5 102.5 189.5 -32.0 299.2 1088 436 B F T 3 S+ 0 0 50 -2,-0.9 28,-0.2 1,-0.3 -1,-0.1 0.619 97.0 64.1 -48.9 -14.9 191.1 -33.7 296.2 1089 437 B D T 3 S+ 0 0 106 26,-0.1 -1,-0.3 25,-0.1 26,-0.1 0.347 81.1 151.4 -90.7 6.4 194.2 -31.6 297.0 1090 438 B A < - 0 0 10 -3,-3.6 25,-2.1 24,-0.2 2,-0.2 -0.059 35.8-145.7 -45.0 125.8 194.3 -33.7 300.2 1091 439 B V E -V 1114 0b 108 23,-0.3 2,-0.3 21,-0.0 23,-0.2 -0.649 18.1-177.9 -96.1 151.3 197.8 -34.2 301.7 1092 440 B T E -V 1113 0b 24 21,-2.6 21,-2.7 -2,-0.2 2,-0.2 -0.995 15.8-139.2-149.4 151.3 198.9 -37.4 303.6 1093 441 B Q - 0 0 71 -2,-0.3 19,-0.2 19,-0.2 17,-0.1 -0.622 12.3-155.3-106.6 167.4 202.0 -38.7 305.4 1094 442 B V - 0 0 0 -2,-0.2 17,-2.4 -127,-0.0 2,-0.2 -0.967 22.0-116.0-149.2 129.8 203.6 -42.1 305.4 1095 443 B P B -W 1110 0c 46 0, 0.0 2,-0.3 0, 0.0 15,-0.2 -0.445 44.1-175.1 -64.9 126.4 205.8 -44.0 307.9 1096 444 B I - 0 0 17 13,-2.9 -287,-0.1 -2,-0.2 2,-0.1 -0.826 26.2-163.1-126.7 163.5 209.2 -44.7 306.3 1097 445 B T - 0 0 55 -289,-0.7 2,-0.3 -2,-0.3 12,-0.1 0.138 41.1 -93.5-109.2-134.2 212.5 -46.4 307.0 1098 446 B V + 0 0 99 -2,-0.1 2,-0.2 -292,-0.1 -290,-0.1 -0.991 47.9 144.2-156.1 153.6 215.6 -45.5 305.0 1099 447 B I S S- 0 0 54 -2,-0.3 -292,-0.8 -292,-0.1 3,-0.2 -0.667 79.0 -37.7 178.6 131.7 217.6 -46.5 302.0 1100 448 B E - 0 0 138 -2,-0.2 2,-0.4 1,-0.2 -293,-0.1 0.509 67.3-119.0 -6.2 109.4 219.3 -43.8 299.9 1101 449 B P + 0 0 105 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 -0.469 48.5 157.7 -63.8 116.7 217.1 -40.7 299.7 1102 450 B A - 0 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