==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 28-JUL-09 3IGO . COMPND 2 MOLECULE: CALMODULIN-DOMAIN PROTEIN KINASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: CRYPTOSPORIDIUM PARVUM; . AUTHOR A.K.WERNIMONT,J.D.ARTZ,P.FINNERTY,M.AMANI,A.ALLALI-HASSANALI . 446 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20993.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 307 68.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 43 9.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 2 0.4 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 . 27 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 53 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 170 38.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 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 2 1 3 0 2 0 3 2 1 1 1 1 1 1 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 4 0 1 0 1 2 1 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 . 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 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 69 A Q 0 0 116 0, 0.0 2,-0.3 0, 0.0 73,-0.1 0.000 360.0 360.0 360.0-145.4 36.3 26.5 11.4 2 70 A G - 0 0 21 73,-0.3 73,-1.3 70,-0.0 2,-1.0 -0.999 360.0-110.6-155.2 160.2 39.0 23.9 10.4 3 71 A T > - 0 0 70 -2,-0.3 4,-1.0 1,-0.2 3,-0.2 -0.768 31.6-177.3 -90.2 98.6 41.7 22.6 8.0 4 72 A F H >> S+ 0 0 4 -2,-1.0 4,-2.5 1,-0.2 3,-0.6 0.911 74.9 54.4 -56.7 -49.5 40.1 19.5 6.5 5 73 A A H 34 S+ 0 0 57 1,-0.3 -1,-0.2 2,-0.2 -2,-0.0 0.818 103.2 53.8 -65.9 -35.4 43.1 18.4 4.3 6 74 A E H 34 S+ 0 0 98 -3,-0.2 -1,-0.3 1,-0.2 -2,-0.2 0.859 118.1 37.9 -61.5 -35.1 45.7 18.3 7.1 7 75 A R H << S+ 0 0 33 -4,-1.0 21,-2.7 -3,-0.6 22,-0.3 0.840 119.8 28.3 -90.4 -39.9 43.4 16.0 9.1 8 76 A Y E < -A 27 0A 8 -4,-2.5 2,-0.4 19,-0.2 19,-0.2 -0.913 55.5-149.2-127.1 149.8 41.8 13.6 6.6 9 77 A N E -A 26 0A 43 17,-2.3 17,-2.5 -2,-0.3 2,-0.4 -0.914 30.5-117.0-110.4 149.9 42.4 12.0 3.3 10 78 A I E +A 25 0A 94 -2,-0.4 15,-0.3 15,-0.2 3,-0.1 -0.704 30.8 177.9 -83.6 128.9 39.6 11.2 1.0 11 79 A V E - 0 0 64 13,-3.6 2,-0.3 -2,-0.4 14,-0.2 0.848 56.3 -37.8 -99.0 -49.8 39.3 7.5 0.3 12 80 A C E -A 24 0A 53 12,-1.3 12,-3.6 0, 0.0 -1,-0.4 -0.983 60.3 -81.8-165.6 167.8 36.2 7.2 -1.9 13 81 A M E +A 23 0A 91 -2,-0.3 10,-0.2 10,-0.3 3,-0.1 -0.533 34.8 175.2 -68.8 136.3 32.7 8.4 -2.8 14 82 A L E - 0 0 87 8,-3.0 2,-0.3 1,-0.4 9,-0.2 0.701 60.0 -29.3-109.9 -38.0 30.0 6.9 -0.7 15 83 A G E -A 22 0A 29 7,-2.2 7,-3.9 2,-0.0 -1,-0.4 -0.979 46.2-134.7-173.2 160.9 26.9 8.7 -1.9 16 84 A K E +A 21 0A 156 -2,-0.3 5,-0.2 5,-0.3 2,-0.2 -0.970 22.3 175.7-134.7 118.6 25.5 11.9 -3.4 17 85 A G - 0 0 48 3,-2.3 145,-0.1 -2,-0.4 -2,-0.0 -0.472 49.2 -93.0-102.1-173.4 22.4 13.6 -2.2 18 86 A S S S+ 0 0 35 1,-0.2 144,-0.1 -2,-0.2 3,-0.1 0.708 122.6 49.8 -73.1 -22.4 20.9 16.9 -3.3 19 87 A F S S- 0 0 23 1,-0.3 21,-0.3 141,-0.2 2,-0.3 0.831 126.7 -47.2 -84.5 -39.2 22.7 18.9 -0.5 20 88 A G - 0 0 15 19,-0.1 -3,-2.3 24,-0.0 2,-0.3 -0.962 63.7 -76.7-175.0-177.1 26.2 17.6 -1.1 21 89 A E E -AB 16 38A 70 17,-1.2 17,-2.8 -2,-0.3 2,-0.5 -0.771 33.8-137.2-101.8 150.2 28.2 14.4 -1.7 22 90 A V E -AB 15 37A 38 -7,-3.9 -8,-3.0 -2,-0.3 -7,-2.2 -0.939 25.8-175.7-110.1 126.7 29.2 12.0 1.1 23 91 A L E -AB 13 36A 16 13,-3.0 13,-3.2 -2,-0.5 2,-0.5 -0.838 28.3-119.1-120.2 150.8 32.7 10.6 1.0 24 92 A K E -AB 12 35A 51 -12,-3.6 -13,-3.6 -2,-0.3 -12,-1.3 -0.812 39.9-178.7 -84.3 131.0 34.7 8.1 3.0 25 93 A C E -AB 10 34A 0 9,-3.0 9,-2.6 -2,-0.5 2,-0.4 -0.933 17.6-143.5-133.2 155.9 37.6 9.8 4.7 26 94 A K E -AB 9 33A 44 -17,-2.5 -17,-2.3 -2,-0.3 2,-0.5 -0.974 21.6-119.3-127.4 130.7 40.4 8.6 6.9 27 95 A D E > -A 8 0A 4 5,-2.6 4,-2.7 -2,-0.4 -19,-0.2 -0.589 23.8-140.0 -67.4 120.6 42.1 10.3 9.8 28 96 A R T 4 S+ 0 0 124 -21,-2.7 -1,-0.1 -2,-0.5 -20,-0.1 0.668 96.4 33.4 -58.4 -23.5 45.7 10.7 8.8 29 97 A I T 4 S+ 0 0 42 -22,-0.3 -1,-0.2 3,-0.1 366,-0.1 0.843 127.3 33.2-101.8 -46.6 47.0 9.9 12.3 30 98 A T T 4 S- 0 0 15 2,-0.1 -2,-0.2 364,-0.1 3,-0.1 0.653 87.8-138.2 -88.5 -17.3 44.5 7.3 13.7 31 99 A Q < + 0 0 101 -4,-2.7 2,-0.1 1,-0.2 -3,-0.1 0.474 53.4 147.6 65.2 5.3 43.7 5.6 10.4 32 100 A Q - 0 0 28 -5,-0.2 -5,-2.6 -6,-0.1 2,-0.3 -0.450 44.7-125.9 -74.3 142.7 40.1 5.6 11.7 33 101 A E E +B 26 0A 99 -7,-0.2 53,-0.5 -2,-0.1 2,-0.3 -0.685 30.4 174.2-100.5 148.3 37.4 5.9 9.0 34 102 A Y E -B 25 0A 10 -9,-2.6 -9,-3.0 -2,-0.3 2,-0.5 -0.949 31.0-118.6-148.4 152.6 34.6 8.5 8.8 35 103 A A E -BC 24 84A 17 49,-2.6 49,-3.3 -2,-0.3 2,-0.5 -0.879 31.0-164.3 -98.5 133.8 31.8 9.7 6.5 36 104 A V E -BC 23 83A 0 -13,-3.2 -13,-3.0 -2,-0.5 2,-0.6 -0.977 12.2-152.3-124.7 124.1 32.1 13.3 5.3 37 105 A K E -BC 22 82A 40 45,-2.7 45,-3.1 -2,-0.5 2,-0.6 -0.853 14.0-156.3 -90.0 124.7 29.4 15.4 3.8 38 106 A V E -BC 21 81A 18 -17,-2.8 -17,-1.2 -2,-0.6 2,-0.5 -0.896 10.0-172.3-103.6 118.6 30.9 18.0 1.5 39 107 A I E - C 0 80A 0 41,-2.6 41,-2.5 -2,-0.6 2,-0.2 -0.955 23.6-127.7-117.7 118.1 28.7 21.0 1.0 40 108 A N E > - C 0 79A 65 -2,-0.5 4,-1.2 -21,-0.3 5,-0.4 -0.411 14.1-149.3 -63.1 127.9 29.6 23.7 -1.6 41 109 A K H > S+ 0 0 34 37,-3.0 4,-1.9 3,-0.2 -1,-0.1 0.914 90.6 38.9 -65.0 -43.1 29.6 27.1 0.1 42 110 A A H 4 S+ 0 0 96 36,-0.5 -1,-0.2 2,-0.2 37,-0.1 0.763 119.6 42.1 -86.5 -31.3 28.6 29.1 -3.0 43 111 A S H 4 S+ 0 0 102 1,-0.1 -1,-0.2 115,-0.0 -2,-0.2 0.788 130.2 26.5 -78.1 -29.0 26.1 26.8 -4.7 44 112 A A H < S+ 0 0 6 -4,-1.2 115,-2.3 114,-0.1 -2,-0.2 0.778 81.1 112.7-111.8 -37.3 24.5 25.9 -1.4 45 113 A K B < +E 158 0B 81 -4,-1.9 113,-0.2 -5,-0.4 112,-0.1 -0.127 25.3 168.7 -50.8 139.4 24.7 28.5 1.4 46 114 A N 0 0 81 111,-2.1 112,-0.2 112,-0.0 -1,-0.2 0.333 360.0 360.0-131.5 -5.3 21.4 30.0 2.2 47 115 A K 0 0 124 110,-0.6 4,-0.3 0, 0.0 3,-0.3 0.362 360.0 360.0-148.1 360.0 22.5 31.8 5.3 48 ! 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 49 117 A T > 0 0 35 0, 0.0 4,-1.5 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -14.6 28.4 31.0 7.5 50 118 A S H > + 0 0 101 -3,-0.3 4,-1.2 2,-0.2 5,-0.0 0.779 360.0 47.5 -76.4 -30.5 27.9 32.1 11.2 51 119 A T H > S+ 0 0 52 -4,-0.3 4,-2.0 2,-0.2 5,-0.2 0.844 112.3 51.9 -76.4 -37.3 24.2 31.0 11.3 52 120 A I H > S+ 0 0 1 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.903 106.1 52.7 -61.2 -47.5 25.2 27.7 9.7 53 121 A L H X S+ 0 0 50 -4,-1.5 4,-2.0 1,-0.2 -1,-0.2 0.879 108.4 52.9 -60.5 -36.8 27.9 27.2 12.4 54 122 A R H X S+ 0 0 165 -4,-1.2 4,-1.7 2,-0.2 -2,-0.2 0.962 112.2 41.7 -62.2 -54.6 25.2 27.7 15.1 55 123 A E H X S+ 0 0 50 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.860 113.4 52.9 -65.7 -35.3 22.7 25.2 13.8 56 124 A V H X S+ 0 0 3 -4,-2.6 4,-2.7 2,-0.2 -1,-0.2 0.893 104.5 57.5 -66.5 -36.5 25.5 22.6 13.0 57 125 A E H X S+ 0 0 86 -4,-2.0 4,-1.9 -5,-0.2 -2,-0.2 0.937 106.0 49.1 -56.1 -46.1 26.6 23.0 16.6 58 126 A L H < S+ 0 0 88 -4,-1.7 4,-0.4 1,-0.2 -2,-0.2 0.898 112.1 48.0 -60.1 -43.7 23.2 22.0 17.7 59 127 A L H >< S+ 0 0 12 -4,-2.1 3,-1.0 1,-0.2 11,-0.3 0.867 108.1 57.8 -59.7 -37.8 23.3 19.0 15.3 60 128 A K H 3< S+ 0 0 54 -4,-2.7 10,-0.3 1,-0.2 -2,-0.2 0.898 101.3 53.6 -63.9 -40.5 26.8 18.2 16.7 61 129 A K T 3< S+ 0 0 121 -4,-1.9 2,-0.3 -5,-0.2 -1,-0.2 0.518 76.0 118.7 -81.9 -0.4 25.6 17.9 20.3 62 130 A L < - 0 0 12 -3,-1.0 2,-0.4 -4,-0.4 8,-0.3 -0.513 42.1-176.4 -62.7 127.0 22.9 15.3 19.5 63 131 A D + 0 0 27 -2,-0.3 314,-0.5 6,-0.1 6,-0.1 -0.871 26.8 122.4-138.5 89.3 23.9 12.3 21.5 64 132 A H > - 0 0 8 -2,-0.4 3,-2.1 3,-0.3 261,-0.1 -0.957 62.3-123.8-158.4 136.6 21.6 9.3 21.0 65 133 A P T 3 S+ 0 0 12 0, 0.0 4,-0.1 0, 0.0 52,-0.0 0.635 111.1 46.0 -61.6 -16.7 22.3 5.7 19.7 66 134 A N T 3 S+ 0 0 12 82,-0.1 83,-3.6 47,-0.1 2,-0.4 0.261 98.5 83.8-111.6 11.2 19.7 6.0 16.8 67 135 A I B < S-f 149 0C 4 -3,-2.1 -3,-0.3 81,-0.2 83,-0.2 -0.945 90.8 -99.9-115.8 132.9 20.9 9.4 15.5 68 136 A M - 0 0 28 81,-2.4 2,-0.5 -2,-0.4 -2,-0.1 -0.215 40.6-132.6 -42.6 130.5 23.8 10.0 13.1 69 137 A K - 0 0 50 -4,-0.1 16,-2.2 -6,-0.1 2,-0.5 -0.885 17.7-160.2 -95.9 124.0 26.8 11.1 15.2 70 138 A L E -D 84 0A 17 -2,-0.5 14,-0.3 -11,-0.3 3,-0.1 -0.903 11.7-177.3-104.0 130.3 28.7 14.2 14.0 71 139 A F E - 0 0 11 12,-2.7 2,-0.3 -2,-0.5 13,-0.2 0.871 61.7 -17.7 -91.1 -47.5 32.2 14.8 15.2 72 140 A E E -D 83 0A 24 11,-1.4 11,-2.9 2,-0.0 2,-0.5 -0.990 43.9-132.7-154.9 163.2 33.1 18.1 13.5 73 141 A I E -D 82 0A 31 -2,-0.3 2,-0.2 9,-0.2 9,-0.2 -0.990 29.8-176.5-118.3 124.0 32.4 20.7 10.9 74 142 A L E -D 81 0A 4 7,-3.0 7,-2.7 -2,-0.5 2,-0.4 -0.674 8.9-148.8-111.2 171.6 35.4 21.9 8.9 75 143 A E E +D 80 0A 60 -73,-1.3 -73,-0.3 5,-0.3 5,-0.2 -0.993 13.9 179.1-150.4 133.3 35.7 24.6 6.3 76 144 A D - 0 0 63 3,-2.6 -73,-0.0 -2,-0.4 -74,-0.0 -0.523 53.6 -91.5-105.9-175.6 37.7 25.3 3.2 77 145 A S S S+ 0 0 118 -2,-0.2 3,-0.1 1,-0.2 -2,-0.0 0.763 128.4 30.9 -71.6 -22.9 37.5 28.3 0.8 78 146 A S S S+ 0 0 55 1,-0.1 -37,-3.0 -37,-0.1 -36,-0.5 0.700 121.6 23.8-103.6 -24.8 35.0 26.2 -1.3 79 147 A S E -C 40 0A 8 -39,-0.3 -3,-2.6 -38,-0.1 2,-0.4 -0.926 54.1-127.5-147.9 155.7 33.2 23.9 1.2 80 148 A F E -CD 39 75A 5 -41,-2.5 -41,-2.6 -2,-0.3 2,-0.5 -0.886 28.6-153.6 -96.5 142.7 31.9 22.9 4.6 81 149 A Y E -CD 38 74A 20 -7,-2.7 -7,-3.0 -2,-0.4 2,-0.8 -0.969 4.1-163.4-121.6 111.8 32.9 19.3 5.6 82 150 A I E -CD 37 73A 13 -45,-3.1 -45,-2.7 -2,-0.5 2,-0.5 -0.875 11.7-158.7-100.1 109.7 30.6 17.6 8.0 83 151 A V E +CD 36 72A 0 -11,-2.9 -12,-2.7 -2,-0.8 -11,-1.4 -0.805 24.0 151.8 -95.9 125.3 32.5 14.7 9.5 84 152 A G E -CD 35 70A 6 -49,-3.3 -49,-2.6 -2,-0.5 -14,-0.2 -0.834 46.8 -60.2-143.2 178.8 30.5 11.9 11.1 85 153 A E - 0 0 29 -16,-2.2 2,-0.5 -2,-0.3 -51,-0.2 -0.332 48.2-127.6 -64.5 137.0 30.3 8.2 11.9 86 154 A L - 0 0 26 -53,-0.5 2,-0.4 -2,-0.1 -1,-0.1 -0.807 23.0-164.5 -90.7 123.3 30.6 5.9 9.0 87 155 A Y - 0 0 23 -2,-0.5 53,-0.2 1,-0.1 52,-0.2 -0.908 9.3-175.0-110.1 139.9 27.7 3.3 8.9 88 156 A T + 0 0 87 51,-1.9 52,-0.2 -2,-0.4 51,-0.2 0.284 61.7 85.4-121.3 5.2 28.1 0.2 6.6 89 157 A G S S- 0 0 8 49,-2.4 50,-0.2 1,-0.2 51,-0.1 0.492 83.8-138.0 -83.2 -6.8 24.8 -1.7 6.8 90 158 A G - 0 0 32 48,-0.5 48,-3.4 49,-0.1 -1,-0.2 -0.220 44.5 -25.4 71.0-169.2 23.1 0.4 4.1 91 159 A E B >> -G 137 0C 71 46,-0.3 3,-1.1 1,-0.1 4,-1.0 -0.409 46.7-127.0 -80.7 148.6 19.5 1.6 4.1 92 160 A L H 3> S+ 0 0 3 44,-3.1 4,-1.9 41,-1.0 3,-0.2 0.826 109.8 72.2 -57.5 -28.3 16.6 0.2 6.1 93 161 A F H 3> S+ 0 0 70 40,-1.2 4,-1.8 43,-0.4 -1,-0.3 0.863 93.4 50.1 -54.7 -42.3 15.0 0.2 2.7 94 162 A D H <> S+ 0 0 68 -3,-1.1 4,-2.5 1,-0.2 -1,-0.2 0.858 106.8 54.8 -67.1 -36.9 17.2 -2.7 1.4 95 163 A E H X S+ 0 0 40 -4,-1.0 4,-2.7 -3,-0.2 5,-0.2 0.865 106.8 51.5 -64.8 -37.0 16.4 -4.8 4.5 96 164 A I H X S+ 0 0 16 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.907 110.4 48.2 -64.5 -43.0 12.6 -4.3 3.7 97 165 A I H < S+ 0 0 97 -4,-1.8 -2,-0.2 2,-0.2 -1,-0.2 0.942 116.2 44.2 -62.7 -47.1 13.1 -5.5 0.1 98 166 A K H < S+ 0 0 102 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.942 124.0 32.6 -61.6 -52.7 15.2 -8.5 1.2 99 167 A R H < S- 0 0 135 -4,-2.7 2,-2.4 -5,-0.2 -2,-0.2 0.684 86.6-154.3 -83.1 -17.3 12.9 -9.6 4.1 100 168 A K S < S- 0 0 155 -4,-2.2 2,-0.3 -5,-0.2 -1,-0.1 -0.286 72.0 -4.8 72.6 -54.0 9.6 -8.4 2.4 101 169 A R S S- 0 0 116 -2,-2.4 2,-0.3 -3,-0.1 93,-0.2 -0.962 74.7-123.4-164.5 168.6 8.0 -8.0 5.8 102 170 A F - 0 0 18 91,-3.1 94,-0.0 -2,-0.3 -6,-0.0 -0.790 23.0-104.9-124.9 151.7 8.9 -8.6 9.4 103 171 A S > - 0 0 61 -2,-0.3 4,-2.8 1,-0.1 5,-0.2 -0.227 43.0-106.4 -61.9 162.7 7.5 -10.5 12.4 104 172 A E H > S+ 0 0 28 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.925 123.4 53.5 -55.8 -43.9 5.9 -8.4 15.1 105 173 A H H > S+ 0 0 86 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.913 113.5 41.0 -55.6 -47.0 8.9 -9.0 17.3 106 174 A D H > S+ 0 0 71 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.862 114.7 50.4 -76.2 -38.0 11.3 -7.8 14.6 107 175 A A H X S+ 0 0 0 -4,-2.8 4,-2.9 2,-0.2 5,-0.2 0.867 110.6 51.0 -62.7 -38.7 9.2 -4.8 13.4 108 176 A A H X S+ 0 0 0 -4,-2.3 4,-2.3 -5,-0.2 -2,-0.2 0.876 109.1 49.7 -70.2 -40.6 8.8 -3.6 17.1 109 177 A R H X S+ 0 0 27 -4,-1.6 4,-1.0 -5,-0.2 -1,-0.2 0.878 115.6 43.7 -62.7 -45.3 12.6 -3.7 17.7 110 178 A I H >X S+ 0 0 24 -4,-1.7 4,-1.5 2,-0.2 3,-0.8 0.979 117.6 42.8 -63.2 -56.7 13.2 -1.8 14.5 111 179 A I H 3X S+ 0 0 0 -4,-2.9 4,-3.2 1,-0.3 5,-0.2 0.833 103.6 65.9 -70.5 -30.1 10.5 0.8 14.9 112 180 A K H 3X S+ 0 0 10 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.3 0.921 104.2 47.7 -51.0 -43.6 11.2 1.3 18.7 113 181 A Q H <>S+ 0 0 0 -4,-2.7 5,-3.1 1,-0.2 3,-0.6 0.903 110.7 50.3 -49.8 -47.4 15.0 15.0 17.9 122 190 A H H ><5S+ 0 0 21 -4,-2.3 3,-2.1 1,-0.3 -1,-0.2 0.883 104.4 56.3 -64.4 -39.6 11.7 16.5 18.9 123 191 A K H 3<5S+ 0 0 138 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.728 109.4 48.9 -64.5 -20.3 12.8 17.1 22.4 124 192 A H T <<5S- 0 0 78 -4,-1.0 -1,-0.3 -3,-0.6 -2,-0.2 0.129 123.0-109.3-101.0 19.4 15.6 19.1 20.8 125 193 A N T < 5S+ 0 0 151 -3,-2.1 2,-0.5 1,-0.2 -3,-0.2 0.808 75.4 136.2 58.3 31.6 13.1 21.0 18.6 126 194 A I < - 0 0 26 -5,-3.1 2,-0.5 -6,-0.1 -1,-0.2 -0.961 36.5-165.6-111.0 123.6 14.3 19.1 15.4 127 195 A V - 0 0 35 -2,-0.5 26,-0.4 1,-0.1 52,-0.1 -0.919 13.3-148.6-100.5 131.2 11.7 17.8 13.0 128 196 A H - 0 0 6 -2,-0.5 25,-0.3 51,-0.1 -1,-0.1 0.955 16.1-170.8 -63.4 -55.2 13.1 15.3 10.4 129 197 A R S S+ 0 0 101 49,-0.1 -1,-0.1 23,-0.1 23,-0.1 0.066 75.8 48.3 83.6 -21.7 10.7 16.3 7.6 130 198 A D + 0 0 61 21,-0.1 2,-0.4 2,-0.1 5,-0.1 -0.189 68.1 168.0-142.3 47.7 11.7 13.3 5.3 131 199 A L + 0 0 0 36,-0.1 58,-0.1 3,-0.1 5,-0.1 -0.508 21.2 141.8 -67.1 120.3 11.6 10.3 7.5 132 200 A K > - 0 0 29 -2,-0.4 3,-1.7 1,-0.0 -40,-0.2 -0.970 66.3-104.6-158.6 156.4 11.8 7.3 5.1 133 201 A P G > S+ 0 0 0 0, 0.0 -40,-1.2 0, 0.0 3,-1.1 0.805 120.6 61.6 -65.9 -23.3 13.5 3.9 5.1 134 202 A E G 3 S+ 0 0 41 1,-0.2 -3,-0.1 -42,-0.2 -40,-0.0 0.749 102.2 51.1 -66.6 -26.7 16.1 5.4 2.7 135 203 A N G < S+ 0 0 11 -3,-1.7 15,-2.7 -5,-0.1 2,-0.4 0.147 96.6 79.3-102.3 16.0 17.1 7.9 5.4 136 204 A I E < - H 0 149C 0 -3,-1.1 -44,-3.1 13,-0.2 -43,-0.4 -0.995 67.1-164.5-117.1 124.6 17.6 5.2 8.1 137 205 A L E -GH 91 148C 33 11,-2.8 11,-3.0 -2,-0.4 2,-0.4 -0.787 21.0-121.5-107.7 151.5 20.9 3.3 7.9 138 206 A L E - 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H 0 137C 10 -11,-3.0 -11,-2.8 -2,-0.3 2,-0.5 -0.975 6.8-137.3-130.7 119.0 20.7 5.3 12.6 149 217 A I E +fH 67 136C 0 -83,-3.6 -81,-2.4 -2,-0.4 -13,-0.2 -0.635 35.3 172.4 -74.3 124.9 18.5 8.2 11.5 150 218 A I + 0 0 37 -15,-2.7 -15,-0.0 -2,-0.5 -1,-0.0 -0.650 36.7 51.4-121.2 175.0 20.3 10.4 8.9 151 219 A D S S+ 0 0 51 -2,-0.2 2,-0.3 1,-0.2 -1,-0.1 0.940 75.5 105.8 67.5 60.0 19.7 13.3 6.5 152 220 A F + 0 0 9 -3,-0.1 -1,-0.2 -23,-0.1 -24,-0.1 -0.960 45.1 54.0-154.0 168.9 18.1 16.1 8.5 153 221 A G S S+ 0 0 22 -26,-0.4 4,-0.3 -2,-0.3 3,-0.2 0.166 84.2 87.2 92.6 -14.7 18.9 19.5 10.0 154 222 A L > + 0 0 10 1,-0.2 4,-1.9 2,-0.1 3,-0.2 0.691 55.5 94.3 -92.8 -15.4 20.2 21.2 6.9 155 223 A S T 4 S+ 0 0 53 1,-0.2 -1,-0.2 2,-0.2 5,-0.1 0.694 86.9 45.0 -60.7 -35.6 17.1 22.7 5.3 156 224 A T T 4 S+ 0 0 70 -3,-0.2 -1,-0.2 1,-0.1 -2,-0.1 0.953 118.9 41.8 -66.5 -51.5 17.1 26.2 6.7 157 225 A C T 4 S+ 0 0 3 -4,-0.3 -111,-2.1 -3,-0.2 -110,-0.6 0.687 116.0 38.3 -73.5 -25.6 20.9 26.7 6.1 158 226 A F B < -E 45 0B 1 -4,-1.9 2,-0.4 -113,-0.2 -113,-0.2 -0.941 67.7-128.7-134.9 150.2 21.3 25.2 2.6 159 227 A Q - 0 0 119 -115,-2.3 -3,-0.1 -2,-0.3 -4,-0.0 -0.829 26.2-147.6 -94.9 136.2 19.6 25.0 -0.7 160 228 A Q - 0 0 96 -2,-0.4 -141,-0.2 1,-0.2 -1,-0.1 -0.067 9.0-165.0 -78.2-172.8 19.2 21.5 -2.3 161 229 A N 0 0 139 1,-0.1 -1,-0.2 -2,-0.0 -143,-0.1 0.034 360.0 360.0-133.1-100.1 19.1 20.6 -5.9 162 230 A T 0 0 159 -144,-0.1 -1,-0.1 -145,-0.1 0, 0.0 -0.907 360.0 360.0-162.4 360.0 17.9 17.2 -7.3 163 ! 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 0.0 164 238 A T > 0 0 65 0, 0.0 3,-1.4 0, 0.0 4,-0.4 0.000 360.0 360.0 360.0 153.6 9.0 9.7 -1.8 165 239 A A G > + 0 0 5 1,-0.2 3,-0.7 2,-0.1 47,-0.0 0.737 360.0 73.8 -54.0 -31.9 5.2 10.0 -1.9 166 240 A Y G 3 S+ 0 0 63 1,-0.2 -1,-0.2 33,-0.0 34,-0.2 0.795 100.5 38.4 -51.8 -35.8 4.5 7.0 0.4 167 241 A Y G < S+ 0 0 10 -3,-1.4 -1,-0.2 2,-0.1 2,-0.2 0.495 82.0 113.8-106.5 -7.4 5.5 8.7 3.7 168 242 A I < - 0 0 46 -3,-0.7 14,-0.1 -4,-0.4 -38,-0.1 -0.454 63.6-124.6 -74.7 131.8 4.4 12.3 3.6 169 243 A A >> - 0 0 0 -2,-0.2 3,-0.9 1,-0.1 4,-0.7 -0.369 25.2-110.9 -68.0 155.5 1.6 13.3 6.0 170 244 A P G >4 S+ 0 0 7 0, 0.0 3,-1.0 0, 0.0 4,-0.3 0.877 116.1 57.5 -54.9 -39.8 -1.6 14.9 4.6 171 245 A E G >4>S+ 0 0 19 1,-0.2 5,-2.0 70,-0.2 3,-1.2 0.722 92.1 67.7 -67.6 -22.7 -0.7 18.4 6.1 172 246 A V G X45S+ 0 0 21 -3,-0.9 3,-1.5 1,-0.3 -1,-0.2 0.810 92.4 62.8 -65.1 -28.4 2.7 18.5 4.2 173 247 A L G <<5S+ 0 0 47 -3,-1.0 -1,-0.3 -4,-0.7 -2,-0.2 0.710 101.9 50.5 -64.4 -22.0 0.5 18.8 1.1 174 248 A R G < 5S- 0 0 158 -3,-1.2 -1,-0.3 -4,-0.3 -2,-0.2 0.230 129.4 -98.6 -98.1 9.3 -0.7 22.1 2.6 175 249 A G T < 5S+ 0 0 60 -3,-1.5 2,-0.3 1,-0.3 -3,-0.2 0.384 82.4 128.1 92.6 -4.1 2.8 23.3 3.2 176 250 A T < + 0 0 71 -5,-2.0 -1,-0.3 1,-0.0 -2,-0.2 -0.644 30.2 177.6 -95.0 146.4 3.1 22.4 6.9 177 251 A Y + 0 0 92 -2,-0.3 2,-0.2 -5,-0.1 -50,-0.1 -0.590 22.2 151.4-146.4 67.9 6.0 20.3 8.5 178 252 A D >> - 0 0 69 -2,-0.1 3,-2.2 -49,-0.0 4,-0.6 -0.462 64.4 -85.3 -98.0 177.9 5.5 20.1 12.3 179 253 A E H >> S+ 0 0 75 1,-0.3 4,-0.9 2,-0.2 3,-0.5 0.748 123.5 66.0 -59.0 -23.8 6.7 17.2 14.6 180 254 A K H 3> S+ 0 0 24 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.783 87.8 66.8 -68.5 -27.8 3.5 15.3 13.9 181 255 A C H <> S+ 0 0 2 -3,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.883 99.5 52.0 -63.6 -34.4 4.5 14.8 10.2 182 256 A D H S- 0 0 82 -3,-0.1 4,-2.6 1,-0.0 3,-0.2 -0.845 84.8 -78.4-144.6 177.7 1.7 6.0 -9.7 205 279 A E H > S+ 0 0 124 -2,-0.3 4,-2.9 1,-0.2 5,-0.3 0.862 122.2 59.5 -48.5 -45.7 2.4 9.2 -7.8 206 280 A Y H > S+ 0 0 164 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.951 112.0 38.5 -49.6 -57.0 -0.8 10.8 -9.0 207 281 A D H > S+ 0 0 46 -3,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.868 113.9 55.4 -65.1 -39.7 -3.0 8.0 -7.4 208 282 A I H X S+ 0 0 10 -4,-2.6 4,-2.5 1,-0.2 3,-0.5 0.962 107.7 48.6 -55.5 -53.8 -0.8 7.7 -4.3 209 283 A L H X S+ 0 0 56 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.809 104.8 60.4 -57.9 -34.0 -1.2 11.4 -3.4 210 284 A K H X S+ 0 0 96 -4,-1.5 4,-0.9 -5,-0.3 -1,-0.2 0.913 110.4 41.3 -59.1 -44.2 -4.9 11.1 -3.9 211 285 A R H >X>S+ 0 0 118 -4,-1.7 5,-1.1 -3,-0.5 4,-0.9 0.916 112.6 52.5 -71.3 -43.2 -5.0 8.5 -1.2 212 286 A V H ><5S+ 0 0 0 -4,-2.5 3,-1.5 1,-0.2 -2,-0.2 0.939 104.9 58.6 -53.6 -48.7 -2.6 10.3 1.1 213 287 A E H 3<5S+ 0 0 93 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.765 110.4 39.5 -55.1 -38.0 -4.7 13.5 0.8 214 288 A T H <<5S- 0 0 92 -4,-0.9 -1,-0.3 -3,-0.5 -2,-0.2 0.508 103.3-128.3 -91.4 -5.2 -7.8 11.8 2.2 215 289 A G T <<5 + 0 0 15 -3,-1.5 2,-0.7 -4,-0.9 -3,-0.2 0.638 54.2 155.8 67.9 16.6 -5.9 9.8 4.9 216 290 A K < + 0 0 141 -5,-1.1 2,-0.3 25,-0.0 -1,-0.2 -0.662 4.2 130.1 -88.5 114.7 -7.7 6.7 3.6 217 291 A Y - 0 0 42 -2,-0.7 2,-0.3 -3,-0.1 -17,-0.1 -0.872 27.5-169.6-144.3 176.9 -6.0 3.4 4.3 218 292 A A - 0 0 37 -2,-0.3 3,-0.2 -19,-0.2 -2,-0.0 -0.948 36.1-114.6-160.1 172.0 -7.1 0.0 5.8 219 293 A F + 0 0 39 -2,-0.3 5,-0.1 1,-0.2 13,-0.0 -0.376 69.6 126.8-108.9 49.2 -5.8 -3.3 7.0 220 294 A D + 0 0 120 4,-0.1 -1,-0.2 3,-0.1 5,-0.1 0.764 35.1 104.6 -82.3 -28.0 -7.6 -5.2 4.2 221 295 A L S > S- 0 0 45 -3,-0.2 3,-2.2 1,-0.1 4,-0.4 -0.283 82.3-118.1 -56.1 137.6 -4.6 -7.1 2.9 222 296 A P G > S+ 0 0 109 0, 0.0 3,-1.6 0, 0.0 4,-0.4 0.778 109.3 67.8 -48.4 -35.6 -4.8 -10.8 3.9 223 297 A Q G > S+ 0 0 46 1,-0.3 3,-1.0 2,-0.2 -2,-0.1 0.729 85.9 70.6 -61.8 -21.0 -1.5 -10.6 5.9 224 298 A W G X S+ 0 0 2 -3,-2.2 3,-1.7 1,-0.2 -1,-0.3 0.786 82.2 72.4 -69.0 -25.0 -3.3 -8.3 8.4 225 299 A R G < S+ 0 0 88 -3,-1.6 -1,-0.2 -4,-0.4 -2,-0.2 0.860 97.8 49.0 -53.0 -36.3 -5.3 -11.2 9.7 226 300 A T G < S+ 0 0 105 -3,-1.0 2,-0.4 -4,-0.4 -1,-0.3 0.230 93.8 91.1 -96.0 15.6 -2.2 -12.6 11.4 227 301 A I S < S- 0 0 14 -3,-1.7 5,-0.0 1,-0.1 -124,-0.0 -0.914 80.1-106.4-115.3 139.1 -1.1 -9.3 13.1 228 302 A S > - 0 0 31 -2,-0.4 4,-1.4 1,-0.1 3,-0.2 -0.072 18.5-122.5 -59.8 157.4 -2.2 -8.4 16.7 229 303 A D H > S+ 0 0 118 1,-0.2 4,-2.6 2,-0.2 5,-0.1 0.760 111.3 68.0 -68.4 -26.2 -4.7 -5.7 17.5 230 304 A D H > S+ 0 0 81 2,-0.2 4,-2.1 1,-0.2 27,-0.2 0.932 101.5 43.9 -57.7 -47.7 -2.0 -4.1 19.5 231 305 A A H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.917 114.0 50.6 -64.3 -44.9 0.1 -3.3 16.3 232 306 A K H X S+ 0 0 27 -4,-1.4 4,-2.8 2,-0.2 -1,-0.2 0.882 107.2 54.1 -58.7 -42.0 -3.0 -2.1 14.5 233 307 A D H X S+ 0 0 54 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.946 109.6 47.5 -58.9 -53.1 -3.9 0.2 17.4 234 308 A L H X S+ 0 0 0 -4,-2.1 4,-1.5 2,-0.2 -2,-0.2 0.946 113.0 47.6 -47.2 -60.0 -0.5 1.8 17.3 235 309 A I H >X S+ 0 0 0 -4,-2.5 4,-3.1 1,-0.2 3,-0.9 0.943 109.9 53.8 -49.9 -53.2 -0.6 2.4 13.5 236 310 A R H 3< S+ 0 0 110 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.857 108.4 49.7 -50.6 -41.7 -4.1 3.8 13.8 237 311 A K H >< S+ 0 0 83 -4,-1.9 10,-1.5 -5,-0.2 3,-0.5 0.817 115.2 43.6 -68.8 -27.9 -2.9 6.3 16.3 238 312 A M H << S+ 0 0 0 -4,-1.5 -2,-0.2 -3,-0.9 -1,-0.2 0.809 111.6 52.3 -86.8 -34.3 0.0 7.3 14.1 239 313 A L T 3< S+ 0 0 5 -4,-3.1 2,-0.5 -5,-0.2 -1,-0.2 -0.086 76.8 139.3 -96.1 34.4 -2.0 7.5 10.9 240 314 A T < - 0 0 35 -3,-0.5 6,-0.1 1,-0.1 5,-0.1 -0.685 52.4-138.3 -77.8 127.2 -4.6 9.8 12.4 241 315 A F S S+ 0 0 87 -2,-0.5 -70,-0.2 -26,-0.1 -1,-0.1 0.884 85.0 64.6 -55.0 -51.6 -5.5 12.5 9.9 242 316 A H S >> S- 0 0 110 1,-0.2 3,-1.3 -72,-0.1 4,-0.8 -0.697 75.4-146.1 -82.8 124.2 -5.7 15.5 12.2 243 317 A P T 34 S+ 0 0 37 0, 0.0 3,-0.4 0, 0.0 -1,-0.2 0.799 97.8 58.5 -56.7 -35.7 -2.2 16.3 13.6 244 318 A S T 34 S+ 0 0 105 1,-0.2 -3,-0.0 -3,-0.0 -2,-0.0 0.722 110.7 42.7 -70.9 -20.6 -3.7 17.5 16.9 245 319 A L T <4 S+ 0 0 117 -3,-1.3 2,-0.3 -5,-0.1 -1,-0.2 0.497 95.1 101.8 -95.1 -10.5 -5.3 14.0 17.4 246 320 A R S < S- 0 0 4 -4,-0.8 -8,-0.2 -3,-0.4 -9,-0.1 -0.553 81.0-110.3 -78.2 137.1 -2.2 12.2 16.3 247 321 A I - 0 0 20 -10,-1.5 2,-0.1 -2,-0.3 -1,-0.1 -0.182 30.4-115.4 -63.7 155.8 -0.1 10.7 19.0 248 322 A T > - 0 0 44 1,-0.1 4,-1.6 -65,-0.1 5,-0.1 -0.394 28.0-105.1 -81.0 170.1 3.4 12.2 19.8 249 323 A A H > S+ 0 0 5 2,-0.2 4,-2.6 1,-0.2 -130,-0.2 0.838 121.9 56.4 -61.3 -39.2 6.6 10.3 19.4 250 324 A T H > S+ 0 0 37 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.907 107.6 48.3 -59.4 -42.3 6.9 9.8 23.1 251 325 A Q H 4 S+ 0 0 94 2,-0.2 4,-0.2 1,-0.2 -1,-0.2 0.815 110.0 52.0 -70.0 -33.3 3.5 8.1 23.1 252 326 A C H >< S+ 0 0 2 -4,-1.6 3,-1.6 2,-0.2 6,-0.3 0.946 110.3 48.2 -59.6 -51.9 4.6 6.0 20.2 253 327 A L H 3< S+ 0 0 8 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.839 113.1 48.7 -62.5 -31.7 7.7 4.9 22.1 254 328 A E T 3< S+ 0 0 108 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.353 80.5 129.0 -88.0 -1.0 5.5 4.2 25.2 255 329 A H X> - 0 0 8 -3,-1.6 4,-2.2 -4,-0.2 3,-0.9 -0.367 67.0-125.3 -62.7 136.1 2.9 2.1 23.4 256 330 A P H 3> S+ 0 0 73 0, 0.0 4,-2.2 0, 0.0 -1,-0.1 0.783 110.2 60.0 -53.8 -34.0 2.3 -1.3 25.0 257 331 A W H 3> S+ 0 0 2 -27,-0.2 4,-1.5 2,-0.2 -26,-0.1 0.902 109.7 43.1 -59.0 -42.6 3.1 -3.1 21.8 258 332 A I H <> S+ 0 0 0 -3,-0.9 4,-1.3 -6,-0.3 3,-0.4 0.979 112.0 52.0 -62.9 -58.6 6.6 -1.6 21.8 259 333 A Q H < S+ 0 0 104 -4,-2.2 3,-0.4 1,-0.2 -2,-0.2 0.859 106.9 56.7 -46.6 -43.5 7.1 -2.2 25.5 260 334 A K H < S+ 0 0 92 -4,-2.2 3,-0.4 1,-0.2 -1,-0.2 0.923 113.1 35.3 -59.5 -50.3 6.2 -5.9 25.0 261 335 A Y H < S+ 0 0 71 -4,-1.5 -1,-0.2 -3,-0.4 -2,-0.2 0.456 115.9 50.9 -91.6 -0.3 8.8 -6.7 22.3 262 336 A S < + 0 0 4 -4,-1.3 -1,-0.2 -3,-0.4 -2,-0.1 -0.490 64.4 136.9-129.3 60.4 11.8 -4.7 23.4 263 337 A S + 0 0 81 -3,-0.4 -1,-0.1 2,-0.0 -2,-0.1 0.015 29.7 168.5 -92.7 22.3 11.7 -5.9 27.0 264 338 A E + 0 0 55 55,-0.1 -2,-0.1 -3,-0.0 -3,-0.0 -0.041 6.0 168.4 -41.4 136.5 15.6 -6.2 26.9 265 339 A T - 0 0 75 53,-0.0 53,-0.1 0, 0.0 52,-0.1 -0.985 39.3 -83.5-157.1 148.0 16.9 -6.8 30.4 266 340 A P - 0 0 10 0, 0.0 2,-0.2 0, 0.0 48,-0.0 -0.315 46.1-175.0 -60.2 137.5 20.3 -7.8 32.1 267 341 A T > - 0 0 56 1,-0.0 3,-1.2 74,-0.0 4,-0.3 -0.700 42.9 -94.0-119.9-179.7 21.0 -11.5 32.3 268 342 A I G > S+ 0 0 118 1,-0.3 3,-1.7 -2,-0.2 -1,-0.0 0.859 123.4 61.9 -61.6 -37.5 23.8 -13.7 33.9 269 343 A S G 3 S+ 0 0 98 1,-0.3 4,-0.3 2,-0.1 -1,-0.3 0.731 100.2 56.3 -62.2 -20.0 25.6 -13.7 30.6 270 344 A D G <> S+ 0 0 20 -3,-1.2 4,-2.6 1,-0.2 3,-0.3 0.541 79.7 94.7 -86.6 -11.3 25.9 -9.9 31.0 271 345 A L H <> S+ 0 0 31 -3,-1.7 4,-2.6 -4,-0.3 5,-0.2 0.837 80.5 51.9 -53.6 -41.1 27.6 -10.1 34.4 272 346 A P H > S+ 0 0 82 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.927 116.1 39.6 -64.4 -41.5 31.2 -9.8 33.1 273 347 A S H > S+ 0 0 31 -4,-0.3 4,-2.5 -3,-0.3 -2,-0.2 0.828 114.3 54.8 -75.1 -31.7 30.5 -6.7 31.0 274 348 A L H X S+ 0 0 4 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.920 109.6 46.2 -67.7 -44.1 28.3 -5.2 33.8 275 349 A E H X S+ 0 0 91 -4,-2.6 4,-2.3 -5,-0.2 5,-0.2 0.896 111.4 53.6 -63.7 -40.1 31.1 -5.6 36.4 276 350 A S H X S+ 0 0 46 -4,-1.7 4,-2.5 -5,-0.2 5,-0.3 0.972 110.5 45.6 -54.9 -58.1 33.6 -4.1 33.8 277 351 A A H X S+ 0 0 3 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.883 112.8 51.5 -53.4 -42.4 31.4 -1.0 33.3 278 352 A M H X S+ 0 0 15 -4,-2.1 4,-2.7 2,-0.2 -1,-0.2 0.883 109.3 48.4 -67.4 -37.9 30.8 -0.6 37.1 279 353 A T H X S+ 0 0 80 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.915 114.3 46.1 -68.0 -44.5 34.5 -0.7 37.9 280 354 A N H X S+ 0 0 19 -4,-2.5 4,-2.4 104,-0.2 -2,-0.2 0.886 113.2 50.6 -65.2 -36.5 35.3 1.8 35.2 281 355 A I H X S+ 0 0 9 -4,-2.6 4,-2.7 -5,-0.3 5,-0.2 0.962 109.4 49.9 -65.3 -48.9 32.4 4.0 36.4 282 356 A R H X S+ 0 0 138 -4,-2.7 4,-1.0 1,-0.2 -2,-0.2 0.929 114.1 45.2 -55.3 -46.9 33.6 3.8 40.1 283 357 A Q H X S+ 0 0 47 -4,-2.3 4,-0.7 1,-0.2 -1,-0.2 0.869 110.3 55.1 -63.8 -40.0 37.1 4.9 39.0 284 358 A F H >< S+ 0 0 6 -4,-2.4 3,-1.4 99,-0.3 -2,-0.2 0.934 105.2 52.0 -56.6 -48.8 35.8 7.6 36.7 285 359 A Q H 3< S+ 0 0 73 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.784 104.5 58.5 -61.2 -27.7 33.8 9.2 39.6 286 360 A A H 3< S+ 0 0 64 -4,-1.0 -1,-0.3 -5,-0.2 -2,-0.2 0.668 88.8 92.4 -76.8 -18.8 37.0 9.2 41.7 287 361 A E S << S- 0 0 10 -3,-1.4 160,-0.1 -4,-0.7 2,-0.0 -0.412 85.5-103.8 -73.2 153.3 38.9 11.4 39.1 288 362 A K >> - 0 0 147 -2,-0.1 4,-2.3 1,-0.1 3,-0.8 -0.340 37.5 -99.3 -75.7 160.1 38.9 15.2 39.4 289 363 A K H 3> S+ 0 0 63 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.848 121.7 53.4 -47.9 -46.7 36.7 17.3 37.1 290 364 A L H 3> S+ 0 0 49 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.867 110.6 47.5 -58.9 -40.3 39.5 18.2 34.7 291 365 A A H <> S+ 0 0 5 -3,-0.8 4,-2.7 2,-0.2 3,-0.3 0.977 111.3 50.5 -64.8 -54.5 40.4 14.5 34.2 292 366 A Q H X S+ 0 0 12 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.870 110.3 50.3 -48.9 -45.2 36.7 13.6 33.7 293 367 A A H X S+ 0 0 51 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.880 111.8 46.1 -65.3 -40.2 36.3 16.3 31.0 294 368 A A H X S+ 0 0 28 -4,-1.7 4,-2.8 -3,-0.3 -2,-0.2 0.918 114.3 48.8 -70.4 -39.9 39.4 15.3 29.0 295 369 A L H X S+ 0 0 7 -4,-2.7 4,-3.0 2,-0.2 5,-0.2 0.894 112.2 47.8 -64.2 -41.1 38.4 11.6 29.2 296 370 A L H X S+ 0 0 34 -4,-2.4 4,-2.3 -5,-0.2 5,-0.2 0.929 113.5 48.4 -63.1 -46.0 34.8 12.4 28.1 297 371 A Y H X S+ 0 0 66 -4,-2.4 4,-1.6 2,-0.2 5,-0.2 0.915 114.9 45.5 -59.0 -47.5 36.2 14.6 25.2 298 372 A M H X S+ 0 0 7 -4,-2.8 4,-2.7 2,-0.2 5,-0.3 0.939 113.2 47.8 -62.5 -53.4 38.6 11.8 24.2 299 373 A A H X S+ 0 0 0 -4,-3.0 4,-1.2 1,-0.2 -2,-0.2 0.890 115.8 44.6 -54.6 -42.1 36.1 8.9 24.4 300 374 A S H < S+ 0 0 24 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.779 122.1 35.5 -84.7 -22.4 33.4 10.8 22.4 301 375 A K H < S+ 0 0 41 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.748 126.9 32.5 -91.9 -26.5 35.7 12.1 19.7 302 376 A L H < S+ 0 0 3 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.542 88.5 95.4-120.7 -3.8 38.1 9.2 19.3 303 377 A T < - 0 0 19 -4,-1.2 2,-0.3 -5,-0.3 87,-0.0 -0.360 60.9-126.8 -84.9 168.9 36.6 5.8 20.0 304 378 A T > - 0 0 44 -2,-0.1 4,-0.7 1,-0.1 3,-0.4 -0.736 19.4-115.4-114.5 163.4 35.2 3.4 17.3 305 379 A L T >4 S+ 0 0 29 -2,-0.3 3,-0.6 1,-0.2 4,-0.5 0.848 116.3 57.2 -64.0 -34.8 31.9 1.6 16.9 306 380 A D T 34 S+ 0 0 119 1,-0.2 3,-0.5 2,-0.2 4,-0.3 0.829 105.7 50.1 -67.6 -31.0 33.7 -1.7 17.3 307 381 A E T 34 S+ 0 0 63 -3,-0.4 4,-0.2 1,-0.2 -1,-0.2 0.626 111.4 47.3 -79.8 -16.3 35.0 -0.7 20.7 308 382 A T S S+ 0 0 38 -4,-0.5 4,-1.5 -3,-0.5 -1,-0.1 0.833 83.1 46.6 -71.0 -37.1 29.5 -2.5 21.0 310 384 A Q H > S+ 0 0 57 -4,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.928 115.5 48.2 -66.2 -44.1 29.5 -4.5 24.3 311 385 A L H > S+ 0 0 14 -4,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.792 106.1 57.5 -67.5 -26.0 28.7 -1.4 26.2 312 386 A T H X S+ 0 0 6 -4,-1.7 4,-2.5 2,-0.2 -1,-0.2 0.918 105.5 50.7 -71.8 -37.2 25.9 -0.5 23.8 313 387 A E H X S+ 0 0 96 -4,-1.5 4,-1.7 2,-0.2 -2,-0.2 0.910 112.8 45.8 -63.0 -43.6 24.2 -3.8 24.5 314 388 A I H X S+ 0 0 3 -4,-1.9 4,-1.6 2,-0.2 5,-0.2 0.925 109.1 56.1 -62.4 -44.7 24.5 -3.1 28.3 315 389 A F H >X S+ 0 0 3 -4,-2.4 4,-1.4 1,-0.2 3,-0.5 0.928 108.3 48.3 -54.3 -49.5 23.2 0.4 27.7 316 390 A R H 3< S+ 0 0 47 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.834 109.2 52.1 -57.6 -41.8 20.1 -1.0 26.0 317 391 A K H 3< S+ 0 0 48 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.729 113.9 43.5 -71.8 -24.0 19.5 -3.5 28.8 318 392 A L H << S+ 0 0 15 -4,-1.6 2,-1.8 -3,-0.5 -1,-0.2 0.680 92.8 86.4 -86.4 -23.6 19.6 -0.7 31.4 319 393 A D >< + 0 0 14 -4,-1.4 3,-1.4 -5,-0.2 -1,-0.1 -0.582 56.4 173.7 -85.8 77.4 17.5 1.7 29.3 320 394 A T T 3 S+ 0 0 78 -2,-1.8 -1,-0.2 1,-0.3 6,-0.1 0.813 74.2 45.4 -59.6 -39.4 14.1 0.4 30.5 321 395 A N T 3 S- 0 0 71 4,-0.2 -1,-0.3 -3,-0.2 3,-0.1 0.366 102.9-128.8 -93.3 5.6 12.0 3.1 28.8 322 396 A N < + 0 0 15 -3,-1.4 -2,-0.1 -6,-0.2 2,-0.1 0.541 63.9 132.1 65.2 10.2 13.8 2.8 25.5 323 397 A D S S- 0 0 24 2,-0.2 -1,-0.2 1,-0.1 -207,-0.1 -0.275 78.8 -95.9 -80.3 174.7 14.4 6.5 25.1 324 398 A G S S+ 0 0 2 -208,-0.4 53,-0.5 -3,-0.1 2,-0.3 0.366 94.2 60.6 -86.6 29.3 18.0 7.0 24.2 325 399 A M S S- 0 0 21 51,-0.1 2,-0.6 -261,-0.1 -2,-0.2 -0.931 74.4-111.2-148.4 159.2 19.4 7.7 27.7 326 400 A L B -I 375 0D 0 49,-2.7 49,-2.7 -2,-0.3 2,-0.1 -0.832 31.5-165.3 -98.7 118.9 19.9 6.5 31.3 327 401 A D > - 0 0 42 -2,-0.6 4,-1.9 47,-0.2 5,-0.1 -0.469 37.2 -97.8 -89.6 175.2 17.9 8.2 34.0 328 402 A R H > S+ 0 0 76 45,-0.4 4,-2.2 1,-0.2 5,-0.1 0.885 123.7 47.6 -54.8 -47.2 18.6 8.0 37.8 329 403 A D H > S+ 0 0 82 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.884 109.2 54.8 -68.4 -36.0 15.9 5.4 38.4 330 404 A E H > S+ 0 0 1 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.869 109.5 47.8 -61.5 -36.8 17.2 3.3 35.5 331 405 A L H X S+ 0 0 9 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.895 111.8 49.9 -70.5 -41.1 20.7 3.4 37.1 332 406 A V H X S+ 0 0 11 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.947 113.3 44.4 -60.5 -54.7 19.3 2.4 40.5 333 407 A R H X S+ 0 0 125 -4,-2.8 4,-3.1 2,-0.2 5,-0.2 0.901 112.3 54.8 -55.3 -43.5 17.3 -0.6 39.1 334 408 A G H X S+ 0 0 6 -4,-1.9 4,-3.0 -5,-0.3 -2,-0.2 0.936 108.7 45.8 -57.2 -52.8 20.3 -1.6 37.0 335 409 A Y H X S+ 0 0 28 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.896 114.7 49.4 -58.2 -41.0 22.6 -1.7 40.0 336 410 A H H X S+ 0 0 63 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.917 112.4 47.0 -63.4 -43.9 20.0 -3.7 42.0 337 411 A E H X S+ 0 0 46 -4,-3.1 4,-2.8 1,-0.2 5,-0.3 0.921 108.7 55.6 -65.4 -42.7 19.5 -6.1 39.2 338 412 A F H X S+ 0 0 12 -4,-3.0 4,-1.3 -5,-0.2 -1,-0.2 0.924 110.6 44.9 -56.7 -45.8 23.2 -6.5 38.8 339 413 A M H >X>S+ 0 0 26 -4,-2.2 5,-2.3 2,-0.2 4,-1.1 0.959 111.8 52.2 -62.5 -52.3 23.5 -7.5 42.5 340 414 A R H ><5S+ 0 0 153 -4,-2.7 3,-1.2 1,-0.3 -2,-0.2 0.912 109.2 49.2 -49.8 -50.5 20.5 -9.9 42.3 341 415 A L H 3<5S+ 0 0 31 -4,-2.8 -1,-0.3 1,-0.3 -2,-0.2 0.816 111.7 50.1 -58.8 -33.2 21.9 -11.7 39.3 342 416 A K H <<5S- 0 0 131 -4,-1.3 -1,-0.3 -3,-0.6 -2,-0.2 0.612 118.2-112.2 -83.6 -15.9 25.2 -12.0 41.1 343 417 A G T <<5S+ 0 0 71 -3,-1.2 2,-0.4 -4,-1.1 -3,-0.2 0.705 71.3 136.7 90.6 24.6 23.6 -13.4 44.3 344 418 A V < - 0 0 58 -5,-2.3 2,-0.7 -6,-0.1 -1,-0.3 -0.883 54.2-130.1-112.6 134.9 24.3 -10.4 46.4 345 419 A D > - 0 0 103 -2,-0.4 3,-2.4 1,-0.1 4,-0.3 -0.728 10.9-144.0 -83.3 115.1 21.9 -8.7 48.8 346 420 A S G > S+ 0 0 20 -2,-0.7 3,-1.6 1,-0.3 4,-0.2 0.764 98.3 69.2 -49.3 -28.9 21.8 -4.9 48.2 347 421 A N G > S+ 0 0 114 1,-0.3 3,-1.4 2,-0.2 4,-0.5 0.780 82.3 72.1 -62.0 -30.5 21.4 -4.5 52.0 348 422 A S G < S+ 0 0 64 -3,-2.4 -1,-0.3 1,-0.2 3,-0.2 0.671 80.5 78.1 -52.5 -21.7 25.0 -5.7 52.5 349 423 A L G < S+ 0 0 48 -3,-1.6 5,-0.7 -4,-0.3 -1,-0.2 0.766 80.9 63.3 -67.8 -27.3 26.1 -2.3 51.0 350 424 A I < 0 0 94 -3,-1.4 -1,-0.2 3,-0.2 -2,-0.2 0.944 360.0 360.0 -60.3 -47.9 25.4 -0.4 54.3 351 425 A Q 0 0 122 -4,-0.5 -2,-0.1 -3,-0.2 -3,-0.1 0.832 360.0 360.0 -91.7 360.0 28.2 -2.5 56.0 352 ! 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 0.0 353 428 A G 0 0 98 0, 0.0 2,-0.3 0, 0.0 -3,-0.2 0.000 360.0 360.0 360.0 46.9 28.8 2.6 53.9 354 429 A S - 0 0 40 -5,-0.7 -3,-0.0 -3,-0.1 0, 0.0 -0.973 360.0 -94.9-152.0 155.7 25.7 3.7 51.9 355 430 A T > - 0 0 43 -2,-0.3 4,-2.2 1,-0.1 5,-0.1 -0.173 39.6-106.0 -68.6 164.7 22.7 2.3 49.8 356 431 A I H > S+ 0 0 5 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.885 122.4 55.0 -53.4 -42.2 22.6 1.9 46.1 357 432 A E H > S+ 0 0 65 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.940 107.9 45.5 -61.1 -54.0 20.3 4.9 46.0 358 433 A D H > S+ 0 0 94 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.901 114.8 51.4 -52.1 -44.2 22.7 7.2 47.9 359 434 A Q H X S+ 0 0 44 -4,-2.2 4,-1.3 2,-0.2 -2,-0.2 0.895 111.8 43.7 -65.1 -42.7 25.5 5.9 45.6 360 435 A I H X S+ 0 0 2 -4,-2.7 4,-2.8 1,-0.2 -1,-0.2 0.920 111.0 56.4 -69.5 -39.3 23.6 6.6 42.4 361 436 A D H < S+ 0 0 74 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.831 111.4 42.0 -61.5 -33.2 22.4 10.0 43.7 362 437 A S H X S+ 0 0 66 -4,-1.6 4,-0.5 -5,-0.2 -1,-0.2 0.737 115.4 51.7 -86.9 -23.8 26.0 11.2 44.3 363 438 A L H >X S+ 0 0 7 -4,-1.3 4,-2.3 -5,-0.2 3,-0.7 0.839 93.6 72.7 -75.2 -37.8 27.2 9.7 41.1 364 439 A M H 3X S+ 0 0 23 -4,-2.8 4,-2.6 1,-0.3 -2,-0.2 0.873 96.1 48.9 -51.4 -47.1 24.6 11.4 38.9 365 440 A P H 34 S+ 0 0 88 0, 0.0 -1,-0.3 0, 0.0 -2,-0.2 0.860 113.4 49.6 -60.9 -33.9 26.1 14.8 39.2 366 441 A L H << S+ 0 0 55 -3,-0.7 -2,-0.2 -4,-0.5 -3,-0.1 0.903 118.3 35.3 -71.5 -40.6 29.5 13.3 38.2 367 442 A L H < S+ 0 0 4 -4,-2.3 2,-1.7 1,-0.2 -1,-0.2 0.771 102.6 73.6 -87.6 -30.1 28.3 11.3 35.2 368 443 A D >< + 0 0 19 -4,-2.6 3,-0.8 -5,-0.3 -1,-0.2 -0.665 63.4 170.5 -85.0 83.3 25.8 13.8 33.9 369 444 A M T 3 S+ 0 0 62 -2,-1.7 -1,-0.2 1,-0.2 6,-0.1 0.724 71.8 44.2 -76.0 -25.4 28.4 16.2 32.7 370 445 A D T 3 S- 0 0 93 4,-0.2 -1,-0.2 -3,-0.2 -2,-0.1 0.451 106.6-121.8 -95.2 1.7 26.2 18.6 30.8 371 446 A G < + 0 0 59 -3,-0.8 -2,-0.1 -6,-0.1 4,-0.1 0.689 64.8 143.8 64.4 25.1 23.6 18.6 33.6 372 447 A S - 0 0 58 2,-0.3 3,-0.1 1,-0.1 -1,-0.1 0.568 68.4-114.1 -73.6 -10.5 20.9 17.4 31.1 373 448 A G S S+ 0 0 49 1,-0.2 -45,-0.4 -9,-0.1 2,-0.3 0.306 91.6 69.2 91.7 -6.8 19.1 15.2 33.8 374 449 A S S S- 0 0 21 -47,-0.1 2,-0.8 -46,-0.1 -2,-0.3 -0.958 83.8-117.9-139.3 157.6 20.1 12.1 31.9 375 450 A I B -I 326 0D 0 -49,-2.7 -49,-2.7 -2,-0.3 -7,-0.1 -0.876 40.5-153.9 -94.4 106.0 23.2 10.1 31.2 376 451 A E >> - 0 0 11 -2,-0.8 4,-2.4 -51,-0.2 3,-0.5 -0.307 29.9 -92.6 -81.0 169.2 23.5 10.2 27.4 377 452 A Y H 3> S+ 0 0 28 -314,-0.5 4,-2.8 -53,-0.5 5,-0.1 0.879 124.0 45.6 -46.7 -54.7 25.2 7.6 25.3 378 453 A S H 3> S+ 0 0 20 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.828 111.5 52.6 -66.5 -29.5 28.6 9.3 25.1 379 454 A E H <> S+ 0 0 10 -3,-0.5 4,-1.4 2,-0.2 -1,-0.2 0.890 111.5 47.9 -70.4 -39.2 28.6 10.1 28.9 380 455 A F H X S+ 0 0 5 -4,-2.4 4,-2.0 2,-0.2 5,-0.2 0.957 113.5 46.8 -61.4 -52.1 27.9 6.4 29.5 381 456 A I H X S+ 0 0 4 -4,-2.8 4,-2.2 1,-0.2 3,-0.4 0.958 110.6 51.7 -57.7 -53.2 30.7 5.3 27.1 382 457 A A H < S+ 0 0 0 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.834 117.9 39.0 -49.3 -37.6 33.3 7.7 28.6 383 458 A S H < S+ 0 0 0 -4,-1.4 -99,-0.3 -3,-0.2 -1,-0.2 0.739 122.0 39.4 -88.3 -23.9 32.6 6.5 32.1 384 459 A A H < S+ 0 0 1 -4,-2.0 -104,-0.2 -3,-0.4 -2,-0.2 0.541 93.7 93.3-109.7 -9.8 32.1 2.7 31.5 385 460 A I S < S- 0 0 7 -4,-2.2 2,-1.0 -5,-0.2 -77,-0.1 -0.433 89.3-101.6 -77.5 157.9 34.8 2.0 28.9 386 461 A D > - 0 0 70 1,-0.1 3,-1.9 -2,-0.1 4,-0.2 -0.747 36.4-155.0 -72.3 102.8 38.3 0.8 29.8 387 462 A R G > S+ 0 0 1 -2,-1.0 3,-1.7 1,-0.3 4,-0.2 0.592 82.5 80.7 -71.4 -5.2 39.9 4.2 29.4 388 463 A T G > S+ 0 0 74 1,-0.3 3,-2.0 2,-0.2 -1,-0.3 0.805 79.1 73.2 -63.6 -29.8 43.4 2.7 28.6 389 464 A I G X S+ 0 0 53 -3,-1.9 3,-0.6 1,-0.3 -1,-0.3 0.728 91.3 57.2 -48.6 -26.9 41.9 2.3 25.1 390 465 A L G < S+ 0 0 2 -3,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.624 91.1 73.3 -80.9 -13.2 42.3 6.1 24.8 391 466 A L G < + 0 0 39 -3,-2.0 -1,-0.2 -4,-0.2 -2,-0.1 0.144 60.9 125.9 -98.2 18.0 46.1 5.9 25.5 392 467 A S S <> S- 0 0 43 -3,-0.6 4,-1.8 1,-0.1 5,-0.2 -0.454 71.8-116.3 -68.8 153.0 47.2 4.5 22.2 393 468 A R H > S+ 0 0 146 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.884 111.4 53.0 -60.8 -39.5 49.9 6.7 20.6 394 469 A E H > S+ 0 0 90 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.893 109.6 48.3 -65.3 -40.2 47.8 7.7 17.6 395 470 A R H > S+ 0 0 14 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.887 111.3 48.6 -69.7 -41.2 44.8 8.9 19.7 396 471 A M H X S+ 0 0 9 -4,-1.8 4,-3.2 2,-0.2 -1,-0.2 0.873 112.2 51.7 -63.1 -37.9 47.0 11.0 22.0 397 472 A E H X S+ 0 0 53 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.886 110.6 46.5 -66.6 -43.1 48.6 12.4 18.9 398 473 A R H X S+ 0 0 3 -4,-2.2 4,-1.5 2,-0.2 -2,-0.2 0.932 114.1 49.0 -65.9 -42.6 45.3 13.3 17.4 399 474 A A H >X S+ 0 0 1 -4,-2.9 4,-1.2 2,-0.2 3,-0.5 0.951 111.6 48.5 -59.6 -51.8 44.2 14.8 20.8 400 475 A F H >X S+ 0 0 16 -4,-3.2 4,-1.2 1,-0.2 3,-1.1 0.948 111.9 50.3 -44.9 -54.8 47.4 16.8 21.1 401 476 A K H 3< S+ 0 0 64 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.727 102.1 61.3 -63.4 -25.8 46.9 18.0 17.5 402 477 A M H << S+ 0 0 30 -4,-1.5 -1,-0.3 -3,-0.5 -2,-0.2 0.838 112.3 37.3 -70.4 -32.8 43.3 19.1 18.2 403 478 A F H << S+ 0 0 62 -4,-1.2 2,-2.0 -3,-1.1 3,-0.3 0.554 91.2 97.2 -95.2 -12.7 44.6 21.6 20.8 404 479 A D < + 0 0 19 -4,-1.2 -1,-0.1 1,-0.2 6,-0.1 -0.563 39.6 149.6 -78.2 79.0 47.7 22.6 18.9 405 480 A K + 0 0 112 -2,-2.0 2,-0.5 1,-0.2 -1,-0.2 0.932 60.4 54.0 -75.8 -49.1 46.1 25.7 17.3 406 481 A D S > S- 0 0 69 -3,-0.3 3,-0.9 3,-0.3 2,-0.6 -0.786 115.7 -67.6 -93.2 121.7 49.5 27.6 17.2 407 482 A G T 3 S- 0 0 78 -2,-0.5 3,-0.1 1,-0.2 -3,-0.1 -0.131 101.7 -27.6 54.0 -91.8 52.5 26.1 15.4 408 483 A S T 3 S+ 0 0 81 -2,-0.6 2,-0.3 1,-0.2 -1,-0.2 0.476 114.0 50.0-144.4 -14.1 53.8 23.1 17.4 409 484 A G S < S- 0 0 13 -3,-0.9 2,-0.8 27,-0.1 -3,-0.3 -0.951 75.1-108.8-138.6 157.1 53.1 23.2 21.1 410 485 A K B -J 435 0E 4 25,-2.3 25,-2.9 -2,-0.3 -6,-0.1 -0.779 35.9-137.5 -90.7 109.3 50.1 23.8 23.4 411 486 A I > - 0 0 17 -2,-0.8 4,-3.0 23,-0.2 5,-0.2 -0.288 12.1-131.5 -60.8 144.0 50.4 27.2 25.2 412 487 A S H > S+ 0 0 41 21,-0.4 4,-1.4 1,-0.2 -1,-0.1 0.826 115.4 53.9 -60.3 -32.1 49.5 27.4 28.9 413 488 A T H > S+ 0 0 122 2,-0.2 4,-0.8 3,-0.1 -1,-0.2 0.751 112.5 42.1 -74.4 -29.5 47.5 30.4 27.8 414 489 A K H >> S+ 0 0 39 2,-0.1 4,-1.6 3,-0.1 3,-0.6 0.962 112.6 51.2 -73.1 -62.7 45.7 28.3 25.1 415 490 A E H 3< S+ 0 0 53 -4,-3.0 -2,-0.2 1,-0.3 -3,-0.2 0.742 108.8 52.8 -48.6 -35.1 45.1 25.1 27.3 416 491 A L H >< S+ 0 0 63 -4,-1.4 3,-1.1 1,-0.2 -1,-0.3 0.912 114.1 40.0 -69.3 -47.5 43.6 27.3 30.1 417 492 A F H << S+ 0 0 95 -4,-0.8 -2,-0.2 -3,-0.6 -1,-0.2 0.595 113.5 59.1 -72.8 -13.2 41.0 28.9 27.8 418 493 A K T 3< 0 0 49 -4,-1.6 -1,-0.2 -15,-0.0 -2,-0.2 0.301 360.0 360.0 -93.5 4.8 40.7 25.4 26.2 419 494 A L < 0 0 122 -3,-1.1 -129,-0.0 -5,-0.2 -3,-0.0 -0.891 360.0 360.0-108.6 360.0 39.6 24.0 29.6 420 ! 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 0.0 421 508 A E >> 0 0 207 0, 0.0 3,-2.3 0, 0.0 4,-0.7 0.000 360.0 360.0 360.0 -34.4 45.2 26.4 36.6 422 509 A S H 3> + 0 0 98 1,-0.3 4,-0.5 2,-0.2 3,-0.4 0.686 360.0 44.3 -25.9 -50.0 46.3 24.1 39.4 423 510 A I H >> S+ 0 0 54 1,-0.2 4,-1.9 2,-0.2 3,-0.7 0.806 98.3 71.4 -73.8 -31.9 47.1 21.2 37.1 424 511 A I H <> S+ 0 0 43 -3,-2.3 4,-1.3 1,-0.3 -1,-0.2 0.820 95.0 53.3 -56.3 -38.9 48.9 23.2 34.4 425 512 A E H 3< S+ 0 0 81 -4,-0.7 -1,-0.3 -3,-0.4 -2,-0.2 0.842 111.2 48.0 -64.3 -35.8 52.0 23.9 36.5 426 513 A Q H << S+ 0 0 133 -3,-0.7 -2,-0.2 -4,-0.5 -1,-0.2 0.913 107.3 50.7 -72.6 -47.9 52.3 20.1 37.2 427 514 A V H < S+ 0 0 18 -4,-1.9 2,-1.7 1,-0.2 -1,-0.2 0.840 95.7 74.4 -64.6 -35.2 52.0 18.7 33.6 428 515 A D < + 0 0 15 -4,-1.3 3,-0.4 -5,-0.2 -1,-0.2 -0.603 68.2 179.1 -77.5 82.7 54.7 21.1 32.3 429 516 A N S S+ 0 0 132 -2,-1.7 -1,-0.2 1,-0.2 -2,-0.1 0.675 76.1 41.3 -73.4 -18.6 57.5 19.1 34.0 430 517 A N S S- 0 0 102 -3,-0.1 -1,-0.2 0, 0.0 -2,-0.1 0.628 103.7-130.9 -95.4 -17.8 60.4 21.4 32.7 431 518 A K + 0 0 79 -3,-0.4 -2,-0.1 3,-0.1 4,-0.1 0.858 58.5 139.5 72.8 42.7 58.4 24.6 33.4 432 519 A D S S- 0 0 102 2,-0.4 2,-1.4 1,-0.0 -1,-0.1 0.099 71.3-110.5-100.9 22.3 58.9 26.5 30.1 433 520 A G S S+ 0 0 40 -5,-0.1 -21,-0.4 1,-0.1 2,-0.2 -0.306 91.6 79.3 84.8 -52.6 55.3 27.8 29.9 434 521 A E S S- 0 0 83 -2,-1.4 2,-0.6 -23,-0.2 -2,-0.4 -0.503 74.6-126.7 -94.3 160.4 54.2 25.6 27.0 435 522 A V B -J 410 0E 13 -25,-2.9 -25,-2.3 -2,-0.2 -7,-0.1 -0.910 21.8-164.6-112.4 110.4 53.1 22.0 26.8 436 523 A D > - 0 0 74 -2,-0.6 4,-2.0 -27,-0.2 3,-0.3 -0.223 40.9 -92.7 -81.5-179.0 54.9 19.5 24.4 437 524 A F H > S+ 0 0 37 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.848 121.9 58.1 -67.2 -34.6 53.6 16.1 23.4 438 525 A N H > S+ 0 0 118 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.844 109.3 42.1 -63.3 -38.7 55.5 14.3 26.1 439 526 A E H > S+ 0 0 13 -3,-0.3 4,-2.8 2,-0.2 -1,-0.2 0.877 113.4 54.8 -75.2 -36.7 54.0 16.3 28.9 440 527 A F H X S+ 0 0 10 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.886 108.2 48.7 -60.9 -43.4 50.6 15.9 27.2 441 528 A V H X S+ 0 0 21 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.917 112.0 49.0 -60.0 -46.9 51.0 12.1 27.1 442 529 A E H X S+ 0 0 96 -4,-1.6 4,-2.6 2,-0.2 -2,-0.2 0.905 110.2 50.3 -65.3 -43.4 52.0 12.1 30.8 443 530 A M H X S+ 0 0 36 -4,-2.8 4,-1.8 2,-0.2 -1,-0.2 0.913 111.6 49.0 -56.3 -47.1 49.0 14.2 31.8 444 531 A L H X S+ 0 0 9 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.886 111.2 49.2 -60.8 -41.4 46.7 11.9 29.9 445 532 A Q H X S+ 0 0 71 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.915 109.3 52.6 -65.0 -40.8 48.2 8.9 31.5 446 533 A N H X S+ 0 0 83 -4,-2.6 4,-1.1 2,-0.2 -1,-0.2 0.840 106.3 54.9 -60.3 -35.1 47.8 10.6 34.9 447 534 A F H < S+ 0 0 31 -4,-1.8 3,-0.2 1,-0.2 -2,-0.2 0.931 113.9 38.4 -66.1 -44.4 44.2 11.1 34.0 448 535 A V H < S+ 0 0 13 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.778 104.5 76.5 -72.4 -25.5 43.6 7.3 33.3 449 536 A R H < 0 0 62 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.855 360.0 360.0 -57.8 -49.1 45.9 6.6 36.3 450 537 A N < 0 0 125 -4,-1.1 -3,-0.1 -3,-0.2 -2,-0.1 0.298 360.0 360.0 176.7 360.0 43.4 7.3 39.1