==== 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 08-JUL-09 3I7B . COMPND 2 MOLECULE: CALMODULIN-DOMAIN PROTEIN KINASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: TOXOPLASMA GONDII; . AUTHOR E.T.LARSON,E.A.MERRITT,MEDICAL STRUCTURAL GENOMICS OF PATHOG . 459 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22804.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 316 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 . 47 10.2 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 . 23 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 194 42.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.7 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 3 3 1 0 0 0 3 2 2 1 2 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 1 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 . 2 1 2 0 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 0 ANTIPARALLEL BRIDGES PER LADDER . 2 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 46 A I >> 0 0 126 0, 0.0 3,-1.1 0, 0.0 4,-0.7 0.000 360.0 360.0 360.0 130.8 12.3 13.3 82.9 2 47 A F H >> + 0 0 15 1,-0.3 4,-2.5 2,-0.2 3,-1.2 0.881 360.0 53.3 -53.4 -50.3 14.9 13.4 80.1 3 48 A S H 34 S+ 0 0 66 1,-0.3 -1,-0.3 2,-0.2 5,-0.0 0.674 99.0 65.3 -66.4 -20.0 18.0 13.5 82.4 4 49 A D H <4 S+ 0 0 115 -3,-1.1 -1,-0.3 1,-0.1 -2,-0.2 0.829 117.2 25.2 -66.2 -33.2 16.9 10.4 84.3 5 50 A R H << S+ 0 0 111 -3,-1.2 21,-3.2 -4,-0.7 22,-0.4 0.807 122.0 43.4-100.9 -38.2 17.2 8.3 81.2 6 51 A Y E < -A 25 0A 16 -4,-2.5 2,-0.4 19,-0.2 19,-0.2 -0.870 55.2-159.8-119.2 144.2 19.8 10.0 78.9 7 52 A K E -A 24 0A 103 17,-2.2 17,-2.4 -2,-0.3 2,-0.2 -0.981 27.7-119.7-116.3 136.9 23.2 11.6 79.5 8 53 A G E +A 23 0A 31 -2,-0.4 15,-0.3 15,-0.2 3,-0.1 -0.542 31.4 174.6 -69.4 136.1 24.7 14.0 76.9 9 54 A Q E - 0 0 65 13,-3.3 2,-0.3 1,-0.4 14,-0.2 0.760 60.1 -17.5-110.7 -48.0 28.0 12.9 75.5 10 55 A R E -A 22 0A 146 12,-1.4 12,-3.4 0, 0.0 -1,-0.4 -0.983 65.9 -99.1-159.4 155.8 28.9 15.4 72.8 11 56 A V E -A 21 0A 72 -2,-0.3 10,-0.2 10,-0.2 3,-0.1 -0.609 24.0-174.0 -77.6 130.3 27.4 18.2 70.7 12 57 A L E - 0 0 85 8,-2.5 2,-0.3 -2,-0.3 9,-0.2 0.832 52.9 -90.0 -89.5 -40.6 26.5 17.2 67.1 13 58 A G E -A 20 0A 29 7,-1.8 7,-3.3 2,-0.0 2,-0.5 -0.951 44.8 -53.8 159.5-173.5 25.5 20.7 65.9 14 59 A K E +A 19 0A 109 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.855 54.2 171.3 -95.9 127.5 22.9 23.3 65.5 15 60 A G E > -A 18 0A 24 3,-1.8 3,-1.2 -2,-0.5 2,-0.1 -0.646 45.9 -53.8-122.2-177.9 19.8 22.2 63.6 16 61 A S T 3 S+ 0 0 32 1,-0.2 -1,-0.1 -2,-0.2 143,-0.0 -0.398 123.1 2.0 -59.9 129.6 16.4 23.7 62.8 17 62 A F T 3 S- 0 0 25 -2,-0.1 21,-0.4 -3,-0.1 2,-0.3 0.260 131.7 -10.7 76.5 -8.7 14.6 24.8 66.0 18 63 A G E < S-A 15 0A 4 -3,-1.2 -3,-1.8 19,-0.2 19,-0.2 -0.921 83.2 -57.5 165.4 173.4 17.4 23.8 68.4 19 64 A E E -AB 14 36A 39 17,-0.6 17,-2.4 -2,-0.3 2,-0.5 -0.387 40.7-138.0 -76.3 150.8 20.8 22.2 69.2 20 65 A V E -AB 13 35A 29 -7,-3.3 -8,-2.5 15,-0.2 -7,-1.8 -0.951 20.2-171.1-113.9 123.5 21.4 18.5 68.6 21 66 A I E -AB 11 34A 1 13,-2.7 13,-2.8 -2,-0.5 2,-0.5 -0.930 25.0-126.8-117.0 136.1 23.3 16.5 71.2 22 67 A L E -AB 10 33A 3 -12,-3.4 -13,-3.3 -2,-0.4 -12,-1.4 -0.736 41.8-179.2 -75.6 123.3 24.6 13.0 71.0 23 68 A C E -AB 8 32A 1 9,-2.8 9,-2.8 -2,-0.5 2,-0.4 -0.827 20.1-143.2-126.1 164.3 23.2 11.2 74.1 24 69 A K E -AB 7 31A 55 -17,-2.4 -17,-2.2 -2,-0.3 2,-0.3 -0.996 24.5-114.6-132.3 132.3 23.4 7.8 75.7 25 70 A D E > -A 6 0A 7 5,-2.4 4,-1.7 -2,-0.4 -19,-0.2 -0.499 26.9-138.7 -59.5 124.5 20.8 5.7 77.5 26 71 A K T 4 S+ 0 0 111 -21,-3.2 -1,-0.1 -2,-0.3 -20,-0.1 0.727 95.6 32.3 -62.9 -25.1 22.2 5.5 81.1 27 72 A I T 4 S+ 0 0 157 -22,-0.4 -1,-0.2 3,-0.1 -21,-0.1 0.897 128.5 29.2 -96.0 -57.4 21.2 1.8 81.4 28 73 A T T 4 S- 0 0 99 2,-0.1 -2,-0.2 1,-0.0 3,-0.1 0.548 91.9-131.2 -87.9 -11.7 21.4 0.1 78.0 29 74 A G < + 0 0 31 -4,-1.7 2,-0.2 1,-0.2 -3,-0.1 0.522 48.5 159.7 72.2 6.7 24.2 2.3 76.6 30 75 A Q - 0 0 119 -6,-0.1 -5,-2.4 1,-0.1 2,-0.2 -0.431 36.2-133.1 -65.4 126.1 22.3 2.9 73.4 31 76 A E E +B 24 0A 67 -7,-0.2 54,-0.3 -2,-0.2 2,-0.3 -0.589 34.5 163.5 -78.8 141.3 23.5 6.0 71.5 32 77 A C E -B 23 0A 3 -9,-2.8 -9,-2.8 -2,-0.2 2,-0.4 -0.913 35.1-117.8-146.0 171.3 20.9 8.5 70.3 33 78 A A E -BC 22 83A 10 50,-3.1 50,-3.0 -2,-0.3 2,-0.4 -0.959 26.0-162.3-114.0 136.5 20.6 12.1 69.0 34 79 A V E -BC 21 82A 1 -13,-2.8 -13,-2.7 -2,-0.4 2,-0.6 -0.983 8.5-154.2-122.2 131.5 18.4 14.6 70.9 35 80 A K E -BC 20 81A 21 46,-2.7 46,-2.6 -2,-0.4 2,-0.6 -0.918 12.5-155.2-101.0 120.9 17.1 17.9 69.6 36 81 A V E -BC 19 80A 17 -17,-2.4 2,-0.6 -2,-0.6 -17,-0.6 -0.877 7.4-165.0-101.3 114.6 16.5 20.4 72.4 37 82 A I E - C 0 79A 0 42,-2.7 42,-2.0 -2,-0.6 2,-0.4 -0.897 15.5-136.3-107.5 114.3 13.8 23.0 71.5 38 83 A S E > - C 0 78A 2 -2,-0.6 4,-2.9 -21,-0.4 40,-0.2 -0.551 4.3-155.4 -70.9 119.4 13.7 26.1 73.7 39 84 A K T 4 S+ 0 0 52 38,-2.6 -1,-0.2 -2,-0.4 5,-0.1 0.695 95.4 51.8 -69.0 -21.5 10.0 27.0 74.5 40 85 A R T 4 S+ 0 0 166 37,-0.6 -1,-0.2 1,-0.1 38,-0.1 0.953 117.3 34.6 -71.1 -58.8 11.2 30.6 75.1 41 86 A Q T 4 S+ 0 0 76 1,-0.1 2,-0.5 -24,-0.1 -2,-0.2 0.859 115.7 58.6 -69.5 -39.9 13.0 31.0 71.8 42 87 A V S < S- 0 0 13 -4,-2.9 2,-0.2 -25,-0.1 -1,-0.1 -0.846 76.3-142.1-103.5 123.9 10.8 28.9 69.6 43 88 A K - 0 0 136 -2,-0.5 115,-2.1 115,-0.4 2,-0.4 -0.532 15.5-129.2 -78.3 143.9 7.0 29.7 69.3 44 89 A Q B -E 157 0B 44 113,-0.2 113,-0.3 -2,-0.2 112,-0.1 -0.779 14.3-165.9 -92.5 140.8 4.5 26.9 69.1 45 90 A K + 0 0 78 111,-2.7 111,-0.1 -2,-0.4 -1,-0.1 0.903 68.3 34.6 -87.1 -50.6 1.9 26.9 66.3 46 91 A T S S- 0 0 44 110,-0.4 2,-0.1 1,-0.2 110,-0.0 -0.387 91.1 -86.7-102.4 174.6 -0.6 24.3 67.4 47 92 A D > - 0 0 90 -2,-0.1 4,-1.8 1,-0.1 3,-0.3 -0.368 40.5-111.6 -73.4 162.8 -2.1 23.2 70.8 48 93 A K H > S+ 0 0 84 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.786 115.6 67.3 -71.6 -28.3 -0.3 20.5 72.8 49 94 A E H > S+ 0 0 133 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.944 108.1 40.0 -47.1 -51.3 -3.1 18.1 72.1 50 95 A S H > S+ 0 0 31 -3,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.882 115.3 50.5 -69.9 -42.4 -2.0 18.2 68.4 51 96 A L H X S+ 0 0 7 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.949 112.6 45.7 -61.6 -51.4 1.8 18.2 69.1 52 97 A L H X S+ 0 0 89 -4,-3.0 4,-2.0 1,-0.2 -1,-0.2 0.877 113.0 51.6 -59.4 -39.3 1.6 15.2 71.5 53 98 A R H X S+ 0 0 165 -4,-1.7 4,-1.9 -5,-0.3 -1,-0.2 0.911 109.7 47.7 -67.6 -43.0 -0.6 13.3 69.0 54 99 A E H X S+ 0 0 35 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.898 110.5 53.0 -64.7 -39.4 1.7 13.9 66.0 55 100 A V H X S+ 0 0 10 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.912 107.9 50.9 -59.7 -43.3 4.7 12.8 68.2 56 101 A Q H X S+ 0 0 101 -4,-2.0 4,-0.8 2,-0.2 -1,-0.2 0.867 110.9 48.7 -64.7 -37.8 2.8 9.5 69.0 57 102 A L H >X S+ 0 0 55 -4,-1.9 3,-1.2 2,-0.2 4,-0.6 0.941 109.0 52.5 -63.8 -48.7 2.1 8.9 65.3 58 103 A L H >< S+ 0 0 30 -4,-2.6 3,-1.0 1,-0.3 11,-0.4 0.861 103.3 58.7 -56.6 -38.3 5.8 9.6 64.4 59 104 A K H 3< S+ 0 0 74 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.784 107.2 47.8 -60.5 -29.1 6.9 7.0 67.1 60 105 A Q H << S+ 0 0 132 -3,-1.2 2,-0.3 -4,-0.8 -1,-0.2 0.480 96.1 88.9 -91.9 -6.4 4.8 4.3 65.3 61 106 A L << - 0 0 20 -3,-1.0 2,-0.3 -4,-0.6 8,-0.3 -0.718 51.4-178.0 -97.1 144.8 6.1 5.0 61.7 62 107 A D + 0 0 101 -2,-0.3 5,-0.1 6,-0.1 6,-0.1 -0.980 12.6 152.5-143.8 129.6 9.2 3.4 60.2 63 108 A H > - 0 0 33 3,-0.4 3,-1.8 -2,-0.3 53,-0.0 -0.957 44.5-127.9-154.1 138.7 10.9 4.0 56.8 64 109 A P T 3 S+ 0 0 69 0, 0.0 4,-0.1 0, 0.0 52,-0.0 0.627 110.2 47.8 -68.5 -10.7 14.5 3.5 55.8 65 110 A N T 3 S+ 0 0 7 82,-0.1 83,-2.6 47,-0.1 2,-0.4 0.264 101.4 75.9-109.2 10.5 14.7 7.0 54.3 66 111 A I B < S-f 148 0C 15 -3,-1.8 -3,-0.4 81,-0.3 83,-0.2 -0.970 90.0-106.9-121.7 134.7 13.1 8.8 57.2 67 112 A M - 0 0 52 81,-2.6 2,-0.4 -2,-0.4 -2,-0.1 -0.365 37.5-122.0 -57.5 133.8 14.8 9.6 60.5 68 113 A K - 0 0 34 -4,-0.1 16,-2.3 -2,-0.1 2,-0.4 -0.676 20.7-153.6 -82.5 125.8 13.5 7.3 63.3 69 114 A L E +D 83 0A 24 -2,-0.4 14,-0.3 -11,-0.4 -8,-0.1 -0.871 17.7 173.2 -97.7 133.5 12.0 9.1 66.3 70 115 A Y E - 0 0 84 12,-2.9 2,-0.3 -2,-0.4 13,-0.2 0.826 54.3 -0.2-103.8 -49.6 12.1 7.2 69.6 71 116 A E E -D 82 0A 39 11,-2.0 11,-2.8 2,-0.0 2,-0.4 -0.939 47.2-146.0-149.5 163.8 10.9 9.4 72.4 72 117 A F E +D 81 0A 39 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.999 18.1 174.7-137.3 132.4 9.6 12.8 73.5 73 118 A F E -D 80 0A 32 7,-2.3 7,-3.0 -2,-0.4 2,-0.3 -0.939 5.9-169.7-132.4 161.6 10.2 14.7 76.8 74 119 A E E +D 79 0A 73 -2,-0.3 2,-0.2 5,-0.2 5,-0.2 -0.995 8.4 172.7-149.5 142.6 9.3 18.1 78.1 75 120 A D - 0 0 66 3,-2.4 3,-0.0 -2,-0.3 -2,-0.0 -0.754 56.8 -77.8-130.7-173.1 10.1 20.4 81.0 76 121 A K S S+ 0 0 203 -2,-0.2 3,-0.0 1,-0.2 0, 0.0 0.826 128.8 27.0 -54.5 -34.7 9.2 24.0 81.8 77 122 A G S S+ 0 0 21 1,-0.1 -38,-2.6 -38,-0.1 -37,-0.6 0.656 119.9 31.7-104.4 -20.0 11.8 25.4 79.4 78 123 A Y E -C 38 0A 48 -40,-0.2 -3,-2.4 -39,-0.1 2,-0.4 -0.931 51.4-139.1-144.5 155.7 12.4 22.8 76.7 79 124 A F E -CD 37 74A 1 -42,-2.0 -42,-2.7 -2,-0.3 2,-0.5 -0.938 23.2-155.9-105.9 142.2 11.1 20.0 74.4 80 125 A Y E -CD 36 73A 30 -7,-3.0 -7,-2.3 -2,-0.4 2,-0.6 -0.959 6.3-169.2-122.0 110.7 13.5 17.0 74.0 81 126 A L E -CD 35 72A 23 -46,-2.6 -46,-2.7 -2,-0.5 2,-0.5 -0.904 10.3-161.2 -99.7 117.6 13.0 15.0 70.8 82 127 A V E +CD 34 71A 0 -11,-2.8 -12,-2.9 -2,-0.6 -11,-2.0 -0.867 23.9 141.2-105.4 129.5 15.0 11.8 70.9 83 128 A G E -CD 33 69A 0 -50,-3.0 -50,-3.1 -2,-0.5 -14,-0.2 -0.856 50.6 -54.2-151.6-175.3 15.8 9.8 67.8 84 129 A E - 0 0 60 -16,-2.3 2,-0.4 -2,-0.2 -52,-0.1 -0.404 49.4-131.4 -70.9 140.0 18.4 7.7 65.8 85 130 A V - 0 0 29 -54,-0.3 2,-0.4 -2,-0.1 -1,-0.1 -0.748 16.3-160.7 -93.1 139.2 21.8 9.2 65.2 86 131 A Y - 0 0 28 -2,-0.4 3,-0.2 1,-0.1 52,-0.2 -0.975 7.9-170.9-120.4 138.8 23.3 9.2 61.7 87 132 A T + 0 0 117 51,-0.7 53,-0.2 -2,-0.4 51,-0.2 0.348 64.2 88.5-113.1 3.1 27.1 9.7 61.3 88 133 A G S S- 0 0 3 49,-2.1 50,-0.2 51,-0.2 51,-0.2 0.523 81.5-140.9 -83.7 -7.5 27.4 10.1 57.5 89 134 A G - 0 0 36 48,-0.4 48,-2.9 -3,-0.2 -1,-0.2 -0.171 44.6 -23.4 75.3-171.2 26.9 13.8 57.4 90 135 A E B >> -G 136 0C 44 46,-0.2 4,-0.9 1,-0.1 3,-0.6 -0.499 58.0-124.6 -80.0 142.5 25.0 15.9 54.9 91 136 A L H >> S+ 0 0 1 44,-2.7 4,-2.3 41,-0.5 3,-1.1 0.882 108.1 50.1 -51.5 -51.1 24.5 14.5 51.4 92 137 A F H 3> S+ 0 0 1 1,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.805 103.7 59.7 -64.6 -30.6 26.0 17.5 49.5 93 138 A D H <4 S+ 0 0 51 -3,-0.6 -1,-0.3 1,-0.2 -2,-0.2 0.731 110.8 43.6 -69.2 -22.5 29.1 17.4 51.7 94 139 A E H X< S+ 0 0 11 -3,-1.1 3,-1.2 -4,-0.9 4,-0.4 0.861 110.9 54.2 -81.7 -43.2 29.6 13.9 50.4 95 140 A I H >< S+ 0 0 1 -4,-2.3 3,-2.1 1,-0.3 -2,-0.2 0.898 98.9 61.2 -59.9 -44.4 28.7 14.7 46.7 96 141 A I T 3< S+ 0 0 28 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.1 0.683 100.5 55.7 -58.3 -22.3 31.3 17.5 46.5 97 142 A S T < S+ 0 0 80 -3,-1.2 -1,-0.3 -4,-0.2 -2,-0.2 0.527 85.8 104.7 -87.0 -9.1 34.2 15.0 47.1 98 143 A R < - 0 0 22 -3,-2.1 3,-0.1 -4,-0.4 -3,-0.0 -0.443 56.3-158.8 -73.0 146.6 33.1 12.7 44.2 99 144 A K S S+ 0 0 185 1,-0.2 2,-0.4 -2,-0.1 -1,-0.1 0.754 81.6 37.1 -90.4 -32.6 35.2 12.7 41.0 100 145 A R + 0 0 92 177,-0.0 2,-0.3 182,-0.0 -1,-0.2 -0.946 61.9 171.5-122.0 143.9 32.4 11.3 38.9 101 146 A F + 0 0 4 -2,-0.4 177,-4.0 -3,-0.1 2,-0.2 -0.897 9.2 176.3-154.5 120.4 28.6 12.0 39.1 102 147 A S > - 0 0 0 -2,-0.3 4,-1.9 175,-0.2 5,-0.1 -0.535 48.0 -96.3-116.8 178.9 26.0 10.8 36.6 103 148 A E H > S+ 0 0 19 173,-0.3 4,-2.7 2,-0.2 5,-0.2 0.844 123.5 58.9 -62.4 -36.2 22.2 10.9 36.1 104 149 A V H > S+ 0 0 3 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.938 105.9 47.3 -58.4 -47.7 22.1 7.4 37.6 105 150 A D H > S+ 0 0 14 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.905 113.7 47.7 -60.3 -44.7 23.7 8.7 40.8 106 151 A A H X S+ 0 0 0 -4,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.888 111.5 51.5 -62.7 -40.4 21.2 11.6 40.9 107 152 A A H X S+ 0 0 0 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.882 107.2 51.7 -65.7 -41.2 18.3 9.3 40.3 108 153 A R H X S+ 0 0 78 -4,-2.3 4,-1.3 158,-0.2 -1,-0.2 0.891 112.2 47.7 -62.8 -40.8 19.3 6.9 43.1 109 154 A I H X S+ 0 0 8 -4,-1.7 4,-1.8 2,-0.2 3,-0.3 0.954 114.1 44.6 -62.5 -53.8 19.4 9.9 45.5 110 155 A I H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.800 107.4 59.2 -66.8 -30.2 16.1 11.4 44.4 111 156 A R H X S+ 0 0 83 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.884 106.8 48.3 -63.0 -39.8 14.4 7.9 44.5 112 157 A Q H X S+ 0 0 20 -4,-1.3 4,-2.3 -3,-0.3 -2,-0.2 0.930 112.5 47.7 -65.6 -45.9 15.3 7.6 48.2 113 158 A V H X S+ 0 0 0 -4,-1.8 4,-2.5 1,-0.2 -2,-0.2 0.948 113.9 47.5 -60.1 -48.3 14.0 11.1 48.9 114 159 A L H X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.825 109.4 54.4 -62.2 -34.3 10.8 10.4 47.0 115 160 A S H X S+ 0 0 26 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.947 111.6 43.4 -65.9 -48.5 10.3 7.1 48.8 116 161 A G H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.927 115.7 48.9 -60.0 -46.0 10.5 8.7 52.2 117 162 A I H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.880 108.6 53.1 -63.4 -40.8 8.3 11.6 51.2 118 163 A T H X S+ 0 0 13 -4,-2.3 4,-1.6 1,-0.2 -1,-0.2 0.896 110.2 48.5 -61.1 -43.0 5.7 9.2 49.7 119 164 A Y H X S+ 0 0 56 -4,-1.9 4,-0.8 2,-0.2 -2,-0.2 0.887 113.0 46.1 -65.1 -43.5 5.5 7.3 53.0 120 165 A M H ><>S+ 0 0 2 -4,-2.1 5,-2.3 2,-0.2 3,-0.9 0.913 110.0 53.5 -67.9 -42.1 5.1 10.4 55.2 121 166 A H H ><5S+ 0 0 30 -4,-2.6 3,-1.9 1,-0.3 -1,-0.2 0.854 101.1 60.9 -60.9 -36.4 2.5 11.9 52.9 122 167 A K H 3<5S+ 0 0 141 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.826 107.6 45.9 -55.1 -33.7 0.5 8.7 53.2 123 168 A N T <<5S- 0 0 40 -3,-0.9 -1,-0.3 -4,-0.8 -2,-0.2 0.148 121.4-110.5 -97.9 17.5 0.4 9.5 56.9 124 169 A K T < 5S+ 0 0 175 -3,-1.9 2,-0.5 1,-0.2 -3,-0.2 0.774 72.2 139.6 61.3 30.7 -0.6 13.1 56.3 125 170 A I < - 0 0 2 -5,-2.3 2,-0.3 -8,-0.1 -1,-0.2 -0.929 31.8-168.1-107.5 125.9 2.8 14.4 57.5 126 171 A V - 0 0 26 -2,-0.5 26,-1.4 1,-0.2 29,-0.3 -0.828 15.9-162.3-111.1 149.4 4.3 17.3 55.5 127 172 A H + 0 0 2 -2,-0.3 27,-0.5 24,-0.2 2,-0.4 0.897 12.0 178.5 -90.8 -58.7 7.9 18.6 55.7 128 173 A R S S+ 0 0 33 56,-0.1 46,-0.3 1,-0.1 -1,-0.1 -0.096 73.4 62.6 78.4 -32.7 7.6 22.1 54.1 129 174 A D + 0 0 34 -2,-0.4 2,-0.2 21,-0.2 5,-0.1 -0.108 67.6 156.2-114.0 35.2 11.3 22.9 54.7 130 175 A L + 0 0 2 42,-0.1 20,-0.1 3,-0.1 3,-0.0 -0.428 15.3 141.7 -66.6 128.8 12.9 20.1 52.6 131 176 A K > - 0 0 16 -2,-0.2 3,-2.1 1,-0.1 4,-0.2 -0.958 66.4 -88.6-160.4 164.8 16.4 21.1 51.6 132 177 A P G > S+ 0 0 9 0, 0.0 3,-2.5 0, 0.0 -41,-0.5 0.866 121.3 63.2 -51.3 -42.1 19.9 19.5 51.2 133 178 A E G 3 S+ 0 0 58 1,-0.3 -3,-0.1 -43,-0.1 16,-0.0 0.707 98.6 57.5 -53.1 -26.1 20.8 20.1 54.9 134 179 A N G < S+ 0 0 4 -3,-2.1 15,-2.4 -5,-0.1 2,-0.7 0.341 87.6 86.7 -89.9 5.6 17.8 17.8 55.8 135 180 A L E < + H 0 148C 0 -3,-2.5 -44,-2.7 13,-0.2 2,-0.3 -0.883 60.5 178.9-107.4 99.5 19.3 14.9 53.9 136 181 A L E -GH 90 147C 35 11,-2.6 11,-3.2 -2,-0.7 2,-0.3 -0.695 20.2-133.8 -97.7 152.9 21.7 13.0 56.1 137 182 A L E - H 0 146C 4 -48,-2.9 -49,-2.1 -2,-0.3 -48,-0.4 -0.774 10.7-138.2-101.9 149.3 23.7 9.9 55.2 138 183 A E S S+ 0 0 64 7,-1.7 -51,-0.7 -2,-0.3 2,-0.3 0.757 96.1 4.4 -74.1 -27.1 24.1 6.8 57.4 139 184 A S S S- 0 0 58 6,-0.3 2,-2.2 2,-0.2 -1,-0.3 -0.972 88.4 -98.5-150.2 155.5 27.7 6.8 56.4 140 185 A K S S+ 0 0 149 -2,-0.3 2,-0.3 -53,-0.2 -51,-0.1 -0.460 86.0 103.2 -75.3 78.5 29.9 9.1 54.3 141 186 A S S > S- 0 0 39 -2,-2.2 3,-1.1 4,-0.1 -2,-0.2 -0.984 79.5-121.1-155.9 150.6 29.7 7.1 51.1 142 187 A K T 3 S+ 0 0 112 -2,-0.3 -2,-0.1 1,-0.2 -1,-0.0 0.658 114.6 54.8 -69.8 -15.0 27.8 7.2 47.8 143 188 A D T 3 S+ 0 0 117 2,-0.1 -1,-0.2 -3,-0.0 2,-0.1 0.487 86.3 106.6 -94.9 -5.5 26.3 3.8 48.6 144 189 A A S < S- 0 0 12 -3,-1.1 2,-0.1 -5,-0.3 -4,-0.0 -0.362 75.7-102.6 -78.2 154.6 24.9 4.8 52.0 145 190 A N - 0 0 63 -2,-0.1 -7,-1.7 1,-0.1 2,-0.4 -0.458 29.7-125.8 -74.4 146.2 21.2 5.4 52.7 146 191 A I E - H 0 137C 1 -9,-0.2 2,-0.5 -2,-0.1 -9,-0.2 -0.756 19.6-162.3 -88.9 136.8 19.7 8.9 52.9 147 192 A R E - H 0 136C 32 -11,-3.2 -11,-2.6 -2,-0.4 2,-0.5 -0.993 11.6-142.4-119.8 123.0 17.7 9.8 56.0 148 193 A I E -fH 66 135C 1 -83,-2.6 -81,-2.6 -2,-0.5 2,-0.3 -0.734 20.2-158.2 -82.6 127.7 15.4 12.8 55.8 149 194 A I + 0 0 27 -15,-2.4 -81,-0.0 -2,-0.5 -15,-0.0 -0.763 60.2 30.0-105.3 152.2 15.4 14.8 59.1 150 195 A D > + 0 0 23 -2,-0.3 3,-1.4 1,-0.2 4,-0.5 0.503 63.9 164.1 84.0 12.6 12.7 17.2 60.4 151 196 A F T 3 S+ 0 0 15 -3,-0.2 -1,-0.2 1,-0.2 -24,-0.2 -0.336 72.4 10.4 -54.5 135.8 9.5 15.9 58.9 152 197 A G T >> S+ 0 0 2 -26,-1.4 3,-0.7 1,-0.1 4,-0.6 0.164 96.0 106.3 84.9 -18.8 6.5 17.4 60.8 153 198 A L H X> S+ 0 0 21 -3,-1.4 4,-1.7 1,-0.2 3,-1.2 0.879 73.8 55.8 -63.6 -39.7 8.4 20.0 62.8 154 199 A S H 34 S+ 0 0 3 -4,-0.5 -1,-0.2 -27,-0.5 5,-0.1 0.702 98.0 63.8 -70.9 -20.6 7.2 23.1 60.8 155 200 A T H <4 S+ 0 0 52 -3,-0.7 -1,-0.3 -29,-0.3 -2,-0.2 0.776 116.9 28.1 -66.7 -27.5 3.6 22.2 61.4 156 201 A H H << S+ 0 0 5 -3,-1.2 -111,-2.7 -4,-0.6 -110,-0.4 0.593 118.7 49.9-114.1 -16.9 4.1 22.8 65.1 157 202 A F B < S-E 44 0B 4 -4,-1.7 2,-0.3 -113,-0.3 -113,-0.2 -0.979 73.1-126.5-130.8 142.2 6.9 25.3 65.5 158 203 A E - 0 0 92 -115,-2.1 -115,-0.4 -2,-0.4 2,-0.2 -0.680 26.9-120.6 -88.8 137.1 7.5 28.7 63.9 159 204 A A - 0 0 58 -2,-0.3 2,-0.1 -5,-0.1 -1,-0.1 -0.477 29.2-115.8 -74.8 144.1 10.8 29.5 62.1 160 205 A S - 0 0 45 -2,-0.2 -1,-0.1 1,-0.1 -118,-0.0 -0.453 5.6-135.8 -79.2 152.1 12.9 32.4 63.4 161 206 A K + 0 0 170 -2,-0.1 2,-0.3 4,-0.1 -1,-0.1 0.342 67.1 123.2 -86.1 4.7 13.6 35.5 61.3 162 207 A K >> - 0 0 121 1,-0.1 4,-1.6 2,-0.0 3,-1.0 -0.540 63.7-138.7 -68.5 130.5 17.3 35.3 62.4 163 208 A M H 3> S+ 0 0 30 -2,-0.3 4,-1.0 1,-0.3 -1,-0.1 0.829 100.9 60.3 -65.7 -35.2 19.4 35.1 59.3 164 209 A K H 34 S+ 0 0 85 1,-0.2 -1,-0.3 2,-0.2 136,-0.1 0.806 111.9 42.1 -59.6 -29.2 21.8 32.5 60.7 165 210 A D H <4 S+ 0 0 48 -3,-1.0 -2,-0.2 1,-0.1 -1,-0.2 0.774 121.5 39.1 -86.0 -31.1 18.7 30.3 61.0 166 211 A K H >< S+ 0 0 51 -4,-1.6 3,-1.2 2,-0.1 4,-0.4 0.219 81.1 128.2-108.8 14.2 17.2 31.1 57.7 167 212 A I T 3< S+ 0 0 19 -4,-1.0 256,-0.1 1,-0.2 255,-0.1 -0.489 79.8 10.3 -64.5 136.6 20.3 31.3 55.5 168 213 A G T 3 S+ 0 0 19 254,-0.3 3,-0.3 -2,-0.2 -1,-0.2 0.441 96.5 108.4 77.7 2.6 20.0 29.2 52.4 169 214 A T X> + 0 0 27 -3,-1.2 3,-1.2 1,-0.2 4,-0.7 0.784 58.6 73.5 -82.9 -28.2 16.3 28.4 52.7 170 215 A A T 34 S+ 0 0 5 -4,-0.4 3,-0.4 1,-0.2 -1,-0.2 0.781 85.2 65.1 -60.0 -32.1 15.0 30.6 49.8 171 216 A Y T 34 S+ 0 0 6 -3,-0.3 34,-0.3 1,-0.2 -1,-0.2 0.796 110.3 34.2 -61.9 -29.5 16.1 28.3 47.0 172 217 A Y T <4 S+ 0 0 12 -3,-1.2 -1,-0.2 -4,-0.2 2,-0.2 0.494 84.7 112.2-110.7 -11.4 13.9 25.4 48.0 173 218 A I < - 0 0 30 -4,-0.7 -44,-0.1 -3,-0.4 14,-0.1 -0.481 67.8-117.9 -75.1 135.7 10.6 26.8 49.3 174 219 A A >> - 0 0 0 -46,-0.3 4,-1.3 -2,-0.2 3,-1.1 -0.424 18.1-123.6 -71.9 144.5 7.5 26.3 47.3 175 220 A P H 3> S+ 0 0 1 0, 0.0 4,-1.3 0, 0.0 3,-0.3 0.876 111.4 57.1 -55.2 -39.3 5.7 29.4 46.0 176 221 A E H 3> S+ 0 0 16 1,-0.2 4,-0.9 2,-0.2 5,-0.5 0.734 100.5 58.1 -68.9 -22.5 2.5 28.5 47.6 177 222 A V H <4 S+ 0 0 23 -3,-1.1 -1,-0.2 2,-0.2 3,-0.2 0.876 103.2 53.8 -69.4 -39.5 4.3 28.3 51.0 178 223 A L H < S+ 0 0 67 -4,-1.3 -2,-0.2 -3,-0.3 -1,-0.2 0.853 112.2 44.0 -59.6 -36.5 5.3 32.0 50.5 179 224 A H H < S- 0 0 113 -4,-1.3 -1,-0.2 2,-0.1 -2,-0.2 0.611 115.3-115.3 -90.7 -13.8 1.6 32.9 49.9 180 225 A G S < S+ 0 0 49 -4,-0.9 2,-0.8 -3,-0.2 -3,-0.1 0.061 84.0 98.5 111.6 -25.6 0.2 30.9 52.8 181 226 A T + 0 0 128 -5,-0.5 2,-0.3 2,-0.0 -2,-0.1 -0.860 51.2 143.3 -99.4 106.9 -1.9 28.1 51.3 182 227 A Y + 0 0 80 -2,-0.8 2,-0.2 -5,-0.1 -5,-0.0 -0.960 22.7 175.0-143.2 161.4 0.1 24.9 51.0 183 228 A D > - 0 0 70 -2,-0.3 3,-2.2 -55,-0.0 4,-0.3 -0.728 60.9 -55.4-145.3-168.5 -0.2 21.1 51.4 184 229 A E T >> S+ 0 0 79 1,-0.3 3,-1.6 -2,-0.2 4,-0.6 0.707 118.7 76.6 -53.3 -24.7 2.0 18.0 50.9 185 230 A K H >> S+ 0 0 30 1,-0.3 4,-1.6 2,-0.2 3,-0.7 0.751 78.0 73.6 -61.7 -22.7 2.7 19.0 47.2 186 231 A C H <> S+ 0 0 0 -3,-2.2 4,-1.9 1,-0.2 -1,-0.3 0.821 91.5 57.5 -59.8 -29.9 5.2 21.7 48.5 187 232 A D H <> S+ 0 0 0 -3,-1.6 4,-1.6 -4,-0.3 -1,-0.2 0.803 101.7 53.9 -71.0 -31.1 7.5 18.8 49.3 188 233 A V H S- 0 0 52 213,-0.1 4,-2.1 214,-0.1 5,-0.2 -0.873 88.8 -85.2-146.9 174.7 20.2 37.8 48.3 210 255 A E H > S+ 0 0 61 211,-0.6 4,-2.8 -2,-0.3 5,-0.2 0.918 123.2 49.1 -52.5 -52.7 17.0 36.4 50.0 211 256 A Y H > S+ 0 0 142 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.902 110.0 50.4 -54.9 -48.6 14.7 38.9 48.3 212 257 A D H > S+ 0 0 59 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.901 113.9 45.6 -59.6 -42.3 16.0 38.3 44.7 213 258 A I H X S+ 0 0 5 -4,-2.1 4,-2.5 2,-0.2 3,-0.5 0.956 112.8 48.4 -65.1 -52.5 15.7 34.5 45.1 214 259 A L H X S+ 0 0 39 -4,-2.8 4,-2.6 1,-0.3 -2,-0.2 0.833 107.5 56.7 -60.6 -34.4 12.2 34.6 46.6 215 260 A K H X S+ 0 0 116 -4,-2.3 4,-1.7 -5,-0.2 -1,-0.3 0.877 109.8 45.6 -62.2 -39.7 11.1 37.0 43.8 216 261 A K H X S+ 0 0 113 -4,-1.3 4,-1.9 -3,-0.5 5,-0.5 0.900 112.1 50.7 -71.9 -41.6 12.2 34.4 41.3 217 262 A V H < S+ 0 0 0 -4,-2.5 -2,-0.2 2,-0.2 -1,-0.2 0.927 110.6 50.0 -57.7 -45.6 10.5 31.5 43.2 218 263 A E H < S+ 0 0 85 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.874 109.5 48.8 -66.0 -40.3 7.3 33.4 43.3 219 264 A K H < S- 0 0 157 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.853 98.9-151.1 -64.2 -34.9 7.3 34.2 39.6 220 265 A G < + 0 0 13 -4,-1.9 2,-0.4 1,-0.2 -3,-0.1 0.477 43.0 139.2 81.3 3.9 8.0 30.5 39.2 221 266 A K + 0 0 162 -5,-0.5 2,-0.3 25,-0.0 -1,-0.2 -0.683 17.1 153.6 -88.8 132.4 9.9 30.8 35.9 222 267 A Y - 0 0 46 -2,-0.4 2,-0.3 -17,-0.1 -17,-0.1 -0.952 19.0-157.9-147.6 164.2 13.0 28.6 35.4 223 268 A T - 0 0 62 -2,-0.3 3,-0.2 -19,-0.3 -2,-0.0 -0.882 30.7-132.0-140.4 167.7 14.9 27.2 32.3 224 269 A F + 0 0 37 -2,-0.3 5,-0.1 1,-0.1 13,-0.0 -0.235 68.3 122.9-107.6 38.8 17.3 24.6 31.0 225 270 A E + 0 0 155 3,-0.1 -1,-0.1 4,-0.1 5,-0.1 0.742 39.3 103.4 -73.9 -25.9 19.3 27.3 29.2 226 271 A L S > S- 0 0 60 -3,-0.2 3,-1.8 1,-0.1 4,-0.2 -0.307 80.7-120.9 -64.3 143.5 22.6 26.5 30.9 227 272 A P G > S+ 0 0 97 0, 0.0 3,-2.0 0, 0.0 4,-0.3 0.820 106.6 65.5 -57.5 -35.9 25.1 24.6 28.7 228 273 A Q G > S+ 0 0 12 1,-0.3 3,-1.0 2,-0.2 53,-0.1 0.653 84.8 74.1 -65.6 -15.8 25.4 21.6 31.1 229 274 A W G X S+ 0 0 0 -3,-1.8 3,-0.9 1,-0.2 -1,-0.3 0.622 81.0 71.9 -70.2 -14.0 21.7 20.7 30.5 230 275 A K G < S+ 0 0 177 -3,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.787 93.1 55.9 -68.1 -27.6 22.7 19.4 27.0 231 276 A K G < S+ 0 0 81 -3,-1.0 2,-0.4 -4,-0.3 -1,-0.2 0.503 96.0 89.0 -79.2 -3.5 24.4 16.5 28.9 232 277 A V S < S- 0 0 10 -3,-0.9 5,-0.0 -4,-0.1 -33,-0.0 -0.794 81.3-111.6-106.1 138.6 21.0 15.7 30.6 233 278 A S > - 0 0 22 -2,-0.4 4,-1.6 1,-0.1 5,-0.1 -0.197 17.7-127.4 -61.0 150.5 18.3 13.3 29.3 234 279 A E H > S+ 0 0 108 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.812 110.7 61.9 -66.6 -31.2 14.9 14.7 28.2 235 280 A S H > S+ 0 0 22 2,-0.2 4,-1.6 1,-0.2 27,-0.3 0.895 102.9 48.7 -61.6 -42.3 13.3 12.2 30.6 236 281 A A H > S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.927 111.7 49.3 -61.7 -46.5 15.0 13.9 33.6 237 282 A K H X S+ 0 0 23 -4,-1.6 4,-2.3 1,-0.2 -2,-0.2 0.853 106.8 56.3 -61.9 -37.7 13.9 17.3 32.4 238 283 A D H X S+ 0 0 54 -4,-2.3 4,-1.7 2,-0.2 -1,-0.2 0.888 107.5 48.2 -60.9 -41.9 10.3 16.0 32.0 239 284 A L H X S+ 0 0 0 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.907 109.9 52.2 -66.0 -42.2 10.3 14.9 35.7 240 285 A I H X S+ 0 0 0 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.902 107.6 52.5 -59.7 -42.0 11.6 18.2 36.8 241 286 A R H < S+ 0 0 97 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.887 110.9 47.1 -61.1 -40.8 8.8 20.0 34.8 242 287 A K H >< S+ 0 0 87 -4,-1.7 10,-1.7 1,-0.2 3,-0.7 0.855 115.2 45.3 -69.8 -35.2 6.2 17.9 36.6 243 288 A M H 3< S+ 0 0 0 -4,-2.2 -51,-0.2 1,-0.2 -2,-0.2 0.789 115.0 47.4 -79.0 -30.1 7.7 18.5 40.0 244 289 A L T 3< S+ 0 0 6 -4,-2.4 2,-0.3 -5,-0.2 -1,-0.2 0.011 77.8 138.4-101.0 26.8 8.2 22.2 39.5 245 290 A T < - 0 0 42 -3,-0.7 6,-0.1 1,-0.1 -3,-0.1 -0.578 51.7-138.3 -69.2 134.4 4.7 22.8 38.1 246 291 A Y S S+ 0 0 87 -2,-0.3 -70,-0.2 4,-0.1 -1,-0.1 0.951 83.9 63.3 -68.6 -57.3 3.4 26.0 39.7 247 292 A V S >> S- 0 0 76 1,-0.1 3,-1.5 3,-0.1 4,-0.9 -0.590 79.9-142.3 -73.2 120.9 -0.2 25.2 40.6 248 293 A P G >4 S+ 0 0 29 0, 0.0 3,-0.6 0, 0.0 -1,-0.1 0.811 96.7 58.3 -59.9 -33.6 -0.0 22.5 43.2 249 294 A S G 34 S+ 0 0 97 1,-0.2 -2,-0.1 -3,-0.0 -3,-0.0 0.768 110.2 45.1 -65.9 -26.0 -3.1 20.6 42.0 250 295 A M G <4 S+ 0 0 140 -3,-1.5 -1,-0.2 2,-0.1 2,-0.2 0.566 95.4 100.6 -90.1 -12.8 -1.4 20.2 38.6 251 296 A R S << S- 0 0 4 -4,-0.9 -8,-0.2 -3,-0.6 -9,-0.1 -0.495 83.5-102.5 -76.0 143.6 1.9 19.2 40.2 252 297 A I - 0 0 28 -10,-1.7 2,-0.1 -2,-0.2 -1,-0.1 -0.284 34.3-120.0 -64.7 145.0 2.9 15.6 40.3 253 298 A S > - 0 0 33 1,-0.1 4,-2.2 -65,-0.0 5,-0.1 -0.457 21.6-114.4 -78.4 160.2 2.5 13.7 43.6 254 299 A A H > S+ 0 0 2 2,-0.2 4,-1.6 1,-0.2 -136,-0.2 0.885 117.9 54.8 -59.8 -39.4 5.5 12.0 45.3 255 300 A R H > S+ 0 0 116 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.922 111.4 42.0 -59.8 -48.8 3.9 8.6 44.6 256 301 A D H 4 S+ 0 0 91 1,-0.2 4,-0.4 2,-0.2 3,-0.3 0.798 107.5 61.5 -72.3 -29.0 3.6 9.2 40.9 257 302 A A H >< S+ 0 0 0 -4,-2.2 3,-1.0 1,-0.2 6,-0.3 0.876 100.3 55.8 -62.5 -36.2 7.0 10.8 40.8 258 303 A L H 3< S+ 0 0 26 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.786 106.2 51.0 -62.9 -30.2 8.4 7.4 41.9 259 304 A D T 3< S+ 0 0 86 -4,-0.7 -1,-0.2 -3,-0.3 -2,-0.2 0.500 83.9 125.0 -84.6 -6.0 6.6 5.8 38.9 260 305 A H S <> S- 0 0 16 -3,-1.0 4,-2.6 -4,-0.4 3,-0.3 -0.245 71.8-120.5 -60.1 141.9 8.2 8.2 36.5 261 306 A E H > S+ 0 0 133 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.817 111.9 55.6 -49.5 -40.5 10.2 6.7 33.5 262 307 A W H > S+ 0 0 0 -27,-0.3 4,-2.8 2,-0.2 -1,-0.2 0.938 111.0 42.7 -61.3 -49.0 13.4 8.5 34.6 263 308 A I H > S+ 0 0 0 -3,-0.3 4,-1.4 -6,-0.3 -2,-0.2 0.953 117.8 46.7 -62.1 -49.4 13.3 7.0 38.1 264 309 A Q H < S+ 0 0 108 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.882 119.4 39.7 -59.9 -42.7 12.3 3.6 36.8 265 310 A T H >< S+ 0 0 39 -4,-2.9 3,-0.6 -5,-0.2 7,-0.3 0.905 119.8 41.3 -75.8 -43.6 15.0 3.6 34.1 266 311 A Y H 3< S+ 0 0 29 -4,-2.8 -158,-0.2 -5,-0.3 -2,-0.2 0.511 107.8 58.5 -91.6 -5.5 17.9 5.2 36.0 267 312 A T T 3< S+ 0 0 23 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.1 0.299 71.0 131.0-105.6 7.8 17.6 3.5 39.4 268 313 A K < - 0 0 102 -3,-0.6 -160,-0.1 -4,-0.1 4,-0.1 -0.365 64.1-131.1 -54.1 135.4 18.0 -0.0 38.0 269 314 A E S S+ 0 0 171 1,-0.1 2,-0.7 2,-0.1 -1,-0.1 0.895 100.3 60.6 -57.0 -41.5 20.6 -1.9 40.0 270 315 A Q S S- 0 0 155 2,-0.0 2,-0.6 1,-0.0 -1,-0.1 -0.821 92.7-133.1 -90.5 115.5 22.2 -2.9 36.7 271 316 A I + 0 0 85 -2,-0.7 -5,-0.1 1,-0.2 4,-0.1 -0.595 38.8 159.5 -74.2 113.2 23.3 0.2 34.8 272 317 A S + 0 0 84 -2,-0.6 2,-0.2 -7,-0.3 -1,-0.2 0.262 51.2 75.8-116.4 7.2 22.0 -0.2 31.2 273 318 A V S S- 0 0 44 -8,-0.1 2,-0.2 1,-0.1 -169,-0.0 -0.654 93.5 -80.5-114.3 168.7 22.1 3.5 30.2 274 319 A D - 0 0 140 -2,-0.2 -171,-0.2 1,-0.1 -170,-0.1 -0.507 39.0-167.3 -66.4 138.3 24.9 5.9 29.2 275 320 A V + 0 0 52 -2,-0.2 2,-0.1 -173,-0.1 -1,-0.1 -0.455 13.6 169.2-130.9 61.0 26.6 7.4 32.3 276 321 A P - 0 0 72 0, 0.0 -173,-0.3 0, 0.0 2,-0.3 -0.490 45.3-102.6 -68.9 143.0 28.8 10.3 31.3 277 322 A S - 0 0 24 -2,-0.1 2,-2.2 -175,-0.1 3,-0.2 -0.506 19.2-135.5 -68.9 129.4 30.1 12.3 34.3 278 323 A L > + 0 0 3 -177,-4.0 4,-1.6 -2,-0.3 -1,-0.1 -0.527 42.4 164.9 -81.0 71.7 28.1 15.6 34.8 279 324 A D H > + 0 0 86 -2,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.852 66.7 49.8 -67.2 -41.4 31.5 17.3 35.3 280 325 A N H > S+ 0 0 65 -3,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.893 109.9 53.5 -64.0 -39.4 30.3 20.9 35.0 281 326 A A H > S+ 0 0 3 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.836 106.7 52.0 -62.5 -35.7 27.5 20.2 37.5 282 327 A I H X S+ 0 0 5 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.937 110.7 47.4 -66.7 -46.4 30.1 18.8 40.0 283 328 A L H X S+ 0 0 103 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.928 116.0 45.8 -57.8 -46.1 32.2 22.0 39.7 284 329 A N H X S+ 0 0 30 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.891 111.1 50.5 -65.1 -43.0 29.1 24.1 40.1 285 330 A I H X S+ 0 0 3 -4,-2.7 4,-3.0 2,-0.2 5,-0.3 0.863 109.5 51.8 -68.8 -33.4 27.7 22.1 43.1 286 331 A R H X S+ 0 0 96 -4,-2.3 4,-2.9 2,-0.2 -1,-0.2 0.928 112.2 46.5 -61.2 -46.3 31.1 22.4 44.8 287 332 A Q H X S+ 0 0 132 -4,-1.9 4,-2.3 -5,-0.2 -2,-0.2 0.879 115.0 47.5 -62.4 -39.8 30.9 26.2 44.2 288 333 A F H X S+ 0 0 17 -4,-2.6 4,-2.6 -87,-0.2 -2,-0.2 0.967 115.8 41.9 -66.2 -55.1 27.3 26.3 45.5 289 334 A Q H X S+ 0 0 13 -4,-3.0 4,-2.8 1,-0.2 5,-0.2 0.922 114.5 53.9 -59.2 -46.1 27.9 24.2 48.6 290 335 A G H X S+ 0 0 8 -4,-2.9 4,-2.1 -5,-0.3 113,-0.2 0.912 110.6 45.0 -52.5 -51.0 31.1 26.1 49.2 291 336 A T H X S+ 0 0 13 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.905 114.2 49.2 -61.7 -45.3 29.4 29.5 49.1 292 337 A Q H X S+ 0 0 20 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.893 113.7 45.7 -62.2 -42.7 26.5 28.3 51.3 293 338 A K H X S+ 0 0 42 -4,-2.8 4,-2.4 2,-0.2 -1,-0.2 0.840 111.8 50.8 -73.2 -34.5 28.8 26.9 53.9 294 339 A L H X S+ 0 0 0 -4,-2.1 4,-2.5 -5,-0.2 -2,-0.2 0.915 110.7 49.2 -69.0 -42.1 31.1 29.9 54.0 295 340 A A H X S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.911 113.6 46.7 -60.3 -44.4 28.1 32.3 54.4 296 341 A Q H X S+ 0 0 49 -4,-1.9 4,-2.2 1,-0.2 -2,-0.2 0.909 112.3 50.3 -62.3 -44.4 26.8 30.1 57.3 297 342 A A H X S+ 0 0 2 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.885 108.3 53.2 -62.2 -40.3 30.3 29.9 58.8 298 343 A A H X S+ 0 0 1 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.921 111.0 44.6 -61.9 -49.1 30.6 33.7 58.7 299 344 A L H X S+ 0 0 19 -4,-1.9 4,-2.6 2,-0.2 -1,-0.2 0.883 114.1 49.8 -63.7 -40.7 27.3 34.4 60.5 300 345 A L H X S+ 0 0 34 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.859 110.1 52.1 -66.6 -35.8 28.1 31.7 63.1 301 346 A Y H X S+ 0 0 14 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.914 111.1 46.1 -63.1 -46.0 31.5 33.3 63.6 302 347 A M H X S+ 0 0 18 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.912 113.7 49.9 -64.4 -43.0 30.0 36.7 64.2 303 348 A G H X S+ 0 0 12 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.921 110.5 49.0 -57.7 -48.2 27.4 35.2 66.5 304 349 A S H X S+ 0 0 38 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.822 108.2 54.6 -64.6 -33.6 30.1 33.3 68.5 305 350 A K H X S+ 0 0 61 -4,-1.8 4,-1.7 2,-0.2 -1,-0.2 0.936 109.8 46.1 -65.1 -47.4 32.2 36.5 68.8 306 351 A L H X S+ 0 0 80 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.914 112.0 51.9 -58.7 -45.6 29.2 38.4 70.3 307 352 A T H X S+ 0 0 62 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.871 108.4 51.7 -59.1 -39.1 28.5 35.5 72.7 308 353 A S H X S+ 0 0 17 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.825 105.7 54.4 -68.9 -34.7 32.2 35.5 73.8 309 354 A Q H X S+ 0 0 47 -4,-1.7 4,-1.6 2,-0.2 -2,-0.2 0.923 112.1 44.5 -60.4 -46.5 32.0 39.3 74.6 310 355 A D H X S+ 0 0 97 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.926 115.3 46.6 -65.1 -47.6 29.0 38.7 76.8 311 356 A E H X S+ 0 0 9 -4,-2.5 4,-2.6 1,-0.2 5,-0.2 0.823 108.1 56.4 -66.3 -34.9 30.5 35.6 78.5 312 357 A T H X S+ 0 0 54 -4,-2.2 4,-1.6 2,-0.2 -1,-0.2 0.914 111.8 43.8 -61.0 -43.4 33.9 37.4 79.1 313 358 A K H X S+ 0 0 134 -4,-1.6 4,-1.6 2,-0.2 -2,-0.2 0.923 116.8 45.0 -66.7 -47.9 32.0 40.1 81.0 314 359 A E H X S+ 0 0 91 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.867 112.7 50.9 -66.0 -39.1 29.8 37.8 83.0 315 360 A L H X S+ 0 0 0 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.863 109.2 50.3 -69.0 -37.2 32.6 35.4 83.9 316 361 A T H X S+ 0 0 53 -4,-1.6 4,-2.4 -5,-0.2 -1,-0.2 0.863 109.8 51.3 -67.0 -37.7 34.9 38.2 85.2 317 362 A A H X S+ 0 0 54 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.908 108.9 51.5 -64.5 -43.3 32.1 39.5 87.3 318 363 A I H X S+ 0 0 8 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.936 113.3 43.0 -59.2 -50.1 31.5 36.0 88.8 319 364 A F H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.876 110.8 56.2 -65.0 -40.2 35.2 35.6 89.7 320 365 A H H < S+ 0 0 126 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.892 108.2 48.4 -55.8 -42.2 35.4 39.2 91.0 321 366 A K H < S+ 0 0 164 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.882 113.2 46.8 -66.2 -40.0 32.5 38.3 93.4 322 367 A M H < S+ 0 0 31 -4,-1.9 2,-1.9 -5,-0.2 -2,-0.2 0.769 92.3 88.9 -69.4 -27.5 34.3 35.1 94.5 323 368 A D < + 0 0 19 -4,-2.0 -1,-0.2 1,-0.2 5,-0.1 -0.510 45.5 158.0 -78.4 80.3 37.6 37.1 94.9 324 369 A K S S+ 0 0 182 -2,-1.9 -1,-0.2 1,-0.2 -2,-0.1 0.761 73.0 53.5 -77.7 -27.1 37.1 38.2 98.6 325 370 A N S S- 0 0 139 -3,-0.2 -1,-0.2 4,-0.1 -2,-0.1 0.835 99.2-138.9 -70.1 -35.6 40.8 38.8 99.1 326 371 A G + 0 0 58 -6,-0.1 -2,-0.1 3,-0.1 -3,-0.1 0.666 69.7 118.0 80.6 19.5 41.0 41.1 96.0 327 372 A D S S- 0 0 86 2,-0.2 3,-0.1 49,-0.0 -3,-0.0 0.497 76.7-128.1 -93.5 -6.5 44.3 39.6 94.9 328 373 A G S S+ 0 0 14 1,-0.2 49,-2.3 -9,-0.1 2,-0.5 0.546 71.0 116.6 74.7 9.7 42.8 38.4 91.6 329 374 A Q E +I 376 0D 71 47,-0.2 2,-0.3 48,-0.1 47,-0.2 -0.945 37.3 174.3-120.8 119.5 44.1 34.8 92.1 330 375 A L E -I 375 0D 3 45,-2.3 45,-2.9 -2,-0.5 2,-0.2 -0.758 23.9-121.7-117.6 162.1 41.8 31.8 92.5 331 376 A D > - 0 0 54 -2,-0.3 4,-2.4 43,-0.2 5,-0.2 -0.472 38.5 -90.9 -97.6 174.4 42.4 28.0 92.8 332 377 A R H > S+ 0 0 93 41,-0.3 4,-2.1 1,-0.2 5,-0.2 0.874 123.8 51.8 -49.6 -48.3 41.1 25.1 90.7 333 378 A A H > S+ 0 0 66 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.911 111.3 46.4 -58.8 -47.2 38.0 24.6 92.8 334 379 A E H > S+ 0 0 67 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.900 110.9 52.5 -64.0 -42.4 37.0 28.2 92.7 335 380 A L H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.879 109.0 49.7 -61.9 -41.3 37.5 28.4 88.9 336 381 A I H X S+ 0 0 12 -4,-2.1 4,-2.5 -5,-0.2 -1,-0.2 0.912 110.9 49.3 -63.8 -44.1 35.3 25.4 88.3 337 382 A E H X S+ 0 0 82 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.904 112.2 48.7 -63.3 -43.2 32.5 26.8 90.4 338 383 A G H X S+ 0 0 0 -4,-2.3 4,-1.7 2,-0.2 -1,-0.2 0.901 111.7 47.9 -63.1 -43.8 32.6 30.1 88.7 339 384 A Y H X S+ 0 0 4 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.930 112.3 49.6 -63.9 -46.1 32.6 28.6 85.2 340 385 A K H X S+ 0 0 99 -4,-2.5 4,-1.2 1,-0.2 -2,-0.2 0.865 108.4 54.1 -59.1 -37.7 29.7 26.4 86.2 341 386 A E H X S+ 0 0 50 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.862 106.0 53.4 -64.0 -36.6 27.9 29.5 87.5 342 387 A L H X S+ 0 0 1 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.924 104.1 54.0 -62.6 -46.4 28.4 31.1 84.1 343 388 A M H < S+ 0 0 25 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.781 114.1 42.2 -64.0 -29.1 26.8 28.3 82.2 344 389 A R H < S+ 0 0 158 -4,-1.2 -1,-0.2 -5,-0.2 -2,-0.2 0.854 109.6 58.5 -78.5 -40.3 23.7 28.5 84.4 345 390 A M H < S+ 0 0 92 -4,-2.2 2,-1.4 1,-0.2 -2,-0.2 0.943 103.0 53.1 -57.8 -54.6 23.7 32.4 84.3 346 391 A K S < S- 0 0 51 -4,-2.5 -1,-0.2 1,-0.2 -35,-0.0 -0.729 80.3-166.6 -78.7 93.1 23.4 32.4 80.5 347 392 A G S S+ 0 0 39 -2,-1.4 2,-1.9 1,-0.2 -1,-0.2 0.828 74.2 73.4 -52.8 -38.5 20.3 30.1 80.4 348 393 A Q S S+ 0 0 90 -3,-0.1 2,-0.3 -310,-0.0 -1,-0.2 -0.557 72.1 125.6 -81.5 76.0 20.7 29.5 76.7 349 394 A D - 0 0 37 -2,-1.9 -6,-0.0 1,-0.1 -2,-0.0 -0.784 68.3 -83.6-119.0 168.5 23.8 27.2 76.8 350 395 A A - 0 0 27 -2,-0.3 -1,-0.1 2,-0.3 -329,-0.0 -0.277 47.8-101.8 -62.8 160.7 24.3 23.8 75.4 351 396 A S 0 0 64 1,-0.1 -343,-0.1 3,-0.0 -1,-0.1 0.781 360.0 360.0 -57.6 -28.7 23.0 20.8 77.4 352 397 A M 0 0 37 2,-0.1 -2,-0.3 3,-0.0 -1,-0.1 -0.820 360.0 360.0 -91.7 360.0 26.6 20.2 78.6 353 ! 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 0.0 354 401 A S 0 0 123 0, 0.0 4,-0.3 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 -14.8 29.5 19.7 82.3 355 402 A A > + 0 0 60 1,-0.2 4,-1.4 2,-0.1 5,-0.1 0.366 360.0 88.0 -86.8 4.9 32.4 20.5 79.8 356 403 A V H > S+ 0 0 10 2,-0.2 4,-3.8 1,-0.2 -1,-0.2 0.905 78.0 54.3 -73.4 -45.2 33.8 23.0 82.3 357 404 A E H > S+ 0 0 98 -3,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.882 113.2 42.1 -63.3 -42.8 36.1 20.9 84.5 358 405 A H H > S+ 0 0 127 -4,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.926 115.9 51.2 -66.2 -45.2 38.1 19.4 81.6 359 406 A E H X S+ 0 0 32 -4,-1.4 4,-2.7 2,-0.2 -2,-0.2 0.929 109.2 51.2 -52.8 -48.9 38.1 22.9 80.0 360 407 A V H X S+ 0 0 0 -4,-3.8 4,-3.1 1,-0.2 -2,-0.2 0.941 111.1 46.7 -55.1 -51.8 39.4 24.3 83.3 361 408 A D H X S+ 0 0 57 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.858 112.6 50.5 -61.1 -36.8 42.3 21.8 83.5 362 409 A Q H X S+ 0 0 70 -4,-2.5 4,-1.2 2,-0.2 -1,-0.2 0.873 112.6 46.5 -68.4 -38.3 43.1 22.4 79.8 363 410 A V H X S+ 0 0 0 -4,-2.7 4,-2.7 -5,-0.2 3,-0.3 0.919 111.7 51.2 -66.0 -45.2 43.2 26.2 80.5 364 411 A L H X S+ 0 0 2 -4,-3.1 4,-3.2 1,-0.2 7,-0.2 0.845 103.2 59.2 -61.5 -37.6 45.3 25.6 83.7 365 412 A D H < S+ 0 0 80 -4,-2.0 -1,-0.2 -5,-0.2 4,-0.2 0.904 113.4 38.7 -54.1 -44.3 47.8 23.5 81.7 366 413 A A H < S+ 0 0 71 -4,-1.2 3,-0.3 -3,-0.3 -2,-0.2 0.903 121.8 42.0 -73.4 -44.4 48.3 26.5 79.4 367 414 A V H < S+ 0 0 32 -4,-2.7 2,-0.2 1,-0.2 -2,-0.2 0.894 137.4 1.7 -75.4 -44.0 48.3 29.2 82.2 368 415 A D >< - 0 0 33 -4,-3.2 3,-0.9 -5,-0.2 -1,-0.2 -0.687 62.3-178.3-148.9 90.6 50.3 27.3 84.9 369 416 A F T 3 S+ 0 0 152 -3,-0.3 -1,-0.1 1,-0.2 -3,-0.1 0.893 84.7 50.8 -57.1 -46.2 51.7 23.9 83.9 370 417 A D T 3 S- 0 0 119 1,-0.1 -1,-0.2 -5,-0.1 -5,-0.1 0.709 96.8-137.8 -65.8 -22.7 53.3 23.1 87.2 371 418 A K < + 0 0 81 -3,-0.9 -2,-0.1 -7,-0.2 -1,-0.1 0.932 36.6 169.2 57.1 49.1 50.1 23.9 89.2 372 419 A N - 0 0 138 2,-0.1 2,-0.1 1,-0.0 -1,-0.1 0.859 58.7 -77.3 -56.8 -40.1 52.2 25.8 91.8 373 420 A G S S+ 0 0 29 1,-0.3 -41,-0.3 -43,-0.1 2,-0.2 -0.388 92.0 32.4-178.5 -94.3 49.1 27.2 93.4 374 421 A Y - 0 0 149 -43,-0.1 2,-0.4 -2,-0.1 -1,-0.3 -0.531 56.2-139.0-103.2 161.1 46.8 30.0 92.3 375 422 A I E -I 330 0D 3 -45,-2.9 -45,-2.3 -2,-0.2 2,-0.8 -0.943 22.6-116.6-123.1 133.1 45.8 31.4 89.0 376 423 A E E > -I 329 0D 64 -2,-0.4 4,-1.9 -47,-0.2 3,-0.5 -0.605 28.0-153.5 -60.4 108.3 45.3 34.9 87.7 377 424 A Y H > S+ 0 0 25 -49,-2.3 4,-2.4 -2,-0.8 -1,-0.2 0.772 93.1 60.6 -64.4 -24.5 41.5 34.6 87.0 378 425 A S H > S+ 0 0 64 -50,-0.5 4,-1.7 2,-0.2 -1,-0.2 0.910 106.1 46.2 -63.0 -44.5 41.9 37.3 84.3 379 426 A E H > S+ 0 0 98 -3,-0.5 4,-2.0 1,-0.2 -2,-0.2 0.868 112.1 52.4 -63.4 -38.4 44.4 35.0 82.5 380 427 A F H X S+ 0 0 0 -4,-1.9 4,-2.8 2,-0.2 -2,-0.2 0.923 105.6 53.2 -63.6 -46.9 42.0 32.1 82.9 381 428 A V H X S+ 0 0 5 -4,-2.4 4,-2.8 2,-0.2 5,-0.4 0.923 109.9 48.2 -55.6 -48.9 39.0 34.0 81.4 382 429 A T H X S+ 0 0 79 -4,-1.7 4,-3.0 1,-0.2 5,-0.5 0.963 115.4 42.6 -56.8 -56.3 41.0 34.9 78.3 383 430 A V H X S+ 0 0 35 -4,-2.0 4,-0.6 1,-0.2 5,-0.2 0.843 115.7 51.5 -62.5 -33.5 42.3 31.4 77.7 384 431 A A H X S+ 0 0 0 -4,-2.8 4,-0.9 -5,-0.2 -1,-0.2 0.922 125.3 23.9 -67.4 -45.9 38.8 29.9 78.5 385 432 A M H X S+ 0 0 4 -4,-2.8 4,-1.3 -5,-0.2 -2,-0.2 0.925 120.0 54.0 -86.4 -53.1 36.9 32.2 76.1 386 433 A D H < S+ 0 0 104 -4,-3.0 -3,-0.2 -5,-0.4 -2,-0.1 0.630 119.3 38.0 -65.8 -13.8 39.5 33.2 73.5 387 434 A R H >< S+ 0 0 88 -4,-0.6 3,-2.7 -5,-0.5 -1,-0.2 0.750 105.3 65.9 -96.5 -36.8 40.2 29.5 72.9 388 435 A K H 3< S+ 0 0 78 -4,-0.9 3,-0.5 1,-0.3 4,-0.2 0.693 92.1 65.2 -61.1 -19.0 36.5 28.3 73.3 389 436 A T T 3X S+ 0 0 19 -4,-1.3 4,-2.3 1,-0.2 -1,-0.3 0.389 74.6 98.9 -76.9 1.8 35.8 30.2 70.1 390 437 A L H <> S+ 0 0 72 -3,-2.7 4,-3.6 1,-0.2 5,-0.5 0.927 72.0 60.3 -55.4 -49.7 38.1 27.7 68.3 391 438 A L H > S+ 0 0 113 -3,-0.5 4,-1.5 1,-0.2 -1,-0.2 0.882 113.5 36.1 -46.1 -50.9 35.2 25.6 67.0 392 439 A S H > S+ 0 0 4 -4,-0.2 4,-2.0 -3,-0.2 -1,-0.2 0.843 118.0 51.4 -73.4 -37.1 33.8 28.6 65.1 393 440 A R H X S+ 0 0 63 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.896 114.2 42.7 -67.2 -43.7 37.2 30.1 64.1 394 441 A E H X S+ 0 0 93 -4,-3.6 4,-2.6 2,-0.2 -2,-0.2 0.843 114.0 52.2 -70.0 -37.1 38.5 26.8 62.7 395 442 A R H X S+ 0 0 76 -4,-1.5 4,-2.5 -5,-0.5 -2,-0.2 0.874 109.0 50.5 -65.2 -39.0 35.2 26.1 61.0 396 443 A L H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.949 112.9 45.4 -63.9 -47.7 35.4 29.6 59.4 397 444 A E H X S+ 0 0 78 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.916 113.1 50.4 -62.2 -43.3 38.9 29.0 58.1 398 445 A R H X S+ 0 0 142 -4,-2.6 4,-2.8 1,-0.2 -1,-0.2 0.914 111.3 48.3 -60.2 -43.9 37.9 25.5 56.9 399 446 A A H X S+ 0 0 12 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.867 111.5 50.8 -64.9 -37.1 34.9 26.9 55.0 400 447 A F H X S+ 0 0 0 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.925 112.8 45.4 -63.8 -46.5 37.2 29.6 53.5 401 448 A R H < S+ 0 0 108 -4,-2.7 6,-0.3 2,-0.2 -2,-0.2 0.924 112.8 50.4 -64.2 -46.3 39.7 27.0 52.3 402 449 A M H < S+ 0 0 124 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.918 111.5 48.8 -55.7 -47.4 37.0 24.7 51.0 403 450 A F H < S+ 0 0 20 -4,-2.2 2,-2.1 -113,-0.2 -1,-0.2 0.864 98.0 71.6 -59.6 -40.1 35.5 27.7 49.1 404 451 A D >< + 0 0 8 -4,-1.9 3,-1.8 1,-0.2 -1,-0.2 -0.493 63.9 168.0 -79.6 71.9 38.9 28.6 47.7 405 452 A S T 3 S+ 0 0 102 -2,-2.1 -1,-0.2 1,-0.3 -2,-0.1 0.751 72.2 49.8 -65.3 -28.0 39.0 25.6 45.3 406 453 A D T 3 S- 0 0 119 -3,-0.2 -1,-0.3 0, 0.0 -2,-0.1 0.373 107.9-123.5 -90.2 4.4 42.0 26.9 43.3 407 454 A N < + 0 0 137 -3,-1.8 -2,-0.1 -6,-0.3 -6,-0.0 0.847 63.0 144.7 54.0 38.8 44.0 27.6 46.5 408 455 A S - 0 0 64 2,-0.2 -1,-0.1 1,-0.1 3,-0.1 0.762 56.8-133.9 -72.0 -25.5 44.5 31.3 45.5 409 456 A G S S+ 0 0 21 1,-0.2 38,-0.5 -5,-0.1 2,-0.3 0.470 73.3 88.0 81.0 4.5 44.2 32.3 49.2 410 457 A K E -J 446 0E 78 36,-0.2 2,-0.4 37,-0.1 36,-0.2 -0.942 63.8-144.8-137.0 153.8 41.8 35.1 48.2 411 458 A I E -J 445 0E 0 34,-2.7 34,-2.4 -2,-0.3 2,-0.1 -0.977 28.2-131.6-115.3 131.6 38.2 35.8 47.6 412 459 A S E > -J 444 0E 39 -2,-0.4 4,-3.0 32,-0.2 32,-0.3 -0.285 22.9-107.8 -79.3 165.6 37.2 38.3 44.9 413 460 A S H > S+ 0 0 43 30,-1.9 4,-2.2 1,-0.2 31,-0.1 0.854 121.6 53.1 -60.8 -36.9 34.8 41.2 45.2 414 461 A T H > S+ 0 0 109 29,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.907 111.3 45.8 -62.9 -44.2 32.3 39.4 43.1 415 462 A E H > S+ 0 0 71 2,-0.2 4,-3.1 1,-0.2 -2,-0.2 0.917 111.6 51.7 -66.2 -44.5 32.5 36.4 45.4 416 463 A L H X S+ 0 0 0 -4,-3.0 4,-2.9 2,-0.2 5,-0.3 0.887 106.4 55.4 -55.8 -40.9 32.3 38.7 48.5 417 464 A A H X S+ 0 0 44 -4,-2.2 4,-2.0 -5,-0.2 -2,-0.2 0.931 112.9 41.7 -59.2 -45.7 29.1 40.2 46.9 418 465 A T H X S+ 0 0 57 -4,-1.8 4,-2.7 2,-0.2 5,-0.2 0.943 115.1 49.4 -63.7 -52.3 27.6 36.7 46.7 419 466 A I H X S+ 0 0 0 -4,-3.1 4,-1.4 1,-0.2 -2,-0.2 0.912 117.2 40.3 -57.1 -47.6 28.7 35.6 50.1 420 467 A F H <>S+ 0 0 1 -4,-2.9 5,-2.7 2,-0.2 4,-0.4 0.851 111.6 57.2 -73.4 -33.7 27.5 38.7 51.9 421 468 A G H ><5S+ 0 0 13 -4,-2.0 3,-1.3 -5,-0.3 -211,-0.6 0.939 109.1 45.6 -59.1 -48.9 24.3 38.8 49.8 422 469 A V H 3<5S+ 0 0 14 -4,-2.7 -254,-0.3 1,-0.2 -1,-0.2 0.851 113.3 52.4 -58.8 -35.1 23.4 35.3 51.0 423 470 A S T 3<5S- 0 0 4 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.406 113.4-117.4 -84.1 0.4 24.4 36.5 54.5 424 471 A D T < 5 + 0 0 112 -3,-1.3 2,-0.6 -4,-0.4 -3,-0.2 0.849 63.5 147.0 60.7 37.4 22.1 39.5 54.5 425 472 A V < - 0 0 23 -5,-2.7 -1,-0.2 -6,-0.1 -2,-0.1 -0.939 53.1-115.6-101.1 118.8 25.0 42.0 54.8 426 473 A D > - 0 0 95 -2,-0.6 4,-2.2 -3,-0.1 5,-0.3 -0.169 17.2-124.4 -54.5 141.2 24.1 45.2 52.9 427 474 A S H > S+ 0 0 68 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.926 109.6 44.4 -54.7 -56.2 26.4 46.0 49.9 428 475 A E H > S+ 0 0 136 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.846 112.0 57.2 -61.0 -33.0 27.4 49.5 51.0 429 476 A T H > S+ 0 0 66 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.954 109.2 40.0 -65.0 -53.6 28.0 48.2 54.5 430 477 A W H X S+ 0 0 10 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.861 116.0 52.5 -68.6 -31.5 30.5 45.4 53.7 431 478 A K H X S+ 0 0 102 -4,-2.0 4,-2.1 -5,-0.3 -1,-0.2 0.876 109.0 50.4 -66.4 -40.3 32.3 47.7 51.1 432 479 A S H X S+ 0 0 62 -4,-2.1 4,-1.7 -5,-0.2 -2,-0.2 0.927 112.4 46.3 -60.5 -47.4 32.6 50.4 53.8 433 480 A V H X S+ 0 0 9 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.884 110.0 53.7 -63.8 -41.7 34.1 47.9 56.2 434 481 A L H X S+ 0 0 8 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.910 107.6 51.4 -57.8 -44.3 36.5 46.5 53.6 435 482 A S H < S+ 0 0 44 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.862 109.4 50.4 -60.6 -38.9 37.7 50.1 52.9 436 483 A E H < S+ 0 0 113 -4,-1.7 3,-0.2 1,-0.2 -1,-0.2 0.864 113.2 46.3 -65.6 -39.1 38.3 50.5 56.7 437 484 A V H < S+ 0 0 27 -4,-2.1 2,-0.3 1,-0.3 -2,-0.2 0.894 132.8 6.2 -71.3 -42.2 40.3 47.3 56.8 438 485 A D >< - 0 0 45 -4,-2.6 3,-1.0 -5,-0.1 -1,-0.3 -0.884 53.7-171.2-150.5 108.9 42.4 48.0 53.7 439 486 A K T 3 S+ 0 0 158 -2,-0.3 -1,-0.1 1,-0.2 -3,-0.1 0.889 92.7 50.2 -66.6 -39.5 42.4 51.2 51.8 440 487 A N T 3 S+ 0 0 145 2,-0.1 -1,-0.2 -5,-0.0 2,-0.2 0.026 75.8 138.3 -90.6 25.9 44.6 49.7 49.0 441 488 A N < - 0 0 43 -3,-1.0 4,-0.1 -7,-0.1 2,-0.1 -0.552 39.1-160.1 -68.0 133.9 42.4 46.6 48.5 442 489 A D - 0 0 130 2,-0.3 -1,-0.1 -2,-0.2 -29,-0.1 -0.435 64.6 -60.7-116.2 55.7 42.1 46.0 44.7 443 490 A G S S+ 0 0 29 1,-0.1 -30,-1.9 -31,-0.1 2,-0.3 0.752 112.4 75.0 80.4 28.4 39.0 43.8 44.7 444 491 A E E -J 412 0E 73 -32,-0.3 -2,-0.3 -31,-0.1 2,-0.3 -0.944 53.5-156.3-164.7 148.5 40.1 40.8 46.8 445 492 A V E -J 411 0E 0 -34,-2.4 -34,-2.7 -2,-0.3 2,-0.1 -0.923 12.1-139.1-124.0 148.6 40.7 39.7 50.4 446 493 A D E > -J 410 0E 56 -2,-0.3 4,-2.4 -36,-0.2 5,-0.2 -0.388 45.0 -88.7 -88.3 179.9 42.8 37.0 52.0 447 494 A F H > S+ 0 0 20 -38,-0.5 4,-2.8 1,-0.2 5,-0.2 0.912 125.8 49.8 -60.7 -46.1 41.5 35.0 55.0 448 495 A D H > S+ 0 0 82 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.908 111.7 48.4 -61.7 -42.7 42.7 37.4 57.7 449 496 A E H > S+ 0 0 34 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.911 111.2 50.8 -63.7 -42.7 41.2 40.4 56.0 450 497 A F H X S+ 0 0 0 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.929 111.1 48.6 -57.9 -47.8 37.9 38.5 55.6 451 498 A Q H X S+ 0 0 33 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.913 109.4 53.3 -57.1 -44.7 38.0 37.7 59.3 452 499 A Q H X S+ 0 0 73 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.862 106.9 52.6 -59.7 -37.5 38.7 41.4 60.0 453 500 A M H X S+ 0 0 0 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.932 107.5 50.8 -63.4 -46.8 35.6 42.3 58.0 454 501 A L H X S+ 0 0 0 -4,-2.1 4,-0.6 1,-0.2 -2,-0.2 0.866 108.1 53.0 -60.5 -37.1 33.4 40.0 60.0 455 502 A L H ><>S+ 0 0 38 -4,-2.0 5,-2.7 1,-0.2 3,-1.0 0.925 110.4 46.5 -65.0 -44.0 34.7 41.4 63.3 456 503 A K H ><5S+ 0 0 77 -4,-1.9 3,-1.0 4,-0.3 -1,-0.2 0.815 107.5 58.9 -65.9 -29.9 33.8 45.0 62.2 457 504 A L H 3<5S+ 0 0 42 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.590 106.2 48.4 -76.4 -11.9 30.4 43.8 61.0 458 505 A C T <<5S- 0 0 14 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.1 -0.141 128.2 -90.9-118.9 37.0 29.6 42.6 64.5 459 506 A G T < 5 0 0 71 -3,-1.0 -3,-0.2 1,-0.1 -2,-0.1 0.603 360.0 360.0 73.1 14.5 30.6 45.7 66.4 460 507 A N < 0 0 77 -5,-2.7 -4,-0.3 -6,-0.2 -3,-0.1 -0.160 360.0 360.0-115.6 360.0 34.2 44.7 67.0