==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-APR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/INHIBITOR 06-NOV-11 3UIX . COMPND 2 MOLECULE: PROTO-ONCOGENE SERINE/THREONINE-PROTEIN KINASE PI . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR L.J.PARKER . 266 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13259.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 166 62.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 50 18.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.8 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 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 15 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 19 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 75 28.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 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 0 0 3 0 2 1 1 0 0 0 0 0 0 0 1 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 . 1 1 2 1 1 1 2 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 . 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 37 A Q 0 0 148 0, 0.0 21,-3.0 0, 0.0 22,-0.4 0.000 360.0 360.0 360.0 -35.0 -44.7 13.2 -10.3 2 38 A Y E -A 21 0A 42 19,-0.2 2,-0.6 20,-0.1 19,-0.2 -0.971 360.0-147.3-128.4 136.7 -45.0 11.9 -6.7 3 39 A Q E -A 20 0A 136 17,-2.4 17,-2.1 -2,-0.4 2,-0.4 -0.909 30.5-137.0 -93.0 124.0 -46.4 13.3 -3.5 4 40 A V E +A 19 0A 88 -2,-0.6 15,-0.3 15,-0.2 3,-0.1 -0.692 25.2 179.7 -91.1 130.5 -44.3 11.9 -0.7 5 41 A G E - 0 0 31 13,-3.5 3,-0.1 -2,-0.4 -1,-0.1 -0.128 42.4 -31.6-105.8-154.5 -45.9 10.6 2.5 6 42 A P E - 0 0 94 0, 0.0 12,-3.1 0, 0.0 2,-0.3 -0.199 66.2 -96.5 -64.8 152.4 -44.5 9.0 5.8 7 43 A L E -A 17 0A 87 10,-0.3 10,-0.3 1,-0.1 3,-0.1 -0.539 33.3-169.6 -59.9 126.2 -41.4 6.9 6.0 8 44 A L E - 0 0 101 8,-3.5 2,-0.3 1,-0.4 9,-0.2 0.790 60.6 -34.2 -91.9 -33.5 -42.5 3.2 6.0 9 45 A G E -A 16 0A 25 7,-1.7 7,-2.9 2,-0.0 -1,-0.4 -0.963 49.4-155.6-175.1 164.3 -39.1 1.7 7.0 10 46 A S E +A 15 0A 77 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.977 35.3 101.7-148.0 158.9 -35.3 2.0 6.8 11 47 A G E > S-A 14 0A 46 3,-1.7 3,-2.0 -2,-0.3 -2,-0.0 -0.962 83.9 -16.3 165.8-150.5 -32.4 -0.4 7.0 12 48 A G T 3 S+ 0 0 86 -2,-0.3 3,-0.1 1,-0.3 -1,-0.0 0.839 131.9 54.3 -51.2 -37.4 -29.9 -2.3 4.9 13 49 A F T 3 S- 0 0 64 1,-0.2 2,-0.4 20,-0.1 -1,-0.3 0.504 114.1-115.8 -76.5 -9.2 -32.2 -1.7 1.8 14 50 A G E < -A 11 0A 13 -3,-2.0 -3,-1.7 19,-0.1 2,-0.5 -0.851 53.3 -32.8 109.6-145.1 -32.3 2.1 2.3 15 51 A S E -AB 10 32A 39 17,-2.6 17,-3.0 -2,-0.4 2,-0.5 -0.980 49.3-162.3-127.1 126.4 -35.3 4.2 3.1 16 52 A V E -AB 9 31A 25 -7,-2.9 -8,-3.5 -2,-0.5 -7,-1.7 -0.939 9.6-173.5-111.8 127.0 -38.9 3.5 1.9 17 53 A Y E -AB 7 30A 75 13,-3.0 13,-3.3 -2,-0.5 -10,-0.3 -0.873 27.3-116.6-115.0 147.2 -41.6 6.1 2.0 18 54 A S E + B 0 29A 18 -12,-3.1 -13,-3.5 -2,-0.3 2,-0.3 -0.533 46.4 169.0 -72.0 149.6 -45.3 5.9 1.3 19 55 A G E -AB 4 28A 1 9,-2.1 9,-2.7 -15,-0.3 2,-0.4 -0.968 31.3-136.2-158.8 166.7 -46.3 8.0 -1.8 20 56 A I E -AB 3 27A 50 -17,-2.1 -17,-2.4 -2,-0.3 2,-0.5 -0.992 25.0-124.6-130.5 135.2 -49.0 8.8 -4.3 21 57 A R E > -A 2 0A 59 5,-3.1 4,-1.9 -2,-0.4 5,-0.4 -0.756 21.6-145.5 -79.1 126.3 -48.5 9.1 -8.0 22 58 A V T 4 S+ 0 0 85 -21,-3.0 -1,-0.1 -2,-0.5 -20,-0.1 0.869 88.3 60.8 -66.0 -39.5 -49.9 12.6 -8.9 23 59 A S T 4 S+ 0 0 102 -22,-0.4 -1,-0.2 1,-0.2 -21,-0.1 0.891 129.4 3.1 -54.4 -48.8 -51.4 11.8 -12.3 24 60 A D T 4 S- 0 0 79 -3,-0.2 -1,-0.2 2,-0.1 -2,-0.2 0.291 95.9-111.6-127.2 8.4 -53.9 9.1 -11.2 25 61 A N < + 0 0 122 -4,-1.9 -3,-0.2 1,-0.2 -2,-0.1 0.685 55.2 167.9 64.7 19.4 -53.6 9.0 -7.4 26 62 A L - 0 0 60 -5,-0.4 -5,-3.1 -6,-0.1 -1,-0.2 -0.488 38.2-120.2 -62.7 128.8 -52.0 5.5 -7.5 27 63 A P E +B 20 0A 46 0, 0.0 57,-0.9 0, 0.0 2,-0.3 -0.525 44.4 168.9 -66.7 135.1 -50.6 4.4 -4.1 28 64 A V E -BC 19 83A 0 -9,-2.7 -9,-2.1 -2,-0.2 2,-0.4 -0.913 33.5-128.0-140.7 167.0 -46.8 3.7 -4.4 29 65 A A E -BC 18 82A 12 53,-2.6 53,-2.9 -2,-0.3 2,-0.6 -0.967 20.2-152.0-117.5 141.9 -43.8 3.1 -2.2 30 66 A I E -BC 17 81A 7 -13,-3.3 -13,-3.0 -2,-0.4 2,-0.5 -0.954 11.8-168.4-122.3 113.3 -40.7 5.2 -2.9 31 67 A K E -BC 16 80A 8 49,-2.6 49,-2.6 -2,-0.6 2,-0.4 -0.917 2.7-167.6-115.8 125.6 -37.4 3.7 -2.0 32 68 A H E +BC 15 79A 44 -17,-3.0 -17,-2.6 -2,-0.5 2,-0.4 -0.893 7.1 176.8-109.8 135.5 -34.1 5.6 -1.8 33 69 A V E - C 0 78A 12 45,-2.1 45,-2.1 -2,-0.4 2,-0.2 -0.999 30.1-120.0-138.6 135.6 -30.6 4.0 -1.6 34 70 A E E > - C 0 77A 91 -2,-0.4 3,-1.4 43,-0.2 4,-0.4 -0.516 18.7-130.8 -74.3 139.5 -27.3 5.8 -1.6 35 71 A K G > S+ 0 0 42 41,-3.1 3,-1.5 1,-0.3 42,-0.1 0.893 109.0 54.2 -56.1 -42.1 -24.9 4.9 -4.4 36 72 A D G 3 S+ 0 0 155 40,-0.4 -1,-0.3 1,-0.3 41,-0.1 0.614 104.2 56.6 -66.9 -16.3 -22.0 4.3 -1.9 37 73 A R G < S+ 0 0 182 -3,-1.4 2,-0.4 -24,-0.0 -1,-0.3 0.429 91.1 87.9 -95.1 -0.9 -24.2 1.9 0.0 38 74 A I < + 0 0 28 -3,-1.5 3,-0.1 -4,-0.4 -25,-0.0 -0.820 44.2 168.5 -95.4 137.7 -24.8 -0.3 -3.1 39 75 A S + 0 0 108 -2,-0.4 2,-0.6 1,-0.2 -1,-0.1 0.672 59.3 66.2-115.0 -32.6 -22.2 -3.1 -3.8 40 76 A D + 0 0 66 110,-0.2 10,-2.3 113,-0.0 11,-0.4 -0.866 61.3 174.5-105.3 120.7 -23.9 -5.2 -6.5 41 77 A W E +E 49 0B 59 -2,-0.6 2,-0.2 8,-0.3 6,-0.1 -0.867 3.4 169.3-125.7 152.7 -24.4 -3.6 -9.9 42 78 A G E -E 48 0B 19 6,-2.9 6,-2.3 -2,-0.3 2,-0.3 -0.758 28.9-103.5-145.2-169.3 -25.6 -4.9 -13.3 43 79 A E E E 47 0B 66 -2,-0.2 4,-0.2 4,-0.2 -2,-0.0 -0.963 360.0 360.0-132.5 148.5 -26.7 -3.8 -16.8 44 80 A L 0 0 97 2,-1.4 3,-0.1 -2,-0.3 9,-0.0 -0.313 360.0 360.0 -63.9 360.0 -30.1 -3.5 -18.4 45 ! 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 46 84 A T 0 0 125 0, 0.0 -2,-1.4 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 133.0 -26.4 0.6 -19.0 47 85 A R E +E 43 0B 157 -4,-0.2 -4,-0.2 -6,-0.1 -6,-0.0 -0.451 360.0 144.0 -79.9 117.4 -25.3 0.6 -15.3 48 86 A V E -E 42 0B 4 -6,-2.3 -6,-2.9 -2,-0.4 2,-0.1 -0.874 55.6 -77.8-135.8 166.2 -27.9 0.1 -12.6 49 87 A P E >> -E 41 0B 4 0, 0.0 4,-1.3 0, 0.0 3,-1.1 -0.455 42.7-118.9 -61.9 144.2 -28.1 -1.6 -9.1 50 88 A M H 3> S+ 0 0 24 -10,-2.3 4,-3.1 1,-0.3 5,-0.2 0.875 113.3 68.6 -49.1 -40.2 -28.6 -5.4 -9.5 51 89 A E H 3> S+ 0 0 21 -11,-0.4 4,-2.7 1,-0.2 -1,-0.3 0.861 99.2 47.5 -47.3 -47.0 -31.9 -4.8 -7.6 52 90 A V H <> S+ 0 0 2 -3,-1.1 4,-2.3 2,-0.2 -1,-0.2 0.911 111.1 51.0 -63.8 -44.2 -33.3 -3.0 -10.7 53 91 A V H X S+ 0 0 19 -4,-1.3 4,-1.9 2,-0.2 -2,-0.2 0.956 114.4 44.2 -55.6 -51.0 -32.1 -5.7 -13.0 54 92 A L H X S+ 0 0 0 -4,-3.1 4,-1.6 1,-0.2 -2,-0.2 0.926 112.2 51.1 -63.9 -47.0 -33.8 -8.4 -10.9 55 93 A L H X S+ 0 0 5 -4,-2.7 4,-1.5 -5,-0.2 13,-0.4 0.851 108.2 51.9 -59.4 -38.6 -37.0 -6.5 -10.4 56 94 A K H < S+ 0 0 109 -4,-2.3 3,-0.3 1,-0.2 -1,-0.2 0.921 107.7 54.1 -64.2 -40.2 -37.4 -5.9 -14.1 57 95 A K H < S+ 0 0 89 -4,-1.9 3,-0.3 1,-0.2 -2,-0.2 0.838 119.3 32.2 -62.9 -31.8 -37.0 -9.7 -14.7 58 96 A V H < S+ 0 0 1 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.534 99.7 79.6-101.6 -8.2 -39.8 -10.5 -12.2 59 97 A S < + 0 0 13 -4,-1.5 2,-0.5 -3,-0.3 -1,-0.2 0.309 65.6 112.3 -86.9 12.1 -42.1 -7.5 -12.7 60 98 A S S S- 0 0 90 -3,-0.3 2,-0.2 -4,-0.2 -4,-0.0 -0.755 84.1 -20.3 -90.5 124.8 -43.6 -8.9 -15.9 61 99 A G S S- 0 0 45 -2,-0.5 2,-0.3 2,-0.0 -3,-0.0 -0.490 105.8 -39.2 79.5-153.8 -47.3 -10.0 -15.6 62 100 A F + 0 0 192 -2,-0.2 2,-0.3 2,-0.0 -2,-0.1 -0.797 69.6 132.0-106.0 149.9 -48.8 -10.6 -12.2 63 101 A S - 0 0 27 -2,-0.3 4,-0.1 2,-0.3 53,-0.1 -0.978 68.3 -78.2-170.0-174.0 -47.4 -12.4 -9.2 64 102 A G S S+ 0 0 17 -2,-0.3 82,-2.7 48,-0.1 2,-0.4 -0.226 97.6 101.4 -87.9 40.1 -46.7 -12.4 -5.5 65 103 A V B S-f 146 0C 1 80,-0.3 2,-0.3 -7,-0.1 -2,-0.3 -0.999 81.8-117.0-125.6 131.5 -43.9 -10.0 -6.2 66 104 A I - 0 0 7 80,-2.2 2,-0.3 -2,-0.4 -2,-0.1 -0.513 41.8-126.9 -61.6 124.6 -44.1 -6.2 -5.6 67 105 A R - 0 0 82 -2,-0.3 16,-2.0 -4,-0.1 2,-0.5 -0.592 5.8-125.9 -85.2 136.0 -43.7 -4.7 -9.1 68 106 A L E +D 82 0A 22 -13,-0.4 14,-0.2 -2,-0.3 3,-0.1 -0.687 27.3 179.6 -73.8 124.2 -41.2 -2.0 -10.0 69 107 A L E - 0 0 68 12,-3.4 2,-0.3 -2,-0.5 13,-0.2 0.788 60.3 -27.9 -96.8 -33.3 -43.1 0.8 -11.6 70 108 A D E -D 81 0A 62 11,-1.3 11,-3.4 2,-0.0 -1,-0.4 -0.952 54.3-151.0-173.1 165.6 -40.2 3.3 -12.4 71 109 A W E -D 80 0A 69 -2,-0.3 2,-0.3 9,-0.3 9,-0.2 -0.980 4.0-157.6-151.3 153.4 -36.8 4.3 -11.2 72 110 A F E -D 79 0A 76 7,-2.7 7,-2.8 -2,-0.3 2,-0.5 -0.983 11.6-140.7-131.1 143.8 -34.7 7.4 -11.2 73 111 A E E -D 78 0A 106 -2,-0.3 5,-0.2 5,-0.2 -2,-0.0 -0.914 20.8-174.8-100.8 130.3 -31.0 8.0 -10.9 74 112 A R - 0 0 132 3,-3.3 -39,-0.0 -2,-0.5 3,-0.0 -0.674 43.4 -95.5-109.4 172.4 -29.8 10.9 -8.8 75 113 A P S S+ 0 0 109 0, 0.0 3,-0.0 0, 0.0 -1,-0.0 0.887 120.9 13.0 -56.0 -38.0 -26.2 12.1 -8.4 76 114 A D S S+ 0 0 119 -41,-0.1 -41,-3.1 -42,-0.0 -40,-0.4 0.369 128.8 32.6-123.5 3.8 -25.7 10.2 -5.2 77 115 A S E -C 34 0A 19 -43,-0.3 -3,-3.3 -42,-0.1 2,-0.4 -0.941 62.3-127.1-152.3 166.6 -28.7 7.8 -5.0 78 116 A F E -CD 33 73A 0 -45,-2.1 -45,-2.1 -2,-0.3 2,-0.4 -0.968 20.4-155.6-117.4 141.5 -31.2 5.7 -6.9 79 117 A V E -CD 32 72A 8 -7,-2.8 -7,-2.7 -2,-0.4 2,-0.4 -0.967 5.8-161.6-119.0 131.9 -34.9 6.0 -6.3 80 118 A L E -CD 31 71A 2 -49,-2.6 -49,-2.6 -2,-0.4 2,-0.6 -0.943 9.0-148.9-114.5 138.1 -37.3 3.1 -7.0 81 119 A I E -CD 30 70A 2 -11,-3.4 -12,-3.4 -2,-0.4 -11,-1.3 -0.927 26.8-177.0-106.4 122.1 -41.0 3.5 -7.5 82 120 A L E -CD 29 68A 20 -53,-2.9 -53,-2.6 -2,-0.6 -14,-0.2 -0.866 30.7 -97.3-125.6 152.6 -42.8 0.4 -6.3 83 121 A E E -C 28 0A 53 -16,-2.0 -55,-0.2 -2,-0.3 -1,-0.1 -0.274 36.8-158.4 -59.9 147.6 -46.4 -0.9 -6.2 84 122 A R - 0 0 36 -57,-0.9 2,-0.1 -56,-0.1 -1,-0.0 -0.831 6.2-157.6-140.4 107.1 -48.2 -0.4 -2.9 85 123 A P - 0 0 15 0, 0.0 3,-0.1 0, 0.0 52,-0.1 -0.416 29.0-116.1 -66.9 150.3 -51.3 -2.3 -1.7 86 124 A E S S+ 0 0 129 1,-0.3 2,-0.1 -2,-0.1 52,-0.1 -0.986 93.9 25.2-143.5 126.4 -53.5 -0.6 1.0 87 125 A P S S+ 0 0 38 0, 0.0 52,-1.5 0, 0.0 53,-0.5 0.650 88.4 160.8 -78.5 157.6 -53.8 -1.7 3.8 88 126 A V E -G 138 0C 48 50,-0.2 2,-0.3 51,-0.1 50,-0.2 -0.962 18.4-179.8-140.4 150.2 -50.6 -3.7 4.0 89 127 A Q E -G 137 0C 35 48,-1.4 48,-2.7 -2,-0.3 2,-0.1 -0.956 30.2-117.8-148.4 137.5 -48.5 -5.1 6.9 90 128 A D E > -G 136 0C 37 -2,-0.3 4,-2.5 46,-0.2 46,-0.2 -0.372 28.5-115.4 -73.4 159.4 -45.3 -7.1 6.7 91 129 A L H > S+ 0 0 0 44,-2.3 4,-2.7 41,-1.1 42,-0.2 0.810 113.9 59.3 -70.8 -30.0 -45.3 -10.6 8.0 92 130 A F H > S+ 0 0 81 40,-0.9 4,-2.7 43,-0.3 -1,-0.2 0.938 110.7 41.8 -58.2 -46.9 -42.9 -9.8 10.8 93 131 A D H > S+ 0 0 74 1,-0.2 4,-2.8 2,-0.2 -2,-0.2 0.922 114.2 52.6 -68.8 -41.7 -45.3 -7.2 12.2 94 132 A F H X S+ 0 0 6 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.899 114.0 42.1 -59.2 -44.3 -48.2 -9.5 11.6 95 133 A I H X S+ 0 0 7 -4,-2.7 4,-2.8 2,-0.2 -2,-0.2 0.904 113.0 52.0 -72.0 -43.2 -46.5 -12.3 13.6 96 134 A T H < S+ 0 0 99 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.930 115.9 44.0 -51.6 -47.1 -45.2 -10.0 16.3 97 135 A E H < S+ 0 0 108 -4,-2.8 -2,-0.2 -5,-0.2 -1,-0.2 0.880 127.9 23.9 -68.4 -42.6 -48.8 -8.7 16.7 98 136 A R H < S- 0 0 157 -4,-2.2 -2,-0.2 1,-0.3 -3,-0.2 0.533 95.2-139.5-110.3 -7.3 -50.7 -12.0 16.6 99 137 A G < + 0 0 30 -4,-2.8 -1,-0.3 -5,-0.2 101,-0.2 -0.332 62.1 3.2 80.3-166.7 -48.2 -14.6 17.7 100 138 A A S S- 0 0 37 99,-0.3 2,-0.3 1,-0.1 98,-0.2 -0.228 82.3-119.4 -49.6 135.0 -47.8 -18.1 16.1 101 139 A L - 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0 0 30 -38,-0.3 3,-1.7 1,-0.1 4,-0.3 -0.711 45.9-149.8 -93.3 121.0 -29.9 -12.6 6.7 167 205 A R G > S+ 0 0 107 -2,-0.6 3,-1.9 1,-0.3 -1,-0.1 0.843 93.8 57.8 -58.7 -41.0 -27.5 -14.9 8.6 168 206 A V G 3 S+ 0 0 32 1,-0.3 -1,-0.3 37,-0.0 36,-0.3 0.623 110.5 46.2 -70.3 -11.9 -30.1 -16.6 10.8 169 207 A Y G < S+ 0 0 13 -3,-1.7 -1,-0.3 2,-0.1 -2,-0.2 0.339 93.4 105.9-102.2 2.0 -32.0 -17.7 7.6 170 208 A S S < S- 0 0 1 -3,-1.9 16,-0.0 -4,-0.3 -7,-0.0 -0.544 74.1-108.4 -88.6 150.2 -28.7 -18.9 5.9 171 209 A P >> - 0 0 5 0, 0.0 4,-2.0 0, 0.0 3,-0.7 -0.277 22.0-113.0 -80.0 163.0 -27.9 -22.5 5.4 172 210 A P H 3> S+ 0 0 5 0, 0.0 4,-3.2 0, 0.0 5,-0.3 0.824 115.5 60.6 -61.5 -33.5 -25.3 -24.5 7.3 173 211 A E H 3>>S+ 0 0 18 1,-0.2 4,-2.0 2,-0.2 6,-1.1 0.844 106.8 47.7 -64.8 -31.6 -23.2 -25.0 4.1 174 212 A W H <>5S+ 0 0 17 -3,-0.7 4,-1.7 4,-0.2 -1,-0.2 0.955 113.7 46.9 -67.6 -49.4 -22.9 -21.2 3.9 175 213 A I H <5S+ 0 0 21 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.1 0.933 123.6 32.5 -58.2 -48.4 -21.9 -21.0 7.6 176 214 A R H <5S+ 0 0 146 -4,-3.2 -1,-0.2 -5,-0.1 -2,-0.2 0.864 138.0 12.6 -75.1 -42.2 -19.4 -23.8 7.4 177 215 A Y H <5S- 0 0 143 -4,-2.0 -3,-0.2 -5,-0.3 -2,-0.2 0.546 85.4-123.4-121.6 -14.9 -18.0 -23.5 3.9 178 216 A H S < - 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0 0 15 -2,-0.3 -9,-0.1 1,-0.1 -10,-0.1 -0.350 30.5-132.4 -79.5 155.3 -37.1 -18.5 14.3 203 241 A P S S+ 0 0 15 0, 0.0 2,-0.4 0, 0.0 13,-0.2 0.816 84.1 42.5 -83.2 -24.1 -35.6 -21.8 15.3 204 242 A F + 0 0 3 -36,-0.3 3,-0.1 1,-0.1 -2,-0.1 -0.950 43.9 168.1-126.3 138.6 -31.9 -20.9 15.4 205 243 A E + 0 0 102 -2,-0.4 2,-0.3 1,-0.1 -1,-0.1 0.686 66.8 52.5-113.3 -33.0 -30.1 -17.9 16.7 206 244 A H S >> S- 0 0 111 1,-0.1 4,-2.1 -38,-0.1 3,-1.1 -0.772 80.1-118.4-112.4 153.0 -26.4 -18.9 16.7 207 245 A D H 3> S+ 0 0 54 -2,-0.3 4,-2.7 1,-0.3 5,-0.2 0.874 115.8 55.4 -45.9 -45.9 -24.1 -20.4 14.0 208 246 A E H 3> S+ 0 0 139 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.799 106.0 51.2 -66.5 -27.8 -23.6 -23.5 16.1 209 247 A E H <> S+ 0 0 76 -3,-1.1 4,-2.4 2,-0.2 5,-0.4 0.917 110.4 49.1 -71.3 -43.2 -27.4 -24.0 16.3 210 248 A I H < S+ 0 0 1 -4,-2.1 -2,-0.2 1,-0.2 -3,-0.1 0.953 112.5 48.6 -53.9 -50.6 -27.6 -23.7 12.4 211 249 A I H < S+ 0 0 42 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.813 113.1 46.1 -63.4 -37.9 -24.7 -26.2 12.0 212 250 A R H < S- 0 0 173 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.856 88.3-163.4 -72.4 -37.1 -26.3 -28.7 14.4 213 251 A G < + 0 0 15 -4,-2.4 2,-0.6 1,-0.2 -3,-0.1 0.671 27.9 153.1 63.0 22.4 -29.7 -28.3 12.7 214 252 A Q - 0 0 121 -5,-0.4 2,-0.5 -11,-0.0 -1,-0.2 -0.760 33.8-147.1 -88.1 122.7 -31.8 -29.9 15.5 215 253 A V - 0 0 9 -2,-0.6 2,-0.5 11,-0.0 -11,-0.0 -0.803 13.6-170.9 -97.4 122.6 -35.3 -28.5 15.5 216 254 A F - 0 0 152 -2,-0.5 2,-0.7 -13,-0.2 -2,-0.0 -0.959 15.7-143.2-107.8 127.3 -37.2 -28.1 18.8 217 255 A F - 0 0 25 -2,-0.5 4,-0.1 1,-0.1 -2,-0.0 -0.836 17.6-179.3 -94.8 117.5 -40.9 -27.2 18.6 218 256 A R + 0 0 116 -2,-0.7 2,-0.3 2,-0.1 -1,-0.1 0.467 70.0 49.3 -91.6 -10.2 -41.9 -24.8 21.4 219 257 A Q S S- 0 0 97 0, 0.0 2,-0.5 0, 0.0 -20,-0.0 -0.883 102.4 -86.8-124.6 161.4 -45.6 -24.7 20.2 220 258 A R + 0 0 196 -2,-0.3 2,-0.4 -21,-0.0 -2,-0.1 -0.581 56.4 169.0 -66.6 118.1 -48.0 -27.4 19.3 221 259 A V - 0 0 6 -2,-0.5 -4,-0.1 -4,-0.1 -22,-0.0 -0.996 35.9-105.2-134.3 136.4 -47.4 -28.1 15.6 222 260 A S > - 0 0 24 -2,-0.4 4,-3.0 1,-0.1 5,-0.2 -0.161 28.1-115.5 -58.3 154.4 -48.9 -31.1 13.7 223 261 A S H > S+ 0 0 99 1,-0.2 4,-2.6 2,-0.2 5,-0.1 0.848 115.5 52.4 -57.8 -40.2 -46.7 -34.0 12.7 224 262 A E H > S+ 0 0 89 2,-0.2 4,-2.5 1,-0.2 27,-0.2 0.914 111.2 46.9 -67.7 -41.7 -47.0 -33.3 9.0 225 263 A C H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 -2,-0.2 0.959 113.1 48.7 -63.7 -49.4 -45.9 -29.7 9.5 226 264 A Q H X S+ 0 0 50 -4,-3.0 4,-2.6 1,-0.2 5,-0.2 0.921 111.2 52.0 -53.2 -43.6 -43.0 -30.8 11.7 227 265 A H H X S+ 0 0 104 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.934 110.7 45.9 -61.1 -48.8 -42.1 -33.3 9.1 228 266 A L H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.912 113.0 51.5 -59.5 -43.0 -42.1 -30.7 6.2 229 267 A I H X S+ 0 0 0 -4,-2.8 4,-1.8 1,-0.2 -2,-0.2 0.945 111.5 44.9 -60.8 -48.5 -40.1 -28.3 8.4 230 268 A R H < S+ 0 0 104 -4,-2.6 -1,-0.2 2,-0.2 -2,-0.2 0.817 111.7 54.4 -69.1 -31.8 -37.4 -30.8 9.3 231 269 A W H >< S+ 0 0 72 -4,-2.2 3,-1.8 -5,-0.2 -1,-0.2 0.963 109.4 46.0 -61.1 -52.3 -37.2 -31.9 5.6 232 270 A C H 3< S+ 0 0 0 -4,-2.6 -41,-0.2 1,-0.3 -2,-0.2 0.820 113.3 53.2 -58.6 -32.2 -36.6 -28.3 4.4 233 271 A L T 3< S+ 0 0 4 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.114 76.4 145.4 -96.4 21.1 -34.0 -28.0 7.2 234 272 A A < - 0 0 17 -3,-1.8 6,-0.1 1,-0.1 5,-0.1 -0.361 52.0-133.7 -55.0 134.8 -32.0 -31.1 6.2 235 273 A L S S+ 0 0 81 -23,-0.1 -62,-0.2 -22,-0.1 -1,-0.1 0.897 92.3 65.1 -60.4 -44.9 -28.3 -30.6 6.9 236 274 A R S > S- 0 0 149 1,-0.1 3,-2.0 -64,-0.1 4,-0.4 -0.697 81.8-140.8 -83.2 124.7 -27.2 -32.0 3.6 237 275 A P G > S+ 0 0 48 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 0.868 101.7 56.6 -50.5 -38.7 -28.5 -29.8 0.7 238 276 A S G 3 S+ 0 0 97 1,-0.3 -3,-0.0 -3,-0.0 -2,-0.0 0.595 99.1 60.7 -72.8 -13.3 -29.3 -32.9 -1.4 239 277 A D G < S+ 0 0 71 -3,-2.0 -1,-0.3 -5,-0.1 -5,-0.1 0.509 85.8 98.8 -86.4 -7.5 -31.6 -34.2 1.3 240 278 A R S < S- 0 0 15 -3,-1.5 -8,-0.2 -4,-0.4 -9,-0.1 -0.522 81.7-103.6 -79.3 152.7 -33.8 -31.2 1.1 241 279 A P - 0 0 5 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.325 28.7-119.9 -70.0 152.8 -37.1 -31.3 -0.9 242 280 A T > - 0 0 75 1,-0.1 4,-2.0 -55,-0.0 5,-0.1 -0.420 36.3-100.8 -75.4 167.9 -37.5 -29.8 -4.3 243 281 A F H > S+ 0 0 21 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.864 126.3 53.9 -58.2 -34.5 -40.2 -27.1 -4.7 244 282 A E H > S+ 0 0 140 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.920 107.2 50.5 -69.4 -42.1 -42.4 -29.7 -6.2 245 283 A E H > S+ 0 0 83 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.847 109.0 51.7 -62.5 -35.7 -41.9 -32.0 -3.3 246 284 A I H >< S+ 0 0 0 -4,-2.0 3,-1.2 1,-0.2 6,-0.3 0.973 112.7 44.7 -63.2 -52.3 -42.8 -29.2 -0.8 247 285 A Q H 3< S+ 0 0 12 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.711 113.9 49.7 -70.0 -20.3 -46.0 -28.4 -2.7 248 286 A N H 3< S+ 0 0 106 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.510 84.9 119.5 -88.8 -8.0 -47.0 -32.1 -3.0 249 287 A H S X< S- 0 0 7 -3,-1.2 3,-1.6 -4,-0.6 4,-0.3 -0.239 76.1-120.3 -56.0 142.6 -46.3 -32.6 0.7 250 288 A P G > S+ 0 0 80 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 0.840 112.0 61.2 -57.8 -32.4 -49.4 -33.8 2.6 251 289 A W G 3 S+ 0 0 7 -27,-0.2 -26,-0.1 1,-0.2 -4,-0.1 0.789 101.2 55.6 -60.4 -26.8 -49.3 -30.8 4.9 252 290 A M G < S+ 0 0 1 -3,-1.6 3,-0.5 -6,-0.3 -1,-0.2 0.405 81.8 113.8 -87.5 -0.5 -49.8 -28.5 1.9 253 291 A Q S < S+ 0 0 85 -3,-1.3 -5,-0.0 -4,-0.3 -146,-0.0 -0.414 71.8 20.1 -78.0 151.6 -53.0 -30.0 0.5 254 292 A D S S- 0 0 157 1,-0.2 -1,-0.2 -2,-0.1 -147,-0.1 0.861 80.2-174.0 63.1 42.4 -56.4 -28.2 0.4 255 293 A V - 0 0 38 -3,-0.5 2,-0.2 1,-0.1 -1,-0.2 -0.347 24.0-113.1 -64.5 145.3 -54.9 -24.7 0.7 256 294 A L - 0 0 26 -152,-0.4 -1,-0.1 1,-0.1 -2,-0.0 -0.512 28.4-109.7 -72.3 148.7 -57.3 -21.8 1.0 257 295 A L > - 0 0 107 -2,-0.2 4,-2.6 1,-0.1 5,-0.2 -0.403 34.6-108.2 -64.6 153.3 -57.7 -19.2 -1.7 258 296 A P H > S+ 0 0 40 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.909 120.3 47.4 -55.8 -43.9 -56.3 -15.8 -0.9 259 297 A Q H > S+ 0 0 71 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.893 110.9 50.7 -66.8 -41.4 -59.8 -14.2 -0.5 260 298 A E H > S+ 0 0 83 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.920 110.1 53.4 -54.1 -45.6 -61.0 -17.1 1.6 261 299 A T H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 5,-0.5 0.898 110.3 44.4 -59.1 -45.6 -57.9 -16.5 3.7 262 300 A A H X>S+ 0 0 0 -4,-2.2 4,-1.7 -121,-0.3 5,-1.3 0.907 114.0 50.7 -68.7 -39.7 -58.6 -12.8 4.3 263 301 A E H <5S+ 0 0 121 -4,-2.4 4,-0.3 3,-0.2 -2,-0.2 0.942 120.3 33.8 -63.5 -48.8 -62.3 -13.5 5.0 264 302 A I H <5S+ 0 0 100 -4,-2.9 -2,-0.2 -5,-0.2 -1,-0.2 0.897 136.5 17.1 -71.1 -39.0 -61.5 -16.2 7.7 265 303 A H H <5S+ 0 0 37 -4,-2.5 -3,-0.2 -5,-0.3 -2,-0.2 0.618 124.8 38.8-116.7 -20.4 -58.3 -14.8 9.1 266 304 A L T <5 0 0 28 -4,-1.7 -3,-0.2 -5,-0.5 -4,-0.1 0.583 360.0 360.0-117.2 -13.7 -57.7 -11.2 8.4 267 305 A H < 0 0 147 -5,-1.3 -4,-0.1 -4,-0.3 -3,-0.1 0.594 360.0 360.0 -94.5 360.0 -61.1 -9.4 8.6