==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 21-FEB-09 3GC8 . COMPND 2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE 11; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR G.SCAPIN,S.B.PATEL . 693 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33808.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 424 61.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 78 11.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 45 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 88 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 190 27.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 5 4 0 2 1 0 1 0 2 2 1 0 3 0 0 0 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 2 0 2 4 0 6 0 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 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 3 A G 0 0 69 0, 0.0 5,-0.2 0, 0.0 7,-0.0 0.000 360.0 360.0 360.0 126.9 12.7 -31.4 35.6 2 4 A P + 0 0 98 0, 0.0 5,-0.0 0, 0.0 90,-0.0 0.009 360.0 82.0 -58.1 162.4 13.3 -33.0 32.2 3 5 A R S > S- 0 0 100 89,-0.0 3,-1.7 2,-0.0 88,-0.0 0.673 79.2-110.6 98.5 95.0 16.6 -32.7 30.2 4 6 A A T 3 S+ 0 0 92 1,-0.2 3,-0.1 15,-0.0 0, 0.0 -0.227 101.8 25.1 -50.5 135.1 19.4 -35.0 31.2 5 7 A G T 3 S+ 0 0 44 1,-0.3 15,-2.9 14,-0.1 2,-0.3 0.389 103.3 103.7 87.6 -0.8 22.3 -33.2 32.9 6 8 A F E < -A 19 0A 24 -3,-1.7 2,-0.3 13,-0.3 -1,-0.3 -0.795 49.5-164.2-111.3 153.6 20.2 -30.3 34.1 7 9 A Y E -A 18 0A 48 11,-2.3 11,-1.7 -2,-0.3 2,-0.3 -0.966 9.5-136.5-135.9 157.3 18.7 -29.4 37.5 8 10 A R E +A 17 0A 123 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.761 24.5 157.0-110.9 153.9 16.1 -27.1 38.8 9 11 A Q E -A 16 0A 64 7,-1.0 7,-3.1 -2,-0.3 2,-0.6 -0.935 40.4-108.0-165.1 156.5 15.8 -24.7 41.7 10 12 A E E +A 15 0A 132 -2,-0.3 2,-0.4 5,-0.2 5,-0.3 -0.800 38.8 169.3 -90.9 121.5 13.8 -21.6 42.8 11 13 A L E > -A 14 0A 18 3,-3.8 3,-1.9 -2,-0.6 -2,-0.1 -0.994 68.4 -14.9-134.6 126.4 15.8 -18.4 42.8 12 14 A N T 3 S- 0 0 61 -2,-0.4 -1,-0.1 1,-0.3 19,-0.1 0.933 127.9 -50.9 40.7 65.4 14.1 -14.9 43.2 13 15 A K T 3 S+ 0 0 198 1,-0.1 2,-0.4 -3,-0.1 -1,-0.3 0.499 124.0 99.3 56.8 5.4 10.5 -16.2 42.5 14 16 A T E < S-A 11 0A 55 -3,-1.9 -3,-3.8 2,-0.0 2,-0.4 -0.957 74.2-122.4-124.0 143.5 11.8 -17.9 39.3 15 17 A V E -A 10 0A 73 -2,-0.4 2,-0.5 -5,-0.3 -5,-0.2 -0.653 25.3-154.7 -73.7 128.8 12.8 -21.5 38.5 16 18 A W E -A 9 0A 1 -7,-3.1 -7,-1.0 -2,-0.4 2,-0.6 -0.942 6.3-166.3-107.4 128.5 16.4 -21.8 37.1 17 19 A E E +A 8 0A 22 -2,-0.5 -9,-0.2 -9,-0.2 -2,-0.0 -0.911 23.3 161.4-119.9 104.7 17.3 -24.7 34.9 18 20 A V E -A 7 0A 0 -11,-1.7 -11,-2.3 -2,-0.6 -2,-0.0 -0.837 42.4 -95.0-125.8 153.2 21.0 -25.0 34.5 19 21 A P E > -A 6 0A 8 0, 0.0 3,-1.7 0, 0.0 -13,-0.3 -0.272 42.5-107.2 -66.8 159.6 23.4 -27.7 33.4 20 22 A Q T 3 S+ 0 0 110 -15,-2.9 -14,-0.1 1,-0.3 22,-0.1 0.742 114.5 70.8 -59.5 -27.3 25.0 -29.8 36.2 21 23 A R T 3 S+ 0 0 45 -16,-0.2 21,-3.8 20,-0.1 2,-0.8 0.725 80.4 83.9 -62.5 -26.6 28.3 -28.0 35.7 22 24 A L E < -B 41 0B 0 -3,-1.7 2,-0.3 19,-0.2 3,-0.2 -0.739 67.9-175.2 -85.5 111.6 26.9 -24.8 37.2 23 25 A Q E +B 40 0B 85 17,-3.0 17,-2.3 -2,-0.8 -2,-0.1 -0.780 48.8 7.7-114.3 150.1 27.2 -25.1 41.0 24 26 A G E S- 0 0 62 -2,-0.3 -1,-0.2 15,-0.2 2,-0.1 0.842 70.0-160.0 55.2 47.5 26.1 -23.0 44.0 25 27 A L E - 0 0 13 -3,-0.2 14,-0.2 14,-0.1 -1,-0.2 -0.378 10.2-172.9 -57.4 125.4 24.0 -20.4 42.1 26 28 A R E -B 38 0B 166 12,-2.2 12,-2.5 -2,-0.1 -15,-0.1 -0.961 22.2-124.1-129.9 116.3 23.6 -17.3 44.4 27 29 A P E -B 37 0B 49 0, 0.0 10,-0.2 0, 0.0 7,-0.1 -0.201 9.8-147.8 -59.6 144.6 21.3 -14.4 43.5 28 30 A V - 0 0 80 8,-2.0 2,-0.2 5,-0.7 6,-0.2 0.834 67.5 -39.9 -83.8 -35.9 23.0 -11.0 43.3 29 31 A G S S- 0 0 26 4,-1.0 2,-0.4 7,-0.4 -1,-0.2 -0.851 70.8 -71.5-161.2-157.8 19.9 -9.0 44.5 30 32 A S S S- 0 0 108 -2,-0.2 2,-1.0 -3,-0.1 3,-0.4 -0.967 93.1 -17.6-118.5 129.3 16.1 -8.7 44.3 31 33 A G S > S+ 0 0 48 -2,-0.4 3,-0.7 1,-0.2 143,-0.2 -0.702 135.2 30.0 88.0 -99.0 14.4 -7.4 41.1 32 34 A A G > S+ 0 0 59 -2,-1.0 3,-0.6 1,-0.3 -1,-0.2 0.961 135.0 32.4 -61.0 -55.3 16.8 -5.5 38.9 33 35 A Y G > S+ 0 0 88 -3,-0.4 -4,-1.0 1,-0.2 3,-0.8 0.263 100.9 98.6 -82.5 14.4 19.9 -7.5 39.9 34 36 A G G < S+ 0 0 10 -3,-0.7 -1,-0.2 1,-0.2 -2,-0.2 0.503 71.4 55.4 -85.9 -7.9 17.4 -10.5 40.3 35 37 A S G < S+ 0 0 27 -3,-0.6 17,-2.6 -4,-0.2 2,-0.4 0.218 96.4 81.7-106.2 13.1 18.0 -12.2 37.0 36 38 A V E < - C 0 51B 33 -3,-0.8 -8,-2.0 15,-0.2 -7,-0.4 -0.963 56.8-176.8-123.1 134.9 21.8 -12.6 37.7 37 39 A C E -BC 27 50B 2 13,-3.2 13,-3.4 -2,-0.4 2,-0.3 -0.924 24.5-129.5-127.5 152.5 23.5 -15.2 39.8 38 40 A S E +BC 26 49B 12 -12,-2.5 -12,-2.2 -2,-0.3 2,-0.3 -0.658 41.3 158.5 -83.7 154.9 27.0 -16.1 40.9 39 41 A A E - C 0 48B 6 9,-1.9 9,-2.1 -2,-0.3 2,-0.4 -0.963 41.1-115.8-160.2 178.1 28.0 -19.7 40.3 40 42 A Y E -BC 23 47B 94 -17,-2.3 -17,-3.0 -2,-0.3 2,-0.9 -0.986 24.0-144.8-125.0 120.8 31.0 -22.0 40.0 41 43 A D E >> -BC 22 46B 0 5,-2.3 4,-2.6 -2,-0.4 5,-1.0 -0.757 7.2-164.0 -90.0 104.9 31.4 -23.7 36.6 42 44 A A T 45S+ 0 0 51 -21,-3.8 -1,-0.2 -2,-0.9 -20,-0.1 0.785 89.2 48.0 -56.4 -33.8 32.7 -27.2 37.2 43 45 A R T 45S+ 0 0 163 1,-0.2 -1,-0.2 -22,-0.1 -2,-0.1 0.897 117.6 39.2 -75.3 -44.9 33.8 -27.6 33.5 44 46 A L T 45S- 0 0 67 2,-0.2 -2,-0.2 -23,-0.1 -1,-0.2 0.752 101.9-136.2 -76.5 -23.0 35.5 -24.2 33.2 45 47 A R T <5 + 0 0 202 -4,-2.6 2,-0.3 1,-0.2 -3,-0.2 0.960 66.3 84.4 65.1 55.2 37.0 -24.6 36.8 46 48 A Q E + 0 0 144 -2,-0.3 3,-1.4 1,-0.1 4,-0.3 0.750 69.3 178.4 41.7 54.4 11.0 -13.6 28.3 56 58 A P T 3 S+ 0 0 1 0, 0.0 10,-0.4 0, 0.0 3,-0.2 0.771 79.6 33.2 -57.2 -26.5 13.4 -13.5 25.2 57 59 A F T 3 S+ 0 0 28 41,-0.3 -2,-0.1 1,-0.1 3,-0.1 -0.038 74.0 121.5-125.3 29.8 10.5 -14.2 22.7 58 60 A Q S < S- 0 0 110 -3,-1.4 2,-0.3 1,-0.2 -1,-0.1 0.834 90.7 -13.9 -58.8 -36.6 7.5 -12.5 24.3 59 61 A S S >> S- 0 0 44 -4,-0.3 4,-2.3 -3,-0.2 3,-0.5 -0.962 82.2 -84.0-156.9 167.8 7.3 -10.4 21.1 60 62 A L H 3> S+ 0 0 73 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.885 124.1 51.9 -37.4 -52.4 9.2 -9.5 17.9 61 63 A I H 3> S+ 0 0 69 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.844 109.7 47.1 -67.9 -36.8 11.1 -6.8 19.6 62 64 A H H <> S+ 0 0 29 -3,-0.5 4,-2.7 2,-0.2 -1,-0.2 0.900 113.1 49.5 -67.3 -42.6 12.3 -8.9 22.5 63 65 A A H X S+ 0 0 0 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.872 111.4 48.9 -63.5 -39.7 13.4 -11.7 20.2 64 66 A R H X S+ 0 0 104 -4,-2.5 4,-2.5 -5,-0.2 -1,-0.2 0.877 113.5 47.5 -66.6 -39.6 15.3 -9.1 18.0 65 67 A R H X S+ 0 0 117 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.870 109.3 52.6 -68.6 -41.9 16.9 -7.7 21.1 66 68 A T H X S+ 0 0 4 -4,-2.7 4,-1.8 -10,-0.4 -2,-0.2 0.916 112.6 45.7 -57.3 -47.0 17.8 -11.1 22.5 67 69 A Y H X S+ 0 0 8 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.938 112.3 49.6 -64.0 -50.2 19.5 -11.9 19.1 68 70 A R H X S+ 0 0 65 -4,-2.5 4,-2.8 1,-0.2 5,-0.3 0.887 107.7 57.1 -52.9 -44.4 21.3 -8.6 18.9 69 71 A E H X S+ 0 0 8 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.934 111.5 40.0 -51.3 -55.5 22.5 -9.1 22.5 70 72 A L H X S+ 0 0 1 -4,-1.8 4,-1.9 1,-0.2 5,-0.2 0.946 115.6 51.9 -60.8 -51.6 24.2 -12.4 21.6 71 73 A R H < S+ 0 0 46 -4,-2.7 4,-0.5 1,-0.2 -2,-0.2 0.808 112.5 44.2 -55.3 -42.1 25.5 -11.1 18.3 72 74 A L H X S+ 0 0 1 -4,-2.8 4,-2.5 2,-0.2 3,-0.3 0.867 109.1 57.0 -70.5 -42.5 27.2 -8.0 19.8 73 75 A L H < S+ 0 0 10 -4,-2.0 11,-0.2 -5,-0.3 -2,-0.2 0.904 114.5 37.4 -57.5 -44.0 28.7 -10.0 22.7 74 76 A K T < S+ 0 0 49 -4,-1.9 -1,-0.2 1,-0.2 3,-0.2 0.502 117.5 52.0 -89.9 -7.4 30.5 -12.4 20.4 75 77 A H T 4 S+ 0 0 46 -4,-0.5 244,-0.2 -3,-0.3 -2,-0.2 0.772 107.6 52.5 -87.2 -33.3 31.3 -9.6 17.9 76 78 A L < + 0 0 0 -4,-2.5 2,-0.3 6,-0.1 -2,-0.1 -0.040 69.0 161.6-101.8 32.3 32.8 -7.2 20.4 77 79 A K + 0 0 146 -3,-0.2 2,-0.3 3,-0.0 6,-0.1 -0.330 20.3 143.0 -57.7 115.4 35.4 -9.5 22.1 78 80 A H > - 0 0 20 3,-0.4 3,-1.6 -2,-0.3 -2,-0.0 -0.982 64.0-108.6-157.9 150.1 37.8 -7.1 23.9 79 81 A E T 3 S+ 0 0 114 -2,-0.3 4,-0.1 1,-0.3 56,-0.1 0.798 120.3 41.4 -55.3 -31.8 39.9 -6.8 27.1 80 82 A N T 3 S+ 0 0 5 83,-0.1 84,-2.2 2,-0.1 2,-0.4 0.094 103.0 79.0-109.3 23.4 37.5 -4.1 28.4 81 83 A V B < S-f 164 0C 0 -3,-1.6 -3,-0.4 82,-0.3 84,-0.2 -0.973 90.2-100.4-127.2 142.4 34.1 -5.6 27.3 82 84 A I - 0 0 9 82,-2.8 2,-0.4 -2,-0.4 -6,-0.1 -0.423 43.2-152.2 -61.9 129.8 32.2 -8.4 29.0 83 85 A G - 0 0 20 -2,-0.1 22,-0.6 -4,-0.1 2,-0.5 -0.860 14.1-115.2-109.9 144.3 32.9 -11.7 27.2 84 86 A L E +E 104 0B 23 -2,-0.4 20,-0.2 -11,-0.2 3,-0.1 -0.618 27.1 175.3 -74.4 122.6 30.7 -14.8 26.9 85 87 A L E S- 0 0 64 18,-2.8 2,-0.3 -2,-0.5 19,-0.2 0.659 73.4 -11.1 -90.9 -22.1 32.2 -17.8 28.5 86 88 A D E -E 103 0B 10 17,-1.9 17,-2.8 -3,-0.1 -1,-0.4 -0.974 50.8-159.6-169.2 159.3 29.0 -19.8 27.7 87 89 A V E +E 102 0B 6 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.979 25.3 162.9-138.2 141.8 25.4 -19.7 26.5 88 90 A F E -E 101 0B 11 13,-1.8 13,-2.4 -2,-0.3 256,-0.1 -0.993 24.0-156.4-157.2 167.9 22.8 -22.4 27.1 89 91 A T - 0 0 10 -2,-0.3 11,-0.1 11,-0.2 8,-0.1 -0.992 23.1-139.1-141.0 139.6 19.1 -23.3 27.1 90 92 A P + 0 0 3 0, 0.0 10,-0.1 0, 0.0 7,-0.1 0.539 68.2 125.5 -71.9 -6.0 17.2 -26.1 28.9 91 93 A A - 0 0 4 8,-0.4 -2,-0.2 1,-0.1 3,-0.1 -0.255 47.9-166.0 -56.1 134.5 15.3 -26.5 25.6 92 94 A T S S- 0 0 90 1,-0.2 2,-0.3 -89,-0.0 -1,-0.1 0.699 79.3 -6.3 -90.6 -27.2 15.3 -30.1 24.2 93 95 A S S S- 0 0 51 0, 0.0 4,-0.4 0, 0.0 3,-0.3 -0.861 86.7 -86.1-149.9-179.3 14.0 -28.6 20.9 94 96 A I S S+ 0 0 47 -2,-0.3 246,-0.0 1,-0.2 -3,-0.0 0.636 125.2 60.6 -72.5 -16.0 12.8 -25.3 19.4 95 97 A E S S+ 0 0 161 1,-0.2 -1,-0.2 3,-0.0 -4,-0.0 0.829 109.4 42.6 -73.0 -34.6 9.2 -26.1 20.7 96 98 A D S S+ 0 0 72 -3,-0.3 2,-0.8 2,-0.0 -2,-0.2 0.531 90.5 115.4 -80.6 -11.2 10.8 -26.2 24.3 97 99 A F + 0 0 5 -4,-0.4 3,-0.1 1,-0.2 243,-0.1 -0.506 25.3 117.7 -77.3 103.4 12.8 -23.1 23.4 98 100 A S + 0 0 72 -2,-0.8 -41,-0.3 1,-0.3 2,-0.3 0.393 63.6 47.7-145.5 -6.9 11.6 -20.2 25.6 99 101 A E - 0 0 38 -3,-0.2 -8,-0.4 -44,-0.1 2,-0.3 -0.995 55.6-160.1-150.5 145.2 14.6 -19.1 27.8 100 102 A V E -D 53 0B 0 -47,-0.5 -47,-2.7 -2,-0.3 2,-0.4 -0.908 5.8-155.8-125.6 143.5 18.3 -18.3 27.3 101 103 A Y E -DE 52 88B 0 -13,-2.4 -13,-1.8 -2,-0.3 2,-0.5 -0.975 2.5-159.5-126.7 138.7 21.2 -18.2 29.8 102 104 A L E -DE 51 87B 11 -51,-3.0 -51,-2.9 -2,-0.4 2,-0.5 -0.974 4.0-166.1-122.9 126.1 24.5 -16.2 29.6 103 105 A V E +DE 50 86B 0 -17,-2.8 -18,-2.8 -2,-0.5 -17,-1.9 -0.942 18.9 158.9-115.9 117.8 27.6 -17.2 31.5 104 106 A T E -DE 49 84B 23 -55,-2.3 -55,-2.4 -2,-0.5 -20,-0.1 -0.697 47.3 -64.1-123.7-178.3 30.4 -14.7 31.8 105 107 A T E -D 48 0B 39 -22,-0.6 2,-0.8 -57,-0.2 -57,-0.2 -0.292 52.0-116.1 -56.3 145.5 33.4 -14.0 34.0 106 108 A L + 0 0 57 -59,-0.7 -59,-0.1 1,-0.2 -1,-0.1 -0.847 40.1 166.1 -89.5 113.9 32.6 -13.0 37.6 107 109 A M - 0 0 20 -2,-0.8 -1,-0.2 50,-0.1 51,-0.1 0.838 26.8-157.6 -90.2 -44.4 33.8 -9.4 38.2 108 110 A G + 0 0 65 -3,-0.2 2,-0.3 49,-0.1 49,-0.1 0.358 58.0 48.5 89.2 -4.8 31.9 -9.2 41.4 109 111 A A - 0 0 31 47,-0.2 47,-2.0 3,-0.0 2,-0.2 -0.980 58.7-153.3-156.7 162.4 31.6 -5.4 41.7 110 112 A D B > -G 155 0C 10 -2,-0.3 4,-1.2 45,-0.3 45,-0.2 -0.655 46.0 -83.2-126.3-172.1 30.7 -2.3 39.7 111 113 A L H > S+ 0 0 2 40,-2.1 4,-2.8 43,-1.3 5,-0.2 0.819 125.9 54.7 -69.9 -30.2 31.6 1.4 39.9 112 114 A N H > S+ 0 0 65 39,-0.4 4,-2.5 2,-0.2 -1,-0.2 0.939 106.5 51.3 -61.5 -50.8 29.0 2.2 42.6 113 115 A N H > S+ 0 0 73 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.782 114.8 45.8 -53.3 -30.8 30.5 -0.6 44.8 114 116 A I H X S+ 0 0 15 -4,-1.2 4,-2.6 2,-0.2 3,-0.4 0.937 111.8 46.6 -83.7 -53.3 33.9 1.1 44.2 115 117 A V H < S+ 0 0 24 -4,-2.8 -2,-0.2 1,-0.2 -3,-0.2 0.844 113.9 53.0 -52.2 -38.1 33.0 4.7 44.8 116 118 A K H < S+ 0 0 178 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.826 117.8 33.5 -69.1 -33.7 31.1 3.6 47.9 117 119 A C H < S+ 0 0 108 -4,-0.8 2,-0.2 -3,-0.4 -2,-0.2 0.824 116.9 40.9-102.6 -35.9 34.1 1.7 49.4 118 120 A Q S < S- 0 0 100 -4,-2.6 0, 0.0 1,-0.1 0, 0.0 -0.619 70.2-130.4-104.8 171.4 37.3 3.6 48.4 119 121 A A - 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0 0 14 -2,-1.6 6,-0.1 1,-0.1 5,-0.1 -0.993 54.0-147.5-127.2 127.9 15.7 16.4 3.2 636 291 B L S S+ 0 0 15 -2,-0.4 2,-0.6 -52,-0.4 -99,-0.2 0.910 87.5 75.3 -61.9 -46.1 12.1 15.7 4.1 637 292 B D S > S- 0 0 6 1,-0.2 3,-1.6 -3,-0.1 4,-0.2 -0.583 78.0-152.7 -70.1 115.5 12.9 15.4 7.8 638 293 B S G > S+ 0 0 1 -2,-0.6 3,-1.2 1,-0.3 -1,-0.2 0.795 87.2 57.7 -71.9 -31.2 13.3 19.0 8.8 639 294 B D G 3 S+ 0 0 27 1,-0.2 -1,-0.3 -3,-0.0 -442,-0.1 0.345 99.2 63.0 -80.0 10.1 15.7 18.6 11.7 640 295 B Q G < S+ 0 0 96 -3,-1.6 2,-0.3 -5,-0.1 -1,-0.2 0.424 79.3 104.5-108.3 -1.4 18.2 16.8 9.4 641 296 B R S < S- 0 0 13 -3,-1.2 -8,-0.2 -4,-0.2 -9,-0.1 -0.614 78.3-116.0 -78.5 133.4 18.7 19.9 7.3 642 297 B V - 0 0 34 -10,-2.7 2,-0.1 -2,-0.3 -1,-0.1 -0.330 30.7-114.3 -62.4 150.2 22.0 21.7 7.8 643 298 B S > - 0 0 46 1,-0.1 4,-2.8 -400,-0.1 5,-0.2 -0.435 27.5-107.3 -76.5 165.1 21.7 25.2 9.2 644 299 B A H > S+ 0 0 2 1,-0.2 4,-1.5 2,-0.2 -160,-0.2 0.866 122.0 52.3 -60.4 -37.7 22.8 28.2 7.0 645 300 B A H > S+ 0 0 38 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.859 112.4 44.2 -64.8 -40.3 25.9 28.5 9.3 646 301 B E H >4 S+ 0 0 92 1,-0.2 3,-1.2 2,-0.2 4,-0.5 0.912 109.6 55.4 -71.7 -42.2 26.8 24.9 8.9 647 302 B A H >< S+ 0 0 1 -4,-2.8 3,-1.3 1,-0.3 6,-0.3 0.856 100.1 61.4 -61.0 -32.1 26.2 24.9 5.2 648 303 B L H 3< S+ 0 0 0 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.784 101.5 53.2 -63.2 -27.7 28.7 27.9 4.9 649 304 B A T << S+ 0 0 62 -3,-1.2 -1,-0.3 -4,-0.6 -2,-0.2 0.505 83.5 118.2 -82.4 -12.3 31.4 25.6 6.3 650 305 B H S X S- 0 0 31 -3,-1.3 3,-2.0 -4,-0.5 7,-0.2 -0.302 78.4-116.8 -61.3 142.6 30.7 22.9 3.6 651 306 B A G > S+ 0 0 51 1,-0.3 3,-1.3 2,-0.2 4,-0.2 0.694 110.6 72.3 -55.7 -24.8 33.6 22.1 1.2 652 307 B Y G 3 S+ 0 0 3 -27,-0.3 3,-0.4 1,-0.2 -1,-0.3 0.865 103.4 40.9 -56.7 -36.4 31.5 23.4 -1.7 653 308 B F G X> S+ 0 0 0 -3,-2.0 4,-3.5 -6,-0.3 3,-1.4 0.206 78.3 113.5 -98.4 15.4 32.0 27.0 -0.4 654 309 B S T <4 S+ 0 0 89 -3,-1.3 -1,-0.2 1,-0.3 -2,-0.1 0.678 71.0 63.0 -66.8 -14.8 35.7 26.6 0.6 655 310 B Q T 34 S+ 0 0 148 -3,-0.4 -1,-0.3 -4,-0.2 -2,-0.1 0.886 122.7 19.1 -69.2 -34.0 36.5 29.1 -2.2 656 311 B Y T <4 S+ 0 0 80 -3,-1.4 -2,-0.2 -8,-0.1 -1,-0.1 0.722 88.6 121.6-111.3 -25.2 34.5 31.7 -0.3 657 312 B H < + 0 0 62 -4,-3.5 -8,-0.1 -7,-0.2 5,-0.0 -0.172 21.9 157.3 -55.6 123.9 34.1 30.6 3.4 658 313 B D > - 0 0 73 1,-0.1 3,-2.2 3,-0.1 -1,-0.1 -0.756 24.0-163.7-149.5 94.4 35.5 33.1 5.9 659 314 B P G > S+ 0 0 84 0, 0.0 3,-1.0 0, 0.0 -1,-0.1 0.711 88.9 59.7 -55.3 -29.1 33.9 32.8 9.5 660 315 B E G 3 S+ 0 0 189 1,-0.3 0, 0.0 3,-0.1 0, 0.0 0.642 108.4 45.9 -75.9 -15.3 35.1 36.2 10.6 661 316 B D G < S+ 0 0 72 -3,-2.2 -1,-0.3 1,-0.1 -3,-0.1 -0.149 92.2 82.7-118.0 31.1 33.1 37.8 7.8 662 317 B E S < S- 0 0 5 -3,-1.0 -1,-0.1 -5,-0.0 -14,-0.0 -0.614 74.7-161.7-130.1 70.6 29.9 35.9 8.2 663 318 B P - 0 0 57 0, 0.0 2,-0.2 0, 0.0 -2,-0.1 -0.114 11.1-139.7 -62.9 149.5 28.3 38.0 11.0 664 319 B E - 0 0 103 -176,-0.1 2,-0.2 -177,-0.1 -179,-0.1 -0.630 22.6-129.2 -90.5 162.8 25.5 36.9 13.3 665 320 B A - 0 0 17 -180,-0.4 3,-0.1 -181,-0.3 -242,-0.1 -0.715 18.2-102.6-110.8 163.0 22.8 39.4 14.3 666 321 B E - 0 0 160 -2,-0.2 3,-0.1 -244,-0.2 -1,-0.0 -0.622 56.2 -87.1 -76.1 146.4 21.2 40.5 17.6 667 322 B P - 0 0 102 0, 0.0 -177,-0.2 0, 0.0 2,-0.2 -0.239 45.2-111.5 -56.1 137.2 17.8 38.9 18.3 668 323 B Y - 0 0 13 -179,-3.5 2,-0.7 1,-0.1 -249,-0.0 -0.518 34.2-120.0 -65.7 136.5 15.0 40.9 16.7 669 324 B D + 0 0 86 -2,-0.2 3,-0.3 1,-0.1 4,-0.2 -0.765 32.9 178.1 -91.0 118.0 13.0 42.4 19.5 670 325 B E > + 0 0 77 -2,-0.7 4,-1.4 1,-0.2 5,-0.1 0.331 52.0 100.9 -98.5 0.6 9.4 41.2 19.5 671 326 B S T 4 S+ 0 0 68 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.867 81.5 48.1 -62.3 -43.2 8.1 43.1 22.6 672 327 B V T >4 S+ 0 0 36 -3,-0.3 3,-1.0 1,-0.2 -1,-0.2 0.933 117.7 41.8 -60.5 -48.4 6.3 46.0 20.8 673 328 B E T 34 S+ 0 0 22 -4,-0.2 -1,-0.2 1,-0.2 -2,-0.2 0.580 99.9 73.1 -78.1 -13.9 4.5 43.6 18.4 674 329 B A T 3< S+ 0 0 75 -4,-1.4 2,-0.3 2,-0.1 -1,-0.2 0.600 88.4 81.4 -73.1 -12.8 3.8 41.1 21.2 675 330 B K S < S- 0 0 137 -3,-1.0 2,-0.4 -4,-0.3 -3,-0.0 -0.697 88.2-114.5 -95.8 148.7 1.2 43.6 22.4 676 331 B E + 0 0 175 -2,-0.3 2,-0.3 0, 0.0 -2,-0.1 -0.697 42.9 172.5 -80.8 127.9 -2.3 44.0 21.0 677 332 B R - 0 0 61 -2,-0.4 -266,-0.1 -4,-0.1 2,-0.0 -0.957 30.5-110.6-136.8 151.6 -2.8 47.4 19.3 678 333 B T > - 0 0 73 -2,-0.3 4,-1.9 1,-0.1 5,-0.2 -0.233 37.9-102.7 -71.0 167.2 -5.5 49.1 17.2 679 334 B L H > S+ 0 0 53 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.908 123.2 52.9 -51.8 -44.5 -5.1 49.8 13.5 680 335 B E H > S+ 0 0 95 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.820 105.2 50.6 -66.8 -37.8 -4.5 53.5 14.5 681 336 B E H > S+ 0 0 83 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.910 110.9 50.4 -67.5 -41.9 -1.7 52.8 17.0 682 337 B W H X S+ 0 0 2 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.884 110.2 50.7 -59.1 -41.4 0.0 50.7 14.3 683 338 B K H X S+ 0 0 31 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.907 111.8 47.6 -58.6 -45.8 -0.4 53.6 11.9 684 339 B E H X S+ 0 0 116 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.844 110.1 51.2 -69.4 -35.8 1.1 55.9 14.5 685 340 B L H X S+ 0 0 49 -4,-2.7 4,-1.8 2,-0.2 -1,-0.2 0.906 113.5 46.2 -62.3 -43.2 4.0 53.6 15.2 686 341 B T H X S+ 0 0 0 -4,-2.2 4,-2.9 2,-0.2 -2,-0.2 0.888 111.0 52.1 -67.1 -42.2 4.7 53.4 11.4 687 342 B Y H X S+ 0 0 32 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.956 111.0 46.3 -57.8 -51.4 4.4 57.2 11.0 688 343 B Q H X S+ 0 0 124 -4,-2.1 4,-1.7 1,-0.2 -1,-0.2 0.877 114.8 49.7 -59.0 -37.6 6.9 57.9 13.8 689 344 B E H < S+ 0 0 42 -4,-1.8 4,-0.5 2,-0.2 -2,-0.2 0.872 108.8 50.5 -67.8 -45.8 9.2 55.2 12.2 690 345 B V H >< S+ 0 0 8 -4,-2.9 3,-1.0 1,-0.2 -2,-0.2 0.961 115.4 44.5 -51.3 -53.0 8.9 56.8 8.7 691 346 B L H >< S+ 0 0 80 -4,-2.5 3,-0.8 1,-0.2 -2,-0.2 0.753 99.9 67.2 -69.8 -30.0 9.8 60.2 10.2 692 347 B S T 3< S+ 0 0 63 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.1 0.588 77.4 84.2 -70.8 -11.3 12.7 59.0 12.4 693 348 B F T < 0 0 63 -3,-1.0 -1,-0.3 -4,-0.5 -2,-0.1 0.309 360.0 360.0 -67.0 11.6 14.8 58.2 9.3 694 349 B K < 0 0 134 -3,-0.8 -2,-0.1 -261,-0.0 -3,-0.0 0.600 360.0 360.0 -73.2 360.0 15.8 61.9 9.3