==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-MAR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 10-AUG-12 4GK5 . COMPND 2 MOLECULE: MITOTIC SPINDLE ASSEMBLY CHECKPOINT PROTEIN MAD2B . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.TAO,X.MIN,X.WEI . 625 10 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 29589.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 452 72.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 1.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 107 17.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 7 1.1 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 . 32 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 62 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 232 37.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.3 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 4 0 0 2 0 0 0 0 0 2 2 0 2 1 1 2 1 2 0 1 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 3 2 2 0 0 3 3 4 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 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 9 A L 0 0 116 0, 0.0 2,-0.3 0, 0.0 318,-0.1 0.000 360.0 360.0 360.0 162.1 -29.7 0.6 20.0 2 10 A N - 0 0 54 316,-0.2 67,-0.2 69,-0.0 68,-0.1 -0.928 360.0-138.2-149.7 118.7 -28.3 4.1 21.0 3 11 A F - 0 0 6 64,-0.5 2,-0.1 -2,-0.3 184,-0.0 -0.256 34.5-112.1 -57.8 158.1 -24.9 5.6 20.9 4 12 A G > - 0 0 2 1,-0.1 4,-2.1 65,-0.1 66,-0.1 -0.361 20.3-109.2 -85.9 171.8 -23.8 7.7 23.9 5 13 A Q H > S+ 0 0 11 309,-0.2 4,-1.2 2,-0.2 5,-0.1 0.843 119.9 47.7 -64.5 -35.5 -23.3 11.4 24.2 6 14 A V H > S+ 0 0 9 308,-0.8 4,-2.0 2,-0.2 -1,-0.2 0.855 110.9 50.0 -82.7 -32.1 -19.5 10.9 24.6 7 15 A V H > S+ 0 0 2 307,-0.3 4,-2.8 1,-0.2 5,-0.2 0.955 110.1 52.1 -60.8 -51.0 -19.3 8.5 21.6 8 16 A A H X S+ 0 0 0 -4,-2.1 4,-1.4 1,-0.2 -2,-0.2 0.787 109.0 49.3 -57.1 -30.1 -21.3 11.1 19.7 9 17 A D H X S+ 0 0 12 -4,-1.2 4,-1.9 2,-0.2 -1,-0.2 0.869 111.0 50.7 -74.5 -40.2 -18.7 13.8 20.7 10 18 A V H X S+ 0 0 6 -4,-2.0 4,-3.1 2,-0.2 3,-0.3 0.974 110.7 48.0 -56.8 -57.2 -15.9 11.6 19.7 11 19 A L H X S+ 0 0 3 -4,-2.8 4,-2.8 1,-0.2 -1,-0.2 0.830 113.0 47.9 -53.8 -40.8 -17.5 10.9 16.3 12 20 A C H X S+ 0 0 7 -4,-1.4 4,-1.5 -5,-0.2 -1,-0.2 0.820 110.5 50.6 -72.6 -34.0 -18.1 14.5 15.6 13 21 A E H X S+ 0 0 76 -4,-1.9 4,-1.9 -3,-0.3 -2,-0.2 0.950 113.5 48.4 -65.3 -48.5 -14.6 15.5 16.6 14 22 A F H X S+ 0 0 0 -4,-3.1 4,-2.4 1,-0.2 -2,-0.2 0.920 110.2 48.3 -57.6 -52.8 -13.5 12.8 14.2 15 23 A L H X S+ 0 0 3 -4,-2.8 4,-3.1 2,-0.2 5,-0.3 0.823 106.5 59.4 -58.8 -32.1 -15.6 13.9 11.3 16 24 A E H X S+ 0 0 53 -4,-1.5 4,-2.1 2,-0.2 -1,-0.2 0.978 108.5 42.8 -63.5 -53.3 -14.5 17.5 11.8 17 25 A V H X S+ 0 0 4 -4,-1.9 4,-2.7 1,-0.2 -2,-0.2 0.949 116.6 49.6 -49.3 -53.6 -10.9 16.6 11.2 18 26 A A H X S+ 0 0 0 -4,-2.4 4,-3.0 1,-0.2 5,-0.3 0.899 107.7 50.7 -59.2 -46.7 -11.8 14.3 8.3 19 27 A V H X S+ 0 0 2 -4,-3.1 4,-1.7 1,-0.2 -1,-0.2 0.909 112.4 49.9 -61.3 -38.6 -14.0 16.8 6.5 20 28 A H H X S+ 0 0 0 -4,-2.1 4,-1.1 -5,-0.3 -2,-0.2 0.935 112.4 47.0 -60.1 -51.2 -11.2 19.3 6.8 21 29 A L H >X S+ 0 0 6 -4,-2.7 4,-2.7 1,-0.2 3,-0.7 0.913 109.7 51.1 -56.0 -56.1 -8.7 16.8 5.5 22 30 A I H 3X S+ 0 0 0 -4,-3.0 4,-1.8 1,-0.2 6,-0.2 0.889 106.6 57.4 -45.8 -44.6 -10.8 15.6 2.5 23 31 A L H 3<>S+ 0 0 0 -4,-1.7 5,-3.2 -5,-0.3 6,-1.1 0.844 113.1 39.4 -60.9 -34.0 -11.2 19.3 1.6 24 32 A Y H X<5S+ 0 0 73 -4,-1.1 3,-1.9 -3,-0.7 -2,-0.2 0.924 113.0 51.4 -78.7 -51.6 -7.5 19.7 1.4 25 33 A V H 3<5S+ 0 0 14 -4,-2.7 -2,-0.2 1,-0.3 -3,-0.2 0.758 115.6 42.9 -62.8 -27.2 -6.5 16.4 -0.3 26 34 A R T 3<5S- 0 0 11 -4,-1.8 -1,-0.3 -5,-0.3 -2,-0.2 0.246 111.6-123.1-101.9 8.9 -9.1 16.9 -3.1 27 35 A E T < 5 + 0 0 103 -3,-1.9 107,-0.2 2,-0.1 -3,-0.2 0.857 60.6 147.1 53.7 47.4 -8.1 20.6 -3.4 28 36 A V S - 0 0 50 0, 0.0 3,-2.0 0, 0.0 4,-0.2 -0.261 30.7-114.9 -70.8 150.5 -6.3 26.0 -1.8 31 39 A V G > S+ 0 0 91 1,-0.3 3,-1.5 2,-0.2 -7,-0.0 0.606 102.1 84.1 -61.8 -19.1 -3.4 24.9 0.5 32 40 A G G 3 S+ 0 0 75 1,-0.3 -1,-0.3 3,-0.0 0, 0.0 0.749 90.7 50.8 -50.0 -29.8 -2.7 28.4 1.6 33 41 A I G < S+ 0 0 26 -3,-2.0 15,-2.0 14,-0.0 16,-0.3 0.560 93.8 90.7 -90.3 -10.6 -5.5 28.1 4.2 34 42 A F E < -A 47 0A 18 -3,-1.5 2,-0.4 13,-0.2 13,-0.2 -0.611 52.2-169.3 -93.2 149.2 -4.4 24.8 5.7 35 43 A Q E -A 46 0A 95 11,-1.8 11,-0.8 -2,-0.2 9,-0.1 -0.999 29.2-111.8-134.3 128.9 -2.0 24.4 8.7 36 44 A K E +A 45 0A 117 -2,-0.4 2,-0.3 9,-0.2 9,-0.2 -0.227 46.8 160.6 -53.2 145.1 -0.5 21.2 9.8 37 45 A R E -A 44 0A 92 7,-2.0 7,-2.6 2,-0.1 2,-0.5 -0.928 34.1-113.2-155.1 179.2 -1.7 19.9 13.1 38 46 A K E +A 43 0A 122 -2,-0.3 2,-0.3 5,-0.2 3,-0.1 -0.953 35.4 156.2-131.1 116.7 -1.9 16.6 15.0 39 47 A K E > S+A 42 0A 57 3,-1.8 3,-2.6 -2,-0.5 -2,-0.1 -0.930 72.0 14.5-129.0 154.6 -4.9 14.6 15.9 40 48 A Y T 3 S- 0 0 19 -2,-0.3 -1,-0.1 1,-0.3 74,-0.1 0.824 130.5 -67.7 51.3 34.1 -5.2 10.9 16.7 41 49 A N T 3 S+ 0 0 125 1,-0.2 -1,-0.3 -3,-0.1 -3,-0.0 0.662 117.4 98.2 61.4 22.7 -1.4 11.0 17.0 42 50 A V E < S-A 39 0A 21 -3,-2.6 -3,-1.8 68,-0.0 -1,-0.2 -0.924 79.8 -94.3-136.5 158.8 -1.0 11.7 13.2 43 51 A P E +A 38 0A 63 0, 0.0 2,-0.3 0, 0.0 -5,-0.2 -0.401 46.6 170.0 -75.3 149.7 -0.5 14.8 11.1 44 52 A V E -A 37 0A 3 -7,-2.6 -7,-2.0 -2,-0.1 2,-0.4 -0.961 30.8-119.6-150.6 168.4 -3.4 16.6 9.6 45 53 A Q E +A 36 0A 38 -2,-0.3 2,-0.4 -9,-0.2 -9,-0.2 -0.886 26.6 177.9-111.4 143.6 -4.5 19.7 7.7 46 54 A M E -A 35 0A 7 -11,-0.8 -11,-1.8 -2,-0.4 -29,-0.1 -0.983 30.4-115.4-144.0 132.2 -7.1 22.1 9.1 47 55 A S E -A 34 0A 1 -2,-0.4 -13,-0.2 -13,-0.2 -16,-0.0 -0.315 12.2-157.9 -60.8 152.2 -8.2 25.3 7.5 48 56 A C + 0 0 76 -15,-2.0 -1,-0.1 4,-0.0 -14,-0.1 0.482 59.1 112.4-102.9 -13.1 -7.5 28.6 9.2 49 57 A H > - 0 0 10 -16,-0.3 4,-2.2 1,-0.1 5,-0.2 -0.457 60.3-149.1 -67.1 124.6 -10.2 30.5 7.4 50 58 A P H > S+ 0 0 82 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.914 92.8 51.8 -69.2 -45.6 -12.9 31.4 10.1 51 59 A E H > S+ 0 0 102 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.943 111.7 50.4 -52.0 -47.2 -16.0 31.3 7.9 52 60 A L H > S+ 0 0 0 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.938 110.4 47.7 -57.7 -48.9 -15.0 27.8 6.7 53 61 A N H X S+ 0 0 38 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.814 110.0 52.9 -67.1 -30.0 -14.4 26.5 10.2 54 62 A Q H X S+ 0 0 95 -4,-2.2 4,-3.8 2,-0.2 5,-0.3 0.925 106.6 52.7 -68.2 -46.6 -17.8 27.9 11.4 55 63 A Y H X S+ 0 0 14 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.907 115.1 41.1 -49.1 -49.9 -19.7 26.2 8.6 56 64 A I H X S+ 0 0 4 -4,-1.8 4,-2.5 2,-0.2 5,-0.2 0.933 115.8 48.6 -72.7 -46.0 -18.2 22.9 9.4 57 65 A Q H X S+ 0 0 96 -4,-2.4 4,-2.7 -5,-0.2 -2,-0.2 0.933 113.4 48.7 -55.0 -49.1 -18.5 23.3 13.1 58 66 A D H X S+ 0 0 31 -4,-3.8 4,-1.8 1,-0.2 -2,-0.2 0.955 109.1 54.1 -57.8 -47.9 -22.1 24.4 12.7 59 67 A T H X S+ 0 0 2 -4,-2.7 4,-1.0 -5,-0.3 -1,-0.2 0.924 115.6 37.3 -55.4 -46.9 -22.8 21.4 10.5 60 68 A L H X S+ 0 0 9 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.764 105.1 65.7 -80.6 -26.1 -21.5 18.9 13.0 61 69 A H H < S+ 0 0 106 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.939 108.9 44.3 -55.9 -40.9 -22.8 20.7 16.0 62 70 A C H < S+ 0 0 0 -4,-1.8 4,-0.3 1,-0.2 -2,-0.2 0.797 108.9 53.6 -74.9 -32.9 -26.2 19.8 14.5 63 71 A V H >X S+ 0 0 0 -4,-1.0 3,-1.7 -5,-0.2 4,-1.1 0.862 92.1 79.3 -71.1 -34.6 -25.5 16.2 13.5 64 72 A K H >X S+ 0 0 57 -4,-1.9 4,-2.8 1,-0.3 3,-1.4 0.845 86.1 51.8 -42.5 -60.4 -24.4 15.4 17.0 65 73 A P H 3> S+ 0 0 26 0, 0.0 4,-1.0 0, 0.0 -1,-0.3 0.721 109.7 53.1 -54.3 -22.2 -27.8 14.9 18.8 66 74 A L H <4>S+ 0 0 0 -3,-1.7 5,-3.9 -4,-0.3 6,-0.3 0.744 109.1 48.2 -82.3 -26.1 -28.8 12.5 16.0 67 75 A L H X<5S+ 0 0 0 -3,-1.4 3,-2.3 -4,-1.1 -64,-0.5 0.878 101.6 65.2 -76.9 -41.0 -25.6 10.5 16.6 68 76 A E H 3<5S+ 0 0 25 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.891 111.6 34.7 -39.9 -52.0 -26.4 10.5 20.3 69 77 A K T 3<5S- 0 0 39 -4,-1.0 -1,-0.3 -67,-0.2 -2,-0.2 0.281 114.1-117.4 -89.9 7.8 -29.5 8.4 19.5 70 78 A N T < 5 + 0 0 7 -3,-2.3 -3,-0.2 -66,-0.1 -2,-0.1 0.910 68.0 143.2 52.3 48.5 -27.8 6.6 16.7 71 79 A D < + 0 0 15 -5,-3.9 72,-1.8 72,-0.1 2,-0.5 0.255 40.4 90.2 -99.2 8.9 -30.2 8.0 14.3 72 80 A V E +B 142 0B 0 -6,-0.3 70,-0.3 70,-0.3 3,-0.1 -0.932 40.8 176.6-117.0 126.9 -27.7 8.5 11.4 73 81 A E E S+ 0 0 59 68,-2.1 21,-2.9 -2,-0.5 2,-0.4 0.913 74.5 10.0 -84.4 -50.9 -26.9 6.0 8.7 74 82 A K E -BC 141 93B 37 67,-1.2 67,-3.0 19,-0.2 2,-0.5 -0.997 48.9-163.8-136.1 129.4 -24.5 8.0 6.6 75 83 A V E -BC 140 92B 1 17,-1.7 17,-2.8 -2,-0.4 2,-0.4 -0.950 29.4-167.8-101.6 139.4 -22.7 11.3 6.9 76 84 A V E -BC 139 91B 3 63,-2.1 63,-2.4 -2,-0.5 2,-0.7 -0.998 23.5-154.5-137.1 129.5 -21.6 12.1 3.4 77 85 A V E -BC 138 90B 0 13,-2.2 13,-2.4 -2,-0.4 2,-0.4 -0.943 24.6-166.2-105.5 104.6 -19.1 14.8 2.2 78 86 A V E -BC 137 89B 0 59,-2.3 59,-1.8 -2,-0.7 2,-0.6 -0.810 9.0-154.5 -96.9 130.7 -20.3 15.4 -1.3 79 87 A I E -BC 136 88B 0 9,-2.5 8,-2.4 -2,-0.4 9,-1.6 -0.943 13.3-159.4-109.5 122.7 -18.0 17.3 -3.7 80 88 A L E -BC 135 86B 19 55,-2.0 55,-1.7 -2,-0.6 2,-0.1 -0.711 9.3-130.5-103.5 151.3 -19.8 19.1 -6.5 81 89 A D > - 0 0 2 4,-2.7 3,-1.7 -2,-0.3 54,-0.2 -0.137 42.6 -78.5 -91.4-171.7 -18.4 20.2 -9.7 82 90 A K T 3 S+ 0 0 136 50,-0.3 52,-0.1 1,-0.3 51,-0.0 0.585 131.5 46.3 -69.3 -13.8 -18.6 23.6 -11.4 83 91 A E T 3 S- 0 0 121 2,-0.2 -1,-0.3 0, 0.0 51,-0.1 0.036 121.7-104.1-115.7 20.8 -22.2 23.0 -12.7 84 92 A H S < S+ 0 0 110 -3,-1.7 -2,-0.1 1,-0.2 50,-0.0 0.592 78.1 135.6 62.3 22.3 -23.3 21.6 -9.3 85 93 A R - 0 0 121 1,-0.0 -4,-2.7 86,-0.0 2,-0.3 -0.778 63.2-105.0 -91.9 135.6 -23.3 18.0 -10.4 86 94 A P E +C 80 0B 8 0, 0.0 86,-0.3 0, 0.0 -6,-0.3 -0.435 40.2 170.9 -63.9 123.5 -21.7 15.6 -7.9 87 95 A V E + 0 0 0 -8,-2.4 109,-2.4 1,-0.3 2,-0.3 0.746 65.6 12.3 -99.2 -28.9 -18.2 14.3 -8.8 88 96 A E E -CD 79 195B 0 -9,-1.6 -9,-2.5 107,-0.2 2,-0.4 -0.990 57.8-160.5-151.9 150.8 -17.1 12.6 -5.6 89 97 A K E -CD 78 194B 20 105,-1.9 105,-1.9 -2,-0.3 2,-0.7 -0.990 6.6-160.6-139.7 131.4 -18.6 11.3 -2.4 90 98 A F E -CD 77 193B 0 -13,-2.4 -13,-2.2 -2,-0.4 2,-0.5 -0.938 21.6-164.3-111.3 113.4 -17.1 10.4 0.9 91 99 A V E -CD 76 192B 5 101,-2.8 101,-1.8 -2,-0.7 2,-0.6 -0.849 15.9-166.0-105.7 128.4 -19.4 8.2 2.8 92 100 A F E -CD 75 191B 0 -17,-2.8 -17,-1.7 -2,-0.5 2,-0.6 -0.955 15.5-164.7-106.9 111.1 -19.2 7.4 6.6 93 101 A E E -CD 74 190B 5 97,-2.4 97,-1.7 -2,-0.6 2,-0.4 -0.861 3.8-160.0-104.6 122.8 -21.5 4.5 7.1 94 102 A I E + D 0 189B 2 -21,-2.9 2,-0.3 -2,-0.6 95,-0.2 -0.885 15.4 167.7-116.3 140.6 -22.4 3.9 10.7 95 103 A T E - D 0 188B 32 93,-2.0 93,-2.2 -2,-0.4 -25,-0.0 -0.907 32.1-123.1-147.5 156.8 -23.7 0.7 12.2 96 104 A Q - 0 0 83 -2,-0.3 91,-0.2 91,-0.2 90,-0.1 -0.940 23.9-145.3-105.5 131.9 -24.3 -1.0 15.5 97 105 A P 0 0 33 0, 0.0 91,-0.0 0, 0.0 86,-0.0 -0.683 360.0 360.0 -86.1 150.7 -22.6 -4.4 16.0 98 106 A P 0 0 124 0, 0.0 88,-0.1 0, 0.0 -2,-0.0 -0.831 360.0 360.0 -96.7 360.0 -24.6 -7.1 18.1 99 ! 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 0.0 100 110 A I 0 0 142 0, 0.0 85,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 139.9 -19.0 -10.0 22.5 101 111 A S + 0 0 120 2,-0.1 84,-0.1 84,-0.1 0, 0.0 0.365 360.0 117.6-154.4 -7.5 -15.2 -10.2 21.9 102 112 A S - 0 0 66 1,-0.1 82,-0.1 82,-0.1 83,-0.1 0.161 68.1 -71.7 -73.9 177.3 -14.3 -7.0 19.8 103 113 A D - 0 0 88 80,-0.4 82,-3.2 1,-0.1 2,-0.7 -0.293 46.1-111.5 -63.7 147.9 -12.0 -3.9 20.5 104 114 A S > - 0 0 19 80,-0.2 4,-1.4 1,-0.2 5,-0.1 -0.745 23.7-156.4 -84.8 118.6 -12.9 -1.2 23.0 105 115 A L H > S+ 0 0 1 -2,-0.7 4,-0.6 1,-0.2 3,-0.2 0.917 89.9 41.7 -61.6 -48.3 -13.6 2.0 21.0 106 116 A L H 4 S+ 0 0 6 1,-0.2 3,-0.3 2,-0.2 4,-0.2 0.852 113.1 52.8 -70.4 -39.7 -12.9 4.5 23.8 107 117 A S H 4 S+ 0 0 33 1,-0.2 -1,-0.2 134,-0.1 -2,-0.2 0.784 124.2 28.8 -59.3 -32.2 -9.8 2.7 25.1 108 118 A H H >X S+ 0 0 63 -4,-1.4 4,-2.0 -3,-0.2 3,-1.3 0.246 78.1 132.5-124.0 11.3 -8.4 2.7 21.6 109 119 A V H 3X S+ 0 0 10 -4,-0.6 4,-3.0 -3,-0.3 5,-0.4 0.800 75.0 45.1 -25.3 -71.1 -9.9 5.8 19.9 110 120 A E H 3> S+ 0 0 41 1,-0.2 4,-0.9 -4,-0.2 -1,-0.3 0.763 114.1 49.3 -63.3 -29.2 -6.7 7.2 18.4 111 121 A Q H X> S+ 0 0 115 -3,-1.3 4,-1.3 2,-0.2 3,-0.6 0.992 116.8 42.2 -62.2 -61.9 -5.5 3.9 17.1 112 122 A L H 3X S+ 0 0 23 -4,-2.0 4,-0.7 1,-0.3 -2,-0.2 0.843 119.6 39.7 -58.1 -44.4 -8.8 3.1 15.5 113 123 A L H 3X S+ 0 0 2 -4,-3.0 4,-1.8 -5,-0.3 -1,-0.3 0.739 103.5 67.4 -83.1 -17.3 -9.6 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5,-0.2 0.995 108.3 41.8 -65.8 -62.2 -12.3 -3.0 3.0 484 1205 E K H > S+ 0 0 39 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.878 115.6 50.7 -50.6 -45.2 -11.6 -6.7 3.2 485 1206 E L H X S+ 0 0 0 -4,-2.1 4,-3.3 1,-0.3 -1,-0.2 0.938 108.4 50.7 -66.3 -45.4 -13.4 -7.3 -0.0 486 1207 E D H X S+ 0 0 12 -4,-2.4 4,-1.5 2,-0.2 -1,-0.3 0.826 114.2 46.1 -56.1 -34.8 -11.5 -4.7 -1.9 487 1208 E L H X S+ 0 0 68 -4,-2.1 4,-3.1 2,-0.2 -2,-0.2 0.964 114.1 47.5 -70.7 -49.5 -8.3 -6.3 -0.6 488 1209 E V H X S+ 0 0 2 -4,-3.0 4,-1.8 2,-0.2 -2,-0.2 0.869 109.7 52.5 -57.8 -45.3 -9.4 -9.8 -1.4 489 1210 E I H X S+ 0 0 0 -4,-3.3 4,-0.7 -5,-0.2 -1,-0.2 0.980 114.7 42.8 -54.4 -57.3 -10.5 -9.0 -4.8 490 1211 E K H >X S+ 0 0 89 -4,-1.5 4,-2.4 2,-0.2 3,-0.7 0.872 107.8 56.8 -58.3 -48.3 -7.1 -7.4 -5.5 491 1212 E Y H 3X S+ 0 0 19 -4,-3.1 4,-2.3 1,-0.3 3,-0.5 0.978 115.4 38.7 -47.3 -57.4 -4.9 -10.0 -3.9 492 1213 E M H 3X S+ 0 0 0 -4,-1.8 4,-1.0 1,-0.3 -1,-0.3 0.554 108.2 63.3 -78.1 -6.9 -6.5 -12.7 -6.1 493 1214 E K H - 0 0 73 1,-0.2 4,-0.8 2,-0.0 3,-0.2 -0.500 65.0-155.5 -58.7 115.8 -3.2 -21.1 -16.4 502 1223 E S H >> S+ 0 0 66 -2,-0.4 4,-1.6 1,-0.2 3,-0.6 0.824 92.1 74.7 -54.3 -34.8 -5.8 -19.3 -18.4 503 1224 E V H >> S+ 0 0 53 1,-0.3 4,-2.4 2,-0.2 3,-1.3 0.942 95.2 46.2 -43.8 -58.6 -8.2 -21.2 -16.1 504 1225 E W H 3> S+ 0 0 0 1,-0.3 4,-2.0 -3,-0.2 -1,-0.3 0.773 107.4 58.9 -58.8 -27.8 -7.3 -18.9 -13.2 505 1226 E N H X>S+ 0 0 0 -4,-1.7 4,-3.3 1,-0.2 5,-1.1 0.970 107.8 57.6 -60.4 -49.7 -22.4 -4.3 -5.3 520 1241 E Q H 3<5S+ 0 0 70 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.715 113.5 39.1 -55.5 -27.5 -24.4 -2.5 -8.0 521 1242 E Q H 3<5S+ 0 0 156 -4,-0.7 -1,-0.3 -3,-0.2 -2,-0.2 0.615 121.7 41.0 -97.9 -15.6 -27.6 -3.5 -6.2 522 1243 E T H <<5S+ 0 0 68 -4,-1.3 -2,-0.2 -3,-1.0 -3,-0.2 0.846 135.6 12.7 -98.1 -45.8 -26.4 -3.0 -2.6 523 1244 E Y T <5S- 0 0 19 -4,-3.3 -3,-0.2 2,-0.3 3,-0.1 0.455 94.5-122.8-108.4 -3.3 -24.4 0.2 -2.8 524 1245 E G S S-S 538 0G 8 3,-2.2 3,-2.4 -2,-0.3 31,-0.1 -0.958 86.4 -32.6-133.4 111.0 -21.8 -23.0 37.0 536 1160 F A T 3 S- 0 0 69 -2,-0.4 3,-0.1 1,-0.3 -1,-0.1 0.714 131.2 -44.2 44.3 29.9 -21.2 -26.8 36.7 537 1161 F G T 3 S+ 0 0 50 1,-0.3 -1,-0.3 2,-0.0 2,-0.1 -0.214 112.8 125.4 113.3 -40.3 -17.6 -25.7 37.5 538 1162 F A B < +S 535 0G 14 -3,-2.4 -3,-2.2 5,-0.1 -1,-0.3 -0.320 20.5 154.9 -72.3 134.9 -17.4 -22.6 35.1 539 1163 F V + 0 0 61 -5,-0.2 -1,-0.1 -2,-0.1 5,-0.1 0.779 44.4 77.6-123.1 -72.9 -16.4 -19.2 36.5 540 1164 F E S > S- 0 0 130 1,-0.1 4,-1.6 3,-0.1 3,-0.3 -0.208 89.0-112.5 -48.4 140.3 -14.8 -16.6 34.2 541 1165 F F H > S+ 0 0 46 1,-0.2 4,-2.5 2,-0.2 3,-0.2 0.860 113.1 56.1 -49.3 -42.9 -17.7 -15.1 32.1 542 1166 F N H > S+ 0 0 109 1,-0.2 4,-2.4 2,-0.2 5,-0.3 0.942 106.3 47.6 -56.1 -53.0 -16.4 -16.7 28.9 543 1167 F D H > S+ 0 0 88 -3,-0.3 4,-1.0 1,-0.2 -1,-0.2 0.802 113.3 50.3 -62.7 -29.3 -16.4 -20.3 30.1 544 1168 F V H X S+ 0 0 0 -4,-1.6 4,-2.9 -3,-0.2 3,-0.3 0.978 110.8 48.1 -67.1 -59.6 -20.0 -19.8 31.5 545 1169 F K H X S+ 0 0 33 -4,-2.5 4,-3.1 1,-0.2 -2,-0.2 0.909 113.3 45.3 -43.9 -59.7 -21.4 -18.3 28.3 546 1170 F T H X S+ 0 0 84 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.764 113.8 50.8 -65.3 -27.5 -19.9 -21.0 26.0 547 1171 F L H X S+ 0 0 63 -4,-1.0 4,-2.4 -3,-0.3 -1,-0.2 0.855 111.4 48.3 -72.6 -39.7 -21.1 -23.7 28.4 548 1172 F L H X S+ 0 0 3 -4,-2.9 4,-2.9 2,-0.2 -2,-0.2 0.917 112.6 49.2 -62.3 -43.8 -24.5 -22.1 28.4 549 1173 F R H X S+ 0 0 146 -4,-3.1 4,-1.4 2,-0.2 5,-0.3 0.967 110.8 48.1 -61.2 -54.4 -24.4 -22.0 24.6 550 1174 F E H >X S+ 0 0 139 -4,-2.5 4,-2.7 1,-0.2 3,-0.6 0.933 116.4 46.6 -48.2 -49.9 -23.4 -25.7 24.4 551 1175 F W H 3< S+ 0 0 28 -4,-2.4 4,-0.3 1,-0.2 -1,-0.2 0.885 107.4 53.5 -64.9 -42.1 -26.2 -26.5 26.8 552 1176 F I H 3< S+ 0 0 15 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.737 123.3 26.5 -71.7 -18.4 -28.9 -24.4 25.1 553 1177 F T H << S+ 0 0 96 -4,-1.4 -2,-0.2 -3,-0.6 -1,-0.2 0.824 114.5 54.6-110.8 -47.1 -28.4 -26.1 21.7 554 1178 F T S < S+ 0 0 92 -4,-2.7 2,-0.5 -5,-0.3 -3,-0.2 0.979 106.1 47.8 -54.3 -76.6 -26.9 -29.6 22.2 555 1179 F I S S- 0 0 92 -4,-0.3 -1,-0.1 -5,-0.3 0, 0.0 -0.571 72.4-164.1 -74.0 116.9 -29.5 -31.2 24.5 556 1180 F S S S+ 0 0 101 -2,-0.5 -1,-0.2 1,-0.2 43,-0.1 0.833 78.3 40.1 -78.9 -38.4 -32.9 -30.4 23.0 557 1181 F D S S- 0 0 121 41,-0.0 2,-0.5 42,-0.0 -1,-0.2 -0.970 84.4-149.9-111.2 118.1 -35.1 -31.2 26.1 558 1182 F P - 0 0 12 0, 0.0 5,-0.1 0, 0.0 2,-0.1 -0.763 13.4-122.7 -95.4 122.5 -33.4 -30.0 29.4 559 1183 F M >> - 0 0 109 -2,-0.5 3,-2.2 1,-0.1 4,-1.4 -0.343 20.3-124.8 -59.9 132.9 -33.9 -31.7 32.7 560 1184 F E H 3> S+ 0 0 159 1,-0.3 4,-2.5 2,-0.2 5,-0.3 0.820 112.2 66.7 -48.5 -36.3 -35.3 -29.4 35.4 561 1185 F E H 3> S+ 0 0 152 1,-0.2 4,-1.0 2,-0.2 -1,-0.3 0.866 103.7 46.6 -52.7 -36.5 -32.2 -30.5 37.6 562 1186 F D H <> S+ 0 0 71 -3,-2.2 4,-0.7 2,-0.2 -2,-0.2 0.865 110.9 49.7 -79.0 -38.0 -30.1 -28.6 34.9 563 1187 F I H >X S+ 0 0 20 -4,-1.4 4,-1.4 1,-0.2 3,-1.2 0.960 109.6 51.3 -58.5 -52.5 -32.3 -25.4 34.8 564 1188 F L H 3X S+ 0 0 90 -4,-2.5 4,-2.8 1,-0.3 5,-0.2 0.810 99.4 62.0 -61.8 -32.5 -32.3 -25.0 38.6 565 1189 F Q H 3X S+ 0 0 89 -4,-1.0 4,-1.7 -5,-0.3 -1,-0.3 0.847 105.2 51.2 -62.7 -29.3 -28.6 -25.2 38.9 566 1190 F V H S+ 0 0 0 -4,-1.7 5,-3.2 1,-0.2 4,-0.3 0.779 109.1 50.1 -61.1 -35.4 -24.1 -13.9 42.0 574 1198 F I H ><5S+ 0 0 3 -4,-1.2 3,-1.1 3,-0.2 -1,-0.2 0.945 115.2 43.3 -63.3 -52.3 -26.6 -11.6 43.5 575 1199 F E H 3<5S+ 0 0 129 -4,-2.8 -2,-0.2 1,-0.3 -3,-0.2 0.903 115.0 50.1 -62.3 -43.0 -25.4 -12.6 47.0 576 1200 F E T 3<5S- 0 0 65 -4,-3.6 -1,-0.3 -5,-0.2 -2,-0.2 0.508 114.9-117.5 -76.7 -4.7 -21.8 -12.4 45.9 577 1201 F K T < 5S+ 0 0 65 -3,-1.1 -3,-0.2 -4,-0.3 3,-0.1 0.926 70.7 131.9 66.8 47.5 -22.3 -8.9 44.5 578 1202 F D >< + 0 0 35 -5,-3.2 4,-1.9 1,-0.1 5,-0.2 -0.505 14.9 155.6-118.1 64.2 -21.5 -9.5 40.7 579 1203 F L H > S+ 0 0 1 2,-0.2 4,-1.6 1,-0.2 -1,-0.1 0.787 70.4 61.2 -52.0 -36.4 -24.6 -7.7 39.4 580 1204 F E H >> S+ 0 0 21 2,-0.2 4,-2.3 1,-0.2 3,-1.1 0.996 106.7 42.1 -52.3 -65.7 -22.6 -7.2 36.2 581 1205 F K H 3> S+ 0 0 30 1,-0.3 4,-2.4 2,-0.2 5,-0.3 0.821 110.0 59.1 -56.5 -30.9 -22.2 -10.9 35.5 582 1206 F L H 3X S+ 0 0 0 -4,-1.9 4,-2.2 1,-0.2 -1,-0.3 0.903 108.6 45.8 -63.3 -38.0 -25.8 -11.5 36.5 583 1207 F D H < S+ 0 0 148 -4,-2.3 3,-1.5 -3,-0.2 -2,-0.2 0.992 121.4 28.9 -56.8 -71.5 -30.7 -14.1 23.3 592 1216 F L H 3< S+ 0 0 33 -4,-1.6 2,-0.3 1,-0.3 -2,-0.2 0.947 113.0 68.2 -54.0 -51.3 -30.2 -17.7 22.8 593 1217 F M T 3< S+ 0 0 0 -4,-3.7 10,-0.3 -5,-0.4 -1,-0.3 0.373 84.9 73.8 -63.2 5.8 -33.1 -18.7 25.0 594 1218 F Q < 0 0 76 -3,-1.5 -1,-0.2 -4,-0.4 -2,-0.1 -0.426 360.0 360.0-123.1 63.2 -35.9 -17.4 22.7 595 1219 F Q 0 0 181 -2,-0.2 -1,-0.1 -3,-0.1 3,-0.1 -0.266 360.0 360.0-146.6 360.0 -36.4 -19.7 19.6 596 ! 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 0.0 597 1223 F S > 0 0 105 0, 0.0 4,-2.0 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 -30.2 -40.8 -22.8 23.3 598 1224 F V H > + 0 0 68 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.926 360.0 49.1 -59.9 -45.3 -39.4 -25.1 25.9 599 1225 F W H > S+ 0 0 31 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.631 107.4 55.9 -72.5 -14.1 -36.3 -22.9 26.1 600 1226 F N H > S+ 0 0 54 -3,-0.2 4,-2.3 2,-0.2 5,-0.2 0.921 105.4 49.0 -80.8 -48.9 -38.5 -19.8 26.4 601 1227 F M H X S+ 0 0 116 -4,-2.0 4,-2.9 1,-0.2 5,-0.3 0.969 108.4 56.9 -46.2 -58.7 -40.4 -21.1 29.5 602 1228 F A H X S+ 0 0 4 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.878 107.4 47.8 -39.7 -54.5 -37.0 -21.9 31.0 603 1229 F F H X S+ 0 0 5 -4,-1.2 4,-2.7 -10,-0.3 3,-0.4 0.950 111.1 48.2 -57.9 -55.3 -35.9 -18.3 30.6 604 1230 F D H X S+ 0 0 68 -4,-2.3 4,-2.6 1,-0.3 -1,-0.2 0.871 109.8 53.4 -54.9 -40.7 -39.0 -16.7 32.1 605 1231 F F H X S+ 0 0 76 -4,-2.9 4,-1.6 -5,-0.2 -1,-0.3 0.895 111.1 46.9 -61.1 -38.7 -38.8 -19.1 35.0 606 1232 F I H X S+ 0 0 1 -4,-1.9 4,-2.4 -3,-0.4 -2,-0.2 0.874 113.5 47.3 -71.9 -37.6 -35.2 -18.0 35.6 607 1233 F L H X S+ 0 0 32 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.875 107.2 57.8 -70.6 -36.5 -36.0 -14.4 35.3 608 1234 F D H X S+ 0 0 102 -4,-2.6 4,-1.8 -5,-0.2 -2,-0.2 0.933 112.5 40.3 -53.9 -51.2 -39.0 -14.7 37.6 609 1235 F N H X S+ 0 0 59 -4,-1.6 4,-1.7 1,-0.2 5,-0.2 0.948 114.5 49.8 -70.5 -51.0 -36.8 -16.0 40.4 610 1236 F V H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.864 110.3 54.2 -52.1 -36.5 -33.9 -13.7 39.9 611 1237 F Q H X S+ 0 0 42 -4,-2.2 4,-3.2 2,-0.2 -1,-0.2 0.920 105.1 48.7 -71.3 -49.4 -36.2 -10.8 39.9 612 1238 F V H X S+ 0 0 87 -4,-1.8 4,-1.6 1,-0.2 -1,-0.2 0.800 112.2 51.6 -58.9 -33.6 -38.0 -11.4 43.2 613 1239 F V H X S+ 0 0 47 -4,-1.7 4,-2.8 2,-0.2 5,-0.3 0.881 110.4 47.4 -72.1 -38.3 -34.6 -11.9 44.8 614 1240 F L H X>S+ 0 0 0 -4,-2.0 4,-2.4 -5,-0.2 5,-1.8 0.945 105.0 62.5 -63.1 -46.0 -33.5 -8.5 43.3 615 1241 F Q H <5S+ 0 0 78 -4,-3.2 4,-0.4 4,-0.2 -2,-0.2 0.892 115.7 29.7 -38.2 -54.8 -36.7 -7.1 44.6 616 1242 F Q H <5S+ 0 0 163 -4,-1.6 -2,-0.2 2,-0.1 -1,-0.2 0.923 121.7 46.5 -80.9 -45.6 -35.6 -7.9 48.1 617 1243 F T H <5S+ 0 0 76 -4,-2.8 -3,-0.2 1,-0.2 -2,-0.2 0.903 134.2 11.2 -68.3 -42.4 -31.8 -7.6 48.1 618 1244 F Y T <5S- 0 0 25 -4,-2.4 -3,-0.2 -5,-0.3 -1,-0.2 0.664 94.6-123.3-111.0 -22.6 -31.5 -4.4 46.1 619 1245 F G S > 0 0 38 0, 0.0 4,-1.8 0, 0.0 3,-0.8 0.000 360.0 360.0 360.0 168.3 -12.4 -30.4 -3.2 628 567 G F T 34 + 0 0 16 1,-0.3 4,-0.3 2,-0.2 -174,-0.0 0.727 360.0 41.3 -48.8 -59.2 -9.9 -27.8 -1.9 629 568 G F T >4 S+ 0 0 2 2,-0.2 3,-0.6 1,-0.2 -1,-0.3 0.862 114.4 53.8 -66.0 -33.6 -11.7 -25.6 0.5 630 569 G D T <4 S+ 0 0 85 -3,-0.8 -2,-0.2 1,-0.3 -1,-0.2 0.986 111.1 44.6 -58.8 -61.5 -13.7 -28.5 2.1 631 570 G K T 3< S+ 0 0 153 -4,-1.8 2,-0.9 1,-0.1 -1,-0.3 0.414 98.3 91.1 -62.3 -3.5 -10.5 -30.5 2.9 632 571 G K < + 0 0 58 -3,-0.6 -1,-0.1 -5,-0.3 -182,-0.0 -0.837 36.5 123.8 -99.9 96.7 -9.1 -27.2 4.1 633 572 G R 0 0 203 -2,-0.9 -1,-0.1 -193,-0.1 -193,-0.1 -0.430 360.0 360.0-137.2 57.6 -9.8 -27.0 7.8 634 573 G S 0 0 136 0, 0.0 -3,-0.0 0, 0.0 -194,-0.0 -0.925 360.0 360.0-145.3 360.0 -6.2 -26.5 9.0