==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-APR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL CYCLE 25-JUN-09 3I0M . COMPND 2 MOLECULE: DNA REPAIR AND TELOMERE MAINTENANCE PROTEIN NBS1; . SOURCE 2 ORGANISM_SCIENTIFIC: SCHIZOSACCHAROMYCES POMBE; . AUTHOR J.A.CLAPPERTON,J.LLOYD,J.R.CHAPMAN,S.P.JACKSON,S.J.SMERDON . 319 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17028.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 209 65.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 8.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 41 12.9 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 27 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 69 21.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 2 0 3 0 1 4 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 5 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 PARALLEL BRIDGES PER LADDER . 1 0 4 1 3 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 2 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 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 1 A X 0 0 7 0, 0.0 113,-3.2 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 139.6 45.8 15.5 54.0 2 2 A W E -AB 18 113A 0 16,-0.7 16,-3.2 111,-0.2 2,-0.4 -0.694 360.0-170.7 -81.4 124.6 46.9 15.9 57.6 3 3 A I E -AB 17 112A 1 109,-3.0 109,-2.8 -2,-0.5 2,-0.4 -0.917 3.4-161.0-111.6 140.6 49.6 13.5 58.8 4 4 A I E +AB 16 111A 0 12,-2.4 12,-2.1 -2,-0.4 2,-0.3 -0.971 14.7 167.1-123.3 145.1 50.6 13.2 62.4 5 5 A E E - B 0 110A 48 105,-1.2 105,-3.0 -2,-0.4 2,-0.3 -0.969 16.5-151.9-152.9 154.0 53.8 11.7 63.7 6 6 A A E - B 0 109A 13 -2,-0.3 2,-0.3 103,-0.2 5,-0.2 -0.997 17.7-136.7-140.6 145.1 55.7 11.5 67.0 7 7 A E S S+ 0 0 143 101,-0.6 2,-0.2 -2,-0.3 102,-0.1 -0.177 85.4 48.4 -97.6 40.2 59.4 11.1 68.0 8 8 A G S S- 0 0 33 -2,-0.3 -2,-0.1 100,-0.1 3,-0.1 -0.478 107.0 -82.1-135.4-143.9 58.9 8.7 70.9 9 9 A D S > S+ 0 0 108 -2,-0.2 3,-1.4 3,-0.1 30,-0.2 0.107 99.0 107.4-103.1 15.2 57.0 5.4 71.3 10 10 A I T 3 S+ 0 0 7 1,-0.3 29,-0.6 2,-0.1 -1,-0.1 0.720 83.6 34.0 -78.8 -22.2 54.0 7.6 71.9 11 11 A L T > S- 0 0 2 -5,-0.2 3,-1.4 27,-0.1 -1,-0.3 0.063 117.8-106.9-111.9 22.7 52.2 7.0 68.7 12 12 A K T < - 0 0 122 -3,-1.4 -2,-0.1 1,-0.3 -3,-0.1 0.542 67.4 -68.0 70.5 9.2 53.5 3.4 68.6 13 13 A G T 3 S+ 0 0 66 1,-0.3 2,-0.4 -7,-0.1 -1,-0.3 0.741 106.0 124.7 78.6 26.5 56.0 4.4 65.8 14 14 A K < - 0 0 98 -3,-1.4 -1,-0.3 181,-0.0 2,-0.2 -0.965 56.5-138.2-122.4 133.2 53.1 4.9 63.3 15 15 A S - 0 0 36 -2,-0.4 180,-2.6 -10,-0.1 2,-0.4 -0.600 24.3-153.9 -75.2 148.4 52.2 7.9 61.2 16 16 A R E -A 4 0A 3 -12,-2.1 -12,-2.4 178,-0.2 2,-0.5 -0.975 10.5-140.9-125.2 139.4 48.4 8.6 61.1 17 17 A I E -A 3 0A 0 174,-1.1 2,-0.9 -2,-0.4 -14,-0.2 -0.900 16.5-151.5 -95.6 127.8 46.3 10.4 58.4 18 18 A L E -A 2 0A 3 -16,-3.2 -16,-0.7 -2,-0.5 3,-0.1 -0.818 13.8-168.0-104.5 97.6 43.7 12.5 60.0 19 19 A F - 0 0 1 -2,-0.9 33,-0.3 1,-0.2 117,-0.1 -0.338 46.3 -65.3 -72.3 158.9 40.7 12.8 57.6 20 20 A P S S+ 0 0 21 0, 0.0 2,-0.3 0, 0.0 33,-0.2 -0.220 99.5 74.5 -47.9 133.2 38.0 15.4 58.3 21 21 A G E S-F 52 0B 34 31,-1.8 31,-2.1 -3,-0.1 2,-0.4 -0.964 82.7 -64.9 148.0-167.3 36.2 14.5 61.5 22 22 A T E -F 51 0B 59 -2,-0.3 2,-0.5 29,-0.2 29,-0.2 -0.976 36.4-166.1-131.7 132.8 36.8 14.6 65.2 23 23 A Y E -F 50 0B 4 27,-3.3 27,-2.5 -2,-0.4 2,-0.6 -0.960 14.0-146.7-126.4 124.5 39.4 12.7 67.3 24 24 A I E -Fg 49 35B 12 10,-2.0 12,-2.7 -2,-0.5 2,-0.5 -0.801 22.1-163.8 -85.8 119.3 39.6 12.2 71.1 25 25 A V E +Fg 48 36B 0 23,-3.2 23,-2.7 -2,-0.6 22,-1.9 -0.913 33.4 100.7-110.5 128.0 43.3 12.2 72.1 26 26 A G E S- g 0 37B 0 10,-1.8 12,-1.8 -2,-0.5 19,-0.2 -0.966 73.1 -88.8 178.8-174.7 44.4 10.8 75.5 27 27 A R S S+ 0 0 101 17,-1.7 18,-0.2 -2,-0.3 19,-0.1 0.648 113.1 50.7 -95.5 -15.9 45.9 7.8 77.3 28 28 A N S S+ 0 0 110 17,-1.7 -1,-0.1 16,-0.2 18,-0.1 0.644 91.3 89.2 -96.8 -16.3 42.7 5.8 78.3 29 29 A V - 0 0 18 16,-0.6 2,-0.1 7,-0.2 9,-0.1 -0.315 66.9-140.2 -73.2 160.7 41.1 5.7 74.8 30 30 A S - 0 0 77 7,-0.1 2,-0.6 6,-0.1 -4,-0.1 -0.052 38.5 -71.9 -99.0-152.4 41.9 2.9 72.2 31 31 A D + 0 0 58 5,-0.2 5,-0.2 -2,-0.1 2,-0.2 -0.835 65.4 146.5-115.6 95.2 42.4 3.2 68.4 32 32 A D B > -H 35 0B 79 -2,-0.6 3,-0.5 3,-0.6 -3,-0.0 -0.401 68.8 -93.9-105.2-176.5 39.1 3.9 66.6 33 33 A S T 3 S+ 0 0 49 1,-0.2 -11,-0.1 -2,-0.2 3,-0.0 0.560 133.0 33.3 -67.8 -10.6 38.5 6.0 63.5 34 34 A S T 3 S+ 0 0 40 -11,-0.1 -10,-2.0 1,-0.1 2,-0.3 0.078 109.6 72.2-138.1 19.7 37.8 8.7 66.1 35 35 A H E < -gH 24 32B 59 -3,-0.5 -3,-0.6 -12,-0.2 2,-0.4 -0.998 52.5-166.1-142.0 138.3 40.2 7.9 68.9 36 36 A I E -g 25 0B 2 -12,-2.7 -10,-1.8 -2,-0.3 2,-0.4 -0.980 12.6-146.6-128.3 120.9 44.0 8.3 69.3 37 37 A Q E -g 26 0B 62 -2,-0.4 2,-0.4 -12,-0.2 -10,-0.2 -0.735 15.4-179.9 -91.4 131.6 46.0 6.7 72.1 38 38 A V - 0 0 1 -12,-1.8 -27,-0.1 -2,-0.4 -28,-0.1 -0.917 15.8-153.7-135.5 103.7 49.1 8.6 73.4 39 39 A I + 0 0 89 -29,-0.6 -1,-0.1 -2,-0.4 -12,-0.1 0.584 45.3 124.6 -55.9 -29.7 50.8 6.6 76.3 40 40 A S - 0 0 28 1,-0.1 3,-0.5 67,-0.1 -2,-0.1 0.238 58.5-131.6 -54.6 160.9 52.6 9.3 78.3 41 41 A K S S+ 0 0 183 1,-0.2 -1,-0.1 63,-0.1 -14,-0.0 0.788 100.2 55.7 -81.6 -34.9 52.3 10.0 82.1 42 42 A S S S+ 0 0 20 60,-0.1 62,-0.4 2,-0.0 2,-0.4 0.458 92.1 90.5 -81.5 -1.4 51.8 13.8 82.1 43 43 A I S S- 0 0 2 -3,-0.5 -16,-0.1 60,-0.1 4,-0.1 -0.810 77.8-114.0-103.6 141.7 48.7 13.6 79.7 44 44 A S - 0 0 33 -2,-0.4 -17,-1.7 2,-0.1 3,-0.4 -0.022 27.6-104.4 -66.7 165.8 45.1 13.2 80.9 45 45 A K S S+ 0 0 115 1,-0.3 -17,-1.7 -19,-0.2 -16,-0.6 0.922 123.4 14.9 -53.5 -49.6 42.7 10.3 80.5 46 46 A R S S+ 0 0 127 -20,-0.2 -1,-0.3 27,-0.2 -20,-0.3 -0.958 85.0 159.4-125.8 109.4 41.0 12.4 77.8 47 47 A H + 0 0 0 -22,-1.9 26,-2.4 -2,-0.4 2,-0.3 0.877 49.3 13.8-102.9 -47.2 43.4 15.2 77.0 48 48 A A E -FI 25 72B 0 -23,-2.7 -23,-3.2 24,-0.2 2,-0.5 -0.936 49.1-142.0-139.5 156.6 42.7 16.8 73.6 49 49 A R E -FI 24 71B 74 22,-2.5 22,-2.1 -2,-0.3 2,-0.5 -0.986 15.4-166.2-118.6 118.9 40.2 17.1 70.8 50 50 A F E -FI 23 70B 0 -27,-2.5 -27,-3.3 -2,-0.5 2,-0.4 -0.947 8.3-176.9-101.5 127.7 41.5 17.3 67.2 51 51 A T E -FI 22 69B 24 18,-2.1 18,-3.6 -2,-0.5 2,-0.5 -0.990 7.4-166.0-128.2 121.0 38.9 18.4 64.6 52 52 A I E -FI 21 68B 5 -31,-2.1 -31,-1.8 -2,-0.4 16,-0.2 -0.915 14.3-147.6-106.5 126.8 39.8 18.6 60.9 53 53 A L - 0 0 62 14,-2.6 3,-0.1 -2,-0.5 13,-0.0 -0.508 22.6 -97.9 -93.9 164.8 37.3 20.5 58.7 54 54 A T - 0 0 65 -2,-0.2 13,-0.3 1,-0.2 81,-0.1 -0.405 58.5 -72.2 -77.1 158.7 36.4 19.7 55.1 55 55 A P - 0 0 20 0, 0.0 -1,-0.2 0, 0.0 2,-0.1 -0.094 43.4-127.4 -58.6 147.2 38.1 21.7 52.3 56 56 A S > - 0 0 59 8,-0.1 3,-0.5 9,-0.1 4,-0.4 -0.326 29.6-104.6 -79.2 169.2 37.4 25.4 51.6 57 57 A E T 3 S+ 0 0 186 1,-0.2 3,-0.4 2,-0.1 4,-0.2 0.815 121.0 49.4 -65.3 -31.9 36.4 26.6 48.1 58 58 A K T >> S+ 0 0 120 1,-0.2 4,-2.4 2,-0.1 3,-1.1 0.603 86.8 85.9 -82.5 -17.5 39.9 28.1 47.6 59 59 A D H <> S+ 0 0 7 -3,-0.5 4,-1.8 1,-0.3 -1,-0.2 0.795 84.6 56.6 -63.2 -29.6 41.8 25.0 48.7 60 60 A Y H 34 S+ 0 0 7 -3,-0.4 87,-0.4 -4,-0.4 -1,-0.3 0.842 116.5 37.0 -65.2 -32.7 41.7 23.5 45.2 61 61 A F H <4 S+ 0 0 76 -3,-1.1 85,-0.3 -4,-0.2 -2,-0.2 0.736 126.4 33.9 -93.2 -26.8 43.4 26.7 43.9 62 62 A T H < S- 0 0 88 -4,-2.4 -3,-0.2 2,-0.1 -2,-0.2 0.708 90.0-133.1-102.7 -24.2 45.8 27.5 46.7 63 63 A G < + 0 0 9 -4,-1.8 -4,-0.1 -5,-0.3 -3,-0.1 0.502 53.1 153.5 80.2 4.3 46.8 24.1 48.0 64 64 A G - 0 0 12 -6,-0.2 -1,-0.2 1,-0.1 -8,-0.1 -0.152 43.3 -98.8 -66.6 161.7 46.2 25.3 51.5 65 65 A P - 0 0 15 0, 0.0 -1,-0.1 0, 0.0 -9,-0.1 -0.398 31.0 -98.3 -87.7 156.7 45.3 22.9 54.3 66 66 A C - 0 0 2 71,-0.2 2,-0.2 1,-0.1 -12,-0.1 -0.385 57.4 -88.5 -58.8 146.7 42.0 21.9 56.0 67 67 A E - 0 0 92 -13,-0.3 -14,-2.6 25,-0.1 2,-0.6 -0.461 40.7-154.2 -65.1 126.8 41.3 23.8 59.2 68 68 A F E -IJ 52 93B 0 25,-1.9 25,-2.4 -2,-0.2 2,-0.4 -0.932 10.1-162.0-108.4 115.4 42.9 21.9 62.2 69 69 A E E -IJ 51 92B 63 -18,-3.6 -18,-2.1 -2,-0.6 2,-0.5 -0.837 4.3-164.9-105.6 134.4 41.1 22.6 65.5 70 70 A V E -IJ 50 91B 0 21,-2.9 21,-1.6 -2,-0.4 2,-0.4 -0.970 7.0-179.7-123.2 118.7 42.6 21.9 68.9 71 71 A K E -I 49 0B 98 -22,-2.1 -22,-2.5 -2,-0.5 2,-0.4 -0.970 21.2-141.3-114.0 131.3 40.6 21.9 72.1 72 72 A D E -I 48 0B 36 -2,-0.4 2,-1.0 -24,-0.2 -24,-0.2 -0.748 18.7-136.1 -81.0 135.0 42.1 21.2 75.5 73 73 A L - 0 0 45 -26,-2.4 -27,-0.2 -2,-0.4 -25,-0.1 -0.513 59.0 -72.4 -98.5 67.8 39.7 19.1 77.6 74 74 A D S S- 0 0 162 -2,-1.0 2,-0.2 1,-0.2 -1,-0.1 0.920 79.5-178.5 45.1 55.5 39.8 20.9 81.0 75 75 A T - 0 0 16 -28,-0.2 -1,-0.2 1,-0.1 4,-0.1 -0.512 36.8-134.8 -88.1 148.0 43.3 19.5 81.5 76 76 A K S S+ 0 0 179 -2,-0.2 -1,-0.1 1,-0.2 -33,-0.1 0.928 108.0 27.3 -62.2 -45.4 45.5 20.0 84.6 77 77 A F S S- 0 0 94 -35,-0.2 -1,-0.2 1,-0.2 26,-0.1 0.497 105.2-142.7-102.4 -6.6 48.6 20.7 82.6 78 78 A G - 0 0 18 24,-0.1 25,-2.2 -31,-0.1 2,-0.3 -0.044 13.6 -84.2 77.4-177.2 47.0 22.1 79.4 79 79 A T E -CD 86 102A 1 7,-0.8 7,-2.3 23,-0.2 2,-0.4 -0.972 31.9-159.7-130.7 142.7 47.8 21.8 75.7 80 80 A K E -CD 85 101A 85 21,-3.2 21,-2.8 -2,-0.3 2,-0.4 -0.955 4.9-166.4-122.9 145.9 50.3 23.8 73.6 81 81 A V E > S-CD 84 100A 1 3,-2.6 3,-1.3 -2,-0.4 19,-0.2 -0.970 83.9 -9.3-131.6 120.2 50.4 24.3 69.8 82 82 A N T 3 S- 0 0 60 17,-3.1 -1,-0.1 -2,-0.4 18,-0.1 0.909 126.8 -63.7 54.2 44.0 53.6 25.8 68.4 83 83 A E T 3 S+ 0 0 167 16,-0.5 2,-0.4 1,-0.2 -1,-0.2 0.365 113.4 117.4 66.6 -3.5 54.7 26.5 72.0 84 84 A K E < S-C 81 0A 153 -3,-1.3 -3,-2.6 1,-0.0 2,-0.4 -0.769 75.0-106.0 -91.1 139.6 51.7 28.9 72.5 85 85 A V E -C 80 0A 97 -2,-0.4 2,-0.4 -5,-0.2 -5,-0.2 -0.487 29.2-154.8 -69.2 120.3 49.2 27.9 75.1 86 86 A V E +C 79 0A 3 -7,-2.3 -7,-0.8 -2,-0.4 2,-0.3 -0.768 42.5 112.6 -85.4 141.6 45.9 26.6 73.7 87 87 A G > + 0 0 19 -2,-0.4 3,-2.2 3,-0.2 -15,-0.1 -0.828 36.1 70.3-168.2-143.4 43.0 27.1 76.0 88 88 A Q T 3 S- 0 0 181 1,-0.3 3,-0.1 -2,-0.3 -16,-0.1 -0.306 123.2 -21.9 56.7-120.9 39.8 29.1 76.1 89 89 A N T 3 S- 0 0 153 1,-0.5 -1,-0.3 -2,-0.1 2,-0.1 -0.146 109.0 -95.2-112.8 34.4 37.5 27.7 73.5 90 90 A G < - 0 0 14 -3,-2.2 -1,-0.5 -21,-0.1 2,-0.3 -0.252 39.0 -98.2 86.0-173.2 40.3 26.1 71.5 91 91 A D E -J 70 0B 76 -21,-1.6 -21,-2.9 -3,-0.1 2,-0.4 -0.983 18.4-142.0-147.6 154.4 42.2 27.3 68.5 92 92 A S E -J 69 0B 51 -2,-0.3 2,-0.4 -23,-0.2 -23,-0.2 -0.962 16.6-154.3-124.2 134.1 42.1 26.8 64.7 93 93 A Y E +J 68 0B 25 -25,-2.4 -25,-1.9 -2,-0.4 5,-0.0 -0.914 25.2 172.9-122.5 137.2 45.1 26.5 62.4 94 94 A K + 0 0 125 -2,-0.4 2,-0.1 -27,-0.2 -1,-0.1 0.311 53.1 107.1-116.6 0.3 45.7 27.1 58.7 95 95 A E S S- 0 0 97 -27,-0.1 -27,-0.1 1,-0.1 -2,-0.1 -0.438 72.1-130.1 -78.1 158.0 49.5 26.6 58.7 96 96 A K S S+ 0 0 99 1,-0.1 17,-1.8 -2,-0.1 2,-0.4 0.439 92.1 62.4 -83.9 1.2 51.0 23.5 57.1 97 97 A D E + E 0 112A 115 15,-0.2 2,-0.5 2,-0.0 15,-0.2 -0.963 60.4 175.5-139.6 112.4 53.1 22.8 60.2 98 98 A L E - E 0 111A 0 13,-3.1 13,-2.8 -2,-0.4 2,-0.7 -0.966 14.7-166.7-127.1 121.0 51.8 22.1 63.7 99 99 A K E - E 0 110A 121 -2,-0.5 -17,-3.1 11,-0.2 2,-0.6 -0.889 16.8-168.3-102.2 105.4 53.7 21.2 66.8 100 100 A I E -DE 81 109A 1 9,-3.0 9,-3.4 -2,-0.7 2,-0.5 -0.842 5.2-171.4-100.5 117.4 51.3 19.9 69.5 101 101 A Q E -D 80 0A 47 -21,-2.8 -21,-3.2 -2,-0.6 2,-0.7 -0.933 8.9-155.6-108.2 123.9 52.4 19.4 73.1 102 102 A L E > -D 79 0A 5 -2,-0.5 3,-1.3 5,-0.4 -23,-0.2 -0.873 56.7 -52.2-101.6 110.2 50.1 17.7 75.5 103 103 A G T 3 S- 0 0 7 -25,-2.2 -60,-0.1 -2,-0.7 -23,-0.1 -0.312 109.9 -27.4 66.3-144.0 50.8 18.7 79.1 104 104 A K T 3 S+ 0 0 149 -62,-0.4 -1,-0.2 -25,-0.0 -61,-0.1 0.274 100.0 126.6 -88.0 9.3 54.4 18.4 80.5 105 105 A C < - 0 0 4 -3,-1.3 -3,-0.2 1,-0.1 -65,-0.0 -0.564 49.1-157.3 -74.3 122.5 55.2 15.6 78.0 106 106 A P S S+ 0 0 99 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.741 70.6 86.0 -77.6 -24.0 58.3 16.5 75.9 107 107 A F S S- 0 0 105 -5,-0.1 -5,-0.4 -101,-0.1 2,-0.2 -0.696 74.5-151.5 -80.8 121.6 57.5 14.2 72.9 108 108 A T - 0 0 29 -2,-0.6 2,-0.7 -7,-0.1 -101,-0.6 -0.585 14.8-121.3-104.5 150.9 55.4 16.3 70.7 109 109 A I E -BE 6 100A 1 -9,-3.4 -9,-3.0 -2,-0.2 2,-0.7 -0.840 30.4-154.8 -90.2 115.5 52.6 15.4 68.2 110 110 A N E -BE 5 99A 29 -105,-3.0 -105,-1.2 -2,-0.7 2,-0.4 -0.803 8.2-167.3-100.6 109.2 53.7 16.8 64.8 111 111 A A E +BE 4 98A 1 -13,-2.8 -13,-3.1 -2,-0.7 2,-0.3 -0.796 11.4 174.2 -93.4 132.3 51.0 17.6 62.3 112 112 A Y E -BE 3 97A 94 -109,-2.8 -109,-3.0 -2,-0.4 2,-0.7 -0.997 28.3-125.7-138.2 146.4 51.9 18.3 58.7 113 113 A W E -B 2 0A 18 -17,-1.8 2,-0.5 -2,-0.3 -111,-0.2 -0.791 17.3-161.2 -94.6 112.7 49.9 18.8 55.6 114 114 A R - 0 0 118 -113,-3.2 2,-0.1 -2,-0.7 -2,-0.0 -0.842 28.6-116.3 -91.2 126.1 50.7 16.6 52.6 115 115 A S + 0 0 68 -2,-0.5 2,-0.2 23,-0.0 -51,-0.1 -0.393 44.3 156.9 -64.5 129.2 49.4 18.1 49.3 116 116 A X + 0 0 9 21,-0.1 2,-0.4 -2,-0.1 32,-0.1 -0.708 2.6 161.3-154.2 107.9 46.7 16.3 47.4 117 117 A C - 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0 0 80 -2,-1.0 4,-1.2 1,-0.1 -2,-0.1 -0.211 49.9-101.1 -85.6-178.3 44.3 33.1 2.8 262 262 A K H > S+ 0 0 179 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.748 121.6 69.8 -71.6 -26.3 47.3 32.4 0.6 263 263 A E H > S+ 0 0 149 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.938 99.8 44.1 -48.8 -55.6 49.2 34.0 3.6 264 264 A L H >> S+ 0 0 26 1,-0.2 3,-1.4 2,-0.2 4,-0.6 0.924 110.5 51.5 -62.5 -52.7 48.5 30.9 5.8 265 265 A I H >< S+ 0 0 79 -4,-1.2 3,-1.0 1,-0.3 -1,-0.2 0.899 107.6 54.4 -50.2 -47.5 49.2 28.1 3.3 266 266 A S H 3< S+ 0 0 111 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.649 120.6 30.7 -65.4 -18.8 52.6 29.7 2.4 267 267 A K H << S+ 0 0 121 -3,-1.4 2,-0.4 -4,-0.6 -1,-0.2 0.203 105.3 83.0-127.1 13.6 53.7 29.7 6.1 268 268 A T << - 0 0 11 -3,-1.0 -37,-0.2 -4,-0.6 3,-0.1 -0.984 50.2-166.8-126.9 132.2 51.8 26.6 7.5 269 269 A D S S- 0 0 59 -39,-1.4 21,-0.6 -2,-0.4 2,-0.3 0.842 73.3 -13.4 -85.8 -39.6 52.9 23.0 7.3 270 270 A F E -op 231 290D 0 -40,-1.2 -38,-1.7 19,-0.1 2,-0.4 -0.945 64.3-122.7-154.0 175.3 49.7 21.3 8.3 271 271 A V E -op 232 291D 5 19,-2.5 21,-2.2 -2,-0.3 2,-0.5 -0.967 8.8-145.7-133.6 141.5 46.3 22.1 9.9 272 272 A V E -op 233 292D 2 -40,-3.4 -38,-1.5 -2,-0.4 2,-0.3 -0.926 22.6-168.4-110.6 126.6 44.4 20.8 12.9 273 273 A L E - p 0 293D 5 19,-2.1 21,-0.6 -2,-0.5 -38,-0.0 -0.810 23.3-110.8-117.2 151.8 40.6 20.5 12.7 274 274 A N > - 0 0 62 -2,-0.3 4,-1.5 19,-0.1 5,-0.1 -0.284 39.6-107.1 -64.4 162.8 37.7 19.9 15.1 275 275 A N H > S+ 0 0 104 1,-0.2 4,-0.9 2,-0.2 -1,-0.1 0.884 117.6 48.1 -61.4 -40.0 35.9 16.6 14.9 276 276 A A H >> S+ 0 0 76 1,-0.2 4,-1.4 2,-0.2 3,-0.5 0.926 113.1 43.7 -69.0 -50.2 32.8 18.3 13.3 277 277 A V H 3> S+ 0 0 14 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.760 108.2 62.0 -68.4 -26.6 34.6 20.3 10.6 278 278 A Y H 3< S+ 0 0 39 -4,-1.5 -1,-0.2 1,-0.1 -2,-0.2 0.804 108.5 39.2 -69.5 -32.3 36.9 17.4 9.7 279 279 A D H << S+ 0 0 112 -4,-0.9 3,-0.3 -3,-0.5 -2,-0.2 0.904 124.1 29.1 -90.3 -45.3 34.0 15.1 8.6 280 280 A S H >< S+ 0 0 68 -4,-1.4 2,-1.4 1,-0.2 3,-0.6 0.900 112.2 59.8 -85.8 -45.4 31.5 17.2 6.7 281 281 A E T 3< + 0 0 82 -4,-0.7 4,-0.3 -5,-0.4 -1,-0.2 -0.338 62.5 115.5 -85.9 54.8 33.7 20.0 5.2 282 282 A K T 3 S+ 0 0 112 -2,-1.4 -1,-0.2 -3,-0.3 -2,-0.1 0.478 75.2 60.2 -89.8 -7.9 36.0 17.8 3.2 283 283 A I S < S+ 0 0 167 -3,-0.6 -1,-0.1 1,-0.1 -2,-0.1 0.713 110.8 36.0 -87.2 -25.6 34.5 19.6 0.2 284 284 A S S S+ 0 0 76 -4,-0.1 -2,-0.1 2,-0.0 -1,-0.1 0.351 87.9 105.7-118.7 4.9 35.6 23.0 1.2 285 285 A F S S- 0 0 58 -4,-0.3 -27,-0.0 1,-0.1 6,-0.0 -0.604 81.0 -75.5 -90.0 154.3 39.1 22.6 2.8 286 286 A P - 0 0 27 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 0.002 33.3-135.4 -55.1 147.5 42.4 23.7 1.0 287 287 A E S S+ 0 0 195 1,-0.2 -2,-0.0 -3,-0.1 -3,-0.0 0.812 94.7 36.8 -74.4 -37.1 43.9 21.5 -1.7 288 288 A G S S+ 0 0 38 2,-0.1 2,-0.3 30,-0.0 -1,-0.2 0.682 95.8 89.7 -93.3 -20.2 47.6 21.4 -0.8 289 289 A I S S- 0 0 18 1,-0.1 2,-0.4 29,-0.0 -19,-0.1 -0.629 73.0-122.4 -94.4 139.0 47.6 21.2 3.0 290 290 A F E -p 270 0D 34 -21,-0.6 -19,-2.5 -2,-0.3 2,-0.4 -0.604 29.6-160.3 -76.7 126.6 47.5 18.1 5.1 291 291 A C E +p 271 0D 13 -2,-0.4 2,-0.3 -21,-0.2 -19,-0.2 -0.943 17.7 157.8-118.0 130.2 44.6 18.0 7.6 292 292 A L E -p 272 0D 3 -21,-2.2 -19,-2.1 -2,-0.4 2,-0.1 -0.965 34.7-115.7-142.2 160.1 44.2 16.0 10.8 293 293 A T E > -p 273 0D 11 -2,-0.3 4,-2.3 -21,-0.2 -19,-0.1 -0.460 35.4-110.0 -82.9 165.6 42.3 15.9 14.1 294 294 A I H > S+ 0 0 16 -21,-0.6 4,-2.7 2,-0.2 5,-0.2 0.902 120.9 57.4 -59.4 -43.1 44.0 16.2 17.5 295 295 A E H > S+ 0 0 63 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.898 109.9 42.7 -52.4 -47.7 43.1 12.5 18.0 296 296 A Q H > S+ 0 0 73 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.873 111.7 54.6 -69.1 -39.4 45.0 11.5 14.8 297 297 A L H X S+ 0 0 1 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.917 105.7 53.1 -60.0 -44.4 47.9 13.8 15.7 298 298 A W H X S+ 0 0 3 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.868 105.8 53.7 -57.0 -40.8 48.2 12.2 19.0 299 299 A K H X S+ 0 0 88 -4,-1.3 4,-0.9 2,-0.2 -1,-0.2 0.857 108.5 49.2 -64.6 -35.7 48.4 8.8 17.3 300 300 A I H >< S+ 0 0 36 -4,-1.8 3,-0.9 1,-0.2 6,-0.4 0.953 109.5 53.9 -59.8 -49.8 51.3 10.2 15.2 301 301 A I H 3< S+ 0 0 0 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.827 100.8 58.3 -54.8 -40.5 52.9 11.4 18.4 302 302 A I H 3< S+ 0 0 38 -4,-2.0 -85,-0.3 -5,-0.1 -1,-0.2 0.840 92.8 88.2 -60.4 -36.4 52.8 8.0 20.0 303 303 A E S X< S- 0 0 92 -4,-0.9 3,-0.6 -3,-0.9 6,-0.0 -0.159 81.6-129.6 -62.2 155.4 54.9 6.5 17.2 304 304 A R T 3 S+ 0 0 230 1,-0.2 3,-0.3 2,-0.1 -1,-0.1 0.822 107.2 59.5 -68.7 -31.3 58.7 6.5 17.2 305 305 A N T >> + 0 0 69 1,-0.2 4,-1.6 2,-0.1 3,-1.5 0.494 65.4 137.1 -73.6 -11.8 58.6 8.1 13.6 306 306 A S H <> S+ 0 0 7 -3,-0.6 4,-1.9 -6,-0.4 5,-0.2 0.475 75.8 32.1 -16.9 -62.7 56.6 11.3 14.5 307 307 A R H 3> S+ 0 0 108 -3,-0.3 4,-2.9 1,-0.2 -1,-0.3 0.906 121.5 49.1 -68.4 -44.9 58.6 13.9 12.5 308 308 A E H <> S+ 0 0 133 -3,-1.5 4,-1.8 1,-0.2 -1,-0.2 0.793 111.8 53.7 -60.9 -29.1 59.5 11.5 9.6 309 309 A L H < S+ 0 0 55 -4,-1.6 4,-0.3 2,-0.2 -2,-0.2 0.888 114.2 36.9 -76.4 -44.7 55.8 10.5 9.6 310 310 A I H >X S+ 0 0 2 -4,-1.9 4,-1.5 -5,-0.2 3,-0.6 0.868 114.7 57.5 -74.2 -40.2 54.4 14.1 9.3 311 311 A S H >X S+ 0 0 40 -4,-2.9 4,-1.9 1,-0.2 3,-1.5 0.979 108.1 44.3 -52.9 -62.4 57.3 15.2 7.0 312 312 A K H 3< S+ 0 0 143 -4,-1.8 4,-0.3 1,-0.3 -1,-0.2 0.588 110.5 57.6 -62.9 -12.1 56.6 12.5 4.3 313 313 A E H <> S+ 0 0 40 -3,-0.6 4,-1.3 -4,-0.3 -1,-0.3 0.711 105.3 48.5 -89.0 -25.6 52.9 13.2 4.6 314 314 A I H << S+ 0 0 34 -3,-1.5 -2,-0.2 -4,-1.5 5,-0.2 0.853 112.4 50.4 -72.1 -38.2 53.4 16.9 3.7 315 315 A E T X S+ 0 0 116 -4,-1.9 4,-1.3 1,-0.2 -2,-0.2 0.667 108.3 52.9 -73.7 -20.7 55.6 15.6 0.8 316 316 A R T 4 S+ 0 0 169 -4,-0.3 -1,-0.2 -5,-0.2 -2,-0.2 0.882 111.9 43.5 -78.7 -42.1 52.7 13.3 -0.3 317 317 A L T < S+ 0 0 64 -4,-1.3 -2,-0.2 1,-0.2 -1,-0.2 0.264 123.4 38.2 -89.0 11.4 50.1 16.1 -0.4 318 318 A K T 4 0 0 152 -3,-0.1 -2,-0.2 -4,-0.1 -3,-0.2 0.550 360.0 360.0-125.1 -31.0 52.6 18.4 -2.2 319 319 A Y < 0 0 251 -4,-1.3 -4,-0.1 -5,-0.2 -3,-0.1 0.251 360.0 360.0 69.5 360.0 54.3 15.9 -4.5