==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL CYCLE 29-MAY-07 2Q2Z . COMPND 2 MOLECULE: KINESIN-LIKE PROTEIN KIF11; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Y.YAN . 660 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32671.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 472 71.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 50 7.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 98 14.8 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 . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.5 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 . 66 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 68 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 153 23.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 2.4 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 5 0 0 0 0 0 0 1 3 2 0 1 1 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 0 1 4 1 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 3 3 2 1 0 1 1 0 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 3 1 0 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 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 18 A N 0 0 108 0, 0.0 2,-0.3 0, 0.0 328,-0.2 0.000 360.0 360.0 360.0 -58.5 36.5 -8.7 101.8 2 19 A I - 0 0 3 326,-2.2 2,-0.5 324,-0.3 298,-0.2 -0.444 360.0-143.6 -63.9 123.1 33.6 -6.2 101.1 3 20 A Q E -a 300 0A 71 296,-1.2 298,-2.1 -2,-0.3 2,-0.5 -0.773 15.4-167.3 -94.9 128.4 30.7 -6.8 103.4 4 21 A V E -a 301 0A 0 -2,-0.5 48,-2.4 296,-0.2 49,-0.6 -0.969 4.0-173.1-117.8 130.2 27.2 -6.4 102.1 5 22 A V E -ab 302 53A 10 296,-3.3 298,-3.6 -2,-0.5 2,-0.5 -0.778 15.5-142.6-113.8 155.3 24.0 -6.3 104.2 6 23 A V E -ab 303 54A 0 47,-1.7 49,-1.8 -2,-0.3 2,-0.5 -0.974 13.7-165.9-118.0 120.7 20.4 -6.2 102.9 7 24 A R E -ab 304 55A 19 296,-3.6 298,-1.2 -2,-0.5 2,-0.5 -0.949 7.4-155.1-108.7 132.3 18.0 -4.0 104.9 8 25 A C E -a 305 0A 11 47,-1.8 51,-0.3 -2,-0.5 298,-0.1 -0.916 4.6-148.1-110.7 131.5 14.3 -4.6 104.2 9 26 A R - 0 0 53 296,-1.7 2,-0.3 -2,-0.5 48,-0.2 -0.227 18.0-118.0 -87.2 175.7 11.8 -1.9 104.9 10 27 A P - 0 0 56 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.792 37.7 -70.5-115.4 169.7 8.2 -2.5 105.9 11 28 A F - 0 0 39 -2,-0.3 2,-0.2 4,-0.1 11,-0.0 -0.239 42.3-136.9 -57.8 127.7 4.8 -1.7 104.4 12 29 A N >> - 0 0 67 1,-0.1 4,-1.6 -2,-0.1 3,-1.6 -0.521 35.9 -99.8 -79.9 152.8 3.6 1.9 104.3 13 30 A L H 3> S+ 0 0 136 1,-0.3 4,-0.7 2,-0.2 -1,-0.1 0.382 123.2 68.0 -56.4 11.2 -0.0 2.5 105.3 14 31 A A H 3> S+ 0 0 59 2,-0.1 4,-1.2 3,-0.1 -1,-0.3 0.830 109.3 30.0 -93.9 -46.7 -0.6 2.6 101.5 15 32 A E H <4>S+ 0 0 26 -3,-1.6 5,-1.7 2,-0.2 -2,-0.2 0.489 119.1 62.1 -88.2 -6.7 0.1 -1.1 101.0 16 33 A R H ><5S+ 0 0 141 -4,-1.6 3,-1.4 3,-0.2 -3,-0.2 0.966 109.5 35.0 -79.8 -62.1 -1.2 -1.7 104.5 17 34 A K H 3<5S+ 0 0 166 -4,-0.7 -2,-0.2 1,-0.3 -3,-0.1 0.867 111.2 62.7 -56.8 -43.4 -4.8 -0.4 103.9 18 35 A A T 3<5S- 0 0 65 -4,-1.2 -1,-0.3 1,-0.1 -2,-0.1 0.180 107.8-130.3 -70.9 18.9 -4.8 -1.7 100.3 19 36 A S T < 5 + 0 0 103 -3,-1.4 -3,-0.2 1,-0.1 -2,-0.1 0.746 48.6 168.7 31.3 44.8 -4.4 -5.1 102.0 20 37 A A < - 0 0 50 -5,-1.7 2,-0.3 -6,-0.1 -1,-0.1 -0.156 27.9-120.5 -78.5 175.2 -1.4 -5.9 99.7 21 38 A H - 0 0 104 286,-0.1 288,-0.4 1,-0.0 2,-0.1 -0.919 10.9-132.2-122.7 147.4 1.1 -8.7 99.9 22 39 A S - 0 0 33 -2,-0.3 286,-0.1 286,-0.1 287,-0.1 -0.250 9.1-169.1 -84.1 175.3 4.9 -8.9 100.2 23 40 A I + 0 0 5 284,-0.1 13,-2.2 285,-0.1 2,-0.4 0.005 64.6 89.9-152.6 15.9 7.1 -11.1 98.0 24 41 A V E -J 35 0B 11 11,-0.2 2,-0.5 283,-0.0 11,-0.2 -0.982 52.9-169.6-122.1 135.1 10.2 -10.6 100.0 25 42 A E E -J 34 0B 111 9,-1.4 9,-1.3 -2,-0.4 2,-1.1 -0.875 5.4-167.2-127.7 98.9 11.2 -12.8 102.9 26 43 A C E -J 33 0B 27 -2,-0.5 7,-0.2 7,-0.2 31,-0.1 -0.696 6.0-173.7 -89.5 94.4 14.1 -11.4 104.9 27 44 A D E >> -J 32 0B 50 5,-2.2 5,-1.6 -2,-1.1 4,-1.2 -0.730 11.9-170.1 -97.7 106.4 15.5 -14.1 107.3 28 45 A P T 45S+ 0 0 68 0, 0.0 26,-0.2 0, 0.0 -1,-0.1 0.650 84.4 53.3 -56.4 -29.6 18.2 -12.9 109.8 29 46 A V T 45S+ 0 0 122 1,-0.2 -2,-0.0 3,-0.1 0, 0.0 0.950 117.1 32.7 -80.0 -50.8 19.2 -16.4 110.9 30 47 A R T 45S- 0 0 145 -3,-0.1 -1,-0.2 2,-0.1 3,-0.1 0.581 109.1-131.7 -76.7 -12.9 19.8 -18.1 107.6 31 48 A K T <5 + 0 0 94 -4,-1.2 20,-1.3 1,-0.2 2,-0.3 0.964 62.6 106.3 60.9 58.4 21.1 -14.6 106.5 32 49 A E E < -JK 27 50B 22 -5,-1.6 -5,-2.2 18,-0.2 2,-0.4 -0.995 59.7-132.6-160.6 164.6 19.2 -14.4 103.3 33 50 A V E -JK 26 49B 0 16,-2.1 16,-3.2 -2,-0.3 2,-0.5 -0.978 15.7-161.3-128.6 134.3 16.4 -13.0 101.3 34 51 A S E -JK 25 48B 20 -9,-1.3 -9,-1.4 -2,-0.4 2,-0.4 -0.985 8.2-157.1-119.2 121.9 14.0 -15.0 99.1 35 52 A V E -JK 24 47B 0 12,-3.9 12,-2.8 -2,-0.5 2,-0.8 -0.807 15.3-133.4-102.3 140.8 11.9 -13.3 96.4 36 53 A R E + K 0 46B 43 -13,-2.2 10,-0.2 -2,-0.4 4,-0.1 -0.825 31.2 168.9 -91.9 107.1 8.6 -14.5 94.9 37 54 A T + 0 0 49 8,-1.9 9,-0.2 -2,-0.8 -1,-0.2 0.748 69.1 31.3 -92.3 -29.0 9.1 -14.2 91.2 38 55 A G S S- 0 0 57 7,-1.6 2,-0.2 1,-0.2 8,-0.1 0.925 103.5 -97.9 -96.5 -59.0 6.1 -16.1 89.8 39 56 A G + 0 0 32 1,-0.2 6,-0.2 6,-0.2 -1,-0.2 -0.659 65.8 81.6 147.5 159.3 3.0 -16.0 92.1 40 57 A L - 0 0 107 -2,-0.2 -1,-0.2 4,-0.1 -2,-0.1 0.760 50.0-136.8 87.0 116.3 1.1 -17.8 94.8 41 58 A A S S+ 0 0 92 2,-0.1 3,-0.1 -5,-0.0 -1,-0.1 0.397 113.8 46.9 -75.5 2.8 1.7 -18.0 98.6 42 59 A D S S+ 0 0 152 1,-0.2 2,-0.8 0, 0.0 -2,-0.1 0.650 125.7 11.9-101.4 -92.3 0.8 -21.6 97.8 43 60 A K S S+ 0 0 160 -5,-0.0 2,-0.3 2,-0.0 -1,-0.2 -0.774 84.3 156.8 -97.7 104.7 2.8 -22.8 94.7 44 61 A S - 0 0 50 -2,-0.8 2,-0.6 -3,-0.1 -4,-0.1 -0.922 44.0-134.8-134.3 156.7 5.6 -20.4 93.7 45 62 A S - 0 0 75 -2,-0.3 -8,-1.9 -6,-0.2 -7,-1.6 -0.914 40.8-174.2-101.0 118.5 8.9 -20.0 91.8 46 63 A R E -K 36 0B 78 -2,-0.6 2,-0.4 -10,-0.2 -10,-0.2 -0.623 24.4-137.9-115.7 174.4 11.3 -18.0 94.0 47 64 A K E -K 35 0B 98 -12,-2.8 -12,-3.9 -2,-0.2 2,-0.4 -0.993 21.4-164.0-133.8 121.2 14.7 -16.3 93.9 48 65 A T E -K 34 0B 73 -2,-0.4 2,-0.3 -14,-0.3 -14,-0.2 -0.925 8.5-179.8-119.1 133.5 17.1 -16.6 96.9 49 66 A Y E -K 33 0B 15 -16,-3.2 -16,-2.1 -2,-0.4 2,-0.4 -0.879 12.6-151.2-125.8 152.0 20.3 -14.6 97.9 50 67 A T E +K 32 0B 60 -2,-0.3 -18,-0.2 -18,-0.2 2,-0.2 -0.974 20.9 165.5-124.1 143.0 22.7 -14.8 100.8 51 68 A F - 0 0 5 -20,-1.3 -46,-0.2 -2,-0.4 3,-0.1 -0.613 52.0 -84.5-137.8-167.8 24.7 -11.9 102.2 52 69 A D S S- 0 0 60 -48,-2.4 2,-0.3 1,-0.3 -47,-0.2 0.594 105.1 -3.5 -85.3 -11.7 26.7 -11.0 105.3 53 70 A M E -b 5 0A 47 -49,-0.6 -47,-1.7 -22,-0.1 2,-0.4 -0.914 60.2-155.2-177.4 144.8 23.7 -9.9 107.4 54 71 A V E -b 6 0A 6 -2,-0.3 2,-0.4 -26,-0.2 -47,-0.2 -1.000 3.4-169.3-137.7 136.6 20.0 -9.4 107.0 55 72 A F E -b 7 0A 19 -49,-1.8 -47,-1.8 -2,-0.4 -28,-0.1 -0.979 14.0-148.8-127.5 131.5 17.6 -7.1 108.9 56 73 A G > - 0 0 12 -2,-0.4 3,-0.9 -49,-0.2 -48,-0.2 -0.097 38.7 -91.4 -84.3-171.9 13.8 -7.5 108.5 57 74 A A T 3 S+ 0 0 39 1,-0.2 -1,-0.0 -48,-0.2 -48,-0.0 0.834 121.6 72.1 -74.6 -31.1 11.3 -4.7 108.7 58 75 A S T 3 S+ 0 0 112 -49,-0.1 -1,-0.2 2,-0.0 2,-0.1 0.456 80.5 108.8 -61.8 -0.2 11.0 -5.4 112.5 59 76 A T < - 0 0 14 -3,-0.9 2,-0.3 -51,-0.3 -4,-0.0 -0.441 58.1-149.3 -83.0 153.8 14.4 -3.9 112.8 60 77 A K >> - 0 0 133 -2,-0.1 3,-2.6 1,-0.1 4,-1.5 -0.931 30.5-103.6-124.7 152.9 15.1 -0.6 114.4 61 78 A Q H 3> S+ 0 0 7 53,-0.5 4,-1.2 -2,-0.3 54,-0.1 0.787 121.9 55.5 -36.2 -46.1 17.7 2.1 113.8 62 79 A I H 3> S+ 0 0 68 52,-0.3 4,-1.7 1,-0.2 -1,-0.3 0.799 103.5 54.2 -62.2 -35.1 19.5 1.0 117.0 63 80 A D H <> S+ 0 0 67 -3,-2.6 4,-1.2 1,-0.2 -1,-0.2 0.894 106.3 50.7 -70.9 -35.6 19.8 -2.6 115.6 64 81 A V H X>S+ 0 0 5 -4,-1.5 4,-1.9 3,-0.2 5,-0.9 0.819 111.2 53.9 -69.2 -26.3 21.4 -1.4 112.5 65 82 A Y H X>S+ 0 0 11 -4,-1.2 5,-2.5 -5,-0.3 4,-1.1 0.969 108.1 38.9 -75.4 -61.0 23.9 0.5 114.6 66 83 A R H <5S+ 0 0 169 -4,-1.7 -1,-0.2 3,-0.2 -2,-0.1 0.821 122.9 48.7 -61.1 -30.1 25.5 -1.8 117.1 67 84 A S H <5S+ 0 0 55 -4,-1.2 -2,-0.2 -5,-0.3 -1,-0.2 0.892 130.7 6.7 -79.1 -45.2 25.5 -4.4 114.4 68 85 A V H X5S+ 0 0 14 -4,-1.9 4,-0.7 -5,-0.2 -3,-0.2 0.741 130.9 43.9-113.1 -27.3 27.0 -2.7 111.4 69 86 A V H X> S+ 0 0 50 0, 0.0 4,-3.1 0, 0.0 5,-0.3 0.980 110.9 52.1 -49.8 -69.8 32.9 -2.0 114.5 72 89 A I H 3X S+ 0 0 3 -4,-0.7 4,-1.7 1,-0.2 -2,-0.2 0.721 111.1 51.1 -44.7 -21.7 33.5 0.4 111.7 73 90 A L H <>S+ 0 0 36 -4,-3.1 3,-3.3 1,-0.2 5,-1.3 0.983 109.1 52.2 -62.0 -54.4 38.2 0.6 113.5 76 93 A V H ><5S+ 0 0 0 -4,-1.7 3,-1.0 -5,-0.3 -1,-0.2 0.800 105.0 59.0 -54.1 -24.6 37.9 4.2 112.3 77 94 A I T 3<5S+ 0 0 15 -4,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.399 93.8 64.0 -85.3 2.7 39.2 5.2 115.8 78 95 A M T < 5S- 0 0 103 -3,-3.3 -1,-0.2 -5,-0.2 -2,-0.2 0.288 130.0 -93.9-102.2 4.5 42.4 3.2 115.4 79 96 A G T < 5S+ 0 0 22 -3,-1.0 -3,-0.2 -4,-0.3 164,-0.2 0.286 86.4 135.3 100.4 -8.2 43.2 5.5 112.5 80 97 A Y < - 0 0 105 -5,-1.3 163,-0.9 -6,-0.2 2,-0.4 0.057 52.7-121.8 -60.1 176.4 41.7 3.2 109.9 81 98 A N E -c 243 0A 71 215,-0.2 217,-1.9 161,-0.2 2,-0.4 -0.978 29.0-174.3-124.4 139.4 39.5 4.5 107.1 82 99 A C E -cd 244 298A 0 161,-3.3 163,-3.6 -2,-0.4 2,-0.4 -0.990 11.5-163.2-141.3 150.1 36.0 3.3 106.5 83 100 A T E -cd 245 299A 0 215,-2.8 217,-2.0 -2,-0.4 2,-0.5 -0.979 0.7-166.9-128.3 135.5 33.2 3.7 104.0 84 101 A I E -cd 246 300A 1 161,-4.4 163,-2.7 -2,-0.4 2,-0.2 -0.892 7.6-169.2-124.0 112.0 29.5 2.9 104.1 85 102 A F E -cd 247 301A 4 215,-2.2 217,-1.7 -2,-0.5 2,-0.4 -0.587 8.8-158.0 -87.1 150.9 27.3 2.9 101.0 86 103 A A E -cd 248 302A 0 161,-1.8 163,-1.1 -2,-0.2 2,-0.4 -0.987 23.5-175.8-122.5 134.0 23.5 2.7 101.0 87 104 A Y E + d 0 303A 12 215,-2.3 217,-2.5 -2,-0.4 2,-0.3 -0.973 18.8 74.3-138.3 136.5 22.2 1.4 97.7 88 105 A G E - d 0 304A 0 162,-0.5 164,-2.6 -2,-0.4 165,-0.2 -0.919 68.4 -38.2 157.2 173.0 18.8 0.8 96.1 89 106 A Q S > S- 0 0 33 215,-0.6 3,-0.8 -2,-0.3 5,-0.4 0.062 71.3 -88.6 -48.6 170.2 15.7 1.9 94.4 90 107 A T T 3 S+ 0 0 50 1,-0.2 -1,-0.1 2,-0.1 126,-0.0 -0.666 110.4 29.2 -86.2 141.9 14.1 5.1 95.5 91 108 A G T 3 S+ 0 0 50 -2,-0.3 -1,-0.2 -3,-0.1 -2,-0.1 0.530 89.1 105.2 87.3 8.6 11.6 4.9 98.3 92 109 A T S < S- 0 0 3 -3,-0.8 213,-0.3 212,-0.1 -83,-0.2 0.558 97.1 -92.7-101.1 -7.8 13.2 1.9 99.9 93 110 A G S > S+ 0 0 19 211,-0.1 4,-2.7 -4,-0.1 5,-0.3 0.505 77.8 134.8 112.3 6.8 14.9 3.5 102.9 94 111 A K H > S+ 0 0 15 -5,-0.4 4,-1.7 1,-0.2 5,-0.1 0.899 87.7 37.4 -51.6 -41.0 18.5 4.3 101.8 95 112 A T H >>S+ 0 0 70 2,-0.2 4,-3.2 3,-0.2 5,-1.4 0.879 110.7 57.5 -76.1 -45.5 18.0 7.7 103.4 96 113 A F H 45S+ 0 0 51 3,-0.2 -2,-0.2 1,-0.2 -1,-0.1 0.936 112.4 45.0 -50.6 -48.3 16.0 6.6 106.5 97 114 A T H <5S+ 0 0 3 -4,-2.7 21,-1.8 1,-0.2 -1,-0.2 0.945 117.5 41.1 -61.6 -55.3 18.9 4.3 107.3 98 115 A M H <5S+ 0 0 2 -4,-1.7 21,-2.4 -5,-0.3 -2,-0.2 0.922 138.5 8.6 -64.9 -46.4 21.7 6.8 106.6 99 116 A E T <5S- 0 0 58 -4,-3.2 18,-1.8 19,-0.2 -3,-0.2 0.801 89.2-158.1-100.2 -45.9 20.2 9.9 108.2 100 117 A G B < -L 116 0C 14 -5,-1.4 16,-0.3 16,-0.3 2,-0.2 -0.476 18.9-101.7 91.0-169.0 17.0 8.6 110.0 101 118 A E - 0 0 115 14,-0.7 2,-0.5 -2,-0.2 14,-0.1 -0.630 30.8 -87.7-134.5-165.8 14.1 10.9 110.8 102 119 A R - 0 0 93 -2,-0.2 8,-0.1 13,-0.1 -2,-0.0 -0.952 33.8-118.5-115.5 131.8 12.7 12.7 113.8 103 120 A S > - 0 0 16 -2,-0.5 5,-0.5 6,-0.2 3,-0.4 -0.667 48.3-116.9 -71.8 114.8 10.2 11.2 116.2 104 121 A P T > 5S+ 0 0 89 0, 0.0 3,-2.0 0, 0.0 4,-0.1 0.389 86.2 32.2 -45.0 163.3 7.0 13.6 115.8 105 122 A N T 3 5S- 0 0 164 1,-0.3 -2,-0.1 2,-0.1 0, 0.0 0.519 122.9 -80.3 59.0 -1.3 5.1 15.9 118.2 106 123 A E T 3 5S+ 0 0 176 -3,-0.4 -1,-0.3 3,-0.0 -3,-0.1 0.684 80.5 154.1 81.3 24.5 8.5 16.5 119.8 107 124 A E T < 5 + 0 0 144 -3,-2.0 2,-0.2 -4,-0.1 -2,-0.1 0.903 63.4 12.6 -47.4 -60.0 8.6 13.4 121.9 108 125 A Y S - 0 0 69 -2,-0.2 3,-1.0 -7,-0.0 4,-0.5 -0.402 42.7 -91.3-107.8-175.8 15.5 15.0 121.5 110 127 A W T 3 S+ 0 0 38 1,-0.2 3,-0.1 2,-0.2 6,-0.0 0.692 122.1 55.9 -76.6 -15.0 18.2 14.4 118.9 111 128 A E T 3 S+ 0 0 64 1,-0.2 -1,-0.2 13,-0.0 0, 0.0 0.286 117.9 30.2 -99.7 12.6 20.3 12.2 121.2 112 129 A E S < S+ 0 0 134 -3,-1.0 -2,-0.2 0, 0.0 -1,-0.2 0.211 76.1 131.6-148.4 11.7 17.5 9.7 122.0 113 130 A D > - 0 0 2 -4,-0.5 3,-1.7 1,-0.2 -12,-0.1 -0.621 46.2-153.7 -78.0 108.3 15.3 9.5 119.0 114 131 A P T 3 S+ 0 0 55 0, 0.0 -53,-0.5 0, 0.0 -52,-0.3 0.521 95.1 60.7 -52.9 -8.2 14.9 5.8 118.2 115 132 A L T 3 S+ 0 0 45 -14,-0.1 -14,-0.7 -54,-0.1 -13,-0.1 0.737 75.0 108.4 -93.2 -29.3 14.3 7.1 114.6 116 133 A A B < -L 100 0C 10 -3,-1.7 -16,-0.3 -16,-0.3 2,-0.1 -0.289 57.1-154.6 -54.1 126.8 17.7 8.7 114.1 117 134 A G > - 0 0 2 -18,-1.8 4,-1.5 -21,-0.1 5,-0.2 -0.142 37.5 -54.8 -92.3-168.0 19.8 6.7 111.6 118 135 A I H > S+ 0 0 4 -21,-1.8 4,-2.4 1,-0.2 5,-0.2 0.796 121.4 51.4 -33.6 -84.2 23.6 6.4 111.2 119 136 A I H > S+ 0 0 13 -21,-2.4 4,-1.6 2,-0.2 -1,-0.2 0.783 116.5 44.5 -33.2 -41.8 25.2 9.8 110.7 120 137 A P H > S+ 0 0 17 0, 0.0 4,-2.0 0, 0.0 3,-0.4 0.996 113.5 45.0 -70.8 -65.1 23.4 11.2 113.8 121 138 A R H X S+ 0 0 43 -4,-1.5 4,-0.6 1,-0.2 -2,-0.2 0.746 112.1 59.2 -44.6 -34.5 24.0 8.4 116.3 122 139 A T H >X S+ 0 0 0 -4,-2.4 4,-2.6 -5,-0.2 3,-0.8 0.946 104.3 44.0 -68.1 -53.6 27.5 8.3 115.0 123 140 A L H 3X S+ 0 0 10 -4,-1.6 4,-1.7 -3,-0.4 5,-0.3 0.961 112.4 53.5 -58.4 -47.6 28.5 11.8 115.9 124 141 A H H 3X S+ 0 0 26 -4,-2.0 4,-1.2 1,-0.3 -1,-0.3 0.706 114.2 45.7 -58.2 -20.1 26.8 11.5 119.3 125 142 A Q H << S+ 0 0 51 -3,-0.8 -1,-0.3 -4,-0.6 5,-0.2 0.785 100.9 61.3 -92.4 -39.3 29.0 8.4 119.7 126 143 A I H >X S+ 0 0 2 -4,-2.6 4,-1.9 -3,-0.3 3,-0.8 0.951 116.5 35.8 -54.8 -47.6 32.4 9.6 118.6 127 144 A F H 3X>S+ 0 0 10 -4,-1.7 4,-2.3 1,-0.2 5,-0.6 0.989 109.6 62.2 -66.1 -60.8 32.2 12.2 121.4 128 145 A E H 3<5S+ 0 0 91 -4,-1.2 -1,-0.2 -5,-0.3 -2,-0.2 0.435 115.5 35.9 -47.8 4.5 30.5 9.8 123.8 129 146 A K H <>5S+ 0 0 49 -3,-0.8 4,-1.6 -4,-0.2 -2,-0.2 0.661 120.4 36.1-122.9 -63.7 33.6 7.6 123.5 130 147 A L H <>S+ 0 0 13 -4,-1.9 5,-0.7 -5,-0.2 -3,-0.2 0.861 116.2 57.3 -63.7 -35.5 36.8 9.6 123.2 131 148 A T T <5S+ 0 0 93 -4,-2.3 4,-0.4 -5,-0.4 -1,-0.2 0.981 104.2 53.2 -56.2 -57.6 35.5 12.3 125.5 132 149 A D T 4 S- 0 0 104 1,-0.0 3,-1.3 4,-0.0 -3,-0.3 -0.780 88.9-123.7 -94.1 117.4 49.3 11.1 96.4 174 191 A K T 3 S+ 0 0 165 -2,-0.6 3,-0.1 1,-0.2 -1,-0.0 -0.135 95.2 31.8 -49.3 154.1 48.3 9.5 93.1 175 192 A R T 3 S+ 0 0 101 1,-0.3 115,-0.3 -5,-0.1 -1,-0.2 0.472 99.2 111.9 72.3 3.8 44.7 8.4 92.8 176 193 A G < - 0 0 14 -3,-1.3 -6,-2.0 -6,-0.5 2,-0.4 -0.601 54.6-144.1-104.5 167.3 43.6 11.2 95.1 177 194 A V E -M 169 0D 31 -8,-0.3 2,-0.5 -2,-0.2 -8,-0.3 -0.976 6.0-138.4-133.9 150.4 41.5 14.3 94.3 178 195 A I E -M 168 0D 55 -10,-4.7 -10,-1.7 -2,-0.4 2,-1.0 -0.912 11.4-154.0-109.9 124.6 41.5 17.9 95.4 179 196 A I E > -M 167 0D 34 -2,-0.5 3,-2.1 -12,-0.2 -12,-0.2 -0.671 18.0-140.4-100.5 81.6 38.1 19.5 96.1 180 197 A K E 3 S-M 166 0D 118 -14,-1.8 -14,-0.8 -2,-1.0 -2,-0.0 -0.102 82.1 -0.7 -47.2 113.4 38.5 23.2 95.5 181 198 A G T 3 S+ 0 0 52 1,-0.3 2,-0.4 -16,-0.1 -1,-0.3 0.736 84.5 158.8 79.2 24.6 36.6 25.1 98.1 182 199 A L < - 0 0 34 -3,-2.1 2,-0.4 -16,-0.1 -1,-0.3 -0.670 36.9-130.2 -78.0 135.0 35.1 22.1 100.0 183 200 A E - 0 0 79 -2,-0.4 2,-0.6 -40,-0.1 -40,-0.4 -0.697 18.4-167.4 -89.3 133.8 34.1 23.1 103.5 184 201 A E - 0 0 119 -2,-0.4 -42,-0.2 -42,-0.1 2,-0.1 -0.912 14.1-152.7-121.1 102.4 35.1 21.0 106.5 185 202 A I E -F 141 0A 39 -44,-2.0 -44,-1.7 -2,-0.6 2,-0.6 -0.352 9.3-134.2 -70.9 151.2 33.2 22.0 109.6 186 203 A T E -F 140 0A 50 -46,-0.2 2,-1.3 -2,-0.1 -46,-0.3 -0.910 9.6-155.8-113.6 110.0 34.8 21.5 113.0 187 204 A V + 0 0 8 -48,-1.4 -48,-0.3 -2,-0.6 3,-0.1 -0.632 16.7 173.7 -91.0 91.9 32.6 19.9 115.7 188 205 A H + 0 0 138 -2,-1.3 2,-0.3 1,-0.2 -1,-0.2 0.827 66.6 16.0 -61.6 -38.9 34.0 21.0 119.1 189 206 A N S >> S- 0 0 74 1,-0.0 3,-2.8 0, 0.0 4,-0.5 -0.996 76.7-110.9-145.9 142.0 31.2 19.5 121.3 190 207 A K T 34 S+ 0 0 49 -2,-0.3 4,-0.3 1,-0.3 -66,-0.0 0.511 113.6 68.3 -42.0 -8.8 28.4 17.0 121.0 191 208 A D T 34 S+ 0 0 108 1,-0.1 -1,-0.3 2,-0.1 4,-0.2 0.284 91.0 58.9-102.2 13.5 26.0 19.9 121.3 192 209 A E T <> S+ 0 0 33 -3,-2.8 4,-1.8 2,-0.1 3,-0.5 0.654 83.5 84.4-105.6 -27.5 27.0 21.4 117.9 193 210 A V H >X S+ 0 0 0 -4,-0.5 4,-1.3 1,-0.2 3,-0.6 0.904 85.5 52.4 -36.9 -71.3 26.0 18.3 115.9 194 211 A Y H 3> S+ 0 0 74 -4,-0.3 4,-2.6 1,-0.3 -1,-0.2 0.733 108.2 45.6 -44.9 -46.9 22.3 19.1 115.6 195 212 A Q H 3> S+ 0 0 94 -3,-0.5 4,-2.3 1,-0.2 -1,-0.3 0.924 106.5 62.0 -67.8 -37.3 22.5 22.6 114.1 196 213 A I H X S+ 0 0 104 -4,-2.3 3,-1.8 2,-0.2 4,-1.3 1.000 107.4 39.3 -64.6 -68.4 21.9 23.5 108.3 200 217 A G H 3X S+ 0 0 3 -4,-1.4 4,-3.5 1,-0.3 5,-0.3 0.784 105.0 68.5 -53.0 -35.0 22.3 21.1 105.3 201 218 A A H 3X S+ 0 0 57 -4,-2.5 4,-1.7 2,-0.2 -1,-0.3 0.917 107.8 41.3 -52.9 -38.7 18.6 20.2 105.7 202 219 A A H X S+ 0 0 50 -4,-3.5 3,-2.2 -5,-0.2 4,-2.1 0.999 103.3 53.7 -57.6 -66.1 19.6 20.6 100.5 205 222 A T H 3X S+ 0 0 87 -4,-1.7 4,-1.7 1,-0.3 -2,-0.2 0.738 105.3 51.6 -34.6 -45.2 16.1 22.0 100.0 206 223 A T H 3X S+ 0 0 74 -4,-1.3 4,-1.5 2,-0.2 -1,-0.3 0.853 110.8 50.6 -69.6 -29.2 17.3 24.9 97.9 207 224 A A H < S- 0 0 23 -4,-2.3 3,-1.0 -5,-0.1 2,-0.2 -0.903 92.3 -89.4-125.9 152.8 17.5 21.0 90.0 212 229 A N T 3 S- 0 0 110 -2,-0.3 5,-0.1 1,-0.3 -3,-0.1 -0.393 95.7 -12.5 -72.8 134.5 15.0 18.2 89.2 213 230 A A T 3> S+ 0 0 45 -5,-0.2 4,-2.4 -2,-0.2 -1,-0.3 0.832 80.8 168.2 46.5 40.6 14.3 15.2 91.3 214 231 A Y H <> + 0 0 6 -3,-1.0 4,-1.6 -6,-0.4 -2,-0.1 0.870 65.3 51.3 -44.0 -58.6 17.4 16.1 93.1 215 232 A S H 4 S+ 0 0 94 1,-0.2 3,-0.5 2,-0.2 -1,-0.2 0.914 115.5 40.9 -48.0 -57.3 16.9 13.7 96.1 216 233 A S H 4 S+ 0 0 37 1,-0.2 35,-3.0 34,-0.1 -1,-0.2 0.836 120.6 44.9 -62.0 -35.9 16.4 10.7 93.9 217 234 A R H < S+ 0 0 108 -4,-2.4 -69,-0.4 33,-0.2 -2,-0.2 0.469 99.4 82.9 -91.9 -7.4 19.2 11.7 91.4 218 235 A S < - 0 0 10 -4,-1.6 2,-0.4 -3,-0.5 -71,-0.2 -0.341 59.5-140.7 -98.9 176.4 22.0 12.8 93.8 219 236 A H E -E 146 0A 1 -73,-1.0 -73,-2.5 30,-0.1 2,-0.5 -0.997 14.2-162.8-135.7 125.4 24.9 11.3 95.8 220 237 A S E -EI 145 248A 10 28,-1.3 28,-2.5 -2,-0.4 2,-0.7 -0.967 2.3-164.1-115.4 124.5 25.8 12.7 99.3 221 238 A V E -EI 144 247A 5 -77,-4.4 -77,-2.0 -2,-0.5 2,-0.7 -0.940 8.7-167.4-107.2 106.6 29.1 11.9 100.7 222 239 A F E -EI 143 246A 10 24,-2.6 24,-2.3 -2,-0.7 2,-0.5 -0.877 9.6-169.1 -96.4 117.8 29.0 12.6 104.4 223 240 A S E -EI 142 245A 9 -81,-3.5 -81,-2.1 -2,-0.7 2,-0.5 -0.922 13.6-171.0-118.4 127.4 32.5 12.6 105.9 224 241 A V E -EI 141 244A 2 20,-1.9 20,-1.8 -2,-0.5 2,-0.5 -0.934 10.4-161.3-112.8 125.2 33.5 12.7 109.5 225 242 A T E -EI 140 243A 24 -85,-4.7 -85,-2.1 -2,-0.5 2,-0.5 -0.919 3.0-163.7-113.7 124.1 37.2 13.2 110.4 226 243 A I E -EI 139 242A 0 16,-2.3 16,-2.0 -2,-0.5 2,-0.6 -0.919 4.2-167.3-110.3 122.0 38.8 12.3 113.7 227 244 A H E -EI 138 241A 78 -89,-3.2 -89,-1.3 -2,-0.5 2,-0.5 -0.944 19.4-164.8-105.0 113.6 42.2 13.7 114.7 228 245 A M E +E 137 0A 7 12,-3.1 -91,-0.2 -2,-0.6 -2,-0.0 -0.916 29.0 175.1-113.3 129.3 43.3 11.7 117.7 229 246 A K E -E 136 0A 99 -93,-3.1 -93,-0.5 -2,-0.5 10,-0.2 -0.547 31.0-176.5-120.9 55.5 46.1 12.6 120.2 230 247 A E - 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