==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-APR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 22-OCT-09 3KD5 . COMPND 2 MOLECULE: DNA (5'- . SOURCE 2 SYNTHETIC: YES; . AUTHOR K.E.ZAHN,S.DOUBLIE . 905 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 42832.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 621 68.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 21 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 120 13.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.7 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 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 75 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 305 33.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 2.2 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 2 0 2 3 3 0 1 4 0 3 1 2 0 0 0 0 0 1 0 0 0 0 0 0 0 3 RESIDUES PER ALPHA HELIX . 1 1 1 1 0 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 PARALLEL BRIDGES PER LADDER . 4 4 3 2 4 2 4 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 . 3 5 0 0 1 0 1 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 E M 0 0 187 0, 0.0 2,-0.4 0, 0.0 23,-0.1 0.000 360.0 360.0 360.0 -38.5 37.9 41.9 32.8 2 2 E K - 0 0 133 1,-0.1 2,-0.2 21,-0.1 18,-0.0 -0.583 360.0-140.6 -73.3 121.6 35.5 44.7 31.8 3 3 E E - 0 0 55 -2,-0.4 2,-0.3 100,-0.1 18,-0.2 -0.500 19.6-174.1 -88.7 150.9 33.9 46.3 34.8 4 4 E F E -A 20 0A 8 16,-1.4 16,-2.8 -2,-0.2 2,-0.1 -0.962 24.8-107.4-140.4 157.1 30.3 47.4 35.3 5 5 E Y E -A 19 0A 0 -2,-0.3 14,-0.3 14,-0.2 3,-0.1 -0.371 19.3-173.4 -78.0 160.1 28.2 49.2 37.9 6 6 E L E S- 0 0 1 12,-3.3 349,-0.4 1,-0.5 2,-0.3 0.644 72.6 -3.0-112.5 -63.0 25.6 47.5 40.1 7 7 E T E -A 18 0A 2 11,-1.5 11,-2.7 347,-0.1 -1,-0.5 -0.972 60.7-161.1-131.1 147.8 24.0 50.4 42.0 8 8 E V E -A 17 0A 1 -2,-0.3 2,-0.3 9,-0.2 259,-0.2 -0.982 12.2-178.4-130.1 144.5 24.7 54.2 42.0 9 9 E E E -A 16 0A 17 7,-1.5 7,-3.5 -2,-0.4 2,-0.6 -0.996 20.9-145.2-149.2 133.3 23.6 56.7 44.6 10 10 E Q E +A 15 0A 68 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.900 24.3 166.2-102.8 117.6 23.9 60.4 45.3 11 11 E I E > -A 14 0A 41 3,-2.3 3,-0.8 -2,-0.6 2,-0.2 -0.951 63.2 -51.8-131.5 111.6 24.2 61.4 49.0 12 12 E G T 3 S- 0 0 51 -2,-0.4 53,-0.0 1,-0.2 0, 0.0 -0.416 118.8 -19.5 61.5-128.6 25.3 65.0 49.6 13 13 E D T 3 S+ 0 0 69 -2,-0.2 2,-0.3 52,-0.1 -1,-0.2 -0.226 123.9 81.2-102.9 40.4 28.4 66.0 47.7 14 14 E S E < -A 11 0A 8 -3,-0.8 -3,-2.3 18,-0.2 2,-0.6 -0.999 68.7-136.5-148.4 143.0 29.4 62.3 47.1 15 15 E I E -AB 10 31A 0 16,-2.9 16,-1.2 -2,-0.3 2,-0.7 -0.910 16.5-155.7-104.6 118.8 28.5 59.5 44.8 16 16 E F E -AB 9 30A 39 -7,-3.5 -7,-1.5 -2,-0.6 2,-0.4 -0.857 20.7-178.7 -96.6 113.7 28.1 56.1 46.4 17 17 E E E -AB 8 29A 0 -2,-0.7 12,-2.4 12,-0.6 2,-0.5 -0.943 23.0-164.0-124.2 133.5 28.7 53.3 43.9 18 18 E R E +AB 7 28A 5 -11,-2.7 -12,-3.3 -2,-0.4 -11,-1.5 -0.963 30.4 161.0-108.1 127.2 28.6 49.5 44.1 19 19 E Y E -AB 5 27A 29 8,-2.1 8,-2.5 -2,-0.5 2,-0.5 -0.913 42.9-116.8-142.5 164.1 30.3 47.8 41.1 20 20 E I E -AB 4 26A 6 -16,-2.8 -16,-1.4 -2,-0.3 6,-0.2 -0.944 41.4-146.4-103.4 127.3 31.9 44.6 39.9 21 21 E D > - 0 0 15 4,-2.4 3,-2.5 -2,-0.5 -17,-0.1 -0.163 31.8 -79.3 -91.7-177.4 35.6 45.0 39.2 22 22 E S T 3 S+ 0 0 45 1,-0.3 -20,-0.0 2,-0.1 -1,-0.0 0.709 129.7 47.5 -53.2 -29.3 38.1 43.6 36.6 23 23 E N T 3 S- 0 0 120 2,-0.1 -1,-0.3 -22,-0.1 -21,-0.1 0.176 122.0-104.2-100.6 15.6 38.5 40.4 38.6 24 24 E G S < S+ 0 0 18 -3,-2.5 2,-0.3 1,-0.2 -2,-0.1 0.799 75.6 135.4 71.3 33.7 34.7 39.9 38.9 25 25 E R - 0 0 153 -4,-0.0 -4,-2.4 0, 0.0 2,-0.4 -0.879 56.7-114.2-118.2 147.4 34.4 40.9 42.6 26 26 E E E +B 20 0A 61 -2,-0.3 2,-0.3 -6,-0.2 -6,-0.2 -0.648 44.9 161.5 -83.6 127.4 31.9 43.2 44.3 27 27 E R E -B 19 0A 116 -8,-2.5 -8,-2.1 -2,-0.4 2,-0.4 -0.886 29.4-128.6-141.0 169.1 33.3 46.5 45.8 28 28 E T E -B 18 0A 85 -2,-0.3 2,-0.2 -10,-0.2 -10,-0.2 -0.980 17.6-173.1-129.4 134.7 32.3 49.9 47.0 29 29 E R E -B 17 0A 68 -12,-2.4 -12,-0.6 -2,-0.4 -2,-0.0 -0.626 17.8-157.5-107.9 170.5 33.5 53.4 46.1 30 30 E E E -B 16 0A 110 -2,-0.2 2,-0.4 -14,-0.2 -14,-0.2 -0.492 24.0-177.4-144.2 75.2 32.8 56.9 47.4 31 31 E V E -B 15 0A 49 -16,-1.2 -16,-2.9 1,-0.1 2,-1.5 -0.610 26.0-140.9 -79.8 123.0 33.8 59.2 44.6 32 32 E E - 0 0 149 -2,-0.4 -18,-0.2 -18,-0.2 -1,-0.1 -0.668 34.1-145.3 -79.6 87.0 33.5 62.9 45.2 33 33 E Y - 0 0 24 -2,-1.5 32,-0.2 1,-0.1 59,-0.0 -0.301 13.1-150.1 -69.8 134.8 32.2 63.7 41.7 34 34 E K - 0 0 106 30,-0.1 29,-0.1 -2,-0.1 30,-0.1 -0.857 24.9-157.6-102.7 96.1 33.1 66.9 40.0 35 35 E P - 0 0 0 0, 0.0 27,-2.1 0, 0.0 2,-0.4 -0.359 2.7-144.3 -80.2 154.8 30.1 67.6 37.8 36 36 E S E +C 61 0B 27 25,-0.2 49,-0.3 49,-0.1 2,-0.3 -0.953 17.3 175.7-120.9 138.9 30.0 69.7 34.6 37 37 E L E -C 60 0B 1 23,-1.9 23,-2.4 -2,-0.4 2,-0.3 -0.891 18.1-135.2-132.1 165.8 27.3 72.1 33.2 38 38 E F E -CD 59 83B 27 45,-3.0 45,-1.1 -2,-0.3 2,-0.3 -0.772 12.4-167.2-127.2 165.0 27.3 74.4 30.2 39 39 E A E -C 58 0B 9 19,-1.3 19,-2.7 -2,-0.3 43,-0.1 -0.996 33.1 -96.5-151.2 146.2 26.3 77.9 29.2 40 40 E H E +C 57 0B 77 41,-0.4 17,-0.2 -2,-0.3 10,-0.0 -0.326 45.9 179.8 -60.2 142.0 25.8 79.9 26.0 41 41 E C - 0 0 17 15,-1.4 4,-0.1 1,-0.1 -1,-0.0 -0.939 32.0 -81.6-141.9 162.7 28.8 82.1 25.0 42 42 E P > - 0 0 81 0, 0.0 3,-0.9 0, 0.0 -1,-0.1 -0.128 42.0-109.6 -63.0 164.9 29.8 84.5 22.2 43 43 E E T 3 S+ 0 0 135 1,-0.3 3,-0.1 3,-0.1 -2,-0.0 0.638 113.4 71.1 -73.9 -15.7 31.1 83.3 18.9 44 44 E S T 3 S+ 0 0 122 1,-0.2 -1,-0.3 2,-0.1 2,-0.1 0.100 81.8 81.5 -83.5 21.0 34.6 84.6 19.6 45 45 E Q < - 0 0 95 -3,-0.9 2,-0.4 -4,-0.1 -1,-0.2 -0.505 69.9-170.9-123.7 58.8 34.8 81.8 22.2 46 46 E A + 0 0 100 -3,-0.1 2,-0.1 -2,-0.1 -3,-0.1 -0.368 23.6 143.2 -61.4 110.4 35.7 78.9 19.9 47 47 E T - 0 0 62 -2,-0.4 11,-0.1 2,-0.2 -1,-0.1 -0.397 59.2-104.6-125.4-156.2 35.5 75.6 21.9 48 48 E K S S+ 0 0 119 9,-0.2 2,-0.4 -2,-0.1 10,-0.1 0.501 87.3 90.6-114.3 -10.0 34.4 72.0 21.2 49 49 E Y + 0 0 46 8,-0.5 8,-2.4 329,-0.1 2,-0.3 -0.765 48.1 167.0 -95.3 131.4 31.0 72.0 23.0 50 50 E F E -Ef 56 378C 83 327,-1.0 329,-2.9 -2,-0.4 2,-0.1 -0.972 31.5-119.5-136.8 151.5 27.8 72.9 21.2 51 51 E D E > - f 0 379C 6 4,-2.5 3,-1.8 -2,-0.3 329,-0.2 -0.395 44.0 -93.4 -81.4 170.2 24.1 72.7 21.9 52 52 E I T 3 S+ 0 0 14 327,-0.9 328,-0.1 1,-0.3 -1,-0.1 0.716 126.6 52.6 -58.2 -23.7 21.7 70.6 19.7 53 53 E Y T 3 S- 0 0 143 2,-0.1 -1,-0.3 376,-0.0 375,-0.0 0.586 121.6-104.1 -90.1 -12.9 20.9 73.7 17.7 54 54 E G S < S+ 0 0 46 -3,-1.8 -2,-0.1 1,-0.3 374,-0.0 0.181 71.9 141.2 112.0 -15.4 24.5 74.6 17.0 55 55 E K - 0 0 98 1,-0.1 -4,-2.5 -5,-0.1 -1,-0.3 -0.367 56.4-107.7 -61.8 133.8 25.0 77.5 19.4 56 56 E P B -E 50 0C 16 0, 0.0 -15,-1.4 0, 0.0 2,-0.3 -0.321 34.9-160.2 -67.8 144.6 28.4 77.5 21.1 57 57 E C E -C 40 0B 0 -8,-2.4 -8,-0.5 -17,-0.2 2,-0.3 -0.960 11.1-142.2-130.1 145.2 28.8 76.6 24.8 58 58 E T E -C 39 0B 37 -19,-2.7 -19,-1.3 -2,-0.3 2,-0.3 -0.818 26.6-119.7-101.3 143.4 31.4 77.1 27.6 59 59 E R E -C 38 0B 112 -2,-0.3 2,-0.5 -21,-0.2 -21,-0.2 -0.624 18.9-162.0 -86.0 140.0 32.2 74.4 30.1 60 60 E K E -C 37 0B 91 -23,-2.4 -23,-1.9 -2,-0.3 2,-0.5 -0.940 4.3-165.6-122.3 106.4 31.7 75.0 33.9 61 61 E L E -C 36 0B 97 -2,-0.5 2,-0.2 -25,-0.2 -25,-0.2 -0.827 12.6-155.7 -92.2 125.6 33.5 72.5 36.2 62 62 E F - 0 0 23 -27,-2.1 3,-0.1 -2,-0.5 4,-0.0 -0.662 21.3-136.5-101.7 154.2 32.3 72.6 39.8 63 63 E A S S+ 0 0 66 -2,-0.2 2,-0.3 1,-0.2 -1,-0.1 0.935 89.1 7.5 -69.8 -49.6 34.0 71.7 43.0 64 64 E N S > S- 0 0 44 -30,-0.1 4,-1.4 1,-0.1 -1,-0.2 -0.847 72.8-113.4-130.9 169.4 31.0 69.8 44.4 65 65 E M H > S+ 0 0 1 -2,-0.3 4,-2.9 1,-0.2 5,-0.2 0.852 115.0 58.8 -70.4 -37.1 27.5 68.7 43.3 66 66 E R H > S+ 0 0 152 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.875 105.5 52.3 -56.3 -39.2 25.7 71.1 45.6 67 67 E D H > S+ 0 0 61 2,-0.2 4,-0.7 1,-0.2 -2,-0.2 0.900 111.3 44.6 -63.8 -45.3 27.6 73.9 43.8 68 68 E A H >X S+ 0 0 0 -4,-1.4 4,-1.5 1,-0.2 3,-0.6 0.909 113.4 51.7 -64.4 -43.5 26.4 72.7 40.4 69 69 E S H 3X S+ 0 0 50 -4,-2.9 4,-0.9 1,-0.2 -2,-0.2 0.803 112.7 44.9 -63.1 -33.6 22.9 72.3 41.8 70 70 E Q H 3X S+ 0 0 66 -4,-1.8 4,-0.7 -5,-0.2 -1,-0.2 0.492 105.0 61.8 -93.6 -5.4 22.9 75.8 43.2 71 71 E W H << S+ 0 0 34 -4,-0.7 -2,-0.2 -3,-0.6 -1,-0.2 0.825 100.4 56.4 -77.9 -37.8 24.3 77.3 40.0 72 72 E I H >X S+ 0 0 24 -4,-1.5 3,-1.5 1,-0.2 4,-1.4 0.938 106.5 46.8 -58.9 -51.3 21.3 76.1 38.1 73 73 E K H 3X S+ 0 0 114 -4,-0.9 4,-1.1 1,-0.3 -1,-0.2 0.779 112.6 49.3 -68.4 -28.3 18.7 77.9 40.3 74 74 E R H 3< S+ 0 0 131 -4,-0.7 -1,-0.3 2,-0.2 -2,-0.2 0.237 108.1 55.4 -94.5 13.4 20.7 81.2 40.2 75 75 E M H <>>S+ 0 0 19 -3,-1.5 5,-2.7 2,-0.1 4,-0.9 0.577 106.6 50.6-101.5 -27.2 20.9 80.8 36.4 76 76 E E H <5S+ 0 0 102 -4,-1.4 -2,-0.2 3,-0.2 -3,-0.1 0.851 102.2 60.3 -73.3 -37.2 17.1 80.6 36.2 77 77 E D T <5S+ 0 0 137 -4,-1.1 -1,-0.2 1,-0.2 -3,-0.1 0.499 111.5 40.7 -72.7 -4.8 16.6 83.7 38.4 78 78 E I T 45S- 0 0 127 -3,-0.4 -1,-0.2 2,-0.2 -2,-0.2 0.554 116.7-114.3-110.4 -21.0 18.5 85.7 35.7 79 79 E G T <5 + 0 0 64 -4,-0.9 2,-0.5 1,-0.3 -3,-0.2 0.745 67.5 136.8 93.5 28.9 16.8 83.9 32.8 80 80 E L < - 0 0 101 -5,-2.7 -1,-0.3 -41,-0.0 -2,-0.2 -0.930 58.2-109.6-112.4 131.1 19.8 82.2 31.3 81 81 E E - 0 0 32 -2,-0.5 2,-0.8 1,-0.1 -41,-0.4 -0.273 20.6-151.7 -59.5 132.6 19.6 78.5 30.1 82 82 E A - 0 0 4 -43,-0.1 301,-0.2 301,-0.1 -43,-0.2 -0.795 22.7-168.5-109.4 87.0 21.5 76.0 32.3 83 83 E L B +D 38 0B 0 -45,-1.1 -45,-3.0 -2,-0.8 2,-0.2 -0.342 34.9 61.4 -80.0 155.2 22.5 73.3 29.8 84 84 E G S S- 0 0 4 296,-1.9 2,-0.8 -47,-0.2 -47,-0.1 -0.533 91.5 -46.3 120.9 172.7 23.8 69.8 30.7 85 85 E M - 0 0 7 -49,-0.3 -49,-0.1 -2,-0.2 6,-0.1 -0.710 45.5-176.9 -82.0 110.7 22.9 66.7 32.6 86 86 E D + 0 0 67 -2,-0.8 2,-0.9 -51,-0.0 -1,-0.2 0.695 65.5 83.4 -85.8 -22.8 21.5 67.8 36.0 87 87 E D > - 0 0 20 1,-0.2 4,-1.6 2,-0.0 3,-0.2 -0.770 67.8-164.5 -77.3 107.3 21.1 64.3 37.3 88 88 E F H > S+ 0 0 8 -2,-0.9 4,-2.0 1,-0.2 -1,-0.2 0.686 81.2 63.8 -75.7 -17.6 24.6 63.7 38.5 89 89 E K H > S+ 0 0 36 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.941 105.8 45.2 -65.3 -47.6 24.2 59.9 38.8 90 90 E L H > S+ 0 0 3 1,-0.2 4,-2.1 -3,-0.2 -2,-0.2 0.891 111.8 53.2 -62.3 -40.9 23.6 59.7 35.0 91 91 E A H X S+ 0 0 10 -4,-1.6 4,-2.0 1,-0.2 -1,-0.2 0.896 109.9 48.4 -59.4 -43.3 26.6 62.0 34.4 92 92 E Y H X S+ 0 0 10 -4,-2.0 4,-3.5 2,-0.2 5,-0.3 0.930 111.3 47.5 -65.1 -48.9 28.8 59.8 36.6 93 93 E L H X S+ 0 0 0 -4,-2.3 4,-1.3 1,-0.2 -1,-0.2 0.860 112.2 51.4 -62.7 -37.1 27.8 56.5 34.8 94 94 E S H < S+ 0 0 0 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.885 115.8 41.5 -64.6 -42.0 28.4 58.2 31.5 95 95 E D H >< S+ 0 0 86 -4,-2.0 3,-0.7 1,-0.2 -2,-0.2 0.929 117.9 44.7 -70.3 -47.8 31.8 59.4 32.5 96 96 E T H 3< S+ 0 0 44 -4,-3.5 -2,-0.2 1,-0.2 -1,-0.2 0.659 122.9 36.3 -75.7 -16.8 32.9 56.1 34.3 97 97 E Y T 3< + 0 0 1 -4,-1.3 2,-2.7 -5,-0.3 -1,-0.2 -0.349 62.5 163.5-136.1 57.9 31.6 53.8 31.5 98 98 E N < + 0 0 97 -3,-0.7 2,-0.3 2,-0.1 -4,-0.1 -0.257 60.7 65.2 -73.7 54.4 32.2 55.5 28.1 99 99 E Y S S- 0 0 57 -2,-2.7 2,-0.8 -5,-0.0 -2,-0.0 -0.963 102.0 -69.3-162.2 169.0 31.7 52.2 26.3 100 100 E E - 0 0 136 -2,-0.3 2,-0.3 1,-0.1 250,-0.1 -0.612 56.6-131.7 -72.1 107.4 29.1 49.6 25.5 101 101 E I - 0 0 20 -2,-0.8 2,-0.4 248,-0.4 -97,-0.1 -0.459 24.9-174.0 -68.5 120.1 28.5 47.9 28.9 102 102 E K - 0 0 145 -2,-0.3 2,-0.3 -99,-0.1 -1,-0.0 -0.977 14.2-168.5-113.1 131.3 28.6 44.1 28.8 103 103 E Y - 0 0 54 -2,-0.4 2,-0.5 -99,-0.0 -100,-0.1 -0.751 24.5-134.1-124.2 163.0 27.7 42.4 32.1 104 104 E D > - 0 0 59 -2,-0.3 3,-1.1 1,-0.1 -100,-0.1 -0.969 10.4-162.5-119.3 114.8 27.7 39.0 33.8 105 105 E H G > S+ 0 0 108 -2,-0.5 3,-1.1 1,-0.2 5,-0.2 0.700 85.1 68.4 -72.3 -20.9 24.5 38.1 35.6 106 106 E T G 3 S+ 0 0 81 1,-0.3 -1,-0.2 3,-0.1 -2,-0.0 0.690 102.6 47.0 -71.2 -19.6 26.1 35.4 37.8 107 107 E K G < S+ 0 0 87 -3,-1.1 2,-0.6 2,-0.1 -1,-0.3 0.246 93.4 90.9-104.4 8.5 28.0 38.1 39.6 108 108 E I S < S- 0 0 0 -3,-1.1 2,-1.0 33,-0.1 33,-0.0 -0.937 79.2-134.4-103.3 116.7 24.9 40.3 40.0 109 109 E R - 0 0 35 -2,-0.6 102,-2.8 100,-0.2 103,-1.9 -0.598 25.4-175.7 -79.2 101.5 23.3 39.4 43.3 110 110 E V E -g 212 0D 22 -2,-1.0 31,-1.8 101,-0.2 2,-0.4 -0.868 6.9-175.3 -98.6 124.2 19.5 39.1 42.7 111 111 E A E +gH 213 140D 0 101,-3.1 103,-3.6 -2,-0.5 2,-0.3 -0.956 13.1 178.1-124.8 138.1 17.4 38.4 45.9 112 112 E N E +gH 214 139D 2 27,-1.4 27,-2.8 -2,-0.4 2,-0.3 -0.999 14.3 157.3-135.8 143.2 13.8 37.7 46.5 113 113 E F E - 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0 0 77 0, 0.0 3,-1.1 0, 0.0 4,-0.1 -0.297 54.7-111.9 -71.9 161.8 -7.9 31.2 58.4 309 309 E I G >> S+ 0 0 90 1,-0.2 3,-1.5 2,-0.2 4,-0.6 0.812 113.3 63.4 -66.3 -32.8 -4.2 32.3 57.9 310 310 E S G 34 S+ 0 0 35 1,-0.3 -1,-0.2 2,-0.1 4,-0.1 0.658 109.0 42.3 -67.2 -16.4 -4.0 33.9 61.4 311 311 E K G <> S+ 0 0 115 -3,-1.1 4,-2.0 2,-0.1 -1,-0.3 0.304 92.8 89.8-106.6 5.6 -4.6 30.5 62.9 312 312 E L H <> S+ 0 0 6 -3,-1.5 4,-2.9 2,-0.2 8,-0.2 0.906 81.3 51.9 -75.6 -44.5 -2.3 28.6 60.5 313 313 E R H < S+ 0 0 3 -4,-0.6 4,-0.5 2,-0.2 -1,-0.2 0.852 113.5 50.0 -59.2 -35.3 1.0 28.8 62.4 314 314 E E H 4 S+ 0 0 119 2,-0.2 3,-0.5 -4,-0.1 -2,-0.2 0.996 121.1 28.5 -60.2 -67.9 -0.9 27.4 65.4 315 315 E S H < S+ 0 0 88 -4,-2.0 -2,-0.2 1,-0.2 -3,-0.2 0.833 139.3 13.9 -70.8 -39.1 -2.6 24.4 63.8 316 316 E N X + 0 0 65 -4,-2.9 4,-1.8 -5,-0.2 3,-0.3 -0.531 58.1 162.0-145.0 72.3 -0.1 23.6 61.1 317 317 E H H > S+ 0 0 15 -4,-0.5 4,-1.5 -3,-0.5 5,-0.2 0.777 77.5 65.9 -59.3 -29.3 3.3 25.3 61.4 318 318 E Q H > S+ 0 0 31 2,-0.2 4,-1.6 1,-0.2 3,-0.4 0.953 108.0 35.2 -57.7 -56.4 4.6 22.7 59.0 319 319 E R H > S+ 0 0 37 -3,-0.3 4,-2.9 1,-0.2 5,-0.2 0.819 109.9 68.0 -66.7 -33.2 2.6 23.9 56.0 320 320 E Y H X S+ 0 0 3 -4,-1.8 4,-1.0 -8,-0.2 -1,-0.2 0.849 107.4 37.0 -55.5 -40.8 3.0 27.5 57.2 321 321 E I H X S+ 0 0 1 -4,-1.5 4,-1.6 -3,-0.4 -1,-0.2 0.868 113.8 56.9 -80.0 -39.1 6.7 27.4 56.5 322 322 E S H X S+ 0 0 0 -4,-1.6 4,-2.8 1,-0.2 -2,-0.2 0.900 105.3 51.1 -58.8 -45.1 6.4 25.3 53.3 323 323 E Y H X S+ 0 0 9 -4,-2.9 4,-2.9 1,-0.2 -1,-0.2 0.898 107.4 52.5 -62.3 -42.9 4.0 27.8 51.7 324 324 E N H X S+ 0 0 1 -4,-1.0 4,-1.0 -5,-0.2 -1,-0.2 0.820 112.2 47.1 -61.6 -32.1 6.4 30.7 52.4 325 325 E I H X S+ 0 0 0 -4,-1.6 4,-1.6 2,-0.2 -2,-0.2 0.917 112.3 48.6 -73.2 -46.4 9.1 28.7 50.7 326 326 E I H X S+ 0 0 7 -4,-2.8 4,-2.7 1,-0.2 3,-0.3 0.940 106.4 57.7 -57.6 -50.8 6.9 27.8 47.7 327 327 E D H X S+ 0 0 18 -4,-2.9 4,-1.4 1,-0.2 -1,-0.2 0.837 105.9 49.5 -47.2 -43.8 5.8 31.5 47.3 328 328 E V H X S+ 0 0 4 -4,-1.0 4,-1.1 1,-0.2 -1,-0.2 0.892 112.2 48.0 -66.0 -39.6 9.4 32.6 46.9 329 329 E Y H X S+ 0 0 40 -4,-1.6 4,-2.5 -3,-0.3 -2,-0.2 0.850 101.6 65.3 -69.9 -34.7 10.0 29.9 44.3 330 330 E R H X S+ 0 0 21 -4,-2.7 4,-2.8 1,-0.2 5,-0.2 0.936 100.8 50.1 -50.0 -52.0 6.8 30.8 42.4 331 331 E V H X S+ 0 0 4 -4,-1.4 4,-2.4 1,-0.2 -1,-0.2 0.881 110.3 50.5 -55.8 -41.4 8.3 34.2 41.6 332 332 E L H X S+ 0 0 37 -4,-1.1 4,-2.2 2,-0.2 -1,-0.2 0.877 110.5 48.4 -66.4 -39.9 11.5 32.5 40.3 333 333 E Q H X S+ 0 0 42 -4,-2.5 4,-1.2 2,-0.2 -2,-0.2 0.913 111.3 50.7 -64.6 -43.7 9.4 30.1 38.1 334 334 E I H X S+ 0 0 0 -4,-2.8 4,-3.1 1,-0.2 5,-0.3 0.904 113.6 45.3 -60.3 -42.3 7.4 33.1 36.7 335 335 E D H X S+ 0 0 24 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.836 105.3 60.0 -70.9 -33.8 10.7 34.9 35.9 336 336 E A H < S+ 0 0 71 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.795 116.8 35.5 -60.9 -27.0 12.2 31.7 34.4 337 337 E K H < S+ 0 0 23 -4,-1.2 -2,-0.2 -3,-0.3 -1,-0.2 0.892 129.4 29.3 -91.2 -52.0 9.3 31.9 32.0 338 338 E R H < S- 0 0 24 -4,-3.1 -3,-0.2 -5,-0.1 -2,-0.2 0.814 84.5-150.3 -84.9 -33.5 8.8 35.7 31.4 339 339 E Q X + 0 0 78 -4,-1.9 4,-2.0 -5,-0.3 -4,-0.1 0.871 37.8 152.8 67.0 41.7 12.4 36.8 32.0 340 340 E F H > + 0 0 0 2,-0.2 4,-1.6 1,-0.2 -1,-0.1 0.742 69.6 52.1 -76.0 -25.7 11.5 40.3 33.3 341 341 E I H > S+ 0 0 14 2,-0.2 4,-1.8 3,-0.1 -1,-0.2 0.917 110.0 47.8 -76.3 -46.1 14.6 40.6 35.4 342 342 E N H > S+ 0 0 53 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.927 111.7 52.3 -54.0 -47.5 16.9 39.8 32.5 343 343 E L H X S+ 0 0 19 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.903 108.1 50.0 -55.2 -47.0 15.0 42.3 30.4 344 344 E S H X S+ 0 0 0 -4,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.795 112.2 47.9 -66.9 -31.6 15.4 45.0 33.0 345 345 E L H X S+ 0 0 2 -4,-1.8 4,-2.4 2,-0.2 5,-0.4 0.941 110.3 50.0 -72.7 -49.0 19.2 44.4 33.2 346 346 E D H X S+ 0 0 92 -4,-2.8 4,-0.9 1,-0.2 -2,-0.2 0.847 117.4 43.3 -55.6 -35.5 19.6 44.4 29.4 347 347 E M H X S+ 0 0 13 -4,-1.9 4,-2.7 -5,-0.2 5,-0.2 0.946 113.1 48.5 -75.6 -52.2 17.7 47.7 29.3 348 348 E G H X>S+ 0 0 0 -4,-2.2 5,-2.5 1,-0.2 4,-0.6 0.812 113.7 46.0 -62.3 -37.2 19.3 49.5 32.3 349 349 E Y H <5S+ 0 0 4 -4,-2.4 -248,-0.4 3,-0.2 -1,-0.2 0.834 113.4 50.7 -73.9 -33.1 22.9 48.7 31.2 350 350 E Y H <5S+ 0 0 94 -4,-0.9 -2,-0.2 -5,-0.4 -1,-0.2 0.897 116.4 40.1 -68.5 -41.5 22.0 49.8 27.6 351 351 E A H <5S- 0 0 1 -4,-2.7 -1,-0.2 2,-0.1 -2,-0.2 0.593 106.6-129.5 -81.1 -11.8 20.5 53.1 28.8 352 352 E K T <5 + 0 0 22 -4,-0.6 2,-0.3 -5,-0.2 -3,-0.2 0.956 63.6 129.2 55.8 55.2 23.3 53.5 31.5 353 353 E I S - 0 0 25 -2,-0.3 3,-2.5 1,-0.1 4,-0.2 -0.478 51.6-120.0 -55.4 129.8 19.9 52.9 37.7 355 355 E I G > S+ 0 0 1 -349,-0.4 3,-1.6 1,-0.3 -1,-0.1 0.840 111.9 58.8 -49.2 -40.7 18.3 49.5 37.0 356 356 E Q G > S+ 0 0 44 1,-0.3 3,-1.8 2,-0.1 -1,-0.3 0.743 86.4 79.3 -60.1 -24.2 15.0 50.6 38.7 357 357 E S G X + 0 0 17 -3,-2.5 3,-1.7 1,-0.3 7,-0.3 0.490 64.9 90.4 -68.6 -1.5 14.7 53.4 36.2 358 358 E V G < S+ 0 0 9 -3,-1.6 -1,-0.3 1,-0.3 -2,-0.1 0.761 77.9 64.5 -61.0 -25.0 13.4 50.9 33.6 359 359 E F G < S+ 0 0 64 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.611 96.0 67.6 -70.7 -13.4 9.9 51.8 35.0 360 360 E S <> - 0 0 43 -3,-1.7 4,-2.0 1,-0.1 -1,-0.2 -0.887 56.5-179.2-116.1 98.6 10.5 55.3 33.6 361 361 E P H > S+ 0 0 35 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.802 88.8 55.4 -58.6 -33.5 10.7 55.5 29.8 362 362 E I H > S+ 0 0 46 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.958 109.7 43.8 -66.0 -52.3 11.3 59.3 30.2 363 363 E K H > S+ 0 0 59 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.863 114.8 53.7 -54.9 -37.8 14.4 58.7 32.4 364 364 E T H X S+ 0 0 4 -4,-2.0 4,-1.9 -7,-0.3 -2,-0.2 0.938 113.1 38.6 -65.6 -50.6 15.4 55.9 29.9 365 365 E W H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 5,-0.3 0.804 110.4 59.2 -74.8 -30.7 15.3 58.1 26.8 366 366 E D H X S+ 0 0 15 -4,-2.5 4,-1.5 -5,-0.2 -1,-0.2 0.834 111.6 42.7 -65.1 -32.1 16.8 61.2 28.5 367 367 E A H X S+ 0 0 0 -4,-1.2 4,-2.3 -5,-0.2 -2,-0.2 0.858 113.6 50.6 -80.2 -39.8 19.8 59.0 29.3 368 368 E I H X S+ 0 0 8 -4,-1.9 4,-1.6 2,-0.2 -2,-0.2 0.934 115.8 42.2 -61.1 -47.7 20.0 57.3 25.9 369 369 E I H X S+ 0 0 4 -4,-2.7 4,-2.5 2,-0.2 5,-0.2 0.913 113.9 51.5 -68.4 -43.9 19.8 60.7 24.1 370 370 E F H X S+ 0 0 19 -4,-1.5 4,-2.8 -5,-0.3 -1,-0.2 0.910 112.1 47.1 -56.5 -46.8 22.2 62.4 26.5 371 371 E N H X S+ 0 0 16 -4,-2.3 4,-0.8 2,-0.2 -1,-0.2 0.770 112.1 49.8 -67.9 -31.2 24.8 59.6 26.0 372 372 E S H X S+ 0 0 9 -4,-1.6 4,-0.6 2,-0.2 -2,-0.2 0.872 115.5 43.1 -73.1 -40.7 24.4 59.7 22.2 373 373 E L H ><>S+ 0 0 1 -4,-2.5 5,-2.3 1,-0.2 3,-1.0 0.889 106.8 60.4 -69.4 -44.4 24.9 63.5 22.2 374 374 E K H ><5S+ 0 0 44 -4,-2.8 3,-1.1 1,-0.3 -1,-0.2 0.799 99.4 58.4 -54.8 -32.9 27.8 63.4 24.7 375 375 E E H 3<5S+ 0 0 135 -4,-0.8 -1,-0.3 1,-0.3 -2,-0.2 0.827 105.2 48.5 -67.1 -33.2 29.7 61.2 22.2 376 376 E Q T <<5S- 0 0 96 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 0.296 122.9-109.7 -85.9 9.0 29.4 63.9 19.5 377 377 E N T < 5S+ 0 0 67 -3,-1.1 -327,-1.0 1,-0.2 2,-0.2 0.827 70.5 150.0 62.2 37.2 30.6 66.4 22.2 378 378 E K E < -f 50 0C 75 -5,-2.3 2,-0.5 -329,-0.2 -327,-0.2 -0.658 43.7-129.9-107.3 159.0 27.2 68.0 22.3 379 379 E V E -f 51 0C 3 -329,-2.9 -327,-0.9 -2,-0.2 -342,-0.0 -0.905 19.0-130.5-114.5 125.8 25.2 69.7 25.1 380 380 E I - 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