==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 14-OCT-04 1VPA . COMPND 2 MOLECULE: 2-C-METHYL-D-ERYTHRITOL 4-PHOSPHATE CYTIDYLYLTRAN . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOTOGA MARITIMA; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 441 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18546.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 322 73.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 52 11.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 52 11.8 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 . 4 0.9 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 . 37 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 65 14.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 105 23.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.7 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 0 3 1 0 3 2 0 0 3 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 2 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 0 PARALLEL BRIDGES PER LADDER . 0 2 1 4 1 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 ANTIPARALLEL BRIDGES PER LADDER . 2 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 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 H 0 0 186 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 135.7 -8.6 123.6 -29.6 2 0 A H - 0 0 112 95,-0.1 97,-0.0 96,-0.0 0, 0.0 -0.706 360.0-148.9-130.7 80.8 -10.8 123.7 -26.5 3 1 A M - 0 0 34 -2,-0.3 96,-2.5 93,-0.2 2,-0.6 -0.212 5.8-155.8 -52.6 126.0 -8.6 123.2 -23.5 4 2 A N E -a 99 0A 9 94,-0.2 44,-2.1 42,-0.1 45,-1.4 -0.938 11.7-172.4-106.5 117.3 -10.1 121.4 -20.5 5 3 A V E -ab 100 49A 0 94,-2.4 96,-3.1 -2,-0.6 2,-0.4 -0.901 10.7-147.5-111.8 139.4 -8.6 122.2 -17.2 6 4 A A E -ab 101 50A 0 43,-2.8 45,-2.6 -2,-0.4 2,-0.6 -0.829 4.1-153.5-104.3 138.3 -9.4 120.4 -13.9 7 5 A I E -ab 102 51A 0 94,-3.5 96,-2.1 -2,-0.4 2,-0.8 -0.950 4.2-158.5-116.9 117.1 -9.3 122.0 -10.5 8 6 A L E -ab 103 52A 0 43,-3.0 45,-2.9 -2,-0.6 2,-0.6 -0.851 10.6-149.1 -99.9 109.2 -8.7 119.9 -7.5 9 7 A L E +ab 104 53A 13 94,-2.4 96,-2.3 -2,-0.8 97,-0.3 -0.693 39.5 142.9 -81.7 115.1 -10.0 121.5 -4.4 10 8 A A E + b 0 54A 3 43,-2.5 45,-0.5 -2,-0.6 -1,-0.1 -0.164 38.7 100.5-147.9 42.0 -7.8 120.5 -1.4 11 9 A A + 0 0 6 43,-0.3 43,-0.1 65,-0.1 45,-0.1 0.431 56.2 107.9-105.6 -8.8 -7.7 123.7 0.7 12 10 A G - 0 0 44 1,-0.1 43,-0.2 43,-0.0 12,-0.1 -0.129 63.1-140.5 -69.2 170.8 -10.4 122.7 3.3 13 11 A K - 0 0 77 9,-0.1 10,-0.1 10,-0.1 -1,-0.1 0.589 24.5-134.7-111.9 -17.0 -9.7 121.7 6.9 14 12 A G >> + 0 0 13 8,-0.2 3,-1.5 1,-0.1 4,-0.5 0.924 36.8 168.3 62.4 46.3 -12.1 118.8 7.4 15 13 A E G >4 S+ 0 0 162 1,-0.3 3,-1.2 2,-0.2 -1,-0.1 0.860 71.3 58.6 -61.6 -37.1 -13.4 120.1 10.8 16 14 A R G 34 S+ 0 0 133 1,-0.2 191,-0.5 2,-0.1 -1,-0.3 0.645 94.9 66.6 -69.3 -14.1 -16.3 117.6 10.8 17 15 A M G <4 S- 0 0 1 -3,-1.5 -1,-0.2 189,-0.2 -2,-0.2 0.754 94.6-142.4 -71.0 -28.7 -13.8 114.7 10.6 18 16 A S << + 0 0 89 -3,-1.2 2,-0.3 -4,-0.5 -3,-0.1 0.954 53.5 128.7 55.2 56.9 -12.4 115.5 14.0 19 17 A E - 0 0 84 -5,-0.4 -1,-0.2 2,-0.1 -2,-0.1 -0.864 69.1-120.6-125.3 166.6 -8.7 114.7 13.1 20 18 A N S S+ 0 0 169 -2,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.779 98.8 53.5 -67.9 -30.8 -5.4 116.6 13.5 21 19 A V S S- 0 0 54 -7,-0.1 5,-0.1 1,-0.0 -2,-0.1 -0.883 97.6-100.9-118.6 134.3 -4.9 116.5 9.7 22 20 A P > - 0 0 17 0, 0.0 3,-2.4 0, 0.0 4,-0.3 -0.298 37.0-117.4 -56.4 139.1 -7.2 117.6 7.0 23 21 A K G > S+ 0 0 22 1,-0.3 3,-1.5 2,-0.2 10,-0.4 0.753 110.1 64.1 -49.3 -37.2 -9.0 114.7 5.4 24 22 A Q G 3 S+ 0 0 4 1,-0.3 10,-2.3 -12,-0.1 -1,-0.3 0.677 104.4 48.1 -64.4 -20.1 -7.4 115.2 1.9 25 23 A F G < S+ 0 0 7 -3,-2.4 -1,-0.3 8,-0.2 2,-0.2 0.272 83.6 113.6-105.5 5.7 -4.0 114.5 3.4 26 24 A L < - 0 0 32 -3,-1.5 7,-2.1 -4,-0.3 2,-0.3 -0.579 67.7-124.0 -70.7 139.7 -5.0 111.3 5.3 27 25 A E E +I 32 0B 99 -2,-0.2 2,-0.3 5,-0.2 5,-0.2 -0.666 30.1 176.5 -87.2 138.3 -3.3 108.2 3.9 28 26 A I E > S-I 31 0B 7 3,-2.7 3,-1.5 -2,-0.3 186,-0.0 -0.980 76.1 -6.5-137.7 139.1 -5.2 105.1 2.7 29 27 A E T 3 S- 0 0 107 -2,-0.3 3,-0.1 1,-0.2 -1,-0.1 0.863 132.6 -55.9 38.9 46.0 -3.5 102.2 1.2 30 28 A G T 3 S+ 0 0 58 1,-0.2 2,-0.3 0, 0.0 -1,-0.2 0.695 120.0 90.3 70.0 22.8 -0.3 104.2 1.3 31 29 A R E < S-I 28 0B 37 -3,-1.5 -3,-2.7 -5,-0.0 -1,-0.2 -0.992 79.5-105.4-143.7 148.6 -1.4 107.3 -0.7 32 30 A M E >> -I 27 0B 15 -2,-0.3 3,-2.4 -5,-0.2 4,-0.7 -0.482 35.2-114.6 -72.6 144.8 -3.0 110.6 0.4 33 31 A L T >4 S+ 0 0 0 -7,-2.1 3,-1.2 -10,-0.4 -8,-0.2 0.865 114.8 58.7 -46.2 -44.7 -6.7 110.8 -0.4 34 32 A F T 3> S+ 0 0 0 -10,-2.3 4,-1.5 1,-0.3 -1,-0.3 0.714 95.1 66.3 -63.5 -18.6 -6.1 113.7 -2.8 35 33 A E H <> S+ 0 0 42 -3,-2.4 4,-2.1 -11,-0.2 -1,-0.3 0.853 90.1 64.3 -70.7 -33.9 -3.8 111.4 -4.9 36 34 A Y H XX S+ 0 0 10 -3,-1.2 4,-1.1 -4,-0.7 3,-0.5 0.973 111.0 33.0 -57.0 -60.2 -6.7 109.1 -5.9 37 35 A P H 3> S+ 0 0 0 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.844 112.1 65.9 -67.3 -31.5 -8.7 111.6 -7.9 38 36 A L H 3X S+ 0 0 8 -4,-1.5 4,-1.8 1,-0.2 -2,-0.2 0.884 102.9 45.4 -54.8 -42.2 -5.5 113.4 -9.0 39 37 A S H < - 0 0 2 -4,-0.7 3,-1.7 -3,-0.3 -4,-0.0 -0.685 57.2-159.6 -88.1 118.4 -7.6 111.2 -18.4 45 43 A E T 3 S+ 0 0 186 -2,-0.6 -1,-0.1 1,-0.3 -4,-0.0 0.742 91.8 65.2 -63.7 -27.1 -7.2 112.2 -22.1 46 44 A A T 3 S+ 0 0 28 1,-0.1 2,-0.7 66,-0.1 -1,-0.3 0.612 90.3 80.7 -67.2 -14.3 -10.1 114.7 -21.7 47 45 A I < + 0 0 2 -3,-1.7 -42,-0.2 -6,-0.2 -1,-0.1 -0.860 49.7 175.3-106.2 111.6 -7.9 116.7 -19.3 48 46 A D S S+ 0 0 66 -44,-2.1 2,-0.3 -2,-0.7 -43,-0.2 0.802 70.1 3.5 -80.2 -31.9 -5.3 119.0 -20.7 49 47 A G E -b 5 0A 0 -45,-1.4 -43,-2.8 22,-0.0 2,-0.4 -0.995 59.0-144.3-155.9 160.5 -4.2 120.5 -17.4 50 48 A V E -bc 6 71A 0 20,-3.0 22,-2.9 -2,-0.3 23,-0.9 -0.974 3.4-166.5-130.7 138.7 -4.6 120.3 -13.6 51 49 A V E -bc 7 73A 0 -45,-2.6 -43,-3.0 -2,-0.4 2,-0.5 -0.996 11.8-155.3-120.0 126.7 -4.5 122.9 -10.9 52 50 A I E -bc 8 74A 0 21,-2.1 23,-3.3 -2,-0.4 2,-0.6 -0.927 7.6-158.2-104.6 124.2 -4.2 121.8 -7.3 53 51 A V E +bc 9 75A 0 -45,-2.9 -43,-2.5 -2,-0.5 2,-0.3 -0.895 28.3 142.6-106.6 116.0 -5.6 124.2 -4.7 54 52 A T E -bc 10 76A 0 21,-1.8 23,-2.4 -2,-0.6 -43,-0.3 -0.889 51.4 -80.5-142.3 173.7 -4.4 123.9 -1.2 55 53 A R > - 0 0 78 -45,-0.5 3,-2.3 -2,-0.3 4,-0.5 -0.466 46.0-108.5 -76.7 155.5 -3.4 126.0 1.9 56 54 A R G > S+ 0 0 85 1,-0.3 3,-1.3 2,-0.2 4,-0.3 0.845 116.8 59.3 -54.8 -36.5 0.0 127.5 2.0 57 55 A E G 3 S+ 0 0 120 1,-0.2 -1,-0.3 2,-0.1 4,-0.3 0.654 104.0 51.6 -71.1 -13.5 1.2 125.1 4.7 58 56 A W G <> S+ 0 0 50 -3,-2.3 4,-1.9 1,-0.1 -1,-0.2 0.450 77.1 100.2-101.6 -0.2 0.5 122.1 2.5 59 57 A F H <> S+ 0 0 49 -3,-1.3 4,-3.2 -4,-0.5 -1,-0.1 0.858 85.8 44.7 -54.1 -43.6 2.5 123.2 -0.7 60 58 A E H > S+ 0 0 158 -4,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.941 109.5 53.9 -70.7 -44.7 5.5 121.1 0.1 61 59 A V H 4 S+ 0 0 40 -4,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.831 117.0 40.7 -55.0 -36.0 3.6 117.9 1.0 62 60 A V H >X S+ 0 0 2 -4,-1.9 3,-2.5 2,-0.2 4,-0.8 0.945 111.0 55.1 -77.4 -52.1 1.9 118.3 -2.4 63 61 A E H 3< S+ 0 0 116 -4,-3.2 3,-0.5 1,-0.3 -2,-0.2 0.797 106.4 53.8 -49.8 -34.3 5.0 119.3 -4.3 64 62 A K T 3< S+ 0 0 77 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.434 112.8 42.1 -85.3 1.5 6.7 116.1 -3.1 65 63 A R T <4 S+ 0 0 87 -3,-2.5 2,-0.5 1,-0.2 -1,-0.2 0.369 105.0 68.3-121.0 -1.3 3.9 113.8 -4.3 66 64 A V < + 0 0 20 -4,-0.8 2,-0.4 -3,-0.5 -1,-0.2 -0.947 41.5 152.6-133.9 104.9 3.2 115.3 -7.7 67 65 A F + 0 0 176 -2,-0.5 2,-0.3 -3,-0.1 3,-0.1 -0.902 31.2 127.4-127.2 99.2 5.6 115.2 -10.7 68 66 A H > - 0 0 76 -2,-0.4 3,-2.1 3,-0.1 -2,-0.0 -0.913 59.3-134.7-157.1 133.2 3.5 115.4 -13.8 69 67 A E T 3 S+ 0 0 191 -2,-0.3 -1,-0.1 1,-0.3 -27,-0.0 0.760 103.7 65.1 -59.3 -27.7 3.7 117.7 -16.9 70 68 A K T 3 S+ 0 0 38 -21,-0.1 -20,-3.0 -28,-0.1 2,-0.8 0.601 78.4 97.4 -67.2 -16.6 -0.2 118.1 -16.8 71 69 A V E < -c 50 0A 28 -3,-2.1 -20,-0.2 -22,-0.2 -3,-0.1 -0.724 51.3-177.6 -81.9 113.3 0.1 119.9 -13.4 72 70 A L E - 0 0 54 -22,-2.9 2,-0.3 -2,-0.8 -21,-0.2 0.677 58.7 -35.5 -85.1 -24.6 0.0 123.6 -14.2 73 71 A G E -c 51 0A 16 -23,-0.9 -21,-2.1 2,-0.0 2,-0.5 -0.894 44.3-113.4 173.2 156.6 0.4 124.8 -10.6 74 72 A I E -c 52 0A 36 -2,-0.3 2,-0.4 -23,-0.2 -21,-0.2 -0.966 44.8-162.6-104.3 126.8 -0.2 124.4 -7.0 75 73 A V E -c 53 0A 14 -23,-3.3 -21,-1.8 -2,-0.5 2,-0.1 -0.935 21.4-107.4-126.8 136.8 -2.4 127.4 -6.0 76 74 A E E -c 54 0A 97 -2,-0.4 -21,-0.2 -23,-0.2 -65,-0.1 -0.354 36.5-140.7 -64.3 126.3 -3.2 128.9 -2.7 77 75 A G - 0 0 15 -23,-2.4 2,-0.2 -2,-0.1 -21,-0.1 -0.087 12.6-121.2 -74.2 179.9 -6.8 128.2 -1.5 78 76 A G - 0 0 17 2,-0.5 -1,-0.1 3,-0.1 6,-0.1 -0.490 33.9 -92.2-109.8-172.2 -9.1 130.6 0.2 79 77 A D S S+ 0 0 136 -2,-0.2 2,-0.3 -67,-0.0 3,-0.1 0.603 110.3 37.6 -77.1 -12.2 -11.0 130.5 3.5 80 78 A T S > S- 0 0 45 1,-0.1 4,-2.5 -68,-0.1 -2,-0.5 -0.951 86.6-111.1-135.4 159.5 -13.9 129.0 1.7 81 79 A R H > S+ 0 0 55 -2,-0.3 4,-2.7 2,-0.2 5,-0.1 0.914 119.8 49.7 -47.3 -52.9 -14.7 126.5 -1.1 82 80 A S H > S+ 0 0 0 96,-0.3 4,-2.8 1,-0.2 -1,-0.2 0.911 111.7 48.5 -59.2 -42.6 -15.9 129.4 -3.4 83 81 A Q H > S+ 0 0 60 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.855 109.3 52.8 -67.3 -32.4 -12.8 131.4 -2.6 84 82 A S H X S+ 0 0 6 -4,-2.5 4,-1.3 2,-0.2 -2,-0.2 0.943 109.6 49.6 -68.9 -40.1 -10.7 128.4 -3.4 85 83 A V H >X S+ 0 0 0 -4,-2.7 4,-1.9 1,-0.2 3,-1.2 0.976 110.8 49.0 -56.9 -55.7 -12.5 128.1 -6.7 86 84 A R H 3X S+ 0 0 49 -4,-2.8 4,-2.2 1,-0.3 5,-0.2 0.875 105.4 57.9 -53.0 -43.2 -11.9 131.8 -7.5 87 85 A S H 3X S+ 0 0 34 -4,-2.4 4,-1.5 1,-0.2 -1,-0.3 0.836 108.2 47.3 -55.3 -36.3 -8.2 131.6 -6.6 88 86 A A H < S+ 0 0 47 -4,-1.5 3,-0.5 1,-0.2 -2,-0.2 0.881 112.8 47.9 -61.7 -41.0 -4.5 131.5 -11.9 92 90 A L H >X S+ 0 0 0 -4,-2.5 3,-2.1 1,-0.2 4,-1.1 0.658 86.5 90.6 -75.2 -16.9 -6.0 130.0 -15.0 93 91 A E G >< S+ 0 0 107 -4,-1.0 3,-1.0 -3,-0.5 -1,-0.2 0.874 80.7 57.9 -49.0 -44.6 -6.8 133.4 -16.5 94 92 A K G <4 S+ 0 0 144 -3,-0.5 -1,-0.3 -4,-0.5 -2,-0.1 0.719 106.7 49.7 -60.1 -21.3 -3.4 133.5 -18.3 95 93 A F G <4 S- 0 0 82 -3,-2.1 -1,-0.2 -4,-0.2 -2,-0.2 0.703 92.2-147.8 -89.4 -24.0 -4.2 130.2 -20.1 96 94 A S << - 0 0 86 -4,-1.1 -93,-0.2 -3,-1.0 -3,-0.1 0.901 24.0-163.8 52.9 52.7 -7.7 131.3 -21.3 97 95 A P - 0 0 5 0, 0.0 68,-0.3 0, 0.0 -1,-0.1 -0.358 20.5-140.8 -72.2 145.1 -9.0 127.7 -21.1 98 96 A S S S+ 0 0 37 -95,-0.5 67,-1.3 1,-0.2 2,-0.3 0.865 81.7 17.6 -72.8 -40.6 -12.3 126.8 -22.8 99 97 A Y E -aD 4 164A 36 -96,-2.5 -94,-2.4 65,-0.3 2,-0.4 -0.958 63.6-157.3-137.2 150.8 -13.7 124.5 -20.1 100 98 A V E -aD 5 163A 0 63,-3.2 63,-2.7 -2,-0.3 2,-0.5 -0.997 2.7-157.9-135.5 130.7 -13.0 123.9 -16.4 101 99 A L E -aD 6 162A 0 -96,-3.1 -94,-3.5 -2,-0.4 2,-0.4 -0.938 10.4-161.0-109.5 129.9 -13.8 120.9 -14.3 102 100 A V E +aD 7 161A 0 59,-3.9 59,-2.5 -2,-0.5 2,-0.3 -0.906 12.8 174.5-115.7 138.3 -14.1 121.3 -10.5 103 101 A H E -a 8 0A 2 -96,-2.1 -94,-2.4 -2,-0.4 2,-0.4 -0.982 33.0-124.0-148.5 133.3 -13.8 118.4 -8.0 104 102 A D E > -a 9 0A 18 -2,-0.3 3,-1.7 -96,-0.2 -94,-0.1 -0.622 17.5-148.3 -71.9 124.0 -13.7 118.0 -4.3 105 103 A S T 3 S+ 0 0 3 -96,-2.3 -1,-0.2 -2,-0.4 -95,-0.1 0.769 95.7 71.4 -62.7 -25.2 -10.5 116.1 -3.5 106 104 A A T 3 S+ 0 0 7 -97,-0.3 98,-3.2 1,-0.2 -1,-0.3 0.490 84.5 69.5 -71.6 -6.9 -12.5 114.7 -0.5 107 105 A R S < S+ 0 0 6 -3,-1.7 -1,-0.2 96,-0.3 96,-0.2 -0.905 70.3 169.6-100.8 94.7 -14.5 112.6 -3.1 108 106 A P + 0 0 0 0, 0.0 2,-1.3 0, 0.0 -1,-0.1 0.705 50.0 77.0 -87.4 -19.3 -11.5 110.4 -3.9 109 107 A F + 0 0 2 91,-0.5 2,-0.4 93,-0.3 93,-0.1 -0.487 60.7 160.5 -98.3 67.5 -13.0 107.6 -6.0 110 108 A L - 0 0 4 -2,-1.3 2,-0.3 -3,-0.2 91,-0.0 -0.730 27.1-144.2 -92.1 128.6 -13.4 109.4 -9.3 111 109 A R > - 0 0 36 -2,-0.4 4,-1.5 1,-0.1 3,-0.4 -0.688 17.3-125.8 -96.4 147.1 -13.8 107.4 -12.5 112 110 A K H >> S+ 0 0 108 -2,-0.3 4,-1.7 1,-0.2 3,-0.6 0.935 109.8 55.5 -46.4 -57.2 -12.5 108.2 -16.0 113 111 A K H 3> S+ 0 0 124 1,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.830 104.8 53.7 -54.1 -36.1 -15.9 107.9 -17.6 114 112 A H H 3> S+ 0 0 12 -3,-0.4 4,-2.3 2,-0.2 -1,-0.3 0.898 106.3 52.3 -65.0 -41.9 -17.4 110.4 -15.2 115 113 A V H - K 0 145C 62 3,-2.9 3,-1.5 -2,-0.6 -2,-0.0 -0.995 67.1 -38.6-123.5 123.7 -36.8 121.5 13.9 143 141 A N T 3 S- 0 0 111 -2,-0.4 3,-0.1 1,-0.3 -1,-0.1 0.743 124.3 -37.9 26.0 62.0 -36.8 122.0 17.8 144 142 A D T 3 S+ 0 0 98 1,-0.2 2,-0.3 270,-0.0 -1,-0.3 0.776 123.0 92.9 66.5 31.8 -37.0 118.3 18.7 145 143 A R E < -K 142 0C 62 -3,-1.5 -3,-2.9 268,-0.1 2,-0.5 -0.960 68.4-133.2-139.3 151.2 -39.4 117.2 15.9 146 144 A I E -K 141 0C 12 -2,-0.3 2,-0.5 -5,-0.2 -5,-0.2 -0.944 11.5-147.8-109.7 123.8 -38.3 115.8 12.5 147 145 A E E -K 140 0C 70 -7,-3.5 -7,-2.4 -2,-0.5 2,-0.8 -0.771 14.6-135.4 -86.1 130.1 -39.9 117.1 9.3 148 146 A Y E -K 139 0C 39 -2,-0.5 -9,-0.3 -9,-0.2 3,-0.1 -0.777 23.6-142.5 -90.0 108.9 -40.2 114.5 6.6 149 147 A I E -K 138 0C 13 -11,-2.3 -11,-0.5 -2,-0.8 2,-0.0 -0.494 20.4-105.1 -77.7 136.4 -39.1 116.2 3.4 150 148 A P - 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0 0 32 -3,-0.1 2,-0.4 -2,-0.0 -1,-0.1 -0.438 37.8-105.8 119.9 166.6 -51.5 104.0 6.1 399 175 B E + 0 0 101 -2,-0.1 2,-0.3 -95,-0.1 3,-0.0 -0.970 39.1 156.0-136.6 122.7 -48.5 104.2 3.7 400 176 B W - 0 0 59 -2,-0.4 -96,-0.3 1,-0.1 -97,-0.1 -0.975 49.9-118.9-141.9 157.1 -45.1 105.7 4.4 401 177 B A S S- 0 0 37 -2,-0.3 2,-0.2 -98,-0.1 -264,-0.1 0.775 98.5 -0.1 -61.3 -31.3 -41.5 105.4 3.2 402 178 B D S S- 0 0 5 -3,-0.0 -2,-0.1 -99,-0.0 -21,-0.1 -0.753 73.6-106.2-143.2-169.3 -40.4 104.3 6.7 403 179 B D S > S+ 0 0 0 -2,-0.2 4,-1.2 2,-0.1 5,-0.1 0.553 102.1 70.8-106.6 -10.8 -41.7 103.5 10.1 404 180 B T H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.895 94.5 58.4 -70.5 -37.2 -40.4 106.5 12.1 405 181 B E H > S+ 0 0 54 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.910 107.9 41.9 -60.4 -48.1 -42.9 108.9 10.4 406 182 B P H > S+ 0 0 3 0, 0.0 4,-0.6 0, 0.0 -1,-0.2 0.881 115.5 52.0 -66.9 -34.6 -46.1 107.1 11.4 407 183 B V H ><>S+ 0 0 0 -4,-1.2 3,-1.1 1,-0.2 5,-0.7 0.888 105.3 54.9 -66.8 -41.5 -44.7 106.6 14.9 408 184 B Q H ><5S+ 0 0 33 -4,-2.7 3,-2.4 1,-0.2 4,-0.2 0.834 95.8 66.5 -61.7 -33.4 -43.9 110.3 15.2 409 185 B K H 3<5S+ 0 0 119 -4,-1.3 -1,-0.2 1,-0.3 -2,-0.2 0.798 92.6 62.3 -58.6 -27.1 -47.5 111.2 14.4 410 186 B L T <<5S- 0 0 89 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.353 126.6-104.1 -75.9 7.2 -48.4 109.5 17.7 411 187 B G T < 5S+ 0 0 71 -3,-2.4 2,-0.4 1,-0.3 -3,-0.2 0.870 73.8 144.6 70.1 38.2 -46.3 112.2 19.4 412 188 B V < - 0 0 29 -5,-0.7 -1,-0.3 -4,-0.2 2,-0.2 -0.924 49.7-123.2-105.1 135.6 -43.3 110.0 20.1 413 189 B K - 0 0 57 -2,-0.4 2,-0.6 -66,-0.1 -64,-0.3 -0.541 22.5-136.1 -77.8 142.9 -39.8 111.5 19.8 414 190 B I - 0 0 21 -2,-0.2 2,-0.5 -270,-0.1 -64,-0.2 -0.882 7.7-141.9-107.5 117.8 -37.4 109.7 17.4 415 191 B A E -q 350 0C 9 -66,-2.2 -64,-2.8 -2,-0.6 2,-0.4 -0.652 14.5-145.8 -78.6 122.7 -33.8 109.0 18.5 416 192 B L E -q 351 0C 37 -2,-0.5 2,-0.5 -66,-0.2 -64,-0.2 -0.755 12.1-160.1 -88.1 135.1 -31.4 109.5 15.6 417 193 B V E -q 352 0C 10 -66,-2.7 -64,-3.6 -2,-0.4 2,-0.4 -0.978 21.4-117.6-119.1 131.8 -28.5 107.2 15.7 418 194 B E E +q 353 0C 99 -2,-0.5 -64,-0.2 -66,-0.2 2,-0.1 -0.509 42.7 167.5 -71.4 121.6 -25.3 108.0 13.8 419 195 B G - 0 0 2 -66,-2.4 -64,-0.1 -2,-0.4 -211,-0.1 -0.180 25.2-116.8-110.2-151.8 -24.6 105.4 11.1 420 196 B D > - 0 0 10 -2,-0.1 3,-2.4 -66,-0.1 -211,-0.1 -0.961 31.2 -93.0-152.7 165.1 -22.2 105.3 8.2 421 197 B P G > S+ 0 0 15 0, 0.0 3,-1.5 0, 0.0 -212,-0.1 0.640 111.1 77.4 -62.5 -18.1 -22.2 105.2 4.3 422 198 B L G 3 S+ 0 0 2 1,-0.3 -91,-0.6 -92,-0.0 -213,-0.0 0.630 83.0 71.5 -58.9 -15.6 -22.0 101.4 4.3 423 199 B C G < S+ 0 0 3 -3,-2.4 -42,-0.4 -93,-0.1 -1,-0.3 0.289 70.9 133.0 -84.9 9.1 -25.7 101.5 5.2 424 200 B F < - 0 0 10 -3,-1.5 2,-0.5 1,-0.1 -93,-0.3 -0.135 56.8-119.9 -60.9 159.8 -26.7 102.6 1.8 425 201 B K - 0 0 31 -96,-0.2 2,-1.0 -95,-0.1 -96,-0.3 -0.911 16.1-124.3-108.7 122.7 -29.6 100.9 -0.0 426 202 B V + 0 0 0 -98,-3.4 -187,-0.1 -2,-0.5 3,-0.1 -0.581 56.5 143.4 -63.7 100.3 -29.0 99.2 -3.3 427 203 B T + 0 0 0 -2,-1.0 2,-0.3 1,-0.2 -1,-0.2 0.705 53.6 37.0-114.3 -37.9 -31.7 101.1 -5.2 428 204 B F S > S- 0 0 23 -3,-0.3 3,-2.3 -189,-0.1 4,-0.3 -0.810 83.0-107.5-120.4 161.6 -30.3 101.6 -8.8 429 205 B K G > S+ 0 0 72 -191,-0.5 3,-1.8 1,-0.3 4,-0.4 0.861 117.2 63.6 -50.4 -39.4 -28.2 99.6 -11.2 430 206 B E G 3 S+ 0 0 75 1,-0.3 4,-0.4 2,-0.1 -1,-0.3 0.616 91.6 67.7 -65.3 -13.4 -25.3 101.9 -10.6 431 207 B D G <> S+ 0 0 9 -3,-2.3 4,-1.7 1,-0.2 -1,-0.3 0.694 80.6 77.5 -77.9 -19.5 -25.3 100.7 -6.9 432 208 B L H <> S+ 0 0 10 -3,-1.8 4,-2.5 -4,-0.3 5,-0.2 0.863 84.4 58.1 -67.8 -39.7 -24.2 97.2 -7.7 433 209 B E H > S+ 0 0 83 -4,-0.4 4,-1.8 1,-0.2 -1,-0.2 0.937 108.9 46.5 -53.9 -49.0 -20.5 97.8 -8.3 434 210 B L H > S+ 0 0 2 -4,-0.4 4,-2.1 1,-0.2 -1,-0.2 0.868 109.5 54.3 -65.6 -36.8 -20.1 99.3 -4.8 435 211 B A H X S+ 0 0 0 -4,-1.7 4,-2.5 1,-0.2 -1,-0.2 0.905 108.9 49.8 -57.9 -41.6 -22.1 96.4 -3.3 436 212 B R H X S+ 0 0 101 -4,-2.5 4,-1.7 2,-0.2 -2,-0.2 0.845 108.7 52.2 -66.2 -35.4 -19.6 94.0 -5.0 437 213 B I H < S+ 0 0 17 -4,-1.8 4,-0.2 -5,-0.2 -2,-0.2 0.925 114.6 40.9 -68.2 -45.4 -16.6 95.9 -3.7 438 214 B I H >X S+ 0 0 0 -4,-2.1 3,-1.8 1,-0.2 4,-1.0 0.886 109.7 59.2 -70.8 -41.0 -17.8 95.8 -0.1 439 215 B A H >< S+ 0 0 6 -4,-2.5 3,-0.7 1,-0.3 -1,-0.2 0.886 95.1 64.4 -53.9 -41.6 -19.1 92.2 -0.4 440 216 B R T 3< S+ 0 0 112 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.661 105.2 47.3 -55.4 -16.5 -15.5 91.1 -1.3 441 217 B E T <4 0 0 75 -3,-1.8 -1,-0.2 -4,-0.2 -2,-0.2 0.675 360.0 360.0-103.3 -26.0 -14.5 92.2 2.2 442 218 B W << 0 0 124 -4,-1.0 -2,-0.2 -3,-0.7 -1,-0.1 0.833 360.0 360.0 -49.1 360.0 -17.3 90.5 4.3