==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 22-MAY-06 2DQ6 . COMPND 2 MOLECULE: AMINOPEPTIDASE N; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR Y.NAKAJIMA,Y.ONOHARA,K.ITO,T.YOSHIMOTO . 865 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33395.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 634 73.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 31 3.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 128 14.8 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 . 3 0.3 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 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 84 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 298 34.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 17 2.0 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 2 0 2 1 0 2 1 4 1 3 1 2 1 2 1 0 0 0 0 1 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 1 0 1 1 2 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 PARALLEL BRIDGES PER LADDER . 3 5 0 5 1 3 0 1 2 2 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 2 3 1 0 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 6 A Q 0 0 184 0, 0.0 2,-0.1 0, 0.0 363,-0.0 0.000 360.0 360.0 360.0 -3.6 71.5 55.5 30.9 2 7 A A - 0 0 29 361,-0.0 2,-0.4 364,-0.0 363,-0.2 -0.447 360.0-144.9 -75.3 145.7 74.6 54.1 29.2 3 8 A K E -A 364 0A 103 361,-3.1 361,-2.4 -2,-0.1 2,-0.4 -0.874 12.5-143.7-110.9 145.4 75.0 50.3 28.9 4 9 A Y E > -A 363 0A 92 -2,-0.4 3,-2.0 359,-0.2 359,-0.2 -0.907 16.4-138.4-118.8 140.0 78.3 48.6 29.1 5 10 A R G > S+ 0 0 65 357,-1.9 3,-1.6 -2,-0.4 -1,-0.1 0.848 104.2 62.2 -56.9 -37.1 79.8 45.5 27.3 6 11 A H G 3 S+ 0 0 147 356,-0.4 -1,-0.3 1,-0.3 357,-0.1 0.571 92.9 66.3 -69.9 -5.7 81.4 44.4 30.5 7 12 A D G < + 0 0 108 -3,-2.0 -1,-0.3 2,-0.0 -2,-0.2 0.355 69.1 138.2 -95.7 6.7 78.0 44.0 32.2 8 13 A Y < + 0 0 74 -3,-1.6 2,-0.3 -4,-0.1 299,-0.0 -0.257 25.0 173.4 -55.7 134.4 76.8 41.2 29.9 9 14 A R - 0 0 155 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 -0.993 36.8-104.5-144.8 135.1 75.0 38.5 31.8 10 15 A A - 0 0 60 -2,-0.3 2,-0.1 1,-0.1 30,-0.0 -0.228 51.9 -92.1 -55.9 147.5 73.1 35.4 30.5 11 16 A P - 0 0 14 0, 0.0 -1,-0.1 0, 0.0 29,-0.1 -0.336 18.7-140.3 -66.7 142.3 69.3 35.8 30.5 12 17 A D S S+ 0 0 35 28,-0.1 28,-3.4 1,-0.1 29,-2.4 0.780 91.1 31.0 -70.1 -26.7 67.4 34.6 33.6 13 18 A Y E -B 39 0B 4 26,-0.3 2,-0.3 27,-0.2 26,-0.2 -0.977 67.7-159.2-134.5 147.9 64.7 33.3 31.2 14 19 A Q E -B 38 0B 40 24,-2.6 24,-2.6 -2,-0.3 2,-0.5 -0.869 10.2-147.4-119.5 153.0 64.7 32.0 27.6 15 20 A I E +B 37 0B 1 -2,-0.3 22,-0.2 22,-0.2 3,-0.1 -0.991 15.3 180.0-122.2 117.1 61.8 31.8 25.2 16 21 A T E + 0 0 44 20,-2.2 119,-2.2 -2,-0.5 2,-0.3 0.724 67.0 18.1 -89.8 -26.0 62.0 28.8 23.0 17 22 A D E -Bc 36 135B 43 19,-0.8 19,-2.7 117,-0.3 2,-0.4 -0.996 59.8-171.3-148.9 141.5 58.9 29.3 20.9 18 23 A I E -Bc 35 136B 0 117,-2.5 119,-1.7 -2,-0.3 2,-0.6 -0.993 7.4-161.9-140.1 130.6 56.5 32.1 20.2 19 24 A D E -Bc 34 137B 67 15,-2.7 15,-2.7 -2,-0.4 2,-0.3 -0.957 18.3-166.8-112.3 114.3 53.2 32.1 18.5 20 25 A L E -Bc 33 138B 2 117,-3.2 119,-3.3 -2,-0.6 2,-0.4 -0.810 11.7-171.1-106.3 143.6 52.1 35.5 17.3 21 26 A T E -Bc 32 139B 39 11,-2.1 11,-2.6 -2,-0.3 2,-0.5 -0.998 5.4-165.4-132.0 127.2 48.7 36.7 16.1 22 27 A F E -Bc 31 140B 0 117,-2.7 119,-3.0 -2,-0.4 2,-1.2 -0.961 12.3-163.8-115.9 118.2 48.2 40.2 14.5 23 28 A D E -Bc 30 141B 59 7,-2.8 7,-2.0 -2,-0.5 2,-0.2 -0.843 37.1-145.8 -96.6 92.4 44.7 41.6 14.1 24 29 A L + 0 0 9 117,-2.5 119,-0.3 -2,-1.2 2,-0.3 -0.404 39.0 141.1 -72.9 138.0 46.0 44.2 11.7 25 30 A D - 0 0 74 -2,-0.2 71,-0.2 117,-0.1 -2,-0.1 -0.868 49.3-127.9-169.3 134.7 44.7 47.7 11.3 26 31 A A S S+ 0 0 2 -2,-0.3 70,-3.1 1,-0.2 71,-0.3 0.839 110.2 38.0 -58.1 -35.8 46.6 51.0 10.6 27 32 A Q S S+ 0 0 126 1,-0.3 2,-0.4 68,-0.2 -1,-0.2 0.898 133.2 11.5 -83.9 -43.4 45.0 52.7 13.5 28 33 A K - 0 0 118 66,-0.1 2,-0.5 67,-0.0 -1,-0.3 -0.877 64.2-176.1-143.7 108.1 44.8 49.9 16.1 29 34 A T E - D 0 93B 0 64,-2.7 64,-2.0 -2,-0.4 2,-0.6 -0.871 15.5-148.2-103.6 132.7 46.6 46.6 15.7 30 35 A V E -BD 23 92B 37 -7,-2.0 -7,-2.8 -2,-0.5 2,-0.5 -0.906 12.1-162.0-104.4 123.4 46.0 43.9 18.4 31 36 A V E -BD 22 91B 0 60,-3.2 60,-2.2 -2,-0.6 2,-0.5 -0.902 7.9-171.4-108.7 128.7 48.9 41.7 19.1 32 37 A T E -BD 21 90B 29 -11,-2.6 -11,-2.1 -2,-0.5 2,-0.5 -0.982 9.2-174.0-118.4 120.0 48.5 38.3 20.9 33 38 A A E -BD 20 89B 3 56,-3.1 56,-2.5 -2,-0.5 2,-0.7 -0.957 9.6-172.2-122.7 118.6 51.8 36.6 21.8 34 39 A V E -BD 19 88B 34 -15,-2.7 -15,-2.7 -2,-0.5 2,-0.4 -0.923 15.4-176.8-110.6 109.2 52.0 33.2 23.3 35 40 A S E -BD 18 87B 3 52,-2.9 52,-3.2 -2,-0.7 2,-0.8 -0.865 25.4-141.4-112.2 140.7 55.5 32.3 24.4 36 41 A Q E -BD 17 86B 62 -19,-2.7 -20,-2.2 -2,-0.4 -19,-0.8 -0.884 32.8-166.8 -98.1 111.5 56.9 29.1 25.8 37 42 A A E -BD 15 85B 2 48,-2.8 48,-1.8 -2,-0.8 2,-0.4 -0.742 16.2-168.1-106.0 151.6 59.4 30.2 28.5 38 43 A V E -BD 14 84B 21 -24,-2.6 -24,-2.6 -2,-0.3 2,-0.3 -0.992 20.1-132.3-137.6 125.3 62.1 28.4 30.5 39 44 A R E +B 13 0B 34 44,-3.1 -26,-0.3 -2,-0.4 -27,-0.1 -0.616 29.2 166.1 -81.7 135.5 63.9 29.7 33.5 40 45 A H + 0 0 125 -28,-3.4 -27,-0.2 -2,-0.3 -1,-0.2 0.573 59.9 60.4-117.3 -24.0 67.7 29.4 33.6 41 46 A G S S- 0 0 30 -29,-2.4 -29,-0.1 1,-0.2 -2,-0.0 0.070 104.0 -31.2 -90.2-157.8 68.5 31.8 36.4 42 47 A A > - 0 0 57 1,-0.1 3,-1.9 2,-0.1 -1,-0.2 -0.252 56.3-122.5 -58.8 143.1 67.7 31.9 40.1 43 48 A S T 3 S+ 0 0 96 1,-0.3 38,-0.2 -3,-0.1 -1,-0.1 0.745 111.9 50.8 -60.6 -24.5 64.3 30.4 41.0 44 49 A D T 3 S+ 0 0 134 36,-0.1 -1,-0.3 2,-0.1 36,-0.2 0.358 83.3 118.4 -95.5 5.9 63.2 33.7 42.6 45 50 A A < - 0 0 10 -3,-1.9 36,-0.3 -33,-0.1 2,-0.1 -0.505 60.5-132.6 -75.0 135.8 64.2 35.8 39.6 46 51 A P - 0 0 28 0, 0.0 2,-0.6 0, 0.0 33,-0.2 -0.486 21.3-109.7 -84.5 160.7 61.3 37.7 38.0 47 52 A L E -I 78 0C 1 31,-3.0 31,-2.9 -2,-0.1 2,-0.7 -0.819 32.0-158.8 -89.9 120.8 60.8 37.7 34.2 48 53 A R E -I 77 0C 141 -2,-0.6 2,-0.4 29,-0.2 29,-0.2 -0.894 8.8-170.4-107.6 109.6 61.7 41.2 32.8 49 54 A L E -I 76 0C 0 27,-2.8 27,-2.3 -2,-0.7 2,-0.3 -0.812 17.7-130.8-101.5 137.1 60.1 41.9 29.5 50 55 A N E +IJ 75 126C 40 76,-2.9 76,-2.1 -2,-0.4 2,-0.3 -0.625 33.9 164.9 -84.2 143.0 61.0 45.0 27.4 51 56 A G - 0 0 3 23,-1.8 2,-0.4 -2,-0.3 71,-0.2 -0.951 17.6-169.5-160.3 138.2 58.2 47.1 26.0 52 57 A E S S- 0 0 63 69,-2.6 21,-0.0 -2,-0.3 -2,-0.0 -0.986 72.1 -13.7-136.5 125.5 57.9 50.6 24.5 53 58 A D S S+ 0 0 154 -2,-0.4 2,-0.3 1,-0.2 -1,-0.1 0.923 89.9 146.4 52.7 54.4 54.7 52.5 23.7 54 59 A L - 0 0 24 39,-0.1 2,-0.8 -3,-0.1 -1,-0.2 -0.896 48.1-139.2-118.4 147.5 52.4 49.5 24.1 55 60 A K E -E 92 0B 136 37,-2.2 37,-2.2 -2,-0.3 2,-0.2 -0.900 26.5-143.0-107.1 102.6 48.8 49.4 25.5 56 61 A L E +E 91 0B 33 -2,-0.8 35,-0.3 35,-0.2 3,-0.1 -0.479 26.0 173.2 -69.1 129.3 48.7 46.2 27.7 57 62 A V E - 0 0 75 33,-3.1 2,-0.3 1,-0.4 34,-0.2 0.808 60.2 -19.0-102.4 -46.1 45.4 44.4 27.5 58 63 A S E -E 90 0B 31 32,-1.7 32,-1.9 2,-0.0 2,-0.4 -0.995 44.0-148.8-163.6 158.9 46.1 41.2 29.5 59 64 A V E +E 89 0B 7 -2,-0.3 7,-2.7 30,-0.2 2,-0.3 -0.995 20.4 175.6-134.4 124.4 48.7 38.9 31.0 60 65 A H E -EF 88 65B 43 28,-2.3 28,-2.8 -2,-0.4 2,-0.5 -0.971 18.0-159.8-130.8 146.6 48.2 35.1 31.5 61 66 A I E > S-EF 87 64B 3 3,-2.1 3,-1.9 -2,-0.3 26,-0.2 -0.986 89.5 -15.4-124.7 114.4 50.5 32.4 32.7 62 67 A N T 3 S- 0 0 89 24,-2.9 -1,-0.1 -2,-0.5 25,-0.1 0.895 130.3 -55.7 55.4 41.2 49.3 28.9 31.6 63 68 A D T 3 S+ 0 0 127 23,-0.4 -1,-0.3 1,-0.2 24,-0.1 0.438 111.3 125.8 71.8 3.1 45.9 30.6 30.8 64 69 A E E < S-F 61 0B 118 -3,-1.9 -3,-2.1 1,-0.0 -1,-0.2 -0.809 70.7-115.4 -94.6 122.9 45.6 31.9 34.4 65 70 A P E -F 60 0B 74 0, 0.0 2,-0.4 0, 0.0 -5,-0.3 -0.401 38.8-132.3 -55.8 125.7 45.1 35.7 34.6 66 71 A W + 0 0 51 -7,-2.7 -7,-0.2 1,-0.1 3,-0.1 -0.713 33.8 173.5 -92.2 130.7 48.3 36.9 36.3 67 72 A T + 0 0 133 -2,-0.4 2,-1.3 1,-0.1 -1,-0.1 0.579 63.8 83.2-105.6 -14.5 48.2 39.3 39.2 68 73 A A S S+ 0 0 24 11,-0.2 11,-2.8 12,-0.1 2,-0.3 -0.513 73.1 93.4 -93.1 68.3 51.9 39.2 40.1 69 74 A W E -K 78 0C 75 -2,-1.3 2,-0.3 9,-0.2 9,-0.2 -0.978 47.6-164.8-151.3 160.8 53.2 41.8 37.7 70 75 A K E -K 77 0C 141 7,-1.9 7,-3.0 -2,-0.3 2,-0.4 -0.990 18.0-132.8-150.0 140.5 54.0 45.4 37.4 71 76 A E E +K 76 0C 92 -2,-0.3 2,-0.2 5,-0.2 5,-0.2 -0.810 32.0 169.9 -95.4 135.6 54.7 47.8 34.6 72 77 A E E > -K 75 0C 115 3,-2.6 3,-2.4 -2,-0.4 2,-0.1 -0.776 51.2 -48.1-132.5 176.9 57.7 50.1 34.9 73 78 A E T 3 S- 0 0 176 1,-0.3 3,-0.1 -2,-0.2 -21,-0.1 -0.305 126.1 -13.8 -53.1 116.1 59.6 52.4 32.5 74 79 A G T 3 S+ 0 0 16 -2,-0.1 -23,-1.8 1,-0.1 2,-0.3 0.625 125.9 77.6 65.2 16.9 60.2 50.4 29.4 75 80 A A E < -IK 50 72C 17 -3,-2.4 -3,-2.6 -25,-0.3 2,-0.5 -0.992 61.2-144.7-156.9 162.2 59.3 47.1 31.0 76 81 A L E -IK 49 71C 0 -27,-2.3 -27,-2.8 -2,-0.3 2,-0.6 -0.990 26.2-159.2-125.5 114.5 56.8 44.5 32.3 77 82 A V E -IK 48 70C 13 -7,-3.0 -7,-1.9 -2,-0.5 2,-0.5 -0.885 5.8-167.3-104.1 116.8 58.1 42.7 35.3 78 83 A I E -IK 47 69C 0 -31,-2.9 -31,-3.0 -2,-0.6 -9,-0.2 -0.902 9.2-164.7-108.7 123.6 56.4 39.4 36.1 79 84 A S + 0 0 44 -11,-2.8 -11,-0.2 -2,-0.5 -34,-0.1 -0.551 53.7 26.4-106.2 168.5 57.0 37.7 39.4 80 85 A N S S+ 0 0 128 -36,-0.2 -1,-0.2 -2,-0.2 -12,-0.1 0.874 75.5 166.7 51.4 55.4 56.6 34.3 41.1 81 86 A L - 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0 0 9 203,-3.1 205,-0.4 -2,-0.6 3,-0.1 -0.618 18.0-170.8 -82.9 128.0 89.5 72.2 8.5 628 633 A D > - 0 0 34 -2,-0.4 4,-2.3 1,-0.1 5,-0.2 -0.872 9.2-176.0-113.5 91.2 89.0 75.3 6.3 629 634 A P H > S+ 0 0 4 0, 0.0 4,-2.0 0, 0.0 161,-0.3 0.792 79.1 51.6 -60.8 -31.5 85.9 74.1 4.3 630 635 A I H > S+ 0 0 44 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.935 110.6 47.2 -73.1 -44.6 85.8 77.2 2.1 631 636 A A H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.916 112.9 51.1 -60.7 -42.6 89.5 77.0 1.1 632 637 A I H X S+ 0 0 2 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.932 111.1 46.5 -61.4 -46.8 89.1 73.3 0.4 633 638 A A H X S+ 0 0 30 -4,-2.0 4,-1.8 1,-0.2 -1,-0.2 0.911 115.5 45.2 -63.6 -43.3 86.1 73.8 -1.9 634 639 A E H X S+ 0 0 105 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.871 113.1 50.3 -70.1 -35.3 87.7 76.6 -3.8 635 640 A V H X S+ 0 0 7 -4,-2.5 4,-2.8 -5,-0.2 5,-0.2 0.883 107.5 54.3 -69.3 -36.9 91.0 74.8 -4.2 636 641 A R H X S+ 0 0 70 -4,-2.3 4,-1.9 -5,-0.2 -2,-0.2 0.925 112.4 43.5 -63.1 -41.8 89.2 71.7 -5.5 637 642 A E H X S+ 0 0 56 -4,-1.8 4,-2.7 2,-0.2 -2,-0.2 0.913 113.3 51.3 -69.0 -41.3 87.5 73.8 -8.1 638 643 A A H X S+ 0 0 30 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.895 110.3 49.1 -62.1 -40.3 90.8 75.7 -8.9 639 644 A L H X S+ 0 0 8 -4,-2.8 4,-2.3 2,-0.2 5,-0.2 0.900 111.2 50.2 -65.4 -40.1 92.6 72.4 -9.3 640 645 A T H X S+ 0 0 11 -4,-1.9 4,-2.2 -5,-0.2 -2,-0.2 0.926 111.9 47.9 -63.4 -44.4 89.8 71.1 -11.6 641 646 A R H X S+ 0 0 104 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.893 111.3 49.9 -64.0 -42.1 90.0 74.3 -13.7 642 647 A T H X S+ 0 0 45 -4,-2.5 4,-2.7 2,-0.2 5,-0.2 0.925 113.6 44.3 -65.0 -44.8 93.8 74.2 -14.0 643 648 A L H X S+ 0 0 3 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.879 111.2 56.0 -67.3 -34.9 93.9 70.5 -15.1 644 649 A A H < S+ 0 0 3 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.891 112.4 42.1 -62.5 -40.1 91.0 71.3 -17.5 645 650 A T H >< S+ 0 0 96 -4,-2.0 3,-0.9 2,-0.2 4,-0.2 0.938 116.7 45.5 -72.6 -48.7 93.1 74.0 -19.1 646 651 A E H 3< S+ 0 0 101 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.751 124.6 33.5 -67.7 -25.6 96.4 72.1 -19.2 647 652 A L T 3X S+ 0 0 2 -4,-2.1 4,-3.2 -5,-0.2 5,-0.3 0.158 78.0 125.7-117.4 18.6 94.7 68.9 -20.5 648 653 A A H <> S+ 0 0 42 -3,-0.9 4,-1.8 1,-0.2 5,-0.2 0.856 78.6 41.0 -44.4 -51.6 91.9 70.4 -22.7 649 654 A D H > S+ 0 0 133 -4,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.920 116.9 47.1 -67.8 -45.2 92.9 68.5 -25.9 650 655 A E H > S+ 0 0 36 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.894 110.9 53.2 -63.9 -40.5 93.7 65.2 -24.2 651 656 A L H X S+ 0 0 0 -4,-3.2 4,-2.2 1,-0.2 -1,-0.2 0.913 110.7 45.9 -61.7 -43.8 90.5 65.3 -22.2 652 657 A L H X S+ 0 0 68 -4,-1.8 4,-2.4 -5,-0.3 5,-0.2 0.890 111.0 53.4 -67.6 -38.6 88.3 65.8 -25.3 653 658 A A H X S+ 0 0 54 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.930 113.4 41.9 -61.7 -46.2 90.2 63.1 -27.2 654 659 A I H X S+ 0 0 29 -4,-2.4 4,-1.4 2,-0.2 -1,-0.2 0.853 111.1 57.1 -70.4 -34.7 89.6 60.6 -24.4 655 660 A Y H < S+ 0 0 8 -4,-2.2 3,-0.2 -5,-0.2 -2,-0.2 0.934 113.4 39.8 -60.4 -46.6 86.0 61.8 -23.9 656 661 A N H >< S+ 0 0 92 -4,-2.4 3,-1.6 1,-0.2 -2,-0.2 0.878 110.0 59.0 -71.2 -38.2 85.2 61.1 -27.6 657 662 A A H 3< S+ 0 0 70 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.772 105.6 50.5 -62.7 -27.0 87.2 57.8 -27.7 658 663 A N T 3< S+ 0 0 17 -4,-1.4 -1,-0.3 -3,-0.2 18,-0.2 0.238 77.3 133.1 -98.6 14.5 85.1 56.3 -25.0 659 664 A Y < - 0 0 141 -3,-1.6 2,-0.4 17,-0.1 -3,-0.1 -0.396 36.7-166.1 -63.5 140.0 81.7 57.1 -26.5 660 665 A Q - 0 0 27 1,-0.1 -2,-0.1 -2,-0.1 -1,-0.0 -0.971 18.1-169.0-134.9 117.8 79.4 54.1 -26.5 661 666 A S S S+ 0 0 75 -2,-0.4 2,-0.3 2,-0.0 -1,-0.1 0.896 77.9 62.6 -71.5 -40.5 76.2 54.0 -28.5 662 667 A E S S- 0 0 113 2,-0.0 2,-0.6 1,-0.0 41,-0.0 -0.662 80.1-140.1 -86.2 140.2 74.9 50.9 -26.7 663 668 A Y + 0 0 32 -2,-0.3 2,-0.4 40,-0.1 -388,-0.1 -0.905 28.7 170.5-103.2 122.9 74.2 51.1 -23.0 664 669 A R - 0 0 95 -2,-0.6 2,-1.6 2,-0.1 -2,-0.0 -0.996 38.8-141.0-134.6 137.6 75.2 48.0 -21.0 665 670 A V + 0 0 39 -2,-0.4 2,-0.4 4,-0.1 -2,-0.0 -0.606 66.4 123.7 -92.2 69.9 75.4 47.4 -17.3 666 671 A E S > S- 0 0 110 -2,-1.6 4,-2.8 1,-0.1 3,-0.5 -0.992 71.3-118.9-133.2 138.2 78.6 45.4 -17.9 667 672 A H H > S+ 0 0 69 -2,-0.4 4,-2.2 1,-0.2 5,-0.1 0.792 110.2 50.6 -50.2 -40.5 82.0 46.2 -16.2 668 673 A E H > S+ 0 0 167 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.924 115.9 43.7 -66.6 -40.4 84.0 47.0 -19.3 669 674 A D H > S+ 0 0 16 -3,-0.5 4,-2.4 2,-0.2 -2,-0.2 0.892 111.7 53.1 -68.5 -41.6 81.3 49.4 -20.5 670 675 A I H X S+ 0 0 14 -4,-2.8 4,-2.6 1,-0.2 -1,-0.2 0.900 107.8 52.6 -61.4 -39.5 80.9 50.9 -17.1 671 676 A A H X S+ 0 0 11 -4,-2.2 4,-2.2 -5,-0.2 -2,-0.2 0.936 110.4 45.8 -62.0 -48.7 84.7 51.5 -17.0 672 677 A K H X S+ 0 0 72 -4,-1.8 4,-2.6 1,-0.2 -1,-0.2 0.892 115.2 47.8 -62.2 -39.8 84.7 53.4 -20.3 673 678 A R H X S+ 0 0 5 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.874 109.7 51.9 -69.7 -37.6 81.7 55.4 -19.3 674 679 A T H X S+ 0 0 43 -4,-2.6 4,-1.5 -5,-0.2 -2,-0.2 0.897 112.6 46.8 -65.9 -38.0 83.2 56.3 -15.9 675 680 A L H X S+ 0 0 12 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.929 111.2 50.9 -68.2 -45.3 86.3 57.5 -17.7 676 681 A R H X S+ 0 0 24 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.928 114.1 44.0 -58.0 -45.4 84.3 59.4 -20.3 677 682 A N H X S+ 0 0 14 -4,-2.6 4,-1.5 2,-0.2 -1,-0.2 0.764 107.6 58.7 -73.3 -24.2 82.4 61.2 -17.5 678 683 A A H X S+ 0 0 0 -4,-1.5 4,-0.8 2,-0.2 -1,-0.2 0.904 108.8 46.6 -68.4 -39.5 85.5 61.7 -15.5 679 684 A C H >X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 3,-0.7 0.889 105.9 59.9 -66.9 -38.9 86.8 63.7 -18.5 680 685 A L H 3X S+ 0 0 1 -4,-1.8 4,-2.0 1,-0.2 -1,-0.2 0.861 95.2 62.9 -57.9 -37.4 83.5 65.5 -18.7 681 686 A R H 3< S+ 0 0 121 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.891 110.9 38.1 -55.1 -42.1 84.0 66.9 -15.2 682 687 A F H X< S+ 0 0 8 -4,-0.8 3,-2.2 -3,-0.7 -2,-0.2 0.904 111.4 57.0 -75.9 -44.2 87.1 68.8 -16.4 683 688 A L H >< S+ 0 0 21 -4,-2.5 3,-1.9 1,-0.3 -2,-0.2 0.784 93.9 69.7 -58.8 -26.7 85.7 69.7 -19.8 684 689 A A T 3< S+ 0 0 2 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.722 97.9 52.5 -63.3 -20.3 82.8 71.4 -18.0 685 690 A F T < S+ 0 0 22 -3,-2.2 -1,-0.3 -4,-0.2 -2,-0.2 0.143 90.7 100.1-102.2 17.6 85.4 74.0 -16.9 686 691 A G S < S- 0 0 32 -3,-1.9 -41,-0.1 1,-0.3 6,-0.1 -0.010 94.2 -28.5 -84.8-162.9 86.7 74.7 -20.3 687 692 A E S > S- 0 0 115 1,-0.1 4,-3.2 4,-0.1 5,-0.3 -0.297 71.6-122.9 -51.6 124.2 85.8 77.7 -22.5 688 693 A T H > S+ 0 0 82 1,-0.2 4,-3.3 2,-0.2 5,-0.2 0.847 106.4 42.2 -37.2 -63.1 82.3 78.6 -21.4 689 694 A H H > S+ 0 0 131 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.923 117.3 48.3 -56.2 -46.5 80.5 78.3 -24.7 690 695 A L H > S+ 0 0 112 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.920 115.9 43.9 -59.7 -46.0 82.4 75.2 -25.7 691 696 A A H X S+ 0 0 2 -4,-3.2 4,-2.7 1,-0.2 5,-0.3 0.899 111.1 54.0 -66.6 -42.6 81.7 73.6 -22.3 692 697 A D H X S+ 0 0 32 -4,-3.3 4,-2.3 -5,-0.3 5,-0.2 0.887 110.8 46.2 -60.3 -41.2 78.0 74.7 -22.3 693 698 A V H X S+ 0 0 71 -4,-2.2 4,-2.3 -5,-0.2 -1,-0.2 0.931 113.4 48.2 -67.8 -46.8 77.4 73.1 -25.7 694 699 A L H X S+ 0 0 33 -4,-2.0 4,-2.0 -5,-0.2 -2,-0.2 0.924 116.0 43.4 -60.3 -47.6 79.2 69.8 -24.8 695 700 A V H X S+ 0 0 0 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.928 114.8 47.3 -66.4 -47.2 77.4 69.4 -21.5 696 701 A S H X S+ 0 0 28 -4,-2.3 4,-2.2 -5,-0.3 5,-0.2 0.892 110.9 54.8 -62.1 -38.1 73.9 70.4 -22.8 697 702 A K H X S+ 0 0 106 -4,-2.3 4,-2.5 -5,-0.2 5,-0.2 0.927 108.1 47.0 -61.5 -46.8 74.5 68.0 -25.7 698 703 A Q H X S+ 0 0 8 -4,-2.0 4,-1.7 1,-0.2 -1,-0.2 0.899 110.5 52.8 -64.3 -39.9 75.2 65.0 -23.5 699 704 A F H < S+ 0 0 29 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.926 116.4 38.7 -60.8 -45.5 72.2 65.7 -21.2 700 705 A H H < S+ 0 0 100 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.813 121.3 42.5 -76.4 -31.8 69.8 65.8 -24.2 701 706 A E H < S+ 0 0 121 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.590 83.4 121.6 -91.6 -12.2 71.4 62.9 -26.2 702 707 A A < - 0 0 30 -4,-1.7 3,-0.1 -5,-0.2 -3,-0.0 -0.217 44.5-165.2 -54.1 136.6 72.0 60.6 -23.3 703 708 A N S S+ 0 0 87 -42,-0.0 2,-0.3 -41,-0.0 -1,-0.1 0.038 74.3 39.1-111.4 24.4 70.3 57.2 -23.7 704 709 A N S > S- 0 0 8 -428,-0.1 4,-1.5 1,-0.0 -428,-0.2 -0.960 84.6-113.5-164.2 155.7 70.7 56.3 -20.0 705 710 A M H > S+ 0 0 4 -430,-2.8 4,-3.0 -427,-0.5 5,-0.3 0.755 108.0 67.0 -69.7 -24.9 70.6 58.1 -16.6 706 711 A T H > S+ 0 0 18 -428,-0.4 4,-1.9 -431,-0.3 -1,-0.2 0.962 108.7 37.0 -60.0 -50.8 74.3 57.7 -15.9 707 712 A D H > S+ 0 0 15 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.848 116.7 53.1 -70.8 -34.2 75.2 60.0 -18.8 708 713 A A H X S+ 0 0 14 -4,-1.5 4,-2.5 2,-0.2 -2,-0.2 0.948 112.2 44.0 -65.9 -47.5 72.3 62.4 -18.2 709 714 A L H X S+ 0 0 31 -4,-3.0 4,-3.0 1,-0.2 5,-0.2 0.867 109.5 56.6 -66.3 -35.9 73.1 62.9 -14.5 710 715 A A H X S+ 0 0 23 -4,-1.9 4,-1.8 -5,-0.3 -1,-0.2 0.922 111.0 44.5 -61.2 -42.5 76.8 63.3 -15.3 711 716 A A H X S+ 0 0 0 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.932 113.9 48.7 -67.1 -46.5 76.0 66.2 -17.6 712 717 A L H X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.914 110.8 51.4 -60.4 -42.5 73.5 67.7 -15.2 713 718 A S H X S+ 0 0 39 -4,-3.0 4,-3.0 1,-0.2 -1,-0.2 0.874 109.2 50.5 -62.2 -38.5 76.0 67.5 -12.4 714 719 A A H X S+ 0 0 6 -4,-1.8 4,-2.5 2,-0.2 6,-0.2 0.876 106.5 54.7 -67.8 -38.5 78.7 69.2 -14.6 715 720 A A H <>S+ 0 0 0 -4,-2.1 5,-2.0 2,-0.2 4,-0.3 0.901 114.3 41.2 -61.4 -41.2 76.3 72.0 -15.4 716 721 A V H ><5S+ 0 0 5 -4,-1.9 3,-0.9 3,-0.2 -2,-0.2 0.934 113.5 52.5 -72.2 -46.8 75.7 72.6 -11.7 717 722 A A H 3<5S+ 0 0 43 -4,-3.0 -2,-0.2 1,-0.3 -3,-0.2 0.885 119.7 33.7 -57.0 -42.7 79.4 72.2 -10.7 718 723 A A T 3<5S- 0 0 11 -4,-2.5 -1,-0.3 -5,-0.1 -2,-0.2 0.360 103.6-127.1 -96.5 4.9 80.6 74.7 -13.3 719 724 A Q T < 5 - 0 0 93 -3,-0.9 -3,-0.2 -4,-0.3 -4,-0.1 0.916 42.7-173.3 48.5 49.5 77.6 77.0 -13.0 720 725 A L > < - 0 0 11 -5,-2.0 3,-1.8 -6,-0.2 4,-0.3 -0.310 36.6-109.0 -72.9 156.2 77.2 76.8 -16.8 721 726 A P T 3 S+ 0 0 91 0, 0.0 3,-0.4 0, 0.0 4,-0.4 0.851 117.6 54.7 -52.6 -37.8 74.6 78.9 -18.7 722 727 A C T 3> S+ 0 0 12 1,-0.2 4,-2.5 2,-0.1 3,-0.3 0.581 81.2 97.5 -75.3 -9.6 72.4 75.8 -19.5 723 728 A R H <> S+ 0 0 53 -3,-1.8 4,-2.8 -8,-0.3 5,-0.2 0.894 81.6 45.3 -46.0 -59.9 72.2 74.8 -15.8 724 729 A D H > S+ 0 0 108 -3,-0.4 4,-1.9 -4,-0.3 -1,-0.2 0.872 114.3 49.8 -57.0 -39.1 68.8 76.3 -14.9 725 730 A A H > S+ 0 0 51 -4,-0.4 4,-2.3 -3,-0.3 -1,-0.2 0.943 113.0 45.6 -65.7 -47.5 67.2 75.0 -18.1 726 731 A L H X S+ 0 0 1 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.904 112.1 51.5 -63.3 -42.0 68.5 71.5 -17.6 727 732 A M H X S+ 0 0 10 -4,-2.8 4,-2.1 -5,-0.3 -1,-0.2 0.889 112.0 46.3 -63.5 -38.6 67.5 71.5 -13.9 728 733 A Q H X S+ 0 0 95 -4,-1.9 4,-3.0 -5,-0.2 -1,-0.2 0.898 111.1 52.3 -70.5 -39.0 63.9 72.6 -14.8 729 734 A E H X S+ 0 0 81 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.894 110.4 48.3 -62.4 -40.4 63.7 70.0 -17.6 730 735 A Y H X S+ 0 0 3 -4,-2.3 4,-2.8 2,-0.2 -1,-0.2 0.926 112.2 49.5 -65.1 -45.8 64.7 67.3 -15.1 731 736 A D H X S+ 0 0 7 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.946 111.0 48.8 -58.3 -51.1 62.2 68.5 -12.6 732 737 A D H < S+ 0 0 95 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.847 117.7 41.7 -59.7 -34.6 59.4 68.6 -15.1 733 738 A K H < S+ 0 0 133 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.833 128.5 24.2 -83.1 -33.2 60.2 65.1 -16.3 734 739 A W H >< S+ 0 0 14 -4,-2.8 3,-2.8 -5,-0.2 7,-0.3 0.399 77.6 112.6-117.7 4.2 60.9 63.3 -13.0 735 740 A H T 3< S+ 0 0 70 -4,-2.2 -1,-0.1 1,-0.3 -3,-0.1 0.757 80.0 57.8 -50.5 -27.6 59.1 65.2 -10.2 736 741 A Q T 3 S+ 0 0 120 -5,-0.1 2,-0.7 -3,-0.1 -1,-0.3 0.577 94.3 76.0 -80.4 -8.8 56.7 62.2 -9.7 737 742 A N <> - 0 0 19 -3,-2.8 4,-2.6 1,-0.2 5,-0.2 -0.875 61.1-169.0-109.6 103.8 59.7 59.8 -9.0 738 743 A G H > S+ 0 0 20 -2,-0.7 4,-1.7 1,-0.2 -1,-0.2 0.899 85.8 50.4 -56.6 -48.7 61.2 60.3 -5.6 739 744 A L H > S+ 0 0 29 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.869 114.2 45.8 -60.3 -37.5 64.4 58.2 -6.1 740 745 A V H >> S+ 0 0 1 1,-0.2 3,-0.9 2,-0.2 4,-0.8 0.899 111.0 52.4 -73.0 -39.8 65.1 60.1 -9.3 741 746 A M H 3X S+ 0 0 0 -4,-2.6 4,-2.7 -7,-0.3 5,-0.2 0.768 95.2 71.1 -67.9 -23.1 64.4 63.4 -7.7 742 747 A D H 3X S+ 0 0 12 -4,-1.7 4,-2.2 1,-0.2 -1,-0.2 0.875 95.3 52.9 -60.2 -34.7 66.8 62.6 -4.9 743 748 A K H < S+ 0 0 37 -4,-2.2 3,-1.0 1,-0.2 -2,-0.2 0.926 113.4 47.7 -66.0 -43.5 70.8 71.5 -5.4 749 754 A A H 3< S+ 0 0 0 -4,-2.7 -2,-0.2 30,-0.3 -1,-0.2 0.779 116.2 42.3 -68.8 -29.6 72.2 70.9 -1.9 750 755 A T T 3< S+ 0 0 45 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.191 84.8 134.8-103.7 15.8 75.8 70.6 -3.1 751 756 A S < - 0 0 8 -3,-1.0 5,-0.1 -4,-0.2 -34,-0.1 -0.331 55.4-141.4 -66.5 143.5 75.7 73.5 -5.6 752 757 A P + 0 0 57 0, 0.0 -1,-0.1 0, 0.0 -35,-0.1 0.494 62.9 125.0 -83.1 -2.0 78.6 76.0 -5.6 753 758 A A S > S- 0 0 9 1,-0.1 3,-1.4 -37,-0.1 -37,-0.0 -0.244 70.0-125.8 -59.1 143.3 76.1 78.8 -6.2 754 759 A A T 3 S+ 0 0 109 1,-0.3 3,-0.3 2,-0.1 -1,-0.1 0.797 108.3 50.6 -61.0 -30.7 76.2 81.6 -3.6 755 760 A N T 3> S+ 0 0 76 1,-0.2 4,-2.1 2,-0.1 -1,-0.3 0.033 71.1 124.2 -99.0 28.2 72.5 81.3 -2.8 756 761 A V H <> S+ 0 0 11 -3,-1.4 4,-2.9 1,-0.2 5,-0.2 0.888 72.1 50.4 -55.6 -44.6 72.5 77.6 -2.2 757 762 A L H > S+ 0 0 30 -3,-0.3 4,-3.0 1,-0.2 5,-0.3 0.930 109.4 51.1 -62.0 -43.7 71.0 77.8 1.3 758 763 A E H > S+ 0 0 142 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.911 113.1 47.0 -58.0 -41.8 68.2 80.0 0.1 759 764 A T H X S+ 0 0 40 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.931 111.9 49.2 -66.2 -46.4 67.5 77.5 -2.6 760 765 A V H < S+ 0 0 0 -4,-2.9 4,-0.4 1,-0.2 -2,-0.2 0.924 111.0 49.8 -59.4 -46.4 67.7 74.5 -0.2 761 766 A R H >< S+ 0 0 92 -4,-3.0 3,-1.3 1,-0.2 -1,-0.2 0.907 110.4 51.3 -60.1 -41.1 65.3 76.2 2.2 762 767 A G H >< S+ 0 0 45 -4,-2.0 3,-1.8 -5,-0.3 -1,-0.2 0.851 100.0 63.6 -65.1 -33.6 62.9 76.9 -0.6 763 768 A L G >< S+ 0 0 17 -4,-1.9 3,-1.5 1,-0.3 -1,-0.3 0.571 79.5 81.4 -69.3 -7.9 63.0 73.3 -1.7 764 769 A L G < S+ 0 0 27 -3,-1.3 -1,-0.3 -4,-0.4 -2,-0.2 0.734 96.6 47.5 -67.0 -18.1 61.4 72.3 1.6 765 770 A Q G < S+ 0 0 163 -3,-1.8 -1,-0.3 -4,-0.2 -2,-0.2 0.317 85.8 125.6-102.0 4.9 58.2 73.3 -0.2 766 771 A H X - 0 0 25 -3,-1.5 3,-1.9 1,-0.1 -3,-0.0 -0.384 69.2-124.3 -67.8 142.7 59.0 71.4 -3.4 767 772 A R T 3 S+ 0 0 136 1,-0.3 -1,-0.1 -2,-0.1 -3,-0.0 0.737 111.3 51.1 -58.9 -24.8 56.3 69.0 -4.6 768 773 A S T 3 S+ 0 0 16 -5,-0.1 2,-0.3 -27,-0.1 -1,-0.3 0.462 99.0 83.1 -92.9 -2.7 58.8 66.2 -4.6 769 774 A F < + 0 0 16 -3,-1.9 2,-0.3 -6,-0.1 -5,-0.0 -0.773 47.9 165.6-105.4 149.0 60.0 66.8 -1.1 770 775 A T > - 0 0 55 -2,-0.3 3,-1.4 3,-0.2 7,-0.3 -0.930 37.3-141.2-160.2 135.3 58.5 65.7 2.3 771 776 A M T 3 S+ 0 0 29 -2,-0.3 -1,-0.0 1,-0.3 6,-0.0 0.566 100.1 71.1 -70.5 -8.9 59.8 65.6 5.9 772 777 A S T 3 S+ 0 0 50 1,-0.1 -1,-0.3 5,-0.0 -3,-0.0 0.567 87.7 72.2 -84.4 -8.5 58.0 62.3 6.2 773 778 A N <> - 0 0 4 -3,-1.4 4,-2.4 1,-0.1 3,-0.4 -0.921 65.7-155.7-116.5 115.5 60.5 60.4 4.0 774 779 A P H > S+ 0 0 2 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.816 95.9 55.3 -53.2 -36.3 64.0 59.7 5.2 775 780 A N H > S+ 0 0 8 -524,-0.3 4,-2.1 2,-0.2 5,-0.1 0.921 109.6 45.6 -66.1 -42.8 65.3 59.5 1.6 776 781 A R H > S+ 0 0 25 -3,-0.4 4,-1.7 2,-0.2 5,-0.4 0.929 113.2 51.0 -64.0 -45.5 64.1 63.0 0.8 777 782 A I H X>S+ 0 0 1 -4,-2.4 5,-2.1 -7,-0.3 4,-1.3 0.934 113.6 43.4 -57.4 -49.4 65.4 64.3 4.1 778 783 A R H <>S+ 0 0 75 -4,-2.6 5,-1.1 3,-0.2 -1,-0.2 0.844 112.0 53.4 -68.3 -33.5 68.9 62.9 3.5 779 784 A S H <5S+ 0 0 14 -4,-2.1 -30,-0.3 -5,-0.2 -1,-0.2 0.770 125.3 21.4 -74.3 -26.1 69.0 63.9 -0.2 780 785 A L H X5S+ 0 0 0 -4,-1.7 4,-1.4 -3,-0.2 -3,-0.2 0.839 137.1 23.8-104.2 -63.3 68.3 67.6 0.5 781 786 A I H X5S+ 0 0 1 -4,-1.3 4,-2.4 -5,-0.4 5,-0.3 0.929 126.3 47.0 -72.6 -47.3 69.1 68.4 4.1 782 787 A G H >XS+ 0 0 18 -5,-2.1 4,-2.8 1,-0.2 5,-0.5 0.901 112.1 51.0 -62.4 -41.1 71.6 65.7 4.8 783 788 A A H >X + 0 0 18 -4,-1.0 4,-3.0 -5,-0.4 3,-0.8 -0.482 60.6 157.1-128.6 60.6 78.4 70.8 1.2 789 794 A P H 3> S+ 0 0 12 0, 0.0 4,-2.7 0, 0.0 -159,-0.1 0.824 70.6 63.6 -56.3 -30.3 80.6 71.7 4.2 790 795 A A H 34 S+ 0 0 21 -161,-0.3 -160,-0.1 1,-0.2 -2,-0.1 0.916 113.9 32.1 -60.7 -42.1 81.6 75.0 2.5 791 796 A A H X4 S+ 0 0 19 -3,-0.8 3,-1.7 -7,-0.2 8,-0.3 0.867 117.1 55.2 -81.7 -39.4 78.0 76.2 2.6 792 797 A F H 3< S+ 0 0 1 -4,-3.0 8,-0.3 -8,-0.4 7,-0.2 0.886 111.8 46.6 -59.8 -37.2 77.1 74.4 5.9 793 798 A H T 3< S+ 0 0 3 -4,-2.7 -1,-0.3 -5,-0.3 -2,-0.1 -0.053 80.3 158.2 -96.1 31.0 80.1 76.2 7.5 794 799 A A X - 0 0 24 -3,-1.7 3,-2.3 1,-0.1 5,-0.2 -0.299 51.9-119.5 -54.5 138.0 79.2 79.6 6.1 795 800 A E T 3 S+ 0 0 125 1,-0.3 -1,-0.1 2,-0.1 -4,-0.0 0.760 110.5 62.4 -54.3 -29.3 80.9 82.2 8.3 796 801 A D T 3 S- 0 0 116 1,-0.1 -1,-0.3 0, 0.0 -2,-0.1 0.576 108.5-123.0 -75.7 -7.0 77.6 83.8 9.2 797 802 A G S <> S+ 0 0 4 -3,-2.3 4,-1.9 3,-0.0 3,-0.3 0.561 70.8 133.7 78.7 8.4 76.5 80.5 10.8 798 803 A S H > + 0 0 31 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.822 67.3 58.0 -60.0 -33.0 73.4 80.3 8.7 799 804 A G H > S+ 0 0 0 -8,-0.3 4,-2.1 -5,-0.2 -1,-0.2 0.913 106.3 47.0 -65.2 -42.7 74.1 76.6 8.0 800 805 A Y H > S+ 0 0 2 -8,-0.3 4,-2.2 -3,-0.3 -2,-0.2 0.899 111.0 52.0 -66.2 -40.9 74.1 75.7 11.6 801 806 A L H X S+ 0 0 113 -4,-1.9 4,-1.8 2,-0.2 -1,-0.2 0.891 109.1 50.8 -62.9 -39.8 70.9 77.6 12.3 802 807 A F H X S+ 0 0 1 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.940 110.2 48.4 -63.1 -47.9 69.2 75.8 9.4 803 808 A L H X S+ 0 0 1 -4,-2.1 4,-2.9 1,-0.2 5,-0.2 0.882 107.9 55.6 -61.6 -37.7 70.2 72.4 10.6 804 809 A V H X S+ 0 0 3 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.915 106.9 50.2 -61.4 -41.3 69.0 73.2 14.1 805 810 A E H X S+ 0 0 103 -4,-1.8 4,-1.1 1,-0.2 -1,-0.2 0.936 113.4 45.4 -61.5 -46.2 65.5 74.1 12.7 806 811 A M H X S+ 0 0 8 -4,-2.1 4,-2.7 1,-0.2 3,-0.3 0.903 113.3 49.0 -64.8 -42.0 65.4 70.8 10.8 807 812 A L H X S+ 0 0 0 -4,-2.9 4,-2.4 1,-0.2 -1,-0.2 0.779 102.2 62.4 -69.7 -26.4 66.6 68.7 13.8 808 813 A T H < S+ 0 0 56 -4,-1.8 4,-0.5 -5,-0.2 -1,-0.2 0.875 112.0 39.0 -65.2 -35.0 64.1 70.4 16.1 809 814 A D H >X S+ 0 0 55 -4,-1.1 4,-2.0 -3,-0.3 3,-1.1 0.960 118.0 46.7 -75.9 -56.1 61.4 68.8 13.8 810 815 A L H 3X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.3 8,-0.3 0.756 97.3 71.0 -61.5 -28.0 63.1 65.5 13.3 811 816 A N H 3< S+ 0 0 4 -4,-2.4 -1,-0.3 1,-0.2 -2,-0.1 0.886 112.8 30.1 -56.4 -37.8 64.0 64.9 16.9 812 817 A S H <4 S+ 0 0 83 -3,-1.1 -2,-0.2 -4,-0.5 -1,-0.2 0.841 125.9 44.6 -88.3 -37.6 60.3 64.3 17.6 813 818 A R H < S- 0 0 79 -4,-2.0 -3,-0.2 1,-0.2 -2,-0.2 0.952 133.8 -4.7 -73.2 -53.6 59.4 62.9 14.2 814 819 A N X - 0 0 5 -4,-2.0 4,-2.1 -5,-0.1 3,-0.4 -0.714 58.3-173.1-149.8 88.5 62.2 60.4 13.4 815 820 A P H > S+ 0 0 23 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.825 84.9 57.9 -52.9 -37.5 65.1 60.3 15.9 816 821 A Q H > S+ 0 0 21 -716,-0.2 4,-1.4 2,-0.2 5,-0.1 0.923 109.5 41.7 -64.2 -44.1 67.1 57.9 13.8 817 822 A V H > S+ 0 0 4 -3,-0.4 4,-2.1 1,-0.2 -1,-0.2 0.876 113.4 55.4 -70.6 -32.8 67.2 60.2 10.7 818 823 A A H X S+ 0 0 0 -4,-2.1 4,-1.4 -8,-0.3 -2,-0.2 0.918 106.1 51.2 -62.7 -42.2 67.8 63.2 13.1 819 824 A S H X S+ 0 0 3 -4,-2.6 4,-0.6 1,-0.2 -1,-0.2 0.838 107.9 51.7 -65.5 -33.1 70.8 61.4 14.5 820 825 A R H >< S+ 0 0 112 -4,-1.4 3,-0.8 1,-0.2 -1,-0.2 0.928 111.7 48.6 -67.6 -42.1 72.3 60.8 11.0 821 826 A L H 3< S+ 0 0 7 -4,-2.1 4,-0.2 1,-0.2 -2,-0.2 0.687 101.3 61.9 -72.0 -21.0 71.8 64.5 10.2 822 827 A I H >X S+ 0 0 0 -4,-1.4 3,-1.5 1,-0.2 4,-1.1 0.692 77.4 92.5 -80.8 -15.5 73.5 65.8 13.4 823 828 A E G X< S+ 0 0 25 -3,-0.8 3,-0.7 -4,-0.6 4,-0.4 0.847 79.4 56.2 -46.1 -46.5 76.8 64.2 12.6 824 829 A P G >4 S+ 0 0 23 0, 0.0 3,-0.8 0, 0.0 -1,-0.3 0.845 105.5 53.7 -58.3 -30.6 78.2 67.3 10.8 825 830 A L G X4 S+ 0 0 0 -3,-1.5 3,-0.9 -4,-0.2 -2,-0.2 0.777 99.0 60.5 -75.2 -27.5 77.6 69.4 13.8 826 831 A I G << S+ 0 0 1 -4,-1.1 3,-0.4 -3,-0.7 -1,-0.2 0.488 88.0 74.6 -81.4 1.2 79.5 67.2 16.2 827 832 A R G X + 0 0 47 -3,-0.8 3,-2.4 -4,-0.4 -1,-0.2 0.233 60.1 123.0 -93.2 13.1 82.7 67.7 14.3 828 833 A L G X + 0 0 1 -3,-0.9 3,-2.1 1,-0.3 -1,-0.2 0.762 59.5 64.8 -46.8 -38.0 83.1 71.2 15.7 829 834 A K G 3 S+ 0 0 113 -3,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.630 92.0 65.5 -66.8 -9.8 86.5 70.8 17.3 830 835 A R G < S+ 0 0 34 -3,-2.4 -203,-3.1 -204,-0.1 -1,-0.3 0.489 98.1 71.6 -86.6 -3.4 88.0 70.3 13.8 831 836 A Y S < S- 0 0 16 -3,-2.1 -203,-0.1 -205,-0.2 5,-0.0 -0.604 92.8 -79.6-112.1 170.5 87.1 73.9 13.0 832 837 A D > - 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0 0 38 -3,-1.8 3,-0.8 -4,-0.1 2,-0.2 -0.303 65.9-112.4 -63.2 142.9 64.8 70.6 23.4 850 855 A E T 3 S+ 0 0 166 1,-0.3 3,-0.1 2,-0.0 -1,-0.1 -0.526 102.4 13.8 -72.5 142.8 61.7 69.3 25.1 851 856 A N T 3 S- 0 0 128 1,-0.2 -1,-0.3 -2,-0.2 2,-0.3 0.913 87.3-167.0 56.9 45.7 61.4 65.5 24.7 852 857 A L < - 0 0 42 -3,-0.8 -1,-0.2 -5,-0.1 -40,-0.0 -0.488 19.8-121.2 -66.5 127.7 65.0 65.2 23.5 853 858 A S > - 0 0 15 -2,-0.3 4,-2.6 -3,-0.1 5,-0.1 -0.322 8.9-125.5 -69.7 152.1 65.6 61.8 22.0 854 859 A G H > S+ 0 0 23 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.854 110.2 64.2 -64.2 -32.5 68.2 59.5 23.4 855 860 A D H > S+ 0 0 16 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.935 112.2 32.2 -55.2 -51.2 69.6 59.2 19.8 856 861 A L H > S+ 0 0 0 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.861 112.7 62.7 -76.5 -36.5 70.5 62.9 19.8 857 862 A Y H X S+ 0 0 101 -4,-2.6 4,-2.5 1,-0.2 5,-0.3 0.914 101.7 52.2 -54.5 -46.3 71.2 63.2 23.5 858 863 A E H X S+ 0 0 0 -4,-2.3 4,-1.6 1,-0.2 -1,-0.2 0.922 115.6 39.4 -58.4 -46.0 74.1 60.7 23.2 859 864 A K H X S+ 0 0 10 -4,-1.0 4,-2.3 -5,-0.2 -2,-0.2 0.886 114.8 51.8 -73.2 -39.7 75.8 62.6 20.4 860 865 A I H X S+ 0 0 1 -4,-3.1 4,-2.0 2,-0.2 -2,-0.2 0.923 109.0 51.2 -63.2 -44.6 75.1 66.1 21.8 861 866 A T H X S+ 0 0 42 -4,-2.5 4,-0.7 -5,-0.3 -1,-0.2 0.930 112.4 45.4 -59.7 -46.4 76.6 65.2 25.1 862 867 A K H >< S+ 0 0 54 -4,-1.6 3,-0.6 -5,-0.3 -1,-0.2 0.898 112.6 51.6 -65.0 -39.0 79.8 63.8 23.6 863 868 A A H 3< S+ 0 0 1 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.813 112.3 45.3 -67.9 -31.2 80.1 66.8 21.3 864 869 A L H 3< 0 0 29 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.477 360.0 360.0 -92.1 -3.3 79.7 69.4 24.1 865 870 A A << 0 0 112 -4,-0.7 -3,-0.0 -3,-0.6 -4,-0.0 -0.341 360.0 360.0 -70.7 360.0 82.1 67.6 26.4