==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL TRANSPORT 23-DEC-03 1RYX . COMPND 2 MOLECULE: OVOTRANSFERRIN; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR J.K.DATTAGUPTA,P.G.THAKURTA,D.CHOUDHURY,R.DASGUPTA . 686 1 15 15 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32733.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 360 52.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 3 0.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 42 6.1 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 . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 2 0.3 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 . 63 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 75 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 115 16.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 1.7 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 6 3 1 3 2 3 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 8 3 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 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 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 A 0 0 163 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 146.6 19.1 86.0 48.3 2 2 A P - 0 0 111 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.769 360.0 -47.7-104.3 -90.3 16.0 85.7 46.1 3 3 A P S S+ 0 0 78 0, 0.0 2,-0.3 0, 0.0 0, 0.0 -0.501 73.0 124.4-160.9 86.7 15.4 87.4 42.8 4 4 A K + 0 0 84 -2,-0.1 2,-0.2 28,-0.0 28,-0.2 -0.886 26.5 150.9-149.5 112.9 16.1 91.2 42.3 5 5 A S - 0 0 13 -2,-0.3 28,-0.6 26,-0.1 29,-0.0 -0.810 40.8-135.8-137.7 177.1 18.4 92.8 39.7 6 6 A V - 0 0 55 26,-0.3 28,-0.2 -2,-0.2 26,-0.0 -0.278 31.1-155.9-133.1 50.8 19.2 95.9 37.5 7 7 A I - 0 0 22 255,-0.4 2,-0.4 26,-0.2 48,-0.1 0.368 3.2-146.1 -22.8 150.2 20.2 94.6 33.9 8 8 A R - 0 0 27 26,-0.2 47,-1.6 45,-0.0 48,-0.3 -0.888 10.5-155.1-133.5 102.9 22.4 96.8 31.7 9 9 A W - 0 0 34 -2,-0.4 48,-0.1 11,-0.2 2,-0.1 -0.385 8.5-141.8 -75.0 153.5 21.7 96.6 27.9 10 10 A a - 0 0 4 46,-1.2 27,-0.3 1,-0.1 28,-0.1 -0.021 21.1-177.4 -94.8-154.6 24.5 97.4 25.4 11 11 A T - 0 0 18 30,-0.2 2,-0.2 28,-0.1 27,-0.2 -0.137 24.1-136.6-160.8-105.3 23.9 99.3 22.1 12 12 A I S S+ 0 0 46 1,-0.2 27,-0.2 25,-0.1 2,-0.2 -0.684 78.2 28.4 157.0 -92.6 25.7 100.5 18.9 13 13 A S S > S- 0 0 75 -2,-0.2 3,-0.6 281,-0.1 4,-0.4 -0.571 85.0-105.8 -95.3 162.6 24.8 104.0 17.7 14 14 A S T >> S+ 0 0 91 1,-0.2 3,-2.9 -2,-0.2 4,-0.9 0.903 108.0 65.0 -54.8 -55.8 23.6 106.9 20.0 15 15 A P H >> S+ 0 0 52 0, 0.0 4,-1.1 0, 0.0 3,-0.7 0.816 102.7 51.0 -38.2 -43.9 19.9 107.1 19.3 16 16 A E H <> S+ 0 0 6 -3,-0.6 4,-1.2 1,-0.2 -2,-0.2 0.599 97.3 66.8 -74.7 -14.5 19.3 103.6 20.7 17 17 A E H <4 S+ 0 0 19 -3,-2.9 -1,-0.2 -4,-0.4 19,-0.1 0.771 103.1 47.8 -76.6 -25.8 21.1 104.4 24.0 18 18 A K H X< S+ 0 0 59 -4,-0.9 3,-1.2 -3,-0.7 -2,-0.2 0.863 111.3 44.9 -82.3 -44.0 18.4 106.8 24.9 19 19 A K H >X S+ 0 0 28 -4,-1.1 3,-1.2 2,-0.3 4,-0.5 0.887 111.0 56.0 -65.3 -36.4 15.3 104.7 24.1 20 20 A b T 3< S+ 0 0 5 -4,-1.2 16,-0.3 1,-0.3 15,-0.3 0.402 114.6 41.4 -70.9 2.7 17.3 102.1 26.0 21 21 A N T <4 S+ 0 0 90 -3,-1.2 -2,-0.3 14,-0.1 -1,-0.3 0.321 100.1 71.9-128.3 -6.1 17.1 104.9 28.5 22 22 A N T <4 S+ 0 0 43 -3,-1.2 4,-0.2 -4,-0.2 -2,-0.2 0.458 105.5 37.7 -93.1 -3.2 13.5 105.9 27.9 23 23 A L S X S+ 0 0 34 -4,-0.5 4,-1.6 -5,-0.2 3,-0.3 0.562 86.5 95.2-116.5 -24.6 12.1 102.8 29.6 24 24 A R H > S+ 0 0 26 -5,-0.2 4,-0.9 1,-0.2 10,-0.3 0.538 80.9 65.0 -46.8 -6.9 14.7 102.6 32.4 25 25 A D H >> S+ 0 0 98 2,-0.2 3,-1.4 1,-0.1 4,-1.1 0.965 100.3 39.6 -82.3 -71.2 12.1 104.5 34.4 26 26 A L H 34 S+ 0 0 75 1,-0.3 -2,-0.2 -3,-0.3 -1,-0.1 0.743 109.0 71.1 -51.6 -20.7 9.2 102.1 34.8 27 27 A T H 3< S+ 0 0 12 -4,-1.6 3,-0.5 1,-0.1 -1,-0.3 0.967 97.2 46.4 -57.3 -55.5 12.1 99.8 35.2 28 28 A Q H << S+ 0 0 72 -3,-1.4 2,-4.0 -4,-0.9 -2,-0.2 0.971 110.9 51.4 -46.8 -78.6 12.8 101.4 38.6 29 29 A Q S < S+ 0 0 180 -4,-1.1 -1,-0.3 2,-0.0 2,-0.2 -0.248 109.1 66.9 -61.7 64.4 9.2 101.2 39.5 30 30 A E S S- 0 0 54 -2,-4.0 239,-0.0 -3,-0.5 0, 0.0 -0.756 100.4 -83.7 176.2 138.6 9.1 97.5 38.6 31 31 A R S S+ 0 0 223 -2,-0.2 2,-0.2 -27,-0.0 -26,-0.1 0.485 103.9 10.8 -14.2 -54.2 10.7 94.2 39.9 32 32 A I S S- 0 0 19 -28,-0.2 2,-0.3 -5,-0.1 -26,-0.3 -0.448 77.8-132.4-120.7-162.0 14.2 94.3 38.2 33 33 A S - 0 0 30 -28,-0.6 -26,-0.2 229,-0.2 2,-0.1 -0.920 10.2-144.0-154.8 178.4 16.1 96.9 36.3 34 34 A L - 0 0 35 -2,-0.3 -26,-0.2 -10,-0.3 -13,-0.1 -0.354 2.6-170.0-122.7-157.7 18.2 98.3 33.5 35 35 A T - 0 0 48 -15,-0.3 -14,-0.1 -2,-0.1 -15,-0.0 -0.094 32.0-128.8 157.4 91.4 21.0 100.7 32.9 36 36 A b - 0 0 24 -16,-0.3 2,-0.2 -28,-0.2 -26,-0.1 0.230 25.2-172.3 -48.4-179.1 21.6 101.5 29.2 37 37 A V - 0 0 35 -27,-0.3 2,-0.3 -20,-0.0 -25,-0.1 -0.832 3.4-162.8-176.0 138.4 25.1 101.3 27.7 38 38 A Q + 0 0 61 -2,-0.2 2,-0.3 -27,-0.2 -25,-0.1 -0.951 10.9 168.7-135.4 155.9 26.6 102.3 24.3 39 39 A K - 0 0 30 -2,-0.3 6,-0.2 -27,-0.2 -28,-0.1 -0.903 47.7-103.8-166.6 134.1 29.7 101.5 22.2 40 40 A A S S+ 0 0 92 -2,-0.3 2,-0.3 4,-0.1 -1,-0.1 0.684 99.5 39.0 -28.6 -35.6 30.8 102.1 18.6 41 41 A T > - 0 0 52 1,-0.1 4,-1.3 -3,-0.0 -30,-0.2 -0.881 66.7-133.5-134.7 162.4 30.1 98.5 17.7 42 42 A Y H > S+ 0 0 25 -2,-0.3 4,-1.8 2,-0.2 -1,-0.1 0.675 117.3 51.3 -70.8 -17.8 28.0 95.5 18.1 43 43 A L H > S+ 0 0 97 2,-0.2 4,-3.1 3,-0.1 5,-0.3 0.942 101.6 51.3 -83.5 -60.6 31.4 93.9 18.6 44 44 A D H > S+ 0 0 96 1,-0.2 4,-2.9 2,-0.2 -2,-0.2 0.832 113.3 55.9 -47.9 -29.3 32.9 96.1 21.3 45 45 A a H X S+ 0 0 0 -4,-1.3 4,-2.0 2,-0.2 -2,-0.2 0.997 103.7 46.1 -66.6 -66.6 29.6 95.3 22.9 46 46 A I H X S+ 0 0 3 -4,-1.8 4,-1.6 2,-0.3 3,-0.3 0.883 115.3 50.1 -44.5 -43.3 29.8 91.5 22.8 47 47 A K H >X S+ 0 0 14 -4,-3.1 3,-1.6 1,-0.3 4,-1.1 0.998 106.9 54.5 -54.8 -63.2 33.3 91.9 24.1 48 48 A A H 3<>S+ 0 0 17 -4,-2.9 6,-1.3 1,-0.3 5,-0.8 0.730 106.3 54.7 -38.8 -33.6 31.9 94.2 26.7 49 49 A I H ><5S+ 0 0 2 -4,-2.0 3,-0.7 -3,-0.3 -1,-0.3 0.842 103.6 49.6 -76.5 -36.0 29.5 91.3 27.7 50 50 A A H <<5S+ 0 0 47 -3,-1.6 -1,-0.2 -4,-1.6 -2,-0.2 0.576 97.3 74.0 -77.9 -8.7 32.0 88.6 28.3 51 51 A N T 3<5S- 0 0 90 -4,-1.1 -1,-0.3 -3,-0.2 -2,-0.1 -0.028 116.3-111.7 -90.5 26.8 33.9 91.1 30.5 52 52 A N T < 5S+ 0 0 99 -3,-0.7 -3,-0.1 1,-0.1 -2,-0.1 0.469 95.8 110.6 55.6 -1.2 31.1 90.6 33.2 53 53 A E < + 0 0 128 -5,-0.8 -4,-0.2 -6,-0.2 -1,-0.1 0.994 68.9 23.6 -64.1 -71.7 30.4 94.2 32.1 54 54 A A - 0 0 25 -6,-1.3 -45,-0.2 -9,-0.2 201,-0.1 0.068 64.7-126.1 -89.0-163.8 27.1 94.3 30.2 55 55 A D - 0 0 10 -47,-1.6 200,-1.0 1,-0.3 2,-0.3 0.793 60.2 -46.7-110.0 -75.1 23.9 92.3 29.9 56 56 A A E -A 254 0A 0 -48,-0.3 -46,-1.2 198,-0.2 2,-0.3 -0.984 36.2-144.8-163.1 165.6 22.8 91.1 26.4 57 57 A I E -A 253 0A 7 196,-2.8 196,-2.3 -2,-0.3 2,-0.8 -0.949 23.6-124.2-147.1 123.0 22.3 92.3 22.8 58 58 A S - 0 0 21 -2,-0.3 2,-0.4 194,-0.3 194,-0.2 -0.491 43.8-177.3 -65.1 106.6 19.7 91.3 20.3 59 59 A L - 0 0 8 -2,-0.8 192,-1.2 190,-0.1 -2,-0.0 -0.927 16.3-141.8-118.2 137.2 22.0 90.1 17.4 60 60 A D > - 0 0 67 -2,-0.4 4,-3.5 190,-0.3 5,-0.3 0.183 50.5 -57.2 -75.3-166.2 21.1 88.9 13.9 61 61 A G H > S+ 0 0 28 2,-0.2 4,-1.7 1,-0.2 3,-0.3 0.907 133.6 29.5 -38.8 -78.7 22.6 86.1 11.8 62 62 A G H >> S+ 0 0 46 1,-0.2 4,-1.3 2,-0.2 3,-1.3 0.962 123.2 50.4 -49.5 -60.2 26.3 87.1 11.6 63 63 A Q H 3> S+ 0 0 52 1,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.811 108.9 53.8 -46.2 -39.4 26.2 88.9 15.0 64 64 A A H 3X S+ 0 0 5 -4,-3.5 4,-1.2 -3,-0.3 -1,-0.3 0.793 108.5 49.9 -68.4 -33.5 24.7 85.7 16.5 65 65 A F H X< S+ 0 0 10 -4,-1.7 3,-0.9 -3,-1.3 9,-0.2 0.989 113.1 40.2 -67.6 -78.4 27.4 83.5 15.2 66 66 A E H >< S+ 0 0 44 -4,-1.3 3,-0.6 1,-0.2 7,-0.3 0.825 104.6 74.4 -38.9 -41.7 30.5 85.4 16.3 67 67 A A H 3< S+ 0 0 0 -4,-1.7 2,-1.6 -5,-0.4 6,-0.8 0.912 100.6 39.5 -37.5 -69.0 28.6 86.1 19.5 68 68 A G T << S+ 0 0 1 -4,-1.2 -1,-0.3 -3,-0.9 2,-0.3 -0.552 94.9 117.5 -89.0 76.2 29.1 82.5 20.7 69 69 A L S X> S- 0 0 45 -2,-1.6 3,-1.3 -3,-0.6 4,-0.7 -0.826 72.6 -75.9-132.6 170.9 32.7 81.8 19.6 70 70 A A T 34 S+ 0 0 53 -2,-0.3 2,-2.4 1,-0.2 3,-0.5 0.139 116.1 42.6 -48.9-171.9 36.0 81.0 21.1 71 71 A P T 34 S+ 0 0 133 0, 0.0 -1,-0.2 0, 0.0 0, 0.0 0.084 137.8 13.9 54.2 -28.3 37.8 84.1 22.8 72 72 A Y T <4 S- 0 0 98 -2,-2.4 -2,-0.2 -3,-1.3 -4,-0.1 0.444 80.3-152.7-128.4 -88.5 34.3 84.9 24.2 73 73 A K < + 0 0 107 -6,-0.8 183,-0.4 -4,-0.7 -5,-0.3 0.765 21.6 170.2 97.2 97.3 31.5 82.4 24.1 74 74 A L - 0 0 5 -9,-0.2 181,-0.1 -8,-0.1 -1,-0.1 -0.871 9.0-171.1-130.4 164.8 27.9 83.8 24.0 75 75 A K E -B 254 0A 25 179,-1.4 179,-2.2 -2,-0.3 2,-0.2 -0.991 27.5 -92.7-155.0 159.0 24.5 82.3 23.4 76 76 A P E +B 253 0A 2 0, 0.0 177,-0.2 0, 0.0 3,-0.1 -0.503 28.8 169.1 -77.6 139.3 20.7 83.2 22.9 77 77 A I E S+ 0 0 13 175,-1.8 233,-0.3 1,-0.3 2,-0.2 -0.056 73.2 20.9-136.6 27.7 18.2 83.4 25.7 78 78 A A E - 0 0 2 231,-0.3 174,-0.6 174,-0.1 2,-0.3 -0.863 63.0-152.2 174.2 153.5 15.4 85.0 23.7 79 79 A A E -B 251 0A 5 -2,-0.2 229,-2.5 172,-0.2 2,-0.4 -0.947 22.8-121.0-150.3 126.8 14.3 85.3 20.1 80 80 A E E -C 307 0B 2 170,-1.3 227,-0.2 -2,-0.3 169,-0.2 -0.469 31.8-165.7 -66.2 115.5 12.2 87.9 18.2 81 81 A V E +C 306 0B 20 225,-0.7 224,-2.9 -2,-0.4 225,-0.8 -0.460 12.2 174.2 -92.0 174.3 9.2 86.1 16.8 82 82 A Y - 0 0 32 7,-1.0 7,-0.4 222,-0.3 2,-0.3 -0.615 27.4 -65.2-152.5-146.8 7.1 87.9 14.1 83 83 A E + 0 0 81 -2,-0.2 2,-0.2 220,-0.2 5,-0.1 -0.918 49.0 128.9-128.2 152.0 4.2 87.4 11.8 84 84 A H - 0 0 71 -2,-0.3 5,-0.1 3,-0.1 4,-0.0 -0.786 53.6-103.1-163.6-154.4 3.3 85.3 8.7 85 85 A T S S+ 0 0 150 -2,-0.2 3,-0.1 3,-0.1 -1,-0.0 0.539 97.6 54.5-127.4 -21.2 0.7 82.9 7.2 86 86 A E S S- 0 0 82 1,-0.2 2,-0.2 2,-0.0 3,-0.1 0.972 112.3 -34.6 -82.2 -81.6 2.2 79.3 7.6 87 87 A G S S- 0 0 54 1,-0.3 -1,-0.2 599,-0.0 -3,-0.1 -0.424 89.4 -49.7-125.1-157.5 3.3 78.4 11.1 88 88 A S - 0 0 81 -2,-0.2 2,-0.5 597,-0.1 -1,-0.3 -0.382 64.9-118.5 -75.0 164.1 4.8 80.4 14.0 89 89 A T + 0 0 30 -7,-0.4 -7,-1.0 1,-0.1 -1,-0.1 -0.884 57.9 130.8-125.5 119.2 7.7 82.5 13.1 90 90 A T S S+ 0 0 15 596,-0.7 2,-0.2 -2,-0.5 596,-0.1 -0.392 75.7 29.4-145.4 54.1 11.4 82.5 14.2 91 91 A S - 0 0 31 157,-0.3 157,-0.1 2,-0.0 159,-0.1 -0.713 59.7-131.3-167.5-143.8 13.1 82.5 10.8 92 92 A Y - 0 0 27 -2,-0.2 155,-1.4 157,-0.1 2,-0.1 -0.040 32.0-133.7 153.5 96.5 13.2 83.4 7.1 93 93 A Y E -D 246 0C 70 153,-0.2 117,-1.7 116,-0.1 2,-0.4 -0.358 14.9-145.2 -69.7 145.4 14.2 80.7 4.6 94 94 A A E +DE 245 209C 6 151,-1.8 150,-1.4 115,-0.2 151,-0.7 -0.886 22.6 172.6-114.2 143.0 16.7 81.3 1.8 95 95 A V - 0 0 8 113,-1.1 2,-0.4 -2,-0.4 113,-0.4 -0.846 32.8-135.6-142.3 178.7 16.6 79.9 -1.7 96 96 A A - 0 0 3 131,-0.3 131,-0.3 146,-0.3 111,-0.3 -0.921 30.0-158.2-140.0 106.4 18.0 79.7 -5.2 97 97 A V B -F 206 0D 5 109,-2.1 109,-0.7 -2,-0.4 2,-0.3 -0.133 8.4-171.2 -80.4 176.7 15.4 79.6 -7.9 98 98 A V - 0 0 4 127,-0.3 127,-0.5 107,-0.2 2,-0.2 -0.966 32.0 -96.7-162.8 157.4 15.7 78.4 -11.5 99 99 A K B -G 224 0E 45 105,-0.5 125,-0.4 125,-0.3 124,-0.1 -0.553 54.8 -97.8 -77.7 148.2 13.6 78.4 -14.7 100 100 A K S S+ 0 0 46 123,-3.8 -1,-0.1 122,-0.4 3,-0.1 0.155 110.5 50.8 -53.5-176.7 11.6 75.2 -15.2 101 101 A G S S- 0 0 79 1,-0.1 -1,-0.2 -3,-0.1 -2,-0.1 0.852 92.2-156.9 49.3 30.7 13.0 72.5 -17.4 102 102 A T - 0 0 41 1,-0.2 -1,-0.1 -4,-0.1 -2,-0.1 -0.033 17.4-153.4 -39.3 134.9 16.1 73.1 -15.2 103 103 A E S S+ 0 0 94 -3,-0.1 2,-0.3 -4,-0.1 -1,-0.2 0.108 73.1 34.6-101.8 20.3 19.2 72.0 -17.1 104 104 A F - 0 0 39 1,-0.1 -2,-0.0 5,-0.0 5,-0.0 -0.986 54.9-153.6-163.1 170.5 20.9 71.3 -13.8 105 105 A T - 0 0 52 -2,-0.3 -1,-0.1 122,-0.1 127,-0.1 0.679 57.8 -87.8-108.8 -89.7 20.8 70.2 -10.1 106 106 A V S S+ 0 0 33 125,-0.1 31,-0.1 123,-0.1 4,-0.0 -0.059 114.6 84.9-175.0 -1.9 23.4 71.6 -7.7 107 107 A N S S+ 0 0 137 1,-0.1 122,-0.0 2,-0.1 -3,-0.0 0.090 106.1 12.2-101.3 17.9 25.6 68.7 -8.7 108 108 A D S S+ 0 0 60 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 0.314 73.1 125.9-178.6 19.7 27.2 70.4 -11.7 109 109 A L > + 0 0 12 2,-0.1 2,-1.4 1,-0.1 3,-0.8 0.598 36.1 138.6 -67.3 -5.1 26.4 74.1 -11.9 110 110 A Q T 3 S+ 0 0 63 1,-0.2 46,-0.1 46,-0.1 -1,-0.1 -0.078 75.7 12.4 -41.8 77.2 30.2 74.4 -12.2 111 111 A G T 3 S+ 0 0 17 -2,-1.4 46,-1.3 1,-0.4 -1,-0.2 -0.266 89.3 116.7 151.2 -60.1 30.1 77.1 -14.9 112 112 A K S < S- 0 0 78 -3,-0.8 45,-0.4 44,-0.3 -1,-0.4 0.183 71.5 -92.7 -36.4 157.7 26.7 78.6 -15.4 113 113 A T - 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0 0 15 -229,-1.7 2,-1.3 -226,-0.1 -1,-0.4 -0.998 59.7-143.0-136.6 134.6 23.3 41.9 9.3 644 644 A L - 0 0 4 -2,-0.4 -231,-0.2 -231,-0.1 -230,-0.1 -0.629 29.8-154.4 -95.8 76.7 22.5 45.6 9.5 645 645 A F - 0 0 37 -2,-1.3 -233,-0.6 -233,-0.2 2,-0.5 -0.044 13.9-119.0 -47.5 150.7 19.6 45.7 7.1 646 646 A K B -K 411 0H 114 -235,-0.2 2,-0.3 -225,-0.2 -235,-0.2 -0.831 18.2-133.1 -99.4 130.2 18.9 49.0 5.3 647 647 A V - 0 0 56 -237,-1.5 4,-0.1 -2,-0.5 9,-0.0 -0.624 37.3 -95.5 -81.7 143.5 15.7 50.8 5.9 648 648 A R - 0 0 77 -2,-0.3 3,-0.5 2,-0.1 -1,-0.1 -0.233 46.8 -98.7 -58.6 139.2 14.0 52.0 2.7 649 649 A E S S+ 0 0 149 1,-0.2 -1,-0.1 -3,-0.1 3,-0.1 0.268 104.0 40.4 -45.3-177.1 14.6 55.7 1.7 650 650 A G S S+ 0 0 57 1,-0.1 -1,-0.2 0, 0.0 -2,-0.1 0.658 84.0 139.4 42.7 25.2 12.1 58.4 2.5 651 651 A T - 0 0 36 -3,-0.5 2,-0.3 -242,-0.1 -1,-0.1 -0.007 37.6-148.1 -79.0-167.5 11.4 56.8 6.0 652 652 A T > - 0 0 53 1,-0.1 4,-1.2 -3,-0.1 -244,-0.1 -0.951 31.1-101.6-156.0 169.9 11.0 58.9 9.1 653 653 A Y H > S+ 0 0 44 -2,-0.3 4,-0.7 -246,-0.2 5,-0.1 0.866 122.9 49.7 -68.7 -29.4 11.6 58.7 12.9 654 654 A K H >> S+ 0 0 99 1,-0.2 3,-2.7 2,-0.2 4,-2.3 0.999 104.7 54.3 -64.6 -72.7 7.9 57.9 13.2 655 655 A E H 34 S+ 0 0 108 1,-0.3 -1,-0.2 2,-0.2 -2,-0.2 0.639 103.9 54.3 -33.7 -38.8 7.5 55.2 10.6 656 656 A F H 3< S+ 0 0 39 -4,-1.2 -1,-0.3 1,-0.2 -2,-0.2 0.813 116.9 37.5 -73.7 -28.6 10.3 53.0 12.0 657 657 A L H << S- 0 0 14 -3,-2.7 2,-0.3 -4,-0.7 4,-0.3 0.868 108.8-130.4 -87.3 -40.3 8.7 52.9 15.4 658 658 A G < - 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0 0 81 0, 0.0 2,-0.2 0, 0.0 -3,-0.1 -0.676 9.4-160.7 -86.8 131.5 11.2 67.0 29.4 674 674 A S > - 0 0 61 -2,-0.4 4,-2.3 1,-0.0 5,-0.3 -0.526 33.2 -92.2-106.7 172.8 15.0 67.1 29.1 675 675 A D H > S+ 0 0 76 3,-0.2 4,-1.5 2,-0.2 -362,-0.1 0.893 119.5 36.3 -46.3 -61.4 17.7 69.4 27.5 676 676 A I H >>>S+ 0 0 15 2,-0.2 4,-3.4 1,-0.2 3,-1.5 0.997 121.4 42.0 -59.2 -75.2 18.0 67.7 24.1 677 677 A L H 3>5S+ 0 0 31 1,-0.3 4,-1.0 2,-0.2 -1,-0.2 0.788 123.9 42.6 -44.5 -32.9 14.3 66.6 23.5 678 678 A Q H 3X5S+ 0 0 32 -4,-2.3 4,-0.7 2,-0.2 -1,-0.3 0.714 115.3 49.5 -88.0 -22.1 13.4 70.0 24.9 679 679 A M H < S+ 0 0 85 -4,-0.7 3,-0.9 1,-0.2 -2,-0.2 0.975 108.3 38.7 -52.1 -75.1 11.9 74.1 20.1 683 683 A L H >< S+ 0 0 37 -4,-0.9 3,-1.8 1,-0.2 -1,-0.2 0.907 98.9 86.9 -40.9 -53.7 13.6 74.8 16.8 684 684 A E H 3< S+ 0 0 79 -4,-2.0 2,-0.3 1,-0.3 -1,-0.2 0.606 115.3 0.5 -11.8 -70.6 11.4 72.1 15.3 685 685 A G T << 0 0 64 -3,-0.9 -1,-0.3 -4,-0.9 -597,-0.1 -0.689 360.0 360.0-130.9 73.8 8.4 74.3 14.6 686 686 A K < 0 0 28 -3,-1.8 -596,-0.7 -2,-0.3 -3,-0.1 -0.801 360.0 360.0-108.8 360.0 9.9 77.7 15.8