==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 14-NOV-96 2NUL . COMPND 2 MOLECULE: PEPTIDYLPROLYL ISOMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR K.J.EDWARDS,D.L.OLLIS . 163 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7324.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 109 66.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 52 31.9 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 . 2 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 1.2 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 . 15 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 17 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 19 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 1 2 3 3 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 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 0 0 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 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 M 0 0 94 0, 0.0 162,-2.4 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 154.6 9.3 -21.7 0.1 2 2 A V E -AB 13 162A 0 11,-2.2 11,-3.1 160,-0.3 2,-0.5 -0.997 360.0-156.6-135.9 136.3 12.7 -20.6 -0.9 3 3 A T E -AB 12 161A 21 158,-2.9 158,-2.8 -2,-0.4 2,-0.7 -0.984 5.3-153.3-119.5 128.4 14.5 -17.3 0.0 4 4 A F E -AB 11 160A 0 7,-2.8 7,-2.0 -2,-0.5 2,-1.0 -0.879 10.2-156.3 -90.4 115.3 17.3 -15.8 -2.1 5 5 A H E +AB 10 159A 40 154,-2.9 153,-2.6 -2,-0.7 154,-1.1 -0.848 25.0 176.0 -93.9 103.3 19.4 -13.8 0.3 6 6 A T E > -AB 9 157A 7 3,-1.9 3,-1.7 -2,-1.0 151,-0.2 -0.605 47.9-106.4-104.9 168.6 21.1 -11.3 -2.1 7 7 A N T 3 S+ 0 0 65 149,-1.8 150,-0.1 1,-0.3 3,-0.1 0.435 124.0 51.7 -72.3 3.5 23.4 -8.4 -1.4 8 8 A H T 3 S- 0 0 62 1,-0.5 -1,-0.3 148,-0.3 2,-0.2 0.364 126.3 -82.1-114.0 -0.6 20.3 -6.2 -2.3 9 9 A G E < -A 6 0A 26 -3,-1.7 -3,-1.9 2,-0.0 -1,-0.5 -0.631 60.8 -42.8 126.5 175.9 18.0 -8.0 0.1 10 10 A D E -A 5 0A 79 -5,-0.2 2,-0.5 -2,-0.2 122,-0.2 -0.540 35.9-166.0 -85.7 145.6 15.8 -11.1 0.4 11 11 A I E -A 4 0A 0 -7,-2.0 -7,-2.8 -2,-0.2 2,-0.5 -0.989 12.2-156.8-129.2 113.8 13.5 -12.4 -2.3 12 12 A V E -AC 3 128A 25 116,-3.0 115,-2.7 -2,-0.5 116,-1.2 -0.857 13.6-174.6 -96.4 137.0 11.0 -15.0 -1.0 13 13 A I E -AC 2 126A 0 -11,-3.1 -11,-2.2 -2,-0.5 2,-0.4 -0.894 19.5-152.0-133.8 144.6 9.5 -17.5 -3.5 14 14 A K E - C 0 125A 93 111,-2.3 111,-2.4 -2,-0.3 2,-0.3 -0.937 24.5-139.2-113.0 140.0 6.8 -20.2 -3.5 15 15 A T E - C 0 124A 21 -2,-0.4 2,-1.2 109,-0.2 109,-0.3 -0.738 10.7-129.5-101.2 152.7 7.3 -23.0 -6.0 16 16 A F >> + 0 0 37 107,-3.0 4,-1.7 -2,-0.3 3,-0.7 -0.522 38.2 166.6-100.2 69.6 4.6 -24.8 -8.1 17 17 A D T 34 S+ 0 0 80 -2,-1.2 -1,-0.2 1,-0.3 7,-0.2 0.840 73.3 46.4 -49.9 -47.0 5.6 -28.3 -7.2 18 18 A D T 34 S+ 0 0 141 -3,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.773 115.7 44.9 -71.6 -28.1 2.4 -29.9 -8.5 19 19 A K T <4 S+ 0 0 63 -3,-0.7 -1,-0.2 1,-0.2 -2,-0.2 0.637 128.2 22.7 -90.6 -18.5 2.4 -28.0 -11.8 20 20 A A S X S+ 0 0 0 -4,-1.7 4,-3.0 -3,-0.2 5,-0.3 -0.509 72.0 164.9-146.3 70.4 6.2 -28.4 -12.8 21 21 A P H > S+ 0 0 73 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.888 76.9 40.5 -56.3 -52.5 7.4 -31.5 -10.8 22 22 A E H > S+ 0 0 75 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.881 118.1 49.6 -67.9 -37.9 10.6 -32.1 -12.7 23 23 A T H > S+ 0 0 1 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.946 113.5 43.6 -67.6 -46.0 11.4 -28.4 -12.8 24 24 A V H X S+ 0 0 4 -4,-3.0 4,-2.9 1,-0.2 5,-0.3 0.937 113.1 52.3 -67.9 -42.0 10.8 -27.8 -9.1 25 25 A K H X S+ 0 0 68 -4,-2.4 4,-1.7 -5,-0.3 -1,-0.2 0.912 111.5 47.8 -60.4 -36.2 12.6 -30.9 -8.1 26 26 A N H X S+ 0 0 15 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.915 113.4 47.4 -67.8 -46.8 15.6 -29.7 -10.2 27 27 A F H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.910 111.7 48.2 -60.6 -50.2 15.5 -26.2 -8.7 28 28 A L H X S+ 0 0 22 -4,-2.9 4,-3.0 2,-0.2 -1,-0.2 0.813 107.0 57.2 -66.6 -32.1 15.2 -27.3 -5.1 29 29 A D H X S+ 0 0 71 -4,-1.7 4,-2.4 -5,-0.3 6,-0.3 0.951 108.5 45.9 -63.1 -48.7 18.1 -29.8 -5.5 30 30 A Y H <>S+ 0 0 4 -4,-1.8 5,-2.2 2,-0.2 6,-0.6 0.905 114.7 50.1 -58.7 -39.7 20.4 -27.0 -6.7 31 31 A C H ><5S+ 0 0 5 -4,-2.1 3,-1.2 1,-0.2 -2,-0.2 0.960 112.2 45.6 -63.5 -46.0 19.1 -24.9 -3.7 32 32 A R H 3<5S+ 0 0 133 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.850 109.1 55.2 -67.9 -36.6 19.7 -27.6 -1.2 33 33 A E T 3<5S- 0 0 83 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.535 114.0-115.3 -72.6 -9.1 23.2 -28.4 -2.4 34 34 A G T X 5S+ 0 0 24 -3,-1.2 3,-1.1 -4,-0.5 -3,-0.2 0.659 70.7 141.9 81.4 17.9 24.2 -24.8 -2.0 35 35 A F T 3 < + 0 0 24 -5,-2.2 -4,-0.2 1,-0.3 -5,-0.1 0.851 69.5 46.4 -61.8 -36.2 24.6 -24.5 -5.8 36 36 A Y T > S+ 0 0 0 -6,-0.6 3,-0.8 -5,-0.1 -1,-0.3 0.558 83.7 111.4 -85.0 -9.0 23.3 -21.0 -6.0 37 37 A N T < S+ 0 0 58 -3,-1.1 121,-0.2 1,-0.3 122,-0.2 -0.456 88.0 14.0 -66.5 133.4 25.3 -19.6 -3.1 38 38 A N T 3 S+ 0 0 82 119,-2.0 2,-0.3 1,-0.3 -1,-0.3 0.938 98.9 124.9 68.5 40.8 27.8 -17.1 -4.3 39 39 A T E < -D 157 0A 0 118,-1.3 118,-3.2 -3,-0.8 -1,-0.3 -0.876 47.4-137.7-123.3 163.7 26.3 -16.8 -7.9 40 40 A I E -D 156 0A 5 15,-1.9 2,-0.9 -2,-0.3 13,-0.8 -0.649 22.5-108.4-117.7 171.8 25.2 -13.6 -9.6 41 41 A F E +E 52 0A 1 114,-1.8 114,-0.3 -2,-0.2 11,-0.3 -0.912 43.0 177.6 -95.6 99.7 22.4 -12.2 -11.7 42 42 A H E + 0 0 8 -2,-0.9 2,-0.4 9,-0.9 10,-0.2 0.578 61.6 48.0 -86.8 -12.0 24.5 -12.0 -14.9 43 43 A R E +E 51 0A 65 8,-1.6 8,-3.5 107,-0.1 2,-0.5 -0.969 62.8 171.1-132.8 114.4 21.8 -10.7 -17.3 44 44 A V E +E 50 0A 3 105,-2.4 2,-0.5 -2,-0.4 6,-0.2 -0.975 4.1 178.3-127.2 116.5 19.6 -7.8 -16.2 45 45 A I E >> -E 49 0A 42 4,-3.1 3,-2.1 -2,-0.5 4,-1.2 -0.941 27.1-131.8-121.0 107.4 17.3 -6.2 -18.7 46 46 A N T 34 S+ 0 0 99 -2,-0.5 92,-0.1 1,-0.3 88,-0.0 -0.328 92.7 15.5 -56.5 141.0 15.1 -3.3 -17.5 47 47 A G T 34 S+ 0 0 42 1,-0.2 -1,-0.3 55,-0.1 91,-0.0 0.616 130.7 51.5 69.9 13.0 11.5 -3.7 -18.4 48 48 A F T <4 S- 0 0 47 -3,-2.1 54,-1.7 1,-0.2 55,-0.7 0.425 106.0 -52.1-137.3 -70.3 12.0 -7.3 -19.3 49 49 A M E < -EF 45 101A 2 -4,-1.2 -4,-3.1 52,-0.2 2,-0.4 -0.989 27.7-123.5-170.6 163.1 13.7 -9.6 -16.8 50 50 A I E -EF 44 100A 0 50,-1.6 50,-2.6 -2,-0.3 2,-0.4 -0.992 31.8-163.0-119.0 129.1 16.6 -10.4 -14.4 51 51 A Q E +EF 43 99A 21 -8,-3.5 -8,-1.6 -2,-0.4 -9,-0.9 -0.944 19.9 140.8-115.8 139.4 18.4 -13.7 -15.0 52 52 A G E +EF 41 98A 0 46,-2.5 46,-1.4 -2,-0.4 -11,-0.2 -0.684 24.6 94.7-151.8-161.6 20.8 -15.7 -12.8 53 53 A G S S+ 0 0 0 -13,-0.8 -12,-0.1 44,-0.2 -1,-0.1 0.595 78.0 76.6 82.4 13.6 21.9 -19.1 -11.5 54 54 A G S S+ 0 0 4 -14,-0.5 8,-2.5 1,-0.2 2,-0.3 0.690 83.2 44.0-127.2 -17.4 24.9 -19.8 -13.8 55 55 A F E -I 61 0B 14 -15,-0.4 -15,-1.9 6,-0.2 6,-0.2 -0.894 60.6-134.4-132.0 157.1 28.0 -17.9 -12.9 56 56 A E E >> -I 60 0B 54 4,-2.4 4,-1.5 -2,-0.3 3,-1.1 -0.560 56.9 -66.5-100.7 162.2 30.1 -16.9 -9.9 57 57 A P T 34 S+ 0 0 42 0, 0.0 3,-0.4 0, 0.0 -1,-0.2 -0.181 129.4 40.2 -45.6 139.7 31.4 -13.3 -9.3 58 58 A G T 34 S- 0 0 70 1,-0.2 -2,-0.0 -3,-0.1 0, 0.0 0.608 130.0 -84.4 91.4 11.1 33.9 -12.7 -12.0 59 59 A M T <4 S+ 0 0 37 -3,-1.1 2,-0.7 1,-0.2 -1,-0.2 0.853 72.8 166.8 55.5 38.4 31.8 -14.5 -14.6 60 60 A K E < -I 56 0B 80 -4,-1.5 -4,-2.4 -3,-0.4 -1,-0.2 -0.757 33.4-131.6 -87.2 111.6 33.1 -17.9 -13.6 61 61 A Q E -I 55 0B 144 -2,-0.7 2,-0.2 -6,-0.2 -6,-0.2 -0.458 16.7-142.7 -65.9 131.0 30.8 -20.5 -15.2 62 62 A K - 0 0 38 -8,-2.5 2,-0.2 -2,-0.2 -1,-0.1 -0.649 16.5-116.8 -94.3 147.6 29.6 -23.3 -12.9 63 63 A A - 0 0 95 -2,-0.2 2,-0.2 1,-0.0 -1,-0.0 -0.594 36.8-163.2 -81.3 148.7 29.2 -26.9 -14.0 64 64 A T - 0 0 62 -2,-0.2 2,-0.1 1,-0.1 -10,-0.0 -0.694 18.8-101.0-124.4 173.7 25.5 -28.2 -13.9 65 65 A K - 0 0 97 -2,-0.2 -1,-0.1 1,-0.2 31,-0.1 -0.205 64.3 -56.2 -83.4-177.3 23.7 -31.5 -13.9 66 66 A E - 0 0 76 1,-0.1 -1,-0.2 -2,-0.1 27,-0.0 -0.221 68.5 -97.2 -58.2 147.8 21.9 -33.0 -17.0 67 67 A P - 0 0 77 0, 0.0 2,-0.3 0, 0.0 28,-0.2 -0.205 38.6-128.0 -66.3 164.9 19.3 -30.7 -18.6 68 68 A I B -J 94 0C 13 26,-2.6 26,-0.7 1,-0.0 2,-0.2 -0.741 22.4 -94.7-113.6 165.3 15.5 -31.1 -17.8 69 69 A K - 0 0 83 -2,-0.3 2,-0.2 24,-0.1 23,-0.1 -0.519 43.8-106.8 -79.3 138.7 12.4 -31.5 -19.9 70 70 A N - 0 0 16 -2,-0.2 3,-0.2 1,-0.1 -1,-0.1 -0.494 33.7-177.8 -64.4 126.3 10.4 -28.4 -20.7 71 71 A E > + 0 0 28 -2,-0.2 3,-1.3 1,-0.1 -1,-0.1 0.073 44.6 118.8-114.6 24.6 7.2 -28.3 -18.6 72 72 A A G > + 0 0 2 1,-0.3 3,-1.2 47,-0.2 38,-0.3 0.637 56.8 79.1 -69.2 -11.5 5.8 -25.1 -20.0 73 73 A N G 3 + 0 0 76 1,-0.3 -1,-0.3 -3,-0.2 -2,-0.0 0.419 66.4 93.7 -76.8 8.1 2.7 -27.0 -21.3 74 74 A N G < S- 0 0 36 -3,-1.3 -1,-0.3 2,-0.1 -2,-0.1 0.472 100.5-123.5 -76.7 -2.2 1.6 -26.7 -17.7 75 75 A G < + 0 0 53 -3,-1.2 2,-0.2 1,-0.2 -2,-0.1 0.323 61.4 144.1 80.2 -8.0 -0.2 -23.6 -18.9 76 76 A L - 0 0 46 46,-0.2 46,-0.4 -57,-0.1 34,-0.3 -0.454 42.1-134.9 -69.2 137.1 1.4 -21.2 -16.4 77 77 A K - 0 0 89 -2,-0.2 2,-2.1 -3,-0.1 29,-0.1 -0.587 13.6-113.8-100.4 152.4 2.1 -17.8 -17.9 78 78 A N + 0 0 1 -2,-0.2 27,-2.9 27,-0.2 2,-0.2 -0.431 56.5 155.6 -79.2 64.0 5.1 -15.5 -17.7 79 79 A T > - 0 0 56 -2,-2.1 3,-2.4 25,-0.3 22,-0.3 -0.515 55.1 -67.7 -90.5 167.3 3.6 -12.7 -15.7 80 80 A R T 3 S+ 0 0 89 1,-0.3 22,-0.2 -2,-0.2 -1,-0.2 -0.154 122.3 22.4 -52.3 129.9 5.3 -10.1 -13.6 81 81 A G T 3 S+ 0 0 5 20,-3.1 45,-2.4 1,-0.3 -1,-0.3 0.243 93.9 119.7 97.3 -16.2 6.8 -11.8 -10.5 82 82 A T E < -G 125 0A 3 -3,-2.4 19,-2.3 43,-0.2 2,-0.4 -0.374 55.1-137.9 -84.2 160.8 7.0 -15.3 -11.9 83 83 A L E -GH 124 100A 0 41,-2.2 40,-2.6 17,-0.2 41,-1.3 -0.993 23.1-180.0-115.8 131.0 10.3 -17.3 -12.3 84 84 A A E -GH 122 99A 0 15,-1.7 15,-2.5 -2,-0.4 2,-0.4 -0.879 33.7-100.8-125.6 157.0 10.8 -19.4 -15.4 85 85 A M E - H 0 98A 4 36,-2.0 13,-0.3 -2,-0.3 36,-0.2 -0.666 30.4-133.1 -80.3 131.0 13.8 -21.6 -16.5 86 86 A A + 0 0 12 11,-1.9 9,-0.4 -2,-0.4 2,-0.3 -0.526 36.5 172.5 -72.7 147.5 16.3 -20.0 -18.9 87 87 A R - 0 0 39 -2,-0.2 7,-0.1 7,-0.2 2,-0.1 -0.918 31.2-107.8-149.5 172.9 17.1 -22.5 -21.8 88 88 A T - 0 0 92 2,-0.4 5,-0.2 -2,-0.3 6,-0.1 -0.254 58.5 -74.5 -90.3-167.0 18.9 -22.6 -25.1 89 89 A Q S S+ 0 0 87 -2,-0.1 -1,-0.0 4,-0.1 3,-0.0 0.716 114.5 82.8 -61.6 -27.0 17.2 -22.8 -28.5 90 90 A A S > S- 0 0 49 1,-0.1 3,-1.1 3,-0.0 -2,-0.4 -0.652 82.8-133.6 -79.7 141.8 16.4 -26.4 -27.9 91 91 A P T 3 S+ 0 0 24 0, 0.0 3,-0.4 0, 0.0 -1,-0.1 0.852 101.7 47.7 -63.8 -37.8 13.2 -27.0 -25.7 92 92 A H T 3 S+ 0 0 78 1,-0.2 -3,-0.1 -23,-0.1 -2,-0.0 0.026 84.0 100.5 -99.2 41.2 14.7 -29.5 -23.4 93 93 A S < + 0 0 21 -3,-1.1 -1,-0.2 -5,-0.2 -24,-0.1 0.332 43.0 124.2-101.9 1.5 17.9 -27.6 -22.6 94 94 A A B +J 68 0C 8 -26,-0.7 -26,-2.6 -3,-0.4 -7,-0.2 -0.400 18.8 150.9 -71.8 142.6 17.3 -26.0 -19.1 95 95 A T S S- 0 0 30 -9,-0.4 -1,-0.1 -28,-0.2 -29,-0.1 0.293 70.6 -28.2-126.5 -91.0 19.7 -26.8 -16.3 96 96 A A S S+ 0 0 0 -31,-0.1 2,-0.2 -43,-0.1 -44,-0.1 0.651 99.0 99.4-113.0 -21.3 20.3 -24.2 -13.5 97 97 A Q + 0 0 49 -11,-0.1 -11,-1.9 -43,-0.1 2,-0.3 -0.507 43.1 167.5 -76.5 141.8 19.7 -20.7 -14.9 98 98 A F E -FH 52 85A 0 -46,-1.4 -46,-2.5 -13,-0.3 2,-0.3 -0.872 17.5-148.5-142.4 164.7 16.3 -19.1 -14.3 99 99 A F E -FH 51 84A 9 -15,-2.5 -15,-1.7 -2,-0.3 2,-0.5 -0.932 11.3-130.1-138.8 162.7 14.9 -15.6 -14.7 100 100 A I E -FH 50 83A 0 -50,-2.6 -50,-1.6 -2,-0.3 2,-0.4 -0.966 23.1-130.3-115.7 124.2 12.4 -13.4 -13.0 101 101 A N E -F 49 0A 0 -19,-2.3 -20,-3.1 -2,-0.5 -52,-0.2 -0.628 20.9-176.1 -71.9 124.1 9.7 -11.6 -15.2 102 102 A V S S+ 0 0 3 -54,-1.7 2,-0.3 -2,-0.4 -53,-0.2 0.452 77.7 16.9 -99.7 -5.0 9.7 -8.0 -14.2 103 103 A V S S- 0 0 54 -55,-0.7 2,-0.6 -25,-0.1 -22,-0.1 -0.861 107.0 -77.4-148.3 172.2 6.7 -7.3 -16.6 104 104 A D - 0 0 104 -2,-0.3 2,-0.7 -25,-0.2 -25,-0.3 -0.737 42.8-166.5 -78.6 122.4 4.3 -9.8 -18.2 105 105 A N > + 0 0 5 -27,-2.9 3,-2.3 -2,-0.6 4,-0.3 -0.643 17.3 167.1-113.2 74.4 6.3 -11.3 -21.1 106 106 A D G > S+ 0 0 67 -2,-0.7 3,-2.1 1,-0.3 -1,-0.2 0.820 70.0 68.8 -57.0 -34.6 3.4 -13.0 -22.9 107 107 A F G 3 S+ 0 0 152 1,-0.3 -1,-0.3 -3,-0.2 12,-0.1 0.644 95.0 57.7 -62.9 -13.8 5.7 -13.6 -25.9 108 108 A L G < S+ 0 0 17 -3,-2.3 12,-2.7 -30,-0.1 -1,-0.3 0.522 84.0 112.6 -92.7 -10.1 7.5 -16.1 -23.8 109 109 A N S < S- 0 0 37 -3,-2.1 10,-0.2 -4,-0.3 2,-0.1 -0.338 76.9 -99.3 -70.0 146.0 4.5 -18.2 -23.1 110 110 A F + 0 0 59 -34,-0.3 8,-0.2 -38,-0.3 -1,-0.1 -0.337 38.8 173.4 -61.5 137.7 4.1 -21.7 -24.4 111 111 A S - 0 0 95 6,-2.6 7,-0.2 1,-0.5 2,-0.2 0.299 62.2 -33.5-133.3 14.8 1.9 -22.0 -27.5 112 112 A G S S- 0 0 24 5,-0.4 2,-2.9 2,-0.1 -1,-0.5 -0.565 74.4 -75.2 141.6 150.1 2.3 -25.6 -28.5 113 113 A E S S+ 0 0 129 -2,-0.2 2,-0.3 4,-0.2 -3,-0.0 -0.344 88.9 107.5 -75.1 69.6 4.8 -28.3 -28.5 114 114 A S S > S- 0 0 62 -2,-2.9 4,-3.0 1,-0.1 3,-0.2 -0.889 84.3-103.3-136.8 165.0 6.9 -27.1 -31.3 115 115 A L T 4 S+ 0 0 131 -2,-0.3 4,-0.2 1,-0.2 -1,-0.1 0.863 125.6 40.2 -55.8 -40.1 10.3 -25.5 -31.6 116 116 A Q T 4 S+ 0 0 102 2,-0.1 -1,-0.2 1,-0.1 -3,-0.1 0.664 123.6 38.9 -83.7 -16.2 8.7 -22.2 -32.1 117 117 A G T 4 S+ 0 0 1 -3,-0.2 -6,-2.6 -5,-0.2 -5,-0.4 0.821 83.0 91.9-105.4 -32.7 5.9 -22.7 -29.5 118 118 A W < + 0 0 21 -4,-3.0 -8,-0.2 -8,-0.2 -46,-0.1 0.656 64.1 174.7 -34.9 -37.9 7.4 -24.5 -26.5 119 119 A G - 0 0 12 -4,-0.2 2,-0.5 -10,-0.2 -10,-0.2 -0.042 37.7 -41.3 59.8-157.8 8.2 -21.2 -24.7 120 120 A Y - 0 0 69 -12,-2.7 2,-0.4 -48,-0.1 -10,-0.3 -0.943 53.5-119.4-120.2 128.2 9.6 -20.9 -21.2 121 121 A C - 0 0 6 -2,-0.5 -36,-2.0 -36,-0.2 2,-0.4 -0.459 17.8-153.8 -70.3 111.9 8.6 -22.9 -18.2 122 122 A V E + G 0 84A 1 -46,-0.4 -38,-0.3 -2,-0.4 -46,-0.2 -0.737 26.5 159.3 -82.7 126.7 7.1 -20.9 -15.2 123 123 A F E + 0 0 0 -40,-2.6 -107,-3.0 -2,-0.4 2,-0.3 0.384 56.1 12.7-132.5 2.7 7.8 -22.9 -12.0 124 124 A A E -CG 15 83A 0 -41,-1.3 -41,-2.2 -109,-0.3 2,-0.3 -0.987 56.6-138.6-168.6 174.0 7.5 -20.4 -9.2 125 125 A E E -CG 14 82A 63 -111,-2.4 -111,-2.3 -2,-0.3 2,-0.4 -0.997 24.7-112.5-149.6 148.0 6.5 -16.9 -8.0 126 126 A V E +C 13 0A 13 -45,-2.4 -113,-0.3 -2,-0.3 3,-0.1 -0.665 30.5 172.5 -82.3 122.2 7.8 -14.1 -5.8 127 127 A V E S+ 0 0 73 -115,-2.7 2,-0.3 -2,-0.4 -114,-0.2 0.482 70.8 15.5-105.0 -12.2 5.6 -13.7 -2.7 128 128 A D E S+C 12 0A 106 -116,-1.2 -116,-3.0 1,-0.0 -1,-0.4 -0.931 110.0 42.6-160.7 139.2 7.8 -11.1 -0.9 129 129 A G >> + 0 0 5 -2,-0.3 4,-1.9 -118,-0.2 3,-1.2 0.672 55.5 136.7 98.6 19.3 10.7 -9.0 -2.0 130 130 A M H 3> S+ 0 0 39 1,-0.3 4,-2.8 2,-0.2 5,-0.2 0.810 74.3 61.3 -67.7 -25.8 9.5 -7.7 -5.4 131 131 A D H 3> S+ 0 0 120 2,-0.2 4,-0.7 1,-0.2 -1,-0.3 0.738 103.6 49.2 -71.3 -18.7 10.8 -4.3 -4.4 132 132 A V H <> S+ 0 0 15 -3,-1.2 4,-2.3 -122,-0.2 3,-0.3 0.875 110.3 51.5 -81.6 -40.0 14.3 -6.0 -4.2 133 133 A V H X S+ 0 0 0 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.916 110.2 48.7 -62.7 -40.0 13.6 -7.4 -7.7 134 134 A D H < S+ 0 0 52 -4,-2.8 4,-0.5 2,-0.2 -1,-0.2 0.762 108.2 53.5 -72.1 -23.7 12.7 -3.9 -8.9 135 135 A K H >< S+ 0 0 85 -4,-0.7 3,-0.7 -3,-0.3 4,-0.2 0.910 109.9 48.6 -74.2 -42.0 15.9 -2.4 -7.3 136 136 A I H >< S+ 0 0 0 -4,-2.3 3,-2.0 1,-0.2 -2,-0.2 0.925 101.4 62.7 -65.8 -39.7 18.0 -5.0 -9.2 137 137 A K T 3< S+ 0 0 48 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.732 102.4 53.8 -59.6 -21.3 16.3 -4.4 -12.6 138 138 A G T < S+ 0 0 49 -3,-0.7 -1,-0.3 -4,-0.5 -2,-0.2 0.429 78.5 119.0 -96.6 2.6 17.5 -0.9 -12.6 139 139 A V S < S- 0 0 41 -3,-2.0 -93,-0.1 -4,-0.2 2,-0.1 -0.319 73.9 -95.9 -72.3 147.4 21.3 -1.3 -12.0 140 140 A A - 0 0 71 11,-0.1 12,-2.4 1,-0.0 13,-0.4 -0.351 48.4-172.7 -60.5 138.2 23.8 -0.1 -14.6 141 141 A T E +K 151 0D 49 10,-0.3 2,-0.3 11,-0.1 -98,-0.0 -0.764 12.2 170.7-127.0 172.7 24.9 -2.8 -17.1 142 142 A G E -K 150 0D 28 8,-2.0 8,-2.5 -2,-0.2 2,-0.3 -0.926 41.2 -72.7-164.4-176.2 27.5 -3.3 -19.8 143 143 A R E - 0 0 164 -2,-0.3 2,-0.3 6,-0.2 5,-0.2 -0.722 31.0-171.4 -93.1 146.2 29.1 -5.9 -22.1 144 144 A S E > -K 147 0D 51 3,-3.3 3,-1.6 -2,-0.3 2,-0.3 -0.747 59.7 -72.2-140.6 78.3 31.4 -8.4 -20.6 145 145 A G T 3 S+ 0 0 52 -2,-0.3 -1,-0.1 1,-0.3 0, 0.0 -0.509 119.3 0.0 75.5-121.8 32.8 -10.2 -23.6 146 146 A M T 3 S+ 0 0 191 -2,-0.3 2,-0.4 -3,-0.1 -1,-0.3 0.722 121.5 88.4 -70.2 -21.9 30.3 -12.5 -25.1 147 147 A H E < -K 144 0D 63 -3,-1.6 -3,-3.3 2,-0.0 3,-0.3 -0.656 59.6-164.8 -91.5 129.3 27.9 -11.5 -22.5 148 148 A Q E + 0 0 59 -2,-0.4 -5,-0.2 -5,-0.2 -104,-0.1 -0.721 68.2 26.9-107.3 153.1 25.5 -8.5 -22.9 149 149 A D E S+ 0 0 63 -2,-0.3 -105,-2.4 1,-0.2 -1,-0.2 0.793 75.3 162.2 68.2 37.2 23.6 -6.8 -20.1 150 150 A V E -K 142 0D 15 -8,-2.5 -8,-2.0 -3,-0.3 -1,-0.2 -0.688 44.0-112.2 -88.7 128.5 25.9 -7.7 -17.3 151 151 A P E -K 141 0D 6 0, 0.0 -10,-0.3 0, 0.0 4,-0.1 -0.400 15.9-140.5 -60.5 133.8 25.6 -5.5 -14.1 152 152 A K S S+ 0 0 160 -12,-2.4 2,-0.5 -2,-0.1 -11,-0.1 0.951 95.0 41.6 -60.4 -45.4 28.7 -3.3 -13.5 153 153 A E S S- 0 0 77 -13,-0.4 -1,-0.1 1,-0.1 -14,-0.0 -0.864 108.5-100.5-103.6 130.0 28.6 -4.0 -9.8 154 154 A D - 0 0 58 -2,-0.5 2,-0.7 1,-0.1 -112,-0.1 -0.228 22.1-152.0 -53.6 131.4 27.8 -7.6 -8.9 155 155 A V - 0 0 1 -114,-0.3 -114,-1.8 -4,-0.1 2,-0.4 -0.957 29.1-165.6-107.0 105.7 24.3 -8.7 -7.8 156 156 A I E - D 0 40A 35 -2,-0.7 -149,-1.8 -116,-0.2 2,-0.9 -0.807 30.5-149.1-106.9 132.6 25.0 -11.7 -5.6 157 157 A I E -BD 6 39A 0 -118,-3.2 -119,-2.0 -2,-0.4 -118,-1.3 -0.936 24.2-174.2 -92.6 107.5 22.8 -14.4 -4.2 158 158 A E E - 0 0 113 -153,-2.6 2,-0.3 -2,-0.9 -120,-0.2 0.935 59.7 -21.8 -72.8 -46.7 24.8 -14.9 -1.0 159 159 A S E -B 5 0A 48 -154,-1.1 -154,-2.9 -122,-0.2 2,-0.4 -0.943 59.8-132.8-156.8 167.5 22.9 -17.9 0.3 160 160 A V E -B 4 0A 18 -2,-0.3 2,-0.5 -156,-0.2 -156,-0.2 -0.993 8.7-154.1-130.8 135.2 19.6 -19.5 -0.2 161 161 A T E -B 3 0A 60 -158,-2.8 -158,-2.9 -2,-0.4 2,-0.8 -0.933 8.6-150.9-112.2 128.9 17.2 -20.8 2.5 162 162 A V E B 2 0A 52 -2,-0.5 -160,-0.3 -160,-0.2 -2,-0.0 -0.904 360.0 360.0-104.8 107.4 14.8 -23.6 1.6 163 163 A S 0 0 111 -162,-2.4 -160,-0.1 -2,-0.8 -161,-0.0 -0.214 360.0 360.0 71.5 360.0 11.7 -23.2 3.7