==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CHAPERONE 19-JUL-04 1U2O . COMPND 2 MOLECULE: ENDOPLASMIN; . SOURCE 2 ORGANISM_SCIENTIFIC: CANIS LUPUS FAMILIARIS; . AUTHOR K.L.SOLDANO,A.JIVAN,C.V.NICCHITTA,D.T.GEWIRTH . 452 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22599.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 331 73.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 1.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 92 20.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.9 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 . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 25 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 58 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 132 29.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 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 1 1 2 0 0 2 0 1 3 2 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 2 0 0 4 6 0 2 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 . 0 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 65 A G 0 0 124 0, 0.0 4,-0.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 160.0 -141.1 -58.7 54.6 2 66 A S > + 0 0 71 1,-0.1 4,-1.5 2,-0.1 5,-0.1 0.135 360.0 93.4-108.8 19.8 -142.7 -56.5 57.3 3 67 A H H > S+ 0 0 90 2,-0.2 4,-1.9 1,-0.2 6,-0.3 0.942 81.1 53.0 -75.8 -48.6 -140.4 -57.2 60.2 4 68 A M H 4>S+ 0 0 80 1,-0.2 5,-1.4 2,-0.2 6,-0.5 0.831 116.4 40.0 -56.5 -36.2 -138.0 -54.4 59.8 5 69 A L H >45S+ 0 0 132 3,-0.2 3,-0.9 -4,-0.2 -1,-0.2 0.856 111.6 55.3 -83.6 -37.2 -140.8 -51.8 59.7 6 70 A R H 3<5S+ 0 0 180 -4,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.780 116.3 37.5 -67.3 -27.9 -142.9 -53.4 62.5 7 71 A E T 3<5S- 0 0 121 -4,-1.9 -1,-0.2 -5,-0.1 -2,-0.2 0.258 105.8-125.2-107.3 11.1 -140.0 -53.4 65.0 8 72 A K T X 5 + 0 0 46 -3,-0.9 3,-2.2 1,-0.2 -3,-0.2 0.782 51.1 159.1 50.4 34.1 -138.6 -50.0 63.8 9 73 A S T 3 < + 0 0 46 -5,-1.4 -1,-0.2 -6,-0.3 -4,-0.1 0.461 66.0 65.9 -65.2 1.5 -135.2 -51.6 63.2 10 74 A E T 3 S+ 0 0 38 -6,-0.5 154,-2.1 -5,-0.1 2,-0.4 0.504 85.0 87.4-100.4 -6.8 -134.4 -48.7 60.9 11 75 A K E < +A 163 0A 113 -3,-2.2 2,-0.3 152,-0.2 152,-0.2 -0.784 54.2 178.5-100.0 137.4 -134.5 -46.1 63.7 12 76 A F E -A 162 0A 77 150,-3.5 150,-2.2 -2,-0.4 2,-0.3 -0.903 23.0-131.0-132.9 161.5 -131.4 -45.1 65.7 13 77 A A - 0 0 50 -2,-0.3 2,-0.1 148,-0.2 148,-0.1 -0.795 32.3-110.5-107.7 151.8 -130.5 -42.7 68.5 14 78 A F - 0 0 10 -2,-0.3 2,-0.2 146,-0.1 87,-0.1 -0.488 37.0-100.3 -78.9 155.6 -127.4 -40.5 68.4 15 79 A Q >> - 0 0 71 85,-1.7 4,-2.2 -2,-0.1 3,-0.6 -0.504 33.0-116.9 -71.6 144.3 -124.5 -41.2 70.7 16 80 A A H 3> S+ 0 0 7 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.903 116.6 52.7 -49.3 -48.1 -124.5 -38.9 73.7 17 81 A E H 3> S+ 0 0 72 1,-0.2 4,-2.7 2,-0.2 -1,-0.3 0.863 107.4 52.2 -57.6 -37.7 -121.1 -37.4 72.5 18 82 A V H <> S+ 0 0 0 -3,-0.6 4,-3.0 2,-0.2 -1,-0.2 0.936 107.9 50.7 -66.1 -44.3 -122.6 -36.7 69.1 19 83 A N H X S+ 0 0 21 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.936 113.2 46.4 -56.7 -45.8 -125.6 -34.9 70.6 20 84 A R H X S+ 0 0 70 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.909 111.8 51.0 -63.0 -42.6 -123.2 -32.8 72.7 21 85 A M H X S+ 0 0 7 -4,-2.7 4,-2.7 1,-0.2 5,-0.2 0.908 107.4 53.5 -62.1 -42.9 -121.0 -32.2 69.6 22 86 A M H X S+ 0 0 9 -4,-3.0 4,-2.6 1,-0.2 -1,-0.2 0.914 110.7 46.2 -59.1 -44.6 -124.0 -31.1 67.6 23 87 A K H X S+ 0 0 76 -4,-1.9 4,-3.0 2,-0.2 5,-0.3 0.937 111.7 51.0 -64.4 -47.2 -125.0 -28.5 70.2 24 88 A L H X S+ 0 0 40 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.953 113.9 44.7 -53.3 -52.9 -121.5 -27.2 70.5 25 89 A I H X S+ 0 0 0 -4,-2.7 4,-1.1 1,-0.2 -1,-0.2 0.908 116.1 45.8 -59.5 -45.5 -121.2 -26.8 66.8 26 90 A I H < S+ 0 0 53 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.829 115.2 47.5 -69.2 -32.4 -124.6 -25.2 66.4 27 91 A N H >< S+ 0 0 118 -4,-3.0 3,-0.5 -5,-0.2 -2,-0.2 0.890 115.1 42.2 -76.6 -41.0 -124.1 -22.8 69.4 28 92 A S H 3< S+ 0 0 43 -4,-2.6 3,-0.2 -5,-0.3 92,-0.2 0.609 115.2 49.3 -83.0 -12.6 -120.6 -21.5 68.5 29 93 A L T >< S+ 0 0 4 -4,-1.1 3,-1.8 -5,-0.2 -1,-0.2 0.290 70.3 113.3-109.1 9.8 -121.3 -21.1 64.7 30 94 A Y T < S+ 0 0 53 -3,-0.5 3,-0.4 1,-0.3 -1,-0.1 0.737 84.2 44.7 -53.0 -24.6 -124.5 -19.2 65.0 31 95 A K T 3 S+ 0 0 101 -3,-0.2 -1,-0.3 1,-0.2 3,-0.1 0.566 116.0 45.1 -97.7 -10.0 -122.7 -16.1 63.5 32 96 A N X + 0 0 58 -3,-1.8 3,-1.1 1,-0.1 -1,-0.2 -0.415 66.7 145.1-129.4 55.1 -120.9 -18.0 60.7 33 97 A K T > + 0 0 81 -3,-0.4 3,-2.1 1,-0.2 4,-0.2 0.837 58.4 72.7 -63.2 -38.1 -123.6 -20.2 59.3 34 98 A E T >> S+ 0 0 49 1,-0.3 3,-1.3 2,-0.1 4,-0.6 0.704 79.1 79.4 -53.1 -21.6 -122.5 -20.2 55.7 35 99 A I H <> + 0 0 2 -3,-1.1 4,-2.0 1,-0.3 -1,-0.3 0.596 69.7 81.9 -65.3 -10.5 -119.6 -22.4 56.6 36 100 A F H <> S+ 0 0 0 -3,-2.1 4,-1.9 97,-0.2 -1,-0.3 0.909 91.4 51.1 -60.5 -39.2 -121.8 -25.4 56.5 37 101 A L H <> S+ 0 0 0 -3,-1.3 4,-2.4 -4,-0.2 5,-0.2 0.908 105.3 53.8 -65.2 -42.6 -121.4 -25.5 52.7 38 102 A R H X S+ 0 0 68 -4,-0.6 4,-2.1 1,-0.2 -1,-0.2 0.918 110.6 48.9 -57.2 -42.8 -117.7 -25.3 52.9 39 103 A E H X S+ 0 0 7 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.842 109.3 49.9 -66.3 -38.4 -117.8 -28.4 55.2 40 104 A L H X S+ 0 0 3 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.872 113.2 47.3 -69.7 -35.5 -120.1 -30.4 53.0 41 105 A I H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.872 110.2 52.9 -71.1 -37.3 -117.9 -29.7 50.0 42 106 A S H X S+ 0 0 42 -4,-2.1 4,-2.0 -5,-0.2 -2,-0.2 0.925 109.6 48.4 -63.4 -43.9 -114.8 -30.6 52.0 43 107 A N H X S+ 0 0 47 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.896 110.4 51.6 -64.0 -39.2 -116.4 -33.9 53.0 44 108 A A H X S+ 0 0 1 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.914 107.6 53.0 -62.3 -42.8 -117.3 -34.6 49.3 45 109 A S H X S+ 0 0 13 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.896 108.2 50.8 -58.9 -42.7 -113.7 -33.9 48.4 46 110 A D H X S+ 0 0 68 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.919 108.7 50.4 -62.0 -44.6 -112.5 -36.4 50.9 47 111 A A H X S+ 0 0 16 -4,-2.1 4,-2.0 1,-0.2 41,-1.7 0.858 109.8 51.6 -62.8 -35.3 -114.9 -39.1 49.5 48 112 A L H X S+ 0 0 0 -4,-2.1 4,-1.7 39,-0.3 -1,-0.2 0.837 108.4 51.2 -70.1 -33.7 -113.6 -38.3 46.1 49 113 A D H X S+ 0 0 59 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.917 108.7 53.0 -67.9 -43.3 -110.0 -38.8 47.3 50 114 A K H X S+ 0 0 114 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.918 111.5 42.4 -59.2 -47.8 -110.9 -42.1 48.8 51 115 A I H X S+ 0 0 2 -4,-2.0 4,-2.8 2,-0.2 -1,-0.2 0.876 112.1 55.9 -69.5 -32.4 -112.4 -43.6 45.7 52 116 A R H X S+ 0 0 133 -4,-1.7 4,-0.7 1,-0.2 -1,-0.2 0.898 110.1 45.9 -62.9 -39.7 -109.5 -42.2 43.7 53 117 A L H X S+ 0 0 111 -4,-2.3 4,-0.8 2,-0.2 3,-0.4 0.869 112.2 50.9 -68.7 -39.8 -107.2 -44.1 46.0 54 118 A I H >X S+ 0 0 61 -4,-2.2 4,-2.6 1,-0.2 3,-0.8 0.895 103.2 58.7 -65.8 -40.2 -109.3 -47.2 45.7 55 119 A S H 3< S+ 0 0 37 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.757 94.5 68.6 -61.5 -24.8 -109.3 -47.0 41.9 56 120 A L H 3< S+ 0 0 133 -4,-0.7 -1,-0.2 -3,-0.4 -2,-0.2 0.923 118.1 18.5 -59.4 -46.4 -105.5 -47.2 42.1 57 121 A T H << S+ 0 0 135 -3,-0.8 2,-0.6 -4,-0.8 -2,-0.2 0.601 122.5 62.8-101.4 -16.5 -105.5 -50.8 43.3 58 122 A D >< - 0 0 74 -4,-2.6 3,-1.5 -5,-0.1 4,-0.3 -0.917 61.8-165.9-116.7 106.5 -109.1 -51.8 42.3 59 123 A E T 3 S+ 0 0 100 -2,-0.6 3,-0.2 1,-0.3 -1,-0.1 0.673 89.3 49.0 -62.8 -20.4 -109.6 -51.6 38.5 60 124 A N T > S+ 0 0 124 1,-0.2 3,-1.9 2,-0.1 4,-0.3 0.400 78.1 107.1-101.7 3.6 -113.4 -51.8 38.8 61 125 A A T < S+ 0 0 0 -3,-1.5 3,-0.4 1,-0.3 -1,-0.2 0.835 81.6 42.7 -48.8 -45.3 -113.7 -49.1 41.5 62 126 A L T > S+ 0 0 46 -4,-0.3 3,-1.1 -3,-0.2 -1,-0.3 0.286 81.0 109.6 -91.6 13.7 -115.2 -46.4 39.2 63 127 A A T < S+ 0 0 83 -3,-1.9 3,-0.3 1,-0.3 -1,-0.2 0.888 75.3 51.7 -54.2 -48.5 -117.6 -48.8 37.3 64 128 A G T 3 S+ 0 0 37 -3,-0.4 -1,-0.3 -4,-0.3 2,-0.2 0.662 132.8 4.3 -66.4 -16.4 -120.8 -47.4 38.9 65 129 A N < - 0 0 41 -3,-1.1 -1,-0.3 109,-0.2 -2,-0.1 -0.670 60.1-162.8-171.3 109.1 -119.8 -43.8 37.9 66 130 A E + 0 0 84 -3,-0.3 2,-0.1 -2,-0.2 -3,-0.1 0.729 67.0 85.0 -70.9 -23.4 -116.7 -42.9 35.9 67 131 A E - 0 0 73 -5,-0.1 2,-0.5 1,-0.0 -2,-0.0 -0.431 62.6-150.6 -84.1 156.4 -116.7 -39.2 36.8 68 132 A L + 0 0 38 -2,-0.1 2,-0.3 17,-0.0 19,-0.1 -0.847 46.8 128.8-123.9 91.2 -115.2 -37.6 39.9 69 133 A T - 0 0 11 -2,-0.5 17,-1.5 140,-0.1 2,-0.5 -0.894 53.7-134.2-143.3 170.5 -117.2 -34.5 40.6 70 134 A V E -Bc 85 211A 0 140,-2.2 142,-2.8 -2,-0.3 2,-0.4 -0.999 28.1-173.2-125.2 122.5 -119.2 -32.4 43.1 71 135 A K E -Bc 84 212A 47 13,-3.7 13,-3.1 -2,-0.5 2,-0.4 -0.979 3.6-168.3-124.4 130.0 -122.5 -31.1 41.8 72 136 A I E +Bc 83 213A 0 140,-3.0 142,-3.0 -2,-0.4 2,-0.4 -0.944 6.7 177.5-120.1 135.4 -124.8 -28.7 43.7 73 137 A K E -B 82 0A 84 9,-1.8 9,-2.8 -2,-0.4 2,-0.4 -0.998 19.2-144.4-139.8 137.5 -128.4 -27.8 42.8 74 138 A C E -B 81 0A 17 140,-0.5 2,-0.5 -2,-0.4 7,-0.2 -0.832 6.3-167.5 -98.7 134.7 -130.9 -25.6 44.5 75 139 A D E >>> +B 80 0A 50 5,-3.4 5,-2.2 -2,-0.4 4,-1.3 -0.744 11.0 176.2-120.4 79.0 -134.5 -26.6 44.4 76 140 A K T 345S+ 0 0 131 -2,-0.5 3,-0.2 115,-0.3 -1,-0.2 0.850 76.9 51.8 -53.5 -40.4 -136.2 -23.4 45.5 77 141 A E T 345S+ 0 0 159 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.815 115.5 40.5 -70.3 -29.2 -139.8 -24.8 45.1 78 142 A K T <45S- 0 0 118 -3,-0.7 -1,-0.2 2,-0.2 -2,-0.2 0.559 108.3-125.0 -91.9 -8.9 -139.1 -27.9 47.2 79 143 A N T <5 + 0 0 52 -4,-1.3 104,-1.3 1,-0.3 2,-0.4 0.883 66.5 137.2 65.4 39.5 -137.0 -25.8 49.7 80 144 A L E < -BD 75 182A 36 -5,-2.2 -5,-3.4 102,-0.2 2,-0.4 -0.941 42.6-164.2-124.3 142.1 -134.2 -28.3 49.1 81 145 A L E -BD 74 181A 0 100,-1.5 100,-2.5 -2,-0.4 2,-0.4 -0.989 15.7-158.7-121.7 128.4 -130.4 -27.8 48.6 82 146 A H E -BD 73 180A 30 -9,-2.8 -9,-1.8 -2,-0.4 2,-0.5 -0.920 15.4-177.2-116.8 134.4 -128.4 -30.7 47.1 83 147 A V E +BD 72 179A 1 96,-2.1 96,-3.1 -2,-0.4 2,-0.4 -0.958 17.7 179.8-126.5 108.2 -124.7 -31.4 47.3 84 148 A T E +BD 71 178A 33 -13,-3.1 -13,-3.7 -2,-0.5 2,-0.3 -0.934 8.6 178.7-119.1 135.1 -123.7 -34.5 45.4 85 149 A D E -BD 70 177A 10 92,-2.6 92,-1.6 -2,-0.4 -15,-0.2 -0.872 30.5-138.2-125.8 158.3 -120.3 -36.1 44.9 86 150 A T + 0 0 8 -17,-1.5 90,-0.2 -2,-0.3 -16,-0.1 -0.310 62.1 132.1-109.4 45.2 -119.3 -39.3 43.0 87 151 A G S S- 0 0 0 90,-0.1 -39,-0.3 -18,-0.1 -40,-0.1 0.093 79.3 -64.4 -80.2-162.5 -117.0 -40.3 45.8 88 152 A V S S- 0 0 19 -41,-1.7 60,-0.6 1,-0.1 88,-0.2 0.745 70.9-153.4 -59.4 -26.4 -116.6 -43.6 47.6 89 153 A G - 0 0 2 86,-0.2 2,-0.3 58,-0.2 58,-0.2 -0.131 14.9 -91.4 74.0 179.2 -120.1 -43.4 49.0 90 154 A M - 0 0 33 86,-0.4 57,-0.4 63,-0.1 63,-0.3 -0.985 24.3-132.3-134.2 143.9 -121.2 -45.1 52.2 91 155 A T > - 0 0 18 -2,-0.3 4,-2.3 55,-0.1 5,-0.2 -0.381 40.6 -97.0 -84.7 170.7 -122.7 -48.6 52.9 92 156 A R H > S+ 0 0 94 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.897 127.3 50.8 -55.9 -41.1 -125.7 -48.9 55.2 93 157 A E H > S+ 0 0 117 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.869 109.8 49.2 -64.5 -38.4 -123.4 -49.8 58.1 94 158 A E H >>S+ 0 0 64 2,-0.2 4,-2.2 1,-0.2 5,-0.6 0.833 104.9 58.1 -71.5 -32.9 -121.2 -46.7 57.5 95 159 A L H X5S+ 0 0 0 -4,-2.3 4,-1.1 3,-0.2 5,-0.3 0.945 113.3 40.2 -61.1 -45.7 -124.2 -44.4 57.3 96 160 A V H X5S+ 0 0 35 -4,-1.7 4,-1.5 -5,-0.2 -2,-0.2 0.953 125.1 35.4 -66.9 -52.3 -125.1 -45.6 60.8 97 161 A K H X5S+ 0 0 142 -4,-2.6 4,-1.9 3,-0.2 -3,-0.2 0.961 118.5 45.4 -70.0 -55.1 -121.6 -45.6 62.3 98 162 A N H <5S+ 0 0 89 -4,-2.2 -3,-0.2 1,-0.2 -1,-0.2 0.834 125.8 30.7 -61.7 -35.3 -119.9 -42.7 60.5 99 163 A L H < 0 0 82 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -5.0 -109.9 -37.1 69.8 105 171 A T H > + 0 0 43 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.915 360.0 46.2 -46.5 -56.6 -113.5 -36.8 70.8 106 172 A S H > S+ 0 0 82 1,-0.2 4,-1.7 2,-0.2 3,-0.3 0.955 113.5 45.9 -53.7 -60.9 -112.7 -35.9 74.4 107 173 A E H > S+ 0 0 67 1,-0.2 4,-3.8 2,-0.2 -1,-0.2 0.879 110.4 56.0 -51.9 -42.5 -110.1 -33.3 73.7 108 174 A F H X S+ 0 0 12 -4,-2.7 4,-3.5 1,-0.2 5,-0.3 0.915 103.8 53.2 -57.5 -45.4 -112.3 -31.8 71.0 109 175 A L H X S+ 0 0 42 -4,-2.1 4,-1.6 -3,-0.3 -1,-0.2 0.872 115.4 41.3 -58.2 -38.1 -115.1 -31.3 73.5 110 176 A N H X S+ 0 0 61 -4,-1.7 4,-3.0 2,-0.2 5,-0.2 0.929 115.6 49.3 -74.9 -47.3 -112.6 -29.4 75.7 111 177 A K H X S+ 0 0 41 -4,-3.8 4,-1.6 2,-0.2 -2,-0.2 0.924 113.6 46.2 -57.6 -49.1 -111.0 -27.5 72.9 112 178 A M H X S+ 0 0 2 -4,-3.5 4,-1.2 2,-0.2 -1,-0.2 0.934 114.3 46.9 -60.2 -50.0 -114.4 -26.4 71.5 113 179 A T H >X S+ 0 0 73 -4,-1.6 4,-3.2 -5,-0.3 3,-0.9 0.942 114.6 46.7 -57.8 -49.6 -115.8 -25.4 74.8 114 180 A E H 3< S+ 0 0 74 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.767 110.8 54.3 -64.1 -25.8 -112.6 -23.5 75.7 115 181 A A H 3< S+ 0 0 37 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.677 115.0 39.5 -81.3 -19.3 -112.7 -21.9 72.2 116 182 A Q H << 0 0 67 -4,-1.2 -2,-0.2 -3,-0.9 -3,-0.2 0.877 360.0 360.0 -93.1 -52.0 -116.3 -20.7 72.8 117 183 A E < 0 0 114 -4,-3.2 -1,-0.2 -5,-0.2 -4,-0.0 -0.636 360.0 360.0 -79.4 360.0 -116.0 -19.6 76.5 118 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 119 187 A S 0 0 129 0, 0.0 -90,-0.1 0, 0.0 -91,-0.0 0.000 360.0 360.0 360.0 151.4 -113.3 -18.9 66.7 120 188 A T > + 0 0 7 -92,-0.2 4,-1.9 2,-0.1 3,-0.2 0.352 360.0 99.8-130.0 -3.8 -114.1 -22.6 66.2 121 189 A S H > S+ 0 0 18 1,-0.2 4,-0.9 2,-0.2 -92,-0.0 0.870 88.8 44.5 -53.3 -41.6 -114.7 -22.6 62.4 122 190 A E H > S+ 0 0 69 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.799 108.5 57.3 -75.1 -29.1 -111.2 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3,-1.5 -4,-0.5 -3,-0.2 0.870 50.9 156.7 58.8 38.8 -122.7 -49.9 79.7 239 73 B S T 3 < + 0 0 49 -5,-2.2 -4,-0.1 -6,-0.4 -1,-0.1 0.503 63.6 65.9 -72.6 -3.9 -126.1 -51.4 80.4 240 74 B E T 3 S+ 0 0 36 -6,-0.5 154,-1.9 -5,-0.1 2,-0.4 0.471 85.3 89.0 -94.9 -5.5 -126.8 -48.5 82.7 241 75 B K E < +I 393 0B 47 -3,-1.5 2,-0.3 152,-0.2 152,-0.2 -0.805 52.4 176.5-101.2 135.0 -126.8 -46.0 79.8 242 76 B F E -I 392 0B 61 150,-3.1 150,-2.1 -2,-0.4 2,-0.3 -0.897 23.5-133.3-130.6 160.2 -129.9 -45.1 77.7 243 77 B A - 0 0 49 -2,-0.3 148,-0.1 148,-0.2 2,-0.1 -0.841 34.7-105.8-109.6 149.3 -130.7 -42.7 74.9 244 78 B F - 0 0 10 -2,-0.3 87,-0.1 146,-0.1 86,-0.1 -0.449 37.3-101.0 -75.0 151.0 -133.8 -40.5 75.1 245 79 B Q > - 0 0 69 85,-1.6 4,-2.1 -2,-0.1 3,-0.4 -0.388 34.4-116.1 -65.7 147.9 -136.8 -41.3 72.9 246 80 B A H > S+ 0 0 10 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.922 115.3 51.5 -53.6 -50.9 -136.9 -39.0 69.9 247 81 B E H > S+ 0 0 72 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.827 108.2 54.0 -58.1 -31.9 -140.2 -37.4 70.9 248 82 B V H > S+ 0 0 0 -3,-0.4 4,-2.5 2,-0.2 -1,-0.2 0.917 105.8 51.3 -69.9 -42.1 -138.7 -36.7 74.3 249 83 B N H X S+ 0 0 21 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.935 112.7 47.1 -58.0 -44.7 -135.7 -35.0 72.7 250 84 B R H X S+ 0 0 70 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.891 110.5 51.8 -63.9 -40.6 -138.1 -32.8 70.7 251 85 B M H X S+ 0 0 15 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.879 106.9 53.2 -64.1 -39.9 -140.3 -32.1 73.8 252 86 B M H X S+ 0 0 11 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.902 110.1 48.1 -62.5 -41.9 -137.2 -30.9 75.8 253 87 B K H X S+ 0 0 76 -4,-1.7 4,-2.3 2,-0.2 5,-0.2 0.917 110.5 49.9 -66.2 -44.8 -136.3 -28.5 73.0 254 88 B L H X S+ 0 0 42 -4,-2.2 4,-2.5 1,-0.2 5,-0.2 0.959 111.7 49.6 -57.8 -50.6 -139.8 -27.0 72.7 255 89 B I H X S+ 0 0 0 -4,-2.4 4,-1.5 1,-0.2 -1,-0.2 0.896 113.1 46.3 -54.9 -45.1 -140.0 -26.5 76.4 256 90 B I H < S+ 0 0 63 -4,-2.1 4,-0.3 1,-0.2 -1,-0.2 0.818 114.7 46.7 -70.1 -31.7 -136.6 -24.8 76.5 257 91 B N H < S+ 0 0 107 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.816 118.2 40.3 -80.5 -30.4 -137.4 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41,-1.6 0.876 110.1 47.2 -61.6 -42.2 -146.3 -38.4 93.9 278 112 B L H X S+ 0 0 0 -4,-2.3 4,-1.8 39,-0.3 -2,-0.2 0.886 108.4 55.3 -68.8 -39.3 -147.6 -37.9 97.5 279 113 B D H X S+ 0 0 59 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.886 106.4 53.4 -59.8 -38.8 -151.2 -38.3 96.2 280 114 B K H X S+ 0 0 117 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.924 109.1 45.0 -64.8 -44.6 -150.2 -41.6 94.8 281 115 B I H X S+ 0 0 0 -4,-1.7 4,-2.3 1,-0.2 -1,-0.2 0.809 111.5 56.0 -70.2 -24.3 -148.7 -43.0 98.0 282 116 B R H X S+ 0 0 139 -4,-1.8 4,-0.7 2,-0.2 -2,-0.2 0.914 108.7 45.1 -71.0 -42.7 -151.8 -41.6 99.8 283 117 B L H >X S+ 0 0 114 -4,-2.2 4,-0.6 1,-0.2 3,-0.5 0.858 113.3 51.9 -66.2 -37.8 -154.1 -43.6 97.5 284 118 B I H >X S+ 0 0 65 -4,-2.1 4,-2.8 1,-0.2 3,-1.2 0.912 103.0 57.5 -66.3 -40.9 -151.9 -46.6 97.9 285 119 B S H 3< S+ 0 0 38 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.722 92.4 72.4 -62.7 -20.5 -152.0 -46.3 101.7 286 120 B L H << S+ 0 0 132 -4,-0.7 -1,-0.3 -3,-0.5 -2,-0.2 0.887 115.6 19.7 -62.1 -38.7 -155.8 -46.6 101.5 287 121 B T H << S+ 0 0 131 -3,-1.2 2,-0.7 -4,-0.6 -2,-0.2 0.774 121.0 62.8-100.6 -33.0 -155.6 -50.3 100.6 288 122 B D >< - 0 0 55 -4,-2.8 3,-1.3 -5,-0.1 4,-0.3 -0.845 58.2-166.4-103.3 110.3 -152.1 -51.1 101.9 289 123 B E T 3 S+ 0 0 106 -2,-0.7 3,-0.2 1,-0.3 -1,-0.1 0.666 91.0 50.1 -65.7 -18.3 -151.5 -50.7 105.7 290 124 B N T > S+ 0 0 111 1,-0.1 3,-2.0 2,-0.1 4,-0.3 0.454 78.2 104.6-100.3 -1.4 -147.7 -51.0 105.3 291 125 B A T < S+ 0 0 2 -3,-1.3 3,-0.5 1,-0.3 -1,-0.1 0.841 83.5 42.5 -43.5 -46.4 -147.5 -48.4 102.5 292 126 B L T > S+ 0 0 25 -4,-0.3 3,-0.7 -3,-0.2 -1,-0.3 0.318 80.0 106.8 -91.0 10.8 -146.1 -45.6 104.7 293 127 B A T < S+ 0 0 89 -3,-2.0 3,-0.3 1,-0.2 -1,-0.2 0.813 76.1 55.3 -58.0 -34.3 -143.6 -47.8 106.7 294 128 B G T 3 S- 0 0 37 -3,-0.5 2,-0.2 1,-0.3 -1,-0.2 0.807 132.1 -1.1 -69.8 -31.7 -140.5 -46.3 105.0 295 129 B N < - 0 0 36 -3,-0.7 -1,-0.3 109,-0.2 -2,-0.1 -0.791 60.9-163.3-160.2 110.3 -141.4 -42.7 105.8 296 130 B E + 0 0 139 -3,-0.3 2,-0.1 -2,-0.2 -3,-0.1 0.747 68.0 88.2 -72.1 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