==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-NOV-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE/PROTEIN BINDING 02-NOV-11 3UGB . COMPND 2 MOLECULE: UBIQUITIN-CONJUGATING ENZYME E2 D3; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR R.C.PAGE,J.N.PRUNEDA,R.E.KLEVIT,S.MISRA . 222 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12007.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 144 64.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 40 18.0 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 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 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 . 12 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 53 23.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.8 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 0 0 1 0 0 1 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 4 1 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 ANTIPARALLEL BRIDGES PER LADDER . 0 1 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 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 2 A A > 0 0 48 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -21.6 8.4 12.6 -35.3 2 3 A L H > + 0 0 87 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.887 360.0 47.6 -63.1 -41.8 8.6 11.0 -38.8 3 4 A K H > S+ 0 0 184 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.887 113.1 50.2 -63.6 -41.1 12.0 9.3 -38.3 4 5 A R H > S+ 0 0 59 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.890 109.0 52.0 -63.6 -41.0 10.9 7.9 -35.0 5 6 A I H X S+ 0 0 0 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.889 111.2 46.9 -63.5 -42.9 7.6 6.6 -36.5 6 7 A N H X S+ 0 0 69 -4,-2.0 4,-2.2 2,-0.2 5,-0.2 0.861 109.6 52.3 -65.0 -40.7 9.5 4.8 -39.3 7 8 A K H X S+ 0 0 115 -4,-2.0 4,-1.8 1,-0.2 -2,-0.2 0.915 112.8 46.0 -64.0 -42.5 12.1 3.3 -36.9 8 9 A E H X S+ 0 0 8 -4,-2.1 4,-1.6 2,-0.2 -1,-0.2 0.875 111.0 53.0 -63.5 -41.1 9.2 1.9 -34.8 9 10 A L H < S+ 0 0 45 -4,-1.8 4,-0.2 1,-0.2 -2,-0.2 0.884 113.2 42.7 -63.1 -44.5 7.4 0.7 -37.9 10 11 A S H >X S+ 0 0 47 -4,-2.2 4,-1.4 2,-0.2 3,-0.8 0.783 106.3 63.2 -65.8 -37.6 10.4 -1.2 -39.2 11 12 A D H 3X S+ 0 0 55 -4,-1.8 4,-2.3 1,-0.3 -2,-0.2 0.877 99.9 52.6 -58.7 -41.3 11.2 -2.5 -35.7 12 13 A L H 3< S+ 0 0 22 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.732 104.1 61.6 -66.3 -19.9 7.9 -4.4 -35.6 13 14 A A H <4 S+ 0 0 74 -3,-0.8 -2,-0.2 -4,-0.2 -1,-0.2 0.887 108.9 36.7 -75.3 -47.2 9.1 -5.8 -38.9 14 15 A R H < S+ 0 0 183 -4,-1.4 -2,-0.2 1,-0.3 -3,-0.1 0.902 135.1 23.7 -68.7 -46.4 12.1 -7.6 -37.5 15 16 A D S < S- 0 0 127 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.1 -0.819 85.5-165.2-123.1 89.5 10.5 -8.6 -34.2 16 17 A P - 0 0 76 0, 0.0 -3,-0.1 0, 0.0 -4,-0.1 -0.574 24.3-112.1 -80.1 135.2 6.7 -8.7 -34.8 17 18 A P > - 0 0 20 0, 0.0 3,-1.1 0, 0.0 2,-0.3 -0.385 33.2-117.9 -66.1 134.3 4.4 -8.8 -31.9 18 19 A A T 3 S+ 0 0 88 1,-0.3 3,-0.1 -2,-0.1 19,-0.1 -0.583 96.1 7.4 -72.4 136.9 2.5 -12.1 -31.5 19 20 A Q T 3 S+ 0 0 79 -2,-0.3 18,-2.0 1,-0.2 2,-0.3 0.775 121.3 85.9 63.4 24.9 -1.2 -11.8 -31.9 20 21 A C E < +A 36 0A 10 -3,-1.1 2,-0.3 16,-0.2 -1,-0.2 -0.984 47.6 171.1-148.3 151.7 -0.8 -8.1 -32.8 21 22 A S E +A 35 0A 64 14,-1.4 14,-2.5 -2,-0.3 2,-0.3 -0.957 3.4 178.2-157.0 154.3 -0.1 -6.1 -35.9 22 23 A A E +A 34 0A 25 -2,-0.3 12,-0.2 12,-0.2 -2,-0.0 -0.988 8.5 149.1-151.1 157.9 -0.0 -2.4 -36.9 23 24 A G E -A 33 0A 18 10,-1.6 10,-2.7 -2,-0.3 2,-0.1 -0.966 53.6 -66.4-171.5 169.4 0.7 -0.1 -39.9 24 25 A P E -A 32 0A 38 0, 0.0 8,-0.3 0, 0.0 5,-0.1 -0.473 40.7-137.4 -63.4 139.6 -0.2 3.1 -41.6 25 26 A V S S- 0 0 81 6,-1.9 7,-0.1 3,-0.4 4,-0.1 0.914 79.9 -28.8 -61.9 -46.8 -3.8 2.9 -42.7 26 27 A G S S- 0 0 48 5,-0.5 0, 0.0 2,-0.4 0, 0.0 -0.019 110.9 -35.5-133.1-119.8 -2.7 4.6 -46.0 27 28 A D S S+ 0 0 173 -2,-0.1 2,-0.7 2,-0.0 3,-0.1 0.410 104.5 96.8 -97.7 -1.8 0.0 7.1 -46.9 28 29 A D > - 0 0 90 3,-0.2 3,-0.6 1,-0.2 -2,-0.4 -0.824 54.7-165.1 -96.5 115.8 -0.1 9.0 -43.6 29 30 A M T 3 S+ 0 0 33 -2,-0.7 -1,-0.2 1,-0.2 26,-0.0 0.745 85.9 62.6 -66.2 -26.0 2.5 7.8 -41.2 30 31 A F T 3 S+ 0 0 58 1,-0.2 25,-2.6 24,-0.1 2,-0.7 0.769 97.4 62.9 -74.9 -26.0 0.9 9.6 -38.3 31 32 A H E < + B 0 54A 70 -3,-0.6 -6,-1.9 23,-0.2 -5,-0.5 -0.887 68.1 172.9-112.0 113.5 -2.3 7.5 -38.6 32 33 A W E -AB 24 53A 0 21,-3.4 21,-3.3 -2,-0.7 2,-0.4 -0.768 21.6-147.6-117.8 155.3 -2.0 3.8 -38.0 33 34 A Q E -AB 23 52A 92 -10,-2.7 -10,-1.6 -2,-0.3 2,-0.3 -0.966 20.5-173.7-123.0 139.1 -4.4 0.9 -37.7 34 35 A A E -AB 22 51A 1 17,-2.5 17,-3.0 -2,-0.4 2,-0.4 -0.945 13.0-148.6-136.2 154.7 -3.8 -2.1 -35.4 35 36 A T E -AB 21 50A 21 -14,-2.5 -14,-1.4 -2,-0.3 2,-0.4 -0.920 5.5-166.7-123.4 145.4 -5.3 -5.4 -34.6 36 37 A I E -AB 20 49A 0 13,-2.4 13,-3.1 -2,-0.4 2,-0.2 -0.986 15.5-141.3-129.0 126.5 -5.3 -7.5 -31.4 37 38 A M E - B 0 48A 62 -18,-2.0 11,-0.2 -2,-0.4 8,-0.1 -0.578 40.4 -96.9 -74.1 145.7 -6.3 -11.1 -31.2 38 39 A G - 0 0 3 9,-2.4 8,-0.6 6,-0.3 -1,-0.1 -0.513 51.8-105.3 -63.3 131.4 -8.3 -11.9 -28.2 39 40 A P - 0 0 7 0, 0.0 5,-0.3 0, 0.0 3,-0.2 -0.276 21.8-123.5 -63.0 143.4 -5.7 -13.3 -25.8 40 41 A N S S+ 0 0 95 1,-0.2 5,-0.1 5,-0.1 -2,-0.1 0.871 110.4 47.1 -60.7 -40.7 -5.9 -17.0 -25.3 41 42 A D S S+ 0 0 157 3,-0.1 -1,-0.2 2,-0.0 -3,-0.0 0.868 103.0 80.9 -64.2 -38.8 -6.3 -16.8 -21.5 42 43 A S S > S- 0 0 7 -3,-0.2 3,-1.1 1,-0.1 68,-0.1 -0.060 87.8-114.7 -75.0 168.6 -9.0 -14.1 -21.7 43 44 A P T 3 S+ 0 0 12 0, 0.0 98,-0.2 0, 0.0 -1,-0.1 0.440 110.2 73.9 -78.4 -1.4 -12.8 -14.3 -22.4 44 45 A Y T > + 0 0 0 -5,-0.3 3,-1.9 65,-0.1 -6,-0.3 0.342 69.2 143.7 -92.3 6.5 -12.0 -12.3 -25.5 45 46 A Q T < + 0 0 110 -3,-1.1 3,-0.1 1,-0.3 -5,-0.1 -0.214 65.1 16.8 -60.3 130.2 -10.6 -15.4 -27.2 46 47 A G T 3 S+ 0 0 52 -8,-0.6 -1,-0.3 1,-0.4 2,-0.1 0.043 97.2 116.0 97.6 -20.9 -11.3 -15.8 -30.8 47 48 A G < - 0 0 1 -3,-1.9 -9,-2.4 -8,-0.1 2,-0.5 -0.464 56.8-144.1 -73.2 147.5 -12.3 -12.1 -31.3 48 49 A V E -B 37 0A 52 97,-2.2 2,-0.5 93,-0.2 -11,-0.2 -0.976 17.3-160.7-113.0 123.3 -10.3 -9.8 -33.6 49 50 A F E -B 36 0A 1 -13,-3.1 -13,-2.4 -2,-0.5 2,-0.3 -0.900 2.1-152.9-112.1 129.9 -10.1 -6.3 -32.3 50 51 A F E -B 35 0A 81 -2,-0.5 19,-2.8 -15,-0.2 20,-1.5 -0.729 14.5-177.3-100.4 144.3 -9.2 -3.3 -34.4 51 52 A L E -BC 34 68A 0 -17,-3.0 -17,-2.5 -2,-0.3 2,-0.4 -0.942 19.4-134.8-137.2 156.7 -7.7 -0.1 -33.0 52 53 A T E -BC 33 67A 41 15,-2.3 15,-1.7 -2,-0.3 2,-0.5 -0.902 14.9-164.0-110.9 142.0 -6.7 3.3 -34.3 53 54 A I E -BC 32 66A 0 -21,-3.3 -21,-3.4 -2,-0.4 2,-0.5 -0.985 5.2-175.5-126.2 124.2 -3.4 4.9 -33.5 54 55 A H E -BC 31 65A 73 11,-2.6 11,-3.2 -2,-0.5 -23,-0.2 -0.976 14.4-147.8-118.8 127.4 -2.8 8.6 -34.1 55 56 A F - 0 0 1 -25,-2.6 2,-0.1 -2,-0.5 -2,-0.0 -0.811 16.3-130.4 -96.2 127.1 0.7 10.1 -33.4 56 57 A P > - 0 0 13 0, 0.0 3,-2.3 0, 0.0 6,-0.1 -0.361 24.0-113.6 -69.5 155.5 0.9 13.7 -32.2 57 58 A T T 3 S+ 0 0 112 1,-0.3 -55,-0.1 -2,-0.1 -2,-0.0 0.835 119.0 56.1 -59.7 -31.4 3.2 16.0 -34.0 58 59 A D T > S+ 0 0 87 5,-0.1 3,-2.2 2,-0.1 4,-0.3 0.416 92.4 169.1 -85.4 5.0 5.2 16.2 -30.8 59 60 A Y T < + 0 0 3 -3,-2.3 -55,-0.1 1,-0.3 -54,-0.1 -0.290 56.5 24.0 -61.8 138.1 5.6 12.4 -30.7 60 61 A P T 3 S+ 0 0 16 0, 0.0 -1,-0.3 0, 0.0 36,-0.1 -0.930 119.9 59.9 -99.2 15.2 7.4 10.8 -28.9 61 62 A F S < S+ 0 0 154 -3,-2.2 -2,-0.2 -5,-0.1 -3,-0.0 0.870 115.7 39.8 -63.6 -36.9 7.4 13.6 -26.4 62 63 A K S S- 0 0 117 -4,-0.3 27,-0.1 -6,-0.1 -1,-0.1 -0.873 100.6-104.5-113.6 147.3 3.7 13.2 -26.2 63 64 A P - 0 0 35 0, 0.0 2,-0.1 0, 0.0 -5,-0.1 -0.271 34.4-102.7 -72.1 152.9 1.9 9.8 -26.3 64 65 A P - 0 0 3 0, 0.0 2,-0.7 0, 0.0 -9,-0.2 -0.451 34.0-117.6 -68.8 149.0 0.1 8.3 -29.3 65 66 A K E -C 54 0A 135 -11,-3.2 -11,-2.6 -2,-0.1 2,-0.4 -0.824 39.7-176.1 -91.8 117.7 -3.7 8.5 -29.1 66 67 A V E +C 53 0A 15 -2,-0.7 17,-0.6 -13,-0.2 2,-0.3 -0.946 9.0 161.9-121.4 134.6 -5.0 5.0 -29.1 67 68 A A E -CD 52 82A 26 -15,-1.7 -15,-2.3 -2,-0.4 2,-0.3 -0.990 37.0-110.1-146.2 152.9 -8.7 3.8 -29.2 68 69 A F E -C 51 0A 6 13,-2.6 -17,-0.3 -2,-0.3 4,-0.1 -0.656 21.0-178.9 -78.4 137.9 -10.7 0.7 -30.0 69 70 A T S S+ 0 0 85 -19,-2.8 2,-0.3 -2,-0.3 -18,-0.2 0.671 70.4 74.5-101.0 -33.6 -12.8 0.7 -33.1 70 71 A T S S- 0 0 20 -20,-1.5 2,-0.2 11,-0.1 75,-0.1 -0.602 95.6-109.7 -73.5 139.7 -14.2 -2.7 -32.4 71 72 A R + 0 0 102 -2,-0.3 2,-0.3 73,-0.2 73,-0.1 -0.482 43.6 178.1 -70.0 141.2 -16.8 -2.9 -29.6 72 73 A I - 0 0 11 6,-0.2 2,-0.9 -2,-0.2 9,-0.1 -1.000 33.6-127.8-148.2 146.6 -15.6 -4.6 -26.4 73 74 A Y + 0 0 16 -2,-0.3 5,-0.1 64,-0.2 68,-0.1 -0.824 55.1 135.5 -96.7 100.1 -16.9 -5.4 -22.9 74 75 A H B > -E 77 0B 0 -2,-0.9 3,-0.6 3,-0.7 49,-0.1 -0.995 58.4-136.3-146.7 142.7 -14.3 -4.1 -20.5 75 76 A P T 3 S+ 0 0 0 0, 0.0 43,-3.5 0, 0.0 44,-2.1 0.804 111.6 43.4 -62.7 -33.9 -14.2 -2.1 -17.3 76 77 A N T 3 S+ 0 0 1 41,-0.2 8,-2.2 42,-0.2 2,-0.4 0.419 107.9 65.9 -95.5 -2.7 -11.3 0.0 -18.7 77 78 A I B < S-EF 74 83B 1 -3,-0.6 -3,-0.7 6,-0.2 6,-0.2 -0.985 71.5-150.3-126.2 123.0 -12.7 0.5 -22.2 78 79 A N > - 0 0 49 4,-1.6 3,-2.6 -2,-0.4 -6,-0.2 -0.317 34.1 -93.1 -88.8 174.5 -15.9 2.5 -22.9 79 80 A S T 3 S+ 0 0 83 1,-0.3 -1,-0.1 2,-0.1 -7,-0.0 0.746 124.6 54.1 -60.1 -29.5 -18.6 2.4 -25.6 80 81 A N T 3 S- 0 0 135 2,-0.1 -1,-0.3 -9,-0.1 -9,-0.0 0.447 120.4-108.1 -85.6 -0.2 -16.7 4.9 -27.7 81 82 A G < + 0 0 5 -3,-2.6 -13,-2.6 1,-0.3 -2,-0.1 0.342 65.4 153.1 89.2 -1.3 -13.6 2.8 -27.6 82 83 A S B -D 67 0A 57 -15,-0.2 -4,-1.6 1,-0.1 2,-0.4 -0.287 33.9-139.8 -63.6 143.3 -11.6 5.1 -25.3 83 84 A I B -F 77 0B 10 -17,-0.6 2,-0.9 -6,-0.2 -6,-0.2 -0.879 11.9-155.1-115.3 130.8 -8.9 3.4 -23.2 84 85 A S + 0 0 7 -8,-2.2 2,-0.4 -2,-0.4 139,-0.1 -0.787 41.2 141.6-101.6 88.6 -7.9 4.0 -19.6 85 86 A L >> - 0 0 17 -2,-0.9 3,-1.2 1,-0.1 4,-0.7 -0.998 50.7-138.2-129.2 136.3 -4.3 2.9 -19.5 86 87 A D G >4>S+ 0 0 82 -2,-0.4 5,-2.3 1,-0.3 3,-1.2 0.861 101.3 61.5 -61.6 -37.2 -1.6 4.6 -17.5 87 88 A I G 345S+ 0 0 21 1,-0.3 -1,-0.3 4,-0.2 6,-0.2 0.725 100.7 55.3 -62.9 -25.5 1.0 4.3 -20.2 88 89 A L G <45S+ 0 0 17 -3,-1.2 -1,-0.3 4,-0.1 -2,-0.2 0.695 126.4 9.2 -80.7 -24.0 -1.2 6.4 -22.5 89 90 A R T X<5S+ 0 0 143 -3,-1.2 3,-1.0 -4,-0.7 -3,-0.1 0.544 132.1 11.3-119.4 -92.7 -1.4 9.3 -20.1 90 91 A S T 3 5S+ 0 0 94 1,-0.2 -3,-0.2 -5,-0.1 -4,-0.1 0.839 127.6 46.7 -63.7 -38.4 0.5 9.8 -16.9 91 92 A Q T 3 - 0 0 48 -6,-0.2 3,-2.9 -2,-0.1 -32,-0.1 -0.985 32.3-135.9-135.6 139.3 7.8 7.7 -21.8 94 95 A P T 3 S+ 0 0 54 0, 0.0 -33,-0.1 0, 0.0 -32,-0.1 0.690 109.2 66.7 -61.3 -19.9 9.5 8.7 -25.0 95 96 A A T 3 S+ 0 0 77 2,-0.1 2,-0.1 -35,-0.0 -3,-0.0 0.706 87.5 89.8 -67.6 -28.5 11.4 5.5 -24.3 96 97 A L < - 0 0 38 -3,-2.9 2,-0.3 -36,-0.1 3,-0.0 -0.312 64.6-147.8 -75.6 158.4 8.3 3.4 -24.8 97 98 A T > - 0 0 36 1,-0.1 4,-2.1 -2,-0.1 3,-0.2 -0.795 28.3-112.2-126.7 164.8 7.1 2.0 -28.1 98 99 A I H > S+ 0 0 0 -2,-0.3 4,-3.0 1,-0.2 5,-0.3 0.885 119.8 58.8 -62.8 -34.7 3.8 1.1 -29.9 99 100 A S H > S+ 0 0 32 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.887 107.2 46.6 -61.0 -41.1 4.8 -2.5 -29.5 100 101 A K H > S+ 0 0 99 -3,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.872 110.6 52.2 -65.9 -39.7 4.9 -1.9 -25.8 101 102 A V H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.900 111.0 47.1 -63.3 -43.9 1.6 -0.1 -25.8 102 103 A L H X S+ 0 0 1 -4,-3.0 4,-2.0 2,-0.2 -2,-0.2 0.859 112.4 49.9 -64.2 -39.1 -0.0 -3.0 -27.7 103 104 A L H X S+ 0 0 94 -4,-1.9 4,-2.1 -5,-0.3 -2,-0.2 0.885 110.1 51.0 -64.6 -40.6 1.5 -5.4 -25.3 104 105 A S H X S+ 0 0 37 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.878 109.8 50.2 -63.6 -40.4 0.2 -3.3 -22.4 105 106 A I H X S+ 0 0 0 -4,-2.0 4,-1.5 2,-0.2 -2,-0.2 0.887 108.3 51.8 -66.0 -39.7 -3.2 -3.4 -23.9 106 107 A C H X S+ 0 0 22 -4,-2.0 4,-1.4 1,-0.2 3,-0.2 0.914 110.5 49.1 -62.3 -42.8 -3.2 -7.2 -24.3 107 108 A S H X S+ 0 0 74 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.879 106.6 56.7 -62.7 -38.9 -2.2 -7.5 -20.7 108 109 A L H < S+ 0 0 4 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.829 103.9 53.2 -61.4 -38.2 -5.1 -5.1 -19.8 109 110 A L H < S+ 0 0 0 -4,-1.5 -1,-0.2 -3,-0.2 -2,-0.2 0.849 111.4 45.7 -65.3 -38.3 -7.5 -7.5 -21.6 110 111 A C H < S+ 0 0 41 -4,-1.4 -2,-0.2 1,-0.3 -1,-0.2 0.818 129.0 24.0 -68.5 -40.7 -6.3 -10.4 -19.5 111 112 A D S < S- 0 0 103 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.1 -0.809 79.0-160.9-136.1 100.2 -6.4 -8.4 -16.3 112 113 A P - 0 0 8 0, 0.0 -3,-0.1 0, 0.0 -4,-0.0 -0.248 19.9-128.3 -73.1 155.5 -8.6 -5.4 -16.0 113 114 A N > + 0 0 84 1,-0.2 3,-0.7 3,-0.1 10,-0.1 -0.771 33.8 168.6-108.1 86.8 -8.3 -2.6 -13.5 114 115 A P T 3 + 0 0 17 0, 0.0 -1,-0.2 0, 0.0 9,-0.1 0.805 68.2 66.4 -64.1 -35.7 -11.7 -2.4 -11.9 115 116 A D T 3 S+ 0 0 101 1,-0.3 -2,-0.0 8,-0.1 9,-0.0 0.755 112.8 33.9 -64.6 -25.2 -10.8 -0.2 -9.0 116 117 A D S < S+ 0 0 65 -3,-0.7 -1,-0.3 -32,-0.1 -3,-0.1 -0.666 95.4 171.6-128.9 74.0 -10.0 2.7 -11.5 117 118 A P - 0 0 4 0, 0.0 106,-0.3 0, 0.0 -41,-0.2 -0.261 43.5-154.9 -87.1 163.4 -12.7 2.0 -14.2 118 119 A L S S+ 0 0 8 -43,-3.5 -42,-0.2 1,-0.3 102,-0.1 0.520 100.2 37.3-103.9 -24.1 -14.0 3.7 -17.3 119 120 A V S > S- 0 0 36 -44,-2.1 4,-1.8 1,-0.1 3,-0.3 -0.908 72.5-166.3-128.2 106.2 -17.3 1.9 -17.0 120 121 A P H > S+ 0 0 10 0, 0.0 4,-1.7 0, 0.0 5,-0.1 0.809 84.1 54.6 -62.6 -40.0 -18.4 1.5 -13.4 121 122 A E H > S+ 0 0 79 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.863 109.8 46.5 -65.0 -40.5 -21.1 -1.1 -14.0 122 123 A I H > S+ 0 0 17 -3,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.886 110.9 52.7 -65.3 -40.9 -18.8 -3.5 -15.8 123 124 A A H X S+ 0 0 3 -4,-1.8 4,-1.8 1,-0.2 -2,-0.2 0.863 106.7 53.9 -62.9 -37.1 -16.1 -3.1 -13.1 124 125 A R H X S+ 0 0 95 -4,-1.7 4,-2.6 2,-0.2 5,-0.4 0.890 109.9 46.9 -63.6 -43.5 -18.7 -4.0 -10.5 125 126 A I H X S+ 0 0 12 -4,-1.5 4,-2.2 2,-0.2 8,-0.4 0.906 110.3 51.6 -64.9 -42.1 -19.6 -7.2 -12.3 126 127 A Y H < S+ 0 0 18 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.835 116.9 42.0 -61.4 -41.8 -16.0 -8.1 -12.8 127 128 A K H < S+ 0 0 116 -4,-1.8 3,-0.2 -5,-0.2 -2,-0.2 0.908 127.8 24.6 -70.6 -49.5 -15.4 -7.6 -9.0 128 129 A T H < S+ 0 0 80 -4,-2.6 -3,-0.2 1,-0.2 -2,-0.2 0.683 135.1 27.0 -93.0 -26.4 -18.5 -9.2 -7.5 129 130 A D >X + 0 0 70 -4,-2.2 4,-1.9 -5,-0.4 3,-0.6 -0.535 59.6 168.8-138.5 75.1 -19.5 -11.6 -10.2 130 131 A R H 3> S+ 0 0 118 -3,-0.2 4,-2.6 1,-0.2 5,-0.2 0.788 79.0 57.7 -60.9 -32.4 -16.6 -12.8 -12.3 131 132 A D H 3> S+ 0 0 130 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.892 106.7 47.8 -63.9 -43.5 -18.6 -15.6 -14.0 132 133 A K H <> S+ 0 0 72 -3,-0.6 4,-2.8 2,-0.2 5,-0.3 0.877 112.2 50.4 -64.4 -40.6 -21.2 -13.1 -15.3 133 134 A Y H X S+ 0 0 3 -4,-1.9 4,-2.5 -8,-0.4 -2,-0.2 0.937 112.6 45.6 -64.1 -45.0 -18.4 -10.9 -16.6 134 135 A N H X S+ 0 0 39 -4,-2.6 4,-1.6 2,-0.2 -2,-0.2 0.893 115.1 48.6 -63.2 -41.6 -16.6 -13.7 -18.3 135 136 A R H X S+ 0 0 124 -4,-2.5 4,-1.5 2,-0.2 -2,-0.2 0.919 115.6 41.7 -65.6 -47.4 -20.0 -14.9 -19.8 136 137 A I H X S+ 0 0 21 -4,-2.8 4,-1.9 2,-0.2 5,-0.2 0.882 111.0 56.9 -64.9 -38.9 -21.0 -11.5 -21.0 137 138 A S H X S+ 0 0 0 -4,-2.5 4,-1.4 -5,-0.3 -64,-0.2 0.872 107.7 49.1 -61.3 -39.0 -17.5 -10.7 -22.3 138 139 A R H X S+ 0 0 137 -4,-1.6 4,-1.8 2,-0.2 5,-0.2 0.868 106.1 56.3 -64.1 -40.1 -17.8 -13.9 -24.4 139 140 A E H X S+ 0 0 95 -4,-1.5 4,-2.0 1,-0.2 -2,-0.2 0.880 109.7 45.9 -60.2 -40.0 -21.2 -12.9 -25.8 140 141 A W H X>S+ 0 0 72 -4,-1.9 4,-3.2 2,-0.2 5,-0.6 0.828 105.3 60.3 -74.8 -31.7 -19.8 -9.6 -27.0 141 142 A T H X>S+ 0 0 4 -4,-1.4 4,-2.4 -98,-0.2 5,-1.1 0.951 113.8 36.3 -60.8 -47.0 -16.7 -11.3 -28.6 142 143 A Q H <5S+ 0 0 140 -4,-1.8 4,-0.3 3,-0.2 -2,-0.2 0.889 119.5 50.0 -70.8 -42.1 -18.9 -13.4 -30.9 143 144 A K H <5S+ 0 0 142 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.901 133.6 8.3 -63.2 -44.0 -21.4 -10.6 -31.4 144 145 A Y H <5S+ 0 0 81 -4,-3.2 -73,-0.2 -5,-0.1 -3,-0.2 0.632 127.0 48.8-114.0 -19.0 -18.8 -7.9 -32.3 145 146 A A T << 0 0 7 -4,-2.4 -97,-2.2 -5,-0.6 -3,-0.2 0.695 360.0 360.0-107.4 -19.0 -15.3 -9.4 -32.7 146 147 A M < 0 0 142 -5,-1.1 -1,-0.1 -4,-0.3 -4,-0.1 0.631 360.0 360.0 -79.6 360.0 -15.8 -12.4 -35.0 147 !* 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 0.0 148 1 B M 0 0 30 0, 0.0 16,-3.3 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 153.0 -39.8 10.1 1.1 149 2 B Q E +G 163 0C 68 14,-0.2 62,-3.2 12,-0.0 63,-0.3 -0.954 360.0 169.4-123.2 126.5 -39.3 8.6 -2.4 150 3 B I E -G 162 0C 0 12,-1.5 12,-2.6 -2,-0.5 2,-0.4 -0.901 23.1-130.3-130.6 162.1 -37.0 9.9 -5.1 151 4 B F E -Gh 161 213C 52 61,-2.9 63,-4.1 -2,-0.3 2,-0.5 -0.876 8.3-160.3-115.1 144.7 -35.8 8.6 -8.5 152 5 B V E -Gh 160 214C 0 8,-2.0 8,-3.5 -2,-0.4 2,-0.5 -0.987 10.9-154.3-122.8 124.3 -32.3 8.3 -9.9 153 6 B K E -Gh 159 215C 84 61,-3.5 63,-2.4 -2,-0.5 6,-0.2 -0.845 10.2-154.8-103.1 127.7 -31.9 8.0 -13.7 154 7 B T > - 0 0 21 4,-2.5 3,-1.8 -2,-0.5 63,-0.1 -0.488 30.5-107.0 -97.2 167.4 -28.8 6.3 -15.0 155 8 B L T 3 S+ 0 0 126 61,-0.4 -1,-0.1 1,-0.3 62,-0.1 0.731 118.3 61.5 -67.8 -20.2 -27.2 6.7 -18.4 156 9 B T T 3 S- 0 0 121 2,-0.1 -1,-0.3 1,-0.0 3,-0.1 0.554 120.3-108.4 -80.6 -5.1 -28.4 3.2 -19.4 157 10 B G S < S+ 0 0 53 -3,-1.8 2,-0.2 1,-0.3 -2,-0.1 0.378 74.2 136.8 90.5 -1.1 -31.9 4.5 -19.0 158 11 B K - 0 0 91 -5,-0.0 -4,-2.5 1,-0.0 2,-0.5 -0.474 46.5-139.0 -71.1 148.2 -32.7 2.5 -15.8 159 12 B T E -G 153 0C 73 -6,-0.2 2,-0.4 -2,-0.2 -6,-0.2 -0.942 10.0-153.4-112.2 125.8 -34.5 4.2 -13.0 160 13 B I E -G 152 0C 4 -8,-3.5 -8,-2.0 -2,-0.5 2,-0.6 -0.774 6.2-148.0 -93.1 144.3 -33.5 3.6 -9.4 161 14 B T E -G 151 0C 54 -2,-0.4 2,-0.3 -10,-0.2 -10,-0.2 -0.940 20.2-174.6-116.3 113.9 -36.1 4.0 -6.7 162 15 B L E -G 150 0C 5 -12,-2.6 -12,-1.5 -2,-0.6 2,-0.5 -0.747 22.2-142.2-107.7 152.0 -34.7 5.3 -3.4 163 16 B E E +G 149 0C 114 -2,-0.3 2,-0.2 -14,-0.2 -14,-0.2 -0.962 43.5 141.9-109.3 120.3 -36.2 5.8 0.1 164 17 B V - 0 0 3 -16,-3.3 9,-0.0 -2,-0.5 -2,-0.0 -0.825 42.4-120.8-143.9-179.6 -34.9 8.9 1.7 165 18 B E > - 0 0 106 -2,-0.2 3,-2.0 4,-0.1 38,-0.3 -0.927 32.2-112.6-127.2 157.5 -35.6 11.9 3.9 166 19 B P T 3 S+ 0 0 54 0, 0.0 38,-1.8 0, 0.0 39,-0.3 0.710 116.9 54.7 -60.3 -21.0 -35.3 15.7 3.2 167 20 B S T 3 S+ 0 0 89 36,-0.2 2,-0.2 35,-0.1 -3,-0.0 0.474 80.5 116.9 -94.6 -1.9 -32.5 15.9 5.7 168 21 B D < - 0 0 30 -3,-2.0 35,-2.1 34,-0.1 36,-0.2 -0.459 65.2-126.2 -67.1 133.2 -30.4 13.1 4.1 169 22 B T B > -K 202 0D 35 33,-0.3 4,-1.9 -2,-0.2 3,-0.3 -0.353 19.3-112.9 -74.7 162.8 -27.1 14.3 2.8 170 23 B I H > S+ 0 0 0 31,-2.4 4,-1.5 28,-0.4 29,-0.2 0.713 121.1 58.8 -66.9 -25.1 -26.0 13.8 -0.8 171 24 B E H > S+ 0 0 114 28,-1.3 4,-1.1 30,-0.3 -1,-0.2 0.863 104.8 48.1 -66.1 -41.3 -23.4 11.5 0.8 172 25 B N H > S+ 0 0 67 -3,-0.3 4,-1.5 27,-0.2 -2,-0.2 0.868 109.7 53.2 -66.4 -39.5 -26.1 9.4 2.3 173 26 B V H X S+ 0 0 0 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.894 106.6 51.2 -65.4 -40.7 -28.0 9.2 -1.0 174 27 B K H X S+ 0 0 10 -4,-1.5 4,-1.1 1,-0.2 -1,-0.2 0.804 107.6 54.7 -65.4 -28.1 -24.9 8.0 -2.8 175 28 B A H X S+ 0 0 37 -4,-1.1 4,-1.4 2,-0.2 -1,-0.2 0.841 106.8 49.8 -73.9 -33.9 -24.5 5.3 -0.1 176 29 B K H X S+ 0 0 58 -4,-1.5 4,-1.4 2,-0.2 -2,-0.2 0.841 107.5 54.4 -70.7 -32.6 -28.1 4.2 -0.8 177 30 B I H X S+ 0 0 0 -4,-1.8 4,-2.3 1,-0.2 6,-0.5 0.794 106.6 52.6 -71.3 -27.5 -27.3 4.1 -4.5 178 31 B Q H X S+ 0 0 71 -4,-1.1 4,-1.7 3,-0.2 -1,-0.2 0.844 103.8 56.5 -73.9 -35.1 -24.4 1.8 -3.6 179 32 B D H < S+ 0 0 132 -4,-1.4 -2,-0.2 1,-0.2 -1,-0.2 0.874 118.4 32.5 -62.7 -37.7 -26.7 -0.5 -1.7 180 33 B K H < S+ 0 0 123 -4,-1.4 -2,-0.2 3,-0.1 -1,-0.2 0.835 135.1 22.9 -90.1 -35.3 -28.9 -1.0 -4.8 181 34 B E H < S- 0 0 35 -4,-2.3 -3,-0.2 -5,-0.2 -2,-0.2 0.584 91.2-129.2-111.5 -15.4 -26.4 -0.8 -7.6 182 35 B G < + 0 0 6 -4,-1.7 -4,-0.2 -5,-0.4 -3,-0.1 0.602 60.2 138.1 75.7 12.8 -23.1 -1.6 -5.9 183 36 B I - 0 0 17 -6,-0.5 -1,-0.3 -9,-0.1 -2,-0.2 -0.806 53.9-124.9 -92.0 121.7 -21.4 1.4 -7.3 184 37 B P > - 0 0 35 0, 0.0 3,-1.5 0, 0.0 -9,-0.1 -0.262 21.8-113.8 -62.5 152.7 -19.1 3.1 -4.8 185 38 B P G > S+ 0 0 39 0, 0.0 3,-2.0 0, 0.0 -10,-0.1 0.794 111.6 74.4 -60.9 -26.9 -19.7 6.8 -4.2 186 39 B D G 3 S+ 0 0 73 1,-0.3 -3,-0.0 3,-0.0 0, 0.0 0.884 101.4 39.4 -44.6 -47.8 -16.3 7.5 -5.7 187 40 B Q G < S+ 0 0 23 -3,-1.5 2,-0.4 31,-0.1 32,-0.3 0.064 100.3 101.8 -99.2 22.1 -17.7 6.7 -9.2 188 41 B Q < + 0 0 0 -3,-2.0 2,-0.3 30,-0.1 30,-0.1 -0.868 40.9 174.8-111.2 143.2 -21.0 8.5 -8.5 189 42 B R E -I 217 0C 102 28,-0.8 28,-3.1 -2,-0.4 2,-0.4 -0.942 12.7-158.3-148.3 122.3 -22.0 12.0 -9.7 190 43 B L E -I 216 0C 0 7,-0.4 7,-2.4 -2,-0.3 2,-0.4 -0.836 4.8-167.9-111.9 139.2 -25.4 13.5 -9.2 191 44 B I E +IJ 215 196C 45 24,-2.1 24,-2.0 -2,-0.4 2,-0.3 -0.946 14.1 157.9-123.7 139.8 -27.1 16.3 -11.1 192 45 B F E > - J 0 195C 43 3,-2.3 3,-1.9 -2,-0.4 22,-0.1 -0.879 66.4 -3.5-160.1 132.8 -30.3 18.2 -10.3 193 46 B A T 3 S- 0 0 82 1,-0.3 3,-0.1 -2,-0.3 21,-0.0 0.870 128.2 -54.2 56.8 39.5 -31.7 21.6 -11.3 194 47 B G T 3 S+ 0 0 80 1,-0.2 2,-0.3 0, 0.0 -1,-0.3 0.328 117.4 108.6 79.9 -6.6 -28.6 22.4 -13.3 195 48 B K E < -J 192 0C 121 -3,-1.9 -3,-2.3 11,-0.1 2,-0.6 -0.722 69.9-128.9-105.3 150.3 -26.3 21.8 -10.3 196 49 B Q E -J 191 0C 107 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.882 42.3-118.3 -88.4 120.3 -23.8 19.0 -9.5 197 50 B L - 0 0 3 -7,-2.4 -7,-0.4 -2,-0.6 2,-0.2 -0.428 22.0-136.3 -72.3 123.7 -24.8 17.9 -6.0 198 51 B E > - 0 0 119 -2,-0.3 3,-1.3 1,-0.1 -28,-0.4 -0.544 11.6-129.3 -81.5 141.8 -22.2 18.4 -3.3 199 52 B D T 3 S+ 0 0 65 1,-0.3 -28,-1.3 -2,-0.2 -27,-0.2 0.715 100.6 54.5 -64.0 -27.1 -21.6 15.6 -0.8 200 53 B G T 3 S+ 0 0 71 -30,-0.2 2,-0.3 -31,-0.1 -1,-0.3 0.135 94.5 83.1 -99.1 21.5 -21.9 17.6 2.4 201 54 B R S < S- 0 0 90 -3,-1.3 -31,-2.4 -33,-0.0 -30,-0.3 -0.858 73.5-117.5-123.2 159.0 -25.3 19.1 1.7 202 55 B T B >> -K 169 0D 29 -2,-0.3 4,-1.1 -33,-0.3 3,-0.6 -0.459 24.7-111.0 -96.1 165.8 -28.8 17.8 2.2 203 56 B L T 34>S+ 0 0 0 -35,-2.1 5,-3.6 -38,-0.3 -36,-0.2 0.795 119.7 53.6 -62.6 -28.3 -31.6 17.1 -0.2 204 57 B S T >45S+ 0 0 62 -38,-1.8 3,-1.0 3,-0.3 -1,-0.2 0.725 97.3 64.5 -81.1 -20.5 -33.6 20.0 1.2 205 58 B D T <45S+ 0 0 85 -3,-0.6 -1,-0.2 1,-0.3 -2,-0.2 0.882 110.8 37.8 -63.8 -37.6 -30.6 22.3 0.6 206 59 B Y T 3<5S- 0 0 20 -4,-1.1 -1,-0.3 2,-0.1 -2,-0.2 0.135 117.2-121.7 -95.0 14.5 -31.2 21.6 -3.1 207 60 B N T < 5 + 0 0 124 -3,-1.0 2,-0.5 1,-0.2 -3,-0.3 0.857 49.4 170.0 41.8 47.1 -34.9 21.7 -2.4 208 61 B I < - 0 0 5 -5,-3.6 2,-0.2 -42,-0.1 -1,-0.2 -0.761 9.5-179.7 -85.2 128.3 -35.3 18.1 -3.7 209 62 B Q > - 0 0 127 -2,-0.5 3,-1.9 1,-0.2 -44,-0.0 -0.668 34.7 -45.0-124.2 178.4 -38.7 16.8 -2.9 210 63 B K T 3 S+ 0 0 101 1,-0.3 -60,-0.2 -2,-0.2 -1,-0.2 -0.029 121.8 11.3 -44.5 138.9 -40.9 13.7 -3.4 211 64 B E T 3 S+ 0 0 136 -62,-3.2 -1,-0.3 1,-0.2 -61,-0.2 0.556 87.5 149.8 65.9 11.0 -40.8 12.1 -6.9 212 65 B S < - 0 0 17 -3,-1.9 -61,-2.9 -63,-0.3 2,-0.6 -0.508 41.3-137.0 -69.8 141.7 -37.9 14.2 -8.0 213 66 B T E -h 151 0C 50 -63,-0.2 2,-0.2 -2,-0.2 -61,-0.2 -0.907 17.3-162.9-104.7 119.9 -35.7 12.5 -10.5 214 67 B L E -h 152 0C 0 -63,-4.1 -61,-3.5 -2,-0.6 2,-0.6 -0.672 15.3-128.6 -94.7 157.8 -31.9 12.8 -10.0 215 68 B H E -hI 153 191C 86 -24,-2.0 -24,-2.1 -2,-0.2 2,-0.6 -0.925 14.6-157.6-110.1 120.8 -29.4 12.1 -12.7 216 69 B L E + I 0 190C 17 -63,-2.4 -61,-0.4 -2,-0.6 2,-0.2 -0.859 24.2 162.6 -96.8 123.4 -26.5 9.8 -12.0 217 70 B V E - I 0 189C 35 -28,-3.1 -28,-0.8 -2,-0.6 2,-0.0 -0.741 39.9 -67.1-131.1 178.1 -23.5 10.2 -14.3 218 71 B L - 0 0 66 -2,-0.2 2,-0.2 -30,-0.1 -30,-0.1 -0.295 28.1-165.4 -70.9 150.4 -19.8 9.3 -14.3 219 72 B R - 0 0 118 -32,-0.3 2,-0.3 -2,-0.0 -31,-0.1 -0.582 17.9-170.6-130.2 68.9 -17.2 10.6 -12.0 220 73 B L - 0 0 79 -2,-0.2 -102,-0.1 1,-0.2 -33,-0.0 -0.488 24.9-167.4 -74.2 134.4 -13.8 9.8 -13.5 221 74 B R - 0 0 128 -2,-0.3 -1,-0.2 -104,-0.2 -34,-0.0 0.166 64.6 -96.0 -93.2 10.0 -10.6 10.3 -11.6 222 75 B G 0 0 34 1,-0.3 -2,-0.1 -105,-0.1 -104,-0.1 0.544 360.0 360.0 91.7 9.3 -9.0 9.7 -15.0 223 76 B G 0 0 6 -106,-0.3 -1,-0.3 -139,-0.1 -139,-0.2 -0.821 360.0 360.0 -99.9 360.0 -8.0 6.1 -15.2