==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=17-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE, HYDROLASE 22-AUG-12 4GPZ . COMPND 2 MOLECULE: PHOSPHOGLYCERATE MUTASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.HE,L.ZHOU,L.ZHANG . 477 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21276.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 315 66.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 34 7.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 30 6.3 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 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 1 0.2 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 . 20 4.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 51 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 147 30.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 17 3.6 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 1 4 2 1 2 2 0 0 2 2 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 2 2 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 PARALLEL BRIDGES PER LADDER . 6 2 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 85 0, 0.0 219,-0.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 6.0 -4.9 36.2 -9.1 2 3 A A + 0 0 44 217,-0.8 2,-0.3 1,-0.2 218,-0.2 0.924 360.0 8.0 -57.9 -42.0 -7.8 37.8 -10.9 3 4 A Y E -A 219 0A 23 216,-2.3 216,-2.6 2,-0.0 2,-0.4 -0.976 61.8-147.6-143.1 156.0 -7.9 34.4 -12.8 4 5 A K E -A 218 0A 77 -2,-0.3 176,-0.7 214,-0.2 2,-0.4 -0.975 19.7-175.8-123.7 128.6 -6.4 30.9 -12.7 5 6 A L E -Ab 217 180A 0 212,-2.4 212,-3.1 -2,-0.4 2,-0.5 -0.999 7.5-160.9-126.5 136.6 -6.0 29.1 -16.1 6 7 A V E -Ab 216 181A 0 174,-2.1 176,-2.2 -2,-0.4 2,-0.4 -0.960 7.5-175.5-122.0 125.7 -4.8 25.5 -16.5 7 8 A L E -Ab 215 182A 0 208,-2.5 208,-3.3 -2,-0.5 2,-0.4 -0.936 0.9-174.8-112.5 146.5 -3.4 24.2 -19.8 8 9 A I E - b 0 183A 1 174,-2.8 176,-2.2 -2,-0.4 2,-0.3 -0.936 17.5-143.8-140.8 126.4 -2.3 20.6 -20.4 9 10 A R E -cb 211 184A 51 201,-0.5 203,-2.1 204,-0.5 176,-0.2 -0.579 45.8 -89.8 -75.4 145.8 -0.7 19.1 -23.5 10 11 A X - 0 0 20 174,-2.0 202,-0.5 -2,-0.3 52,-0.2 -0.141 49.4 -97.0 -49.2 145.8 -1.9 15.6 -24.2 11 12 A G - 0 0 0 50,-0.5 22,-0.2 200,-0.3 23,-0.1 -0.236 67.9 -57.6 -55.4 159.5 0.0 12.8 -22.6 12 13 A E - 0 0 30 20,-0.2 18,-2.6 199,-0.2 21,-0.3 -0.074 62.9-134.2 -42.6 131.8 2.6 11.2 -24.7 13 14 A S B > -H 29 0B 9 16,-0.3 3,-1.6 -3,-0.1 4,-0.4 -0.497 22.1-104.9 -94.2 166.2 1.1 9.8 -27.9 14 15 A A T 3 S+ 0 0 53 14,-3.0 4,-0.2 1,-0.3 3,-0.1 0.635 118.1 53.3 -59.8 -18.6 1.7 6.3 -29.5 15 16 A W T 3 >S+ 0 0 27 13,-0.3 5,-1.6 1,-0.1 3,-0.4 0.520 79.6 90.4 -98.9 -6.1 3.9 7.9 -32.2 16 17 A N T X 5S+ 0 0 80 -3,-1.6 3,-2.0 1,-0.2 -1,-0.1 0.920 87.7 48.2 -62.2 -44.9 6.3 9.9 -30.1 17 18 A L T 3 5S+ 0 0 139 -4,-0.4 -1,-0.2 1,-0.3 -2,-0.1 0.782 109.2 54.5 -68.4 -26.5 8.9 7.0 -29.8 18 19 A E T 3 5S- 0 0 118 -3,-0.4 -1,-0.3 -4,-0.2 -2,-0.2 0.467 105.2-132.4 -78.9 -2.6 8.7 6.5 -33.6 19 20 A N T < 5 + 0 0 87 -3,-2.0 80,-0.9 -4,-0.3 2,-0.4 0.895 55.2 154.2 50.0 45.5 9.5 10.3 -34.1 20 21 A R B < -I 98 0C 82 -5,-1.6 2,-0.8 78,-0.2 78,-0.3 -0.863 51.3-117.6-114.1 139.7 6.6 10.2 -36.5 21 22 A F + 0 0 30 76,-2.5 75,-3.3 73,-0.4 76,-0.3 -0.666 33.7 172.3 -81.2 109.2 4.5 13.2 -37.4 22 23 A S > + 0 0 7 -2,-0.8 3,-2.8 73,-0.2 -1,-0.2 0.905 16.8 153.9 -82.7 -48.9 1.0 12.5 -36.3 23 24 A G T 3 S- 0 0 1 1,-0.3 65,-0.3 67,-0.1 67,-0.2 -0.297 80.8 -7.9 62.9-123.7 -0.5 15.9 -37.0 24 25 A W T 3 S+ 0 0 5 63,-0.1 -1,-0.3 2,-0.1 2,-0.2 0.534 106.2 113.0 -87.0 -2.6 -4.2 15.5 -37.7 25 26 A Y S < S- 0 0 68 -3,-2.8 2,-2.1 1,-0.1 71,-0.1 -0.506 79.0-120.2 -61.3 132.6 -3.9 11.7 -37.7 26 27 A D + 0 0 17 -2,-0.2 -1,-0.1 34,-0.1 2,-0.1 -0.359 43.6 174.7 -82.3 57.9 -5.9 10.6 -34.6 27 28 A A - 0 0 2 -2,-2.1 34,-0.5 -4,-0.2 3,-0.1 -0.419 22.0-132.6 -65.2 148.8 -3.2 8.8 -32.7 28 29 A D - 0 0 47 1,-0.2 -14,-3.0 32,-0.1 -13,-0.3 -0.251 30.7 -80.9 -91.0 177.5 -3.9 7.6 -29.2 29 30 A L B -H 13 0B 19 -16,-0.3 -16,-0.3 31,-0.1 -1,-0.2 -0.446 40.9-125.7 -71.3 146.3 -2.0 7.9 -26.0 30 31 A S > - 0 0 13 -18,-2.6 4,-2.3 -2,-0.1 5,-0.2 -0.462 33.0-101.6 -74.8 164.6 0.9 5.6 -25.3 31 32 A P H > S+ 0 0 115 0, 0.0 4,-1.9 0, 0.0 5,-0.2 0.941 128.0 49.3 -50.4 -49.0 0.8 3.6 -22.0 32 33 A A H > S+ 0 0 48 1,-0.2 4,-2.0 2,-0.2 -20,-0.2 0.861 109.5 52.5 -60.1 -37.9 3.4 6.1 -20.7 33 34 A G H > S+ 0 0 0 -21,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.872 106.5 51.7 -71.2 -31.8 1.2 9.1 -21.9 34 35 A H H X S+ 0 0 67 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.900 110.0 49.9 -63.8 -42.8 -1.8 7.7 -20.1 35 36 A E H X S+ 0 0 95 -4,-1.9 4,-3.0 2,-0.2 -2,-0.2 0.863 109.7 52.6 -60.9 -36.6 0.3 7.5 -16.9 36 37 A E H X S+ 0 0 40 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.919 109.7 47.3 -64.2 -45.0 1.4 11.1 -17.5 37 38 A A H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.902 112.1 50.7 -64.8 -38.4 -2.2 12.2 -17.8 38 39 A K H X S+ 0 0 87 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.934 110.8 48.4 -62.9 -45.6 -3.1 10.2 -14.6 39 40 A R H X S+ 0 0 102 -4,-3.0 4,-2.6 1,-0.2 -1,-0.2 0.880 111.5 50.0 -62.3 -40.0 -0.3 11.8 -12.7 40 41 A G H X S+ 0 0 4 -4,-2.2 4,-2.4 172,-0.2 -1,-0.2 0.890 111.4 49.6 -62.6 -42.2 -1.3 15.3 -13.9 41 42 A G H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.928 112.1 47.2 -63.5 -44.2 -4.9 14.6 -12.8 42 43 A Q H X S+ 0 0 73 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.890 109.5 54.2 -64.7 -34.8 -3.7 13.4 -9.4 43 44 A A H X S+ 0 0 15 -4,-2.6 4,-1.4 -5,-0.2 -2,-0.2 0.911 111.5 45.0 -63.3 -43.1 -1.5 16.5 -9.1 44 45 A L H <>S+ 0 0 0 -4,-2.4 5,-2.8 2,-0.2 -2,-0.2 0.903 112.4 50.8 -67.6 -34.7 -4.5 18.7 -9.8 45 46 A R H ><5S+ 0 0 115 -4,-2.4 3,-1.5 3,-0.2 -2,-0.2 0.939 111.6 48.4 -65.7 -47.8 -6.8 16.7 -7.4 46 47 A D H 3<5S+ 0 0 119 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.737 109.8 50.6 -66.3 -26.8 -4.1 17.0 -4.6 47 48 A A T 3<5S- 0 0 55 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.294 115.3-122.6 -86.3 -0.8 -3.7 20.8 -5.2 48 49 A G T < 5 + 0 0 53 -3,-1.5 -3,-0.2 1,-0.2 -2,-0.1 0.752 43.7 179.0 69.2 33.1 -7.5 20.9 -4.9 49 50 A Y < - 0 0 26 -5,-2.8 2,-0.4 -6,-0.2 -1,-0.2 -0.400 10.0-168.2 -75.9 141.8 -8.2 22.5 -8.3 50 51 A E - 0 0 89 -2,-0.1 2,-0.3 25,-0.0 -1,-0.0 -0.976 4.2-168.8-125.0 139.9 -11.8 23.1 -9.3 51 52 A F - 0 0 4 -2,-0.4 129,-0.2 1,-0.1 3,-0.1 -0.795 19.9-160.7-122.9 164.7 -12.8 24.0 -12.9 52 53 A D S S+ 0 0 37 127,-3.2 2,-0.3 1,-0.4 128,-0.2 0.575 76.9 9.5-115.5 -19.3 -16.0 25.3 -14.5 53 54 A I E -d 180 0A 15 126,-1.3 128,-1.9 25,-0.1 -1,-0.4 -0.975 62.0-150.5-160.2 148.6 -15.5 24.5 -18.2 54 55 A C E -de 181 80A 0 25,-2.1 27,-2.6 -2,-0.3 2,-0.4 -0.961 4.5-160.8-124.5 143.4 -13.0 22.6 -20.3 55 56 A F E +de 182 81A 4 126,-2.5 128,-2.6 -2,-0.4 2,-0.3 -0.958 19.0 160.3-122.4 141.0 -11.8 23.0 -23.9 56 57 A T E -de 183 82A 0 25,-2.4 27,-2.0 -2,-0.4 30,-0.3 -0.871 34.9-103.5-147.4 175.7 -10.2 20.5 -26.0 57 58 A S - 0 0 0 126,-0.6 27,-0.3 -2,-0.3 -1,-0.1 -0.139 38.2-104.8 -84.7-168.0 -9.4 19.6 -29.6 58 59 A V S S+ 0 0 11 25,-0.3 2,-0.5 24,-0.2 262,-0.2 0.134 89.3 102.2 -97.5 14.2 -11.2 16.9 -31.7 59 60 A Q S >> S- 0 0 0 1,-0.1 4,-2.5 260,-0.1 3,-1.1 -0.898 72.4-134.2-104.5 136.8 -8.2 14.5 -31.4 60 61 A K H 3> S+ 0 0 27 -2,-0.5 4,-3.1 1,-0.3 5,-0.3 0.772 100.1 63.7 -62.0 -25.5 -8.4 11.6 -29.0 61 62 A R H 3> S+ 0 0 1 -34,-0.5 4,-1.1 1,-0.2 -50,-0.5 0.912 113.0 35.7 -66.7 -38.2 -5.0 12.0 -27.5 62 63 A A H <> S+ 0 0 0 -3,-1.1 4,-2.6 2,-0.2 -2,-0.2 0.911 118.8 50.3 -77.2 -44.3 -6.1 15.4 -26.1 63 64 A I H X S+ 0 0 0 -4,-2.5 4,-3.0 1,-0.2 5,-0.2 0.919 111.1 48.6 -62.2 -40.8 -9.7 14.3 -25.3 64 65 A R H X S+ 0 0 33 -4,-3.1 4,-2.4 2,-0.2 -1,-0.2 0.854 109.2 54.0 -66.4 -38.4 -8.5 11.1 -23.5 65 66 A T H X S+ 0 0 0 -4,-1.1 4,-2.3 -5,-0.3 -2,-0.2 0.951 111.1 46.4 -57.5 -48.3 -6.0 13.3 -21.5 66 67 A L H X S+ 0 0 1 -4,-2.6 4,-3.3 2,-0.2 5,-0.2 0.936 111.6 49.6 -58.5 -50.7 -9.0 15.5 -20.5 67 68 A W H X S+ 0 0 12 -4,-3.0 4,-2.3 1,-0.2 -1,-0.2 0.910 111.3 50.6 -59.5 -38.9 -11.2 12.5 -19.6 68 69 A T H X S+ 0 0 16 -4,-2.4 4,-2.4 -5,-0.2 -1,-0.2 0.930 113.1 45.9 -64.2 -40.2 -8.3 11.1 -17.4 69 70 A V H X S+ 0 0 1 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.939 112.5 49.3 -67.5 -46.1 -7.9 14.4 -15.6 70 71 A L H <>S+ 0 0 0 -4,-3.3 5,-2.8 1,-0.2 6,-0.4 0.861 110.2 50.7 -66.5 -36.5 -11.5 14.9 -15.1 71 72 A D H ><5S+ 0 0 62 -4,-2.3 3,-1.4 -5,-0.2 -1,-0.2 0.952 111.2 50.5 -58.9 -49.8 -11.9 11.3 -13.6 72 73 A A H 3<5S+ 0 0 27 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.870 116.0 39.2 -60.8 -33.8 -9.0 12.0 -11.3 73 74 A I T 3<5S- 0 0 12 -4,-2.3 -1,-0.3 -5,-0.1 -2,-0.2 0.322 109.8-121.1 -99.1 7.2 -10.4 15.3 -10.0 74 75 A D T < 5S+ 0 0 78 -3,-1.4 -3,-0.2 -4,-0.3 3,-0.1 0.870 78.2 121.2 53.7 45.7 -14.0 13.9 -9.9 75 76 A Q > < + 0 0 13 -5,-2.8 3,-1.9 -6,-0.2 -4,-0.2 -0.110 16.5 131.3-129.1 44.9 -15.2 16.6 -12.2 76 77 A M T 3 + 0 0 1 -6,-0.4 -1,-0.1 1,-0.3 -5,-0.1 0.642 67.9 66.9 -65.2 -24.4 -16.6 14.4 -15.1 77 78 A W T 3 S+ 0 0 28 224,-0.2 -1,-0.3 -7,-0.1 248,-0.1 0.441 75.3 113.9 -74.4 -7.2 -19.8 16.4 -14.9 78 79 A L S < S- 0 0 0 -3,-1.9 -25,-0.1 1,-0.1 -26,-0.1 -0.391 77.8-100.0 -69.4 152.5 -18.1 19.7 -16.2 79 80 A P - 0 0 59 0, 0.0 -25,-2.1 0, 0.0 2,-0.4 -0.400 39.9-160.3 -66.0 134.8 -19.1 21.1 -19.6 80 81 A V E -e 54 0A 10 243,-0.5 2,-0.5 -27,-0.2 243,-0.4 -0.999 7.5-163.4-123.4 135.4 -16.6 20.2 -22.3 81 82 A V E -e 55 0A 54 -27,-2.6 -25,-2.4 -2,-0.4 2,-0.4 -0.978 6.6-162.4-119.1 121.0 -16.2 22.0 -25.6 82 83 A R E +e 56 0A 28 -2,-0.5 2,-0.3 -27,-0.2 -25,-0.2 -0.874 13.7 171.7-102.0 143.1 -14.3 20.3 -28.5 83 84 A T > - 0 0 14 -27,-2.0 3,-1.6 -2,-0.4 -25,-0.3 -0.972 40.5-138.2-151.3 140.0 -12.9 22.2 -31.4 84 85 A W G > S+ 0 0 35 -2,-0.3 3,-2.0 -27,-0.3 -1,-0.1 0.759 100.5 76.5 -60.9 -20.6 -10.6 21.6 -34.4 85 86 A R G 3 S+ 0 0 55 1,-0.3 -1,-0.3 77,-0.1 80,-0.1 0.772 92.9 50.4 -69.6 -14.1 -9.1 25.0 -33.7 86 87 A L G < S+ 0 0 2 -3,-1.6 99,-0.4 -30,-0.3 -1,-0.3 0.399 89.4 122.3-101.2 8.2 -7.2 23.5 -30.8 87 88 A N S < S- 0 0 0 -3,-2.0 3,-0.1 -4,-0.1 98,-0.1 -0.187 72.3 -93.3 -60.2 160.5 -5.8 20.6 -33.0 88 89 A E - 0 0 4 -65,-0.3 -1,-0.1 1,-0.2 -64,-0.0 -0.106 62.5 -73.1 -54.9 159.4 -2.2 19.8 -33.5 89 90 A R - 0 0 25 1,-0.1 2,-0.9 -66,-0.1 -1,-0.2 -0.354 46.8-116.4 -55.1 140.0 -0.6 21.4 -36.5 90 91 A H - 0 0 0 -67,-0.2 63,-1.8 64,-0.2 -67,-0.1 -0.790 26.7-163.3 -78.4 110.9 -1.7 19.7 -39.8 91 92 A Y > - 0 0 32 -2,-0.9 3,-1.9 1,-0.2 4,-0.2 0.333 19.5-156.9 -82.7 6.5 1.8 18.4 -41.0 92 93 A G G > - 0 0 0 1,-0.3 3,-2.0 2,-0.2 -1,-0.2 -0.184 67.9 -2.7 63.6-135.0 0.5 17.9 -44.5 93 94 A G G 3 S+ 0 0 8 30,-2.5 -1,-0.3 1,-0.3 32,-0.1 0.614 127.5 69.4 -67.3 -16.0 2.3 15.4 -46.7 94 95 A L G X S+ 0 0 9 -3,-1.9 3,-2.2 29,-0.5 -73,-0.4 0.682 72.8 116.2 -74.1 -12.3 4.7 14.8 -43.8 95 96 A T T < S+ 0 0 1 -3,-2.0 36,-0.2 1,-0.3 -73,-0.2 -0.262 79.1 17.5 -60.4 131.6 2.0 13.1 -41.8 96 97 A G T 3 S+ 0 0 7 -75,-3.3 2,-0.4 1,-0.3 -1,-0.3 0.405 104.4 107.6 96.2 -11.9 2.7 9.5 -41.1 97 98 A L < - 0 0 21 -3,-2.2 -76,-2.5 -76,-0.3 -1,-0.3 -0.808 62.4-133.4-103.2 148.7 6.4 9.8 -41.8 98 99 A N B > -I 20 0C 35 -2,-0.4 4,-2.1 -78,-0.3 -78,-0.2 -0.403 35.9 -98.2 -85.9 175.7 9.3 9.7 -39.5 99 100 A K H > S+ 0 0 92 -80,-0.9 4,-2.0 1,-0.3 5,-0.2 0.904 124.4 49.3 -67.8 -37.3 12.1 12.3 -39.7 100 101 A A H > S+ 0 0 74 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.917 113.0 48.5 -63.0 -43.2 14.4 10.0 -41.6 101 102 A E H > S+ 0 0 88 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.805 106.3 54.8 -65.6 -38.6 11.6 9.3 -44.0 102 103 A T H X S+ 0 0 3 -4,-2.1 4,-2.7 2,-0.2 5,-0.3 0.923 110.8 48.4 -62.1 -41.3 10.6 13.0 -44.5 103 104 A A H X S+ 0 0 11 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.883 110.0 50.5 -64.6 -39.4 14.3 13.6 -45.6 104 105 A A H < S+ 0 0 92 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.875 119.4 37.6 -69.6 -33.1 14.5 10.7 -48.0 105 106 A K H < S+ 0 0 138 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.900 133.1 20.7 -86.4 -39.5 11.3 11.8 -49.7 106 107 A H H < S- 0 0 62 -4,-2.7 4,-0.5 -5,-0.2 -3,-0.2 0.469 106.7-112.4-111.0 -12.9 11.7 15.6 -49.6 107 108 A G X - 0 0 31 -4,-2.3 4,-2.0 -5,-0.3 5,-0.1 0.245 28.0 -88.6 91.0 149.6 15.4 16.1 -49.2 108 109 A E H > S+ 0 0 115 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.832 118.8 61.8 -60.4 -34.6 17.3 17.5 -46.3 109 110 A A H > S+ 0 0 60 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.942 110.4 36.3 -61.1 -54.1 17.1 21.2 -47.5 110 111 A Q H > S+ 0 0 87 -4,-0.5 4,-2.9 2,-0.2 5,-0.3 0.891 114.5 58.2 -66.1 -39.1 13.3 21.5 -47.4 111 112 A V H X S+ 0 0 4 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.905 107.6 45.5 -58.3 -44.0 13.1 19.4 -44.4 112 113 A K H X S+ 0 0 85 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.838 111.5 52.8 -66.7 -31.5 15.3 21.7 -42.4 113 114 A I H X S+ 0 0 68 -4,-1.4 4,-1.6 -5,-0.2 7,-0.2 0.943 111.8 45.6 -68.3 -45.7 13.4 24.8 -43.6 114 115 A W H < S+ 0 0 25 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.884 114.8 49.5 -65.8 -35.2 10.1 23.3 -42.5 115 116 A R H < S+ 0 0 114 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.867 120.1 33.7 -71.0 -38.2 11.6 22.3 -39.2 116 117 A R H < S+ 0 0 169 -4,-2.1 2,-0.3 -5,-0.1 -1,-0.2 0.583 98.5 91.9 -91.4 -15.6 13.1 25.7 -38.4 117 118 A S < - 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