==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 02-APR-07 2YRN . COMPND 2 MOLECULE: NEURON NAVIGATOR 2 ISOFORM 4; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR T.TOMIZAWA,N.TOCHIO,S.KOSHIBA,M.INOUE,Y.NAKAMURA,Y.FURUKAWA, . 129 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8796.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 89 69.0 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 . 0 0.0 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 . 0 0.0 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 . 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 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 14.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 54 41.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 3.9 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 0 1 0 0 0 1 0 0 0 0 1 1 0 1 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 . 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 G 0 0 116 0, 0.0 2,-0.4 0, 0.0 38,-0.0 0.000 360.0 360.0 360.0 116.5 -7.6 3.6 -14.6 2 2 A S - 0 0 53 22,-0.1 2,-0.2 23,-0.1 19,-0.0 -0.975 360.0-144.5-126.6 137.5 -3.8 4.1 -14.6 3 3 A S - 0 0 89 -2,-0.4 2,-0.2 2,-0.0 22,-0.0 -0.571 14.7-179.3 -96.1 160.9 -1.5 4.6 -17.5 4 4 A G + 0 0 73 -2,-0.2 2,-0.3 2,-0.0 -2,-0.0 -0.615 21.3 130.0-164.7 98.3 2.1 3.3 -17.9 5 5 A S - 0 0 121 -2,-0.2 2,-0.9 0, 0.0 -2,-0.0 -0.899 57.2 -99.8-143.7 171.3 4.4 3.9 -20.9 6 6 A S + 0 0 125 -2,-0.3 2,-0.1 3,-0.0 3,-0.1 -0.795 64.7 128.4-100.2 95.7 7.9 5.1 -21.7 7 7 A G - 0 0 74 -2,-0.9 2,-0.3 1,-0.2 -1,-0.0 -0.032 60.7 -31.9-118.1-138.7 7.7 8.7 -22.8 8 8 A K - 0 0 180 -2,-0.1 2,-0.6 2,-0.0 -1,-0.2 -0.689 50.4-145.5 -90.7 140.6 9.4 12.0 -21.8 9 9 A R + 0 0 234 -2,-0.3 -3,-0.0 -3,-0.1 -1,-0.0 -0.922 25.2 167.8-110.4 120.2 10.7 12.6 -18.3 10 10 A K - 0 0 151 -2,-0.6 2,-0.6 2,-0.0 -2,-0.0 -0.919 43.3 -92.3-130.0 155.8 10.5 16.1 -16.9 11 11 A P + 0 0 134 0, 0.0 2,-0.3 0, 0.0 -2,-0.0 -0.533 59.2 151.7 -69.7 113.2 11.0 17.6 -13.4 12 12 A V - 0 0 101 -2,-0.6 2,-0.2 2,-0.0 -2,-0.0 -0.999 39.3-125.4-146.9 142.2 7.6 17.9 -11.7 13 13 A I - 0 0 146 -2,-0.3 2,-0.4 1,-0.0 0, 0.0 -0.564 11.4-151.7 -86.7 150.5 6.3 17.9 -8.2 14 14 A H - 0 0 78 -2,-0.2 5,-0.4 4,-0.0 -1,-0.0 -0.722 17.3-152.0-124.0 81.1 3.6 15.4 -6.9 15 15 A G > - 0 0 35 -2,-0.4 4,-2.6 3,-0.2 3,-0.5 0.146 41.0 -83.8 -43.2 167.3 1.7 17.0 -4.1 16 16 A L H > S+ 0 0 82 1,-0.3 4,-1.9 2,-0.2 3,-0.2 0.902 135.8 46.1 -41.3 -55.3 0.1 14.8 -1.4 17 17 A E H > S+ 0 0 156 1,-0.2 4,-0.6 2,-0.2 -1,-0.3 0.868 111.2 53.6 -58.0 -37.9 -2.9 14.3 -3.6 18 18 A D H >> S+ 0 0 75 -3,-0.5 4,-1.4 1,-0.2 3,-0.9 0.875 104.8 55.0 -65.1 -38.3 -0.6 13.6 -6.6 19 19 A Q H 3X S+ 0 0 60 -4,-2.6 4,-2.2 -5,-0.4 5,-0.4 0.943 90.4 71.7 -60.6 -50.2 1.3 11.0 -4.6 20 20 A K H 3X S+ 0 0 43 -4,-1.9 4,-1.5 1,-0.2 -1,-0.2 0.792 105.2 43.6 -35.0 -36.5 -1.9 9.0 -3.9 21 21 A R H X S+ 0 0 0 -4,-2.5 3,-2.2 2,-0.2 4,-1.3 0.962 108.1 61.0 -76.8 -56.6 0.7 -1.4 -6.1 28 28 A N H 3X S+ 0 0 11 -4,-3.0 4,-3.2 1,-0.3 3,-0.4 0.825 98.5 62.9 -38.7 -39.7 -1.8 -2.2 -8.9 29 29 A H H 3X S+ 0 0 101 -4,-2.0 4,-2.1 1,-0.3 -1,-0.3 0.902 102.6 47.3 -55.0 -44.2 1.2 -3.6 -10.7 30 30 A Y H < S+ 0 0 1 -4,-1.3 3,-0.5 -3,-0.4 5,-0.4 0.956 114.1 41.0 -79.8 -56.9 -2.1 -6.9 -8.2 32 32 A A H >< S+ 0 0 55 -4,-3.2 3,-2.4 1,-0.2 4,-0.3 0.934 108.8 60.7 -57.0 -49.7 -2.5 -7.3 -11.9 33 33 A K H 3< S+ 0 0 130 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.848 104.1 51.5 -46.6 -38.7 0.7 -9.3 -12.3 34 34 A S T << S- 0 0 66 -4,-0.6 -1,-0.3 -3,-0.5 -2,-0.2 -0.042 130.2 -97.4 -90.9 31.9 -0.8 -11.8 -10.0 35 35 A G < + 0 0 70 -3,-2.4 2,-0.6 1,-0.2 -3,-0.2 0.962 69.0 158.0 51.9 61.5 -3.9 -12.0 -12.2 36 36 A H - 0 0 34 -5,-0.4 -1,-0.2 -4,-0.3 -3,-0.1 -0.770 22.2-173.1-119.4 85.5 -6.0 -9.6 -10.1 37 37 A K + 0 0 206 -2,-0.6 -1,-0.2 -5,-0.1 -5,-0.1 0.909 66.4 75.2 -37.6 -71.3 -8.8 -8.1 -12.2 38 38 A R S S- 0 0 170 1,-0.1 2,-0.2 -7,-0.1 -2,-0.1 -0.001 70.7-165.0 -43.9 150.5 -10.0 -5.7 -9.5 39 39 A L - 0 0 83 -8,-0.1 2,-0.8 -7,-0.0 -1,-0.1 -0.752 28.1 -86.0-133.2 179.9 -7.7 -2.6 -9.1 40 40 A I + 0 0 7 -2,-0.2 3,-0.2 -16,-0.2 -12,-0.1 -0.819 43.2 164.8 -96.6 107.6 -7.1 0.2 -6.6 41 41 A R S S+ 0 0 206 -2,-0.8 2,-0.6 1,-0.3 -1,-0.2 0.946 74.0 24.9 -83.7 -58.1 -9.4 3.2 -7.3 42 42 A D >> - 0 0 64 1,-0.2 3,-1.7 3,-0.1 4,-0.9 -0.884 64.3-161.5-115.0 101.3 -9.1 5.2 -4.1 43 43 A L H >> S+ 0 0 0 -2,-0.6 3,-0.8 1,-0.3 4,-0.6 0.860 97.6 52.5 -44.9 -41.7 -5.8 4.6 -2.3 44 44 A Q H 34 S+ 0 0 51 1,-0.3 -1,-0.3 2,-0.2 3,-0.2 0.806 117.0 38.0 -66.4 -29.6 -7.4 6.0 0.8 45 45 A Q H <4 S+ 0 0 145 -3,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.291 106.6 68.5-102.8 7.1 -10.3 3.6 0.4 46 46 A D H << S+ 0 0 5 -4,-0.9 -2,-0.2 -3,-0.8 -3,-0.2 0.510 105.0 39.4-100.6 -9.3 -8.0 0.8 -0.7 47 47 A V S < S+ 0 0 0 -4,-0.6 60,-0.2 -5,-0.3 -1,-0.1 -0.099 84.5 98.9-130.4 34.3 -6.4 0.4 2.7 48 48 A T S S+ 0 0 28 -3,-0.2 34,-0.1 1,-0.1 -2,-0.1 0.715 96.4 29.0 -92.0 -25.0 -9.4 0.8 5.0 49 49 A D S S- 0 0 42 -4,-0.1 21,-0.2 32,-0.1 32,-0.1 0.542 96.8-133.4-108.8 -14.5 -10.0 -2.9 5.5 50 50 A G S > S+ 0 0 0 31,-0.2 4,-2.6 32,-0.1 5,-0.2 0.225 83.1 101.2 80.1 -17.1 -6.4 -4.0 5.1 51 51 A V H > S+ 0 0 43 2,-0.2 4,-2.1 1,-0.2 3,-0.1 0.994 85.8 35.7 -61.8 -66.0 -7.7 -6.8 2.8 52 52 A L H 4 S+ 0 0 18 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.789 116.6 59.8 -59.3 -27.6 -6.8 -5.2 -0.6 53 53 A L H >> S+ 0 0 0 1,-0.2 3,-1.5 2,-0.2 4,-1.5 0.962 106.5 42.6 -65.8 -53.6 -3.7 -3.8 1.1 54 54 A A H 3X S+ 0 0 1 -4,-2.6 4,-2.5 1,-0.3 5,-0.4 0.863 98.5 74.7 -61.2 -37.0 -2.2 -7.1 2.1 55 55 A Q H 3< S+ 0 0 75 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.738 106.5 37.6 -48.4 -22.9 -3.1 -8.5 -1.3 56 56 A I H X> S+ 0 0 1 -3,-1.5 4,-2.6 -4,-0.4 3,-1.1 0.863 113.2 52.5 -95.5 -48.8 -0.2 -6.4 -2.5 57 57 A I H 3X>S+ 0 0 0 -4,-1.5 4,-3.2 1,-0.3 5,-0.5 0.945 106.0 54.1 -52.7 -54.7 2.3 -6.8 0.4 58 58 A Q H 3<>S+ 0 0 69 -4,-2.5 5,-0.7 3,-0.2 -1,-0.3 0.730 115.5 45.0 -53.6 -21.4 2.1 -10.6 0.3 59 59 A V H <45S+ 0 0 28 -3,-1.1 -2,-0.2 -5,-0.4 3,-0.2 0.947 115.6 38.5 -86.2 -67.6 3.0 -10.2 -3.4 60 60 A V H <5S+ 0 0 1 -4,-2.6 -2,-0.2 1,-0.3 -3,-0.2 0.841 127.5 40.1 -52.9 -35.4 5.8 -7.6 -3.5 61 61 A A T <5S- 0 0 8 -4,-3.2 -1,-0.3 -5,-0.4 -3,-0.2 0.725 102.4-137.7 -85.8 -24.5 7.2 -9.3 -0.3 62 62 A N T < + 0 0 111 -5,-0.5 2,-0.3 1,-0.3 -3,-0.2 0.879 63.6 112.5 68.2 38.9 6.4 -12.8 -1.5 63 63 A E < - 0 0 112 -5,-0.7 2,-0.4 -6,-0.3 -1,-0.3 -0.942 63.4-122.1-139.5 160.3 5.1 -13.8 1.9 64 64 A K - 0 0 140 -2,-0.3 2,-0.7 -3,-0.1 3,-0.1 -0.857 14.2-146.8-107.2 139.3 1.8 -14.8 3.5 65 65 A I > + 0 0 16 -2,-0.4 3,-0.6 1,-0.1 20,-0.1 -0.867 16.5 177.7-108.3 102.3 0.2 -13.0 6.5 66 66 A E T 3 S+ 0 0 163 -2,-0.7 -1,-0.1 1,-0.3 18,-0.0 0.643 76.4 74.9 -74.6 -14.5 -1.7 -15.3 8.8 67 67 A D T 3 S+ 0 0 131 17,-0.1 2,-0.6 -3,-0.1 17,-0.3 -0.024 72.8 111.8 -87.5 31.3 -2.4 -12.4 11.1 68 68 A I < - 0 0 32 -3,-0.6 13,-0.1 1,-0.2 3,-0.1 -0.928 63.2-147.7-111.8 118.6 -5.0 -11.1 8.6 69 69 A N - 0 0 66 -2,-0.6 2,-0.5 8,-0.2 -1,-0.2 0.914 21.4-164.2 -44.8 -53.7 -8.6 -11.1 9.6 70 70 A G S S+ 0 0 38 -21,-0.2 -1,-0.2 -3,-0.1 -3,-0.0 -0.268 73.8 48.6 95.5 -48.0 -9.6 -11.7 6.0 71 71 A C S S- 0 0 100 -2,-0.5 2,-0.2 -3,-0.1 6,-0.0 -0.706 76.0-166.5-129.5 80.9 -13.3 -10.8 6.5 72 72 A P + 0 0 34 0, 0.0 3,-0.1 0, 0.0 -22,-0.0 -0.467 24.9 149.4 -69.7 132.2 -13.6 -7.5 8.4 73 73 A K + 0 0 185 -2,-0.2 2,-0.1 1,-0.1 0, 0.0 0.612 53.1 62.1-127.9 -49.8 -17.0 -6.7 9.7 74 74 A N S > S- 0 0 97 1,-0.1 4,-1.5 0, 0.0 -1,-0.1 -0.388 87.4-112.1 -81.5 161.4 -16.7 -4.6 12.9 75 75 A R T 4 S+ 0 0 169 1,-0.2 4,-0.4 2,-0.2 -1,-0.1 0.802 120.9 41.4 -62.0 -29.1 -15.1 -1.2 13.0 76 76 A S T >> S+ 0 0 46 2,-0.2 3,-1.6 1,-0.1 4,-1.2 0.893 102.0 66.7 -84.7 -45.5 -12.2 -2.7 15.1 77 77 A Q H 3> S+ 0 0 63 1,-0.3 4,-1.2 2,-0.2 -8,-0.2 0.877 97.8 56.2 -41.8 -48.0 -11.9 -6.0 13.1 78 78 A M H 3X S+ 0 0 47 -4,-1.5 4,-1.5 1,-0.2 -1,-0.3 0.863 99.9 61.7 -54.7 -38.0 -10.6 -3.9 10.1 79 79 A I H <> S+ 0 0 36 -3,-1.6 4,-3.3 -4,-0.4 5,-0.3 0.962 95.8 56.5 -53.3 -59.1 -7.9 -2.5 12.4 80 80 A E H X S+ 0 0 91 -4,-1.2 4,-3.2 1,-0.2 -1,-0.2 0.852 104.6 57.0 -41.1 -43.2 -6.3 -5.9 13.0 81 81 A N H X S+ 0 0 0 -4,-1.2 4,-1.6 -3,-0.3 -1,-0.2 0.980 112.6 35.8 -54.0 -66.0 -5.9 -6.2 9.2 82 82 A I H X S+ 0 0 0 -4,-1.5 4,-2.0 1,-0.2 -2,-0.2 0.882 116.8 56.6 -56.5 -40.5 -4.0 -3.0 8.7 83 83 A D H X S+ 0 0 73 -4,-3.3 4,-2.6 1,-0.2 5,-0.3 0.941 103.8 51.6 -57.2 -51.1 -2.2 -3.5 12.0 84 84 A A H X S+ 0 0 10 -4,-3.2 4,-2.1 -5,-0.3 -1,-0.2 0.863 108.9 52.4 -54.7 -38.2 -0.9 -7.0 10.9 85 85 A C H X S+ 0 0 0 -4,-1.6 4,-1.8 -5,-0.2 -1,-0.2 0.889 109.5 48.7 -66.2 -40.3 0.4 -5.4 7.7 86 86 A L H X S+ 0 0 8 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.944 114.5 43.7 -65.1 -49.5 2.3 -2.7 9.7 87 87 A N H X S+ 0 0 93 -4,-2.6 4,-1.6 1,-0.2 -2,-0.2 0.853 112.5 54.2 -64.5 -35.2 3.9 -5.2 12.1 88 88 A F H X S+ 0 0 28 -4,-2.1 4,-0.6 -5,-0.3 -1,-0.2 0.860 110.5 46.2 -67.1 -36.2 4.7 -7.6 9.2 89 89 A L H >X>S+ 0 0 4 -4,-1.8 5,-1.4 2,-0.2 3,-1.1 0.919 105.8 58.3 -72.5 -45.4 6.5 -4.8 7.4 90 90 A A H ><5S+ 0 0 40 -4,-2.4 3,-1.7 1,-0.3 -2,-0.2 0.895 102.8 54.4 -50.8 -44.9 8.5 -3.6 10.4 91 91 A A H 3<5S+ 0 0 89 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.797 102.9 57.7 -60.9 -28.8 10.0 -7.1 10.7 92 92 A K H <<5S- 0 0 59 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.587 131.7 -94.2 -77.9 -10.3 11.1 -6.8 7.1 93 93 A G T <<5S+ 0 0 69 -3,-1.7 2,-0.5 -4,-0.6 -3,-0.2 0.714 79.4 140.5 102.8 27.7 13.0 -3.7 8.0 94 94 A I < - 0 0 9 -5,-1.4 2,-0.6 -8,-0.1 -1,-0.3 -0.911 54.4-123.6-108.7 123.5 10.5 -1.1 7.2 95 95 A N + 0 0 120 -2,-0.5 24,-0.1 1,-0.2 23,-0.0 -0.489 41.5 159.4 -66.0 112.0 10.1 2.0 9.4 96 96 A I > + 0 0 38 -2,-0.6 3,-2.2 22,-0.1 -1,-0.2 0.577 28.9 124.4-108.0 -17.3 6.4 2.0 10.5 97 97 A Q T 3 S+ 0 0 169 1,-0.2 3,-0.1 3,-0.0 -2,-0.0 -0.153 71.5 31.3 -47.0 131.7 6.8 4.2 13.6 98 98 A G T 3 S+ 0 0 74 1,-0.4 -1,-0.2 0, 0.0 -2,-0.1 -0.157 94.2 106.6 110.2 -38.8 4.6 7.2 13.3 99 99 A L < - 0 0 37 -3,-2.2 -1,-0.4 15,-0.1 2,-0.2 0.077 55.2-149.4 -62.9-178.4 1.8 5.6 11.3 100 100 A S > - 0 0 59 1,-0.1 4,-2.3 -3,-0.1 3,-0.3 -0.734 14.9-149.8-163.0 107.3 -1.6 4.7 12.8 101 101 A A H > S+ 0 0 10 1,-0.3 4,-2.5 -2,-0.2 5,-0.2 0.863 103.6 54.1 -42.9 -44.1 -3.9 1.8 11.7 102 102 A E H > S+ 0 0 118 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.949 106.8 49.1 -57.8 -52.4 -6.8 4.0 12.8 103 103 A E H >>S+ 0 0 76 -3,-0.3 5,-2.3 1,-0.2 4,-1.1 0.890 112.4 49.3 -55.0 -42.0 -5.8 6.9 10.7 104 104 A I H <5S+ 0 0 0 -4,-2.3 3,-0.4 1,-0.2 -1,-0.2 0.898 107.0 54.5 -65.2 -41.7 -5.4 4.6 7.7 105 105 A R H <5S+ 0 0 55 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.846 106.6 52.4 -61.0 -34.7 -8.8 3.0 8.3 106 106 A N H <5S- 0 0 113 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.772 118.9-113.1 -72.6 -26.6 -10.3 6.5 8.2 107 107 A G T <5 + 0 0 12 -4,-1.1 2,-0.7 -3,-0.4 -3,-0.2 0.661 49.5 173.0 100.8 21.1 -8.6 7.2 4.9 108 108 A N >>< - 0 0 68 -5,-2.3 3,-1.8 1,-0.2 4,-1.7 -0.505 23.4-152.8 -67.2 106.9 -6.3 9.9 6.1 109 109 A L H 3> S+ 0 0 28 -2,-0.7 4,-2.7 1,-0.3 5,-0.5 0.932 93.3 61.6 -42.9 -63.9 -4.0 10.6 3.1 110 110 A K H 3> S+ 0 0 137 1,-0.2 4,-0.9 2,-0.2 -1,-0.3 0.786 113.2 41.5 -34.3 -36.0 -1.1 11.8 5.2 111 111 A A H X> S+ 0 0 10 -3,-1.8 4,-1.7 2,-0.2 3,-0.8 0.978 114.1 44.5 -78.0 -72.8 -1.3 8.2 6.6 112 112 A I H >X S+ 0 0 0 -4,-1.7 4,-2.2 1,-0.3 3,-0.5 0.873 114.2 53.3 -37.8 -52.3 -1.9 6.0 3.6 113 113 A L H 3X S+ 0 0 6 -4,-2.7 4,-1.4 1,-0.3 -1,-0.3 0.912 105.2 54.0 -52.5 -46.9 0.8 7.9 1.7 114 114 A G H X S+ 0 0 1 -4,-2.9 4,-1.0 1,-0.3 3,-0.8 0.951 100.6 54.4 -49.6 -59.1 6.8 -0.0 1.8 120 120 A S H 3X S+ 0 0 24 -4,-1.0 4,-2.8 1,-0.3 3,-0.4 0.852 101.2 63.0 -44.3 -40.8 8.2 0.7 -1.7 121 121 A R H 34 S+ 0 0 153 -3,-0.4 -1,-0.3 -4,-0.3 -2,-0.2 0.940 93.3 60.2 -51.1 -54.4 11.5 1.3 -0.0 122 122 A Y H << S+ 0 0 55 -4,-1.3 -1,-0.2 -3,-0.8 -2,-0.2 0.882 113.0 38.6 -40.6 -50.6 11.7 -2.3 1.2 123 123 A K H < S+ 0 0 75 -4,-1.0 3,-0.4 -3,-0.4 -1,-0.2 0.968 102.3 82.7 -67.4 -55.1 11.6 -3.5 -2.4 124 124 A Q S < S+ 0 0 120 -4,-2.8 3,-0.1 1,-0.2 0, 0.0 -0.120 91.4 30.7 -50.7 146.6 13.8 -0.7 -3.9 125 125 A Q S S+ 0 0 185 1,-0.2 2,-0.8 0, 0.0 -1,-0.2 0.849 81.5 145.7 69.9 35.0 17.5 -1.3 -3.6 126 126 A Q + 0 0 93 -3,-0.4 2,-0.5 2,-0.0 -1,-0.2 -0.799 11.0 151.2-108.7 90.4 17.0 -5.1 -3.8 127 127 A Q + 0 0 186 -2,-0.8 -3,-0.0 -3,-0.1 0, 0.0 -0.952 14.7 175.9-125.2 113.2 20.0 -6.5 -5.7 128 128 A Q 0 0 130 -2,-0.5 -2,-0.0 1,-0.1 0, 0.0 -0.920 360.0 360.0-118.9 142.5 21.1 -10.1 -4.9 129 129 A P 0 0 184 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.419 360.0 360.0 -69.8 360.0 23.9 -12.1 -6.7