==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 17-JUN-07 2V3D . COMPND 2 MOLECULE: GLUCOSYLCERAMIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR B.BRUMSHTEIN,H.M.GREENBLATT,T.D.BUTTERS,Y.SHAALTIEL, . 992 3 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34986.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 670 67.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 100 10.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 141 14.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 8 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 59 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 99 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 189 19.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 22 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 4 0 2 2 2 0 4 4 2 0 0 0 2 0 0 2 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 4 4 4 4 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 PARALLEL BRIDGES PER LADDER . 4 4 4 2 0 5 7 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 2 0 0 0 2 2 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 E 0 0 66 0, 0.0 2,-0.5 0, 0.0 28,-0.0 0.000 360.0 360.0 360.0 -99.9 12.7 28.8 28.6 2 0 A F - 0 0 146 26,-0.1 27,-0.1 109,-0.0 2,-0.1 -0.953 360.0-125.5-112.6 123.1 10.0 31.3 27.3 3 1 A A - 0 0 51 -2,-0.5 25,-0.2 23,-0.1 23,-0.1 -0.421 33.3-177.6 -55.4 129.9 8.8 31.3 23.8 4 2 A R B -A 27 0A 96 23,-1.7 23,-1.5 -2,-0.1 3,-0.1 -0.996 21.8-123.1-136.0 127.4 9.3 34.9 22.5 5 3 A P - 0 0 92 0, 0.0 2,-0.2 0, 0.0 23,-0.0 -0.264 31.3 -89.5 -73.6 162.2 8.1 35.8 19.1 6 4 A a - 0 0 25 41,-0.1 12,-0.1 39,-0.1 14,-0.1 -0.471 29.4-140.6 -54.8 130.3 10.2 37.3 16.2 7 5 A I - 0 0 80 12,-0.3 12,-2.6 -2,-0.2 2,-0.1 -0.896 34.0-144.5 -90.1 98.2 10.3 41.1 16.3 8 6 A P E +B 18 0B 85 0, 0.0 2,-0.3 0, 0.0 10,-0.2 -0.354 24.8 178.2 -76.9 147.8 10.1 41.5 12.5 9 7 A K E -B 17 0B 87 8,-2.0 8,-2.5 -2,-0.1 2,-0.4 -0.984 16.0-146.9-146.0 137.2 11.8 44.2 10.5 10 8 A S + 0 0 74 -2,-0.3 6,-0.1 6,-0.2 344,-0.1 -0.818 15.5 179.7-100.9 139.5 11.8 44.9 6.8 11 9 A F S S- 0 0 69 342,-0.5 342,-0.1 4,-0.5 -1,-0.1 0.016 71.1 -85.0-118.4 19.1 14.8 46.3 4.9 12 10 A G S S+ 0 0 64 1,-0.3 2,-0.1 3,-0.1 342,-0.1 0.541 95.1 116.4 91.4 6.7 13.0 46.2 1.5 13 11 A Y S S- 0 0 68 340,-0.5 -1,-0.3 2,-0.4 342,-0.1 -0.321 84.5 -79.2 -97.8-173.7 13.8 42.6 0.6 14 12 A S S S+ 0 0 58 -2,-0.1 2,-0.2 -3,-0.1 341,-0.2 0.677 105.9 6.3 -64.9 -22.2 11.5 39.6 0.1 15 13 A S S S- 0 0 6 339,-1.0 -4,-0.5 338,-0.2 -2,-0.4 -0.778 81.6 -85.4-146.3-171.7 11.0 38.9 3.8 16 14 A V - 0 0 28 27,-0.4 2,-0.3 -2,-0.2 -6,-0.2 -0.668 22.8-139.1-102.8 156.8 11.8 40.1 7.4 17 15 A V E -B 9 0B 0 -8,-2.5 -8,-2.0 -2,-0.2 2,-0.6 -0.721 25.8-117.7 -96.0 163.7 14.6 39.7 9.7 18 16 A a E -BC 8 412B 0 394,-2.5 394,-2.9 -2,-0.3 2,-0.4 -0.925 27.4-139.5-105.7 125.3 14.1 39.1 13.4 19 17 A V E + C 0 411B 27 -12,-2.6 -12,-0.3 -2,-0.6 2,-0.3 -0.676 24.2 175.4 -91.5 127.3 15.5 41.9 15.6 20 18 A b E + C 0 410B 0 390,-2.4 390,-2.0 -2,-0.4 5,-0.2 -0.922 2.4 165.4-126.6 155.0 17.3 41.1 18.9 21 19 A N - 0 0 60 3,-2.7 3,-0.3 -2,-0.3 388,-0.2 -0.716 57.0 -58.3-147.6-164.1 19.2 43.3 21.4 22 20 A A S S+ 0 0 28 386,-0.5 3,-0.1 1,-0.2 79,-0.1 0.748 133.5 24.7 -56.7 -25.9 20.6 43.3 25.0 23 21 A T S S+ 0 0 124 1,-0.2 2,-0.4 76,-0.0 -1,-0.2 0.436 118.8 50.2-124.0 -3.4 17.2 42.4 26.5 24 22 A Y + 0 0 56 -3,-0.3 -3,-2.7 2,-0.0 2,-0.3 -0.981 45.2 151.7-143.6 133.0 15.2 40.7 23.8 25 23 A b - 0 0 8 -2,-0.4 -5,-0.1 -5,-0.2 2,-0.1 -0.966 45.4-106.8-149.0 145.2 15.6 37.8 21.4 26 24 A D + 0 0 14 -2,-0.3 2,-0.3 -7,-0.1 -20,-0.1 -0.417 51.8 158.7 -64.9 143.4 13.1 35.4 19.8 27 25 A S B -A 4 0A 27 -23,-1.5 -23,-1.7 -2,-0.1 2,-0.3 -0.928 34.1-101.6-156.9 175.3 13.3 31.9 21.3 28 26 A F 0 0 35 83,-1.5 -26,-0.1 -2,-0.3 20,-0.0 -0.798 360.0 360.0-108.1 151.6 11.5 28.6 21.8 29 27 A D 0 0 147 -2,-0.3 -1,-0.1 -27,-0.1 82,-0.1 0.732 360.0 360.0 -59.2 360.0 9.6 27.1 24.8 30 ! 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 31 32 A P 0 0 70 0, 0.0 463,-0.3 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0 118.8 4.3 15.2 21.2 32 33 A A > - 0 0 73 2,-0.1 3,-1.9 4,-0.1 462,-0.1 -0.261 360.0 -83.9 -54.8 132.4 1.7 12.5 22.3 33 34 A L T 3 S+ 0 0 66 1,-0.3 3,-0.1 463,-0.1 462,-0.1 -0.392 112.5 27.3 -69.3 156.4 1.3 9.7 19.8 34 35 A G T 3 S+ 0 0 38 460,-0.2 21,-2.2 1,-0.1 -1,-0.3 -0.078 105.7 88.8 -92.3 77.5 -0.4 9.6 17.4 35 36 A T E < -F 54 0C 46 -3,-1.9 459,-0.5 19,-0.2 2,-0.3 -0.908 61.2-143.6-114.8 155.3 -0.1 13.3 16.9 36 37 A F E -FG 53 493C 2 17,-2.3 17,-1.7 -2,-0.3 2,-0.4 -0.842 6.5-132.8-111.1 158.7 2.6 15.2 15.0 37 38 A S E -FG 52 492C 7 455,-2.7 455,-2.3 -2,-0.3 2,-0.4 -0.877 18.0-163.2-102.7 143.0 4.4 18.5 15.5 38 39 A R E -FG 51 491C 38 13,-3.0 13,-2.1 -2,-0.4 2,-0.5 -0.997 7.0-166.5-125.0 129.9 4.9 21.0 12.7 39 40 A Y E -FG 50 490C 35 451,-2.6 451,-2.0 -2,-0.4 2,-0.4 -0.986 18.0-170.1-110.2 125.4 7.4 23.9 12.7 40 41 A E E -FG 49 489C 33 9,-2.2 9,-2.8 -2,-0.5 2,-0.4 -0.965 16.7-178.8-122.9 133.4 6.6 26.4 9.9 41 42 A S E - G 0 488C 0 447,-2.7 447,-2.2 -2,-0.4 2,-0.3 -0.988 15.6-173.2-121.3 137.6 8.6 29.3 8.6 42 43 A T E > - G 0 487C 8 4,-1.9 3,-1.6 -2,-0.4 445,-0.2 -0.942 39.6-123.7-129.3 153.2 7.1 31.4 5.8 43 44 A R T 3 S+ 0 0 105 443,-2.2 -27,-0.4 -2,-0.3 -1,-0.1 0.883 113.0 66.8 -53.5 -38.4 8.2 34.3 3.5 44 45 A S T 3 S- 0 0 107 442,-0.3 -1,-0.3 -29,-0.1 443,-0.1 0.657 130.3 -87.9 -61.9 -16.6 5.1 36.1 4.9 45 46 A G S < S+ 0 0 23 -3,-1.6 2,-0.1 1,-0.3 -2,-0.1 0.385 77.4 140.1 129.8 -6.0 6.8 36.2 8.3 46 47 A R - 0 0 114 1,-0.1 -4,-1.9 3,-0.0 2,-0.5 -0.467 35.2-157.1 -66.0 137.7 6.2 33.0 10.4 47 48 A R - 0 0 21 -6,-0.2 -6,-0.2 -2,-0.1 -41,-0.1 -0.874 62.6 -46.9-126.7 96.5 9.4 32.0 12.1 48 49 A M S S- 0 0 4 -2,-0.5 2,-0.3 1,-0.2 -7,-0.2 0.874 80.6-175.5 48.3 45.6 9.6 28.3 13.1 49 50 A E E -F 40 0C 84 -9,-2.8 -9,-2.2 1,-0.1 2,-0.3 -0.590 18.1-128.7 -77.8 138.6 6.0 28.4 14.6 50 51 A L E +F 39 0C 93 -2,-0.3 2,-0.3 -11,-0.2 -11,-0.2 -0.655 37.1 152.9 -90.4 135.2 4.7 25.3 16.3 51 52 A S E -F 38 0C 45 -13,-2.1 -13,-3.0 -2,-0.3 2,-0.3 -0.920 25.5-140.1-145.9 170.6 1.4 23.6 15.6 52 53 A M E -F 37 0C 104 -2,-0.3 -15,-0.2 -15,-0.2 -17,-0.0 -0.940 13.3-175.1-136.5 157.8 0.1 20.0 15.8 53 54 A G E -F 36 0C 11 -17,-1.7 -17,-2.3 -2,-0.3 2,-0.3 -0.922 28.8 -99.2-142.2 165.9 -2.0 17.6 13.9 54 55 A P E -F 35 0C 76 0, 0.0 2,-0.6 0, 0.0 426,-0.6 -0.632 24.9-133.3 -83.5 149.5 -3.6 14.2 14.1 55 56 A I E -H 479 0C 21 -21,-2.2 2,-0.2 -2,-0.3 424,-0.2 -0.936 29.2-145.8 -96.5 115.8 -2.1 11.1 12.5 56 57 A Q E -H 478 0C 68 422,-2.6 422,-3.4 -2,-0.6 -22,-0.0 -0.603 14.2-137.0 -86.3 150.2 -5.0 9.3 10.7 57 58 A A S S+ 0 0 80 -2,-0.2 2,-0.3 420,-0.2 -1,-0.1 0.862 87.8 26.8 -69.6 -38.1 -5.3 5.5 10.3 58 59 A N - 0 0 133 420,-0.1 2,-0.3 419,-0.1 420,-0.1 -0.819 60.9-165.3-124.4 165.7 -6.4 5.9 6.6 59 60 A H - 0 0 43 -2,-0.3 2,-0.3 418,-0.1 411,-0.0 -0.977 3.8-175.5-145.7 140.2 -6.1 8.2 3.7 60 61 A T + 0 0 141 -2,-0.3 2,-0.2 0, 0.0 3,-0.1 -0.993 35.8 83.4-134.2 139.2 -8.0 8.5 0.4 61 62 A G - 0 0 53 -2,-0.3 -2,-0.0 1,-0.1 0, 0.0 -0.779 67.3-111.1 152.1 169.9 -7.2 10.8 -2.5 62 63 A T S S+ 0 0 135 -2,-0.2 3,-0.1 2,-0.0 -1,-0.1 0.300 75.6 113.1-108.2 3.1 -5.1 11.4 -5.6 63 64 A G S S- 0 0 41 1,-0.2 406,-0.1 -3,-0.1 375,-0.1 -0.085 83.0 -58.2 -69.1 175.7 -3.0 14.3 -4.2 64 65 A L E -i 469 0C 6 404,-0.6 406,-2.0 374,-0.1 2,-0.4 -0.292 55.1-168.3 -58.3 132.2 0.7 14.2 -3.5 65 66 A L E -i 470 0C 32 404,-0.2 373,-2.0 -3,-0.1 2,-0.6 -0.997 10.6-162.4-126.0 130.9 1.8 11.4 -1.1 66 67 A L E -iJ 471 437C 7 404,-2.7 406,-2.8 -2,-0.4 2,-0.6 -0.968 14.5-159.1-111.6 114.5 5.2 11.1 0.5 67 68 A T E -iJ 472 436C 34 369,-2.7 369,-2.1 -2,-0.6 406,-0.2 -0.867 10.6-135.6-105.4 118.0 5.8 7.6 1.8 68 69 A L E - J 0 435C 2 404,-3.0 367,-0.3 -2,-0.6 3,-0.1 -0.392 10.0-162.5 -62.2 137.7 8.4 7.0 4.5 69 70 A Q E > + J 0 434C 62 365,-2.8 365,-1.7 3,-0.2 3,-1.7 -0.736 13.9 174.9-124.5 80.2 10.6 3.9 3.9 70 71 A P E 3 S+ 0 0 16 0, 0.0 -1,-0.1 0, 0.0 379,-0.0 0.667 74.4 59.2 -66.9 -21.6 12.0 3.4 7.3 71 72 A E E 3 S+ 0 0 118 -3,-0.1 2,-0.9 362,-0.1 -3,-0.0 0.551 86.6 84.8 -78.2 -18.0 13.8 0.1 6.4 72 73 A Q E < S- 0 0 94 -3,-1.7 362,-1.5 362,-0.1 2,-0.4 -0.830 70.6-169.9 -92.8 108.5 15.8 1.9 3.7 73 74 A K E + J 0 433C 97 -2,-0.9 360,-0.2 360,-0.2 3,-0.1 -0.828 14.6 164.6-113.1 133.6 18.7 3.2 5.7 74 75 A F E - 0 0 72 358,-2.9 2,-0.1 -2,-0.4 -1,-0.1 0.045 46.2 -15.9-119.5-135.6 21.3 5.7 4.5 75 76 A Q E - 0 0 20 295,-0.2 357,-2.5 356,-0.1 2,-0.3 -0.376 55.3-123.8 -76.5 152.4 23.9 7.9 6.2 76 77 A K E - J 0 431C 122 355,-0.2 2,-0.3 -2,-0.1 355,-0.3 -0.727 32.4-115.2 -88.0 143.9 24.1 8.9 9.9 77 78 A V - 0 0 4 353,-3.2 352,-2.8 -2,-0.3 353,-0.2 -0.617 24.8-174.1 -84.7 132.8 24.2 12.6 10.6 78 79 A K - 0 0 31 297,-3.4 2,-0.3 -2,-0.3 298,-0.2 0.840 51.7-110.3 -85.9 -47.1 27.3 14.2 12.2 79 80 A G E -o 376 0D 0 296,-1.5 298,-1.5 348,-0.1 2,-0.3 -0.973 21.9 -81.9 150.1-166.2 25.6 17.6 12.6 80 81 A F E +o 377 0D 1 -2,-0.3 36,-2.5 296,-0.2 37,-1.1 -0.969 47.2 112.0-142.6 149.3 25.3 21.3 11.6 81 82 A G E -op 378 117D 0 296,-1.4 298,-3.3 -2,-0.3 2,-0.2 -0.932 40.1-103.7 177.8-151.7 27.0 24.6 12.5 82 83 A G E - p 0 118D 0 35,-1.4 37,-2.5 296,-0.3 2,-0.5 -0.839 35.2 -76.2-155.9-175.2 29.1 27.5 11.4 83 84 A A E -op 381 119D 0 297,-2.7 299,-2.0 -2,-0.2 2,-1.3 -0.849 14.9-152.1-111.2 131.2 32.5 29.2 11.5 84 85 A M + 0 0 0 35,-2.6 2,-0.1 -2,-0.5 297,-0.1 -0.661 38.3 165.7 -93.7 71.6 34.2 31.1 14.3 85 86 A T > - 0 0 0 -2,-1.3 4,-2.4 35,-0.1 5,-0.2 -0.323 55.0-100.8 -74.4 171.0 36.4 33.3 12.0 86 87 A D H > S+ 0 0 5 41,-0.6 4,-2.4 1,-0.2 42,-0.2 0.899 125.8 51.6 -58.8 -40.3 38.2 36.4 13.2 87 88 A A H > S+ 0 0 0 40,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.899 109.7 48.0 -65.7 -43.6 35.3 38.5 11.6 88 89 A A H > S+ 0 0 0 39,-0.2 4,-2.7 2,-0.2 5,-0.2 0.937 112.0 49.0 -62.0 -49.6 32.6 36.5 13.4 89 90 A A H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.917 112.1 49.2 -54.7 -48.8 34.3 36.8 16.8 90 91 A L H X S+ 0 0 60 -4,-2.4 4,-1.1 -5,-0.2 -2,-0.2 0.920 112.5 47.4 -60.9 -43.5 34.8 40.5 16.4 91 92 A N H < S+ 0 0 13 -4,-2.5 4,-0.4 292,-0.2 3,-0.3 0.914 113.2 47.3 -61.2 -46.6 31.2 41.1 15.4 92 93 A I H >< S+ 0 0 0 -4,-2.7 3,-1.4 1,-0.2 -2,-0.2 0.929 113.2 49.2 -59.5 -43.9 29.9 39.0 18.3 93 94 A L H 3< S+ 0 0 56 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.640 96.4 70.6 -77.2 -13.2 32.2 40.8 20.8 94 95 A A T 3< S+ 0 0 38 -4,-1.1 -1,-0.3 -3,-0.3 -2,-0.2 0.631 86.5 85.0 -72.7 -17.9 31.1 44.2 19.5 95 96 A L S < S- 0 0 5 -3,-1.4 310,-0.1 -4,-0.4 314,-0.0 -0.461 97.6 -97.1 -77.7 156.5 27.7 43.5 21.1 96 97 A S >> - 0 0 37 -2,-0.1 4,-2.5 1,-0.1 3,-0.7 -0.480 45.9-103.1 -65.8 149.5 27.2 44.3 24.8 97 98 A P H 3> S+ 0 0 80 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.829 121.3 53.1 -50.1 -41.2 27.6 41.1 26.9 98 99 A P H 3> S+ 0 0 66 0, 0.0 4,-1.5 0, 0.0 5,-0.1 0.902 112.4 44.8 -59.5 -40.8 23.9 40.5 27.4 99 100 A A H <> S+ 0 0 0 -3,-0.7 4,-2.1 2,-0.2 5,-0.2 0.892 110.0 57.1 -67.6 -37.5 23.3 40.7 23.6 100 101 A Q H X S+ 0 0 16 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.895 106.4 50.3 -55.1 -47.2 26.4 38.5 23.0 101 102 A N H X S+ 0 0 60 -4,-2.3 4,-2.6 -5,-0.2 -1,-0.2 0.882 108.5 50.1 -61.4 -41.3 24.7 35.8 25.2 102 103 A L H X S+ 0 0 42 -4,-1.5 4,-2.4 2,-0.2 -1,-0.2 0.863 111.7 49.6 -66.4 -34.2 21.4 35.9 23.3 103 104 A L H X S+ 0 0 0 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.968 112.8 45.9 -66.9 -50.5 23.4 35.6 20.0 104 105 A L H X S+ 0 0 1 -4,-2.7 4,-2.8 1,-0.2 5,-0.3 0.896 113.9 49.2 -59.5 -40.0 25.3 32.6 21.3 105 106 A K H X S+ 0 0 77 -4,-2.6 4,-1.9 1,-0.2 9,-0.3 0.889 102.4 62.1 -66.7 -41.7 22.1 31.0 22.7 106 107 A S H < S+ 0 0 6 -4,-2.4 7,-2.2 6,-0.2 -1,-0.2 0.891 118.8 28.2 -43.9 -46.1 20.3 31.6 19.4 107 108 A Y H < S+ 0 0 0 -4,-1.6 8,-3.2 5,-0.2 -2,-0.2 0.916 132.2 27.5 -82.7 -49.1 22.9 29.2 17.8 108 109 A F H < S+ 0 0 1 -4,-2.8 60,-0.4 6,-0.2 61,-0.3 0.510 99.1 83.2-105.1 -9.9 24.1 26.8 20.5 109 110 A S S ><>S- 0 0 7 -4,-1.9 5,-1.8 -5,-0.3 3,-1.2 -0.608 77.5-124.5 -95.0 158.7 21.3 26.4 23.0 110 111 A E T 3 5S+ 0 0 54 56,-0.4 -1,-0.1 1,-0.3 57,-0.1 0.675 117.2 63.9 -68.6 -17.3 18.3 24.1 22.9 111 112 A E T 3 5S+ 0 0 74 -6,-0.1 -83,-1.5 -84,-0.1 -1,-0.3 0.589 115.9 30.3 -79.2 -10.7 16.4 27.4 23.4 112 113 A G T < 5S- 0 0 4 -3,-1.2 -5,-0.2 -7,-0.3 -6,-0.2 0.091 125.0 -56.0-112.0-128.6 17.9 28.3 20.0 113 114 A I T 5 - 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