==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 03-FEB-03 1NVJ . COMPND 2 MOLECULE: MOLYBDOPTERIN CONVERTING FACTOR SUBUNIT 2; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR M.J.RUDOLPH,M.M.WUEBBENS,O.TURQUE,K.V.RAJAGOPALAN,H.SCHINDEL . 740 11 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33376.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 533 72.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 42 5.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 182 24.6 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 . 51 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 208 28.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.4 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 6 0 0 0 0 0 1 0 5 1 5 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 6 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 1 11 1 1 5 3 6 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 . 2 4 1 0 0 0 3 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 71 0, 0.0 2,-0.2 0, 0.0 69,-0.1 0.000 360.0 360.0 360.0 167.3 11.9 37.2 52.6 2 3 A E - 0 0 103 1,-0.0 69,-1.7 2,-0.0 2,-0.5 -0.453 360.0-154.6 -87.7 150.5 10.9 34.0 50.9 3 4 A T E -a 71 0A 54 67,-0.2 2,-0.6 -2,-0.2 69,-0.2 -0.987 3.3-158.4-122.2 123.2 9.4 30.9 52.5 4 5 A K E +a 72 0A 73 67,-2.8 69,-2.8 -2,-0.5 2,-0.4 -0.914 13.4 179.0-103.9 119.0 9.9 27.4 51.1 5 6 A I E +a 73 0A 44 -2,-0.6 2,-0.4 67,-0.2 69,-0.2 -0.983 4.4 171.7-121.4 119.2 7.2 24.9 52.2 6 7 A V E +a 74 0A 61 67,-2.0 69,-2.1 -2,-0.4 2,-0.4 -0.989 10.5 177.8-131.6 134.3 7.3 21.3 50.8 7 8 A V E +a 75 0A 25 -2,-0.4 69,-0.2 67,-0.2 45,-0.0 -0.996 31.7 110.0-132.4 127.7 5.3 18.2 51.8 8 9 A G E S-a 76 0A 10 67,-1.5 69,-0.7 -2,-0.4 -2,-0.0 -0.951 70.9 -97.6 178.7 166.4 5.8 14.9 50.0 9 10 A P S S+ 0 0 63 0, 0.0 67,-0.1 0, 0.0 -1,-0.1 0.697 82.5 108.2 -71.4 -19.9 7.2 11.3 50.3 10 11 A Q S S- 0 0 130 1,-0.1 -2,-0.1 -3,-0.0 67,-0.1 -0.192 76.2-105.2 -66.4 145.3 10.6 12.0 48.7 11 12 A P - 0 0 105 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.357 33.4-147.4 -57.6 145.1 13.8 12.1 50.7 12 13 A F - 0 0 24 73,-0.3 2,-0.4 62,-0.1 73,-0.1 -0.799 1.1-143.6-108.1 163.2 15.3 15.6 51.3 13 14 A S >> - 0 0 45 -2,-0.3 4,-1.7 1,-0.1 3,-0.6 -0.992 3.4-156.1-126.0 121.1 19.0 16.4 51.7 14 15 A V H 3> S+ 0 0 2 -2,-0.4 4,-2.3 1,-0.2 3,-0.1 0.907 97.6 58.1 -62.5 -39.6 20.0 19.1 54.2 15 16 A G H 34 S+ 0 0 21 1,-0.2 -1,-0.2 120,-0.2 120,-0.2 0.773 109.2 44.9 -61.1 -29.9 23.1 19.8 52.1 16 17 A E H <4 S+ 0 0 152 -3,-0.6 4,-0.4 2,-0.1 -1,-0.2 0.747 116.3 45.2 -81.1 -29.6 21.0 20.6 49.1 17 18 A E H X S+ 0 0 25 -4,-1.7 4,-1.8 -3,-0.1 3,-0.4 0.794 100.2 70.9 -83.1 -26.2 18.5 22.8 51.0 18 19 A Y H X S+ 0 0 9 -4,-2.3 4,-2.7 1,-0.2 -1,-0.1 0.876 87.4 57.5 -67.8 -45.6 21.1 24.7 53.0 19 20 A P H 4 S+ 0 0 36 0, 0.0 -1,-0.2 0, 0.0 4,-0.2 0.859 110.3 46.1 -56.2 -36.0 22.7 26.9 50.2 20 21 A W H >4 S+ 0 0 75 -4,-0.4 3,-1.5 -3,-0.4 4,-0.4 0.953 112.7 49.5 -68.8 -51.3 19.3 28.5 49.4 21 22 A L H 3< S+ 0 0 0 -4,-1.8 3,-0.3 1,-0.3 49,-0.3 0.898 119.0 39.9 -50.1 -40.2 18.4 29.0 53.0 22 23 A A T 3< S+ 0 0 7 -4,-2.7 -1,-0.3 1,-0.2 -2,-0.2 0.244 84.5 103.3-101.3 12.5 21.8 30.6 53.6 23 24 A E < + 0 0 83 -3,-1.5 2,-0.3 -4,-0.2 -1,-0.2 0.872 58.6 82.7 -66.2 -43.3 22.2 32.7 50.4 24 25 A R > - 0 0 70 -4,-0.4 3,-1.5 -3,-0.3 186,-0.1 -0.464 67.0-146.4 -76.5 130.2 21.4 36.2 51.6 25 26 A D T 3 S+ 0 0 88 -2,-0.3 185,-0.3 1,-0.3 134,-0.2 0.852 101.6 58.2 -56.8 -38.2 24.2 38.3 53.3 26 27 A E T 3 S+ 0 0 121 1,-0.2 2,-1.3 132,-0.1 -1,-0.3 0.688 91.1 75.7 -65.8 -17.7 21.7 39.9 55.6 27 28 A D < + 0 0 4 -3,-1.5 67,-0.2 1,-0.2 -1,-0.2 -0.609 59.9 155.3 -92.8 72.4 20.7 36.4 56.8 28 29 A G + 0 0 0 -2,-1.3 128,-2.8 1,-0.1 2,-0.4 0.468 54.6 57.6 -87.8 -3.8 23.8 36.0 58.9 29 30 A A E -BC 93 155A 0 64,-2.3 64,-2.0 126,-0.2 2,-0.5 -0.982 64.3-175.2-131.2 121.0 22.5 33.5 61.4 30 31 A V E -BC 92 154A 0 124,-2.5 124,-2.6 -2,-0.4 2,-0.4 -0.964 0.8-176.4-125.5 116.4 21.2 30.2 60.1 31 32 A V E -BC 91 153A 1 60,-3.2 60,-2.7 -2,-0.5 2,-0.4 -0.953 4.3-174.5-110.6 133.5 19.6 27.6 62.4 32 33 A T E -BC 90 152A 0 120,-2.4 120,-2.0 -2,-0.4 2,-0.4 -0.962 9.7-168.5-124.0 151.2 18.4 24.2 61.3 33 34 A F E -BC 89 151A 3 56,-2.4 56,-2.6 -2,-0.4 2,-0.4 -1.000 2.7-171.8-126.5 137.5 16.6 21.4 62.9 34 35 A T E -BC 88 150A 0 116,-2.3 116,-2.0 -2,-0.4 2,-0.4 -0.990 7.7-159.0-126.6 123.8 16.1 17.9 61.5 35 36 A G E -BC 87 149A 2 52,-2.2 51,-2.5 -2,-0.4 52,-1.6 -0.844 10.0-164.7-101.3 135.9 13.8 15.4 63.1 36 37 A K E -B 85 0A 4 112,-2.5 2,-0.4 -2,-0.4 49,-0.2 -0.753 35.7 -89.2-113.9 161.8 14.3 11.6 62.5 37 38 A V 0 0 19 47,-2.0 46,-1.7 44,-0.3 47,-0.1 -0.625 360.0 360.0 -68.2 124.1 12.1 8.6 63.1 38 39 A R 0 0 155 -2,-0.4 45,-0.1 44,-0.2 -1,-0.1 0.287 360.0 360.0 -89.9 360.0 13.0 7.6 66.7 39 ! 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 40 48 A N 0 0 189 0, 0.0 2,-0.9 0, 0.0 40,-0.0 0.000 360.0 360.0 360.0-134.2 8.3 -1.5 61.7 41 49 A A - 0 0 40 40,-0.1 2,-0.3 38,-0.0 40,-0.2 -0.698 360.0-157.3 -95.5 99.4 7.0 0.9 59.0 42 50 A L E -H 80 0B 43 38,-1.5 38,-2.4 -2,-0.9 2,-0.6 -0.555 9.3-155.9 -62.7 127.1 5.5 4.1 60.3 43 51 A T E -H 79 0B 47 -2,-0.3 76,-2.5 76,-0.2 2,-0.4 -0.966 7.1-160.1-111.8 118.8 3.1 5.5 57.7 44 52 A L E -HI 78 118B 16 34,-2.1 34,-2.7 -2,-0.6 2,-0.3 -0.818 9.3-173.1-102.0 132.1 2.6 9.2 58.0 45 53 A E E - I 0 117B 64 72,-2.6 72,-1.7 -2,-0.4 2,-0.3 -0.772 1.9-171.9-120.3 164.7 -0.5 10.9 56.4 46 54 A H E - I 0 116B 37 -2,-0.3 70,-0.2 70,-0.2 31,-0.0 -0.881 35.2 -97.2-147.0 175.1 -1.6 14.5 56.0 47 55 A Y > - 0 0 134 68,-0.9 4,-2.5 -2,-0.3 5,-0.4 -0.852 46.8-126.6-101.0 96.9 -4.4 16.7 54.9 48 56 A P T 4 S- 0 0 93 0, 0.0 2,-1.3 0, 0.0 0, 0.0 -0.162 87.5 -1.4 -50.6 127.8 -3.6 17.7 51.3 49 57 A G T > S+ 0 0 46 1,-0.2 4,-2.1 4,-0.0 5,-0.2 -0.457 124.8 68.6 93.0 -61.1 -3.7 21.4 50.9 50 58 A M H > S+ 0 0 80 -2,-1.3 4,-2.1 1,-0.2 -1,-0.2 0.815 97.7 50.5 -65.9 -33.3 -4.7 22.3 54.5 51 59 A T H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.915 109.8 49.6 -75.8 -37.1 -1.4 21.2 56.0 52 60 A E H > S+ 0 0 60 -5,-0.4 4,-2.4 2,-0.2 -2,-0.2 0.923 112.7 49.1 -59.8 -43.7 0.7 23.2 53.6 53 61 A K H X S+ 0 0 118 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.897 110.4 50.9 -61.2 -41.2 -1.6 26.2 54.4 54 62 A A H X S+ 0 0 24 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.895 109.2 49.9 -66.7 -41.2 -1.1 25.5 58.1 55 63 A L H X S+ 0 0 2 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.913 110.8 50.6 -60.0 -43.3 2.7 25.4 57.7 56 64 A A H X S+ 0 0 46 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.888 110.9 49.3 -61.0 -39.0 2.5 28.7 55.8 57 65 A E H X S+ 0 0 110 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.898 108.8 50.9 -68.9 -41.8 0.4 30.2 58.6 58 66 A I H X S+ 0 0 22 -4,-2.3 4,-1.8 2,-0.2 -1,-0.2 0.844 112.0 48.1 -65.6 -36.7 2.8 29.0 61.4 59 67 A V H X S+ 0 0 3 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.902 109.3 53.0 -68.9 -39.5 5.8 30.6 59.6 60 68 A D H X S+ 0 0 98 -4,-2.0 4,-1.3 1,-0.2 -2,-0.2 0.905 108.4 50.0 -64.2 -41.5 3.9 33.8 59.1 61 69 A E H X S+ 0 0 70 -4,-2.1 4,-1.0 1,-0.2 3,-0.3 0.902 108.7 53.0 -61.5 -41.7 3.1 34.0 62.8 62 70 A A H >X S+ 0 0 0 -4,-1.8 4,-2.1 1,-0.2 3,-0.9 0.920 106.0 53.4 -58.0 -42.4 6.9 33.4 63.4 63 71 A R H 3< S+ 0 0 56 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.791 104.1 56.6 -65.9 -27.6 7.6 36.4 61.1 64 72 A N H 3< S+ 0 0 114 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.754 115.5 36.6 -69.2 -28.7 5.3 38.5 63.2 65 73 A R H << S+ 0 0 131 -4,-1.0 -2,-0.2 -3,-0.9 -1,-0.2 0.680 122.9 30.3 -98.2 -28.8 7.3 37.7 66.4 66 74 A W S < S- 0 0 52 -4,-2.1 2,-1.3 -5,-0.1 -1,-0.2 -0.987 81.1-110.4-136.9 145.4 10.9 37.6 65.2 67 75 A P + 0 0 64 0, 0.0 27,-0.5 0, 0.0 28,-0.4 -0.609 52.7 173.5 -77.2 95.4 12.9 39.4 62.3 68 76 A L - 0 0 23 -2,-1.3 25,-0.3 -5,-0.2 3,-0.1 -0.707 24.4-167.0-105.7 155.4 13.5 36.5 60.0 69 77 A G - 0 0 2 23,-2.0 -1,-0.1 1,-0.4 24,-0.0 0.264 66.1 -1.2-102.7-125.1 14.9 36.1 56.5 70 78 A R - 0 0 24 -49,-0.3 22,-1.3 -50,-0.1 -1,-0.4 -0.339 66.6-170.6 -68.0 149.2 14.6 33.0 54.4 71 79 A V E -aD 3 91A 0 -69,-1.7 -67,-2.8 20,-0.2 2,-0.4 -0.995 8.8-168.4-142.3 139.2 12.8 30.1 55.9 72 80 A T E +aD 4 90A 0 18,-2.3 18,-3.3 -2,-0.3 2,-0.4 -0.995 5.1 179.1-129.0 126.0 12.4 26.4 54.8 73 81 A V E +aD 5 89A 1 -69,-2.8 -67,-2.0 -2,-0.4 2,-0.4 -0.993 8.1 173.1-125.4 123.4 10.0 23.9 56.2 74 82 A I E -aD 6 88A 9 14,-2.5 14,-2.6 -2,-0.4 2,-0.4 -0.999 5.2-179.2-128.6 134.7 9.9 20.4 54.7 75 83 A H E -aD 7 87A 3 -69,-2.1 -67,-1.5 -2,-0.4 12,-0.2 -0.998 16.8-140.9-134.2 135.2 7.9 17.4 56.0 76 84 A R E -a 8 0A 27 10,-2.9 2,-0.3 -2,-0.4 10,-0.1 -0.582 16.3-172.9 -90.4 153.6 7.8 13.9 54.6 77 85 A I + 0 0 28 -69,-0.7 -32,-0.2 -2,-0.2 2,-0.1 -0.792 43.5 47.9-129.1 179.6 4.8 11.7 54.4 78 86 A G E S-H 44 0B 22 -34,-2.7 -34,-2.1 -2,-0.3 2,-0.2 -0.447 99.9 -1.5 87.4-161.6 4.3 8.1 53.3 79 87 A E E +H 43 0B 122 -36,-0.2 2,-0.3 -2,-0.1 -36,-0.2 -0.457 69.0 179.6 -69.7 132.0 6.3 5.0 54.5 80 88 A L E -H 42 0B 0 -38,-2.4 -38,-1.5 -2,-0.2 3,-0.1 -0.999 11.5-162.0-145.6 141.5 9.1 5.7 56.9 81 89 A W > - 0 0 120 -2,-0.3 3,-2.3 -40,-0.2 -44,-0.3 -0.785 42.1 -67.6-122.6 156.9 11.8 3.7 58.7 82 90 A P T 3 S+ 0 0 77 0, 0.0 -44,-0.2 0, 0.0 -1,-0.1 -0.088 120.3 20.6 -43.2 133.7 14.1 4.2 61.7 83 91 A G T 3 S+ 0 0 18 -46,-1.7 2,-0.3 1,-0.3 -45,-0.1 0.350 87.7 136.3 85.5 -5.3 16.8 6.8 61.0 84 92 A D < - 0 0 48 -3,-2.3 -47,-2.0 -46,-0.1 2,-0.6 -0.588 58.8-125.5 -71.5 134.4 14.8 8.4 58.1 85 93 A E E +B 36 0A 42 -2,-0.3 -73,-0.3 -49,-0.2 -49,-0.3 -0.760 37.7 169.2 -83.0 117.7 14.9 12.2 58.3 86 94 A I E + 0 0 10 -51,-2.5 -10,-2.9 -2,-0.6 2,-0.4 0.702 55.2 37.1-109.9 -24.8 11.3 13.3 58.3 87 95 A V E -BD 35 75A 1 -52,-1.6 -52,-2.2 -12,-0.2 2,-0.4 -0.995 53.3-177.2-137.2 136.1 11.2 17.0 59.1 88 96 A F E -BD 34 74A 0 -14,-2.6 -14,-2.5 -2,-0.4 2,-0.5 -0.993 2.4-179.0-129.1 124.4 13.6 19.9 58.3 89 97 A V E -BD 33 73A 2 -56,-2.6 -56,-2.4 -2,-0.4 2,-0.5 -0.992 4.8-176.0-123.8 125.2 13.1 23.4 59.6 90 98 A G E +BD 32 72A 0 -18,-3.3 -18,-2.3 -2,-0.5 2,-0.4 -0.985 4.5 176.8-123.9 124.5 15.5 26.1 58.5 91 99 A V E -BD 31 71A 0 -60,-2.7 -60,-3.2 -2,-0.5 2,-0.3 -0.991 6.2-168.6-130.5 140.3 15.3 29.6 59.9 92 100 A T E +B 30 0A 0 -22,-1.3 -23,-2.0 -2,-0.4 2,-0.3 -0.892 15.4 150.1-122.4 156.8 17.6 32.7 59.3 93 101 A S E -B 29 0A 2 -64,-2.0 -64,-2.3 -2,-0.3 -25,-0.1 -0.949 54.6-112.2-162.6 170.9 18.0 36.1 60.9 94 102 A A S S+ 0 0 27 -27,-0.5 2,-0.5 -2,-0.3 -67,-0.1 0.643 105.7 64.7 -79.6 -11.3 20.8 38.5 61.4 95 103 A H S > S- 0 0 28 -28,-0.4 4,-1.7 -66,-0.2 222,-0.3 -0.950 74.3-145.8-125.5 126.4 20.3 37.7 65.1 96 104 A R H > S+ 0 0 5 220,-3.4 4,-2.6 -2,-0.5 5,-0.3 0.863 98.1 49.9 -54.7 -51.8 20.9 34.3 66.7 97 105 A S H > S+ 0 0 24 220,-2.1 4,-2.6 1,-0.2 5,-0.3 0.903 109.2 55.2 -64.1 -32.1 18.2 34.4 69.4 98 106 A S H > S+ 0 0 2 219,-0.6 4,-2.2 -3,-0.2 -1,-0.2 0.937 111.5 42.2 -62.6 -47.7 15.7 35.3 66.8 99 107 A A H X S+ 0 0 0 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.901 116.2 48.1 -70.0 -41.2 16.5 32.3 64.6 100 108 A F H X S+ 0 0 0 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.937 114.3 45.7 -63.3 -46.0 16.7 29.8 67.5 101 109 A E H X S+ 0 0 88 -4,-2.6 4,-1.9 -5,-0.3 -2,-0.2 0.935 114.9 47.4 -65.7 -42.5 13.4 31.0 69.1 102 110 A A H X S+ 0 0 0 -4,-2.2 4,-2.4 -5,-0.3 5,-0.2 0.903 110.5 52.1 -65.5 -39.8 11.6 30.9 65.8 103 111 A G H X S+ 0 0 2 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.935 112.5 46.1 -59.8 -43.8 13.0 27.5 64.9 104 112 A Q H X S+ 0 0 35 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.824 111.4 51.7 -68.0 -31.7 11.8 26.2 68.2 105 113 A F H X S+ 0 0 18 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.888 109.7 49.0 -74.4 -41.9 8.4 27.8 67.8 106 114 A I H X S+ 0 0 4 -4,-2.4 4,-1.3 2,-0.2 -2,-0.2 0.931 113.3 47.1 -64.5 -45.9 7.8 26.3 64.4 107 115 A M H X S+ 0 0 1 -4,-2.2 4,-1.2 -5,-0.2 3,-0.4 0.934 110.0 52.3 -61.5 -47.1 8.8 22.8 65.6 108 116 A D H >X S+ 0 0 74 -4,-2.4 4,-1.1 1,-0.2 3,-0.6 0.907 113.2 43.8 -55.4 -46.6 6.6 23.0 68.7 109 117 A Y H 3X>S+ 0 0 70 -4,-1.9 4,-1.2 1,-0.2 5,-1.0 0.714 113.1 53.6 -72.2 -21.6 3.5 24.0 66.7 110 118 A L H 3<5S+ 0 0 7 -4,-1.3 -1,-0.2 -3,-0.4 -2,-0.2 0.577 111.6 43.8 -85.2 -16.6 4.4 21.3 64.1 111 119 A K H <<5S+ 0 0 102 -4,-1.2 -2,-0.2 -3,-0.6 -1,-0.1 0.573 127.4 27.3-103.1 -15.6 4.6 18.5 66.7 112 120 A T H <5S+ 0 0 110 -4,-1.1 -3,-0.2 -5,-0.2 -2,-0.2 0.593 133.9 20.6-118.2 -21.6 1.4 19.4 68.6 113 121 A R T <5S+ 0 0 171 -4,-1.2 -3,-0.2 -5,-0.2 -4,-0.1 0.672 88.3 102.2-123.8 -27.7 -0.9 21.2 66.1 114 122 A A S > - 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