==== 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 IMMUNE SYSTEM 12-SEP-02 1MPU . COMPND 2 MOLECULE: NKG2-D TYPE II INTEGRAL MEMBRANE PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR B.J.MCFARLAND,T.KORTEMME,D.BAKER,R.K.STRONG . 128 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8140.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 72 56.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 4.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 32 25.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.8 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 . 11 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 10 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 11 8.6 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+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 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 . 1 2 1 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 1 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 88 A Q 0 0 243 0, 0.0 3,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 45.0 39.0 59.7 -18.3 2 89 A I - 0 0 141 1,-0.2 2,-0.3 2,-0.0 0, 0.0 0.446 360.0 -44.0 -46.4 173.8 40.0 56.0 -18.7 3 90 A P - 0 0 113 0, 0.0 -1,-0.2 0, 0.0 2,-0.1 -0.248 59.5-134.2 -50.6 106.3 39.3 52.6 -17.0 4 91 A L - 0 0 164 -2,-0.3 2,-0.3 -3,-0.2 -2,-0.0 -0.398 19.8-155.4 -66.9 138.5 39.4 53.1 -13.3 5 92 A T + 0 0 118 -2,-0.1 2,-0.2 2,-0.0 -1,-0.0 -0.770 15.3 177.4-110.1 159.8 41.4 50.4 -11.5 6 93 A E + 0 0 184 -2,-0.3 2,-0.3 2,-0.0 -2,-0.0 -0.654 13.5 151.0-167.2 103.1 41.0 49.4 -7.8 7 94 A S - 0 0 113 -2,-0.2 -2,-0.0 0, 0.0 2,-0.0 -0.960 40.7-115.8-136.9 153.0 43.0 46.6 -6.2 8 95 A Y - 0 0 244 -2,-0.3 2,-0.5 1,-0.0 -2,-0.0 -0.276 33.8-115.6 -77.7 173.6 44.3 45.8 -2.7 9 96 A a - 0 0 54 11,-0.1 3,-0.1 1,-0.0 -1,-0.0 -0.916 42.6 -91.3-121.9 106.2 48.0 45.7 -2.1 10 97 A G - 0 0 20 -2,-0.5 12,-0.1 1,-0.1 9,-0.1 0.481 67.7 -63.6 -4.0 128.7 49.4 42.2 -1.1 11 98 A P + 0 0 118 0, 0.0 -1,-0.1 0, 0.0 12,-0.1 0.208 65.1 170.2 -35.4 133.0 49.5 41.5 2.7 12 99 A b - 0 0 36 1,-0.1 3,-0.1 -3,-0.1 6,-0.1 -0.888 42.0 -84.0-135.1 160.9 51.9 43.9 4.5 13 100 A P > - 0 0 33 0, 0.0 3,-1.3 0, 0.0 2,-0.2 -0.164 69.8 -67.6 -62.6 173.3 52.4 44.4 8.2 14 101 A K T 3 S- 0 0 175 1,-0.2 3,-0.1 -3,-0.1 0, 0.0 -0.413 115.2 -3.2 -68.0 132.1 50.0 46.9 9.9 15 102 A N T 3 S+ 0 0 133 1,-0.2 -1,-0.2 -2,-0.2 2,-0.1 0.632 98.7 137.5 63.6 16.3 50.2 50.6 8.8 16 103 A W < - 0 0 26 -3,-1.3 2,-0.4 1,-0.1 9,-0.2 -0.378 62.5 -96.6 -85.4 168.5 53.2 49.8 6.6 17 104 A I E -A 24 0A 69 7,-3.7 7,-2.9 -2,-0.1 2,-0.4 -0.737 38.4-158.3 -87.4 133.7 53.7 51.3 3.1 18 105 A a E +A 23 0A 43 -2,-0.4 2,-0.3 5,-0.2 5,-0.2 -0.942 19.8 158.8-116.2 132.6 52.6 49.1 0.3 19 106 A Y - 0 0 63 3,-2.2 -2,-0.0 -2,-0.4 -10,-0.0 -0.940 68.7 -21.5-155.3 130.9 53.8 49.3 -3.3 20 107 A K S S- 0 0 99 -2,-0.3 3,-0.1 1,-0.2 -11,-0.1 0.842 127.8 -52.4 35.8 44.5 53.9 46.9 -6.3 21 108 A N S S+ 0 0 84 1,-0.2 107,-0.5 106,-0.1 2,-0.3 0.981 114.3 108.1 56.2 70.9 53.7 44.2 -3.7 22 109 A N - 0 0 5 105,-0.2 -3,-2.2 -12,-0.1 2,-0.5 -0.891 58.9-134.3-165.6 141.5 56.5 45.1 -1.3 23 110 A b E -AB 18 126A 0 103,-2.5 103,-2.0 -2,-0.3 2,-0.3 -0.928 21.1-174.1-114.8 129.5 56.2 46.5 2.2 24 111 A Y E -AB 17 125A 6 -7,-2.9 -7,-3.7 -2,-0.5 2,-0.3 -0.877 9.2-176.4-122.8 151.4 58.1 49.4 3.6 25 112 A Q E - B 0 124A 37 99,-1.7 99,-2.6 -2,-0.3 2,-0.7 -0.947 14.6-149.4-149.2 126.7 58.4 51.1 6.9 26 113 A F E - B 0 123A 134 -2,-0.3 2,-0.5 97,-0.2 97,-0.2 -0.847 13.1-163.1-100.0 107.0 60.5 54.2 7.8 27 114 A F E - B 0 122A 35 95,-3.0 95,-2.0 -2,-0.7 -2,-0.0 -0.794 13.1-173.6 -97.3 124.0 61.8 54.3 11.4 28 115 A D E + 0 0 121 -2,-0.5 2,-1.8 93,-0.2 -1,-0.1 0.411 57.1 105.7 -94.0 3.8 63.0 57.6 12.7 29 116 A E E S- 0 0 122 93,-0.1 -1,-0.1 1,-0.0 91,-0.1 -0.478 75.6-135.0 -84.1 71.0 64.3 56.1 16.0 30 117 A S E + 0 0 68 -2,-1.8 2,-0.3 89,-0.1 91,-0.2 0.186 38.5 157.1 -26.8 124.9 68.1 56.4 15.1 31 118 A K E - B 0 120A 61 89,-2.3 89,-1.6 87,-0.2 87,-0.1 -0.958 45.2 -90.8-149.9 159.7 70.1 53.2 15.9 32 119 A N > - 0 0 33 -2,-0.3 4,-2.2 87,-0.3 85,-0.2 -0.172 51.3 -95.4 -67.5 172.6 73.4 51.7 14.7 33 120 A W H > S+ 0 0 24 83,-2.1 4,-2.3 2,-0.2 5,-0.1 0.842 123.7 49.2 -60.1 -36.8 73.2 49.2 11.8 34 121 A Y H > S+ 0 0 137 82,-0.7 4,-1.6 2,-0.2 -1,-0.2 0.976 113.0 43.8 -67.2 -56.9 73.1 46.2 14.1 35 122 A E H > S+ 0 0 106 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.860 114.1 57.5 -53.7 -35.5 70.3 47.5 16.4 36 123 A S H X S+ 0 0 0 -4,-2.2 4,-1.6 1,-0.2 -1,-0.2 0.932 103.2 47.5 -63.1 -50.0 68.7 48.5 13.2 37 124 A Q H X S+ 0 0 19 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.773 108.2 59.9 -64.6 -24.5 68.6 45.1 11.6 38 125 A A H X S+ 0 0 54 -4,-1.6 4,-3.0 2,-0.2 -1,-0.2 0.932 101.0 51.7 -68.6 -47.9 67.2 43.7 14.8 39 126 A S H X S+ 0 0 15 -4,-1.7 4,-1.0 1,-0.2 -2,-0.2 0.972 110.0 49.4 -53.2 -57.6 64.1 46.0 14.8 40 127 A c H >< S+ 0 0 0 -4,-1.6 3,-1.1 1,-0.2 5,-0.3 0.901 113.9 44.4 -48.2 -51.4 63.3 44.8 11.2 41 128 A M H >< S+ 0 0 117 -4,-1.8 3,-3.1 3,-0.3 -1,-0.2 0.891 105.0 65.8 -61.6 -39.6 63.6 41.1 12.1 42 129 A S H 3< S+ 0 0 98 -4,-3.0 -1,-0.3 1,-0.3 -2,-0.2 0.719 110.0 36.3 -54.0 -24.7 61.7 41.8 15.3 43 130 A Q T << S- 0 0 83 -3,-1.1 -1,-0.3 -4,-1.0 -2,-0.2 0.009 132.5 -97.4-113.9 19.5 58.8 42.6 13.2 44 131 A N S < S+ 0 0 126 -3,-3.1 -3,-0.3 1,-0.2 2,-0.2 0.969 90.2 81.9 59.4 77.5 59.8 39.8 10.7 45 132 A A - 0 0 12 -5,-0.3 2,-0.3 -8,-0.2 -1,-0.2 -0.792 62.8-125.4-174.3-175.6 61.7 41.7 8.0 46 133 A S E -C 125 0A 38 79,-1.3 79,-3.0 -2,-0.2 3,-0.1 -0.899 44.2 -64.1-144.7 179.4 65.1 43.1 7.2 47 134 A L E S-C 124 0A 2 -2,-0.3 77,-0.3 77,-0.3 21,-0.2 -0.385 76.9 -70.9 -72.1 146.4 66.6 46.4 6.2 48 135 A L - 0 0 0 75,-2.8 21,-1.9 19,-0.5 2,-0.5 0.046 50.6-158.4 -40.3 120.4 65.5 47.7 2.7 49 136 A K - 0 0 57 19,-0.2 2,-0.7 -3,-0.1 -1,-0.1 -0.970 7.0-143.2-109.3 137.3 67.0 45.7 -0.3 50 137 A V + 0 0 1 -2,-0.5 38,-0.3 1,-0.2 42,-0.1 -0.877 37.1 146.8-103.3 115.6 67.3 47.2 -3.8 51 138 A Y + 0 0 91 -2,-0.7 2,-0.3 1,-0.3 -1,-0.2 0.587 62.8 14.3-122.8 -17.0 66.6 44.7 -6.5 52 139 A S > - 0 0 20 1,-0.1 4,-0.8 39,-0.0 3,-0.5 -0.843 50.2-144.0-161.2 126.8 65.0 46.5 -9.4 53 140 A K T 4 S+ 0 0 98 -2,-0.3 7,-0.1 1,-0.2 -1,-0.1 0.546 103.4 56.4 -70.8 -0.7 64.5 50.2 -10.5 54 141 A E T 4 S+ 0 0 129 2,-0.1 3,-0.3 1,-0.1 -1,-0.2 0.813 111.5 36.0 -96.1 -39.7 61.1 49.3 -11.9 55 142 A D T 4 S+ 0 0 64 -3,-0.5 -2,-0.2 1,-0.2 -1,-0.1 0.367 127.3 38.4 -95.5 6.8 59.4 47.8 -8.8 56 143 A Q >< + 0 0 0 -4,-0.8 3,-2.3 2,-0.1 -1,-0.2 0.117 69.4 124.8-141.2 21.5 61.1 50.2 -6.4 57 144 A D G > + 0 0 56 -3,-0.3 3,-1.8 1,-0.3 4,-0.2 0.685 65.0 74.3 -58.8 -18.5 61.0 53.5 -8.3 58 145 A L G > S+ 0 0 42 1,-0.3 3,-2.8 2,-0.2 -1,-0.3 0.892 80.6 76.0 -60.1 -32.3 59.2 55.0 -5.3 59 146 A L G X S+ 0 0 4 -3,-2.3 3,-1.2 1,-0.3 49,-0.4 0.680 76.3 74.4 -50.8 -22.6 62.6 54.8 -3.8 60 147 A K G < S+ 0 0 107 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.700 92.3 55.2 -66.9 -19.4 63.7 57.9 -5.9 61 148 A L G < S+ 0 0 155 -3,-2.8 -1,-0.2 -4,-0.2 -2,-0.2 0.454 75.7 118.8 -95.4 -0.9 61.6 60.1 -3.6 62 149 A V < - 0 0 34 -3,-1.2 45,-0.3 -4,-0.2 2,-0.2 -0.411 53.8-144.5 -67.3 139.2 63.2 59.2 -0.2 63 150 A K - 0 0 185 -2,-0.1 -2,-0.1 43,-0.1 -1,-0.0 -0.684 53.7 -2.2-103.2 157.9 64.8 62.1 1.5 64 151 A S S S- 0 0 84 -2,-0.2 43,-0.5 43,-0.1 2,-0.4 -0.076 97.5 -49.2 64.2-161.2 68.0 62.0 3.7 65 152 A Y E +D 106 0A 104 41,-0.1 56,-0.4 39,-0.0 2,-0.3 -0.882 53.4 176.1-113.7 145.7 70.0 58.9 4.5 66 153 A H E -D 105 0A 31 39,-1.3 39,-4.2 -2,-0.4 56,-0.3 -0.996 34.5 -99.2-148.7 148.8 68.7 55.6 5.9 67 154 A W E +De 104 122A 0 54,-2.3 56,-1.6 -2,-0.3 -19,-0.5 -0.429 41.1 178.0 -68.5 137.0 70.1 52.2 6.7 68 155 A M E - 0 0 0 35,-1.7 35,-0.5 2,-0.2 2,-0.4 -0.837 44.0 -94.8-130.9 170.4 69.6 49.5 4.2 69 156 A G E S+ 0 0 0 -21,-1.9 13,-1.7 -2,-0.3 2,-0.6 0.058 78.9 122.0 -79.1 30.8 70.8 45.9 4.1 70 157 A L E + F 0 81A 0 33,-0.5 33,-0.9 -2,-0.4 2,-0.3 -0.826 33.5 158.9 -96.9 124.9 74.0 46.4 2.1 71 158 A V E -DF 102 80A 14 9,-3.3 9,-2.7 -2,-0.6 2,-0.6 -0.974 36.5-134.1-142.2 154.2 77.1 45.3 3.9 72 159 A H E - F 0 79A 49 29,-1.9 7,-0.2 -2,-0.3 -2,-0.0 -0.947 15.8-159.5-111.0 120.0 80.7 44.3 3.1 73 160 A I > - 0 0 72 5,-0.7 2,-1.8 -2,-0.6 4,-0.9 -0.901 24.9-126.8-101.2 118.3 81.9 41.1 4.8 74 161 A P T 4 S+ 0 0 97 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.225 73.2 123.8 -49.0 16.2 85.8 41.1 4.8 75 162 A T T 4 S- 0 0 93 -2,-1.8 3,-0.1 1,-0.2 -2,-0.0 0.272 103.9 -92.8 -65.6 18.6 85.8 37.6 3.2 76 163 A N T 4 S+ 0 0 170 1,-0.2 -1,-0.2 -3,-0.1 2,-0.1 0.796 96.3 138.4 67.6 28.8 87.9 39.4 0.6 77 164 A G < - 0 0 27 -4,-0.9 -1,-0.2 1,-0.2 2,-0.1 -0.208 56.4-108.6 -97.8-171.5 84.4 39.7 -0.8 78 165 A S - 0 0 100 1,-0.1 -5,-0.7 -3,-0.1 2,-0.3 -0.324 52.2 -69.1-103.1-172.6 82.2 42.3 -2.5 79 166 A W E +F 72 0A 53 -7,-0.2 8,-0.7 -2,-0.1 2,-0.3 -0.622 62.2 162.4 -84.2 142.9 79.3 44.1 -1.2 80 167 A Q E -FG 71 86A 44 -9,-2.7 -9,-3.3 -2,-0.3 2,-0.2 -0.909 40.0 -86.5-149.2 174.8 76.2 42.1 -0.5 81 168 A W E > -F 70 0A 1 4,-2.7 3,-2.4 -2,-0.3 -11,-0.2 -0.609 45.3-106.1 -88.8 151.3 72.9 42.0 1.3 82 169 A E T 3 S+ 0 0 50 -13,-1.7 -1,-0.1 1,-0.3 -12,-0.1 0.664 117.8 61.5 -49.2 -17.7 72.7 40.9 4.9 83 170 A D T 3 S- 0 0 97 -14,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.242 119.6-102.4 -98.0 16.5 71.0 37.7 3.6 84 171 A G S < S+ 0 0 52 -3,-2.4 2,-0.2 1,-0.3 -2,-0.1 0.372 78.1 140.9 81.7 -6.5 73.9 36.4 1.4 85 172 A S - 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