| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 38.2 | Very low | 34.1 | Very low | 255 Ų | 255 | 137.6 Ų | 137.6 | 100% | 1.256 | 81% | 0.808 | S | S | * | * | 0 | 125.9 | 0 | -41.8 | 175.6 | -157.8 | 0 | 0 | 105.4 | |||||
| 2 | G | 35.4 | Very low | 33.6 | Very low | 74 Ų | 74 | 137.2 Ų | 137.2 | 76% | 0.763 | 79% | 0.792 | S | S | * | * | cis | 165 | 118.6 | 6.9 | 0 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 3 | N | 30.3 | Very low | 33.3 | Very low | 150 Ų | 150 | 141.7 Ų | 141.7 | 80% | 0.802 | 79% | 0.788 | S | S | * | * | trans | -19.8 | 157.3 | 153.6 | -78.3 | 21.4 | 0 | 0 | 0 | 116 | ||||
| 4 | T | 39.3 | Very low | 33 | Very low | 111 Ų | 111 | 144.6 Ų | 144.6 | 68% | 0.681 | 79% | 0.793 | S | S | * | * | cis | -178 | 164.4 | 26.8 | 2.6 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 5 | S | 38.7 | Very low | 32.6 | Very low | 107 Ų | 107 | 140.4 Ų | 140.4 | 75% | 0.748 | 80% | 0.796 | S | S | * | * | trans | 66.3 | 162.9 | 138.9 | -65.5 | 0 | 0 | 0 | 0 | 121 | ||||
| 6 | S | 35.4 | Very low | 32.3 | Very low | 89 Ų | 89 | 135.8 Ų | 135.8 | 62% | 0.622 | 79% | 0.789 | S | S | * | * | cis | -147.9 | 142.8 | 5.3 | -121.8 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 7 | E | 34.3 | Very low | 32.2 | Very low | 136 Ų | 136 | 138.5 Ų | 138.5 | 64% | 0.636 | 79% | 0.792 | S | S | * | * | 66.5 | 113.3 | 101.6 | -71.2 | -159.6 | 109.3 | 0 | 0 | 117.7 | |||||
| 8 | R | 32.8 | Very low | 32.1 | Very low | 225 Ų | 225 | 140.8 Ų | 140.8 | 85% | 0.849 | 79% | 0.791 | S | S | * | * | 80.9 | 124.4 | 97 | -84 | -170.7 | 165.1 | 129.6 | -10.5 | 116.5 | |||||
| 9 | A | 30.3 | Very low | 32.1 | Very low | 107 Ų | 107 | 140.3 Ų | 140.3 | 88% | 0.884 | 79% | 0.792 | S | S | * | * | trans | -159.4 | 149.4 | 132 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 10 | A | 32 | Very low | 32.2 | Very low | 94 Ų | 94 | 137.4 Ų | 137.4 | 78% | 0.777 | 79% | 0.786 | S | S | * | * | trans | -141.8 | 153.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 11 | L | 28.5 | Very low | 32.1 | Very low | 166 Ų | 166 | 141.5 Ų | 141.5 | 87% | 0.869 | 79% | 0.789 | S | S | * | * | trans | 156.3 | 160.8 | 161 | -86.6 | 149.2 | 0 | 0 | 0 | 107.8 | ||||
| 12 | E | 27.8 | Very low | 31.7 | Very low | 132 Ų | 132 | 141.2 Ų | 141.2 | 62% | 0.617 | 77% | 0.774 | S | S | * | * | cis | -172.7 | 161.7 | -46.4 | -166.7 | -167.1 | -144.3 | 0 | 0 | 106.6 | ||||
| 13 | R | 30.4 | Very low | 31.4 | Very low | 196 Ų | 196 | 143.3 Ų | 143.3 | 74% | 0.74 | 77% | 0.768 | S | S | * | * | trans | 76.9 | 154.1 | 164.2 | -48.9 | -174.8 | -169.9 | -166.6 | -0.9 | 116.5 | ||||
| 14 | Q | 28.7 | Very low | 31.5 | Very low | 183 Ų | 183 | 141.6 Ų | 141.6 | 86% | 0.855 | 77% | 0.768 | S | S | * | * | cis | -160.1 | 162.6 | -5.7 | -128.4 | 169.3 | -24.3 | 0 | 0 | 110.4 | ||||
| 15 | G | 27.7 | Very low | 31.2 | Very low | 81 Ų | 81 | 141.7 Ų | 141.7 | 84% | 0.835 | 77% | 0.773 | S | S | * | * | trans | 130 | 134.6 | 154.9 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 16 | G | 26.8 | Very low | 30.7 | Very low | 67 Ų | 67 | 140.8 Ų | 140.8 | 69% | 0.691 | 78% | 0.78 | S | S | * | * | trans | -171 | 170.9 | 175 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 17 | H | 30.3 | Very low | 30.4 | Very low | 181 Ų | 181 | 140.5 Ų | 140.5 | 84% | 0.838 | 79% | 0.792 | S | S | * | * | trans | -162.5 | 130.5 | 167.8 | -97.2 | -85.2 | 0 | 0 | 0 | 106.8 | ||||
| 18 | K | 31.6 | Very low | 30.3 | Very low | 180 Ų | 180 | 138.7 Ų | 138.7 | 78% | 0.783 | 80% | 0.8 | S | S | * | * | 55.3 | 131.5 | 74.5 | -73.4 | -169.9 | 178.8 | -178.9 | 0 | 112.5 | |||||
| 19 | T | 32.2 | Very low | 30.5 | Very low | 131 Ų | 131 | 136.5 Ų | 136.5 | 80% | 0.804 | 80% | 0.796 | S | S | * | * | cis | -172.6 | 168.1 | 11.6 | 16.3 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 20 | A | 33.2 | Very low | 30.6 | Very low | 82 Ų | 82 | 138.1 Ų | 138.1 | 68% | 0.678 | 79% | 0.79 | S | S | * | * | cis | -173.4 | 161.3 | -11.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 21 | R | 29.4 | Very low | 30.7 | Very low | 224 Ų | 224 | 137 Ų | 137 | 85% | 0.845 | 79% | 0.788 | S | S | * | * | trans | 42.9 | 137.2 | 147 | -67.5 | -179.6 | 178.8 | 171.1 | -3.1 | 123.1 | ||||
| 22 | R | 29.8 | Very low | 30.9 | Very low | 249 Ų | 249 | 137.3 Ų | 137.3 | 94% | 0.94 | 79% | 0.791 | S | S | * | * | -152.5 | 145.8 | 111.5 | -160.4 | 169.2 | -177.9 | -174.3 | -0.8 | 112.4 | |||||
| 23 | D | 29.9 | Very low | 31.2 | Very low | 119 Ų | 119 | 141.7 Ų | 141.7 | 64% | 0.636 | 80% | 0.801 | S | S | * | * | trans | -93.7 | 174.5 | -170.7 | -54.4 | -81.1 | 0 | 0 | 0 | 115.5 | ||||
| 24 | S | 33.1 | Very low | 31.9 | Very low | 114 Ų | 114 | 137.4 Ų | 137.4 | 80% | 0.797 | 80% | 0.799 | S | S | * | * | trans | 116.4 | 141.6 | 139.4 | -62.9 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 25 | S | 31.4 | Very low | 32.2 | Very low | 113 Ų | 113 | 138.8 Ų | 138.8 | 79% | 0.79 | 80% | 0.802 | S | S | * | * | cis | -178.3 | 143.9 | -19.3 | 50.4 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 26 | G | 29.5 | Very low | 32.9 | Very low | 87 Ų | 87 | 142.6 Ų | 142.6 | 90% | 0.897 | 80% | 0.802 | S | S | * | * | trans | 81.6 | 152.6 | 162.8 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 27 | G | 29.7 | Very low | 33.5 | Very low | 84 Ų | 84 | 147.9 Ų | 147.9 | 87% | 0.866 | 81% | 0.813 | S | S | * | * | cis | -174.8 | 148.6 | -3.8 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 28 | A | 32.1 | Very low | 34 | Very low | 97 Ų | 97 | 146.7 Ų | 146.7 | 80% | 0.802 | 81% | 0.81 | S | S | * | * | trans | -105 | 155.6 | -167.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 29 | K | 35.6 | Very low | 34.1 | Very low | 180 Ų | 180 | 144.8 Ų | 144.8 | 78% | 0.783 | 81% | 0.808 | S | S | * | * | 168.7 | 154.5 | 113.1 | -94.6 | -176.1 | 165.3 | -139.9 | 0 | 115 | |||||
| 30 | D | 33.1 | Very low | 34.3 | Very low | 140 Ų | 140 | 143.9 Ų | 143.9 | 75% | 0.749 | 81% | 0.807 | S | S | * | * | trans | 29.5 | 140.3 | 144.5 | -48 | -36.8 | 0 | 0 | 0 | 119.9 | ||||
| 31 | G | 34 | Very low | 35.1 | Very low | 72 Ų | 72 | 145.8 Ų | 145.8 | 74% | 0.742 | 81% | 0.813 | S | S | * | * | cis | 161.8 | 168.2 | 2.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 32 | D | 32 | Very low | 35.8 | Very low | 172 Ų | 172 | 143.2 Ų | 143.2 | 92% | 0.92 | 81% | 0.811 | S | S | * | * | trans | 78.7 | 147.5 | 165.9 | -139.4 | 14.1 | 0 | 0 | 0 | 121.4 | ||||
| 33 | R | 35.3 | Very low | 36.2 | Very low | 223 Ų | 223 | 139.2 Ų | 139.2 | 84% | 0.842 | 81% | 0.808 | S | S | * | * | trans | -140.6 | 168 | -179.8 | -93.3 | -173.2 | 177.2 | -169.3 | 0.2 | 107.3 | ||||
| 34 | P | 44.5 | Very low | 36.6 | Very low | 106 Ų | 106 | 138.1 Ų | 138.1 | 69% | 0.688 | 82% | 0.816 | S | S | * | * | cis | -127.9 | 178 | -17.6 | 38.3 | -23 | 0 | 0 | 0 | 112.3 | ||||
| 35 | K | 35.7 | Very low | 37.1 | Very low | 212 Ų | 212 | 139.4 Ų | 139.4 | 92% | 0.922 | 81% | 0.813 | S | S | * | * | trans | -134.8 | 128.4 | 148.7 | -78.8 | -169.7 | 178.1 | 177.4 | 0 | 110.4 | ||||
| 36 | I | 41.7 | Very low | 37.6 | Very low | 161 Ų | 161 | 141.1 Ų | 141.1 | 83% | 0.826 | 81% | 0.812 | S | S | * | * | trans | -88.2 | 124.7 | 171.1 | -62.1 | 165 | 0 | 0 | 0 | 106.9 | ||||
| 37 | L | 38.3 | Very low | 37.8 | Very low | 178 Ų | 178 | 146.1 Ų | 146.1 | 93% | 0.932 | 81% | 0.81 | S | S | * | * | trans | -139.6 | 148.1 | 153.9 | -152.6 | 75.4 | 0 | 0 | 0 | 108.3 | ||||
| 38 | M | 41 | Very low | 38.1 | Very low | 156 Ų | 156 | 150.4 Ų | 150.4 | 77% | 0.768 | 81% | 0.807 | S | S | * | * | trans | -106.3 | 167.5 | -164.7 | -174.8 | 165.6 | 146.9 | 0 | 0 | 110.7 | ||||
| 39 | D | 34.2 | Very low | 38.4 | Very low | 140 Ų | 140 | 150.5 Ų | 150.5 | 75% | 0.749 | 80% | 0.802 | S | S | * | * | trans | 68.1 | 105 | 173.9 | -62.3 | -22.4 | 0 | 0 | 0 | 118.5 | ||||
| 40 | S | 36.1 | Very low | 38.3 | Very low | 112 Ų | 112 | 150.8 Ų | 150.8 | 78% | 0.783 | 81% | 0.805 | S | S | * | * | -159.2 | 135.6 | 111.1 | -145.4 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 41 | P | 50.2 | Low | 38.6 | Very low | 123 Ų | 123 | 152.8 Ų | 152.8 | 80% | 0.799 | 81% | 0.81 | S | S | * | * | trans | -102.3 | 49.7 | -171.7 | 40.6 | -36.2 | 0 | 0 | 0 | 113.7 | ||||
| 42 | E | 44 | Very low | 39 | Very low | 170 Ų | 170 | 157 Ų | 157 | 79% | 0.794 | 81% | 0.814 | S | S | * | * | trans | -145.2 | 92.3 | -178.2 | -96.2 | 163.1 | -148.2 | 0 | 0 | 110.4 | ||||
| 43 | D | 38.2 | Very low | 39.3 | Very low | 164 Ų | 164 | 157.8 Ų | 157.8 | 88% | 0.877 | 81% | 0.809 | S | S | * | * | trans | 178.5 | 83.5 | 155.8 | -99.9 | -22.4 | 0 | 0 | 0 | 109 | ||||
| 44 | A | 39.5 | Very low | 39.5 | Very low | 97 Ų | 97 | 149.7 Ų | 149.7 | 80% | 0.802 | 79% | 0.79 | S | S | * | * | trans | -116.4 | 25.2 | -176.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 45 | D | 43.3 | Very low | 39.5 | Very low | 140 Ų | 140 | 148.5 Ų | 148.5 | 75% | 0.749 | 78% | 0.782 | S | S | * | * | trans | -134 | 58.7 | -174.1 | -80 | -54.5 | 0 | 0 | 0 | 113.1 | ||||
| 46 | I | 40.8 | Very low | 40.2 | Very low | 149 Ų | 149 | 145.5 Ų | 145.5 | 76% | 0.764 | 77% | 0.772 | S | S | * | * | trans | -126 | 4.3 | 174.5 | -83 | -176.5 | 0 | 0 | 0 | 114.3 | ||||
| 47 | F | 33.8 | Very low | 40.6 | Very low | 193 Ų | 193 | 146.2 Ų | 146.2 | 85% | 0.846 | 77% | 0.769 | S | S | * | * | trans | -116 | 74.4 | 171.3 | -72.5 | -78.3 | 0 | 0 | 0 | 112.2 | S49 | F47-S49 PolarHBondContact O-N 3.08Š| ||
| 48 | H | 37.3 | Very low | 41.2 | Very low | 174 Ų | 174 | 145.2 Ų | 145.2 | 81% | 0.806 | 76% | 0.759 | S | S | * | * | trans | -68.6 | 86.1 | 156.3 | -71.2 | -37.5 | 0 | 0 | 0 | 109.2 | E50 | H48-E50 PolarHBondContact O-N 2.87Š| ||
| 49 | S | 37.3 | Very low | 41.6 | Very low | 99 Ų | 99 | 143.9 Ų | 143.9 | 69% | 0.692 | 75% | 0.751 | S | S | * | * | trans | -65.2 | 115.8 | 160.4 | -60.3 | 0 | 0 | 0 | 0 | 107.9 | F47 E51 | F47-S49 PolarHBondContact O-N 3.08Å; S49-E51 PolarHBondContact O-N 2.79Å; S49-E51 VanDerWaalsContact O-N 3.09Å | ||
| 50 | E | 34.9 | Very low | 42 | Very low | 185 Ų | 185 | 144.5 Ų | 144.5 | 86% | 0.864 | 75% | 0.748 | S | S | * | * | trans | -60.6 | 113.9 | 164.6 | -71.7 | -176 | 133.9 | 0 | 0 | 107.9 | H48 I52 | H48-E50 PolarHBondContact O-N 2.87Å; E50-I52 VanDerWaalsContact C-N 3.33Å; E50-I52 PolarHBondContact O-N 2.99Å | ||
| 51 | E | 37.5 | Very low | 42.6 | Very low | 182 Ų | 182 | 143.9 Ų | 143.9 | 85% | 0.85 | 74% | 0.735 | S | S | * | * | trans | -65.1 | 93.1 | 174.7 | -75.9 | -169.4 | 133.2 | 0 | 0 | 109.6 | S49 K53 | S49-E51 PolarHBondContact O-N 2.79Å; S49-E51 VanDerWaalsContact O-N 3.09Å; E51-K53 PolarHBondContact O-N 2.87Å | ||
| 52 | I | 43.8 | Very low | 42.5 | Very low | 160 Ų | 160 | 140.3 Ų | 140.3 | 82% | 0.821 | 72% | 0.716 | S | S | * | * | trans | -69.1 | 83.2 | 158.4 | -56 | 177.9 | 0 | 0 | 0 | 106.5 | E50 A54 | E50-I52 VanDerWaalsContact C-N 3.33Å; E50-I52 PolarHBondContact O-N 2.99Å; I52-A54 VanDerWaalsContact C-N 3.34Å; I52-A54 PolarHBondContact O-N 3.01Å | ||
| 53 | K | 37.2 | Very low | 42.8 | Very low | 189 Ų | 189 | 141.7 Ų | 141.7 | 82% | 0.822 | 71% | 0.714 | S | S | * | * | trans | -67.6 | 91.5 | 177.9 | -173 | 178.5 | -177.1 | 179.1 | 0 | 109 | E51 | E51-K53 PolarHBondContact O-N 2.87Š| ||
| 54 | A | 40.6 | Very low | 43.3 | Very low | 54 Ų | 54 | 138.9 Ų | 138.9 | 45% | 0.446 | 70% | 0.696 | S | S | . | * | trans | -60.7 | 132.9 | 179.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | I52 E56 | I52-A54 VanDerWaalsContact C-N 3.34Å; I52-A54 PolarHBondContact O-N 3.01Å; A54-E56 HydrophobicContact CB-CG 3.85Å; A54-E56 PolarHBondContact O-N 2.88Å | ||
| 55 | P | 43.3 | Very low | 43.4 | Very low | 80 Ų | 80 | 140.9 Ų | 140.9 | 52% | 0.519 | 69% | 0.688 | S | S | . | * | trans | -78.7 | 35.4 | -179.7 | 34.3 | -36.5 | 0 | 0 | 0 | 112.7 | K57 E58 E59 | P55-K57 PolarHBondContact O-N 2.86Å; P55-K57 VanDerWaalsContact O-N 3.11Å; P55-E58 PolarHBondContact O-N 3.05Å; P55-E59 PolarHBondContact O-N 3.26Å | ||
| 56 | E | 52 | Low | 43.4 | Very low | 149 Ų | 149 | 140.5 Ų | 140.5 | 70% | 0.696 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -61.3 | -27.3 | -171.7 | -70.1 | -178.5 | 165.2 | 0 | 0 | 113.1 | A54 F60 | A54-E56 HydrophobicContact CB-CG 3.85Å; A54-E56 PolarHBondContact O-N 2.88Å; E56-F60 WeakPolarHBondContact O-CB 3.4Å; E56-F60 PolarHBondContact O-N 2.85Å; E56-F60 VanDerWaalsContact O-N 3.13Å |
| 57 | K | 50.1 | Low | 43.9 | Very low | 177 Ų | 177 | 140.1 Ų | 140.1 | 77% | 0.77 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -79.5 | -31.8 | -179.2 | -119.9 | -178 | -177.9 | -178.1 | 0 | 114.1 | P55 L61 | P55-K57 PolarHBondContact O-N 2.86Å; P55-K57 VanDerWaalsContact O-N 3.11Å; K57-L61 WeakPolarHBondContact O-CB 3.39Å; K57-L61 WeakPolarHBondContact O-CD1 3.24Å; K57-L61 WeakPolarHBondContact O-CG 3.47Å; K57-L61 PolarHBondContact O-N 2.84Å |
| 58 | E | 49.2 | Very low | 44.5 | Very low | 156 Ų | 156 | 138.1 Ų | 138.1 | 73% | 0.729 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -81.5 | -38.8 | 179.1 | -75.1 | 177.2 | 152.6 | 0 | 0 | 111 | P55 L61 A62 | P55-E58 PolarHBondContact O-N 3.05Å; E58-L61 PolarHBondContact O-N 3.5Å; E58-A62 WeakPolarHBondContact O-CB 3.27Å; E58-A62 PolarHBondContact O-N 2.88Å |
| 59 | E | 49.9 | Very low | 45 | Very low | 129 Ų | 129 | 134.6 Ų | 134.6 | 60% | 0.603 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -64.4 | -44.4 | 170.9 | -73 | -169.3 | 143.7 | 0 | 0 | 111.8 | P55 L61 A62 W63 | P55-E59 PolarHBondContact O-N 3.26Å; E59-L61 VanDerWaalsContact C-N 3.26Å; E59-L61 PolarHBondContact O-N 2.78Å; E59-A62 WeakPolarHBondContact O-CB 3.41Å; E59-A62 PolarHBondContact O-N 2.92Å; E59-A62 VanDerWaalsContact O-N 3.09Å; E59-W63 PolarHBondContact O-N 3.44Å |
| 60 | F | 43.2 | Very low | 45.2 | Very low | 153 Ų | 153 | 135.2 Ų | 135.2 | 67% | 0.671 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -63.9 | -31.5 | 179.3 | -164.6 | -88.5 | 0 | 0 | 0 | 112.9 | E56 | E56-F60 WeakPolarHBondContact O-CB 3.4Å; E56-F60 PolarHBondContact O-N 2.85Å; E56-F60 VanDerWaalsContact O-N 3.13Å |
| 61 | L | 47.4 | Very low | 45.9 | Very low | 98 Ų | 98 | 133.9 Ų | 133.9 | 51% | 0.513 | 66% | 0.663 | S | S | . | * | H | α-helix | trans | -77.8 | -31.4 | 172.2 | -72.4 | 170.5 | 0 | 0 | 0 | 112.8 | K57 E58 E59 Q64 H65 | K57-L61 WeakPolarHBondContact O-CB 3.39Å; K57-L61 WeakPolarHBondContact O-CD1 3.24Å; K57-L61 WeakPolarHBondContact O-CG 3.47Å; K57-L61 PolarHBondContact O-N 2.84Å; E58-L61 PolarHBondContact O-N 3.5Å; E59-L61 VanDerWaalsContact C-N 3.26Å; E59-L61 PolarHBondContact O-N 2.78Å; L61-Q64 PolarHBondContact O-N 2.92Å; L61-Q64 VanDerWaalsContact O-N 3.16Å; L61-H65 WeakPolarHBondContact O-CB 3.48Å; L61-H65 PolarHBondContact O-N 3.33Å |
| 62 | A | 49.5 | Very low | 46.2 | Very low | 48 Ų | 48 | 133.9 Ų | 133.9 | 40% | 0.397 | 66% | 0.66 | S | S | . | * | H | α-helix | trans | -61.5 | -44.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | E58 E59 Q64 H65 D66 | E58-A62 WeakPolarHBondContact O-CB 3.27Å; E58-A62 PolarHBondContact O-N 2.88Å; E59-A62 WeakPolarHBondContact O-CB 3.41Å; E59-A62 PolarHBondContact O-N 2.92Å; E59-A62 VanDerWaalsContact O-N 3.09Å; A62-Q64 VanDerWaalsContact C-N 3.29Å; A62-Q64 PolarHBondContact O-N 2.98Å; A62-H65 PolarHBondContact O-N 3.45Å; A62-H65 VanDerWaalsContact O-N 3.14Å; A62-D66 PolarHBondContact O-N 2.83Å |
| 63 | W | 49.7 | Very low | 46.4 | Very low | 200 Ų | 200 | 128.6 Ų | 128.6 | 76% | 0.758 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -64.8 | -28.8 | 174.4 | -75.6 | 82 | 0 | 0 | 0 | 113.3 | E59 L67 | E59-W63 PolarHBondContact O-N 3.44Å; W63-L67 WeakPolarHBondContact O-CG 3.35Å |
| 64 | Q | 48.1 | Very low | 47.2 | Very low | 105 Ų | 105 | 125.1 Ų | 125.1 | 49% | 0.491 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -72.9 | -39.4 | 171 | -72.9 | -170 | -52.5 | 0 | 0 | 111.8 | L61 A62 D66 L67 E68 | L61-Q64 PolarHBondContact O-N 2.92Å; L61-Q64 VanDerWaalsContact O-N 3.16Å; A62-Q64 VanDerWaalsContact C-N 3.29Å; A62-Q64 PolarHBondContact O-N 2.98Å; Q64-D66 VanDerWaalsContact C-N 3.3Å; Q64-D66 PolarHBondContact O-N 2.73Å; Q64-L67 PolarHBondContact O-N 3.02Å; Q64-E68 PolarHBondContact O-N 2.92Å |
| 65 | H | 42.3 | Very low | 48.3 | Very low | 138 Ų | 138 | 126.3 Ų | 126.3 | 64% | 0.639 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -70.3 | -25.1 | 179.7 | -158.1 | -50.6 | 0 | 0 | 0 | 112.9 | L61 A62 | L61-H65 WeakPolarHBondContact O-CB 3.48Å; L61-H65 PolarHBondContact O-N 3.33Å; A62-H65 PolarHBondContact O-N 3.45Å; A62-H65 VanDerWaalsContact O-N 3.14Å |
| 66 | D | 44 | Very low | 49.9 | Very low | 132 Ų | 132 | 128.4 Ų | 128.4 | 71% | 0.706 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.4 | -20.3 | 169.6 | -76.6 | -17.9 | 0 | 0 | 0 | 113 | A62 Q64 | A62-D66 PolarHBondContact O-N 2.83Å; Q64-D66 VanDerWaalsContact C-N 3.3Å; Q64-D66 PolarHBondContact O-N 2.73Å |
| 67 | L | 49.9 | Very low | 51.6 | Low | 142 Ų | 142 | 123.7 Ų | 123.7 | 74% | 0.743 | 64% | 0.636 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.3 | -22.3 | 173.8 | -71.3 | 170.6 | 0 | 0 | 0 | 113.1 | W63 Q64 V69 | W63-L67 WeakPolarHBondContact O-CG 3.35Å; Q64-L67 PolarHBondContact O-N 3.02Å; L67-V69 PolarHBondContact O-N 2.84Å |
| 68 | E | 46.4 | Very low | 53.4 | Low | 150 Ų | 150 | 117.2 Ų | 117.2 | 70% | 0.701 | 61% | 0.607 | S | S | * | * | S | Bend | trans | -73.8 | 68.6 | 167.5 | -71.4 | -170.9 | 178.7 | 0 | 0 | 110.6 | Q64 N70 | Q64-E68 PolarHBondContact O-N 2.92Å; E68-N70 VanDerWaalsContact C-N 3.32Å; E68-N70 PolarHBondContact O-N 3.02Å |
| 69 | V | 47.6 | Very low | 55.6 | Low | 101 Ų | 101 | 113.4 Ų | 113.4 | 61% | 0.612 | 60% | 0.596 | S | S | * | * | trans | -59.1 | 97.3 | 167.4 | 179.7 | 0 | 0 | 0 | 0 | 108.2 | L67 D71 | L67-V69 PolarHBondContact O-N 2.84Å; V69-D71 PolarHBondContact O-N 2.8Å; V69-D71 VanDerWaalsContact O-N 3.16Å | ||
| 70 | N | 42.5 | Very low | 57.9 | Low | 112 Ų | 112 | 107.8 Ų | 107.8 | 60% | 0.599 | 57% | 0.57 | S | S | * | * | trans | -10.5 | 106.3 | 165.4 | 172.6 | 35.5 | 0 | 0 | 0 | 113.2 | E68 K72 A73 | E68-N70 VanDerWaalsContact C-N 3.32Å; E68-N70 PolarHBondContact O-N 3.02Å; N70-K72 PolarHBondContact O-N 2.87Å; N70-K72 PolarHBondContact OD1-N 2.68Å; N70-A73 PolarHBondContact O-N 3.44Å | ||
| 71 | D | 48.8 | Very low | 60.4 | Low | 157 Ų | 157 | 104.6 Ų | 104.6 | 84% | 0.84 | 56% | 0.563 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.4 | 21 | 178.9 | -97.6 | -39.2 | 0 | 0 | 0 | 114.3 | V69 | V69-D71 PolarHBondContact O-N 2.8Å; V69-D71 VanDerWaalsContact O-N 3.16Å |
| 72 | K | 44.1 | Very low | 62.8 | Low | 181 Ų | 181 | 100 Ų | 100 | 79% | 0.787 | 54% | 0.539 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -126.2 | 23.5 | 169.5 | -63.9 | -167.2 | 175.6 | -176.1 | 0 | 113.1 | N70 | N70-K72 PolarHBondContact O-N 2.87Å; N70-K72 PolarHBondContact OD1-N 2.68Å |
| 73 | A | 48.8 | Very low | 65.1 | Low | 49 Ų | 49 | 104.3 Ų | 104.3 | 41% | 0.405 | 55% | 0.545 | S | S | . | . | S | Bend | trans | -59.8 | 135.9 | 155 | 0 | 0 | 0 | 0 | 0 | 109 | N70 A75 | N70-A73 PolarHBondContact O-N 3.44Å; A73-A75 PolarHBondContact O-N 3.34Å |
| 74 | P | 54.2 | Low | 67.3 | Low | 116 Ų | 116 | 95.9 Ų | 95.9 | 75% | 0.753 | 51% | 0.513 | S | S | * | . | trans | -57.5 | 139.2 | 167 | 27.4 | -33.7 | 0 | 0 | 0 | 108 | Q76 | P74-Q76 WeakPolarHBondContact O-CA 3.41Å; P74-Q76 PolarHBondContact O-N 3.44Å | ||
| 75 | A | 63.8 | Low | 69.6 | Low | 79 Ų | 79 | 94.3 Ų | 94.3 | 65% | 0.653 | 51% | 0.511 | S | S | * | . | trans | -42.9 | 102.1 | -172.8 | 0 | 0 | 0 | 0 | 0 | 111 | A73 A77 P119 | A73-A75 PolarHBondContact O-N 3.34Å; A75-A77 PolarHBondContact O-N 2.89Å; A75-P119 HydrophobicContact CB-CB 3.97Å | ||
| 76 | Q | 77.4 | Confident | 71.9 | Confident | 124 Ų | 124 | 89 Ų | 89 | 58% | 0.579 | 49% | 0.493 | S | S | * | . | trans | -67.6 | 116.1 | -162 | -173.2 | 173.7 | 2.7 | 0 | 0 | 107.8 | P74 R78 | P74-Q76 WeakPolarHBondContact O-CA 3.41Å; P74-Q76 PolarHBondContact O-N 3.44Å; Q76-R78 WeakPolarHBondContact O-CG 3.46Å | ||
| 77 | A | 86.2 | Confident | 74.2 | Confident | 50 Ų | 50 | 85.7 Ų | 85.7 | 41% | 0.413 | 49% | 0.491 | S | S | . | . | trans | -70 | 133.6 | 178.2 | 0 | 0 | 0 | 0 | 0 | 108.9 | A75 D117 L118 | A75-A77 PolarHBondContact O-N 2.89Å; A77-D117 HydrophobicContact CB-CB 3.72Å; A77-L118 WeakPolarHBondContact CA-O 3.23Å | ||
| 78 | R | 88.9 | Confident | 76.2 | Confident | 41 Ų | 41 | 79.9 Ų | 79.9 | 16% | 0.155 | 47% | 0.465 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.9 | 143.1 | -170.7 | -44.4 | -172.1 | 180 | -150.6 | 2.6 | 111.5 | Q76 T80 D117 L118 E120 K157 F160 | Q76-R78 WeakPolarHBondContact O-CG 3.46Å; R78-T80 PolarHBondContact O-N 3.34Å; R78-T80 PolarHBondContact O-OG1 3.04Å; R78-D117 WeakPolarHBondContact O-CA 3.44Å; R78-L118 PolarHBondContact N-O 3.06Å; R78-L118 PolarHBondContact O-N 2.8Å; R78-E120 IonicContact CZ-OE1 3.36Å; R78-E120 IonicContact NE-OE1 3.34Å; R78-E120 PolarHBondContact NE-OE1 3.44Å; R78-E120 IonicContact NH2-OE1 2.71Å; R78-E120 PolarHBondContact NH2-OE1 2.87Å; R78-K157 PolarHBondContact NH1-O 2.71Å; R78-F160 HydrophobicContact CB-CD1 3.75Å; R78-F160 HydrophobicContact CB-CD2 4.22Å; R78-F160 HydrophobicContact CB-CE1 3.3Å; R78-F160 HydrophobicContact CB-CE2 3.82Å; R78-F160 HydrophobicContact CB-CG 4.2Å; R78-F160 HydrophobicContact CB-CZ 3.34Å; R78-F160 HydrophobicContact CG-CD2 4.37Å; R78-F160 HydrophobicContact CG-CE1 4.39Å; R78-F160 HydrophobicContact CG-CE2 4.22Å; R78-F160 HydrophobicContact CG-CZ 4.23Å |
| 79 | P | 95.8 | Very high | 78.3 | Confident | 76 Ų | 76 | 80.6 Ų | 80.6 | 49% | 0.494 | 47% | 0.465 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -67.9 | 108 | -167.9 | 25.2 | -35.2 | 0 | 0 | 0 | 112.2 | I115 D117 F160 | P79-I115 HydrophobicContact CB-CG2 3.85Å; P79-D117 VanDerWaalsContact CA-OD1 3.22Å; P79-D117 WeakPolarHBondContact CA-OD1 3.47Å; P79-D117 WeakPolarHBondContact CB-OD1 3.15Å; P79-F160 HydrophobicContact CG-CE1 4.38Å |
| 80 | T | 96.8 | Very high | 80.6 | Confident | 11 Ų | 11 | 81.5 Ų | 81.5 | 7% | 0.067 | 46% | 0.463 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107 | 127.8 | -178.7 | -55.6 | 0 | 0 | 0 | 0 | 109.9 | R78 F82 I115 L116 L118 I153 V155 | R78-T80 PolarHBondContact O-N 3.34Å; R78-T80 PolarHBondContact O-OG1 3.04Å; T80-F82 HydrophobicContact CG2-CE2 3.89Å; T80-F82 HydrophobicContact CG2-CZ 4.12Å; T80-I115 WeakPolarHBondContact O-CA 3.39Å; T80-L116 WeakPolarHBondContact CB-O 3.26Å; T80-L116 PolarHBondContact N-O 2.94Å; T80-L116 PolarHBondContact O-N 3.24Å; T80-L118 HydrophobicContact CG2-CD1 4.19Å; T80-I153 HydrophobicContact CG2-CD1 3.66Å; T80-V155 HydrophobicContact CG2-CG2 4.21Å |
| 81 | V | 96.9 | Very high | 83.2 | Confident | 86 Ų | 86 | 76.4 Ų | 76.4 | 52% | 0.521 | 44% | 0.436 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.4 | 120.8 | -176.4 | -175.8 | 0 | 0 | 0 | 0 | 110.6 | V113 I115 | V81-V113 HydrophobicContact CG1-CG1 4.08Å; V81-I115 HydrophobicContact CG2-CD1 4.47Å; V81-I115 HydrophobicContact CG2-CG1 4.25Å |
| 82 | F | 97.6 | Very high | 85.6 | Confident | 2 Ų | 2 | 71.9 Ų | 71.9 | 1% | 0.009 | 41% | 0.408 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.2 | 121.2 | 168.4 | -67.5 | -87.5 | 0 | 0 | 0 | 109.3 | T80 L93 F97 V113 A114 L116 L118 Y125 I153 | T80-F82 HydrophobicContact CG2-CE2 3.89Å; T80-F82 HydrophobicContact CG2-CZ 4.12Å; F82-L93 HydrophobicContact CB-CD2 3.62Å; F82-L93 HydrophobicContact CD1-CD1 4.01Å; F82-L93 HydrophobicContact CD1-CD2 3.93Å; F82-L93 HydrophobicContact CD2-CD2 3.79Å; F82-L93 HydrophobicContact CE2-CD2 4.47Å; F82-L93 HydrophobicContact CG-CD1 4.36Å; F82-L93 HydrophobicContact CG-CD2 3.48Å; F82-L93 VanDerWaalsContact CG-CD2 3.48Å; F82-F97 HydrophobicContact CE1-CE1 4.19Å; F82-F97 HydrophobicContact CE1-CZ 4.37Å; F82-F97 HydrophobicContact CE2-CE1 4.27Å; F82-F97 HydrophobicContact CE2-CZ 4.23Å; F82-F97 AromaticContact CZ-CE1 3.68Å; F82-F97 HydrophobicContact CZ-CE1 3.68Å; F82-F97 AromaticContact CZ-CZ 3.97Å; F82-F97 HydrophobicContact CZ-CZ 3.97Å; F82-V113 VanDerWaalsContact O-CA 3.32Å; F82-V113 WeakPolarHBondContact O-CA 3.49Å; F82-A114 PolarHBondContact N-O 3.19Å; F82-A114 PolarHBondContact O-N 2.68Å; F82-L116 HydrophobicContact CD2-CB 4.49Å; F82-L116 HydrophobicContact CD2-CD1 4.14Å; F82-L116 HydrophobicContact CD2-CG 4.48Å; F82-L116 HydrophobicContact CE2-CB 4.33Å; F82-L116 HydrophobicContact CE2-CD1 4.18Å; F82-L118 HydrophobicContact CE2-CD1 3.72Å; F82-L118 HydrophobicContact CE2-CG 4.49Å; F82-L118 HydrophobicContact CZ-CD1 3.64Å; F82-Y125 HydrophobicContact CD1-CD1 4.39Å; F82-Y125 AromaticContact CD1-CD2 3.81Å; F82-Y125 HydrophobicContact CD1-CD2 3.81Å; F82-Y125 HydrophobicContact CD1-CE1 4.43Å; F82-Y125 AromaticContact CD1-CE2 3.85Å; F82-Y125 HydrophobicContact CD1-CE2 3.85Å; F82-Y125 HydrophobicContact CD1-CG 4.08Å; F82-Y125 AromaticContact CE1-CD1 3.69Å; F82-Y125 HydrophobicContact CE1-CD1 3.69Å; F82-Y125 AromaticContact CE1-CD2 3.89Å; F82-Y125 HydrophobicContact CE1-CD2 3.89Å; F82-Y125 AromaticContact CE1-CE1 3.92Å; F82-Y125 HydrophobicContact CE1-CE1 3.92Å; F82-Y125 HydrophobicContact CE1-CE2 4.11Å; F82-Y125 AromaticContact CE1-CG 3.66Å; F82-Y125 HydrophobicContact CE1-CG 3.66Å; F82-I153 HydrophobicContact CE1-CG2 4.08Å; F82-I153 HydrophobicContact CZ-CG2 4.07Å |
| 83 | R | 96.9 | Very high | 88.1 | Confident | 139 Ų | 139 | 63.2 Ų | 63.2 | 53% | 0.525 | 37% | 0.37 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.1 | 128.4 | -179 | 178.8 | 177.8 | 64.5 | 176.8 | -0.6 | 110.3 | T85 N111 F112 V113 | R83-T85 HydrophobicContact CG-CG2 4.05Å; R83-N111 HydrophobicContact CG-CB 4.24Å; R83-F112 CarbonylContact C-O 3.57Å; R83-F112 WeakPolarHBondContact CA-O 3.42Å; R83-V113 HydrophobicContact CB-CG2 4.42Å; R83-V113 HydrophobicContact CG-CG2 4.18Å |
| 84 | W | 97.2 | Very high | 90.5 | Very high | 23 Ų | 23 | 60.9 Ų | 60.9 | 9% | 0.087 | 35% | 0.351 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.9 | 121.2 | 165.2 | 178.4 | -106.7 | 0 | 0 | 0 | 108.9 | G86 G87 V91 L105 N111 F112 F127 V129 T134 H135 D136 | W84-G86 PolarHBondContact NE1-O 2.86Å; W84-G87 PolarHBondContact NE1-O 3.03Å; W84-V91 HydrophobicContact CB-CG1 4.24Å; W84-V91 HydrophobicContact CG-CG1 4.14Å; W84-L105 HydrophobicContact CB-CD1 4.32Å; W84-N111 WeakPolarHBondContact O-CA 3.28Å; W84-F112 HydrophobicContact CB-CB 4.26Å; W84-F112 PolarHBondContact N-O 3.33Å; W84-F112 PolarHBondContact O-N 2.87Å; W84-F127 HydrophobicContact CB-CD1 4.13Å; W84-F127 HydrophobicContact CB-CE1 3.92Å; W84-F127 HydrophobicContact CB-CZ 4.25Å; W84-F127 HydrophobicContact CD2-CD2 4.43Å; W84-F127 HydrophobicContact CD2-CG 4.33Å; W84-F127 HydrophobicContact CE3-CB 4.23Å; W84-F127 HydrophobicContact CE3-CD1 4.35Å; W84-F127 AromaticContact CE3-CD2 3.46Å; W84-F127 HydrophobicContact CE3-CD2 3.46Å; W84-F127 VanDerWaalsContact CE3-CD2 3.46Å; W84-F127 AromaticContact CE3-CE2 3.79Å; W84-F127 HydrophobicContact CE3-CE2 3.79Å; W84-F127 AromaticContact CE3-CG 3.76Å; W84-F127 HydrophobicContact CE3-CG 3.76Å; W84-F127 HydrophobicContact CE3-CZ 4.36Å; W84-F127 HydrophobicContact CZ3-CB 4.49Å; W84-F127 AromaticContact CZ3-CD2 3.85Å; W84-F127 HydrophobicContact CZ3-CD2 3.85Å; W84-F127 HydrophobicContact CZ3-CE2 4.4Å; W84-F127 HydrophobicContact CZ3-CG 4.33Å; W84-V129 HydrophobicContact CD2-CG2 4.31Å; W84-V129 HydrophobicContact CZ2-CG2 3.89Å; W84-T134 HydrophobicContact CH2-CG2 3.45Å; W84-T134 VanDerWaalsContact CH2-CG2 3.45Å; W84-T134 HydrophobicContact CZ2-CG2 3.86Å; W84-T134 HydrophobicContact CZ3-CG2 3.97Å; W84-H135 WeakPolarHBondContact CZ3-O 3.37Å; W84-D136 HydrophobicContact CE3-CB 4.37Å; W84-D136 HydrophobicContact CZ3-CB 4.15Å |
| 85 | T | 95.4 | Very high | 92.5 | Very high | 71 Ų | 71 | 55.4 Ų | 55.4 | 44% | 0.436 | 32% | 0.315 | S | S | . | . | trans | -97.4 | -9 | -179.7 | 61.7 | 0 | 0 | 0 | 0 | 113.1 | R83 | R83-T85 HydrophobicContact CG-CG2 4.05Š| ||
| 86 | G | 91.6 | Very high | 94 | Very high | 27 Ų | 27 | 54 Ų | 54 | 28% | 0.278 | 30% | 0.301 | S | S | . | . | S | Bend | trans | -75.4 | 171.8 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | W84 | W84-G86 PolarHBondContact NE1-O 2.86Š|
| 87 | G | 90.9 | Very high | 94.9 | Very high | 63 Ų | 63 | 50.6 Ų | 50.6 | 65% | 0.649 | 28% | 0.284 | S | S | * | . | trans | -66 | 167.6 | 171.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | W84 V129 | W84-G87 PolarHBondContact NE1-O 3.03Å; G87-V129 WeakPolarHBondContact O-CG1 3.5Å | ||
| 88 | G | 91.6 | Very high | 95.3 | Very high | 19 Ų | 19 | 49.5 Ų | 49.5 | 20% | 0.196 | 27% | 0.271 | C | S | . | . | trans | 162.3 | 163.7 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | R107 F112 D130 | G88-R107 PolarHBondContact O-NH1 3.1Å; G88-F112 WeakPolarHBondContact O-CZ 3.19Å; G88-D130 WeakPolarHBondContact CA-OD2 3.32Å | ||
| 89 | K | 92.2 | Very high | 95.6 | Very high | 165 Ų | 165 | 54.8 Ų | 54.8 | 72% | 0.717 | 30% | 0.302 | S | S | * | . | S | Bend | trans | -100 | -52 | 162.1 | -63.4 | 178.8 | -177.5 | 175.2 | 0 | 110 | D130 | K89-D130 WeakPolarHBondContact CA-OD1 3.36Å; K89-D130 WeakPolarHBondContact CB-OD1 3.49Å; K89-D130 VanDerWaalsContact N-CG 3.33Å; K89-D130 PolarHBondContact N-OD1 2.75Å; K89-D130 PolarHBondContact N-OD2 3.29Å; K89-D130 VanDerWaalsContact N-OD2 3.08Å |
| 90 | E | 94.8 | Very high | 95.6 | Very high | 121 Ų | 121 | 56.2 Ų | 56.2 | 57% | 0.565 | 30% | 0.298 | S | S | * | . | S | Bend | trans | -121.4 | 120.8 | -179.6 | -61.5 | -175.7 | 134.6 | 0 | 0 | 109.3 | Y92 D130 | E90-Y92 HydrophobicContact CB-CE2 3.95Å; E90-D130 PolarHBondContact N-OD1 3.23Å; E90-D130 PolarHBondContact O-N 2.9Å |
| 91 | V | 97.8 | Very high | 95.6 | Very high | 4 Ų | 4 | 58.8 Ų | 58.8 | 2% | 0.024 | 32% | 0.317 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.4 | 128.3 | 179.8 | -174.6 | 0 | 0 | 0 | 0 | 109.1 | W84 L105 F112 F127 F128 V129 | W84-V91 HydrophobicContact CB-CG1 4.24Å; W84-V91 HydrophobicContact CG-CG1 4.14Å; V91-L105 HydrophobicContact CB-CD1 4.34Å; V91-L105 HydrophobicContact CG1-CD1 3.62Å; V91-L105 HydrophobicContact CG1-CG 4.26Å; V91-L105 PolarHBondContact O-N 2.59Å; V91-F112 HydrophobicContact CB-CB 4.17Å; V91-F112 HydrophobicContact CB-CD1 3.77Å; V91-F112 HydrophobicContact CB-CD2 4.42Å; V91-F112 HydrophobicContact CB-CE1 4.18Å; V91-F112 HydrophobicContact CB-CG 3.89Å; V91-F112 HydrophobicContact CG1-CB 4.44Å; V91-F112 HydrophobicContact CG2-CB 4.38Å; V91-F112 HydrophobicContact CG2-CD1 3.7Å; V91-F112 HydrophobicContact CG2-CD2 3.73Å; V91-F112 HydrophobicContact CG2-CE1 3.73Å; V91-F112 HydrophobicContact CG2-CE2 3.78Å; V91-F112 HydrophobicContact CG2-CG 3.69Å; V91-F112 HydrophobicContact CG2-CZ 3.77Å; V91-F127 HydrophobicContact CG1-CD1 4.18Å; V91-F128 WeakPolarHBondContact CA-O 3.08Å; V91-V129 HydrophobicContact CG1-CG2 3.93Å; V91-V129 HydrophobicContact CG2-CG1 4.27Å; V91-V129 HydrophobicContact CG2-CG2 4.13Å |
| 92 | Y | 98.2 | Very high | 95.6 | Very high | 62 Ų | 62 | 59.5 Ų | 59.5 | 24% | 0.243 | 31% | 0.313 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121 | 153 | 175.1 | -53 | -102.9 | 0 | 0 | 0 | 110.5 | E90 K102 L103 P104 F127 F128 | E90-Y92 HydrophobicContact CB-CE2 3.95Å; Y92-K102 HydrophobicContact CD1-CB 3.92Å; Y92-K102 HydrophobicContact CG-CB 4.16Å; Y92-L103 CarbonylContact C-O 3.45Å; Y92-L103 WeakPolarHBondContact CA-O 3.49Å; Y92-L103 WeakPolarHBondContact CB-O 3.41Å; Y92-P104 HydrophobicContact CD1-CB 3.92Å; Y92-P104 HydrophobicContact CE1-CB 3.9Å; Y92-F127 CarbonylContact O-C 3.46Å; Y92-F127 WeakPolarHBondContact O-CA 3.42Å; Y92-F128 AromaticContact CD2-CD1 3.94Å; Y92-F128 HydrophobicContact CD2-CD1 3.94Å; Y92-F128 PolarHBondContact N-O 2.86Å; Y92-F128 PolarHBondContact O-N 2.95Å |
| 93 | L | 98.3 | Very high | 95.6 | Very high | 0 Ų | 0 | 62.1 Ų | 62.1 | 0% | 0 | 33% | 0.326 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.4 | 136.9 | 174.2 | 176.7 | 68.2 | 0 | 0 | 0 | 109.7 | F82 F97 N98 L103 L105 L116 Y125 F127 | F82-L93 HydrophobicContact CB-CD2 3.62Å; F82-L93 HydrophobicContact CD1-CD1 4.01Å; F82-L93 HydrophobicContact CD1-CD2 3.93Å; F82-L93 HydrophobicContact CD2-CD2 3.79Å; F82-L93 HydrophobicContact CE2-CD2 4.47Å; F82-L93 HydrophobicContact CG-CD1 4.36Å; F82-L93 HydrophobicContact CG-CD2 3.48Å; F82-L93 VanDerWaalsContact CG-CD2 3.48Å; L93-F97 HydrophobicContact CD2-CE2 4.34Å; L93-F97 HydrophobicContact CD2-CZ 3.98Å; L93-F97 HydrophobicContact CG-CZ 4.11Å; L93-N98 PolarHBondContact O-ND2 3.38Å; L93-L103 PolarHBondContact N-O 3.44Å; L93-L103 WeakPolarHBondContact O-CB 3.36Å; L93-L103 PolarHBondContact O-N 2.88Å; L93-L105 HydrophobicContact CB-CD2 3.77Å; L93-L105 HydrophobicContact CB-CG 4.34Å; L93-L105 HydrophobicContact CD2-CD2 4.34Å; L93-L116 HydrophobicContact CD2-CD1 3.93Å; L93-Y125 HydrophobicContact CD1-CD2 3.67Å; L93-Y125 HydrophobicContact CD1-CG 4.25Å; L93-F127 HydrophobicContact CD1-CD1 4.25Å; L93-F127 HydrophobicContact CD1-CE1 3.99Å; L93-F127 HydrophobicContact CD1-CZ 4.47Å |
| 94 | S | 98 | Very high | 95.6 | Very high | 0 Ų | 0 | 59.5 Ų | 59.5 | 0% | 0 | 33% | 0.327 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -137.5 | 141.7 | 173.8 | -63.2 | 0 | 0 | 0 | 0 | 109.6 | S101 Y125 K126 | S94-S101 WeakPolarHBondContact CA-O 3.4Å; S94-S101 VanDerWaalsContact CB-O 3.3Å; S94-S101 WeakPolarHBondContact CB-O 3.36Å; S94-S101 VanDerWaalsContact OG-C 3.31Å; S94-S101 PolarHBondContact OG-O 3.22Å; S94-Y125 CarbonylContact O-C 3.53Å; S94-Y125 VanDerWaalsContact O-CA 3.24Å; S94-Y125 WeakPolarHBondContact O-CA 3.32Å; S94-K126 PolarHBondContact N-O 3.46Å; S94-K126 PolarHBondContact O-N 2.98Å |
| 95 | G | 96.8 | Very high | 95.7 | Very high | 0 Ų | 0 | 59.1 Ų | 59.1 | 0% | 0 | 33% | 0.327 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -167.1 | -176.4 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | F97 N98 N99 W100 Q124 | G95-F97 PolarHBondContact O-N 3.12Å; G95-N98 PolarHBondContact N-OD1 3.34Å; G95-N98 PolarHBondContact O-N 2.83Å; G95-N98 PolarHBondContact O-OD1 2.79Å; G95-N99 PolarHBondContact O-N 2.85Å; G95-W100 PolarHBondContact O-N 2.93Å; G95-Q124 CarbonylContact C-O 3.6Å; G95-Q124 WeakPolarHBondContact CA-O 3.03Å |
| 96 | S | 95.8 | Very high | 95.7 | Very high | 51 Ų | 51 | 61.1 Ų | 61.1 | 36% | 0.357 | 34% | 0.339 | S | S | . | . | G | 310 helix | trans | -54.5 | -40.7 | 178.7 | 48.4 | 0 | 0 | 0 | 0 | 112.6 | N98 H123 Q124 | S96-N98 VanDerWaalsContact C-N 3.3Å; S96-N98 PolarHBondContact O-N 2.92Å; S96-H123 WeakPolarHBondContact OG-CA 3.24Å; S96-Q124 PolarHBondContact N-O 3.05Å; S96-Q124 PolarHBondContact OG-N 2.84Å |
| 97 | F | 95 | Very high | 95.9 | Very high | 52 Ų | 52 | 66.9 Ų | 66.9 | 23% | 0.228 | 35% | 0.353 | C | S | . | . | G | 310 helix | trans | -69.3 | -17.2 | -177.9 | 51 | -99.4 | 0 | 0 | 0 | 115.4 | F82 L93 G95 L116 L118 H123 | F82-F97 HydrophobicContact CE1-CE1 4.19Å; F82-F97 HydrophobicContact CE1-CZ 4.37Å; F82-F97 HydrophobicContact CE2-CE1 4.27Å; F82-F97 HydrophobicContact CE2-CZ 4.23Å; F82-F97 AromaticContact CZ-CE1 3.68Å; F82-F97 HydrophobicContact CZ-CE1 3.68Å; F82-F97 AromaticContact CZ-CZ 3.97Å; F82-F97 HydrophobicContact CZ-CZ 3.97Å; L93-F97 HydrophobicContact CD2-CE2 4.34Å; L93-F97 HydrophobicContact CD2-CZ 3.98Å; L93-F97 HydrophobicContact CG-CZ 4.11Å; G95-F97 PolarHBondContact O-N 3.12Å; F97-L116 HydrophobicContact CD2-CD1 3.95Å; F97-L116 HydrophobicContact CE2-CD1 3.41Å; F97-L116 VanDerWaalsContact CE2-CD1 3.41Å; F97-L116 HydrophobicContact CZ-CD1 4.02Å; F97-L118 HydrophobicContact CB-CD2 3.42Å; F97-L118 VanDerWaalsContact CB-CD2 3.42Å; F97-L118 HydrophobicContact CD1-CD1 3.83Å; F97-L118 HydrophobicContact CD1-CD2 3.88Å; F97-L118 HydrophobicContact CD2-CD2 4.07Å; F97-L118 HydrophobicContact CE1-CD1 4.21Å; F97-L118 HydrophobicContact CG-CD1 4.33Å; F97-L118 HydrophobicContact CG-CD2 3.52Å; F97-H123 HydrophobicContact CD1-CB 4.11Å |
| 98 | N | 94.4 | Very high | 95.8 | Very high | 26 Ų | 26 | 67.3 Ų | 67.3 | 14% | 0.139 | 35% | 0.346 | C | S | . | . | G | 310 helix | trans | -123.6 | 23.9 | -179.9 | 77.3 | -5.2 | 0 | 0 | 0 | 113.4 | L93 G95 S96 W100 S101 | L93-N98 PolarHBondContact O-ND2 3.38Å; G95-N98 PolarHBondContact N-OD1 3.34Å; G95-N98 PolarHBondContact O-N 2.83Å; G95-N98 PolarHBondContact O-OD1 2.79Å; S96-N98 VanDerWaalsContact C-N 3.3Å; S96-N98 PolarHBondContact O-N 2.92Å; N98-W100 PolarHBondContact O-N 2.9Å; N98-W100 PolarHBondContact OD1-N 2.98Å; N98-S101 PolarHBondContact ND2-O 2.99Å; N98-S101 WeakPolarHBondContact O-CB 3.42Å; N98-S101 PolarHBondContact O-N 2.86Å; N98-S101 PolarHBondContact O-OG 3.44Å; N98-S101 PolarHBondContact OD1-N 3.3Å; N98-S101 PolarHBondContact OD1-O 2.91Å |
| 99 | N | 95.8 | Very high | 95.5 | Very high | 152 Ų | 152 | 74.6 Ų | 74.6 | 81% | 0.813 | 38% | 0.375 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.8 | 35.4 | -176.2 | -61.5 | -49.5 | 0 | 0 | 0 | 113 | G95 S101 | G95-N99 PolarHBondContact O-N 2.85Å; N99-S101 PolarHBondContact O-N 2.95Å |
| 100 | W | 95.7 | Very high | 95.3 | Very high | 106 Ų | 106 | 72.9 Ų | 72.9 | 40% | 0.402 | 37% | 0.373 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 58 | 23.3 | -176.2 | -60.2 | 92.2 | 0 | 0 | 0 | 115.1 | G95 N98 Q124 K126 N150 | G95-W100 PolarHBondContact O-N 2.93Å; N98-W100 PolarHBondContact O-N 2.9Å; N98-W100 PolarHBondContact OD1-N 2.98Å; W100-Q124 HydrophobicContact CH2-CB 4.1Å; W100-Q124 HydrophobicContact CZ2-CB 4.11Å; W100-K126 HydrophobicContact CZ3-CB 4.09Å; W100-N150 HydrophobicContact CH2-CB 4.36Å; W100-N150 VanDerWaalsContact CH2-ND2 3.31Å; W100-N150 WeakPolarHBondContact CH2-ND2 3.46Å |
| 101 | S | 97.2 | Very high | 95.3 | Very high | 66 Ų | 66 | 69.4 Ų | 69.4 | 46% | 0.462 | 36% | 0.359 | S | S | . | . | trans | -73 | 157.2 | 171 | 64.3 | 0 | 0 | 0 | 0 | 111.9 | S94 N98 N99 L103 | S94-S101 WeakPolarHBondContact CA-O 3.4Å; S94-S101 VanDerWaalsContact CB-O 3.3Å; S94-S101 WeakPolarHBondContact CB-O 3.36Å; S94-S101 VanDerWaalsContact OG-C 3.31Å; S94-S101 PolarHBondContact OG-O 3.22Å; N98-S101 PolarHBondContact ND2-O 2.99Å; N98-S101 WeakPolarHBondContact O-CB 3.42Å; N98-S101 PolarHBondContact O-N 2.86Å; N98-S101 PolarHBondContact O-OG 3.44Å; N98-S101 PolarHBondContact OD1-N 3.3Å; N98-S101 PolarHBondContact OD1-O 2.91Å; N99-S101 PolarHBondContact O-N 2.95Å; S101-L103 PolarHBondContact O-N 3.29Å | ||
| 102 | K | 97.1 | Very high | 95.2 | Very high | 100 Ų | 100 | 69.6 Ų | 69.6 | 44% | 0.435 | 36% | 0.359 | S | S | . | . | trans | -87.1 | 105.8 | -179.3 | -67.2 | -172.6 | -177.3 | -175.5 | 0 | 111 | Y92 F128 | Y92-K102 HydrophobicContact CD1-CB 3.92Å; Y92-K102 HydrophobicContact CG-CB 4.16Å; K102-F128 HydrophobicContact CD-CD1 4.2Å; K102-F128 HydrophobicContact CD-CG 4.46Å | ||
| 103 | L | 97.6 | Very high | 95.2 | Very high | 57 Ų | 57 | 68.6 Ų | 68.6 | 30% | 0.298 | 36% | 0.359 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.4 | 119.5 | 171.3 | -178.7 | 77.2 | 0 | 0 | 0 | 109.7 | Y92 L93 S101 A114 L116 | Y92-L103 CarbonylContact C-O 3.45Å; Y92-L103 WeakPolarHBondContact CA-O 3.49Å; Y92-L103 WeakPolarHBondContact CB-O 3.41Å; L93-L103 PolarHBondContact N-O 3.44Å; L93-L103 WeakPolarHBondContact O-CB 3.36Å; L93-L103 PolarHBondContact O-N 2.88Å; S101-L103 PolarHBondContact O-N 3.29Å; L103-A114 HydrophobicContact CD2-CB 4.25Å; L103-L116 HydrophobicContact CD2-CD1 3.81Å; L103-L116 HydrophobicContact CD2-CD2 3.79Å; L103-L116 HydrophobicContact CD2-CG 4.2Å |
| 104 | P | 97.3 | Very high | 95.1 | Very high | 84 Ų | 84 | 69.3 Ų | 69.3 | 55% | 0.545 | 37% | 0.366 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -67.5 | 137.9 | 176.6 | 28 | -33.9 | 0 | 0 | 0 | 111.4 | Y92 | Y92-P104 HydrophobicContact CD1-CB 3.92Å; Y92-P104 HydrophobicContact CE1-CB 3.9Å |
| 105 | L | 97.6 | Very high | 95 | Very high | 16 Ų | 16 | 74.6 Ų | 74.6 | 8% | 0.084 | 39% | 0.393 | C | S | . | . | P | Polyproline II helix | trans | -91.3 | 144.3 | 175.5 | -61.9 | -171 | 0 | 0 | 0 | 112.1 | W84 V91 L93 R107 F112 A114 F127 | W84-L105 HydrophobicContact CB-CD1 4.32Å; V91-L105 HydrophobicContact CB-CD1 4.34Å; V91-L105 HydrophobicContact CG1-CD1 3.62Å; V91-L105 HydrophobicContact CG1-CG 4.26Å; V91-L105 PolarHBondContact O-N 2.59Å; L93-L105 HydrophobicContact CB-CD2 3.77Å; L93-L105 HydrophobicContact CB-CG 4.34Å; L93-L105 HydrophobicContact CD2-CD2 4.34Å; L105-R107 PolarHBondContact O-N 3.03Å; L105-F112 HydrophobicContact CB-CB 3.8Å; L105-F112 HydrophobicContact CD1-CB 3.87Å; L105-A114 HydrophobicContact CD2-CB 3.41Å; L105-A114 VanDerWaalsContact CD2-CB 3.41Å; L105-F127 HydrophobicContact CD1-CD1 4.03Å; L105-F127 HydrophobicContact CD1-CE1 3.83Å |
| 106 | T | 96.6 | Very high | 95 | Very high | 112 Ų | 112 | 76.4 Ų | 76.4 | 69% | 0.687 | 40% | 0.402 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -76.5 | 122.4 | 175.1 | -60.7 | 0 | 0 | 0 | 0 | 110 | F112 V113 | T106-F112 WeakPolarHBondContact O-CA 3.33Å; T106-V113 PolarHBondContact N-O 3.21Å; T106-V113 PolarHBondContact O-N 2.94Å |
| 107 | R | 94.9 | Very high | 95 | Very high | 148 Ų | 148 | 79 Ų | 79 | 56% | 0.558 | 41% | 0.412 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -79.3 | 122.1 | 177.9 | -177.1 | 173 | -179.8 | 143 | 6.6 | 111.6 | G88 L105 F112 | G88-R107 PolarHBondContact O-NH1 3.1Å; L105-R107 PolarHBondContact O-N 3.03Å; R107-F112 HydrophobicContact CB-CD1 3.76Å; R107-F112 HydrophobicContact CB-CE1 3.64Å; R107-F112 HydrophobicContact CB-CZ 4.34Å; R107-F112 HydrophobicContact CG-CD1 4.14Å; R107-F112 HydrophobicContact CG-CE1 3.73Å; R107-F112 HydrophobicContact CG-CE2 4.46Å; R107-F112 HydrophobicContact CG-CZ 3.91Å |
| 108 | S | 88.8 | Confident | 95 | Very high | 73 Ų | 73 | 76.8 Ų | 76.8 | 51% | 0.51 | 40% | 0.403 | S | S | . | . | trans | -96.8 | -170.6 | 162.4 | -172 | 0 | 0 | 0 | 0 | 110 | N110 N111 | S108-N110 PolarHBondContact O-N 2.92Å; S108-N111 WeakPolarHBondContact CA-O 3.43Å; S108-N111 WeakPolarHBondContact CB-O 3.3Å; S108-N111 PolarHBondContact N-O 3.24Å | ||
| 109 | Q | 85.8 | Confident | 95 | Very high | 172 Ų | 172 | 77.8 Ų | 77.8 | 80% | 0.804 | 41% | 0.411 | S | S | * | . | S | Bend | trans | -57 | -53.5 | -177.7 | -67 | 179.3 | -8.4 | 0 | 0 | 112.3 | ||
| 110 | N | 88.4 | Confident | 95 | Very high | 128 Ų | 128 | 74 Ų | 74 | 68% | 0.684 | 39% | 0.388 | S | S | * | . | S | Bend | trans | -120.1 | -4 | -175.9 | -69.4 | 33.3 | 0 | 0 | 0 | 114.1 | S108 | S108-N110 PolarHBondContact O-N 2.92Š|
| 111 | N | 93.8 | Very high | 94.9 | Very high | 48 Ų | 48 | 70 Ų | 70 | 26% | 0.257 | 38% | 0.38 | S | S | . | . | trans | -131.8 | 151.5 | -173.2 | -61.1 | -57.7 | 0 | 0 | 0 | 110.7 | R83 W84 S108 V113 | R83-N111 HydrophobicContact CG-CB 4.24Å; W84-N111 WeakPolarHBondContact O-CA 3.28Å; S108-N111 WeakPolarHBondContact CA-O 3.43Å; S108-N111 WeakPolarHBondContact CB-O 3.3Å; S108-N111 PolarHBondContact N-O 3.24Å; N111-V113 HydrophobicContact CB-CG2 4.18Å | ||
| 112 | F | 97.1 | Very high | 94.9 | Very high | 8 Ų | 8 | 71.8 Ų | 71.8 | 4% | 0.035 | 38% | 0.381 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.5 | 133.3 | 163.4 | -63.6 | -106.9 | 0 | 0 | 0 | 108.7 | R83 W84 G88 V91 L105 T106 R107 | R83-F112 CarbonylContact C-O 3.57Å; R83-F112 WeakPolarHBondContact CA-O 3.42Å; W84-F112 HydrophobicContact CB-CB 4.26Å; W84-F112 PolarHBondContact N-O 3.33Å; W84-F112 PolarHBondContact O-N 2.87Å; G88-F112 WeakPolarHBondContact O-CZ 3.19Å; V91-F112 HydrophobicContact CB-CB 4.17Å; V91-F112 HydrophobicContact CB-CD1 3.77Å; V91-F112 HydrophobicContact CB-CD2 4.42Å; V91-F112 HydrophobicContact CB-CE1 4.18Å; V91-F112 HydrophobicContact CB-CG 3.89Å; V91-F112 HydrophobicContact CG1-CB 4.44Å; V91-F112 HydrophobicContact CG2-CB 4.38Å; V91-F112 HydrophobicContact CG2-CD1 3.7Å; V91-F112 HydrophobicContact CG2-CD2 3.73Å; V91-F112 HydrophobicContact CG2-CE1 3.73Å; V91-F112 HydrophobicContact CG2-CE2 3.78Å; V91-F112 HydrophobicContact CG2-CG 3.69Å; V91-F112 HydrophobicContact CG2-CZ 3.77Å; L105-F112 HydrophobicContact CB-CB 3.8Å; L105-F112 HydrophobicContact CD1-CB 3.87Å; T106-F112 WeakPolarHBondContact O-CA 3.33Å; R107-F112 HydrophobicContact CB-CD1 3.76Å; R107-F112 HydrophobicContact CB-CE1 3.64Å; R107-F112 HydrophobicContact CB-CZ 4.34Å; R107-F112 HydrophobicContact CG-CD1 4.14Å; R107-F112 HydrophobicContact CG-CE1 3.73Å; R107-F112 HydrophobicContact CG-CE2 4.46Å; R107-F112 HydrophobicContact CG-CZ 3.91Å |
| 113 | V | 97.1 | Very high | 94.9 | Very high | 41 Ų | 41 | 67.9 Ų | 67.9 | 25% | 0.248 | 36% | 0.364 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.6 | 142.8 | -170.7 | -175.4 | 0 | 0 | 0 | 0 | 111.7 | V81 F82 R83 T106 N111 | V81-V113 HydrophobicContact CG1-CG1 4.08Å; F82-V113 VanDerWaalsContact O-CA 3.32Å; F82-V113 WeakPolarHBondContact O-CA 3.49Å; R83-V113 HydrophobicContact CB-CG2 4.42Å; R83-V113 HydrophobicContact CG-CG2 4.18Å; T106-V113 PolarHBondContact N-O 3.21Å; T106-V113 PolarHBondContact O-N 2.94Å; N111-V113 HydrophobicContact CB-CG2 4.18Å |
| 114 | A | 96.7 | Very high | 94.8 | Very high | 16 Ų | 16 | 67.5 Ų | 67.5 | 13% | 0.132 | 36% | 0.361 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.7 | 149.9 | 157.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | F82 L103 L105 | F82-A114 PolarHBondContact N-O 3.19Å; F82-A114 PolarHBondContact O-N 2.68Å; L103-A114 HydrophobicContact CD2-CB 4.25Å; L105-A114 HydrophobicContact CD2-CB 3.41Å; L105-A114 VanDerWaalsContact CD2-CB 3.41Å |
| 115 | I | 96.7 | Very high | 94.9 | Very high | 110 Ų | 110 | 64 Ų | 64 | 56% | 0.564 | 34% | 0.337 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -115.9 | 126 | 169.7 | -54.2 | -178.4 | 0 | 0 | 0 | 105.9 | P79 T80 V81 | P79-I115 HydrophobicContact CB-CG2 3.85Å; T80-I115 WeakPolarHBondContact O-CA 3.39Å; V81-I115 HydrophobicContact CG2-CD1 4.47Å; V81-I115 HydrophobicContact CG2-CG1 4.25Å |
| 116 | L | 96.2 | Very high | 94.9 | Very high | 39 Ų | 39 | 64.5 Ų | 64.5 | 20% | 0.204 | 34% | 0.338 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.6 | 130.7 | -176 | -67 | 176.8 | 0 | 0 | 0 | 109.7 | T80 F82 L93 F97 L103 L118 | T80-L116 WeakPolarHBondContact CB-O 3.26Å; T80-L116 PolarHBondContact N-O 2.94Å; T80-L116 PolarHBondContact O-N 3.24Å; F82-L116 HydrophobicContact CD2-CB 4.49Å; F82-L116 HydrophobicContact CD2-CD1 4.14Å; F82-L116 HydrophobicContact CD2-CG 4.48Å; F82-L116 HydrophobicContact CE2-CB 4.33Å; F82-L116 HydrophobicContact CE2-CD1 4.18Å; L93-L116 HydrophobicContact CD2-CD1 3.93Å; F97-L116 HydrophobicContact CD2-CD1 3.95Å; F97-L116 HydrophobicContact CE2-CD1 3.41Å; F97-L116 VanDerWaalsContact CE2-CD1 3.41Å; F97-L116 HydrophobicContact CZ-CD1 4.02Å; L103-L116 HydrophobicContact CD2-CD1 3.81Å; L103-L116 HydrophobicContact CD2-CD2 3.79Å; L103-L116 HydrophobicContact CD2-CG 4.2Å; L116-L118 HydrophobicContact CB-CD2 4.27Å; L116-L118 HydrophobicContact CB-CG 4.41Å; L116-L118 PolarHBondContact O-N 3.14Å |
| 117 | D | 95.8 | Very high | 94.9 | Very high | 106 Ų | 106 | 59.2 Ų | 59.2 | 57% | 0.567 | 31% | 0.306 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -74.2 | 111.7 | 172.9 | -62.4 | -42.2 | 0 | 0 | 0 | 109.2 | A77 R78 P79 | A77-D117 HydrophobicContact CB-CB 3.72Å; R78-D117 WeakPolarHBondContact O-CA 3.44Å; P79-D117 VanDerWaalsContact CA-OD1 3.22Å; P79-D117 WeakPolarHBondContact CA-OD1 3.47Å; P79-D117 WeakPolarHBondContact CB-OD1 3.15Å |
| 118 | L | 95.3 | Very high | 95.1 | Very high | 5 Ų | 5 | 53.6 Ų | 53.6 | 3% | 0.026 | 29% | 0.286 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.3 | 139.3 | -179.8 | -62.3 | -170.1 | 0 | 0 | 0 | 110.8 | A77 R78 T80 F82 F97 L116 H123 V155 | A77-L118 WeakPolarHBondContact CA-O 3.23Å; R78-L118 PolarHBondContact N-O 3.06Å; R78-L118 PolarHBondContact O-N 2.8Å; T80-L118 HydrophobicContact CG2-CD1 4.19Å; F82-L118 HydrophobicContact CE2-CD1 3.72Å; F82-L118 HydrophobicContact CE2-CG 4.49Å; F82-L118 HydrophobicContact CZ-CD1 3.64Å; F97-L118 HydrophobicContact CB-CD2 3.42Å; F97-L118 VanDerWaalsContact CB-CD2 3.42Å; F97-L118 HydrophobicContact CD1-CD1 3.83Å; F97-L118 HydrophobicContact CD1-CD2 3.88Å; F97-L118 HydrophobicContact CD2-CD2 4.07Å; F97-L118 HydrophobicContact CE1-CD1 4.21Å; F97-L118 HydrophobicContact CG-CD1 4.33Å; F97-L118 HydrophobicContact CG-CD2 3.52Å; L116-L118 HydrophobicContact CB-CD2 4.27Å; L116-L118 HydrophobicContact CB-CG 4.41Å; L116-L118 PolarHBondContact O-N 3.14Å; L118-H123 HydrophobicContact CD1-CB 4.29Å; L118-V155 HydrophobicContact CB-CG2 4.35Å |
| 119 | P | 94.6 | Very high | 95.5 | Very high | 47 Ų | 47 | 51 Ų | 51 | 31% | 0.305 | 27% | 0.266 | S | S | . | . | trans | -66.8 | 156.1 | 171 | 30.8 | -35.1 | 0 | 0 | 0 | 110.3 | A75 G121 H123 | A75-P119 HydrophobicContact CB-CB 3.97Å; P119-G121 PolarHBondContact O-N 2.89Å; P119-H123 PolarHBondContact O-NE2 2.83Å | ||
| 120 | E | 94.3 | Very high | 96 | Very high | 72 Ų | 72 | 46.8 Ų | 46.8 | 34% | 0.336 | 25% | 0.249 | S | C | . | . | S | Bend | trans | -54.1 | 137.7 | 172.8 | -65.5 | 167 | -142.4 | 0 | 0 | 111.7 | R78 V155 K157 | R78-E120 IonicContact CZ-OE1 3.36Å; R78-E120 IonicContact NE-OE1 3.34Å; R78-E120 PolarHBondContact NE-OE1 3.44Å; R78-E120 IonicContact NH2-OE1 2.71Å; R78-E120 PolarHBondContact NH2-OE1 2.87Å; E120-V155 WeakPolarHBondContact CA-O 3.23Å; E120-K157 HydrophobicContact CG-CG 4.49Å; E120-K157 WeakPolarHBondContact OE1-CE 3.49Å; E120-K157 WeakPolarHBondContact OE1-CG 3.31Å; E120-K157 WeakPolarHBondContact OE2-CE 3.44Å; E120-K157 WeakPolarHBondContact OE2-CG 3.45Å |
| 121 | G | 94.8 | Very high | 96.3 | Very high | 23 Ų | 23 | 42.6 Ų | 42.6 | 24% | 0.237 | 24% | 0.237 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | 140.9 | -175.6 | -177.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | P119 Q154 V155 | P119-G121 PolarHBondContact O-N 2.89Å; G121-Q154 VanDerWaalsContact C-NE2 3.29Å; G121-Q154 PolarHBondContact O-NE2 2.95Å; G121-V155 PolarHBondContact N-O 3.15Å; G121-V155 PolarHBondContact O-N 3.5Å |
| 122 | E | 96.3 | Very high | 96.4 | Very high | 103 Ų | 103 | 47.1 Ų | 47.1 | 48% | 0.481 | 26% | 0.256 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.5 | 130.4 | 172.4 | -176 | -172.4 | 127.8 | 0 | 0 | 110 | Q124 I152 | E122-Q124 PolarHBondContact OE1-NE2 3.39Å; E122-Q124 VanDerWaalsContact OE1-NE2 3.1Å; E122-I152 HydrophobicContact CG-CD1 3.55Å; E122-I152 HydrophobicContact CG-CG1 3.63Å |
| 123 | H | 96.6 | Very high | 96.4 | Very high | 17 Ų | 17 | 52.4 Ų | 52.4 | 8% | 0.079 | 28% | 0.276 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.2 | 129.7 | 171.9 | -63.2 | -83.4 | 0 | 0 | 0 | 110.9 | S96 F97 L118 P119 I152 I153 | S96-H123 WeakPolarHBondContact OG-CA 3.24Å; F97-H123 HydrophobicContact CD1-CB 4.11Å; L118-H123 HydrophobicContact CD1-CB 4.29Å; P119-H123 PolarHBondContact O-NE2 2.83Å; H123-I152 WeakPolarHBondContact O-CA 3.48Å; H123-I153 HydrophobicContact CB-CG2 3.93Å; H123-I153 PolarHBondContact N-O 3.26Å; H123-I153 PolarHBondContact O-N 3.18Å |
| 124 | Q | 97.2 | Very high | 96.3 | Very high | 49 Ų | 49 | 52.6 Ų | 52.6 | 23% | 0.229 | 28% | 0.277 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.3 | 138.9 | 174.9 | -63.5 | -174.2 | 18.1 | 0 | 0 | 109.9 | G95 S96 W100 E122 V142 N150 N151 | G95-Q124 CarbonylContact C-O 3.6Å; G95-Q124 WeakPolarHBondContact CA-O 3.03Å; S96-Q124 PolarHBondContact N-O 3.05Å; S96-Q124 PolarHBondContact OG-N 2.84Å; W100-Q124 HydrophobicContact CH2-CB 4.1Å; W100-Q124 HydrophobicContact CZ2-CB 4.11Å; E122-Q124 PolarHBondContact OE1-NE2 3.39Å; E122-Q124 VanDerWaalsContact OE1-NE2 3.1Å; Q124-V142 VanDerWaalsContact CD-CG1 3.46Å; Q124-V142 HydrophobicContact CG-CG1 3.82Å; Q124-N150 HydrophobicContact CB-CB 4.44Å; Q124-N150 PolarHBondContact OE1-ND2 2.94Å; Q124-N151 WeakPolarHBondContact CA-O 3.49Å |
| 125 | Y | 97.7 | Very high | 96.3 | Very high | 10 Ų | 10 | 54.8 Ų | 54.8 | 4% | 0.039 | 29% | 0.285 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -147.9 | 164.1 | -177.1 | 69.8 | -80.9 | 0 | 0 | 0 | 112.6 | F82 L93 S94 F127 N151 I153 | F82-Y125 HydrophobicContact CD1-CD1 4.39Å; F82-Y125 AromaticContact CD1-CD2 3.81Å; F82-Y125 HydrophobicContact CD1-CD2 3.81Å; F82-Y125 HydrophobicContact CD1-CE1 4.43Å; F82-Y125 AromaticContact CD1-CE2 3.85Å; F82-Y125 HydrophobicContact CD1-CE2 3.85Å; F82-Y125 HydrophobicContact CD1-CG 4.08Å; F82-Y125 AromaticContact CE1-CD1 3.69Å; F82-Y125 HydrophobicContact CE1-CD1 3.69Å; F82-Y125 AromaticContact CE1-CD2 3.89Å; F82-Y125 HydrophobicContact CE1-CD2 3.89Å; F82-Y125 AromaticContact CE1-CE1 3.92Å; F82-Y125 HydrophobicContact CE1-CE1 3.92Å; F82-Y125 HydrophobicContact CE1-CE2 4.11Å; F82-Y125 AromaticContact CE1-CG 3.66Å; F82-Y125 HydrophobicContact CE1-CG 3.66Å; L93-Y125 HydrophobicContact CD1-CD2 3.67Å; L93-Y125 HydrophobicContact CD1-CG 4.25Å; S94-Y125 CarbonylContact O-C 3.53Å; S94-Y125 VanDerWaalsContact O-CA 3.24Å; S94-Y125 WeakPolarHBondContact O-CA 3.32Å; Y125-F127 HydrophobicContact CD2-CE2 4.19Å; Y125-F127 HydrophobicContact CD2-CZ 4.31Å; Y125-F127 AromaticContact CE2-CE2 3.69Å; Y125-F127 HydrophobicContact CE2-CE2 3.69Å; Y125-F127 AromaticContact CE2-CZ 3.88Å; Y125-F127 HydrophobicContact CE2-CZ 3.88Å; Y125-N151 HydrophobicContact CD1-CB 3.84Å; Y125-N151 HydrophobicContact CD2-CB 4Å; Y125-N151 HydrophobicContact CE1-CB 3.4Å; Y125-N151 VanDerWaalsContact CE1-CB 3.4Å; Y125-N151 HydrophobicContact CE2-CB 3.58Å; Y125-N151 HydrophobicContact CG-CB 4.14Å; Y125-N151 PolarHBondContact N-O 3.31Å; Y125-N151 PolarHBondContact O-N 3.08Å; Y125-I153 HydrophobicContact CD1-CG2 4.07Å; Y125-I153 HydrophobicContact CE1-CB 3.94Å; Y125-I153 HydrophobicContact CE1-CG2 3.96Å |
| 126 | K | 97.6 | Very high | 96.3 | Very high | 28 Ų | 28 | 49.8 Ų | 49.8 | 12% | 0.122 | 26% | 0.259 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -153.4 | 148.6 | 179.5 | -159 | 168.4 | -169 | 163.4 | 0 | 111 | S94 W100 W133 T134 V149 | S94-K126 PolarHBondContact N-O 3.46Å; S94-K126 PolarHBondContact O-N 2.98Å; W100-K126 HydrophobicContact CZ3-CB 4.09Å; K126-W133 HydrophobicContact CB-CE3 4.15Å; K126-W133 HydrophobicContact CB-CZ3 4.16Å; K126-W133 HydrophobicContact CD-CB 4.41Å; K126-W133 HydrophobicContact CD-CD2 4.49Å; K126-W133 HydrophobicContact CD-CE3 3.93Å; K126-W133 HydrophobicContact CG-CE3 3.89Å; K126-W133 HydrophobicContact CG-CZ3 4.4Å; K126-T134 WeakPolarHBondContact CG-O 3.38Å; K126-V149 WeakPolarHBondContact CE-O 3.4Å; K126-V149 PolarHBondContact NZ-O 3.46Å |
| 127 | F | 98.1 | Very high | 96.2 | Very high | 1 Ų | 1 | 53.3 Ų | 53.3 | 0% | 0.004 | 28% | 0.284 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -96 | 142.5 | 176.4 | -62.8 | -78.5 | 0 | 0 | 0 | 111.1 | W84 V91 Y92 L93 L105 Y125 V129 T134 D136 | W84-F127 HydrophobicContact CB-CD1 4.13Å; W84-F127 HydrophobicContact CB-CE1 3.92Å; W84-F127 HydrophobicContact CB-CZ 4.25Å; W84-F127 HydrophobicContact CD2-CD2 4.43Å; W84-F127 HydrophobicContact CD2-CG 4.33Å; W84-F127 HydrophobicContact CE3-CB 4.23Å; W84-F127 HydrophobicContact CE3-CD1 4.35Å; W84-F127 AromaticContact CE3-CD2 3.46Å; W84-F127 HydrophobicContact CE3-CD2 3.46Å; W84-F127 VanDerWaalsContact CE3-CD2 3.46Å; W84-F127 AromaticContact CE3-CE2 3.79Å; W84-F127 HydrophobicContact CE3-CE2 3.79Å; W84-F127 AromaticContact CE3-CG 3.76Å; W84-F127 HydrophobicContact CE3-CG 3.76Å; W84-F127 HydrophobicContact CE3-CZ 4.36Å; W84-F127 HydrophobicContact CZ3-CB 4.49Å; W84-F127 AromaticContact CZ3-CD2 3.85Å; W84-F127 HydrophobicContact CZ3-CD2 3.85Å; W84-F127 HydrophobicContact CZ3-CE2 4.4Å; W84-F127 HydrophobicContact CZ3-CG 4.33Å; V91-F127 HydrophobicContact CG1-CD1 4.18Å; Y92-F127 CarbonylContact O-C 3.46Å; Y92-F127 WeakPolarHBondContact O-CA 3.42Å; L93-F127 HydrophobicContact CD1-CD1 4.25Å; L93-F127 HydrophobicContact CD1-CE1 3.99Å; L93-F127 HydrophobicContact CD1-CZ 4.47Å; L105-F127 HydrophobicContact CD1-CD1 4.03Å; L105-F127 HydrophobicContact CD1-CE1 3.83Å; Y125-F127 HydrophobicContact CD2-CE2 4.19Å; Y125-F127 HydrophobicContact CD2-CZ 4.31Å; Y125-F127 AromaticContact CE2-CE2 3.69Å; Y125-F127 HydrophobicContact CE2-CE2 3.69Å; Y125-F127 AromaticContact CE2-CZ 3.88Å; Y125-F127 HydrophobicContact CE2-CZ 3.88Å; F127-V129 HydrophobicContact CB-CG2 4.2Å; F127-T134 HydrophobicContact CB-CG2 4.04Å; F127-T134 PolarHBondContact N-O 3.39Å; F127-T134 PolarHBondContact O-N 3.42Å; F127-T134 VanDerWaalsContact O-O 3.05Å; F127-D136 HydrophobicContact CE2-CB 4.11Å |
| 128 | F | 97.8 | Very high | 96.2 | Very high | 30 Ų | 30 | 52.6 Ų | 52.6 | 13% | 0.132 | 29% | 0.288 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.4 | 106 | 169.3 | -173.9 | -94.5 | 0 | 0 | 0 | 108 | V91 Y92 K102 G131 Q132 W133 | V91-F128 WeakPolarHBondContact CA-O 3.08Å; Y92-F128 AromaticContact CD2-CD1 3.94Å; Y92-F128 HydrophobicContact CD2-CD1 3.94Å; Y92-F128 PolarHBondContact N-O 2.86Å; Y92-F128 PolarHBondContact O-N 2.95Å; K102-F128 HydrophobicContact CD-CD1 4.2Å; K102-F128 HydrophobicContact CD-CG 4.46Å; F128-G131 VanDerWaalsContact CE2-C 3.5Å; F128-G131 VanDerWaalsContact CE2-O 3.27Å; F128-G131 WeakPolarHBondContact CE2-O 3.22Å; F128-G131 VanDerWaalsContact CZ-O 3.24Å; F128-G131 WeakPolarHBondContact CZ-O 3.44Å; F128-Q132 CarbonylContact C-O 3.53Å; F128-Q132 WeakPolarHBondContact CA-O 3.48Å; F128-W133 HydrophobicContact CB-CD2 4.37Å; F128-W133 HydrophobicContact CB-CE3 3.94Å; F128-W133 HydrophobicContact CB-CH2 4.31Å; F128-W133 HydrophobicContact CB-CZ3 3.91Å; F128-W133 AromaticContact CD2-CD2 3.67Å; F128-W133 HydrophobicContact CD2-CD2 3.67Å; F128-W133 AromaticContact CD2-CE2 3.65Å; F128-W133 HydrophobicContact CD2-CE3 4.12Å; F128-W133 AromaticContact CD2-CG 3.94Å; F128-W133 HydrophobicContact CD2-CG 3.94Å; F128-W133 HydrophobicContact CD2-CZ2 4.13Å; F128-W133 AromaticContact CD2-NE1 3.86Å |
| 129 | V | 97.5 | Very high | 96.3 | Very high | 18 Ų | 18 | 56.3 Ų | 56.3 | 11% | 0.109 | 31% | 0.305 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.1 | 122 | -171.8 | 178.2 | 0 | 0 | 0 | 0 | 108.6 | W84 G87 V91 F127 G131 Q132 T134 | W84-V129 HydrophobicContact CD2-CG2 4.31Å; W84-V129 HydrophobicContact CZ2-CG2 3.89Å; G87-V129 WeakPolarHBondContact O-CG1 3.5Å; V91-V129 HydrophobicContact CG1-CG2 3.93Å; V91-V129 HydrophobicContact CG2-CG1 4.27Å; V91-V129 HydrophobicContact CG2-CG2 4.13Å; F127-V129 HydrophobicContact CB-CG2 4.2Å; V129-G131 PolarHBondContact O-N 3.04Å; V129-Q132 PolarHBondContact N-O 3.17Å; V129-Q132 PolarHBondContact O-N 3.26Å; V129-T134 HydrophobicContact CB-CG2 4.16Å; V129-T134 HydrophobicContact CG2-CG2 3.59Å |
| 130 | D | 95.9 | Very high | 96.4 | Very high | 83 Ų | 83 | 57.8 Ų | 57.8 | 44% | 0.444 | 32% | 0.315 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 47 | 37.6 | 174 | -65.7 | -12 | 0 | 0 | 0 | 114.5 | G88 K89 E90 | G88-D130 WeakPolarHBondContact CA-OD2 3.32Å; K89-D130 WeakPolarHBondContact CA-OD1 3.36Å; K89-D130 WeakPolarHBondContact CB-OD1 3.49Å; K89-D130 VanDerWaalsContact N-CG 3.33Å; K89-D130 PolarHBondContact N-OD1 2.75Å; K89-D130 PolarHBondContact N-OD2 3.29Å; K89-D130 VanDerWaalsContact N-OD2 3.08Å; E90-D130 PolarHBondContact N-OD1 3.23Å; E90-D130 PolarHBondContact O-N 2.9Å |
| 131 | G | 94.9 | Very high | 96.5 | Very high | 41 Ų | 41 | 58.5 Ų | 58.5 | 42% | 0.423 | 32% | 0.32 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 96.2 | -6.3 | 179.8 | 0 | 0 | 0 | 0 | 0 | 115.9 | F128 V129 | F128-G131 VanDerWaalsContact CE2-C 3.5Å; F128-G131 VanDerWaalsContact CE2-O 3.27Å; F128-G131 WeakPolarHBondContact CE2-O 3.22Å; F128-G131 VanDerWaalsContact CZ-O 3.24Å; F128-G131 WeakPolarHBondContact CZ-O 3.44Å; V129-G131 PolarHBondContact O-N 3.04Å |
| 132 | Q | 96.3 | Very high | 96.6 | Very high | 143 Ų | 143 | 59.3 Ų | 59.3 | 67% | 0.668 | 32% | 0.32 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -118.3 | 142.6 | -174.1 | -63.4 | -59.1 | -31.2 | 0 | 0 | 113.1 | F128 V129 | F128-Q132 CarbonylContact C-O 3.53Å; F128-Q132 WeakPolarHBondContact CA-O 3.48Å; V129-Q132 PolarHBondContact N-O 3.17Å; V129-Q132 PolarHBondContact O-N 3.26Å |
| 133 | W | 96.4 | Very high | 96.5 | Very high | 118 Ų | 118 | 58.6 Ų | 58.6 | 45% | 0.447 | 32% | 0.323 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.7 | 122.8 | 174.2 | -76.2 | 111.4 | 0 | 0 | 0 | 111 | K126 F128 | K126-W133 HydrophobicContact CB-CE3 4.15Å; K126-W133 HydrophobicContact CB-CZ3 4.16Å; K126-W133 HydrophobicContact CD-CB 4.41Å; K126-W133 HydrophobicContact CD-CD2 4.49Å; K126-W133 HydrophobicContact CD-CE3 3.93Å; K126-W133 HydrophobicContact CG-CE3 3.89Å; K126-W133 HydrophobicContact CG-CZ3 4.4Å; F128-W133 HydrophobicContact CB-CD2 4.37Å; F128-W133 HydrophobicContact CB-CE3 3.94Å; F128-W133 HydrophobicContact CB-CH2 4.31Å; F128-W133 HydrophobicContact CB-CZ3 3.91Å; F128-W133 AromaticContact CD2-CD2 3.67Å; F128-W133 HydrophobicContact CD2-CD2 3.67Å; F128-W133 AromaticContact CD2-CE2 3.65Å; F128-W133 HydrophobicContact CD2-CE3 4.12Å; F128-W133 AromaticContact CD2-CG 3.94Å; F128-W133 HydrophobicContact CD2-CG 3.94Å; F128-W133 HydrophobicContact CD2-CZ2 4.13Å; F128-W133 AromaticContact CD2-NE1 3.86Å |
| 134 | T | 96.3 | Very high | 96 | Very high | 45 Ų | 45 | 60 Ų | 60 | 28% | 0.276 | 34% | 0.335 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.7 | 169.1 | -179.3 | -166.8 | 0 | 0 | 0 | 0 | 111.6 | W84 K126 F127 V129 | W84-T134 HydrophobicContact CH2-CG2 3.45Å; W84-T134 VanDerWaalsContact CH2-CG2 3.45Å; W84-T134 HydrophobicContact CZ2-CG2 3.86Å; W84-T134 HydrophobicContact CZ3-CG2 3.97Å; K126-T134 WeakPolarHBondContact CG-O 3.38Å; F127-T134 HydrophobicContact CB-CG2 4.04Å; F127-T134 PolarHBondContact N-O 3.39Å; F127-T134 PolarHBondContact O-N 3.42Å; F127-T134 VanDerWaalsContact O-O 3.05Å; V129-T134 HydrophobicContact CB-CG2 4.16Å; V129-T134 HydrophobicContact CG2-CG2 3.59Å |
| 135 | H | 96.2 | Very high | 95.4 | Very high | 62 Ų | 62 | 67.4 Ų | 67.4 | 29% | 0.287 | 37% | 0.369 | S | S | . | . | trans | -127.3 | 157.6 | 176 | 66.8 | -82.9 | 0 | 0 | 0 | 108.7 | W84 N151 | W84-H135 WeakPolarHBondContact CZ3-O 3.37Å; H135-N151 VanDerWaalsContact CA-OD1 3.32Å; H135-N151 WeakPolarHBondContact CA-OD1 3.46Å; H135-N151 VanDerWaalsContact CB-OD1 3.28Å; H135-N151 WeakPolarHBondContact CB-OD1 3.34Å | ||
| 136 | D | 96.3 | Very high | 94.9 | Very high | 6 Ų | 6 | 74.4 Ų | 74.4 | 3% | 0.032 | 41% | 0.407 | C | S | . | . | trans | -79.2 | 122.3 | 170.5 | -164.3 | -48.6 | 0 | 0 | 0 | 108.6 | W84 F127 S138 E139 N151 | W84-D136 HydrophobicContact CE3-CB 4.37Å; W84-D136 HydrophobicContact CZ3-CB 4.15Å; F127-D136 HydrophobicContact CE2-CB 4.11Å; D136-S138 VanDerWaalsContact C-N 3.25Å; D136-S138 PolarHBondContact O-N 3.21Å; D136-S138 WeakPolarHBondContact OD1-CB 3.45Å; D136-S138 PolarHBondContact OD1-N 3.49Å; D136-S138 PolarHBondContact OD1-OG 3.37Å; D136-E139 HydrophobicContact CB-CB 4.29Å; D136-E139 HydrophobicContact CB-CG 4.2Å; D136-N151 PolarHBondContact N-OD1 3.24Å; D136-N151 PolarHBondContact O-ND2 2.8Å | ||
| 137 | P | 95.3 | Very high | 94.4 | Very high | 112 Ų | 112 | 75.6 Ų | 75.6 | 73% | 0.727 | 43% | 0.427 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.1 | -8.5 | -178.8 | 33.6 | -37.2 | 0 | 0 | 0 | 113.6 | ||
| 138 | S | 95.3 | Very high | 94.1 | Very high | 92 Ų | 92 | 78.5 Ų | 78.5 | 64% | 0.643 | 45% | 0.445 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.3 | -19.2 | 175.8 | 66.2 | 0 | 0 | 0 | 0 | 113.2 | D136 | D136-S138 VanDerWaalsContact C-N 3.25Å; D136-S138 PolarHBondContact O-N 3.21Å; D136-S138 WeakPolarHBondContact OD1-CB 3.45Å; D136-S138 PolarHBondContact OD1-N 3.49Å; D136-S138 PolarHBondContact OD1-OG 3.37Å |
| 139 | E | 96.6 | Very high | 94 | Very high | 82 Ų | 82 | 79.1 Ų | 79.1 | 38% | 0.383 | 45% | 0.451 | S | S | . | . | S | Bend | trans | -96.9 | 152 | 179.1 | -67.3 | -63.5 | 155.5 | 0 | 0 | 111.7 | D136 N151 | D136-E139 HydrophobicContact CB-CB 4.29Å; D136-E139 HydrophobicContact CB-CG 4.2Å; E139-N151 PolarHBondContact O-ND2 3.26Å |
| 140 | P | 96.6 | Very high | 94 | Very high | 79 Ų | 79 | 78.7 Ų | 78.7 | 51% | 0.513 | 45% | 0.448 | S | S | . | . | trans | -54.4 | 148.7 | 176 | -26.8 | 36.4 | 0 | 0 | 0 | 113.4 | N151 I152 | P140-N151 VanDerWaalsContact O-CA 3.26Å; P140-N151 WeakPolarHBondContact O-CA 3.36Å; P140-N151 PolarHBondContact O-ND2 3.23Å; P140-N151 VanDerWaalsContact O-ND2 3.12Å; P140-I152 HydrophobicContact CB-CG2 3.71Å; P140-I152 PolarHBondContact O-N 2.91Å | ||
| 141 | I | 97.1 | Very high | 94.1 | Very high | 87 Ų | 87 | 74.7 Ų | 74.7 | 45% | 0.446 | 43% | 0.427 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.5 | 153.6 | 178.2 | 58.9 | 166.7 | 0 | 0 | 0 | 112.7 | V149 N150 | I141-V149 HydrophobicContact CB-CG1 4Å; I141-V149 HydrophobicContact CD1-CG1 3.9Å; I141-V149 HydrophobicContact CG2-CG1 4.15Å; I141-N150 CarbonylContact C-O 3.59Å; I141-N150 VanDerWaalsContact CA-O 3.23Å; I141-N150 WeakPolarHBondContact CA-O 3.45Å; I141-N150 WeakPolarHBondContact CB-O 3.48Å |
| 142 | V | 96.5 | Very high | 94.2 | Very high | 39 Ų | 39 | 74.6 Ų | 74.6 | 24% | 0.236 | 42% | 0.416 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.9 | 139.6 | 171.2 | 64.2 | 0 | 0 | 0 | 0 | 109.7 | Q124 N150 I152 | Q124-V142 VanDerWaalsContact CD-CG1 3.46Å; Q124-V142 HydrophobicContact CG-CG1 3.82Å; V142-N150 HydrophobicContact CG1-CB 4.35Å; V142-N150 PolarHBondContact N-O 3.1Å; V142-N150 PolarHBondContact O-N 3.36Å; V142-I152 HydrophobicContact CB-CB 4.34Å; V142-I152 HydrophobicContact CB-CD1 4.45Å; V142-I152 HydrophobicContact CB-CG2 4.32Å; V142-I152 HydrophobicContact CG1-CB 3.97Å; V142-I152 HydrophobicContact CG1-CG2 4.44Å |
| 143 | T | 94.8 | Very high | 94.2 | Very high | 88 Ų | 88 | 69.7 Ų | 69.7 | 54% | 0.54 | 39% | 0.394 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.4 | 118.2 | 177.7 | -54.9 | 0 | 0 | 0 | 0 | 109.4 | V149 | T143-V149 HydrophobicContact CG2-CG2 4.4Å |
| 144 | S | 86.4 | Confident | 94.2 | Very high | 48 Ų | 48 | 68.4 Ų | 68.4 | 34% | 0.336 | 39% | 0.393 | S | S | . | . | trans | -66.4 | 157.4 | 174.6 | -176.6 | 0 | 0 | 0 | 0 | 111.6 | L146 G147 T148 | S144-L146 PolarHBondContact O-N 2.65Å; S144-G147 PolarHBondContact O-N 3.45Å; S144-T148 WeakPolarHBondContact CB-O 3.49Å; S144-T148 PolarHBondContact N-O 3.4Å | ||
| 145 | Q | 84.6 | Confident | 94.1 | Very high | 203 Ų | 203 | 66.5 Ų | 66.5 | 95% | 0.949 | 38% | 0.381 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.7 | -24.2 | 177.3 | -61.6 | 177 | 9.3 | 0 | 0 | 113.3 | G147 | Q145-G147 VanDerWaalsContact C-N 3.3Š|
| 146 | L | 85.9 | Confident | 93.9 | Very high | 158 Ų | 158 | 68.3 Ų | 68.3 | 83% | 0.827 | 39% | 0.388 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.4 | 7.8 | 176.6 | -58.3 | 176.4 | 0 | 0 | 0 | 113.7 | S144 T148 | S144-L146 PolarHBondContact O-N 2.65Å; L146-T148 VanDerWaalsContact C-N 3.32Å; L146-T148 PolarHBondContact O-N 2.93Å |
| 147 | G | 88.2 | Confident | 93.6 | Very high | 52 Ų | 52 | 73.6 Ų | 73.6 | 54% | 0.536 | 41% | 0.411 | S | S | . | . | S | Bend | trans | 83.3 | -3.5 | -179.5 | 0 | 0 | 0 | 0 | 0 | 115.3 | S144 Q145 V149 | S144-G147 PolarHBondContact O-N 3.45Å; Q145-G147 VanDerWaalsContact C-N 3.3Å; G147-V149 PolarHBondContact O-N 3.33Å |
| 148 | T | 91.2 | Very high | 93.4 | Very high | 63 Ų | 63 | 70 Ų | 70 | 39% | 0.387 | 39% | 0.387 | S | S | . | . | trans | -72.3 | 117.9 | 178.1 | -52.3 | 0 | 0 | 0 | 0 | 111.2 | S144 L146 N150 | S144-T148 WeakPolarHBondContact CB-O 3.49Å; S144-T148 PolarHBondContact N-O 3.4Å; L146-T148 VanDerWaalsContact C-N 3.32Å; L146-T148 PolarHBondContact O-N 2.93Å; T148-N150 WeakPolarHBondContact CG2-OD1 3.21Å | ||
| 149 | V | 95.8 | Very high | 93.2 | Very high | 42 Ų | 42 | 68.8 Ų | 68.8 | 26% | 0.255 | 37% | 0.373 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.9 | 127.8 | 169.1 | -177.7 | 0 | 0 | 0 | 0 | 110.1 | K126 I141 T143 G147 | K126-V149 WeakPolarHBondContact CE-O 3.4Å; K126-V149 PolarHBondContact NZ-O 3.46Å; I141-V149 HydrophobicContact CB-CG1 4Å; I141-V149 HydrophobicContact CD1-CG1 3.9Å; I141-V149 HydrophobicContact CG2-CG1 4.15Å; T143-V149 HydrophobicContact CG2-CG2 4.4Å; G147-V149 PolarHBondContact O-N 3.33Å |
| 150 | N | 97 | Very high | 92.8 | Very high | 9 Ų | 9 | 67.9 Ų | 67.9 | 5% | 0.048 | 37% | 0.368 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.7 | 156.6 | 174.4 | -63.3 | -28.2 | 0 | 0 | 0 | 109.2 | W100 Q124 I141 V142 T148 | W100-N150 HydrophobicContact CH2-CB 4.36Å; W100-N150 VanDerWaalsContact CH2-ND2 3.31Å; W100-N150 WeakPolarHBondContact CH2-ND2 3.46Å; Q124-N150 HydrophobicContact CB-CB 4.44Å; Q124-N150 PolarHBondContact OE1-ND2 2.94Å; I141-N150 CarbonylContact C-O 3.59Å; I141-N150 VanDerWaalsContact CA-O 3.23Å; I141-N150 WeakPolarHBondContact CA-O 3.45Å; I141-N150 WeakPolarHBondContact CB-O 3.48Å; V142-N150 HydrophobicContact CG1-CB 4.35Å; V142-N150 PolarHBondContact N-O 3.1Å; V142-N150 PolarHBondContact O-N 3.36Å; T148-N150 WeakPolarHBondContact CG2-OD1 3.21Å |
| 151 | N | 97.7 | Very high | 92.6 | Very high | 0 Ų | 0 | 69.7 Ų | 69.7 | 0% | 0 | 37% | 0.37 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.6 | 157.7 | 161.1 | -70.2 | 111.7 | 0 | 0 | 0 | 110.4 | Q124 Y125 H135 D136 E139 P140 | Q124-N151 WeakPolarHBondContact CA-O 3.49Å; Y125-N151 HydrophobicContact CD1-CB 3.84Å; Y125-N151 HydrophobicContact CD2-CB 4Å; Y125-N151 HydrophobicContact CE1-CB 3.4Å; Y125-N151 VanDerWaalsContact CE1-CB 3.4Å; Y125-N151 HydrophobicContact CE2-CB 3.58Å; Y125-N151 HydrophobicContact CG-CB 4.14Å; Y125-N151 PolarHBondContact N-O 3.31Å; Y125-N151 PolarHBondContact O-N 3.08Å; H135-N151 VanDerWaalsContact CA-OD1 3.32Å; H135-N151 WeakPolarHBondContact CA-OD1 3.46Å; H135-N151 VanDerWaalsContact CB-OD1 3.28Å; H135-N151 WeakPolarHBondContact CB-OD1 3.34Å; D136-N151 PolarHBondContact N-OD1 3.24Å; D136-N151 PolarHBondContact O-ND2 2.8Å; E139-N151 PolarHBondContact O-ND2 3.26Å; P140-N151 VanDerWaalsContact O-CA 3.26Å; P140-N151 WeakPolarHBondContact O-CA 3.36Å; P140-N151 PolarHBondContact O-ND2 3.23Å; P140-N151 VanDerWaalsContact O-ND2 3.12Å |
| 152 | I | 97.5 | Very high | 92.3 | Very high | 38 Ų | 38 | 70.3 Ų | 70.3 | 20% | 0.195 | 38% | 0.377 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -132 | 131.2 | 179.5 | 179.4 | 177.6 | 0 | 0 | 0 | 109.2 | E122 H123 P140 V142 | E122-I152 HydrophobicContact CG-CD1 3.55Å; E122-I152 HydrophobicContact CG-CG1 3.63Å; H123-I152 WeakPolarHBondContact O-CA 3.48Å; P140-I152 HydrophobicContact CB-CG2 3.71Å; P140-I152 PolarHBondContact O-N 2.91Å; V142-I152 HydrophobicContact CB-CB 4.34Å; V142-I152 HydrophobicContact CB-CD1 4.45Å; V142-I152 HydrophobicContact CB-CG2 4.32Å; V142-I152 HydrophobicContact CG1-CB 3.97Å; V142-I152 HydrophobicContact CG1-CG2 4.44Å |
| 153 | I | 96.7 | Very high | 92.1 | Very high | 40 Ų | 40 | 76.5 Ų | 76.5 | 21% | 0.205 | 40% | 0.401 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.2 | 137.6 | 173 | -172.5 | 164.1 | 0 | 0 | 0 | 109.7 | T80 F82 H123 Y125 | T80-I153 HydrophobicContact CG2-CD1 3.66Å; F82-I153 HydrophobicContact CE1-CG2 4.08Å; F82-I153 HydrophobicContact CZ-CG2 4.07Å; H123-I153 HydrophobicContact CB-CG2 3.93Å; H123-I153 PolarHBondContact N-O 3.26Å; H123-I153 PolarHBondContact O-N 3.18Å; Y125-I153 HydrophobicContact CD1-CG2 4.07Å; Y125-I153 HydrophobicContact CE1-CB 3.94Å; Y125-I153 HydrophobicContact CE1-CG2 3.96Å |
| 154 | Q | 95.6 | Very high | 92 | Very high | 92 Ų | 92 | 75.3 Ų | 75.3 | 43% | 0.43 | 39% | 0.392 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.2 | 111.7 | 176.8 | -179.4 | 66.6 | 49 | 0 | 0 | 108.7 | G121 K156 | G121-Q154 VanDerWaalsContact C-NE2 3.29Å; G121-Q154 PolarHBondContact O-NE2 2.95Å; Q154-K156 HydrophobicContact CG-CD 4.41Å; Q154-K156 HydrophobicContact CG-CG 3.88Å |
| 155 | V | 95.3 | Very high | 92.3 | Very high | 5 Ų | 5 | 74.2 Ų | 74.2 | 3% | 0.03 | 39% | 0.385 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.8 | 121.1 | 175.5 | -179 | 0 | 0 | 0 | 0 | 108.4 | T80 L118 E120 G121 F160 | T80-V155 HydrophobicContact CG2-CG2 4.21Å; L118-V155 HydrophobicContact CB-CG2 4.35Å; E120-V155 WeakPolarHBondContact CA-O 3.23Å; G121-V155 PolarHBondContact N-O 3.15Å; G121-V155 PolarHBondContact O-N 3.5Å; V155-F160 HydrophobicContact CG1-CE2 3.69Å; V155-F160 HydrophobicContact CG1-CZ 3.83Å |
| 156 | K | 92.3 | Very high | 92.6 | Very high | 100 Ų | 100 | 69.8 Ų | 69.8 | 44% | 0.435 | 37% | 0.367 | S | S | . | . | trans | -122 | 160.1 | -178.9 | -54.6 | -178.2 | -178.7 | 180 | 0 | 111.9 | Q154 T158 D159 F160 | Q154-K156 HydrophobicContact CG-CD 4.41Å; Q154-K156 HydrophobicContact CG-CG 3.88Å; K156-T158 WeakPolarHBondContact CB-OG1 3.18Å; K156-T158 PolarHBondContact O-N 3.19Å; K156-D159 WeakPolarHBondContact CA-OD2 3.36Å; K156-D159 WeakPolarHBondContact CB-OD2 3.33Å; K156-D159 PolarHBondContact N-OD2 3.45Å; K156-D159 PolarHBondContact O-N 2.79Å; K156-F160 VanDerWaalsContact O-CD2 3.23Å; K156-F160 WeakPolarHBondContact O-CD2 3.27Å; K156-F160 VanDerWaalsContact O-CE2 3.27Å; K156-F160 WeakPolarHBondContact O-CE2 3.49Å | ||
| 157 | K | 89.8 | Confident | 92.8 | Very high | 117 Ų | 117 | 66.8 Ų | 66.8 | 51% | 0.509 | 35% | 0.35 | S | S | . | . | G | 310 helix | trans | -52.7 | -42 | 172.6 | -63.1 | -163.2 | 172.6 | -173.1 | 0 | 112.9 | R78 E120 D159 | R78-K157 PolarHBondContact NH1-O 2.71Å; E120-K157 HydrophobicContact CG-CG 4.49Å; E120-K157 WeakPolarHBondContact OE1-CE 3.49Å; E120-K157 WeakPolarHBondContact OE1-CG 3.31Å; E120-K157 WeakPolarHBondContact OE2-CE 3.44Å; E120-K157 WeakPolarHBondContact OE2-CG 3.45Å; K157-D159 PolarHBondContact O-N 3.44Å |
| 158 | T | 90.8 | Very high | 92.8 | Very high | 35 Ų | 35 | 65.8 Ų | 65.8 | 22% | 0.215 | 33% | 0.334 | C | S | . | . | G | 310 helix | trans | -62.1 | -25 | -176.7 | 50.6 | 0 | 0 | 0 | 0 | 114.2 | K156 F160 D164 A165 V168 | K156-T158 WeakPolarHBondContact CB-OG1 3.18Å; K156-T158 PolarHBondContact O-N 3.19Å; T158-F160 PolarHBondContact O-N 3.34Å; T158-D164 HydrophobicContact CG2-CB 4.08Å; T158-A165 WeakPolarHBondContact O-CA 3.3Å; T158-A165 WeakPolarHBondContact O-CB 3.4Å; T158-A165 PolarHBondContact O-N 2.92Å; T158-A165 VanDerWaalsContact O-N 3.08Å; T158-V168 HydrophobicContact CG2-CG2 4.14Å |
| 159 | D | 90.1 | Very high | 92.7 | Very high | 68 Ų | 68 | 66.9 Ų | 66.9 | 36% | 0.364 | 34% | 0.337 | S | S | . | . | G | 310 helix | trans | -78.8 | -3.7 | -169 | -47.6 | -27 | 0 | 0 | 0 | 112.5 | K156 K157 | K156-D159 WeakPolarHBondContact CA-OD2 3.36Å; K156-D159 WeakPolarHBondContact CB-OD2 3.33Å; K156-D159 PolarHBondContact N-OD2 3.45Å; K156-D159 PolarHBondContact O-N 2.79Å; K157-D159 PolarHBondContact O-N 3.44Å |
| 160 | F | 89.3 | Confident | 92.4 | Very high | 62 Ų | 62 | 67.6 Ų | 67.6 | 27% | 0.272 | 34% | 0.344 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -117.7 | -21.4 | -175 | -58 | -85.1 | 0 | 0 | 0 | 113.1 | R78 P79 V155 K156 T158 | R78-F160 HydrophobicContact CB-CD1 3.75Å; R78-F160 HydrophobicContact CB-CD2 4.22Å; R78-F160 HydrophobicContact CB-CE1 3.3Å; R78-F160 HydrophobicContact CB-CE2 3.82Å; R78-F160 HydrophobicContact CB-CG 4.2Å; R78-F160 HydrophobicContact CB-CZ 3.34Å; R78-F160 HydrophobicContact CG-CD2 4.37Å; R78-F160 HydrophobicContact CG-CE1 4.39Å; R78-F160 HydrophobicContact CG-CE2 4.22Å; R78-F160 HydrophobicContact CG-CZ 4.23Å; P79-F160 HydrophobicContact CG-CE1 4.38Å; V155-F160 HydrophobicContact CG1-CE2 3.69Å; V155-F160 HydrophobicContact CG1-CZ 3.83Å; K156-F160 VanDerWaalsContact O-CD2 3.23Å; K156-F160 WeakPolarHBondContact O-CD2 3.27Å; K156-F160 VanDerWaalsContact O-CE2 3.27Å; K156-F160 WeakPolarHBondContact O-CE2 3.49Å; T158-F160 PolarHBondContact O-N 3.34Å |
| 161 | E | 91.8 | Very high | 91.8 | Very high | 118 Ų | 118 | 72.9 Ų | 72.9 | 55% | 0.551 | 37% | 0.369 | S | S | * | . | S | Bend | trans | -90.8 | 113.6 | 168.1 | -71.1 | -55.6 | 150.9 | 0 | 0 | 108.9 | F163 D164 A165 | E161-F163 PolarHBondContact O-N 2.63Å; E161-F163 VanDerWaalsContact O-N 3.15Å; E161-D164 HydrophobicContact CB-CB 4.07Å; E161-D164 PolarHBondContact O-N 3.02Å; E161-A165 PolarHBondContact O-N 3.24Å |
| 162 | V | 91.6 | Very high | 91 | Very high | 99 Ų | 99 | 79.9 Ų | 79.9 | 60% | 0.6 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -58 | -36.7 | -168.7 | 178.8 | 0 | 0 | 0 | 0 | 112.2 | L166 | V162-L166 HydrophobicContact CG1-CD1 3.99Å; V162-L166 WeakPolarHBondContact O-CB 3.17Å; V162-L166 WeakPolarHBondContact O-CD1 3.37Å; V162-L166 WeakPolarHBondContact O-CG 3.41Å; V162-L166 PolarHBondContact O-N 3.22Å; V162-L166 VanDerWaalsContact O-N 3.1Å |
| 163 | F | 92.2 | Very high | 89.7 | Confident | 170 Ų | 170 | 82 Ų | 82 | 75% | 0.746 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -70.2 | -38.2 | 177.7 | -62.8 | -66.3 | 0 | 0 | 0 | 112.7 | E161 M167 | E161-F163 PolarHBondContact O-N 2.63Å; E161-F163 VanDerWaalsContact O-N 3.15Å; F163-M167 VanDerWaalsContact O-CB 3.29Å; F163-M167 WeakPolarHBondContact O-CB 3.47Å; F163-M167 PolarHBondContact O-N 3.3Å |
| 164 | D | 92.3 | Very high | 87.8 | Confident | 63 Ų | 63 | 83.7 Ų | 83.7 | 34% | 0.337 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -70.9 | -41.6 | 177.9 | -73.4 | -10.8 | 0 | 0 | 0 | 111.4 | T158 E161 M167 V168 | T158-D164 HydrophobicContact CG2-CB 4.08Å; E161-D164 HydrophobicContact CB-CB 4.07Å; E161-D164 PolarHBondContact O-N 3.02Å; D164-M167 PolarHBondContact O-N 3.24Å; D164-V168 WeakPolarHBondContact O-CB 3.29Å; D164-V168 WeakPolarHBondContact O-CG2 3.34Å; D164-V168 PolarHBondContact O-N 3.44Å |
| 165 | A | 92.5 | Very high | 85.8 | Confident | 24 Ų | 24 | 86 Ų | 86 | 20% | 0.198 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -58.2 | -49.8 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | T158 E161 M167 V168 D169 | T158-A165 WeakPolarHBondContact O-CA 3.3Å; T158-A165 WeakPolarHBondContact O-CB 3.4Å; T158-A165 PolarHBondContact O-N 2.92Å; T158-A165 VanDerWaalsContact O-N 3.08Å; E161-A165 PolarHBondContact O-N 3.24Å; A165-M167 PolarHBondContact O-N 3.45Å; A165-V168 PolarHBondContact O-N 3.34Å; A165-D169 WeakPolarHBondContact O-CB 2.98Å; A165-D169 PolarHBondContact O-N 3.02Å |
| 166 | L | 91.7 | Very high | 83.9 | Confident | 110 Ų | 110 | 88.2 Ų | 88.2 | 58% | 0.576 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -63.2 | -38.9 | 177.1 | -71.8 | 171.7 | 0 | 0 | 0 | 112.4 | V162 S170 | V162-L166 HydrophobicContact CG1-CD1 3.99Å; V162-L166 WeakPolarHBondContact O-CB 3.17Å; V162-L166 WeakPolarHBondContact O-CD1 3.37Å; V162-L166 WeakPolarHBondContact O-CG 3.41Å; V162-L166 PolarHBondContact O-N 3.22Å; V162-L166 VanDerWaalsContact O-N 3.1Å; L166-S170 WeakPolarHBondContact O-CB 3.02Å; L166-S170 PolarHBondContact O-N 3.04Å; L166-S170 PolarHBondContact O-OG 3.21Å |
| 167 | M | 89.3 | Confident | 82 | Confident | 95 Ų | 95 | 88.3 Ų | 88.3 | 47% | 0.468 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -61.8 | -49.8 | 174.7 | 177 | 171.7 | 53.5 | 0 | 0 | 111.2 | F163 D164 A165 D169 S170 Q171 | F163-M167 VanDerWaalsContact O-CB 3.29Å; F163-M167 WeakPolarHBondContact O-CB 3.47Å; F163-M167 PolarHBondContact O-N 3.3Å; D164-M167 PolarHBondContact O-N 3.24Å; A165-M167 PolarHBondContact O-N 3.45Å; M167-D169 PolarHBondContact O-N 3.16Å; M167-S170 PolarHBondContact O-N 3.19Å; M167-S170 PolarHBondContact O-OG 3.06Å; M167-Q171 WeakPolarHBondContact O-CG 3.29Å; M167-Q171 PolarHBondContact O-N 3.14Å |
| 168 | V | 89.1 | Confident | 80.2 | Confident | 31 Ų | 31 | 88.5 Ų | 88.5 | 19% | 0.188 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -61.1 | -42.4 | 178.2 | 168.2 | 0 | 0 | 0 | 0 | 111.6 | T158 D164 A165 Q171 K172 | T158-V168 HydrophobicContact CG2-CG2 4.14Å; D164-V168 WeakPolarHBondContact O-CB 3.29Å; D164-V168 WeakPolarHBondContact O-CG2 3.34Å; D164-V168 PolarHBondContact O-N 3.44Å; A165-V168 PolarHBondContact O-N 3.34Å; V168-Q171 PolarHBondContact O-N 2.64Å; V168-K172 PolarHBondContact O-N 3.38Å |
| 169 | D | 89.1 | Confident | 78.4 | Confident | 86 Ų | 86 | 93.2 Ų | 93.2 | 46% | 0.46 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -72.1 | -35.7 | -179.9 | -77.8 | -12.3 | 0 | 0 | 0 | 113 | A165 M167 Q171 K172 C173 | A165-D169 WeakPolarHBondContact O-CB 2.98Å; A165-D169 PolarHBondContact O-N 3.02Å; M167-D169 PolarHBondContact O-N 3.16Å; D169-Q171 VanDerWaalsContact C-N 3.28Å; D169-Q171 PolarHBondContact O-N 3.32Å; D169-K172 PolarHBondContact O-N 3.32Å; D169-K172 WeakPolarHBondContact OD1-CE 3.23Å; D169-K172 IonicContact OD1-NZ 2.65Å; D169-K172 PolarHBondContact OD1-NZ 3.04Å; D169-C173 PolarHBondContact O-N 2.91Å |
| 170 | S | 87.7 | Confident | 76.9 | Confident | 57 Ų | 57 | 95.6 Ų | 95.6 | 40% | 0.399 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -59.5 | -39.9 | 171.6 | 71.6 | 0 | 0 | 0 | 0 | 111.9 | L166 M167 K172 C173 V176 | L166-S170 WeakPolarHBondContact O-CB 3.02Å; L166-S170 PolarHBondContact O-N 3.04Å; L166-S170 PolarHBondContact O-OG 3.21Å; M167-S170 PolarHBondContact O-N 3.19Å; M167-S170 PolarHBondContact O-OG 3.06Å; S170-K172 PolarHBondContact O-N 2.74Å; S170-C173 CarbonylContact O-C 3.09Å; S170-C173 PolarHBondContact O-N 2.88Å; S170-V176 WeakPolarHBondContact O-CG2 3.1Å |
| 171 | Q | 84.7 | Confident | 75.5 | Confident | 121 Ų | 121 | 95.2 Ų | 95.2 | 57% | 0.565 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -68.7 | -32.3 | 178 | -69.2 | 173.6 | 11.9 | 0 | 0 | 113 | M167 V168 D169 C173 S174 | M167-Q171 WeakPolarHBondContact O-CG 3.29Å; M167-Q171 PolarHBondContact O-N 3.14Å; V168-Q171 PolarHBondContact O-N 2.64Å; D169-Q171 VanDerWaalsContact C-N 3.28Å; D169-Q171 PolarHBondContact O-N 3.32Å; Q171-C173 PolarHBondContact O-N 3Å; Q171-S174 VanDerWaalsContact O-CB 3.3Å; Q171-S174 WeakPolarHBondContact O-CB 3.34Å; Q171-S174 PolarHBondContact O-N 3.42Å; Q171-S174 PolarHBondContact O-OG 3.19Å |
| 172 | K | 81.4 | Confident | 74.6 | Confident | 147 Ų | 147 | 95.3 Ų | 95.3 | 64% | 0.639 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -64.5 | -30.6 | 172.4 | -67.8 | 171.3 | -168.1 | 159.6 | 0 | 112 | V168 D169 S170 S174 | V168-K172 PolarHBondContact O-N 3.38Å; D169-K172 PolarHBondContact O-N 3.32Å; D169-K172 WeakPolarHBondContact OD1-CE 3.23Å; D169-K172 IonicContact OD1-NZ 2.65Å; D169-K172 PolarHBondContact OD1-NZ 3.04Å; S170-K172 PolarHBondContact O-N 2.74Å; K172-S174 PolarHBondContact O-N 3.29Å |
| 173 | C | 70.8 | Confident | 74 | Confident | 81 Ų | 81 | 93.4 Ų | 93.4 | 55% | 0.547 | 53% | 0.53 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -87.2 | 39.3 | 177.8 | -156.3 | 0 | 0 | 0 | 0 | 112 | D169 S170 Q171 D175 V176 | D169-C173 PolarHBondContact O-N 2.91Å; S170-C173 CarbonylContact O-C 3.09Å; S170-C173 PolarHBondContact O-N 2.88Å; Q171-C173 PolarHBondContact O-N 3Å; C173-D175 PolarHBondContact O-N 3.38Å; C173-V176 HydrophobicContact CB-CG1 4.37Å; C173-V176 WeakPolarHBondContact O-CG1 3.43Å; C173-V176 PolarHBondContact O-N 2.95Å |
| 174 | S | 55.7 | Low | 73.3 | Confident | 76 Ų | 76 | 88.6 Ų | 88.6 | 53% | 0.531 | 52% | 0.516 | S | S | . | . | G | 310 helix | trans | -63.5 | 6.4 | -160.7 | -0.2 | 0 | 0 | 0 | 0 | 117.9 | Q171 K172 V176 S177 | Q171-S174 VanDerWaalsContact O-CB 3.3Å; Q171-S174 WeakPolarHBondContact O-CB 3.34Å; Q171-S174 PolarHBondContact O-N 3.42Å; Q171-S174 PolarHBondContact O-OG 3.19Å; K172-S174 PolarHBondContact O-N 3.29Å; S174-V176 PolarHBondContact O-N 3.19Å; S174-S177 PolarHBondContact O-N 3.06Å |
| 175 | D | 53.5 | Low | 72.8 | Confident | 141 Ų | 141 | 87.5 Ų | 87.5 | 75% | 0.754 | 52% | 0.519 | S | S | * | . | G | 310 helix | trans | -57.5 | -16.2 | 152.6 | -144.9 | 22.7 | 0 | 0 | 0 | 111.4 | C173 S177 | C173-D175 PolarHBondContact O-N 3.38Å; D175-S177 VanDerWaalsContact C-N 3.29Å; D175-S177 PolarHBondContact O-N 3.33Å |
| 176 | V | 55.8 | Low | 72.6 | Confident | 51 Ų | 51 | 91.7 Ų | 91.7 | 31% | 0.309 | 54% | 0.544 | S | S | . | . | G | 310 helix | trans | -69.5 | -11.4 | 173.1 | -62.8 | 0 | 0 | 0 | 0 | 115.5 | S170 C173 S174 E178 L179 S180 | S170-V176 WeakPolarHBondContact O-CG2 3.1Å; C173-V176 HydrophobicContact CB-CG1 4.37Å; C173-V176 WeakPolarHBondContact O-CG1 3.43Å; C173-V176 PolarHBondContact O-N 2.95Å; S174-V176 PolarHBondContact O-N 3.19Å; V176-E178 PolarHBondContact O-N 3.4Å; V176-L179 HydrophobicContact CG1-CD1 4.27Å; V176-L179 PolarHBondContact O-N 3.21Å; V176-S180 PolarHBondContact O-N 3.39Å |
| 177 | S | 53.5 | Low | 72.5 | Confident | 102 Ų | 102 | 96 Ų | 96 | 71% | 0.713 | 55% | 0.554 | S | S | * | * | G | 310 helix | trans | -60.7 | -29.5 | 175.3 | -100 | 0 | 0 | 0 | 0 | 112.2 | S174 D175 L179 | S174-S177 PolarHBondContact O-N 3.06Å; D175-S177 VanDerWaalsContact C-N 3.29Å; D175-S177 PolarHBondContact O-N 3.33Å; S177-L179 VanDerWaalsContact C-N 3.3Å |
| 178 | E | 51.6 | Low | 72.5 | Confident | 121 Ų | 121 | 97.9 Ų | 97.9 | 57% | 0.565 | 56% | 0.562 | S | S | * | * | G | 310 helix | trans | -74.3 | -17.8 | 173.7 | -66.8 | -128 | 143.6 | 0 | 0 | 113.1 | V176 P184 | V176-E178 PolarHBondContact O-N 3.4Å; E178-P184 HydrophobicContact CB-CB 4.02Å; E178-P184 WeakPolarHBondContact O-CA 3.42Å; E178-P184 VanDerWaalsContact O-CB 3.23Å; E178-P184 WeakPolarHBondContact O-CB 3.43Å; E178-P184 VanDerWaalsContact O-CG 3.29Å; E178-P184 WeakPolarHBondContact O-CG 3.31Å |
| 179 | L | 53.7 | Low | 72.8 | Confident | 134 Ų | 134 | 106 Ų | 106 | 70% | 0.702 | 60% | 0.598 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.4 | -12.9 | -174.1 | -57.8 | -178.8 | 0 | 0 | 0 | 114.2 | V176 S177 S181 | V176-L179 HydrophobicContact CG1-CD1 4.27Å; V176-L179 PolarHBondContact O-N 3.21Å; S177-L179 VanDerWaalsContact C-N 3.3Å; L179-S181 VanDerWaalsContact C-N 3.32Å |
| 180 | S | 56.7 | Low | 73 | Confident | 119 Ų | 119 | 109.2 Ų | 109.2 | 83% | 0.832 | 61% | 0.61 | S | S | * | * | S | Bend | trans | -69.9 | -29.3 | -179.3 | -168.8 | 0 | 0 | 0 | 0 | 112.7 | V176 | V176-S180 PolarHBondContact O-N 3.39Š|
| 181 | S | 61.7 | Low | 73.1 | Confident | 53 Ų | 53 | 111.9 Ų | 111.9 | 37% | 0.371 | 63% | 0.626 | S | S | . | * | S | Bend | trans | -113 | 139 | 170.3 | 64.7 | 0 | 0 | 0 | 0 | 110.8 | L179 P183 | L179-S181 VanDerWaalsContact C-N 3.32Å; S181-P183 CarbonylContact C-O 3.56Å; S181-P183 WeakPolarHBondContact CB-O 3.02Å; S181-P183 CarbonylContact O-C 3.2Å; S181-P183 VanDerWaalsContact O-O 3.06Å; S181-P183 PolarHBondContact OG-O 3.47Å |
| 182 | S | 73.1 | Confident | 73.2 | Confident | 120 Ų | 120 | 112.9 Ų | 112.9 | 84% | 0.839 | 63% | 0.625 | S | S | * | * | S | Bend | trans | -113.7 | 111.9 | 163.7 | -178.2 | 0 | 0 | 0 | 0 | 107.5 | ||
| 183 | P | 78.1 | Confident | 73.5 | Confident | 59 Ų | 59 | 112.8 Ų | 112.8 | 38% | 0.383 | 63% | 0.63 | S | S | . | * | S | Bend | cis | -72.5 | 160 | 2.7 | 32.2 | -36.4 | 0 | 0 | 0 | 114 | S181 Y187 | S181-P183 CarbonylContact C-O 3.56Å; S181-P183 WeakPolarHBondContact CB-O 3.02Å; S181-P183 CarbonylContact O-C 3.2Å; S181-P183 VanDerWaalsContact O-O 3.06Å; S181-P183 PolarHBondContact OG-O 3.47Å; P183-Y187 HydrophobicContact CG-CE1 4.15Å |
| 184 | P | 78.1 | Confident | 74 | Confident | 70 Ų | 70 | 112.6 Ų | 112.6 | 46% | 0.455 | 63% | 0.63 | S | S | . | * | S | Bend | trans | -57.7 | 137.5 | 165.8 | -23.5 | 33.7 | 0 | 0 | 0 | 111.7 | E178 | E178-P184 HydrophobicContact CB-CB 4.02Å; E178-P184 WeakPolarHBondContact O-CA 3.42Å; E178-P184 VanDerWaalsContact O-CB 3.23Å; E178-P184 WeakPolarHBondContact O-CB 3.43Å; E178-P184 VanDerWaalsContact O-CG 3.29Å; E178-P184 WeakPolarHBondContact O-CG 3.31Å |
| 185 | G | 81.9 | Confident | 75.4 | Confident | 39 Ų | 39 | 114 Ų | 114 | 40% | 0.402 | 63% | 0.626 | S | S | . | * | S | Bend | trans | 76.2 | -178.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||
| 186 | P | 87.6 | Confident | 76.6 | Confident | 112 Ų | 112 | 111.2 Ų | 111.2 | 73% | 0.727 | 62% | 0.616 | S | S | * | * | trans | -76.1 | 148.1 | -178.5 | 31.6 | -35 | 0 | 0 | 0 | 112.2 | H188 | P186-H188 PolarHBondContact O-CD2 2.91Å; P186-H188 PolarHBondContact O-N 3.32Å | ||
| 187 | Y | 89.8 | Confident | 77.6 | Confident | 200 Ų | 200 | 116 Ų | 116 | 78% | 0.784 | 64% | 0.635 | S | S | * | * | trans | -61.3 | 126.3 | 169.4 | -71.2 | -87.9 | 0 | 0 | 0 | 111 | P183 | P183-Y187 HydrophobicContact CG-CE1 4.15Š| ||
| 188 | H | 89.8 | Confident | 78.7 | Confident | 136 Ų | 136 | 113.9 Ų | 113.9 | 63% | 0.63 | 61% | 0.614 | S | S | * | * | trans | -129.4 | 163.3 | 175.3 | 58.7 | 80.9 | 0 | 0 | 0 | 111.4 | P186 E190 | P186-H188 PolarHBondContact O-CD2 2.91Å; P186-H188 PolarHBondContact O-N 3.32Å; H188-E190 PolarHBondContact CE1-O 3.08Å; H188-E190 PolarHBondContact ND1-O 3.26Å | ||
| 189 | Q | 94.6 | Very high | 79.5 | Confident | 202 Ų | 202 | 117 Ų | 117 | 94% | 0.944 | 62% | 0.621 | S | S | * | * | trans | -98.3 | -5.9 | 176.6 | -64.8 | -175.9 | -2.9 | 0 | 0 | 113.2 | ||||
| 190 | E | 92.9 | Very high | 80.6 | Confident | 153 Ų | 153 | 119.6 Ų | 119.6 | 72% | 0.715 | 63% | 0.627 | S | S | * | * | S | Bend | trans | -66.2 | 129.3 | 177.3 | -60.6 | -171.2 | 169 | 0 | 0 | 110.5 | H188 | H188-E190 PolarHBondContact CE1-O 3.08Å; H188-E190 PolarHBondContact ND1-O 3.26Å |
| 191 | P | 89.9 | Confident | 82 | Confident | 112 Ų | 112 | 121.4 Ų | 121.4 | 73% | 0.727 | 62% | 0.619 | S | S | * | * | P | Polyproline II helix | trans | -71.6 | 141.2 | -179.8 | 29.5 | -34.6 | 0 | 0 | 0 | 111.1 | I193 | P191-I193 PolarHBondContact O-N 2.85Š|
| 192 | Y | 87.8 | Confident | 83.3 | Confident | 142 Ų | 142 | 123 Ų | 123 | 56% | 0.557 | 64% | 0.636 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 128.8 | 176.5 | -175.3 | -105.4 | 0 | 0 | 0 | 111.9 | E198 | Y192-E198 WeakPolarHBondContact CE1-OE2 3.4Å; Y192-E198 PolarHBondContact OH-OE1 3.32Å; Y192-E198 PolarHBondContact OH-OE2 3.07Å |
| 193 | I | 87.5 | Confident | 84.1 | Confident | 145 Ų | 145 | 122.8 Ų | 122.8 | 74% | 0.744 | 63% | 0.632 | S | S | * | * | trans | -95.9 | 111.6 | 178.1 | -57.6 | 175.8 | 0 | 0 | 0 | 108.9 | P191 K195 | P191-I193 PolarHBondContact O-N 2.85Å; I193-K195 PolarHBondContact O-N 3.16Å | ||
| 194 | S | 81.8 | Confident | 84.9 | Confident | 78 Ų | 78 | 126 Ų | 126 | 55% | 0.545 | 65% | 0.653 | S | S | . | * | trans | -59.3 | 118.7 | -177.9 | -50.8 | 0 | 0 | 0 | 0 | 113 | ||||
| 195 | K | 83.9 | Confident | 85.9 | Confident | 104 Ų | 104 | 130.3 Ų | 130.3 | 45% | 0.452 | 67% | 0.67 | S | S | . | * | trans | -70.2 | 150.5 | 178.1 | -63.1 | 174.6 | -172.3 | 164.8 | 0 | 111.4 | I193 E197 E198 R199 | I193-K195 PolarHBondContact O-N 3.16Å; K195-E197 VanDerWaalsContact C-N 3.26Å; K195-E197 PolarHBondContact O-N 2.98Å; K195-E198 HydrophobicContact CB-CG 4.24Å; K195-E198 PolarHBondContact N-OE2 3.45Å; K195-E198 PolarHBondContact O-N 3.07Å; K195-R199 PolarHBondContact O-N 2.79Å | ||
| 196 | P | 78 | Confident | 86.6 | Confident | 84 Ų | 84 | 133.4 Ų | 133.4 | 55% | 0.545 | 68% | 0.677 | S | S | . | * | G | 310 helix | trans | -55.8 | -38.3 | 177.8 | -25.5 | 35.2 | 0 | 0 | 0 | 113.6 | E198 R199 | P196-E198 PolarHBondContact O-N 2.7Å; P196-R199 PolarHBondContact O-N 3.48Å |
| 197 | E | 78.5 | Confident | 87.1 | Confident | 152 Ų | 152 | 131 Ų | 131 | 71% | 0.71 | 66% | 0.661 | S | S | * | * | G | 310 helix | trans | -64.1 | -23.6 | 177.5 | -64.4 | 128 | -138.9 | 0 | 0 | 113.9 | K195 | K195-E197 VanDerWaalsContact C-N 3.26Å; K195-E197 PolarHBondContact O-N 2.98Å |
| 198 | E | 76.3 | Confident | 87.4 | Confident | 57 Ų | 57 | 125.6 Ų | 125.6 | 27% | 0.266 | 65% | 0.651 | S | S | . | * | G | 310 helix | trans | -93.5 | -15.4 | -176.3 | -67.8 | 167.7 | 176.2 | 0 | 0 | 112.7 | Y192 K195 P196 F200 K201 | Y192-E198 WeakPolarHBondContact CE1-OE2 3.4Å; Y192-E198 PolarHBondContact OH-OE1 3.32Å; Y192-E198 PolarHBondContact OH-OE2 3.07Å; K195-E198 HydrophobicContact CB-CG 4.24Å; K195-E198 PolarHBondContact N-OE2 3.45Å; K195-E198 PolarHBondContact O-N 3.07Å; P196-E198 PolarHBondContact O-N 2.7Å; E198-F200 PolarHBondContact O-N 2.81Å; E198-K201 PolarHBondContact O-N 2.82Å |
| 199 | R | 68.7 | Low | 87.8 | Confident | 187 Ų | 187 | 123.2 Ų | 123.2 | 71% | 0.706 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.2 | -17.7 | -176.8 | -67.2 | -176.4 | -179.1 | -175.9 | 0.2 | 114.6 | K195 P196 | K195-R199 PolarHBondContact O-N 2.79Å; P196-R199 PolarHBondContact O-N 3.48Å |
| 200 | F | 75.2 | Confident | 87.9 | Confident | 188 Ų | 188 | 114.9 Ų | 114.9 | 83% | 0.825 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.4 | -0.6 | 179.4 | -55.5 | -74.8 | 0 | 0 | 0 | 113.6 | E198 A202 | E198-F200 PolarHBondContact O-N 2.81Å; F200-A202 PolarHBondContact O-N 3.47Å |
| 201 | K | 85.9 | Confident | 88.1 | Confident | 156 Ų | 156 | 113.2 Ų | 113.2 | 68% | 0.678 | 60% | 0.597 | S | S | * | * | trans | -85.8 | 108.2 | 175.9 | -63.9 | -176.7 | -176.8 | 175.5 | 0 | 109.3 | E198 | E198-K201 PolarHBondContact O-N 2.82Š| ||
| 202 | A | 89.3 | Confident | 88.4 | Confident | 88 Ų | 88 | 112.7 Ų | 112.7 | 73% | 0.727 | 59% | 0.585 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 148.7 | 169.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | F200 | F200-A202 PolarHBondContact O-N 3.47Š|
| 203 | P | 91.5 | Very high | 88.7 | Confident | 114 Ų | 114 | 107.4 Ų | 107.4 | 74% | 0.74 | 57% | 0.567 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 153.3 | 171.7 | 27.8 | -35.1 | 0 | 0 | 0 | 110.8 | ||
| 204 | P | 94.8 | Very high | 89.1 | Confident | 127 Ų | 127 | 100.8 Ų | 100.8 | 83% | 0.825 | 53% | 0.533 | S | S | * | . | P | Polyproline II helix | trans | -61 | 143.2 | 179 | 26.3 | -34.7 | 0 | 0 | 0 | 111.4 | ||
| 205 | I | 97.5 | Very high | 89.8 | Confident | 160 Ų | 160 | 100.4 Ų | 100.4 | 82% | 0.821 | 53% | 0.525 | S | S | * | . | P | Polyproline II helix | trans | -64.6 | 134.8 | 176.8 | -59.2 | 172 | 0 | 0 | 0 | 109.1 | P207 | I205-P207 WeakPolarHBondContact O-CD 3.34Š|
| 206 | L | 97.1 | Very high | 90.4 | Very high | 104 Ų | 104 | 101.2 Ų | 101.2 | 55% | 0.545 | 53% | 0.534 | S | S | . | . | P | Polyproline II helix | trans | -56.3 | 121.5 | 177.9 | 179.5 | 66.8 | 0 | 0 | 0 | 111 | L210 L211 | L206-L210 HydrophobicContact CD1-CB 4.44Å; L206-L210 HydrophobicContact CD1-CD1 4.01Å; L206-L211 HydrophobicContact CD2-CD2 3.77Å; L206-L211 HydrophobicContact CD2-CG 4.33Å |
| 207 | P | 97.8 | Very high | 91.1 | Very high | 62 Ų | 62 | 101.8 Ų | 101.8 | 40% | 0.403 | 53% | 0.528 | S | S | . | . | P | Polyproline II helix | trans | -62.7 | 126.6 | 176.4 | -24.8 | 35.4 | 0 | 0 | 0 | 111.2 | I205 H209 L210 | I205-P207 WeakPolarHBondContact O-CD 3.34Å; P207-H209 PolarHBondContact O-N 3.06Å; P207-L210 PolarHBondContact O-N 3.37Å |
| 208 | P | 97.6 | Very high | 91.7 | Very high | 87 Ų | 87 | 102.5 Ų | 102.5 | 57% | 0.565 | 54% | 0.537 | S | S | * | . | G | 310 helix | trans | -64.7 | -18.2 | -173.2 | 25.2 | -35.1 | 0 | 0 | 0 | 113.6 | L210 L211 | P208-L210 PolarHBondContact O-N 2.93Å; P208-L211 WeakPolarHBondContact O-CB 3.37Å; P208-L211 PolarHBondContact O-N 3.1Å; P208-L211 VanDerWaalsContact O-N 3.16Å |
| 209 | H | 97.3 | Very high | 92.3 | Very high | 86 Ų | 86 | 102.6 Ų | 102.6 | 40% | 0.398 | 54% | 0.541 | S | S | . | . | G | 310 helix | trans | -57.4 | -34.2 | 172.4 | -61.1 | 104.3 | 0 | 0 | 0 | 113 | P207 L211 Q212 | P207-H209 PolarHBondContact O-N 3.06Å; H209-L211 PolarHBondContact O-N 3.45Å; H209-Q212 PolarHBondContact O-N 2.89Å |
| 210 | L | 97.4 | Very high | 93.2 | Very high | 27 Ų | 27 | 95.9 Ų | 95.9 | 14% | 0.141 | 53% | 0.53 | C | S | . | . | G | 310 helix | trans | -71.9 | -16.7 | -179.4 | -60.5 | -177.1 | 0 | 0 | 0 | 112.9 | L206 P207 P208 Q212 M235 H238 Y240 | L206-L210 HydrophobicContact CD1-CB 4.44Å; L206-L210 HydrophobicContact CD1-CD1 4.01Å; P207-L210 PolarHBondContact O-N 3.37Å; P208-L210 PolarHBondContact O-N 2.93Å; L210-Q212 VanDerWaalsContact C-N 3.31Å; L210-M235 HydrophobicContact CD2-CB 4.39Å; L210-H238 HydrophobicContact CD2-CB 4.46Å; L210-Y240 WeakPolarHBondContact O-CE1 3.43Å; L210-Y240 PolarHBondContact O-OH 3.38Å |
| 211 | L | 96.9 | Very high | 93.8 | Very high | 118 Ų | 118 | 95.7 Ų | 95.7 | 62% | 0.618 | 54% | 0.536 | S | S | * | . | G | 310 helix | trans | -79 | -12.8 | 175 | -57.5 | 174.8 | 0 | 0 | 0 | 112.8 | L206 P208 H209 V213 | L206-L211 HydrophobicContact CD2-CD2 3.77Å; L206-L211 HydrophobicContact CD2-CG 4.33Å; P208-L211 WeakPolarHBondContact O-CB 3.37Å; P208-L211 PolarHBondContact O-N 3.1Å; P208-L211 VanDerWaalsContact O-N 3.16Å; H209-L211 PolarHBondContact O-N 3.45Å; L211-V213 VanDerWaalsContact C-N 3.25Å; L211-V213 PolarHBondContact O-N 2.84Å |
| 212 | Q | 94.6 | Very high | 94.1 | Very high | 100 Ų | 100 | 94.3 Ų | 94.3 | 47% | 0.467 | 55% | 0.546 | S | S | . | . | S | Bend | trans | -85.3 | 55.7 | -176.3 | -59 | -172 | 8.3 | 0 | 0 | 112.8 | H209 L210 I214 M235 | H209-Q212 PolarHBondContact O-N 2.89Å; L210-Q212 VanDerWaalsContact C-N 3.31Å; Q212-I214 PolarHBondContact O-N 2.95Å; Q212-M235 WeakPolarHBondContact O-CE 3.42Å |
| 213 | V | 95.5 | Very high | 94.2 | Very high | 32 Ų | 32 | 92.6 Ų | 92.6 | 19% | 0.194 | 53% | 0.528 | C | S | . | . | trans | -50.1 | 119.8 | -174.9 | -171.2 | 0 | 0 | 0 | 0 | 111.8 | L211 L215 N216 Y240 | L211-V213 VanDerWaalsContact C-N 3.25Å; L211-V213 PolarHBondContact O-N 2.84Å; V213-L215 VanDerWaalsContact C-N 3.34Å; V213-L215 HydrophobicContact CG1-CB 4.48Å; V213-L215 PolarHBondContact O-N 2.88Å; V213-N216 HydrophobicContact CB-CB 4.08Å; V213-N216 HydrophobicContact CG1-CB 4.38Å; V213-N216 PolarHBondContact O-N 3.1Å; V213-Y240 HydrophobicContact CB-CD1 4.45Å; V213-Y240 HydrophobicContact CB-CE1 4.42Å; V213-Y240 HydrophobicContact CG1-CD1 4.02Å; V213-Y240 HydrophobicContact CG1-CE1 4.41Å; V213-Y240 HydrophobicContact CG1-CG 4.43Å; V213-Y240 HydrophobicContact CG2-CD1 3.86Å; V213-Y240 HydrophobicContact CG2-CE1 3.78Å | ||
| 214 | I | 95.9 | Very high | 94.4 | Very high | 5 Ų | 5 | 91.7 Ų | 91.7 | 3% | 0.026 | 52% | 0.517 | C | S | . | . | G | 310 helix | trans | -64.6 | -36 | -175.6 | -172.6 | 165.4 | 0 | 0 | 0 | 113.2 | Q212 N216 K217 L228 P229 P231 M235 T263 | Q212-I214 PolarHBondContact O-N 2.95Å; I214-N216 PolarHBondContact O-N 3.01Å; I214-K217 PolarHBondContact O-N 3.43Å; I214-L228 HydrophobicContact CD1-CB 4.04Å; I214-L228 HydrophobicContact CD1-CD1 4.41Å; I214-L228 HydrophobicContact CG1-CB 4.32Å; I214-L228 HydrophobicContact CG1-CD1 4.45Å; I214-P229 HydrophobicContact CD1-CG 4.43Å; I214-P229 VanDerWaalsContact CD1-O 3.32Å; I214-P229 WeakPolarHBondContact CD1-O 3.44Å; I214-P229 HydrophobicContact CG1-CG 4.17Å; I214-P231 HydrophobicContact CD1-CB 4Å; I214-M235 HydrophobicContact CB-CE 4.31Å; I214-M235 HydrophobicContact CB-SD 4.21Å; I214-M235 HydrophobicContact CG2-SD 4.39Å; I214-T263 HydrophobicContact CG2-CG2 4.44Å |
| 215 | L | 96.3 | Very high | 94.4 | Very high | 71 Ų | 71 | 91.3 Ų | 91.3 | 37% | 0.372 | 52% | 0.515 | S | S | . | . | G | 310 helix | trans | -74.7 | -10.5 | 178.7 | -63.2 | 177.7 | 0 | 0 | 0 | 113.9 | V213 L228 T263 L265 | V213-L215 VanDerWaalsContact C-N 3.34Å; V213-L215 HydrophobicContact CG1-CB 4.48Å; V213-L215 PolarHBondContact O-N 2.88Å; L215-L228 HydrophobicContact CD2-CD1 3.85Å; L215-L228 HydrophobicContact CD2-CD2 4.19Å; L215-T263 HydrophobicContact CD1-CG2 4.05Å; L215-T263 HydrophobicContact CD2-CG2 3.91Å; L215-T263 HydrophobicContact CG-CG2 4.05Å; L215-L265 HydrophobicContact CD1-CD1 3.96Å; L215-L265 HydrophobicContact CD1-CD2 4.3Å; L215-L265 HydrophobicContact CD1-CG 4.2Å; L215-L265 HydrophobicContact CD2-CD1 4.42Å |
| 216 | N | 95.5 | Very high | 94.2 | Very high | 120 Ų | 120 | 87.7 Ų | 87.7 | 64% | 0.642 | 51% | 0.508 | S | S | * | . | G | 310 helix | trans | -96.7 | 7.3 | 175.5 | -62.9 | 3.1 | 0 | 0 | 0 | 111.9 | V213 I214 | V213-N216 HydrophobicContact CB-CB 4.08Å; V213-N216 HydrophobicContact CG1-CB 4.38Å; V213-N216 PolarHBondContact O-N 3.1Å; I214-N216 PolarHBondContact O-N 3.01Å |
| 217 | K | 92.7 | Very high | 94.2 | Very high | 96 Ų | 96 | 87.6 Ų | 87.6 | 42% | 0.417 | 51% | 0.508 | S | S | . | . | S | Bend | trans | -97.8 | 125.1 | 176.6 | -63.7 | -177 | -179.4 | -177.7 | 0 | 109.3 | I214 P229 | I214-K217 PolarHBondContact O-N 3.43Å; K217-P229 HydrophobicContact CD-CG 4.38Å |
| 218 | D | 91.3 | Very high | 94.1 | Very high | 168 Ų | 168 | 88 Ų | 88 | 90% | 0.898 | 51% | 0.506 | S | S | * | . | P | Polyproline II helix | trans | -62.6 | 135.5 | 172 | -60.1 | -57.7 | 0 | 0 | 0 | 110.7 | ||
| 219 | T | 89.5 | Confident | 94 | Very high | 58 Ų | 58 | 86.5 Ų | 86.5 | 36% | 0.356 | 50% | 0.497 | S | S | . | . | P | Polyproline II helix | trans | -98.3 | 155.3 | 170.8 | 53.6 | 0 | 0 | 0 | 0 | 110 | I221 | T219-I221 PolarHBondContact O-N 2.97Š|
| 220 | G | 88 | Confident | 94 | Very high | 46 Ų | 46 | 89.3 Ų | 89.3 | 47% | 0.474 | 51% | 0.51 | S | S | . | . | P | Polyproline II helix | trans | -66.6 | 132.6 | -179.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | S222 C223 | G220-S222 PolarHBondContact O-N 3.14Å; G220-C223 PolarHBondContact O-N 2.89Å; G220-C223 PolarHBondContact O-SG 3.36Å |
| 221 | I | 88.4 | Confident | 94 | Very high | 184 Ų | 184 | 88.6 Ų | 88.6 | 94% | 0.944 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.9 | -19.4 | -176.5 | -56 | 164.5 | 0 | 0 | 0 | 112.9 | T219 | T219-I221 PolarHBondContact O-N 2.97Š|
| 222 | S | 91.8 | Very high | 94 | Very high | 127 Ų | 127 | 86.1 Ų | 86.1 | 89% | 0.888 | 49% | 0.494 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.5 | -4.7 | 178.4 | 60.7 | 0 | 0 | 0 | 0 | 115.8 | G220 | G220-S222 PolarHBondContact O-N 3.14Š|
| 223 | C | 91.6 | Very high | 94.2 | Very high | 53 Ų | 53 | 87.6 Ų | 87.6 | 36% | 0.358 | 50% | 0.501 | S | S | . | . | S | Bend | trans | -102.6 | 163 | 176.8 | 69.7 | 0 | 0 | 0 | 0 | 112.8 | G220 | G220-C223 PolarHBondContact O-N 2.89Å; G220-C223 PolarHBondContact O-SG 3.36Å |
| 224 | D | 94.6 | Very high | 94.3 | Very high | 94 Ų | 94 | 88.8 Ų | 88.8 | 50% | 0.503 | 51% | 0.508 | S | S | . | . | trans | -58.2 | 127.6 | 174.5 | 179.5 | -25.6 | 0 | 0 | 0 | 110.3 | A226 L227 | D224-A226 PolarHBondContact O-N 3.16Å; D224-A226 VanDerWaalsContact O-N 3.12Å; D224-A226 WeakPolarHBondContact OD1-CB 3.47Å; D224-A226 PolarHBondContact OD1-N 3.21Å; D224-L227 HydrophobicContact CB-CD1 3.87Å; D224-L227 HydrophobicContact CB-CG 3.94Å; D224-L227 WeakPolarHBondContact O-CB 3.41Å; D224-L227 PolarHBondContact O-N 3.33Å | ||
| 225 | P | 94.1 | Very high | 94.4 | Very high | 120 Ų | 120 | 88.9 Ų | 88.9 | 78% | 0.779 | 51% | 0.508 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.5 | -20.1 | -179.9 | -26 | 35.2 | 0 | 0 | 0 | 115.6 | L227 | P225-L227 VanDerWaalsContact C-N 3.33Š|
| 226 | A | 95.1 | Very high | 94.4 | Very high | 83 Ų | 83 | 86.2 Ų | 86.2 | 69% | 0.686 | 50% | 0.495 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.2 | -9.3 | 176 | 0 | 0 | 0 | 0 | 0 | 113.4 | D224 | D224-A226 PolarHBondContact O-N 3.16Å; D224-A226 VanDerWaalsContact O-N 3.12Å; D224-A226 WeakPolarHBondContact OD1-CB 3.47Å; D224-A226 PolarHBondContact OD1-N 3.21Å |
| 227 | L | 95.9 | Very high | 94.6 | Very high | 103 Ų | 103 | 86.2 Ų | 86.2 | 54% | 0.539 | 50% | 0.495 | S | S | . | . | trans | -85.6 | 133.1 | 177.6 | -64.9 | 176.2 | 0 | 0 | 0 | 111.4 | D224 P225 | D224-L227 HydrophobicContact CB-CD1 3.87Å; D224-L227 HydrophobicContact CB-CG 3.94Å; D224-L227 WeakPolarHBondContact O-CB 3.41Å; D224-L227 PolarHBondContact O-N 3.33Å; P225-L227 VanDerWaalsContact C-N 3.33Å | ||
| 228 | L | 96.4 | Very high | 94.8 | Very high | 69 Ų | 69 | 85.5 Ų | 85.5 | 36% | 0.361 | 49% | 0.493 | S | S | . | . | trans | -114.5 | 155 | 173.4 | -65.7 | 175.4 | 0 | 0 | 0 | 109.9 | I214 L215 T263 | I214-L228 HydrophobicContact CD1-CB 4.04Å; I214-L228 HydrophobicContact CD1-CD1 4.41Å; I214-L228 HydrophobicContact CG1-CB 4.32Å; I214-L228 HydrophobicContact CG1-CD1 4.45Å; L215-L228 HydrophobicContact CD2-CD1 3.85Å; L215-L228 HydrophobicContact CD2-CD2 4.19Å; L228-T263 HydrophobicContact CD1-CG2 4.26Å; L228-T263 WeakPolarHBondContact CD1-OG1 3.49Å | ||
| 229 | P | 95.8 | Very high | 95.2 | Very high | 57 Ų | 57 | 83.2 Ų | 83.2 | 37% | 0.37 | 48% | 0.48 | S | S | . | . | P | Polyproline II helix | trans | -63.5 | 164.6 | 172.3 | 28.6 | -36.1 | 0 | 0 | 0 | 111.7 | I214 K217 P231 | I214-P229 HydrophobicContact CD1-CG 4.43Å; I214-P229 VanDerWaalsContact CD1-O 3.32Å; I214-P229 WeakPolarHBondContact CD1-O 3.44Å; I214-P229 HydrophobicContact CG1-CG 4.17Å; K217-P229 HydrophobicContact CD-CG 4.38Å; P229-P231 WeakPolarHBondContact O-CD 3.47Å |
| 230 | E | 96.8 | Very high | 95.6 | Very high | 145 Ų | 145 | 82.1 Ų | 82.1 | 68% | 0.678 | 47% | 0.469 | S | S | * | . | P | Polyproline II helix | trans | -64.2 | 125.9 | 177 | -175.5 | 165.6 | -164.5 | 0 | 0 | 111.3 | Y261 | E230-Y261 HydrophobicContact CG-CD2 4.4Å; E230-Y261 HydrophobicContact CG-CE2 3.74Å; E230-Y261 VanDerWaalsContact OE1-CE2 3.31Å; E230-Y261 WeakPolarHBondContact OE1-CE2 3.43Å; E230-Y261 PolarHBondContact OE1-OH 3.45Å |
| 231 | P | 97.4 | Very high | 96 | Very high | 12 Ų | 12 | 83.3 Ų | 83.3 | 8% | 0.078 | 47% | 0.474 | C | S | . | . | P | Polyproline II helix | trans | -74.7 | 149.1 | 176.3 | 30.4 | -35.9 | 0 | 0 | 0 | 111.8 | I214 P229 M235 L236 T254 Y261 | I214-P231 HydrophobicContact CD1-CB 4Å; P229-P231 WeakPolarHBondContact O-CD 3.47Å; P231-M235 HydrophobicContact CB-CG 4.23Å; P231-M235 HydrophobicContact CB-SD 3.78Å; P231-L236 HydrophobicContact CB-CD2 4.14Å; P231-L236 HydrophobicContact CG-CD2 3.91Å; P231-T254 HydrophobicContact CB-CG2 4.3Å; P231-T254 HydrophobicContact CG-CG2 4.07Å; P231-Y261 HydrophobicContact CG-CD1 3.65Å; P231-Y261 HydrophobicContact CG-CD2 3.9Å; P231-Y261 HydrophobicContact CG-CE1 4.11Å; P231-Y261 HydrophobicContact CG-CE2 4.34Å; P231-Y261 HydrophobicContact CG-CG 3.52Å |
| 232 | N | 97.4 | Very high | 96.4 | Very high | 65 Ų | 65 | 79.6 Ų | 79.6 | 35% | 0.348 | 46% | 0.456 | S | S | . | . | P | Polyproline II helix | trans | -67.7 | 134.6 | 166 | -173.7 | -29.6 | 0 | 0 | 0 | 109.2 | V234 M235 | N232-V234 PolarHBondContact O-N 3.28Å; N232-V234 PolarHBondContact OD1-N 3.1Å; N232-V234 VanDerWaalsContact OD1-N 3.14Å; N232-M235 HydrophobicContact CB-CG 4.47Å; N232-M235 WeakPolarHBondContact O-CG 3.32Å; N232-M235 PolarHBondContact O-N 2.79Å |
| 233 | H | 97.8 | Very high | 96.7 | Very high | 131 Ų | 131 | 78.7 Ų | 78.7 | 61% | 0.606 | 45% | 0.449 | S | S | * | . | G | 310 helix | trans | -55.2 | -28.4 | -179.1 | 71.1 | -86.3 | 0 | 0 | 0 | 113.9 | M235 L236 | H233-M235 VanDerWaalsContact C-N 3.35Å; H233-M235 PolarHBondContact O-N 2.82Å; H233-L236 HydrophobicContact CB-CD1 4.38Å; H233-L236 WeakPolarHBondContact O-CB 3.49Å; H233-L236 WeakPolarHBondContact O-CG 3.42Å; H233-L236 PolarHBondContact O-N 2.72Å |
| 234 | V | 98 | Very high | 96.9 | Very high | 57 Ų | 57 | 80.8 Ų | 80.8 | 35% | 0.345 | 46% | 0.456 | S | S | . | . | G | 310 helix | trans | -69.5 | -25.1 | 179.6 | -177.7 | 0 | 0 | 0 | 0 | 113.3 | N232 H238 | N232-V234 PolarHBondContact O-N 3.28Å; N232-V234 PolarHBondContact OD1-N 3.1Å; N232-V234 VanDerWaalsContact OD1-N 3.14Å; V234-H238 PolarHBondContact O-CD2 2.9Å; V234-H238 PolarHBondContact O-NE2 2.86Å |
| 235 | M | 97.3 | Very high | 97 | Very high | 7 Ų | 7 | 83.4 Ų | 83.4 | 3% | 0.034 | 46% | 0.463 | C | S | . | . | G | 310 helix | trans | -88.2 | -3.4 | 177.9 | 61.7 | 144.9 | 41.5 | 0 | 0 | 114.1 | L210 Q212 I214 P231 N232 H233 H238 | L210-M235 HydrophobicContact CD2-CB 4.39Å; Q212-M235 WeakPolarHBondContact O-CE 3.42Å; I214-M235 HydrophobicContact CB-CE 4.31Å; I214-M235 HydrophobicContact CB-SD 4.21Å; I214-M235 HydrophobicContact CG2-SD 4.39Å; P231-M235 HydrophobicContact CB-CG 4.23Å; P231-M235 HydrophobicContact CB-SD 3.78Å; N232-M235 HydrophobicContact CB-CG 4.47Å; N232-M235 WeakPolarHBondContact O-CG 3.32Å; N232-M235 PolarHBondContact O-N 2.79Å; H233-M235 VanDerWaalsContact C-N 3.35Å; H233-M235 PolarHBondContact O-N 2.82Å; M235-H238 PolarHBondContact O-N 3.11Å |
| 236 | L | 97.9 | Very high | 97 | Very high | 16 Ų | 16 | 85.5 Ų | 85.5 | 8% | 0.084 | 47% | 0.468 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -68.8 | 147.1 | 179.3 | -58.5 | 175.4 | 0 | 0 | 0 | 110.2 | P231 H233 H238 T254 R256 Y261 | P231-L236 HydrophobicContact CB-CD2 4.14Å; P231-L236 HydrophobicContact CG-CD2 3.91Å; H233-L236 HydrophobicContact CB-CD1 4.38Å; H233-L236 WeakPolarHBondContact O-CB 3.49Å; H233-L236 WeakPolarHBondContact O-CG 3.42Å; H233-L236 PolarHBondContact O-N 2.72Å; L236-H238 PolarHBondContact O-CD2 2.98Å; L236-H238 PolarHBondContact O-N 2.88Å; L236-T254 WeakPolarHBondContact CA-O 3.39Å; L236-T254 HydrophobicContact CD2-CG2 3.6Å; L236-R256 HydrophobicContact CD1-CB 4.24Å; L236-Y261 HydrophobicContact CD1-CD1 4.16Å; L236-Y261 HydrophobicContact CD1-CE1 3.92Å; L236-Y261 HydrophobicContact CD2-CD1 3.96Å; L236-Y261 HydrophobicContact CD2-CE1 4.43Å |
| 237 | N | 98 | Very high | 97 | Very high | 120 Ų | 120 | 83.6 Ų | 83.6 | 64% | 0.642 | 46% | 0.456 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 63 | 1.8 | -176.7 | -42.3 | -34.8 | 0 | 0 | 0 | 115.2 | T254 H255 | N237-T254 PolarHBondContact N-O 2.94Å; N237-H255 PolarHBondContact OD1-CD2 3.29Å |
| 238 | H | 98.3 | Very high | 97.1 | Very high | 81 Ų | 81 | 80.9 Ų | 80.9 | 38% | 0.375 | 44% | 0.443 | S | S | . | . | trans | -80.3 | 137.6 | 169.8 | -74.1 | -90.6 | 0 | 0 | 0 | 111.1 | L210 V234 M235 L236 Y240 | L210-H238 HydrophobicContact CD2-CB 4.46Å; V234-H238 PolarHBondContact O-CD2 2.9Å; V234-H238 PolarHBondContact O-NE2 2.86Å; M235-H238 PolarHBondContact O-N 3.11Å; L236-H238 PolarHBondContact O-CD2 2.98Å; L236-H238 PolarHBondContact O-N 2.88Å; H238-Y240 HydrophobicContact CB-CE2 4.18Å | ||
| 239 | L | 98.3 | Very high | 97.2 | Very high | 119 Ų | 119 | 80.5 Ų | 80.5 | 62% | 0.623 | 44% | 0.441 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -83.4 | 125.5 | 177.5 | -172.7 | 69.9 | 0 | 0 | 0 | 110.6 | L251 | L239-L251 HydrophobicContact CD1-CB 4.17Å; L239-L251 HydrophobicContact CD1-CD2 4.41Å; L239-L251 HydrophobicContact CD2-CD2 4.35Å |
| 240 | Y | 98.1 | Very high | 97.3 | Very high | 36 Ų | 36 | 78.8 Ų | 78.8 | 14% | 0.141 | 43% | 0.429 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.4 | 142.9 | 167.9 | -65.9 | -84.1 | 0 | 0 | 0 | 109 | L210 V213 H238 S252 | L210-Y240 WeakPolarHBondContact O-CE1 3.43Å; L210-Y240 PolarHBondContact O-OH 3.38Å; V213-Y240 HydrophobicContact CB-CD1 4.45Å; V213-Y240 HydrophobicContact CB-CE1 4.42Å; V213-Y240 HydrophobicContact CG1-CD1 4.02Å; V213-Y240 HydrophobicContact CG1-CE1 4.41Å; V213-Y240 HydrophobicContact CG1-CG 4.43Å; V213-Y240 HydrophobicContact CG2-CD1 3.86Å; V213-Y240 HydrophobicContact CG2-CE1 3.78Å; H238-Y240 HydrophobicContact CB-CE2 4.18Å; Y240-S252 PolarHBondContact N-O 3.12Å; Y240-S252 PolarHBondContact O-N 2.83Å; Y240-S252 VanDerWaalsContact O-O 3.14Å |
| 241 | A | 97.8 | Very high | 97.4 | Very high | 70 Ų | 70 | 74.1 Ų | 74.1 | 58% | 0.579 | 41% | 0.408 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -137.6 | 144.9 | 179.7 | 0 | 0 | 0 | 0 | 0 | 110.3 | V250 L251 | A241-V250 WeakPolarHBondContact CA-O 3.39Å; A241-L251 HydrophobicContact CB-CD2 3.69Å |
| 242 | L | 97.1 | Very high | 97.4 | Very high | 107 Ų | 107 | 74 Ų | 74 | 56% | 0.56 | 41% | 0.408 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -87.9 | 153.5 | 164.6 | -65 | 175.9 | 0 | 0 | 0 | 109.6 | I244 V250 | L242-I244 PolarHBondContact O-N 3.13Å; L242-V250 HydrophobicContact CB-CB 4.29Å; L242-V250 HydrophobicContact CD1-CB 4.25Å; L242-V250 HydrophobicContact CD1-CG1 4.25Å; L242-V250 PolarHBondContact N-O 2.9Å; L242-V250 VanDerWaalsContact N-O 3.1Å |
| 243 | S | 97 | Very high | 97.4 | Very high | 107 Ų | 107 | 71.6 Ų | 71.6 | 75% | 0.748 | 40% | 0.397 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -56.4 | 128 | 167.6 | -52.4 | 0 | 0 | 0 | 0 | 109.8 | K245 | S243-K245 PolarHBondContact O-N 3.08Å |
| 244 | I | 96.6 | Very high | 97.5 | Very high | 97 Ų | 97 | 65.4 Ų | 65.4 | 50% | 0.497 | 37% | 0.368 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -55.3 | 133.1 | 179 | -64.2 | 157.8 | 0 | 0 | 0 | 109.8 | L242 M249 I270 | L242-I244 PolarHBondContact O-N 3.13Å; I244-M249 HydrophobicContact CD1-CE 4.27Å; I244-M249 HydrophobicContact CG1-CB 4.41Å; I244-M249 HydrophobicContact CG1-CG 4.37Å; I244-I270 HydrophobicContact CB-CD1 4.34Å; I244-I270 HydrophobicContact CD1-CD1 3.57Å; I244-I270 HydrophobicContact CG1-CD1 3.85Å; I244-I270 HydrophobicContact CG2-CD1 3.53Å |
| 245 | K | 95.5 | Very high | 97.5 | Very high | 150 Ų | 150 | 67 Ų | 67 | 65% | 0.652 | 37% | 0.372 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -140.2 | 148.3 | 174.8 | -67.9 | -176.9 | -178 | -178.9 | 0 | 109.4 | S243 G247 V248 | S243-K245 PolarHBondContact O-N 3.08Å; K245-G247 PolarHBondContact O-N 3.24Å; K245-V248 PolarHBondContact N-O 2.89Å; K245-V248 PolarHBondContact O-N 3.09Å |
| 246 | D | 95.3 | Very high | 97.6 | Very high | 164 Ų | 164 | 72.3 Ų | 72.3 | 88% | 0.877 | 39% | 0.391 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.5 | 34.5 | 172.7 | -48.9 | -43.2 | 0 | 0 | 0 | 114.7 | V248 | D246-V248 VanDerWaalsContact C-N 3.28Å; D246-V248 PolarHBondContact O-N 3.43Å |
| 247 | G | 95.5 | Very high | 97.6 | Very high | 42 Ų | 42 | 78.9 Ų | 78.9 | 43% | 0.433 | 42% | 0.416 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 75.2 | 8.2 | -178.9 | 0 | 0 | 0 | 0 | 0 | 115.3 | K245 P269 I270 | K245-G247 PolarHBondContact O-N 3.24Å; G247-P269 WeakPolarHBondContact O-CA 3.45Å; G247-I270 PolarHBondContact O-N 2.93Å |
| 248 | V | 97.4 | Very high | 97.5 | Very high | 46 Ų | 46 | 81 Ų | 81 | 28% | 0.279 | 42% | 0.42 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.4 | 128.1 | -177.4 | -176.2 | 0 | 0 | 0 | 0 | 111.2 | K245 D246 V250 Y267 | K245-V248 PolarHBondContact N-O 2.89Å; K245-V248 PolarHBondContact O-N 3.09Å; D246-V248 VanDerWaalsContact C-N 3.28Å; D246-V248 PolarHBondContact O-N 3.43Å; V248-V250 HydrophobicContact CG1-CG2 4.43Å; V248-Y267 HydrophobicContact CG1-CD1 4.11Å |
| 249 | M | 97.4 | Very high | 97.5 | Very high | 62 Ų | 62 | 86.6 Ų | 86.6 | 31% | 0.305 | 44% | 0.443 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.3 | 135.1 | 166.7 | -170.3 | -177.1 | -68.1 | 0 | 0 | 109.7 | I244 L251 Y267 K268 I270 | I244-M249 HydrophobicContact CD1-CE 4.27Å; I244-M249 HydrophobicContact CG1-CB 4.41Å; I244-M249 HydrophobicContact CG1-CG 4.37Å; M249-L251 HydrophobicContact CG-CD2 4.05Å; M249-L251 HydrophobicContact CG-CG 4.04Å; M249-L251 HydrophobicContact SD-CD1 3.91Å; M249-L251 HydrophobicContact SD-CD2 3.94Å; M249-L251 HydrophobicContact SD-CG 3.93Å; M249-Y267 WeakPolarHBondContact O-CA 3.48Å; M249-K268 PolarHBondContact N-O 3.3Å; M249-K268 PolarHBondContact O-N 3.26Å; M249-I270 HydrophobicContact CB-CD1 4.05Å; M249-I270 HydrophobicContact CB-CG1 4.08Å; M249-I270 HydrophobicContact CE-CD1 4.08Å; M249-I270 HydrophobicContact CE-CG1 4.47Å |
| 250 | V | 98.2 | Very high | 97.5 | Very high | 21 Ų | 21 | 88.4 Ų | 88.4 | 13% | 0.127 | 45% | 0.446 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.9 | 116.4 | 173.9 | -168.6 | 0 | 0 | 0 | 0 | 109.3 | A241 L242 V248 L266 Y267 | A241-V250 WeakPolarHBondContact CA-O 3.39Å; L242-V250 HydrophobicContact CB-CB 4.29Å; L242-V250 HydrophobicContact CD1-CB 4.25Å; L242-V250 HydrophobicContact CD1-CG1 4.25Å; L242-V250 PolarHBondContact N-O 2.9Å; L242-V250 VanDerWaalsContact N-O 3.1Å; V248-V250 HydrophobicContact CG1-CG2 4.43Å; V250-L266 WeakPolarHBondContact CA-O 3.44Å; V250-Y267 HydrophobicContact CB-CD1 4.45Å; V250-Y267 HydrophobicContact CB-CE1 4.31Å; V250-Y267 HydrophobicContact CG1-CD1 4.2Å; V250-Y267 HydrophobicContact CG1-CD2 4.3Å; V250-Y267 HydrophobicContact CG1-CE1 3.83Å; V250-Y267 HydrophobicContact CG1-CE2 3.94Å; V250-Y267 HydrophobicContact CG1-CG 4.41Å; V250-Y267 HydrophobicContact CG2-CD1 3.53Å; V250-Y267 HydrophobicContact CG2-CE1 3.45Å; V250-Y267 VanDerWaalsContact CG2-CE1 3.45Å; V250-Y267 HydrophobicContact CG2-CG 4.33Å |
| 251 | L | 98.1 | Very high | 97.5 | Very high | 46 Ų | 46 | 89.8 Ų | 89.8 | 24% | 0.241 | 45% | 0.451 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.4 | 148.7 | 179.6 | -62.6 | -177.5 | 0 | 0 | 0 | 110.3 | L239 A241 M249 L265 L266 | L239-L251 HydrophobicContact CD1-CB 4.17Å; L239-L251 HydrophobicContact CD1-CD2 4.41Å; L239-L251 HydrophobicContact CD2-CD2 4.35Å; A241-L251 HydrophobicContact CB-CD2 3.69Å; M249-L251 HydrophobicContact CG-CD2 4.05Å; M249-L251 HydrophobicContact CG-CG 4.04Å; M249-L251 HydrophobicContact SD-CD1 3.91Å; M249-L251 HydrophobicContact SD-CD2 3.94Å; M249-L251 HydrophobicContact SD-CG 3.93Å; L251-L265 CarbonylContact O-C 3.46Å; L251-L265 WeakPolarHBondContact O-CA 3.38Å; L251-L266 PolarHBondContact N-O 3.32Å; L251-L266 PolarHBondContact O-N 3.43Å |
| 252 | S | 98.3 | Very high | 97.6 | Very high | 10 Ų | 10 | 90.2 Ų | 90.2 | 7% | 0.07 | 45% | 0.447 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -147.1 | 148.7 | 173.5 | -170.6 | 0 | 0 | 0 | 0 | 112.5 | Y240 T263 T264 | Y240-S252 PolarHBondContact N-O 3.12Å; Y240-S252 PolarHBondContact O-N 2.83Å; Y240-S252 VanDerWaalsContact O-O 3.14Å; S252-T263 WeakPolarHBondContact OG-CG2 3.19Å; S252-T264 WeakPolarHBondContact CA-O 3.36Å; S252-T264 WeakPolarHBondContact CB-O 3.2Å; S252-T264 PolarHBondContact OG-O 2.85Å |
| 253 | A | 98.4 | Very high | 97.6 | Very high | 14 Ų | 14 | 86.5 Ų | 86.5 | 12% | 0.116 | 43% | 0.429 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -149.2 | 145.1 | 170.9 | 0 | 0 | 0 | 0 | 0 | 110 | T264 | A253-T264 PolarHBondContact N-O 3.09Å; A253-T264 PolarHBondContact O-N 2.92Å; A253-T264 VanDerWaalsContact O-N 3.11Å |
| 254 | T | 98.6 | Very high | 97.7 | Very high | 1 Ų | 1 | 85.3 Ų | 85.3 | 1% | 0.006 | 42% | 0.417 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.1 | 121.9 | 176.5 | -50.1 | 0 | 0 | 0 | 0 | 109.6 | P231 L236 N237 V262 T263 | P231-T254 HydrophobicContact CB-CG2 4.3Å; P231-T254 HydrophobicContact CG-CG2 4.07Å; L236-T254 WeakPolarHBondContact CA-O 3.39Å; L236-T254 HydrophobicContact CD2-CG2 3.6Å; N237-T254 PolarHBondContact N-O 2.94Å; T254-V262 WeakPolarHBondContact CA-O 3.37Å; T254-T263 WeakPolarHBondContact CG2-OG1 3.41Å; T254-T263 PolarHBondContact OG1-OG1 2.82Å; T254-T263 VanDerWaalsContact OG1-OG1 3.1Å |
| 255 | H | 98.5 | Very high | 97.8 | Very high | 90 Ų | 90 | 84.4 Ų | 84.4 | 42% | 0.417 | 41% | 0.413 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.9 | 149.1 | -179.3 | -62.8 | 96.1 | 0 | 0 | 0 | 111.1 | N237 Y261 V262 | N237-H255 PolarHBondContact OD1-CD2 3.29Å; H255-Y261 WeakPolarHBondContact O-CA 3.09Å; H255-V262 PolarHBondContact N-O 2.91Å; H255-V262 PolarHBondContact O-N 3.22Å |
| 256 | R | 98.4 | Very high | 97.9 | Very high | 119 Ų | 119 | 82 Ų | 82 | 45% | 0.449 | 41% | 0.406 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.2 | 126.4 | 173.8 | -173.2 | -170.9 | -68 | -92.2 | -0.5 | 109.9 | L236 K258 K260 Y261 | L236-R256 HydrophobicContact CD1-CB 4.24Å; R256-K258 WeakPolarHBondContact CD-O 3.39Å; R256-K258 WeakPolarHBondContact CG-O 3.45Å; R256-K260 CarbonylContact C-O 3.58Å; R256-K260 WeakPolarHBondContact CA-O 3.4Å; R256-Y261 HydrophobicContact CB-CD1 4.28Å; R256-Y261 HydrophobicContact CB-CE1 4.48Å; R256-Y261 HydrophobicContact CG-CD1 4.31Å; R256-Y261 HydrophobicContact CG-CE1 4.2Å; R256-Y261 VanDerWaalsContact CZ-CE1 3.42Å; R256-Y261 PolarHBondContact NH1-OH 2.98Å; R256-Y261 VanDerWaalsContact NH1-OH 3.08Å; R256-Y261 PolarHBondContact NH2-OH 3.4Å |
| 257 | Y | 98 | Very high | 98 | Very high | 154 Ų | 154 | 81.2 Ų | 81.2 | 60% | 0.604 | 39% | 0.392 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -117.1 | 110.3 | 167.6 | -179.7 | -102.7 | 0 | 0 | 0 | 109.6 | K259 K260 | Y257-K259 PolarHBondContact O-N 3.11Å; Y257-K259 VanDerWaalsContact O-N 3.08Å; Y257-K260 PolarHBondContact N-O 3.05Å; Y257-K260 PolarHBondContact O-N 2.94Å |
| 258 | K | 97.3 | Very high | 98.1 | Very high | 166 Ų | 166 | 85.4 Ų | 85.4 | 72% | 0.722 | 40% | 0.398 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.9 | -110.8 | -170.3 | -55.4 | -177.1 | -179.1 | -176.3 | 0 | 110.9 | R256 | R256-K258 WeakPolarHBondContact CD-O 3.39Å; R256-K258 WeakPolarHBondContact CG-O 3.45Å |
| 259 | K | 97.9 | Very high | 98.1 | Very high | 198 Ų | 198 | 88 Ų | 88 | 86% | 0.861 | 42% | 0.416 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -105.9 | 13.5 | 176.9 | -61.8 | -172.8 | 178.5 | -176.8 | 0 | 113.5 | Y257 | Y257-K259 PolarHBondContact O-N 3.11Å; Y257-K259 VanDerWaalsContact O-N 3.08Å |
| 260 | K | 98.1 | Very high | 97.8 | Very high | 157 Ų | 157 | 92.2 Ų | 92.2 | 68% | 0.683 | 44% | 0.438 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -114.8 | 160.6 | 177.6 | -63.9 | -168.7 | 175.9 | -169.3 | 0 | 110.9 | R256 Y257 | R256-K260 CarbonylContact C-O 3.58Å; R256-K260 WeakPolarHBondContact CA-O 3.4Å; Y257-K260 PolarHBondContact N-O 3.05Å; Y257-K260 PolarHBondContact O-N 2.94Å |
| 261 | Y | 98.6 | Very high | 97.7 | Very high | 64 Ų | 64 | 95.8 Ų | 95.8 | 25% | 0.251 | 45% | 0.454 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.5 | 142.8 | 176.5 | -49.1 | -80 | 0 | 0 | 0 | 109.5 | E230 P231 L236 H255 R256 | E230-Y261 HydrophobicContact CG-CD2 4.4Å; E230-Y261 HydrophobicContact CG-CE2 3.74Å; E230-Y261 VanDerWaalsContact OE1-CE2 3.31Å; E230-Y261 WeakPolarHBondContact OE1-CE2 3.43Å; E230-Y261 PolarHBondContact OE1-OH 3.45Å; P231-Y261 HydrophobicContact CG-CD1 3.65Å; P231-Y261 HydrophobicContact CG-CD2 3.9Å; P231-Y261 HydrophobicContact CG-CE1 4.11Å; P231-Y261 HydrophobicContact CG-CE2 4.34Å; P231-Y261 HydrophobicContact CG-CG 3.52Å; L236-Y261 HydrophobicContact CD1-CD1 4.16Å; L236-Y261 HydrophobicContact CD1-CE1 3.92Å; L236-Y261 HydrophobicContact CD2-CD1 3.96Å; L236-Y261 HydrophobicContact CD2-CE1 4.43Å; H255-Y261 WeakPolarHBondContact O-CA 3.09Å; R256-Y261 HydrophobicContact CB-CD1 4.28Å; R256-Y261 HydrophobicContact CB-CE1 4.48Å; R256-Y261 HydrophobicContact CG-CD1 4.31Å; R256-Y261 HydrophobicContact CG-CE1 4.2Å; R256-Y261 VanDerWaalsContact CZ-CE1 3.42Å; R256-Y261 PolarHBondContact NH1-OH 2.98Å; R256-Y261 VanDerWaalsContact NH1-OH 3.08Å; R256-Y261 PolarHBondContact NH2-OH 3.4Å |
| 262 | V | 98.4 | Very high | 97.7 | Very high | 80 Ų | 80 | 98.4 Ų | 98.4 | 49% | 0.485 | 47% | 0.465 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.1 | 123 | 177.5 | -177.9 | 0 | 0 | 0 | 0 | 108.4 | T254 H255 | T254-V262 WeakPolarHBondContact CA-O 3.37Å; H255-V262 PolarHBondContact N-O 2.91Å; H255-V262 PolarHBondContact O-N 3.22Å |
| 263 | T | 98.5 | Very high | 97.7 | Very high | 29 Ų | 29 | 103.3 Ų | 103.3 | 18% | 0.178 | 49% | 0.487 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.2 | 103.7 | 173.4 | -53.4 | 0 | 0 | 0 | 0 | 108.5 | I214 L215 L228 S252 T254 L265 | I214-T263 HydrophobicContact CG2-CG2 4.44Å; L215-T263 HydrophobicContact CD1-CG2 4.05Å; L215-T263 HydrophobicContact CD2-CG2 3.91Å; L215-T263 HydrophobicContact CG-CG2 4.05Å; L228-T263 HydrophobicContact CD1-CG2 4.26Å; L228-T263 WeakPolarHBondContact CD1-OG1 3.49Å; S252-T263 WeakPolarHBondContact OG-CG2 3.19Å; T254-T263 WeakPolarHBondContact CG2-OG1 3.41Å; T254-T263 PolarHBondContact OG1-OG1 2.82Å; T254-T263 VanDerWaalsContact OG1-OG1 3.1Å; T263-L265 HydrophobicContact CG2-CD1 4.35Å |
| 264 | T | 98.3 | Very high | 97.6 | Very high | 82 Ų | 82 | 108.6 Ų | 108.6 | 50% | 0.503 | 51% | 0.509 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.5 | 139.6 | 179.3 | -52.6 | 0 | 0 | 0 | 0 | 109.3 | S252 A253 | S252-T264 WeakPolarHBondContact CA-O 3.36Å; S252-T264 WeakPolarHBondContact CB-O 3.2Å; S252-T264 PolarHBondContact OG-O 2.85Å; A253-T264 PolarHBondContact N-O 3.09Å; A253-T264 PolarHBondContact O-N 2.92Å; A253-T264 VanDerWaalsContact O-N 3.11Å |
| 265 | L | 98.4 | Very high | 97.6 | Very high | 78 Ų | 78 | 115.3 Ų | 115.3 | 41% | 0.408 | 54% | 0.54 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.6 | 135.4 | 169.4 | -73.5 | 75.4 | 0 | 0 | 0 | 108.8 | L215 L251 T263 Y267 | L215-L265 HydrophobicContact CD1-CD1 3.96Å; L215-L265 HydrophobicContact CD1-CD2 4.3Å; L215-L265 HydrophobicContact CD1-CG 4.2Å; L215-L265 HydrophobicContact CD2-CD1 4.42Å; L251-L265 CarbonylContact O-C 3.46Å; L251-L265 WeakPolarHBondContact O-CA 3.38Å; T263-L265 HydrophobicContact CG2-CD1 4.35Å; L265-Y267 HydrophobicContact CB-CE2 4.19Å; L265-Y267 HydrophobicContact CD2-CE2 4.34Å |
| 266 | L | 98.1 | Very high | 97.5 | Very high | 98 Ų | 98 | 117 Ų | 117 | 51% | 0.513 | 55% | 0.549 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -120 | 120.8 | 175.2 | 175.8 | 64 | 0 | 0 | 0 | 109.3 | V250 L251 | V250-L266 WeakPolarHBondContact CA-O 3.44Å; L251-L266 PolarHBondContact N-O 3.32Å; L251-L266 PolarHBondContact O-N 3.43Å |
| 267 | Y | 98 | Very high | 97.4 | Very high | 148 Ų | 148 | 116.9 Ų | 116.9 | 58% | 0.58 | 56% | 0.556 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -99.5 | 122.1 | 170 | -69.9 | -105.4 | 0 | 0 | 0 | 108 | V248 M249 V250 L265 | V248-Y267 HydrophobicContact CG1-CD1 4.11Å; M249-Y267 WeakPolarHBondContact O-CA 3.48Å; V250-Y267 HydrophobicContact CB-CD1 4.45Å; V250-Y267 HydrophobicContact CB-CE1 4.31Å; V250-Y267 HydrophobicContact CG1-CD1 4.2Å; V250-Y267 HydrophobicContact CG1-CD2 4.3Å; V250-Y267 HydrophobicContact CG1-CE1 3.83Å; V250-Y267 HydrophobicContact CG1-CE2 3.94Å; V250-Y267 HydrophobicContact CG1-CG 4.41Å; V250-Y267 HydrophobicContact CG2-CD1 3.53Å; V250-Y267 HydrophobicContact CG2-CE1 3.45Å; V250-Y267 VanDerWaalsContact CG2-CE1 3.45Å; V250-Y267 HydrophobicContact CG2-CG 4.33Å; L265-Y267 HydrophobicContact CB-CE2 4.19Å; L265-Y267 HydrophobicContact CD2-CE2 4.34Å |
| 268 | K | 97.4 | Very high | 97.4 | Very high | 130 Ų | 130 | 114 Ų | 114 | 57% | 0.565 | 55% | 0.552 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -135.6 | 125.3 | -177.6 | -168.4 | -167.8 | 170 | -173.9 | 0 | 110.4 | M249 | M249-K268 PolarHBondContact N-O 3.3Å; M249-K268 PolarHBondContact O-N 3.26Å |
| 269 | P | 96.4 | Very high | 97.4 | Very high | 100 Ų | 100 | 109.7 Ų | 109.7 | 65% | 0.649 | 54% | 0.538 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -59.9 | 153.9 | 168.6 | -22.4 | 34.2 | 0 | 0 | 0 | 112.2 | G247 | G247-P269 WeakPolarHBondContact O-CA 3.45Å |
| 270 | I | 90.8 | Very high | 97.4 | Very high | 152 Ų | 152 | 101.6 Ų | 101.6 | 78% | 0.779 | 51% | 0.509 | S | S | * | . | trans | -108.6 | 0 | 176.6 | -52.1 | -176.6 | 0 | 0 | 0 | 109.8 | I244 G247 M249 | I244-I270 HydrophobicContact CB-CD1 4.34Å; I244-I270 HydrophobicContact CD1-CD1 3.57Å; I244-I270 HydrophobicContact CG1-CD1 3.85Å; I244-I270 HydrophobicContact CG2-CD1 3.53Å; G247-I270 PolarHBondContact O-N 2.93Å; M249-I270 HydrophobicContact CB-CD1 4.05Å; M249-I270 HydrophobicContact CB-CG1 4.08Å; M249-I270 HydrophobicContact CE-CD1 4.08Å; M249-I270 HydrophobicContact CE-CG1 4.47Å |
Retrieved 270 of 270 residues in 148.6 ms
(Link to these results)