| 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 | 45.5 | Very low | 50.9 | Low | 238 Ų | 238 | 147.6 Ų | 147.6 | 100% | 1.172 | 82% | 0.821 | S | S | * | * | 0 | 110.3 | 0 | -62.9 | -170 | -179.8 | 0 | 0 | 106.3 | |||||
| 2 | T | 43.8 | Very low | 50.9 | Low | 147 Ų | 147 | 149.5 Ų | 149.5 | 90% | 0.902 | 83% | 0.825 | S | S | * | * | trans | -108.3 | 108.1 | 176.7 | -72.9 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 3 | V | 59.8 | Low | 50.5 | Low | 140 Ų | 140 | 148.5 Ų | 148.5 | 85% | 0.848 | 81% | 0.811 | S | S | * | * | trans | -114.3 | 100.6 | 166.3 | -157 | 0 | 0 | 0 | 0 | 105 | ||||
| 4 | G | 49.7 | Very low | 49.5 | Very low | 65 Ų | 65 | 147.4 Ų | 147.4 | 67% | 0.67 | 80% | 0.804 | S | S | * | * | trans | -91.5 | 132.4 | 158.6 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 5 | E | 46.7 | Very low | 49.6 | Very low | 144 Ų | 144 | 145.6 Ų | 145.6 | 67% | 0.673 | 81% | 0.806 | S | S | * | * | trans | 172.1 | 114.1 | 143.7 | -178 | 136.6 | 57.3 | 0 | 0 | 108.9 | K7 | E5-K7 IonicContact OE2-NZ 2.79Å; E5-K7 PolarHBondContact OE2-NZ 3.39Å | ||
| 6 | I | 62.1 | Low | 48.9 | Very low | 172 Ų | 172 | 142.7 Ų | 142.7 | 88% | 0.882 | 80% | 0.799 | S | S | * | * | trans | -145.3 | 123.7 | 132 | 43.9 | 171.7 | 0 | 0 | 0 | 109.5 | ||||
| 7 | K | 41.8 | Very low | 48.9 | Very low | 173 Ų | 173 | 142.7 Ų | 142.7 | 75% | 0.752 | 80% | 0.797 | S | S | * | * | trans | -69.8 | 123.6 | 168.8 | -79.5 | 170.6 | 172.5 | 84.9 | 0 | 109.7 | E5 | E5-K7 IonicContact OE2-NZ 2.79Å; E5-K7 PolarHBondContact OE2-NZ 3.39Å | ||
| 8 | G | 57.8 | Low | 48.6 | Very low | 83 Ų | 83 | 143.9 Ų | 143.9 | 86% | 0.856 | 79% | 0.793 | S | S | * | * | trans | -131.1 | 116 | 163.3 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 9 | K | 47.7 | Very low | 48.2 | Very low | 192 Ų | 192 | 144.9 Ų | 144.9 | 84% | 0.835 | 79% | 0.788 | S | S | * | * | trans | -114.6 | 155.7 | -166.9 | 48 | -177.5 | 165.7 | 177.8 | 0 | 110.3 | ||||
| 10 | S | 47.7 | Very low | 48.2 | Very low | 102 Ų | 102 | 145.3 Ų | 145.3 | 71% | 0.713 | 79% | 0.79 | S | S | * | * | trans | 68.8 | 83.7 | 164.4 | 68.1 | 0 | 0 | 0 | 0 | 117.8 | I12 | S10-I12 PolarHBondContact O-N 3.01Š| ||
| 11 | K | 57.3 | Low | 47.8 | Very low | 168 Ų | 168 | 147.2 Ų | 147.2 | 73% | 0.73 | 79% | 0.793 | S | S | * | * | -11.7 | 113.6 | 128 | -163.8 | 176 | -167.8 | -158.8 | 0 | 114 | E13 | K11-E13 HydrophobicContact CD-CG 4.14Å; K11-E13 WeakPolarHBondContact CE-OE1 3.45Å; K11-E13 HydrophobicContact CG-CG 4.04Å; K11-E13 IonicContact NZ-OE1 2.69Å; K11-E13 PolarHBondContact NZ-OE1 3.24Å | |||
| 12 | I | 50.9 | Low | 47.8 | Very low | 170 Ų | 170 | 144.8 Ų | 144.8 | 87% | 0.872 | 78% | 0.776 | S | S | * | * | trans | -91.6 | 116.5 | 160.5 | -68.1 | 165.9 | 0 | 0 | 0 | 105.5 | S10 | S10-I12 PolarHBondContact O-N 3.01Š| ||
| 13 | E | 45.6 | Very low | 48.2 | Very low | 137 Ų | 137 | 144.1 Ų | 144.1 | 64% | 0.64 | 77% | 0.774 | S | S | * | * | trans | -90.4 | 157.2 | 171.5 | -62.4 | -153 | 154.2 | 0 | 0 | 110.5 | K11 | K11-E13 HydrophobicContact CD-CG 4.14Å; K11-E13 WeakPolarHBondContact CE-OE1 3.45Å; K11-E13 HydrophobicContact CG-CG 4.04Å; K11-E13 IonicContact NZ-OE1 2.69Å; K11-E13 PolarHBondContact NZ-OE1 3.24Å | ||
| 14 | D | 36.5 | Very low | 48.1 | Very low | 133 Ų | 133 | 143.2 Ų | 143.2 | 71% | 0.711 | 77% | 0.769 | S | S | * | * | trans | 103.4 | 102.8 | 156.5 | -153.9 | -120.6 | 0 | 0 | 0 | 116.8 | ||||
| 15 | S | 51.5 | Low | 48.6 | Very low | 120 Ų | 120 | 148.4 Ų | 148.4 | 84% | 0.839 | 78% | 0.776 | S | S | * | * | -159.3 | 99.4 | 120.2 | -81.5 | 0 | 0 | 0 | 0 | 109.2 | |||||
| 16 | S | 38.6 | Very low | 49.2 | Very low | 99 Ų | 99 | 151.3 Ų | 151.3 | 69% | 0.692 | 79% | 0.786 | S | S | * | * | trans | -89.3 | 112.6 | 169.6 | -51.8 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 17 | D | 49.3 | Very low | 49.3 | Very low | 143 Ų | 143 | 148.6 Ų | 148.6 | 77% | 0.765 | 77% | 0.772 | S | S | * | * | trans | -165.9 | 97.2 | 151.8 | -108.5 | -54.3 | 0 | 0 | 0 | 113.5 | ||||
| 18 | K | 42.2 | Very low | 50.6 | Low | 165 Ų | 165 | 145 Ų | 145 | 72% | 0.717 | 76% | 0.761 | S | S | * | * | 83.2 | 124.5 | 109.7 | -152.1 | 151.3 | -173.2 | 165.9 | 0 | 121.4 | |||||
| 19 | K | 42.2 | Very low | 51.2 | Low | 163 Ų | 163 | 146.5 Ų | 146.5 | 71% | 0.709 | 75% | 0.748 | S | S | * | * | trans | 76.7 | 110.6 | 147.1 | -78.7 | 173.9 | -174.8 | -171 | 0 | 118.3 | ||||
| 20 | N | 46.9 | Very low | 52.2 | Low | 152 Ų | 152 | 141.2 Ų | 141.2 | 81% | 0.813 | 73% | 0.732 | S | S | * | * | -176.3 | 143.7 | 83.8 | -101.3 | -44.6 | 0 | 0 | 0 | 112.6 | |||||
| 21 | Q | 40.5 | Very low | 53.2 | Low | 186 Ų | 186 | 142 Ų | 142 | 87% | 0.869 | 73% | 0.728 | S | S | * | * | trans | -78.7 | 126.2 | -178.7 | -60.7 | 165.3 | -49.3 | 0 | 0 | 110.8 | ||||
| 22 | K | 45.3 | Very low | 53.9 | Low | 186 Ų | 186 | 139.6 Ų | 139.6 | 81% | 0.809 | 72% | 0.723 | S | S | * | * | trans | -146.6 | 128.7 | 138.2 | -83.3 | -158.7 | -174 | 176.9 | 0 | 109 | V24 | K22-V24 PolarHBondContact O-N 3.45Š| ||
| 23 | P | 53.2 | Low | 54.8 | Low | 133 Ų | 133 | 137.3 Ų | 137.3 | 86% | 0.864 | 71% | 0.708 | S | S | * | * | trans | -85 | 92 | 180 | 32.9 | -27 | 0 | 0 | 0 | 107.8 | ||||
| 24 | V | 57.5 | Low | 55.8 | Low | 122 Ų | 122 | 137.3 Ų | 137.3 | 74% | 0.739 | 71% | 0.708 | S | S | * | * | trans | -91 | 125.7 | 164.8 | -176.7 | 0 | 0 | 0 | 0 | 105.9 | K22 | K22-V24 PolarHBondContact O-N 3.45Š| ||
| 25 | E | 59.9 | Low | 57.5 | Low | 173 Ų | 173 | 138 Ų | 138 | 81% | 0.808 | 71% | 0.712 | S | S | * | * | trans | -36.5 | 136.1 | -174 | -66 | 165.3 | -179.6 | 0 | 0 | 112 | I27 | E25-I27 VanDerWaalsContact C-N 3.27Å; E25-I27 PolarHBondContact O-N 2.73Å | ||
| 26 | K | 59.3 | Low | 58.5 | Low | 206 Ų | 206 | 138.1 Ų | 138.1 | 90% | 0.896 | 70% | 0.703 | S | S | * | * | trans | -33.9 | 91.5 | 173.7 | -65.2 | 172.3 | -86.3 | -179 | 0 | 109.5 | D28 | K26-D28 PolarHBondContact O-N 2.97Š| ||
| 27 | I | 64.1 | Low | 60.4 | Low | 114 Ų | 114 | 140 Ų | 140 | 59% | 0.585 | 71% | 0.706 | S | S | * | * | trans | -57.6 | 114.7 | 168.1 | -62.3 | 161.8 | 0 | 0 | 0 | 102 | E25 I29 L32 | E25-I27 VanDerWaalsContact C-N 3.27Å; E25-I27 PolarHBondContact O-N 2.73Å; I27-I29 VanDerWaalsContact C-N 3.31Å; I27-I29 PolarHBondContact O-N 3.02Å; I27-L32 HydrophobicContact CG2-CD1 3.64Å; I27-L32 HydrophobicContact CG2-CD2 4.49Å; I27-L32 HydrophobicContact CG2-CG 3.98Å | ||
| 28 | D | 68.9 | Low | 61.7 | Low | 99 Ų | 99 | 141.1 Ų | 141.1 | 53% | 0.529 | 70% | 0.704 | S | S | . | * | trans | -61.3 | 102.7 | -177.7 | -166.5 | -8.5 | 0 | 0 | 0 | 106 | K26 T30 L31 | K26-D28 PolarHBondContact O-N 2.97Å; D28-T30 PolarHBondContact O-N 3.48Å; D28-T30 WeakPolarHBondContact OD1-CB 3.43Å; D28-T30 WeakPolarHBondContact OD1-CG2 3.5Å; D28-T30 PolarHBondContact OD1-N 3.18Å; D28-T30 PolarHBondContact OD1-OG1 3.02Å; D28-T30 PolarHBondContact OD2-OG1 3.09Å; D28-L31 HydrophobicContact CB-CB 4.43Å; D28-L31 WeakPolarHBondContact O-CB 3.24Å; D28-L31 PolarHBondContact O-N 3.23Å | ||
| 29 | I | 69.7 | Low | 63.4 | Low | 113 Ų | 113 | 141.1 Ų | 141.1 | 58% | 0.579 | 71% | 0.706 | S | S | * | * | H | α-helix | trans | -54.9 | -30.5 | -175.5 | -62.1 | 169.6 | 0 | 0 | 0 | 108.8 | I27 L31 L32 E33 | I27-I29 VanDerWaalsContact C-N 3.31Å; I27-I29 PolarHBondContact O-N 3.02Å; I29-L31 VanDerWaalsContact C-N 3.34Å; I29-L31 PolarHBondContact O-N 2.81Å; I29-L32 PolarHBondContact O-N 3.11Å; I29-L32 VanDerWaalsContact O-N 3.16Å; I29-E33 HydrophobicContact CG2-CG 4.28Å; I29-E33 VanDerWaalsContact CG2-OE1 3.27Å; I29-E33 WeakPolarHBondContact CG2-OE1 3.46Å; I29-E33 WeakPolarHBondContact O-CG 3.37Å; I29-E33 PolarHBondContact O-N 2.66Å |
| 30 | T | 70.2 | Confident | 65.3 | Low | 81 Ų | 81 | 142.5 Ų | 142.5 | 50% | 0.497 | 72% | 0.715 | S | S | . | * | H | α-helix | trans | -62 | -34.8 | 176.7 | 69.5 | 0 | 0 | 0 | 0 | 113.6 | D28 L32 E33 E34 | D28-T30 PolarHBondContact O-N 3.48Å; D28-T30 WeakPolarHBondContact OD1-CB 3.43Å; D28-T30 WeakPolarHBondContact OD1-CG2 3.5Å; D28-T30 PolarHBondContact OD1-N 3.18Å; D28-T30 PolarHBondContact OD1-OG1 3.02Å; D28-T30 PolarHBondContact OD2-OG1 3.09Å; T30-L32 VanDerWaalsContact C-N 3.34Å; T30-E33 PolarHBondContact O-N 3.46Å; T30-E34 WeakPolarHBondContact O-CB 3.34Å; T30-E34 PolarHBondContact O-N 3.35Å |
| 31 | L | 68.9 | Low | 66.9 | Low | 120 Ų | 120 | 143.1 Ų | 143.1 | 63% | 0.628 | 71% | 0.711 | S | S | * | * | H | α-helix | trans | -74.3 | -26.3 | 177.5 | -168.6 | 73.4 | 0 | 0 | 0 | 112.1 | D28 I29 | D28-L31 HydrophobicContact CB-CB 4.43Å; D28-L31 WeakPolarHBondContact O-CB 3.24Å; D28-L31 PolarHBondContact O-N 3.23Å; I29-L31 VanDerWaalsContact C-N 3.34Å; I29-L31 PolarHBondContact O-N 2.81Å |
| 32 | L | 70.8 | Confident | 68.8 | Low | 117 Ų | 117 | 139.7 Ų | 139.7 | 61% | 0.613 | 71% | 0.705 | S | S | * | * | H | α-helix | trans | -80.1 | -29.1 | 173.4 | -66.1 | 179 | 0 | 0 | 0 | 112 | I27 I29 T30 | I27-L32 HydrophobicContact CG2-CD1 3.64Å; I27-L32 HydrophobicContact CG2-CD2 4.49Å; I27-L32 HydrophobicContact CG2-CG 3.98Å; I29-L32 PolarHBondContact O-N 3.11Å; I29-L32 VanDerWaalsContact O-N 3.16Å; T30-L32 VanDerWaalsContact C-N 3.34Å |
| 33 | E | 69.8 | Low | 70.3 | Confident | 121 Ų | 121 | 135.9 Ų | 135.9 | 57% | 0.565 | 71% | 0.708 | S | S | * | * | H | α-helix | trans | -77.1 | -31.7 | 175.2 | -70 | 172 | -179.9 | 0 | 0 | 111.7 | I29 T30 D35 D36 D37 | I29-E33 HydrophobicContact CG2-CG 4.28Å; I29-E33 VanDerWaalsContact CG2-OE1 3.27Å; I29-E33 WeakPolarHBondContact CG2-OE1 3.46Å; I29-E33 WeakPolarHBondContact O-CG 3.37Å; I29-E33 PolarHBondContact O-N 2.66Å; T30-E33 PolarHBondContact O-N 3.46Å; E33-D35 VanDerWaalsContact C-N 3.3Å; E33-D35 PolarHBondContact O-N 3.33Å; E33-D36 PolarHBondContact O-N 2.97Å; E33-D36 VanDerWaalsContact O-N 3.16Å; E33-D37 PolarHBondContact O-N 3.3Å |
| 34 | E | 67 | Low | 71.4 | Confident | 138 Ų | 138 | 136.6 Ų | 136.6 | 65% | 0.645 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.6 | -23.1 | -177.5 | -165.1 | 173.8 | -149.2 | 0 | 0 | 114.1 | T30 | T30-E34 WeakPolarHBondContact O-CB 3.34Å; T30-E34 PolarHBondContact O-N 3.35Å |
| 35 | D | 71.6 | Confident | 72.1 | Confident | 146 Ų | 146 | 135.5 Ų | 135.5 | 78% | 0.781 | 70% | 0.703 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.5 | -15.8 | 176 | -159.7 | 31.1 | 0 | 0 | 0 | 112.5 | E33 | E33-D35 VanDerWaalsContact C-N 3.3Å; E33-D35 PolarHBondContact O-N 3.33Å |
| 36 | D | 72.5 | Confident | 72.3 | Confident | 123 Ų | 123 | 132.1 Ų | 132.1 | 66% | 0.658 | 70% | 0.698 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.9 | -5.5 | 174.1 | -149.5 | 9.2 | 0 | 0 | 0 | 112 | E33 F38 | E33-D36 PolarHBondContact O-N 2.97Å; E33-D36 VanDerWaalsContact O-N 3.16Å; D36-F38 PolarHBondContact O-N 3.34Å |
| 37 | D | 78.6 | Confident | 72.1 | Confident | 140 Ų | 140 | 124.9 Ų | 124.9 | 75% | 0.749 | 68% | 0.681 | S | S | * | * | trans | -75.6 | 59.8 | 168.4 | -97.5 | -0.4 | 0 | 0 | 0 | 110 | E33 E39 | E33-D37 PolarHBondContact O-N 3.3Å; D37-E39 PolarHBondContact O-N 2.88Å | ||
| 38 | F | 76.1 | Confident | 71.7 | Confident | 165 Ų | 165 | 129 Ų | 129 | 72% | 0.724 | 70% | 0.698 | S | S | * | * | trans | -46.8 | 134 | 169 | -89.4 | -92.1 | 0 | 0 | 0 | 110.4 | D36 E40 | D36-F38 PolarHBondContact O-N 3.34Å; F38-E40 PolarHBondContact O-N 3.29Å | ||
| 39 | E | 79.5 | Confident | 70.9 | Confident | 166 Ų | 166 | 127 Ų | 127 | 78% | 0.776 | 70% | 0.701 | S | S | * | * | trans | -59.1 | 110.2 | 168 | -69 | -175.2 | -151.4 | 0 | 0 | 108.8 | D37 F41 | D37-E39 PolarHBondContact O-N 2.88Å; E39-F41 WeakPolarHBondContact O-CD2 3.26Å; E39-F41 PolarHBondContact O-N 3.09Å | ||
| 40 | E | 82.4 | Confident | 70.2 | Confident | 192 Ų | 192 | 129.1 Ų | 129.1 | 90% | 0.897 | 71% | 0.708 | S | S | * | * | trans | -59.9 | 99.8 | 179.4 | -174 | -178.6 | 175.4 | 0 | 0 | 109.6 | F38 | F38-E40 PolarHBondContact O-N 3.29Š| ||
| 41 | F | 79.6 | Confident | 69.4 | Low | 165 Ų | 165 | 131.5 Ų | 131.5 | 72% | 0.724 | 73% | 0.725 | S | S | * | * | trans | -63.9 | 142.2 | 179.7 | -79.2 | -90.1 | 0 | 0 | 0 | 110.3 | E39 A43 | E39-F41 WeakPolarHBondContact O-CD2 3.26Å; E39-F41 PolarHBondContact O-N 3.09Å; F41-A43 PolarHBondContact O-N 3.25Å | ||
| 42 | P | 80 | Confident | 68.9 | Low | 114 Ų | 114 | 131.9 Ų | 131.9 | 74% | 0.74 | 73% | 0.728 | S | S | * | * | trans | -53.7 | 130.1 | 176.6 | -24.6 | 33 | 0 | 0 | 0 | 110.7 | H44 | P42-H44 PolarHBondContact O-N 3.46Š| ||
| 43 | A | 76.9 | Confident | 68.2 | Low | 105 Ų | 105 | 134.2 Ų | 134.2 | 87% | 0.868 | 74% | 0.735 | S | S | * | * | trans | -57 | 104.6 | 172.4 | 0 | 0 | 0 | 0 | 0 | 108.6 | F41 | F41-A43 PolarHBondContact O-N 3.25Š| ||
| 44 | H | 76.7 | Confident | 67.6 | Low | 149 Ų | 149 | 136.7 Ų | 136.7 | 69% | 0.69 | 75% | 0.747 | S | S | * | * | trans | -72.8 | 134.7 | 167.2 | 67.7 | -79.8 | 0 | 0 | 0 | 106.8 | P42 C46 | P42-H44 PolarHBondContact O-N 3.46Å; H44-C46 PolarHBondContact CD2-N 3.43Å; H44-C46 PolarHBondContact O-N 2.95Å | ||
| 45 | A | 72 | Confident | 67.4 | Low | 98 Ų | 98 | 133.8 Ų | 133.8 | 81% | 0.81 | 75% | 0.746 | S | S | * | * | trans | -64.4 | 94.9 | 159.2 | 0 | 0 | 0 | 0 | 0 | 104.8 | G47 | A45-G47 PolarHBondContact O-N 3.49Š| ||
| 46 | C | 63.3 | Low | 66.7 | Low | 103 Ų | 103 | 130 Ų | 130 | 70% | 0.696 | 73% | 0.729 | S | S | * | * | trans | -55 | 101.4 | 163.1 | -163.8 | 0 | 0 | 0 | 0 | 103.3 | H44 | H44-C46 PolarHBondContact CD2-N 3.43Å; H44-C46 PolarHBondContact O-N 2.95Å | ||
| 47 | G | 55.5 | Low | 66.2 | Low | 53 Ų | 53 | 128 Ų | 128 | 55% | 0.546 | 72% | 0.721 | S | S | . | * | trans | -54.2 | 157.3 | -173 | 0 | 0 | 0 | 0 | 0 | 107.5 | A45 G49 | A45-G47 PolarHBondContact O-N 3.49Å; G47-G49 PolarHBondContact O-N 3.13Å | ||
| 48 | E | 55.5 | Low | 65.5 | Low | 200 Ų | 200 | 132 Ų | 132 | 94% | 0.935 | 73% | 0.726 | S | S | * | * | trans | -65.9 | 58.2 | 160.8 | -71.1 | 150.8 | 158.3 | 0 | 0 | 108.2 | H50 | E48-H50 PolarHBondContact O-N 3.17Š| ||
| 49 | G | 52.9 | Low | 64.8 | Low | 58 Ų | 58 | 132.2 Ų | 132.2 | 60% | 0.598 | 73% | 0.729 | S | S | * | * | trans | -68.8 | 114.5 | 170.7 | 0 | 0 | 0 | 0 | 0 | 105 | G47 | G47-G49 PolarHBondContact O-N 3.13Š| ||
| 50 | H | 54 | Low | 64.1 | Low | 158 Ų | 158 | 129.5 Ų | 129.5 | 73% | 0.731 | 72% | 0.719 | S | S | * | * | trans | -25.2 | 119.4 | 177.3 | -51.5 | -80.6 | 0 | 0 | 0 | 111.9 | E48 N52 | E48-H50 PolarHBondContact O-N 3.17Å; H50-N52 PolarHBondContact O-N 2.98Å | ||
| 51 | P | 55.2 | Low | 63.1 | Low | 131 Ų | 131 | 125.1 Ų | 125.1 | 85% | 0.851 | 70% | 0.702 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.1 | 18.6 | -171.4 | 27.7 | -36.8 | 0 | 0 | 0 | 114.5 | ||
| 52 | N | 56.4 | Low | 62.6 | Low | 128 Ų | 128 | 127.3 Ų | 127.3 | 68% | 0.684 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -126.6 | -5.8 | -162.8 | -159.3 | 37.9 | 0 | 0 | 0 | 116.2 | H50 | H50-N52 PolarHBondContact O-N 2.98Š|
| 53 | E | 56.9 | Low | 61.7 | Low | 165 Ų | 165 | 125.4 Ų | 125.4 | 77% | 0.771 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -127.7 | -29.9 | -173.2 | -63.9 | -176.4 | -169.8 | 0 | 0 | 115.6 | ||
| 54 | E | 57.2 | Low | 61.1 | Low | 174 Ų | 174 | 125.1 Ų | 125.1 | 81% | 0.813 | 67% | 0.673 | S | S | * | * | S | Bend | trans | -105.9 | -26.6 | -174.1 | -165.1 | 168.3 | -161.8 | 0 | 0 | 114.2 | T56 | E54-T56 PolarHBondContact O-N 3.04Š|
| 55 | A | 61.8 | Low | 60.4 | Low | 76 Ų | 76 | 124.8 Ų | 124.8 | 63% | 0.628 | 68% | 0.677 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.5 | -10.7 | -178.8 | 0 | 0 | 0 | 0 | 0 | 114 | ||
| 56 | T | 57.8 | Low | 59.9 | Low | 67 Ų | 67 | 124.6 Ų | 124.6 | 41% | 0.411 | 66% | 0.661 | S | S | . | * | H | α-helix | trans | -75.1 | -24.7 | -177.3 | -44.8 | 0 | 0 | 0 | 0 | 112.1 | E54 W58 D60 | E54-T56 PolarHBondContact O-N 3.04Å; T56-W58 PolarHBondContact O-N 3.49Å; T56-D60 HydrophobicContact CG2-CB 3.67Å; T56-D60 WeakPolarHBondContact CG2-OD2 3.08Å; T56-D60 WeakPolarHBondContact O-CB 3.3Å; T56-D60 PolarHBondContact O-N 3.33Å |
| 57 | V | 62.4 | Low | 59.7 | Low | 81 Ų | 81 | 123.3 Ų | 123.3 | 49% | 0.491 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -73.3 | -30.8 | -168.2 | -172.1 | 0 | 0 | 0 | 0 | 113.4 | ||
| 58 | W | 63.7 | Low | 60.1 | Low | 225 Ų | 225 | 124.7 Ų | 124.7 | 85% | 0.852 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -87.2 | -27 | -178.4 | -63 | -12.5 | 0 | 0 | 0 | 113.8 | T56 | T56-W58 PolarHBondContact O-N 3.49Å |
| 59 | E | 61.8 | Low | 60.8 | Low | 169 Ų | 169 | 119.6 Ų | 119.6 | 79% | 0.79 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -90 | -36.5 | 177.8 | -66.4 | -69.3 | 146.2 | 0 | 0 | 111.9 | ||
| 60 | D | 63.9 | Low | 61.8 | Low | 108 Ų | 108 | 124.1 Ų | 124.1 | 58% | 0.578 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -94.9 | -25.3 | -165.6 | -149 | 28.5 | 0 | 0 | 0 | 112.5 | T56 | T56-D60 HydrophobicContact CG2-CB 3.67Å; T56-D60 WeakPolarHBondContact CG2-OD2 3.08Å; T56-D60 WeakPolarHBondContact O-CB 3.3Å; T56-D60 PolarHBondContact O-N 3.33Å |
| 61 | N | 61.3 | Low | 63 | Low | 100 Ų | 100 | 122.8 Ų | 122.8 | 54% | 0.535 | 62% | 0.622 | S | S | . | * | S | Bend | trans | -107.2 | 9.8 | -177.1 | -61.2 | -44.2 | 0 | 0 | 0 | 114.4 | ||
| 62 | W | 68.9 | Low | 64 | Low | 211 Ų | 211 | 117.7 Ų | 117.7 | 80% | 0.799 | 59% | 0.588 | S | S | * | * | S | Bend | trans | -89.5 | -14.9 | 171.8 | -171.5 | 19.3 | 0 | 0 | 0 | 112.5 | ||
| 63 | D | 61.3 | Low | 65.1 | Low | 75 Ų | 75 | 115.8 Ų | 115.8 | 40% | 0.401 | 58% | 0.575 | S | S | . | * | S | Bend | trans | -102.8 | 4.1 | 176.2 | -162 | 29.3 | 0 | 0 | 0 | 113.4 | D65 I66 | D63-D65 PolarHBondContact O-N 2.8Å; D63-I66 PolarHBondContact O-N 2.84Å; D63-I66 WeakPolarHBondContact OD1-CD1 3.35Å |
| 64 | D | 64.2 | Low | 66.3 | Low | 98 Ų | 98 | 114.2 Ų | 114.2 | 52% | 0.524 | 57% | 0.567 | S | S | . | * | G | 310 helix | trans | -71.3 | 2.3 | 177.2 | -156.2 | 34.2 | 0 | 0 | 0 | 112.8 | I66 V67 | D64-I66 PolarHBondContact O-N 2.83Å; D64-V67 VanDerWaalsContact O-CB 3.3Å; D64-V67 WeakPolarHBondContact O-CB 3.27Å; D64-V67 VanDerWaalsContact O-CG2 3.26Å; D64-V67 WeakPolarHBondContact O-CG2 3.2Å; D64-V67 PolarHBondContact O-N 3.03Å; D64-V67 WeakPolarHBondContact OD1-CG2 3.29Å |
| 65 | D | 62.2 | Low | 67.4 | Low | 143 Ų | 143 | 108.1 Ų | 108.1 | 77% | 0.765 | 54% | 0.54 | S | S | * | . | G | 310 helix | trans | -73.5 | -7.4 | 169.3 | -71.1 | -18.4 | 0 | 0 | 0 | 112.8 | D63 | D63-D65 PolarHBondContact O-N 2.8Š|
| 66 | I | 60.9 | Low | 68.4 | Low | 94 Ų | 94 | 108.9 Ų | 108.9 | 48% | 0.482 | 53% | 0.526 | S | S | . | . | G | 310 helix | trans | -85.3 | 5.9 | 166.4 | -52 | 173.9 | 0 | 0 | 0 | 111 | D63 D64 D68 | D63-I66 PolarHBondContact O-N 2.84Å; D63-I66 WeakPolarHBondContact OD1-CD1 3.35Å; D64-I66 PolarHBondContact O-N 2.83Å; I66-D68 PolarHBondContact O-N 3.32Å; I66-D68 VanDerWaalsContact O-N 3.17Å |
| 67 | V | 60.7 | Low | 69.6 | Low | 76 Ų | 76 | 107.8 Ų | 107.8 | 46% | 0.461 | 53% | 0.525 | S | S | . | . | S | Bend | trans | -53.9 | 128.9 | 160.6 | 163.9 | 0 | 0 | 0 | 0 | 107.8 | D64 D69 | D64-V67 VanDerWaalsContact O-CB 3.3Å; D64-V67 WeakPolarHBondContact O-CB 3.27Å; D64-V67 VanDerWaalsContact O-CG2 3.26Å; D64-V67 WeakPolarHBondContact O-CG2 3.2Å; D64-V67 PolarHBondContact O-N 3.03Å; D64-V67 WeakPolarHBondContact OD1-CG2 3.29Å; V67-D69 PolarHBondContact O-N 3.38Å |
| 68 | D | 62.9 | Low | 70.6 | Confident | 81 Ų | 81 | 108.1 Ų | 108.1 | 43% | 0.433 | 52% | 0.521 | S | S | . | . | trans | -65.3 | 72.3 | -177.9 | -163.7 | 20.1 | 0 | 0 | 0 | 109.8 | I66 H73 R76 | I66-D68 PolarHBondContact O-N 3.32Å; I66-D68 VanDerWaalsContact O-N 3.17Å; D68-H73 VanDerWaalsContact CG-NE2 3.35Å; D68-H73 PolarHBondContact O-CE1 3.1Å; D68-H73 PolarHBondContact O-ND1 2.94Å; D68-H73 IonicContact OD1-CD2 3.99Å; D68-H73 IonicContact OD1-CE1 3.18Å; D68-H73 PolarHBondContact OD1-CE1 3.27Å; D68-H73 IonicContact OD1-ND1 3.57Å; D68-H73 IonicContact OD1-NE2 3.48Å; D68-H73 PolarHBondContact OD1-NE2 2.77Å; D68-H73 IonicContact OD2-CE1 3.02Å; D68-H73 PolarHBondContact OD2-CE1 2.9Å; D68-H73 IonicContact OD2-NE2 2.97Å; D68-H73 PolarHBondContact OD2-NE2 2.64Å; D68-R76 IonicContact OD1-NH1 3.13Å; D68-R76 PolarHBondContact OD1-NH1 3.12Å; D68-R76 VanDerWaalsContact OD1-NH1 3.13Å | ||
| 69 | D | 69.8 | Low | 71.6 | Confident | 94 Ų | 94 | 100.1 Ų | 100.1 | 50% | 0.503 | 49% | 0.492 | S | S | . | . | trans | -63.7 | 144.7 | -170.1 | -147.9 | 10.6 | 0 | 0 | 0 | 108.2 | V67 F71 T72 H73 | V67-D69 PolarHBondContact O-N 3.38Å; D69-F71 CarbonylContact O-C 3.59Å; D69-F71 PolarHBondContact O-N 3.04Å; D69-T72 WeakPolarHBondContact O-CA 3.38Å; D69-T72 WeakPolarHBondContact O-CB 3.45Å; D69-T72 PolarHBondContact O-N 3.06Å; D69-H73 PolarHBondContact O-N 3.35Å; D69-H73 VanDerWaalsContact O-N 3.11Å; D69-H73 PolarHBondContact O-ND1 2.98Å | ||
| 70 | E | 74.5 | Confident | 72.6 | Confident | 152 Ų | 152 | 98.8 Ų | 98.8 | 71% | 0.71 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -52.5 | -30 | 177.3 | -54.8 | 176.2 | -165.4 | 0 | 0 | 110.9 | H73 H74 | E70-H73 WeakPolarHBondContact O-CB 3.47Å; E70-H73 PolarHBondContact O-N 3.21Å; E70-H74 PolarHBondContact O-N 3.48Å; E70-H74 PolarHBondContact O-ND1 2.84Å |
| 71 | F | 78.2 | Confident | 73.5 | Confident | 131 Ų | 131 | 101.1 Ų | 101.1 | 58% | 0.575 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -64.2 | -46.5 | 172 | -176.4 | -112.5 | 0 | 0 | 0 | 113.3 | D69 H73 H74 L75 | D69-F71 CarbonylContact O-C 3.59Å; D69-F71 PolarHBondContact O-N 3.04Å; F71-H73 PolarHBondContact O-N 3.43Å; F71-H74 PolarHBondContact O-N 3.41Å; F71-L75 HydrophobicContact CD1-CD1 3.68Å; F71-L75 HydrophobicContact CD1-CG 4.32Å; F71-L75 HydrophobicContact CE1-CD1 3.16Å; F71-L75 HydrophobicContact CE1-CG 3.9Å; F71-L75 HydrophobicContact CE2-CD1 4.32Å; F71-L75 HydrophobicContact CE2-CG 4.17Å; F71-L75 HydrophobicContact CG-CD1 4.45Å; F71-L75 HydrophobicContact CZ-CD1 3.53Å; F71-L75 HydrophobicContact CZ-CD2 4.26Å; F71-L75 HydrophobicContact CZ-CG 3.81Å; F71-L75 WeakPolarHBondContact O-CB 3.2Å; F71-L75 PolarHBondContact O-N 3.23Å |
| 72 | T | 78.2 | Confident | 74.5 | Confident | 23 Ų | 23 | 102.5 Ų | 102.5 | 14% | 0.141 | 49% | 0.494 | C | S | . | . | H | α-helix | trans | -59.2 | -38.3 | 175.3 | -65.9 | 0 | 0 | 0 | 0 | 110.9 | D69 L75 R76 F86 V88 | D69-T72 WeakPolarHBondContact O-CA 3.38Å; D69-T72 WeakPolarHBondContact O-CB 3.45Å; D69-T72 PolarHBondContact O-N 3.06Å; T72-L75 PolarHBondContact O-N 3.01Å; T72-R76 HydrophobicContact CG2-CG 4.44Å; T72-R76 WeakPolarHBondContact O-CB 3.19Å; T72-R76 VanDerWaalsContact O-CG 3.27Å; T72-R76 WeakPolarHBondContact O-CG 3.34Å; T72-R76 PolarHBondContact O-N 3.26Å; T72-F86 HydrophobicContact CG2-CE1 4.24Å; T72-V88 HydrophobicContact CG2-CG2 4.45Å |
| 73 | H | 79 | Confident | 75 | Confident | 89 Ų | 89 | 96 Ų | 96 | 41% | 0.412 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64.5 | -49.8 | 174.5 | -69.6 | 98.8 | 0 | 0 | 0 | 112.9 | D68 D69 E70 F71 L75 R76 A77 | D68-H73 VanDerWaalsContact CG-NE2 3.35Å; D68-H73 PolarHBondContact O-CE1 3.1Å; D68-H73 PolarHBondContact O-ND1 2.94Å; D68-H73 IonicContact OD1-CD2 3.99Å; D68-H73 IonicContact OD1-CE1 3.18Å; D68-H73 PolarHBondContact OD1-CE1 3.27Å; D68-H73 IonicContact OD1-ND1 3.57Å; D68-H73 IonicContact OD1-NE2 3.48Å; D68-H73 PolarHBondContact OD1-NE2 2.77Å; D68-H73 IonicContact OD2-CE1 3.02Å; D68-H73 PolarHBondContact OD2-CE1 2.9Å; D68-H73 IonicContact OD2-NE2 2.97Å; D68-H73 PolarHBondContact OD2-NE2 2.64Å; D69-H73 PolarHBondContact O-N 3.35Å; D69-H73 VanDerWaalsContact O-N 3.11Å; D69-H73 PolarHBondContact O-ND1 2.98Å; E70-H73 WeakPolarHBondContact O-CB 3.47Å; E70-H73 PolarHBondContact O-N 3.21Å; F71-H73 PolarHBondContact O-N 3.43Å; H73-L75 VanDerWaalsContact C-N 3.32Å; H73-L75 PolarHBondContact O-N 3.42Å; H73-R76 PolarHBondContact O-N 2.73Å; H73-A77 WeakPolarHBondContact O-CB 2.94Å; H73-A77 PolarHBondContact O-N 3.21Å |
| 74 | H | 81.8 | Confident | 75.7 | Confident | 131 Ų | 131 | 95.8 Ų | 95.8 | 61% | 0.606 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -59.9 | -43.1 | 175.5 | -73.8 | 148.4 | 0 | 0 | 0 | 111.7 | E70 F71 A77 E78 | E70-H74 PolarHBondContact O-N 3.48Å; E70-H74 PolarHBondContact O-ND1 2.84Å; F71-H74 PolarHBondContact O-N 3.41Å; H74-A77 PolarHBondContact O-N 2.83Å; H74-E78 PolarHBondContact O-N 2.85Å |
| 75 | L | 80.7 | Confident | 76.1 | Confident | 46 Ų | 46 | 95.4 Ų | 95.4 | 24% | 0.241 | 50% | 0.498 | C | S | . | . | H | α-helix | trans | -59.9 | -50.7 | 175.2 | -87.9 | 177.9 | 0 | 0 | 0 | 111.3 | F71 T72 H73 A77 E78 F79 F86 | F71-L75 HydrophobicContact CD1-CD1 3.68Å; F71-L75 HydrophobicContact CD1-CG 4.32Å; F71-L75 HydrophobicContact CE1-CD1 3.16Å; F71-L75 HydrophobicContact CE1-CG 3.9Å; F71-L75 HydrophobicContact CE2-CD1 4.32Å; F71-L75 HydrophobicContact CE2-CG 4.17Å; F71-L75 HydrophobicContact CG-CD1 4.45Å; F71-L75 HydrophobicContact CZ-CD1 3.53Å; F71-L75 HydrophobicContact CZ-CD2 4.26Å; F71-L75 HydrophobicContact CZ-CG 3.81Å; F71-L75 WeakPolarHBondContact O-CB 3.2Å; F71-L75 PolarHBondContact O-N 3.23Å; T72-L75 PolarHBondContact O-N 3.01Å; H73-L75 VanDerWaalsContact C-N 3.32Å; H73-L75 PolarHBondContact O-N 3.42Å; L75-A77 VanDerWaalsContact C-N 3.29Å; L75-A77 PolarHBondContact O-N 3.28Å; L75-E78 PolarHBondContact O-N 3.46Å; L75-F79 HydrophobicContact CD2-CD2 4.38Å; L75-F79 HydrophobicContact CD2-CE2 4.04Å; L75-F79 VanDerWaalsContact O-CB 3.29Å; L75-F79 WeakPolarHBondContact O-CB 3.38Å; L75-F79 WeakPolarHBondContact O-CD2 3.46Å; L75-F79 PolarHBondContact O-N 3.39Å; L75-F86 HydrophobicContact CD1-CZ 4.18Å |
| 76 | R | 81.8 | Confident | 76.4 | Confident | 92 Ų | 92 | 91.5 Ų | 91.5 | 35% | 0.347 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -57 | -42.1 | 177.2 | -78.3 | 174.8 | 177.8 | 160.1 | 3.3 | 111.6 | D68 T72 H73 F79 Q80 F86 | D68-R76 IonicContact OD1-NH1 3.13Å; D68-R76 PolarHBondContact OD1-NH1 3.12Å; D68-R76 VanDerWaalsContact OD1-NH1 3.13Å; T72-R76 HydrophobicContact CG2-CG 4.44Å; T72-R76 WeakPolarHBondContact O-CB 3.19Å; T72-R76 VanDerWaalsContact O-CG 3.27Å; T72-R76 WeakPolarHBondContact O-CG 3.34Å; T72-R76 PolarHBondContact O-N 3.26Å; H73-R76 PolarHBondContact O-N 2.73Å; R76-F79 PolarHBondContact O-N 2.85Å; R76-Q80 WeakPolarHBondContact O-CB 3.16Å; R76-Q80 VanDerWaalsContact O-CG 3.24Å; R76-Q80 WeakPolarHBondContact O-CG 3.48Å; R76-Q80 PolarHBondContact O-N 2.79Å; R76-F86 HydrophobicContact CG-CB 4.09Å; R76-F86 HydrophobicContact CG-CD1 3.82Å; R76-F86 HydrophobicContact CG-CG 4.41Å |
| 77 | A | 84.1 | Confident | 76.7 | Confident | 45 Ų | 45 | 92.2 Ų | 92.2 | 37% | 0.372 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -64.5 | -45.4 | 179 | 0 | 0 | 0 | 0 | 0 | 112.7 | H73 H74 L75 F79 Q80 K81 | H73-A77 WeakPolarHBondContact O-CB 2.94Å; H73-A77 PolarHBondContact O-N 3.21Å; H74-A77 PolarHBondContact O-N 2.83Å; L75-A77 VanDerWaalsContact C-N 3.29Å; L75-A77 PolarHBondContact O-N 3.28Å; A77-F79 VanDerWaalsContact C-N 3.3Å; A77-F79 PolarHBondContact O-N 3.16Å; A77-Q80 PolarHBondContact O-N 3.31Å; A77-K81 PolarHBondContact O-N 3.07Å; A77-K81 VanDerWaalsContact O-N 3.09Å |
| 78 | E | 83.6 | Confident | 76.7 | Confident | 88 Ų | 88 | 91.3 Ų | 91.3 | 41% | 0.411 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -67.6 | -32.9 | 174.9 | -71.3 | -57.1 | 129.3 | 0 | 0 | 112 | H74 L75 K81 Q82 | H74-E78 PolarHBondContact O-N 2.85Å; L75-E78 PolarHBondContact O-N 3.46Å; E78-K81 IonicContact OE1-NZ 2.73Å; E78-K81 PolarHBondContact OE1-NZ 3.24Å; E78-K81 IonicContact OE2-NZ 3.97Å; E78-Q82 WeakPolarHBondContact O-CG 3.43Å; E78-Q82 PolarHBondContact O-N 3Å |
| 79 | F | 83.2 | Confident | 76.7 | Confident | 57 Ų | 57 | 92.2 Ų | 92.2 | 25% | 0.25 | 49% | 0.488 | C | S | . | . | H | α-helix | trans | -65.2 | -45.9 | 174.6 | -91.2 | -116.3 | 0 | 0 | 0 | 112.3 | L75 R76 A77 K81 Q82 G83 K84 F86 | L75-F79 HydrophobicContact CD2-CD2 4.38Å; L75-F79 HydrophobicContact CD2-CE2 4.04Å; L75-F79 VanDerWaalsContact O-CB 3.29Å; L75-F79 WeakPolarHBondContact O-CB 3.38Å; L75-F79 WeakPolarHBondContact O-CD2 3.46Å; L75-F79 PolarHBondContact O-N 3.39Å; R76-F79 PolarHBondContact O-N 2.85Å; A77-F79 VanDerWaalsContact C-N 3.3Å; A77-F79 PolarHBondContact O-N 3.16Å; F79-K81 PolarHBondContact O-N 2.69Å; F79-Q82 CarbonylContact O-C 3.59Å; F79-Q82 PolarHBondContact O-N 3.39Å; F79-Q82 VanDerWaalsContact O-N 3.12Å; F79-G83 PolarHBondContact O-N 3.01Å; F79-K84 CarbonylContact C-O 3.02Å; F79-K84 HydrophobicContact CB-CD 3.56Å; F79-K84 WeakPolarHBondContact CB-O 3.27Å; F79-K84 HydrophobicContact CD1-CD 2.89Å; F79-K84 HydrophobicContact CD1-CG 4.28Å; F79-K84 HydrophobicContact CD2-CD 4.08Å; F79-K84 HydrophobicContact CE1-CD 3.43Å; F79-K84 VanDerWaalsContact CE1-CD 3.43Å; F79-K84 HydrophobicContact CG-CD 3.24Å; F79-K84 HydrophobicContact CZ-CD 4.23Å; F79-K84 WeakPolarHBondContact O-CD 3.2Å; F79-K84 PolarHBondContact O-N 3.16Å; F79-F86 HydrophobicContact CB-CB 3.86Å; F79-F86 HydrophobicContact CD1-CB 3.61Å; F79-F86 AromaticContact CD1-CD2 3.94Å; F79-F86 HydrophobicContact CD1-CD2 3.94Å; F79-F86 HydrophobicContact CD1-CG 4.25Å; F79-F86 HydrophobicContact CD2-CB 4.45Å; F79-F86 HydrophobicContact CD2-CD2 4.42Å; F79-F86 HydrophobicContact CE1-CB 4.37Å; F79-F86 AromaticContact CE1-CD2 3.85Å; F79-F86 HydrophobicContact CE1-CD2 3.85Å; F79-F86 HydrophobicContact CE2-CD2 4.26Å; F79-F86 HydrophobicContact CG-CB 3.72Å; F79-F86 HydrophobicContact CG-CD2 4.3Å; F79-F86 HydrophobicContact CG-CG 4.39Å; F79-F86 HydrophobicContact CZ-CD2 4.01Å |
| 80 | Q | 82.6 | Confident | 76.2 | Confident | 140 Ų | 140 | 95.2 Ų | 95.2 | 65% | 0.654 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -62.8 | -39.5 | 176.3 | -72.9 | 170 | 11.3 | 0 | 0 | 112.9 | R76 A77 Q82 G83 | R76-Q80 WeakPolarHBondContact O-CB 3.16Å; R76-Q80 VanDerWaalsContact O-CG 3.24Å; R76-Q80 WeakPolarHBondContact O-CG 3.48Å; R76-Q80 PolarHBondContact O-N 2.79Å; A77-Q80 PolarHBondContact O-N 3.31Å; Q80-Q82 PolarHBondContact O-N 3.38Å; Q80-G83 PolarHBondContact O-N 2.92Å |
| 81 | K | 84.4 | Confident | 75.2 | Confident | 158 Ų | 158 | 94.2 Ų | 94.2 | 69% | 0.687 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -57.2 | -34.6 | 173.6 | -79.4 | 176.4 | 173.4 | 171.3 | 0 | 112.9 | A77 E78 F79 G83 | A77-K81 PolarHBondContact O-N 3.07Å; A77-K81 VanDerWaalsContact O-N 3.09Å; E78-K81 IonicContact OE1-NZ 2.73Å; E78-K81 PolarHBondContact OE1-NZ 3.24Å; E78-K81 IonicContact OE2-NZ 3.97Å; F79-K81 PolarHBondContact O-N 2.69Å; K81-G83 VanDerWaalsContact C-N 3.27Å |
| 82 | Q | 81.8 | Confident | 74 | Confident | 129 Ų | 129 | 91.7 Ų | 91.7 | 60% | 0.603 | 50% | 0.496 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.6 | 4.3 | 178.4 | -64.3 | 177.5 | 30.2 | 0 | 0 | 112.7 | E78 F79 Q80 K84 | E78-Q82 WeakPolarHBondContact O-CG 3.43Å; E78-Q82 PolarHBondContact O-N 3Å; F79-Q82 CarbonylContact O-C 3.59Å; F79-Q82 PolarHBondContact O-N 3.39Å; F79-Q82 VanDerWaalsContact O-N 3.12Å; Q80-Q82 PolarHBondContact O-N 3.38Å; Q82-K84 VanDerWaalsContact C-N 3.29Å; Q82-K84 HydrophobicContact CB-CD 4.19Å; Q82-K84 HydrophobicContact CB-CG 3.73Å; Q82-K84 PolarHBondContact O-N 2.65Å |
| 83 | G | 78.4 | Confident | 72.9 | Confident | 75 Ų | 75 | 94.3 Ų | 94.3 | 77% | 0.773 | 52% | 0.52 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 71.7 | 18.9 | -178.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | F79 Q80 K81 | F79-G83 PolarHBondContact O-N 3.01Å; Q80-G83 PolarHBondContact O-N 2.92Å; K81-G83 VanDerWaalsContact C-N 3.27Å |
| 84 | K | 76.1 | Confident | 71.2 | Confident | 70 Ų | 70 | 98.4 Ų | 98.4 | 30% | 0.304 | 55% | 0.545 | S | S | . | . | trans | -116.4 | 132.2 | -178.4 | 38.6 | 91.6 | 179.6 | -84.5 | 0 | 110.6 | F79 Q82 | F79-K84 CarbonylContact C-O 3.02Å; F79-K84 HydrophobicContact CB-CD 3.56Å; F79-K84 WeakPolarHBondContact CB-O 3.27Å; F79-K84 HydrophobicContact CD1-CD 2.89Å; F79-K84 HydrophobicContact CD1-CG 4.28Å; F79-K84 HydrophobicContact CD2-CD 4.08Å; F79-K84 HydrophobicContact CE1-CD 3.43Å; F79-K84 VanDerWaalsContact CE1-CD 3.43Å; F79-K84 HydrophobicContact CG-CD 3.24Å; F79-K84 HydrophobicContact CZ-CD 4.23Å; F79-K84 WeakPolarHBondContact O-CD 3.2Å; F79-K84 PolarHBondContact O-N 3.16Å; Q82-K84 VanDerWaalsContact C-N 3.29Å; Q82-K84 HydrophobicContact CB-CD 4.19Å; Q82-K84 HydrophobicContact CB-CG 3.73Å; Q82-K84 PolarHBondContact O-N 2.65Å | ||
| 85 | A | 73.5 | Confident | 69.5 | Low | 89 Ų | 89 | 100.4 Ų | 100.4 | 74% | 0.736 | 56% | 0.559 | S | S | * | * | trans | -82.2 | 121.7 | 178.1 | 0 | 0 | 0 | 0 | 0 | 109.2 | V87 | A85-V87 PolarHBondContact O-N 3.42Š| ||
| 86 | F | 67.6 | Low | 67.6 | Low | 61 Ų | 61 | 109.1 Ų | 109.1 | 27% | 0.268 | 61% | 0.606 | S | S | . | * | trans | -80.5 | 98.4 | 168.5 | -176.2 | -107.3 | 0 | 0 | 0 | 108.4 | T72 L75 R76 F79 V88 | T72-F86 HydrophobicContact CG2-CE1 4.24Å; L75-F86 HydrophobicContact CD1-CZ 4.18Å; R76-F86 HydrophobicContact CG-CB 4.09Å; R76-F86 HydrophobicContact CG-CD1 3.82Å; R76-F86 HydrophobicContact CG-CG 4.41Å; F79-F86 HydrophobicContact CB-CB 3.86Å; F79-F86 HydrophobicContact CD1-CB 3.61Å; F79-F86 AromaticContact CD1-CD2 3.94Å; F79-F86 HydrophobicContact CD1-CD2 3.94Å; F79-F86 HydrophobicContact CD1-CG 4.25Å; F79-F86 HydrophobicContact CD2-CB 4.45Å; F79-F86 HydrophobicContact CD2-CD2 4.42Å; F79-F86 HydrophobicContact CE1-CB 4.37Å; F79-F86 AromaticContact CE1-CD2 3.85Å; F79-F86 HydrophobicContact CE1-CD2 3.85Å; F79-F86 HydrophobicContact CE2-CD2 4.26Å; F79-F86 HydrophobicContact CG-CB 3.72Å; F79-F86 HydrophobicContact CG-CD2 4.3Å; F79-F86 HydrophobicContact CG-CG 4.39Å; F79-F86 HydrophobicContact CZ-CD2 4.01Å; F86-V88 HydrophobicContact CD1-CG2 4.03Å; F86-V88 HydrophobicContact CE1-CG2 3.37Å; F86-V88 HydrophobicContact CZ-CG2 4.06Å | ||
| 87 | V | 67 | Low | 66.9 | Low | 109 Ų | 109 | 110 Ų | 110 | 66% | 0.661 | 62% | 0.619 | S | S | * | * | trans | -89.9 | 114.8 | 165.1 | 177.1 | 0 | 0 | 0 | 0 | 105.6 | A85 P89 | A85-V87 PolarHBondContact O-N 3.42Å; V87-P89 WeakPolarHBondContact O-CD 3.48Å | ||
| 88 | V | 62.6 | Low | 66 | Low | 58 Ų | 58 | 113.4 Ų | 113.4 | 35% | 0.352 | 63% | 0.632 | S | S | . | * | trans | -62.3 | 115.4 | 161.8 | 178.6 | 0 | 0 | 0 | 0 | 104.8 | T72 F86 E90 | T72-V88 HydrophobicContact CG2-CG2 4.45Å; F86-V88 HydrophobicContact CD1-CG2 4.03Å; F86-V88 HydrophobicContact CE1-CG2 3.37Å; F86-V88 HydrophobicContact CZ-CG2 4.06Å; V88-E90 PolarHBondContact O-N 2.83Å; V88-E90 VanDerWaalsContact O-N 3.1Å | ||
| 89 | P | 61.5 | Low | 65 | Low | 100 Ų | 100 | 114.8 Ų | 114.8 | 65% | 0.649 | 64% | 0.644 | S | S | * | * | trans | -59.8 | 119.1 | 173.5 | -19.3 | 33.3 | 0 | 0 | 0 | 107.3 | V87 I91 | V87-P89 WeakPolarHBondContact O-CD 3.48Å; P89-I91 PolarHBondContact O-N 2.98Å | ||
| 90 | E | 60 | Low | 64 | Low | 157 Ų | 157 | 118.2 Ų | 118.2 | 73% | 0.734 | 67% | 0.668 | S | S | * | * | trans | -51.9 | 111.9 | 168.7 | -79 | 178.7 | 158.9 | 0 | 0 | 107.4 | V88 S92 | V88-E90 PolarHBondContact O-N 2.83Å; V88-E90 VanDerWaalsContact O-N 3.1Å; E90-S92 PolarHBondContact O-N 2.69Å | ||
| 91 | I | 53.7 | Low | 62.8 | Low | 130 Ų | 130 | 116.9 Ų | 116.9 | 67% | 0.667 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.1 | 51.9 | 167.8 | 51.9 | 159.7 | 0 | 0 | 0 | 109.1 | P89 | P89-I91 PolarHBondContact O-N 2.98Š|
| 92 | S | 53.4 | Low | 61.4 | Low | 78 Ų | 78 | 114.1 Ų | 114.1 | 55% | 0.545 | 67% | 0.667 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -136 | 11.9 | -172.6 | -40.1 | 0 | 0 | 0 | 0 | 114 | E90 | E90-S92 PolarHBondContact O-N 2.69Š|
| 93 | A | 53.6 | Low | 59.9 | Low | 78 Ų | 78 | 113.1 Ų | 113.1 | 65% | 0.645 | 67% | 0.672 | S | S | * | * | trans | -140 | 7.5 | -170.1 | 0 | 0 | 0 | 0 | 0 | 117.7 | L95 | A93-L95 VanDerWaalsContact C-N 3.3Å; A93-L95 PolarHBondContact O-N 3.19Å | ||
| 94 | N | 44 | Very low | 58.5 | Low | 176 Ų | 176 | 116 Ų | 116 | 94% | 0.941 | 66% | 0.664 | S | S | * | * | trans | -101.7 | 64.9 | 161.8 | -64.1 | -54.6 | 0 | 0 | 0 | 109 | ||||
| 95 | L | 46.4 | Very low | 57 | Low | 172 Ų | 172 | 119.8 Ų | 119.8 | 90% | 0.901 | 69% | 0.694 | S | S | * | * | trans | -81.9 | 92.1 | 154.6 | -179 | 71.5 | 0 | 0 | 0 | 105.8 | A93 | A93-L95 VanDerWaalsContact C-N 3.3Å; A93-L95 PolarHBondContact O-N 3.19Å | ||
| 96 | D | 41 | Very low | 55.5 | Low | 230 Ų | 230 | 122.6 Ų | 122.6 | 100% | 1.23 | 69% | 0.69 | S | S | * | * | trans | -124.4 | 0 | 161.8 | -165.6 | -132.3 | 0 | 0 | 0 | 108.8 |
Retrieved 96 of 96 residues in 22 ms
(Link to these results)