| 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 | 29.6 | Very low | 43.9 | Very low | 241 Ų | 241 | 138.9 Ų | 138.9 | 100% | 1.187 | 76% | 0.764 | S | S | * | * | 0 | 141.8 | 0 | -84.2 | -81 | 165.4 | 0 | 0 | 108 | |||||
| 2 | P | 59.3 | Low | 43.8 | Very low | 116 Ų | 116 | 136.2 Ų | 136.2 | 75% | 0.753 | 76% | 0.762 | S | S | * | * | trans | -116.5 | -169.1 | -136.4 | 40.2 | -26.7 | 0 | 0 | 0 | 112.1 | ||||
| 3 | A | 43.2 | Very low | 44.7 | Very low | 86 Ų | 86 | 135.3 Ų | 135.3 | 71% | 0.711 | 77% | 0.766 | S | S | * | * | trans | 129.1 | 134.7 | 161.6 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 4 | D | 40.6 | Very low | 44.7 | Very low | 119 Ų | 119 | 136.1 Ų | 136.1 | 64% | 0.636 | 77% | 0.774 | S | S | * | * | cis | -173 | 126.9 | 14 | -134.1 | -133.8 | 0 | 0 | 0 | 106.6 | ||||
| 5 | I | 45.8 | Very low | 44.8 | Very low | 109 Ų | 109 | 133.3 Ų | 133.3 | 56% | 0.559 | 77% | 0.774 | S | S | * | * | 79.4 | 118.9 | 106 | 83.7 | 164.6 | 0 | 0 | 0 | 115.9 | |||||
| 6 | M | 50.7 | Low | 44.8 | Very low | 146 Ų | 146 | 131.4 Ų | 131.4 | 72% | 0.719 | 78% | 0.779 | S | S | * | * | 78.3 | 105 | 103 | 88.1 | -177.6 | 65.7 | 0 | 0 | 112.9 | |||||
| 7 | E | 46.8 | Very low | 44.9 | Very low | 176 Ų | 176 | 131.5 Ų | 131.5 | 82% | 0.822 | 78% | 0.781 | S | S | * | * | 98.2 | 116 | 88.4 | -170.2 | -173.3 | 122.3 | 0 | 0 | 110.9 | |||||
| 8 | K | 45.4 | Very low | 44.8 | Very low | 194 Ų | 194 | 132 Ų | 132 | 84% | 0.843 | 79% | 0.786 | S | S | * | * | trans | -161.9 | 94.8 | 145.6 | -148.3 | 164.3 | 173.3 | 174.4 | 0 | 111.1 | ||||
| 9 | T | 42.9 | Very low | 44.9 | Very low | 108 Ų | 108 | 129.9 Ų | 129.9 | 66% | 0.663 | 79% | 0.785 | S | S | * | * | 61.9 | 118.2 | 103.6 | -22.3 | 0 | 0 | 0 | 0 | 115.7 | |||||
| 10 | S | 39.1 | Very low | 44.6 | Very low | 99 Ų | 99 | 128.8 Ų | 128.8 | 69% | 0.692 | 78% | 0.783 | S | S | * | * | 128.1 | 101.8 | 112.7 | -152.3 | 0 | 0 | 0 | 0 | 116.9 | |||||
| 11 | V | 39.8 | Very low | 44.9 | Very low | 134 Ų | 134 | 130 Ų | 130 | 81% | 0.812 | 78% | 0.782 | S | S | * | * | trans | 20.8 | 125.8 | 130.7 | -139.5 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 12 | S | 42.5 | Very low | 45.4 | Very low | 106 Ų | 106 | 125.6 Ų | 125.6 | 74% | 0.741 | 76% | 0.763 | S | S | * | * | trans | -39.4 | 167.5 | 148.6 | -63.8 | 0 | 0 | 0 | 0 | 114 | ||||
| 13 | P | 55.6 | Low | 45.1 | Very low | 125 Ų | 125 | 126.6 Ų | 126.6 | 81% | 0.812 | 77% | 0.767 | S | S | * | * | cis | -147.1 | 174.8 | 30.9 | 39.5 | -18.1 | 0 | 0 | 0 | 116.2 | ||||
| 14 | V | 44.3 | Very low | 45.4 | Very low | 147 Ų | 147 | 128.3 Ų | 128.3 | 89% | 0.891 | 77% | 0.769 | S | S | * | * | trans | -168.5 | 136.8 | 138 | 70.1 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 15 | A | 46.2 | Very low | 45.8 | Very low | 93 Ų | 93 | 128.2 Ų | 128.2 | 77% | 0.769 | 78% | 0.775 | S | S | * | * | trans | -75 | 143.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 16 | A | 45.3 | Very low | 45.9 | Very low | 104 Ų | 104 | 129.8 Ų | 129.8 | 86% | 0.86 | 79% | 0.785 | S | S | * | * | trans | -147.3 | 105.3 | 152.7 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 17 | T | 45.5 | Very low | 45.8 | Very low | 132 Ų | 132 | 132.4 Ų | 132.4 | 81% | 0.81 | 79% | 0.792 | S | S | * | * | trans | -88.4 | 126.8 | 163.3 | -67.5 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 18 | T | 43.5 | Very low | 46 | Very low | 141 Ų | 141 | 128.3 Ų | 128.3 | 87% | 0.865 | 78% | 0.78 | S | S | * | * | trans | -161.6 | 136.4 | 131.5 | 33.8 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 19 | A | 46 | Very low | 46.3 | Very low | 92 Ų | 92 | 127.7 Ų | 127.7 | 76% | 0.76 | 78% | 0.778 | S | S | * | * | trans | -71.6 | 151.7 | -177.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 20 | S | 39 | Very low | 46.8 | Very low | 107 Ų | 107 | 126.4 Ų | 126.4 | 75% | 0.748 | 77% | 0.77 | S | S | * | * | trans | -156.1 | 112.8 | 138.9 | -157.8 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 21 | M | 52.5 | Low | 47.6 | Very low | 154 Ų | 154 | 125.2 Ų | 125.2 | 76% | 0.759 | 77% | 0.766 | S | S | * | * | trans | -44.5 | 129.9 | 159.3 | 42.6 | -111.2 | 161.1 | 0 | 0 | 112.6 | ||||
| 22 | N | 40.3 | Very low | 48.4 | Very low | 150 Ų | 150 | 121.5 Ų | 121.5 | 80% | 0.802 | 75% | 0.746 | S | S | * | * | trans | -143.4 | 89.4 | 146.5 | -123.1 | 27.6 | 0 | 0 | 0 | 109.8 | T24 | N22-T24 PolarHBondContact O-N 3.2Š| ||
| 23 | T | 52 | Low | 48.9 | Very low | 136 Ų | 136 | 122 Ų | 122 | 83% | 0.834 | 74% | 0.736 | S | S | * | * | trans | -61.7 | 120 | 158.1 | 44.5 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 24 | T | 49.4 | Very low | 48.9 | Very low | 123 Ų | 123 | 122.8 Ų | 122.8 | 76% | 0.755 | 73% | 0.729 | S | S | * | * | trans | -119 | 148.7 | 164.1 | 41.9 | 0 | 0 | 0 | 0 | 110.5 | N22 | N22-T24 PolarHBondContact O-N 3.2Š| ||
| 25 | P | 50 | Low | 49.6 | Very low | 117 Ų | 117 | 125.4 Ų | 125.4 | 76% | 0.76 | 72% | 0.723 | S | S | * | * | trans | -102 | 157.3 | -141.7 | 36.5 | -29.2 | 0 | 0 | 0 | 113.1 | ||||
| 26 | D | 48.1 | Very low | 50.2 | Low | 142 Ų | 142 | 128.1 Ų | 128.1 | 76% | 0.759 | 72% | 0.717 | S | S | * | * | trans | 46 | 90.1 | 150.3 | -146.8 | -98.2 | 0 | 0 | 0 | 117.5 | ||||
| 27 | K | 48.5 | Very low | 50.9 | Low | 200 Ų | 200 | 125.9 Ų | 125.9 | 87% | 0.87 | 70% | 0.695 | S | S | * | * | trans | -108.3 | 107 | 149.1 | -162.4 | 154.7 | 179.1 | 173 | 0 | 107 | K29 | K27-K29 PolarHBondContact O-N 2.86Š| ||
| 28 | P | 49.9 | Very low | 52.1 | Low | 90 Ų | 90 | 122.2 Ų | 122.2 | 58% | 0.584 | 68% | 0.675 | S | S | * | * | trans | -64.8 | 110.2 | 178.3 | 24 | -29.5 | 0 | 0 | 0 | 107.3 | T30 | P28-T30 VanDerWaalsContact C-N 3.34Å; P28-T30 PolarHBondContact O-N 3.39Å | ||
| 29 | K | 52.8 | Low | 54 | Low | 181 Ų | 181 | 123.6 Ų | 123.6 | 79% | 0.787 | 67% | 0.669 | S | S | * | * | trans | -53.1 | 107.9 | 161.9 | -73.5 | 179.5 | 178.6 | 174.5 | 0 | 105.5 | K27 A31 | K27-K29 PolarHBondContact O-N 2.86Å; K29-A31 PolarHBondContact O-N 2.72Å | ||
| 30 | T | 52.2 | Low | 55.9 | Low | 82 Ų | 82 | 123 Ų | 123 | 50% | 0.503 | 66% | 0.657 | S | S | . | * | trans | -50.4 | 132.6 | -170.1 | 63.1 | 0 | 0 | 0 | 0 | 109.4 | P28 S32 E33 | P28-T30 VanDerWaalsContact C-N 3.34Å; P28-T30 PolarHBondContact O-N 3.39Å; T30-S32 PolarHBondContact O-N 3.39Å; T30-E33 PolarHBondContact O-N 3.43Å | ||
| 31 | A | 55.7 | Low | 58.3 | Low | 73 Ų | 73 | 122 Ų | 122 | 60% | 0.603 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -53 | -20.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | K29 R35 | K29-A31 PolarHBondContact O-N 2.72Å; A31-R35 WeakPolarHBondContact O-CG 3.3Å; A31-R35 PolarHBondContact O-N 2.92Å |
| 32 | S | 56.3 | Low | 60.2 | Low | 56 Ų | 56 | 119.8 Ų | 119.8 | 39% | 0.392 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -60 | -45.3 | 169.5 | -169.6 | 0 | 0 | 0 | 0 | 113.4 | T30 R35 K36 | T30-S32 PolarHBondContact O-N 3.39Å; S32-R35 PolarHBondContact O-N 3.4Å; S32-K36 WeakPolarHBondContact O-CB 3.26Å; S32-K36 VanDerWaalsContact O-CD 3.3Å; S32-K36 WeakPolarHBondContact O-CD 3.47Å; S32-K36 WeakPolarHBondContact O-CG 3.42Å; S32-K36 PolarHBondContact O-N 3.09Å; S32-K36 WeakPolarHBondContact OG-CE 3.46Å; S32-K36 PolarHBondContact OG-NZ 3.38Å |
| 33 | E | 54.1 | Low | 62.8 | Low | 116 Ų | 116 | 114.7 Ų | 114.7 | 54% | 0.542 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -71.2 | -35.3 | -177.9 | -157 | -179 | 129.4 | 0 | 0 | 112.1 | T30 K36 S37 | T30-E33 PolarHBondContact O-N 3.43Å; E33-K36 PolarHBondContact O-N 3.01Å; E33-S37 WeakPolarHBondContact O-CB 3.36Å; E33-S37 PolarHBondContact O-N 3.1Å; E33-S37 PolarHBondContact O-OG 2.93Å |
| 34 | H | 55.7 | Low | 64.9 | Low | 143 Ų | 143 | 115.9 Ų | 115.9 | 66% | 0.662 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -68.2 | -37 | 174.3 | -150.1 | 81.7 | 0 | 0 | 0 | 112.1 | S37 S38 | H34-S37 PolarHBondContact O-OG 2.92Å; H34-S38 VanDerWaalsContact O-CB 3.24Å; H34-S38 WeakPolarHBondContact O-CB 3.27Å; H34-S38 PolarHBondContact O-N 2.71Å |
| 35 | R | 58.2 | Low | 67.1 | Low | 202 Ų | 202 | 117.6 Ų | 117.6 | 76% | 0.762 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -71.4 | -33.5 | 173.7 | -73.3 | -179.6 | -177.9 | -175.1 | 1.8 | 112.8 | A31 S32 | A31-R35 WeakPolarHBondContact O-CG 3.3Å; A31-R35 PolarHBondContact O-N 2.92Å; S32-R35 PolarHBondContact O-N 3.4Å |
| 36 | K | 59.4 | Low | 69.4 | Low | 149 Ų | 149 | 117 Ų | 117 | 65% | 0.648 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -72.5 | -33.8 | 176.1 | -70.7 | 161.9 | 177.6 | 173.2 | 0 | 112.7 | S32 E33 P40 | S32-K36 WeakPolarHBondContact O-CB 3.26Å; S32-K36 VanDerWaalsContact O-CD 3.3Å; S32-K36 WeakPolarHBondContact O-CD 3.47Å; S32-K36 WeakPolarHBondContact O-CG 3.42Å; S32-K36 PolarHBondContact O-N 3.09Å; S32-K36 WeakPolarHBondContact OG-CE 3.46Å; S32-K36 PolarHBondContact OG-NZ 3.38Å; E33-K36 PolarHBondContact O-N 3.01Å; K36-P40 WeakPolarHBondContact O-CD 3.35Å |
| 37 | S | 61 | Low | 71.7 | Confident | 57 Ų | 57 | 115.7 Ų | 115.7 | 40% | 0.399 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -91.3 | -15.3 | 179.4 | 56.6 | 0 | 0 | 0 | 0 | 114.8 | E33 H34 P40 I41 | E33-S37 WeakPolarHBondContact O-CB 3.36Å; E33-S37 PolarHBondContact O-N 3.1Å; E33-S37 PolarHBondContact O-OG 2.93Å; H34-S37 PolarHBondContact O-OG 2.92Å; S37-P40 VanDerWaalsContact O-CD 3.22Å; S37-P40 WeakPolarHBondContact O-CD 3.24Å; S37-P40 VanDerWaalsContact O-CG 3.23Å; S37-P40 WeakPolarHBondContact O-CG 3.35Å; S37-I41 WeakPolarHBondContact O-CG2 3.47Å; S37-I41 PolarHBondContact O-N 3.11Å |
| 38 | S | 68.9 | Low | 74.1 | Confident | 55 Ų | 55 | 108.9 Ų | 108.9 | 39% | 0.385 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -65.2 | -37.6 | 178.1 | -179 | 0 | 0 | 0 | 0 | 113.7 | H34 I41 M42 | H34-S38 VanDerWaalsContact O-CB 3.24Å; H34-S38 WeakPolarHBondContact O-CB 3.27Å; H34-S38 PolarHBondContact O-N 2.71Å; S38-I41 WeakPolarHBondContact O-CG2 3.46Å; S38-M42 WeakPolarHBondContact O-CB 3.37Å; S38-M42 WeakPolarHBondContact O-CG 3.37Å; S38-M42 PolarHBondContact O-N 3.12Å; S38-M42 VanDerWaalsContact O-N 3.08Å |
| 39 | K | 83.2 | Confident | 76.4 | Confident | 170 Ų | 170 | 113.2 Ų | 113.2 | 74% | 0.739 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -64.1 | -50.6 | 176.3 | -65.7 | -176.6 | 179.1 | -177.5 | 0 | 113 | I41 M42 E43 | K39-I41 VanDerWaalsContact C-N 3.33Å; K39-I41 PolarHBondContact O-N 3.08Å; K39-M42 PolarHBondContact O-N 3.23Å; K39-E43 WeakPolarHBondContact O-CB 3.4Å; K39-E43 PolarHBondContact O-N 2.91Å |
| 40 | P | 87.6 | Confident | 78.5 | Confident | 79 Ų | 79 | 107.8 Ų | 107.8 | 51% | 0.513 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -65.4 | -31.4 | 179 | 21.1 | -31 | 0 | 0 | 0 | 113.7 | K36 S37 K44 | K36-P40 WeakPolarHBondContact O-CD 3.35Å; S37-P40 VanDerWaalsContact O-CD 3.22Å; S37-P40 WeakPolarHBondContact O-CD 3.24Å; S37-P40 VanDerWaalsContact O-CG 3.23Å; S37-P40 WeakPolarHBondContact O-CG 3.35Å; P40-K44 WeakPolarHBondContact O-CB 3.45Å; P40-K44 PolarHBondContact O-N 3.31Å |
| 41 | I | 88.3 | Confident | 80.6 | Confident | 87 Ų | 87 | 107.5 Ų | 107.5 | 45% | 0.446 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -70.4 | -39.7 | 174.7 | -171.3 | 169.7 | 0 | 0 | 0 | 112.4 | S37 S38 K39 E43 K44 R45 | S37-I41 WeakPolarHBondContact O-CG2 3.47Å; S37-I41 PolarHBondContact O-N 3.11Å; S38-I41 WeakPolarHBondContact O-CG2 3.46Å; K39-I41 VanDerWaalsContact C-N 3.33Å; K39-I41 PolarHBondContact O-N 3.08Å; I41-E43 VanDerWaalsContact C-N 3.33Å; I41-K44 PolarHBondContact O-N 2.9Å; I41-R45 WeakPolarHBondContact O-CG 3.19Å; I41-R45 PolarHBondContact O-N 3.11Å |
| 42 | M | 93.3 | Very high | 82.6 | Confident | 108 Ų | 108 | 109.9 Ų | 109.9 | 53% | 0.532 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -64.7 | -40.7 | 175.8 | -72.7 | -60.5 | -67.2 | 0 | 0 | 111.5 | S38 K39 R45 R46 | S38-M42 WeakPolarHBondContact O-CB 3.37Å; S38-M42 WeakPolarHBondContact O-CG 3.37Å; S38-M42 PolarHBondContact O-N 3.12Å; S38-M42 VanDerWaalsContact O-N 3.08Å; K39-M42 PolarHBondContact O-N 3.23Å; M42-R45 WeakPolarHBondContact O-CB 3.35Å; M42-R45 PolarHBondContact O-N 3.28Å; M42-R46 PolarHBondContact O-N 2.88Å |
| 43 | E | 94.8 | Very high | 84.6 | Confident | 43 Ų | 43 | 110.2 Ų | 110.2 | 20% | 0.201 | 52% | 0.518 | C | S | . | . | H | α-helix | trans | -65.7 | -41.9 | 176.4 | 179.1 | 44.5 | -140.9 | 0 | 0 | 111.8 | K39 I41 R45 R46 R47 W267 | K39-E43 WeakPolarHBondContact O-CB 3.4Å; K39-E43 PolarHBondContact O-N 2.91Å; I41-E43 VanDerWaalsContact C-N 3.33Å; E43-R45 VanDerWaalsContact C-N 3.31Å; E43-R45 PolarHBondContact O-N 3.12Å; E43-R46 WeakPolarHBondContact O-CB 3.46Å; E43-R46 PolarHBondContact O-N 3.47Å; E43-R46 VanDerWaalsContact O-N 3.17Å; E43-R47 WeakPolarHBondContact O-CG 3.47Å; E43-R47 PolarHBondContact O-N 3.37Å; E43-R47 WeakPolarHBondContact OE1-CD 3.34Å; E43-R47 WeakPolarHBondContact OE1-CG 3.42Å; E43-R47 IonicContact OE1-CZ 3.62Å; E43-R47 IonicContact OE1-NE 3.67Å; E43-R47 PolarHBondContact OE1-NE 2.94Å; E43-R47 IonicContact OE1-NH2 2.71Å; E43-W267 WeakPolarHBondContact OE1-CH2 3.34Å; E43-W267 WeakPolarHBondContact OE1-CZ2 2.94Å; E43-W267 WeakPolarHBondContact OE1-CZ3 3.39Å; E43-W267 WeakPolarHBondContact OE2-CZ2 3.48Å |
| 44 | K | 95.3 | Very high | 86.6 | Confident | 161 Ų | 161 | 106 Ų | 106 | 70% | 0.7 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -57.4 | -43.6 | 171.7 | -173.6 | 175.6 | -179 | 177.8 | 0 | 112 | P40 I41 R47 A48 | P40-K44 WeakPolarHBondContact O-CB 3.45Å; P40-K44 PolarHBondContact O-N 3.31Å; I41-K44 PolarHBondContact O-N 2.9Å; K44-R47 PolarHBondContact O-N 2.93Å; K44-A48 PolarHBondContact O-N 3.24Å |
| 45 | R | 95.9 | Very high | 88.5 | Confident | 159 Ų | 159 | 100.8 Ų | 100.8 | 60% | 0.6 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -64.2 | -42.1 | 175.3 | -72.9 | 177.9 | 177.6 | -173 | -1.3 | 112.1 | I41 M42 E43 A48 R49 | I41-R45 WeakPolarHBondContact O-CG 3.19Å; I41-R45 PolarHBondContact O-N 3.11Å; M42-R45 WeakPolarHBondContact O-CB 3.35Å; M42-R45 PolarHBondContact O-N 3.28Å; E43-R45 VanDerWaalsContact C-N 3.31Å; E43-R45 PolarHBondContact O-N 3.12Å; R45-A48 PolarHBondContact O-N 3.41Å; R45-R49 WeakPolarHBondContact O-CG 3.46Å; R45-R49 PolarHBondContact O-N 2.92Å; R45-R49 VanDerWaalsContact O-N 3.08Å |
| 46 | R | 97.7 | Very high | 90.4 | Very high | 105 Ų | 105 | 96.6 Ų | 96.6 | 40% | 0.396 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -59.6 | -47.4 | 175.3 | -176.5 | -176.7 | 170.7 | -78.2 | 3.1 | 111.3 | M42 E43 A48 R49 I50 | M42-R46 PolarHBondContact O-N 2.88Å; E43-R46 WeakPolarHBondContact O-CB 3.46Å; E43-R46 PolarHBondContact O-N 3.47Å; E43-R46 VanDerWaalsContact O-N 3.17Å; R46-A48 VanDerWaalsContact C-N 3.34Å; R46-A48 PolarHBondContact O-N 2.93Å; R46-R49 PolarHBondContact O-N 3Å; R46-I50 HydrophobicContact CG-CD1 4.16Å; R46-I50 WeakPolarHBondContact O-CG1 3.48Å; R46-I50 PolarHBondContact O-N 2.86Å |
| 47 | R | 97.5 | Very high | 92.2 | Very high | 114 Ų | 114 | 91.8 Ų | 91.8 | 43% | 0.43 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -60.7 | -41.4 | 176.9 | -69.7 | 178.5 | -176.4 | -164.4 | -2.3 | 112.4 | E43 K44 I50 N51 W267 | E43-R47 WeakPolarHBondContact O-CG 3.47Å; E43-R47 PolarHBondContact O-N 3.37Å; E43-R47 WeakPolarHBondContact OE1-CD 3.34Å; E43-R47 WeakPolarHBondContact OE1-CG 3.42Å; E43-R47 IonicContact OE1-CZ 3.62Å; E43-R47 IonicContact OE1-NE 3.67Å; E43-R47 PolarHBondContact OE1-NE 2.94Å; E43-R47 IonicContact OE1-NH2 2.71Å; K44-R47 PolarHBondContact O-N 2.93Å; R47-I50 PolarHBondContact O-N 3.48Å; R47-N51 PolarHBondContact O-N 2.84Å; R47-N51 PolarHBondContact O-ND2 3.37Å; R47-W267 HydrophobicContact CG-CH2 3.96Å; R47-W267 HydrophobicContact CG-CZ3 4.16Å; R47-W267 VanDerWaalsContact NE-CZ3 3.27Å |
| 48 | A | 97.6 | Very high | 93.9 | Very high | 57 Ų | 57 | 90.9 Ų | 90.9 | 47% | 0.471 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -59.5 | -47.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | K44 R45 R46 I50 N51 E52 | K44-A48 PolarHBondContact O-N 3.24Å; R45-A48 PolarHBondContact O-N 3.41Å; R46-A48 VanDerWaalsContact C-N 3.34Å; R46-A48 PolarHBondContact O-N 2.93Å; A48-I50 VanDerWaalsContact C-N 3.34Å; A48-I50 PolarHBondContact O-N 3.24Å; A48-N51 PolarHBondContact O-N 3.31Å; A48-E52 WeakPolarHBondContact O-CB 3.5Å; A48-E52 PolarHBondContact O-N 3.25Å |
| 49 | R | 98.2 | Very high | 95.1 | Very high | 181 Ų | 181 | 92.7 Ų | 92.7 | 68% | 0.683 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -60.3 | -40.6 | 176.9 | -69.5 | 178.5 | 65.1 | -146.2 | -2.3 | 113.1 | R45 R46 E52 S53 | R45-R49 WeakPolarHBondContact O-CG 3.46Å; R45-R49 PolarHBondContact O-N 2.92Å; R45-R49 VanDerWaalsContact O-N 3.08Å; R46-R49 PolarHBondContact O-N 3Å; R49-E52 PolarHBondContact O-N 3.48Å; R49-S53 PolarHBondContact O-N 3.46Å; R49-S53 PolarHBondContact O-OG 3.43Å |
| 50 | I | 96.8 | Very high | 95.8 | Very high | 66 Ų | 66 | 90.1 Ų | 90.1 | 34% | 0.338 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -65.5 | -42.2 | 177.3 | -69.7 | 169.3 | 0 | 0 | 0 | 111.1 | R46 R47 A48 E52 S53 L54 | R46-I50 HydrophobicContact CG-CD1 4.16Å; R46-I50 WeakPolarHBondContact O-CG1 3.48Å; R46-I50 PolarHBondContact O-N 2.86Å; R47-I50 PolarHBondContact O-N 3.48Å; A48-I50 VanDerWaalsContact C-N 3.34Å; A48-I50 PolarHBondContact O-N 3.24Å; I50-E52 VanDerWaalsContact C-N 3.35Å; I50-S53 PolarHBondContact O-OG 3.44Å; I50-S53 VanDerWaalsContact O-OG 3.1Å; I50-L54 WeakPolarHBondContact O-CB 3.45Å; I50-L54 PolarHBondContact O-N 2.82Å |
| 51 | N | 97.1 | Very high | 96.2 | Very high | 77 Ų | 77 | 87 Ų | 87 | 41% | 0.412 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -69.8 | -35.3 | 179.2 | -70 | -21.6 | 0 | 0 | 0 | 111.7 | R47 A48 G55 K77 | R47-N51 PolarHBondContact O-N 2.84Å; R47-N51 PolarHBondContact O-ND2 3.37Å; A48-N51 PolarHBondContact O-N 3.31Å; N51-G55 PolarHBondContact O-N 3Å; N51-K77 WeakPolarHBondContact OD1-CE 3.4Å; N51-K77 PolarHBondContact OD1-NZ 2.8Å |
| 52 | E | 97.8 | Very high | 96.5 | Very high | 123 Ų | 123 | 83.1 Ų | 83.1 | 58% | 0.575 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -61.8 | -52.1 | 173.5 | 177.8 | 174.9 | -126.6 | 0 | 0 | 111.5 | A48 R49 I50 L54 G55 Q56 | A48-E52 WeakPolarHBondContact O-CB 3.5Å; A48-E52 PolarHBondContact O-N 3.25Å; R49-E52 PolarHBondContact O-N 3.48Å; I50-E52 VanDerWaalsContact C-N 3.35Å; E52-L54 VanDerWaalsContact C-N 3.29Å; E52-L54 PolarHBondContact O-N 3.35Å; E52-G55 PolarHBondContact O-N 2.92Å; E52-G55 VanDerWaalsContact O-N 3.13Å; E52-Q56 WeakPolarHBondContact O-CG 3.49Å; E52-Q56 PolarHBondContact O-N 3.47Å |
| 53 | S | 97.6 | Very high | 96.6 | Very high | 62 Ų | 62 | 84 Ų | 84 | 43% | 0.434 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -64.5 | -34.5 | 179.3 | 64.7 | 0 | 0 | 0 | 0 | 112.5 | R49 I50 G55 Q56 L57 | R49-S53 PolarHBondContact O-N 3.46Å; R49-S53 PolarHBondContact O-OG 3.43Å; I50-S53 PolarHBondContact O-OG 3.44Å; I50-S53 VanDerWaalsContact O-OG 3.1Å; S53-G55 VanDerWaalsContact C-N 3.35Å; S53-Q56 PolarHBondContact O-N 3.19Å; S53-L57 VanDerWaalsContact O-CB 3.28Å; S53-L57 WeakPolarHBondContact O-CB 3.4Å; S53-L57 PolarHBondContact O-N 2.97Å |
| 54 | L | 96.8 | Very high | 96.6 | Very high | 28 Ų | 28 | 84.7 Ų | 84.7 | 15% | 0.147 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -68.4 | -34.6 | 175.1 | -167.4 | 143.2 | 0 | 0 | 0 | 111.9 | I50 E52 K58 K77 I80 | I50-L54 WeakPolarHBondContact O-CB 3.45Å; I50-L54 PolarHBondContact O-N 2.82Å; E52-L54 VanDerWaalsContact C-N 3.29Å; E52-L54 PolarHBondContact O-N 3.35Å; L54-K58 PolarHBondContact O-N 2.98Å; L54-K77 HydrophobicContact CD1-CB 4.15Å; L54-K77 HydrophobicContact CD1-CD 4.2Å; L54-K77 HydrophobicContact CD1-CG 3.94Å; L54-K77 HydrophobicContact CD2-CG 4.12Å; L54-I80 HydrophobicContact CD2-CD1 3.47Å; L54-I80 VanDerWaalsContact CD2-CD1 3.47Å; L54-I80 HydrophobicContact CD2-CG2 4.45Å; L54-I80 HydrophobicContact CG-CD1 4.46Å; L54-I80 HydrophobicContact CG-CG2 4.35Å |
| 55 | G | 96.3 | Very high | 96.4 | Very high | 33 Ų | 33 | 80.2 Ų | 80.2 | 34% | 0.34 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -66 | -45.3 | 171.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | N51 E52 S53 L57 K58 T59 | N51-G55 PolarHBondContact O-N 3Å; E52-G55 PolarHBondContact O-N 2.92Å; E52-G55 VanDerWaalsContact O-N 3.13Å; S53-G55 VanDerWaalsContact C-N 3.35Å; G55-L57 VanDerWaalsContact C-N 3.33Å; G55-L57 PolarHBondContact O-N 2.76Å; G55-K58 WeakPolarHBondContact O-CB 3.43Å; G55-K58 PolarHBondContact O-N 3.21Å; G55-T59 PolarHBondContact O-N 2.91Å; G55-T59 PolarHBondContact O-OG1 3.41Å |
| 56 | Q | 97.1 | Very high | 96.2 | Very high | 114 Ų | 114 | 82 Ų | 82 | 53% | 0.533 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -60 | -44.7 | 174.2 | -69.7 | 173.7 | -18.4 | 0 | 0 | 111.4 | E52 S53 K58 T59 L60 | E52-Q56 WeakPolarHBondContact O-CG 3.49Å; E52-Q56 PolarHBondContact O-N 3.47Å; S53-Q56 PolarHBondContact O-N 3.19Å; Q56-K58 VanDerWaalsContact C-N 3.35Å; Q56-K58 PolarHBondContact O-N 3.44Å; Q56-T59 PolarHBondContact O-N 2.71Å; Q56-L60 WeakPolarHBondContact O-CG 3.39Å; Q56-L60 PolarHBondContact O-N 3.03Å |
| 57 | L | 97.3 | Very high | 95.9 | Very high | 48 Ų | 48 | 81.2 Ų | 81.2 | 25% | 0.251 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -60.4 | -43.7 | 178.8 | -176.2 | 60.4 | 0 | 0 | 0 | 111.9 | S53 G55 T59 L60 I61 I80 L81 T84 | S53-L57 VanDerWaalsContact O-CB 3.28Å; S53-L57 WeakPolarHBondContact O-CB 3.4Å; S53-L57 PolarHBondContact O-N 2.97Å; G55-L57 VanDerWaalsContact C-N 3.33Å; G55-L57 PolarHBondContact O-N 2.76Å; L57-T59 VanDerWaalsContact C-N 3.35Å; L57-T59 PolarHBondContact O-N 3.18Å; L57-L60 PolarHBondContact O-N 3.45Å; L57-I61 HydrophobicContact CD1-CG1 4.04Å; L57-I61 HydrophobicContact CG-CG1 4.39Å; L57-I61 WeakPolarHBondContact O-CB 3.35Å; L57-I61 VanDerWaalsContact O-CG1 3.24Å; L57-I61 WeakPolarHBondContact O-CG1 3.3Å; L57-I61 PolarHBondContact O-N 2.87Å; L57-I80 HydrophobicContact CD2-CG2 4.38Å; L57-I80 HydrophobicContact CG-CG2 4.37Å; L57-L81 HydrophobicContact CD2-CD2 4.28Å; L57-T84 HydrophobicContact CD1-CG2 3.76Å; L57-T84 HydrophobicContact CD2-CG2 4.09Å; L57-T84 WeakPolarHBondContact CD2-OG1 3.4Å; L57-T84 HydrophobicContact CG-CG2 4.29Å; L57-T84 WeakPolarHBondContact CG-OG1 3.31Å |
| 58 | K | 96.1 | Very high | 95.5 | Very high | 38 Ų | 38 | 80.3 Ų | 80.3 | 17% | 0.165 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -55.5 | -49.6 | 174.4 | 177.7 | -175.2 | 179 | 172.7 | 0 | 111.4 | L54 G55 Q56 I61 L62 H72 S73 L75 I80 | L54-K58 PolarHBondContact O-N 2.98Å; G55-K58 WeakPolarHBondContact O-CB 3.43Å; G55-K58 PolarHBondContact O-N 3.21Å; Q56-K58 VanDerWaalsContact C-N 3.35Å; Q56-K58 PolarHBondContact O-N 3.44Å; K58-I61 PolarHBondContact O-N 2.92Å; K58-L62 HydrophobicContact CG-CD1 3.88Å; K58-L62 HydrophobicContact CG-CG 4.49Å; K58-L62 WeakPolarHBondContact O-CB 3.45Å; K58-L62 VanDerWaalsContact O-CG 3.25Å; K58-L62 WeakPolarHBondContact O-CG 3.47Å; K58-L62 PolarHBondContact O-N 3.3Å; K58-H72 WeakPolarHBondContact CE-O 3.05Å; K58-H72 PolarHBondContact NZ-O 2.95Å; K58-S73 PolarHBondContact NZ-O 3.39Å; K58-L75 HydrophobicContact CG-CD1 4.39Å; K58-I80 HydrophobicContact CB-CD1 4.06Å; K58-I80 HydrophobicContact CB-CG1 4.21Å; K58-I80 HydrophobicContact CB-CG2 4.14Å; K58-I80 HydrophobicContact CD-CD1 3.99Å; K58-I80 HydrophobicContact CD-CG1 4.47Å; K58-I80 HydrophobicContact CG-CD1 4.24Å; K58-I80 HydrophobicContact CG-CG1 4.28Å |
| 59 | T | 95.9 | Very high | 94.9 | Very high | 94 Ų | 94 | 81.5 Ų | 81.5 | 58% | 0.577 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -60.9 | -49.9 | -179.5 | -58.1 | 0 | 0 | 0 | 0 | 111.4 | G55 Q56 L57 I61 L62 D63 | G55-T59 PolarHBondContact O-N 2.91Å; G55-T59 PolarHBondContact O-OG1 3.41Å; Q56-T59 PolarHBondContact O-N 2.71Å; L57-T59 VanDerWaalsContact C-N 3.35Å; L57-T59 PolarHBondContact O-N 3.18Å; T59-I61 VanDerWaalsContact C-N 3.32Å; T59-I61 PolarHBondContact O-N 3.03Å; T59-L62 PolarHBondContact O-N 3.25Å; T59-D63 WeakPolarHBondContact O-CB 3.28Å; T59-D63 PolarHBondContact O-N 2.99Å |
| 60 | L | 96.7 | Very high | 94.4 | Very high | 115 Ų | 115 | 77.2 Ų | 77.2 | 60% | 0.602 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -59.6 | -41.8 | -179.9 | -70.7 | 172.7 | 0 | 0 | 0 | 112.4 | Q56 L57 A64 | Q56-L60 WeakPolarHBondContact O-CG 3.39Å; Q56-L60 PolarHBondContact O-N 3.03Å; L57-L60 PolarHBondContact O-N 3.45Å; L60-A64 VanDerWaalsContact O-CB 3.25Å; L60-A64 WeakPolarHBondContact O-CB 3.41Å; L60-A64 PolarHBondContact O-N 3.41Å |
| 61 | I | 96.4 | Very high | 93.8 | Very high | 13 Ų | 13 | 83.6 Ų | 83.6 | 7% | 0.067 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -71 | -39.8 | -179.3 | -67.9 | -63.1 | 0 | 0 | 0 | 111.9 | L57 K58 T59 D63 L65 M83 T84 H87 | L57-I61 HydrophobicContact CD1-CG1 4.04Å; L57-I61 HydrophobicContact CG-CG1 4.39Å; L57-I61 WeakPolarHBondContact O-CB 3.35Å; L57-I61 VanDerWaalsContact O-CG1 3.24Å; L57-I61 WeakPolarHBondContact O-CG1 3.3Å; L57-I61 PolarHBondContact O-N 2.87Å; K58-I61 PolarHBondContact O-N 2.92Å; T59-I61 VanDerWaalsContact C-N 3.32Å; T59-I61 PolarHBondContact O-N 3.03Å; I61-D63 VanDerWaalsContact C-N 3.34Å; I61-L65 HydrophobicContact CG2-CD1 3.76Å; I61-L65 HydrophobicContact CG2-CG 4.41Å; I61-L65 VanDerWaalsContact O-CB 3.29Å; I61-L65 WeakPolarHBondContact O-CB 3.41Å; I61-L65 VanDerWaalsContact O-CG 3.24Å; I61-L65 WeakPolarHBondContact O-CG 3.35Å; I61-L65 PolarHBondContact O-N 3.26Å; I61-M83 HydrophobicContact CG2-CB 4.03Å; I61-M83 HydrophobicContact CG2-CE 3.96Å; I61-T84 HydrophobicContact CD1-CG2 4.15Å; I61-T84 HydrophobicContact CG1-CG2 4.46Å; I61-T84 WeakPolarHBondContact CG1-OG1 3.16Å; I61-H87 HydrophobicContact CD1-CB 4.03Å |
| 62 | L | 95.4 | Very high | 93.4 | Very high | 6 Ų | 6 | 81.6 Ų | 81.6 | 3% | 0.031 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -66.2 | -40.4 | 177.2 | -69 | 175.1 | 0 | 0 | 0 | 111.4 | K58 T59 L65 K66 K67 H72 M83 | K58-L62 HydrophobicContact CG-CD1 3.88Å; K58-L62 HydrophobicContact CG-CG 4.49Å; K58-L62 WeakPolarHBondContact O-CB 3.45Å; K58-L62 VanDerWaalsContact O-CG 3.25Å; K58-L62 WeakPolarHBondContact O-CG 3.47Å; K58-L62 PolarHBondContact O-N 3.3Å; T59-L62 PolarHBondContact O-N 3.25Å; L62-L65 CarbonylContact O-C 3.57Å; L62-L65 PolarHBondContact O-N 3.44Å; L62-K66 PolarHBondContact O-N 3.4Å; L62-K67 HydrophobicContact CD2-CB 3.73Å; L62-K67 HydrophobicContact CD2-CD 4.27Å; L62-K67 PolarHBondContact O-N 3.47Å; L62-H72 HydrophobicContact CD1-CB 3.67Å; L62-H72 HydrophobicContact CD2-CB 3.7Å; L62-H72 HydrophobicContact CG-CB 4.36Å; L62-M83 HydrophobicContact CD2-CE 3.96Å |
| 63 | D | 94.7 | Very high | 92.9 | Very high | 126 Ų | 126 | 79.9 Ų | 79.9 | 67% | 0.674 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -63.6 | -50.8 | 175.4 | -171.4 | 45.3 | 0 | 0 | 0 | 111.6 | T59 I61 L65 K66 | T59-D63 WeakPolarHBondContact O-CB 3.28Å; T59-D63 PolarHBondContact O-N 2.99Å; I61-D63 VanDerWaalsContact C-N 3.34Å; D63-L65 PolarHBondContact O-N 2.8Å; D63-K66 PolarHBondContact O-N 2.91Å |
| 64 | A | 93.8 | Very high | 92.4 | Very high | 58 Ų | 58 | 86.2 Ų | 86.2 | 48% | 0.479 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -60.1 | -32.4 | 178 | 0 | 0 | 0 | 0 | 0 | 113.3 | L60 | L60-A64 VanDerWaalsContact O-CB 3.25Å; L60-A64 WeakPolarHBondContact O-CB 3.41Å; L60-A64 PolarHBondContact O-N 3.41Å |
| 65 | L | 92.4 | Very high | 92.1 | Very high | 67 Ų | 67 | 86.7 Ų | 86.7 | 35% | 0.351 | 46% | 0.457 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -91 | 0.1 | 177 | -64.9 | 176.6 | 0 | 0 | 0 | 113.5 | I61 L62 D63 K67 M83 | I61-L65 HydrophobicContact CG2-CD1 3.76Å; I61-L65 HydrophobicContact CG2-CG 4.41Å; I61-L65 VanDerWaalsContact O-CB 3.29Å; I61-L65 WeakPolarHBondContact O-CB 3.41Å; I61-L65 VanDerWaalsContact O-CG 3.24Å; I61-L65 WeakPolarHBondContact O-CG 3.35Å; I61-L65 PolarHBondContact O-N 3.26Å; L62-L65 CarbonylContact O-C 3.57Å; L62-L65 PolarHBondContact O-N 3.44Å; D63-L65 PolarHBondContact O-N 2.8Å; L65-K67 HydrophobicContact CB-CD 4.1Å; L65-K67 HydrophobicContact CB-CG 4.16Å; L65-K67 HydrophobicContact CD1-CD 4.26Å; L65-K67 PolarHBondContact O-N 2.86Å; L65-M83 HydrophobicContact CD1-CE 3.67Å |
| 66 | K | 92.2 | Very high | 92 | Very high | 196 Ų | 196 | 91.6 Ų | 91.6 | 85% | 0.852 | 47% | 0.471 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49.5 | 43.2 | -174.1 | -57 | -176.2 | 177.8 | -178.7 | 0 | 112.8 | L62 D63 | L62-K66 PolarHBondContact O-N 3.4Å; D63-K66 PolarHBondContact O-N 2.91Å |
| 67 | K | 90.6 | Very high | 91.9 | Very high | 89 Ų | 89 | 91.7 Ų | 91.7 | 39% | 0.387 | 47% | 0.47 | S | S | . | . | trans | -99 | 140.9 | 179.4 | -83.5 | 176.4 | 168.1 | -169.1 | 0 | 111.1 | L62 L65 S69 M83 | L62-K67 HydrophobicContact CD2-CB 3.73Å; L62-K67 HydrophobicContact CD2-CD 4.27Å; L62-K67 PolarHBondContact O-N 3.47Å; L65-K67 HydrophobicContact CB-CD 4.1Å; L65-K67 HydrophobicContact CB-CG 4.16Å; L65-K67 HydrophobicContact CD1-CD 4.26Å; L65-K67 PolarHBondContact O-N 2.86Å; K67-S69 PolarHBondContact O-N 3.16Å; K67-M83 HydrophobicContact CD-CE 3.74Å | ||
| 68 | D | 88 | Confident | 91.9 | Very high | 95 Ų | 95 | 92.6 Ų | 92.6 | 51% | 0.508 | 48% | 0.484 | S | S | . | . | trans | -64.6 | 118.9 | -179.3 | -58.7 | -53.2 | 0 | 0 | 0 | 112.3 | S70 R71 H72 | D68-S70 PolarHBondContact O-N 3.23Å; D68-R71 HydrophobicContact CB-CB 4.38Å; D68-R71 HydrophobicContact CB-CG 4.1Å; D68-R71 PolarHBondContact O-N 3.44Å; D68-H72 PolarHBondContact O-CD2 3.23Å; D68-H72 VanDerWaalsContact O-CD2 3.22Å; D68-H72 PolarHBondContact O-N 2.95Å | ||
| 69 | S | 86.7 | Confident | 91.8 | Very high | 83 Ų | 83 | 93.3 Ų | 93.3 | 58% | 0.58 | 49% | 0.49 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.7 | -33.7 | 178.2 | -172.5 | 0 | 0 | 0 | 0 | 113 | K67 H72 S73 | K67-S69 PolarHBondContact O-N 3.16Å; S69-H72 CarbonylContact O-C 3.34Å; S69-H72 PolarHBondContact O-N 3.42Å; S69-S73 PolarHBondContact O-N 2.8Å |
| 70 | S | 85.9 | Confident | 91.8 | Very high | 91 Ų | 91 | 89.2 Ų | 89.2 | 64% | 0.636 | 47% | 0.465 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.4 | -45.6 | 180 | 59.1 | 0 | 0 | 0 | 0 | 112.8 | D68 H72 S73 | D68-S70 PolarHBondContact O-N 3.23Å; S70-H72 PolarHBondContact O-N 3.45Å; S70-S73 WeakPolarHBondContact O-CB 3.49Å; S70-S73 PolarHBondContact O-N 3.4Å; S70-S73 PolarHBondContact O-OG 3.01Å |
| 71 | R | 85.2 | Confident | 91.9 | Very high | 199 Ų | 199 | 88 Ų | 88 | 75% | 0.751 | 46% | 0.459 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.4 | -22.5 | 178.1 | -63 | -175.3 | 67.2 | -167 | 0.8 | 112.5 | D68 | D68-R71 HydrophobicContact CB-CB 4.38Å; D68-R71 HydrophobicContact CB-CG 4.1Å; D68-R71 PolarHBondContact O-N 3.44Å |
| 72 | H | 88.1 | Confident | 91.9 | Very high | 36 Ų | 36 | 93.9 Ų | 93.9 | 17% | 0.167 | 49% | 0.486 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -106.1 | 13.2 | -179.3 | -68.8 | -67.9 | 0 | 0 | 0 | 112.9 | K58 L62 D68 S69 S70 K74 L75 | K58-H72 WeakPolarHBondContact CE-O 3.05Å; K58-H72 PolarHBondContact NZ-O 2.95Å; L62-H72 HydrophobicContact CD1-CB 3.67Å; L62-H72 HydrophobicContact CD2-CB 3.7Å; L62-H72 HydrophobicContact CG-CB 4.36Å; D68-H72 PolarHBondContact O-CD2 3.23Å; D68-H72 VanDerWaalsContact O-CD2 3.22Å; D68-H72 PolarHBondContact O-N 2.95Å; S69-H72 CarbonylContact O-C 3.34Å; S69-H72 PolarHBondContact O-N 3.42Å; S70-H72 PolarHBondContact O-N 3.45Å; H72-K74 PolarHBondContact O-N 3.38Å; H72-L75 HydrophobicContact CB-CD1 3.74Å; H72-L75 HydrophobicContact CB-CG 3.95Å; H72-L75 WeakPolarHBondContact O-CG 3.33Å; H72-L75 PolarHBondContact O-N 3.01Å |
| 73 | S | 87.4 | Confident | 91.9 | Very high | 87 Ų | 87 | 94.9 Ų | 94.9 | 61% | 0.608 | 49% | 0.49 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.3 | -34.4 | 179.4 | 54.3 | 0 | 0 | 0 | 0 | 112.6 | K58 S69 S70 | K58-S73 PolarHBondContact NZ-O 3.39Å; S69-S73 PolarHBondContact O-N 2.8Å; S70-S73 WeakPolarHBondContact O-CB 3.49Å; S70-S73 PolarHBondContact O-N 3.4Å; S70-S73 PolarHBondContact O-OG 3.01Å |
| 74 | K | 88 | Confident | 92 | Very high | 194 Ų | 194 | 89.5 Ų | 89.5 | 84% | 0.843 | 46% | 0.462 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -102.7 | 21.7 | -176 | -149.7 | 177.7 | -178.4 | -179.3 | 0 | 115.5 | H72 E76 | H72-K74 PolarHBondContact O-N 3.38Å; K74-E76 PolarHBondContact O-N 2.91Å |
| 75 | L | 90.3 | Very high | 92.2 | Very high | 38 Ų | 38 | 90.7 Ų | 90.7 | 20% | 0.199 | 46% | 0.463 | C | S | . | . | trans | -58.4 | 135.3 | 177.3 | -75.6 | 175.5 | 0 | 0 | 0 | 112.1 | K58 H72 D79 I80 M83 | K58-L75 HydrophobicContact CG-CD1 4.39Å; H72-L75 HydrophobicContact CB-CD1 3.74Å; H72-L75 HydrophobicContact CB-CG 3.95Å; H72-L75 WeakPolarHBondContact O-CG 3.33Å; H72-L75 PolarHBondContact O-N 3.01Å; L75-D79 HydrophobicContact CB-CB 4.45Å; L75-D79 HydrophobicContact CD2-CB 3.73Å; L75-I80 HydrophobicContact CB-CD1 4.18Å; L75-I80 HydrophobicContact CB-CG1 3.83Å; L75-I80 HydrophobicContact CD1-CG1 4.11Å; L75-M83 HydrophobicContact CD1-SD 4.23Å; L75-M83 HydrophobicContact CD2-SD 4.43Å | ||
| 76 | E | 94.4 | Very high | 92.4 | Very high | 136 Ų | 136 | 94.3 Ų | 94.3 | 64% | 0.636 | 48% | 0.476 | S | S | * | . | trans | -76.4 | 163.7 | 173 | -59.2 | -163.7 | 101.7 | 0 | 0 | 111 | K74 A78 D79 I80 | K74-E76 PolarHBondContact O-N 2.91Å; E76-A78 PolarHBondContact O-N 2.97Å; E76-D79 PolarHBondContact N-OD2 3.39Å; E76-D79 PolarHBondContact O-N 2.97Å; E76-I80 WeakPolarHBondContact O-CG1 3.13Å; E76-I80 PolarHBondContact O-N 3.46Å; E76-I80 VanDerWaalsContact O-N 3.11Å | ||
| 77 | K | 94.4 | Very high | 92.6 | Very high | 116 Ų | 116 | 87 Ų | 87 | 50% | 0.504 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -59.3 | -38.2 | 177.9 | -70.8 | -172.1 | 172.8 | -170.3 | 0 | 111.9 | N51 L54 L81 | N51-K77 WeakPolarHBondContact OD1-CE 3.4Å; N51-K77 PolarHBondContact OD1-NZ 2.8Å; L54-K77 HydrophobicContact CD1-CB 4.15Å; L54-K77 HydrophobicContact CD1-CD 4.2Å; L54-K77 HydrophobicContact CD1-CG 3.94Å; L54-K77 HydrophobicContact CD2-CG 4.12Å; K77-L81 VanDerWaalsContact O-CG 3.31Å; K77-L81 WeakPolarHBondContact O-CG 3.49Å; K77-L81 PolarHBondContact O-N 3.12Å |
| 78 | A | 96.6 | Very high | 92.9 | Very high | 67 Ų | 67 | 87.5 Ų | 87.5 | 55% | 0.554 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -63.7 | -46.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | E76 I80 L81 E82 | E76-A78 PolarHBondContact O-N 2.97Å; A78-I80 VanDerWaalsContact C-N 3.35Å; A78-I80 PolarHBondContact O-N 3.48Å; A78-L81 PolarHBondContact O-N 3.5Å; A78-E82 WeakPolarHBondContact O-CB 3.27Å; A78-E82 PolarHBondContact O-N 2.96Å |
| 79 | D | 95.1 | Very high | 93.1 | Very high | 53 Ų | 53 | 90.4 Ų | 90.4 | 28% | 0.283 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -61.1 | -42 | 179.9 | -56.2 | -33.5 | 0 | 0 | 0 | 112.6 | L75 E76 L81 E82 M83 | L75-D79 HydrophobicContact CB-CB 4.45Å; L75-D79 HydrophobicContact CD2-CB 3.73Å; E76-D79 PolarHBondContact N-OD2 3.39Å; E76-D79 PolarHBondContact O-N 2.97Å; D79-L81 VanDerWaalsContact C-N 3.32Å; D79-L81 PolarHBondContact O-N 2.83Å; D79-E82 PolarHBondContact O-N 3.44Å; D79-M83 WeakPolarHBondContact O-CB 3.42Å; D79-M83 WeakPolarHBondContact O-CG 3.39Å; D79-M83 PolarHBondContact O-N 3.31Å |
| 80 | I | 95.4 | Very high | 93.4 | Very high | 9 Ų | 9 | 89.9 Ų | 89.9 | 5% | 0.046 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -59.6 | -48.2 | 178.1 | -67 | 163.3 | 0 | 0 | 0 | 109.3 | L54 L57 K58 L75 E76 A78 M83 T84 | L54-I80 HydrophobicContact CD2-CD1 3.47Å; L54-I80 VanDerWaalsContact CD2-CD1 3.47Å; L54-I80 HydrophobicContact CD2-CG2 4.45Å; L54-I80 HydrophobicContact CG-CD1 4.46Å; L54-I80 HydrophobicContact CG-CG2 4.35Å; L57-I80 HydrophobicContact CD2-CG2 4.38Å; L57-I80 HydrophobicContact CG-CG2 4.37Å; K58-I80 HydrophobicContact CB-CD1 4.06Å; K58-I80 HydrophobicContact CB-CG1 4.21Å; K58-I80 HydrophobicContact CB-CG2 4.14Å; K58-I80 HydrophobicContact CD-CD1 3.99Å; K58-I80 HydrophobicContact CD-CG1 4.47Å; K58-I80 HydrophobicContact CG-CD1 4.24Å; K58-I80 HydrophobicContact CG-CG1 4.28Å; L75-I80 HydrophobicContact CB-CD1 4.18Å; L75-I80 HydrophobicContact CB-CG1 3.83Å; L75-I80 HydrophobicContact CD1-CG1 4.11Å; E76-I80 WeakPolarHBondContact O-CG1 3.13Å; E76-I80 PolarHBondContact O-N 3.46Å; E76-I80 VanDerWaalsContact O-N 3.11Å; A78-I80 VanDerWaalsContact C-N 3.35Å; A78-I80 PolarHBondContact O-N 3.48Å; I80-M83 PolarHBondContact O-N 3.03Å; I80-T84 PolarHBondContact O-N 3.31Å; I80-T84 PolarHBondContact O-OG1 2.86Å |
| 81 | L | 97.9 | Very high | 93.8 | Very high | 90 Ų | 90 | 89 Ų | 89 | 47% | 0.471 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -65.8 | -41.3 | 179.3 | -65.8 | 174.5 | 0 | 0 | 0 | 112.2 | L57 K77 A78 D79 T84 V85 | L57-L81 HydrophobicContact CD2-CD2 4.28Å; K77-L81 VanDerWaalsContact O-CG 3.31Å; K77-L81 WeakPolarHBondContact O-CG 3.49Å; K77-L81 PolarHBondContact O-N 3.12Å; A78-L81 PolarHBondContact O-N 3.5Å; D79-L81 VanDerWaalsContact C-N 3.32Å; D79-L81 PolarHBondContact O-N 2.83Å; L81-T84 WeakPolarHBondContact O-CB 3.28Å; L81-T84 PolarHBondContact O-N 2.92Å; L81-V85 VanDerWaalsContact O-CG2 3.31Å; L81-V85 WeakPolarHBondContact O-CG2 3.39Å; L81-V85 PolarHBondContact O-N 3.26Å |
| 82 | E | 96.8 | Very high | 93.9 | Very high | 136 Ų | 136 | 85 Ų | 85 | 64% | 0.636 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -62.6 | -47.1 | 177.3 | -175.8 | 177.3 | -157.4 | 0 | 0 | 111.3 | A78 D79 T84 V85 K86 | A78-E82 WeakPolarHBondContact O-CB 3.27Å; A78-E82 PolarHBondContact O-N 2.96Å; D79-E82 PolarHBondContact O-N 3.44Å; E82-T84 VanDerWaalsContact C-N 3.31Å; E82-T84 PolarHBondContact O-N 3.44Å; E82-V85 PolarHBondContact O-N 3.39Å; E82-K86 WeakPolarHBondContact O-CB 3.21Å; E82-K86 PolarHBondContact O-N 3.45Å |
| 83 | M | 96.1 | Very high | 94 | Very high | 27 Ų | 27 | 90.8 Ų | 90.8 | 13% | 0.133 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -59.9 | -41.8 | 175.9 | -76.4 | -171.5 | 50.1 | 0 | 0 | 111.7 | I61 L62 L65 K67 L75 D79 I80 H87 | I61-M83 HydrophobicContact CG2-CB 4.03Å; I61-M83 HydrophobicContact CG2-CE 3.96Å; L62-M83 HydrophobicContact CD2-CE 3.96Å; L65-M83 HydrophobicContact CD1-CE 3.67Å; K67-M83 HydrophobicContact CD-CE 3.74Å; L75-M83 HydrophobicContact CD1-SD 4.23Å; L75-M83 HydrophobicContact CD2-SD 4.43Å; D79-M83 WeakPolarHBondContact O-CB 3.42Å; D79-M83 WeakPolarHBondContact O-CG 3.39Å; D79-M83 PolarHBondContact O-N 3.31Å; I80-M83 PolarHBondContact O-N 3.03Å; M83-H87 WeakPolarHBondContact O-CB 3.45Å; M83-H87 PolarHBondContact O-N 3.38Å |
| 84 | T | 97.3 | Very high | 93.8 | Very high | 13 Ų | 13 | 89.2 Ų | 89.2 | 8% | 0.08 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -60.3 | -51.9 | 174.4 | -58.2 | 0 | 0 | 0 | 0 | 111.7 | L57 I61 I80 L81 E82 K86 H87 L88 | L57-T84 HydrophobicContact CD1-CG2 3.76Å; L57-T84 HydrophobicContact CD2-CG2 4.09Å; L57-T84 WeakPolarHBondContact CD2-OG1 3.4Å; L57-T84 HydrophobicContact CG-CG2 4.29Å; L57-T84 WeakPolarHBondContact CG-OG1 3.31Å; I61-T84 HydrophobicContact CD1-CG2 4.15Å; I61-T84 HydrophobicContact CG1-CG2 4.46Å; I61-T84 WeakPolarHBondContact CG1-OG1 3.16Å; I80-T84 PolarHBondContact O-N 3.31Å; I80-T84 PolarHBondContact O-OG1 2.86Å; L81-T84 WeakPolarHBondContact O-CB 3.28Å; L81-T84 PolarHBondContact O-N 2.92Å; E82-T84 VanDerWaalsContact C-N 3.31Å; E82-T84 PolarHBondContact O-N 3.44Å; T84-K86 VanDerWaalsContact C-N 3.31Å; T84-K86 PolarHBondContact O-N 3.09Å; T84-H87 PolarHBondContact O-N 3.35Å; T84-H87 VanDerWaalsContact O-N 3.13Å; T84-L88 HydrophobicContact CG2-CD1 3.99Å; T84-L88 HydrophobicContact CG2-CG 4.31Å; T84-L88 WeakPolarHBondContact O-CG 3.25Å; T84-L88 PolarHBondContact O-N 3.33Å |
| 85 | V | 97.8 | Very high | 93.6 | Very high | 83 Ų | 83 | 85.6 Ų | 85.6 | 50% | 0.503 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -61.5 | -43.5 | -177.6 | 171.5 | 0 | 0 | 0 | 0 | 110.3 | L81 E82 H87 L88 R89 | L81-V85 VanDerWaalsContact O-CG2 3.31Å; L81-V85 WeakPolarHBondContact O-CG2 3.39Å; L81-V85 PolarHBondContact O-N 3.26Å; E82-V85 PolarHBondContact O-N 3.39Å; V85-H87 VanDerWaalsContact C-N 3.34Å; V85-H87 PolarHBondContact O-N 2.89Å; V85-L88 PolarHBondContact O-N 3.18Å; V85-R89 HydrophobicContact CG1-CG 4.37Å; V85-R89 WeakPolarHBondContact O-CB 3.38Å; V85-R89 VanDerWaalsContact O-CG 3.28Å; V85-R89 WeakPolarHBondContact O-CG 3.5Å; V85-R89 PolarHBondContact O-N 2.92Å |
| 86 | K | 96.3 | Very high | 92.8 | Very high | 142 Ų | 142 | 87.8 Ų | 87.8 | 62% | 0.617 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -59.3 | -44.5 | 174.9 | -174.9 | 175 | -178.7 | 171.8 | 0 | 111.6 | E82 T84 R89 N90 | E82-K86 WeakPolarHBondContact O-CB 3.21Å; E82-K86 PolarHBondContact O-N 3.45Å; T84-K86 VanDerWaalsContact C-N 3.31Å; T84-K86 PolarHBondContact O-N 3.09Å; K86-R89 PolarHBondContact O-N 2.83Å; K86-N90 WeakPolarHBondContact O-CB 3.4Å; K86-N90 VanDerWaalsContact O-CG 3.28Å; K86-N90 PolarHBondContact O-N 3.35Å; K86-N90 PolarHBondContact O-OD1 3.04Å; K86-N90 VanDerWaalsContact O-OD1 3.1Å |
| 87 | H | 95.6 | Very high | 91.9 | Very high | 44 Ų | 44 | 84 Ų | 84 | 20% | 0.204 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -62.9 | -46.5 | 177.1 | -179.9 | 72.4 | 0 | 0 | 0 | 111.9 | I61 M83 T84 V85 R89 N90 L91 | I61-H87 HydrophobicContact CD1-CB 4.03Å; M83-H87 WeakPolarHBondContact O-CB 3.45Å; M83-H87 PolarHBondContact O-N 3.38Å; T84-H87 PolarHBondContact O-N 3.35Å; T84-H87 VanDerWaalsContact O-N 3.13Å; V85-H87 VanDerWaalsContact C-N 3.34Å; V85-H87 PolarHBondContact O-N 2.89Å; H87-R89 PolarHBondContact O-N 2.8Å; H87-N90 CarbonylContact O-C 3.57Å; H87-N90 PolarHBondContact O-N 2.84Å; H87-N90 VanDerWaalsContact O-N 3.17Å; H87-L91 WeakPolarHBondContact O-CB 3.4Å; H87-L91 PolarHBondContact O-N 3.03Å |
| 88 | L | 96.7 | Very high | 90.9 | Very high | 99 Ų | 99 | 81.1 Ų | 81.1 | 52% | 0.518 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -62.1 | -42.2 | 178.5 | -69.2 | 176 | 0 | 0 | 0 | 112.3 | T84 V85 N90 L91 Q92 | T84-L88 HydrophobicContact CG2-CD1 3.99Å; T84-L88 HydrophobicContact CG2-CG 4.31Å; T84-L88 WeakPolarHBondContact O-CG 3.25Å; T84-L88 PolarHBondContact O-N 3.33Å; V85-L88 PolarHBondContact O-N 3.18Å; L88-N90 VanDerWaalsContact C-N 3.33Å; L88-N90 PolarHBondContact O-N 2.97Å; L88-L91 PolarHBondContact O-N 3.4Å; L88-Q92 WeakPolarHBondContact O-CB 3.21Å; L88-Q92 PolarHBondContact O-N 3.22Å |
| 89 | R | 93.8 | Very high | 89.4 | Confident | 155 Ų | 155 | 80.9 Ų | 80.9 | 59% | 0.585 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -63.7 | -39.2 | 174.6 | -70.1 | -67.5 | -172.8 | 177.3 | 3.1 | 111.8 | V85 K86 H87 R93 | V85-R89 HydrophobicContact CG1-CG 4.37Å; V85-R89 WeakPolarHBondContact O-CB 3.38Å; V85-R89 VanDerWaalsContact O-CG 3.28Å; V85-R89 WeakPolarHBondContact O-CG 3.5Å; V85-R89 PolarHBondContact O-N 2.92Å; K86-R89 PolarHBondContact O-N 2.83Å; H87-R89 PolarHBondContact O-N 2.8Å; R89-R93 WeakPolarHBondContact O-CG 3.32Å; R89-R93 PolarHBondContact O-N 2.73Å; R89-R93 VanDerWaalsContact O-N 3.11Å |
| 90 | N | 92.9 | Very high | 88 | Confident | 72 Ų | 72 | 80.2 Ų | 80.2 | 39% | 0.385 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -67.4 | -41.8 | 175.6 | -77.4 | 26.7 | 0 | 0 | 0 | 111.7 | K86 H87 L88 R93 A94 | K86-N90 WeakPolarHBondContact O-CB 3.4Å; K86-N90 VanDerWaalsContact O-CG 3.28Å; K86-N90 PolarHBondContact O-N 3.35Å; K86-N90 PolarHBondContact O-OD1 3.04Å; K86-N90 VanDerWaalsContact O-OD1 3.1Å; H87-N90 CarbonylContact O-C 3.57Å; H87-N90 PolarHBondContact O-N 2.84Å; H87-N90 VanDerWaalsContact O-N 3.17Å; L88-N90 VanDerWaalsContact C-N 3.33Å; L88-N90 PolarHBondContact O-N 2.97Å; N90-R93 PolarHBondContact O-N 3.04Å; N90-R93 PolarHBondContact OD1-NH2 2.85Å; N90-A94 VanDerWaalsContact O-CB 3.31Å; N90-A94 WeakPolarHBondContact O-CB 3.35Å; N90-A94 PolarHBondContact O-N 2.76Å |
| 91 | L | 93.1 | Very high | 86.5 | Confident | 73 Ų | 73 | 85.4 Ų | 85.4 | 38% | 0.382 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -62.8 | -45.5 | 177.2 | -176.5 | 63.4 | 0 | 0 | 0 | 111.1 | H87 L88 R93 A94 Q95 | H87-L91 WeakPolarHBondContact O-CB 3.4Å; H87-L91 PolarHBondContact O-N 3.03Å; L88-L91 PolarHBondContact O-N 3.4Å; L91-R93 VanDerWaalsContact C-N 3.34Å; L91-R93 PolarHBondContact O-N 3.12Å; L91-A94 PolarHBondContact O-N 3Å; L91-Q95 HydrophobicContact CD1-CG 4.32Å; L91-Q95 HydrophobicContact CG-CG 4.44Å; L91-Q95 WeakPolarHBondContact O-CB 3.32Å; L91-Q95 VanDerWaalsContact O-CG 3.29Å; L91-Q95 WeakPolarHBondContact O-CG 3.45Å; L91-Q95 PolarHBondContact O-N 3.16Å |
| 92 | Q | 88.8 | Confident | 85 | Confident | 114 Ų | 114 | 85.8 Ų | 85.8 | 53% | 0.533 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -59.8 | -44.2 | 176.5 | -172.7 | -178.3 | 13.9 | 0 | 0 | 111.8 | L88 M96 | L88-Q92 WeakPolarHBondContact O-CB 3.21Å; L88-Q92 PolarHBondContact O-N 3.22Å; Q92-M96 WeakPolarHBondContact O-CB 3.31Å; Q92-M96 PolarHBondContact O-N 2.99Å |
| 93 | R | 88.5 | Confident | 83.5 | Confident | 158 Ų | 158 | 82 Ų | 82 | 60% | 0.596 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -63.7 | -46.2 | 175.3 | -74.7 | -171.9 | -68.2 | -172.1 | 0.2 | 111.8 | R89 N90 L91 Q95 M96 T97 | R89-R93 WeakPolarHBondContact O-CG 3.32Å; R89-R93 PolarHBondContact O-N 2.73Å; R89-R93 VanDerWaalsContact O-N 3.11Å; N90-R93 PolarHBondContact O-N 3.04Å; N90-R93 PolarHBondContact OD1-NH2 2.85Å; L91-R93 VanDerWaalsContact C-N 3.34Å; L91-R93 PolarHBondContact O-N 3.12Å; R93-Q95 PolarHBondContact O-N 3.2Å; R93-M96 PolarHBondContact O-N 3.24Å; R93-T97 PolarHBondContact O-N 2.89Å; R93-T97 PolarHBondContact O-OG1 2.77Å; R93-T97 VanDerWaalsContact O-OG1 3.08Å |
| 94 | A | 84.9 | Confident | 82 | Confident | 55 Ų | 55 | 85.4 Ų | 85.4 | 46% | 0.455 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -63.6 | -39.9 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | N90 L91 T97 A98 | N90-A94 VanDerWaalsContact O-CB 3.31Å; N90-A94 WeakPolarHBondContact O-CB 3.35Å; N90-A94 PolarHBondContact O-N 2.76Å; L91-A94 PolarHBondContact O-N 3Å; A94-T97 PolarHBondContact O-N 3.4Å; A94-A98 VanDerWaalsContact O-CB 3.23Å; A94-A98 WeakPolarHBondContact O-CB 3.37Å; A94-A98 PolarHBondContact O-N 3.39Å |
| 95 | Q | 82.3 | Confident | 80.9 | Confident | 118 Ų | 118 | 87.9 Ų | 87.9 | 55% | 0.551 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -65.1 | -42.1 | 175 | -75.4 | 179.4 | 1.3 | 0 | 0 | 111.8 | L91 R93 A98 A99 | L91-Q95 HydrophobicContact CD1-CG 4.32Å; L91-Q95 HydrophobicContact CG-CG 4.44Å; L91-Q95 WeakPolarHBondContact O-CB 3.32Å; L91-Q95 VanDerWaalsContact O-CG 3.29Å; L91-Q95 WeakPolarHBondContact O-CG 3.45Å; L91-Q95 PolarHBondContact O-N 3.16Å; R93-Q95 PolarHBondContact O-N 3.2Å; Q95-A98 PolarHBondContact O-N 2.96Å; Q95-A99 VanDerWaalsContact O-CB 3.31Å; Q95-A99 WeakPolarHBondContact O-CB 3.48Å; Q95-A99 PolarHBondContact O-N 2.83Å |
| 96 | M | 74.8 | Confident | 80 | Confident | 84 Ų | 84 | 88 Ų | 88 | 41% | 0.414 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -62.1 | -48.2 | 174.3 | -179.6 | 176.5 | -89 | 0 | 0 | 110.9 | Q92 R93 A98 A99 L100 M153 | Q92-M96 WeakPolarHBondContact O-CB 3.31Å; Q92-M96 PolarHBondContact O-N 2.99Å; R93-M96 PolarHBondContact O-N 3.24Å; M96-A98 VanDerWaalsContact C-N 3.33Å; M96-A98 PolarHBondContact O-N 3.5Å; M96-A99 PolarHBondContact O-N 3.31Å; M96-L100 VanDerWaalsContact O-CG 3.31Å; M96-L100 WeakPolarHBondContact O-CG 3.41Å; M96-L100 PolarHBondContact O-N 3.37Å; M96-M153 HydrophobicContact CE-CE 3.68Å; M96-M153 HydrophobicContact CE-CG 4.14Å; M96-M153 HydrophobicContact CE-SD 3.33Å; M96-M153 WeakPolarHBondContact CE-SD 3.44Å; M96-M153 HydrophobicContact CG-CG 4.47Å; M96-M153 HydrophobicContact SD-CE 4.22Å; M96-M153 HydrophobicContact SD-CG 3.51Å; M96-M153 VanDerWaalsContact SD-CG 3.51Å; M96-M153 HydrophobicContact SD-SD 3.55Å |
| 97 | T | 75.3 | Confident | 79 | Confident | 56 Ų | 56 | 82.7 Ų | 82.7 | 34% | 0.344 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -59.4 | -43.9 | 174.7 | -56.6 | 0 | 0 | 0 | 0 | 111.5 | R93 A94 A99 L100 N101 | R93-T97 PolarHBondContact O-N 2.89Å; R93-T97 PolarHBondContact O-OG1 2.77Å; R93-T97 VanDerWaalsContact O-OG1 3.08Å; A94-T97 PolarHBondContact O-N 3.4Å; T97-A99 PolarHBondContact O-N 3.41Å; T97-L100 PolarHBondContact O-N 3.29Å; T97-N101 WeakPolarHBondContact CG2-ND2 3.44Å; T97-N101 PolarHBondContact O-N 3.1Å; T97-N101 PolarHBondContact O-ND2 3.33Å |
| 98 | A | 72.9 | Confident | 78.3 | Confident | 56 Ų | 56 | 82.4 Ų | 82.4 | 46% | 0.463 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -64.6 | -40.1 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | A94 Q95 M96 L100 N101 S102 | A94-A98 VanDerWaalsContact O-CB 3.23Å; A94-A98 WeakPolarHBondContact O-CB 3.37Å; A94-A98 PolarHBondContact O-N 3.39Å; Q95-A98 PolarHBondContact O-N 2.96Å; M96-A98 VanDerWaalsContact C-N 3.33Å; M96-A98 PolarHBondContact O-N 3.5Å; A98-L100 VanDerWaalsContact C-N 3.31Å; A98-L100 PolarHBondContact O-N 2.9Å; A98-N101 CarbonylContact O-C 3.6Å; A98-N101 PolarHBondContact O-N 2.94Å; A98-N101 VanDerWaalsContact O-N 3.13Å; A98-S102 WeakPolarHBondContact O-CB 3.46Å; A98-S102 PolarHBondContact O-N 3.31Å; A98-S102 PolarHBondContact O-OG 2.88Å |
| 99 | A | 64.9 | Low | 77.8 | Confident | 62 Ų | 62 | 84.1 Ų | 84.1 | 51% | 0.512 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -63.9 | -36.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q95 M96 T97 N101 S102 | Q95-A99 VanDerWaalsContact O-CB 3.31Å; Q95-A99 WeakPolarHBondContact O-CB 3.48Å; Q95-A99 PolarHBondContact O-N 2.83Å; M96-A99 PolarHBondContact O-N 3.31Å; T97-A99 PolarHBondContact O-N 3.41Å; A99-N101 VanDerWaalsContact C-N 3.34Å; A99-S102 PolarHBondContact O-OG 3.49Å |
| 100 | L | 64.9 | Low | 77.4 | Confident | 38 Ų | 38 | 82.9 Ų | 82.9 | 20% | 0.199 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -70.3 | -30.4 | 173.4 | -64.6 | -177.5 | 0 | 0 | 0 | 112.6 | M96 T97 A98 L107 M153 | M96-L100 VanDerWaalsContact O-CG 3.31Å; M96-L100 WeakPolarHBondContact O-CG 3.41Å; M96-L100 PolarHBondContact O-N 3.37Å; T97-L100 PolarHBondContact O-N 3.29Å; A98-L100 VanDerWaalsContact C-N 3.31Å; A98-L100 PolarHBondContact O-N 2.9Å; L100-L107 HydrophobicContact CD2-CB 4.29Å; L100-L107 HydrophobicContact CD2-CD1 3.87Å; L100-L107 HydrophobicContact CD2-CD2 3.82Å; L100-L107 HydrophobicContact CD2-CG 4.19Å; L100-M153 VanDerWaalsContact CD1-O 3.25Å; L100-M153 WeakPolarHBondContact CD1-O 3.5Å |
| 101 | N | 64.6 | Low | 77.2 | Confident | 119 Ų | 119 | 80.5 Ų | 80.5 | 64% | 0.636 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -87.5 | -24.3 | 179.9 | -78.1 | -83.5 | 0 | 0 | 0 | 113.7 | T97 A98 A99 D103 | T97-N101 WeakPolarHBondContact CG2-ND2 3.44Å; T97-N101 PolarHBondContact O-N 3.1Å; T97-N101 PolarHBondContact O-ND2 3.33Å; A98-N101 CarbonylContact O-C 3.6Å; A98-N101 PolarHBondContact O-N 2.94Å; A98-N101 VanDerWaalsContact O-N 3.13Å; A99-N101 VanDerWaalsContact C-N 3.34Å; N101-D103 VanDerWaalsContact C-N 3.29Å; N101-D103 PolarHBondContact O-N 3.17Å |
| 102 | S | 66.3 | Low | 77 | Confident | 97 Ų | 97 | 79.5 Ų | 79.5 | 68% | 0.678 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -67.7 | -27.9 | -176.5 | 51.9 | 0 | 0 | 0 | 0 | 113.5 | A98 A99 | A98-S102 WeakPolarHBondContact O-CB 3.46Å; A98-S102 PolarHBondContact O-N 3.31Å; A98-S102 PolarHBondContact O-OG 2.88Å; A99-S102 PolarHBondContact O-OG 3.49Å |
| 103 | D | 64.8 | Low | 77.1 | Confident | 58 Ų | 58 | 75.7 Ų | 75.7 | 31% | 0.31 | 44% | 0.442 | S | S | . | . | trans | -153.4 | 98.1 | 164.2 | -173.7 | -11.6 | 0 | 0 | 0 | 109.1 | N101 T105 V106 | N101-D103 VanDerWaalsContact C-N 3.29Å; N101-D103 PolarHBondContact O-N 3.17Å; D103-T105 VanDerWaalsContact CG-OG1 3.23Å; D103-T105 PolarHBondContact O-N 2.91Å; D103-T105 WeakPolarHBondContact OD1-CA 3.29Å; D103-T105 WeakPolarHBondContact OD1-CB 3.38Å; D103-T105 WeakPolarHBondContact OD1-CG2 3.38Å; D103-T105 PolarHBondContact OD1-N 3.33Å; D103-T105 PolarHBondContact OD1-OG1 3.45Å; D103-T105 PolarHBondContact OD2-OG1 3.43Å; D103-V106 HydrophobicContact CB-CB 4.32Å; D103-V106 HydrophobicContact CB-CG2 3.74Å; D103-V106 PolarHBondContact O-N 3.35Å; D103-V106 WeakPolarHBondContact OD2-CG2 3.38Å | ||
| 104 | P | 64.9 | Low | 77.4 | Confident | 97 Ų | 97 | 69.8 Ų | 69.8 | 63% | 0.63 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -61.1 | -16.7 | 179 | 26.1 | -34 | 0 | 0 | 0 | 112.4 | ||
| 105 | T | 75.2 | Confident | 77.8 | Confident | 65 Ų | 65 | 69.5 Ų | 69.5 | 40% | 0.399 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -78.7 | -26 | 176.9 | 80.7 | 0 | 0 | 0 | 0 | 112.9 | D103 G108 K109 | D103-T105 VanDerWaalsContact CG-OG1 3.23Å; D103-T105 PolarHBondContact O-N 2.91Å; D103-T105 WeakPolarHBondContact OD1-CA 3.29Å; D103-T105 WeakPolarHBondContact OD1-CB 3.38Å; D103-T105 WeakPolarHBondContact OD1-CG2 3.38Å; D103-T105 PolarHBondContact OD1-N 3.33Å; D103-T105 PolarHBondContact OD1-OG1 3.45Å; D103-T105 PolarHBondContact OD2-OG1 3.43Å; T105-G108 PolarHBondContact O-N 3.26Å; T105-K109 WeakPolarHBondContact O-CB 3.31Å; T105-K109 WeakPolarHBondContact O-CD 3.46Å; T105-K109 WeakPolarHBondContact O-CG 3.23Å; T105-K109 PolarHBondContact O-N 2.79Å; T105-K109 PolarHBondContact OG1-NZ 3.08Å |
| 106 | V | 77.7 | Confident | 78.4 | Confident | 86 Ų | 86 | 70.8 Ų | 70.8 | 52% | 0.521 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -66.7 | -43.7 | -179.9 | 169.8 | 0 | 0 | 0 | 0 | 110.8 | D103 K109 Y110 | D103-V106 HydrophobicContact CB-CB 4.32Å; D103-V106 HydrophobicContact CB-CG2 3.74Å; D103-V106 PolarHBondContact O-N 3.35Å; D103-V106 WeakPolarHBondContact OD2-CG2 3.38Å; V106-K109 PolarHBondContact O-N 2.84Å; V106-Y110 WeakPolarHBondContact O-CB 3.31Å; V106-Y110 PolarHBondContact O-N 3.42Å |
| 107 | L | 76.7 | Confident | 79.4 | Confident | 30 Ų | 30 | 70.3 Ų | 70.3 | 16% | 0.157 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -64.4 | -43.2 | 175.5 | -172.6 | 70.7 | 0 | 0 | 0 | 110.8 | L100 K109 Y110 T111 I150 N154 | L100-L107 HydrophobicContact CD2-CB 4.29Å; L100-L107 HydrophobicContact CD2-CD1 3.87Å; L100-L107 HydrophobicContact CD2-CD2 3.82Å; L100-L107 HydrophobicContact CD2-CG 4.19Å; L107-K109 VanDerWaalsContact C-N 3.33Å; L107-K109 PolarHBondContact O-N 3.11Å; L107-Y110 WeakPolarHBondContact O-CB 2.81Å; L107-Y110 PolarHBondContact O-N 3.01Å; L107-T111 PolarHBondContact O-N 3.47Å; L107-T111 PolarHBondContact O-OG1 2.81Å; L107-I150 HydrophobicContact CD1-CG2 4.43Å; L107-N154 HydrophobicContact CD2-CB 4.13Å |
| 108 | G | 81.1 | Confident | 80.4 | Confident | 38 Ų | 38 | 69 Ų | 69 | 39% | 0.392 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -60.1 | -40 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | T105 T111 A112 | T105-G108 PolarHBondContact O-N 3.26Å; G108-T111 WeakPolarHBondContact CA-OG1 3.43Å; G108-T111 PolarHBondContact O-OG1 2.75Å; G108-T111 VanDerWaalsContact O-OG1 3.09Å; G108-A112 VanDerWaalsContact O-CB 3.27Å; G108-A112 WeakPolarHBondContact O-CB 2.74Å; G108-A112 PolarHBondContact O-N 3.42Å |
| 109 | K | 85.4 | Confident | 81.4 | Confident | 136 Ų | 136 | 71 Ų | 71 | 59% | 0.591 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -66.9 | -39.3 | 174 | -72.4 | 162.6 | -176.2 | 160.5 | 0 | 111.5 | T105 V106 L107 G113 | T105-K109 WeakPolarHBondContact O-CB 3.31Å; T105-K109 WeakPolarHBondContact O-CD 3.46Å; T105-K109 WeakPolarHBondContact O-CG 3.23Å; T105-K109 PolarHBondContact O-N 2.79Å; T105-K109 PolarHBondContact OG1-NZ 3.08Å; V106-K109 PolarHBondContact O-N 2.84Å; L107-K109 VanDerWaalsContact C-N 3.33Å; L107-K109 PolarHBondContact O-N 3.11Å; K109-G113 PolarHBondContact O-N 3.28Å |
| 110 | Y | 86.4 | Confident | 82.9 | Confident | 128 Ų | 128 | 72.5 Ų | 72.5 | 50% | 0.502 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -66.4 | -46.5 | 176.4 | 178.4 | -99.3 | 0 | 0 | 0 | 112.1 | V106 L107 A112 G113 F114 I150 | V106-Y110 WeakPolarHBondContact O-CB 3.31Å; V106-Y110 PolarHBondContact O-N 3.42Å; L107-Y110 WeakPolarHBondContact O-CB 2.81Å; L107-Y110 PolarHBondContact O-N 3.01Å; Y110-A112 VanDerWaalsContact C-N 3.34Å; Y110-A112 PolarHBondContact O-N 3.33Å; Y110-G113 PolarHBondContact O-N 2.89Å; Y110-F114 WeakPolarHBondContact O-CB 3.4Å; Y110-F114 PolarHBondContact O-N 3.5Å; Y110-I150 HydrophobicContact CD1-CG2 4.19Å; Y110-I150 HydrophobicContact CE1-CD1 3.79Å; Y110-I150 HydrophobicContact CE1-CG1 4.23Å; Y110-I150 HydrophobicContact CE1-CG2 4.09Å |
| 111 | T | 88.1 | Confident | 84.4 | Confident | 23 Ų | 23 | 72.6 Ų | 72.6 | 14% | 0.141 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -64.8 | -37.6 | 176.2 | 39.7 | 0 | 0 | 0 | 0 | 112.1 | L107 G108 F114 S115 M147 I150 | L107-T111 PolarHBondContact O-N 3.47Å; L107-T111 PolarHBondContact O-OG1 2.81Å; G108-T111 WeakPolarHBondContact CA-OG1 3.43Å; G108-T111 PolarHBondContact O-OG1 2.75Å; G108-T111 VanDerWaalsContact O-OG1 3.09Å; T111-F114 PolarHBondContact O-N 2.78Å; T111-S115 WeakPolarHBondContact O-CB 3.45Å; T111-S115 PolarHBondContact O-N 3.28Å; T111-M147 HydrophobicContact CG2-CE 4.17Å; T111-M147 HydrophobicContact CG2-SD 4.32Å; T111-I150 HydrophobicContact CG2-CG2 3.63Å |
| 112 | A | 88.3 | Confident | 85.8 | Confident | 52 Ų | 52 | 69.2 Ų | 69.2 | 43% | 0.43 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -60.7 | -51 | 171.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | G108 Y110 F114 S115 E116 | G108-A112 VanDerWaalsContact O-CB 3.27Å; G108-A112 WeakPolarHBondContact O-CB 2.74Å; G108-A112 PolarHBondContact O-N 3.42Å; Y110-A112 VanDerWaalsContact C-N 3.34Å; Y110-A112 PolarHBondContact O-N 3.33Å; A112-F114 VanDerWaalsContact C-N 3.34Å; A112-F114 PolarHBondContact O-N 3.02Å; A112-S115 WeakPolarHBondContact O-CB 3.48Å; A112-S115 PolarHBondContact O-N 3.31Å; A112-S115 VanDerWaalsContact O-N 3.16Å; A112-E116 PolarHBondContact O-N 3.13Å |
| 113 | G | 92 | Very high | 87.1 | Confident | 34 Ų | 34 | 71.5 Ų | 71.5 | 35% | 0.351 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -63.6 | -35.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | K109 Y110 E116 C117 | K109-G113 PolarHBondContact O-N 3.28Å; Y110-G113 PolarHBondContact O-N 2.89Å; G113-E116 PolarHBondContact O-N 2.75Å; G113-C117 WeakPolarHBondContact O-CB 3.3Å; G113-C117 PolarHBondContact O-N 2.83Å |
| 114 | F | 94.1 | Very high | 88.5 | Confident | 33 Ų | 33 | 74.4 Ų | 74.4 | 15% | 0.145 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -66.2 | -39.8 | 173.9 | -172.1 | -86.4 | 0 | 0 | 0 | 111.8 | Y110 T111 A112 C117 T118 L143 C146 M147 I150 | Y110-F114 WeakPolarHBondContact O-CB 3.4Å; Y110-F114 PolarHBondContact O-N 3.5Å; T111-F114 PolarHBondContact O-N 2.78Å; A112-F114 VanDerWaalsContact C-N 3.34Å; A112-F114 PolarHBondContact O-N 3.02Å; F114-C117 PolarHBondContact O-N 3.05Å; F114-T118 WeakPolarHBondContact CE1-OG1 3.23Å; F114-T118 WeakPolarHBondContact O-CB 3.45Å; F114-T118 PolarHBondContact O-N 3.39Å; F114-T118 PolarHBondContact O-OG1 3.31Å; F114-L143 HydrophobicContact CZ-CD2 4.01Å; F114-C146 HydrophobicContact CZ-CB 3.93Å; F114-M147 HydrophobicContact CD1-CB 4.25Å; F114-M147 HydrophobicContact CD1-CG 4.46Å; F114-M147 HydrophobicContact CD1-SD 3.64Å; F114-M147 HydrophobicContact CE1-CB 3.94Å; F114-M147 HydrophobicContact CE1-SD 4.3Å; F114-M147 HydrophobicContact CG-SD 4.43Å; F114-I150 HydrophobicContact CD1-CD1 4.48Å; F114-I150 HydrophobicContact CD2-CD1 4.12Å; F114-I150 HydrophobicContact CE2-CD1 4.23Å; F114-I150 HydrophobicContact CG-CD1 4.25Å; F114-I150 HydrophobicContact CZ-CD1 4.48Å |
| 115 | S | 92.9 | Very high | 89.8 | Confident | 50 Ų | 50 | 70.4 Ų | 70.4 | 35% | 0.35 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -62.4 | -46.9 | 173.9 | -175.7 | 0 | 0 | 0 | 0 | 111 | T111 A112 C117 T118 N119 | T111-S115 WeakPolarHBondContact O-CB 3.45Å; T111-S115 PolarHBondContact O-N 3.28Å; A112-S115 WeakPolarHBondContact O-CB 3.48Å; A112-S115 PolarHBondContact O-N 3.31Å; A112-S115 VanDerWaalsContact O-N 3.16Å; S115-C117 PolarHBondContact O-N 3.01Å; S115-T118 PolarHBondContact O-N 2.61Å; S115-N119 WeakPolarHBondContact O-CB 3.36Å; S115-N119 PolarHBondContact O-N 3.39Å; S115-N119 PolarHBondContact O-ND2 2.82Å; S115-N119 PolarHBondContact OG-ND2 3Å |
| 116 | E | 95.4 | Very high | 90.5 | Very high | 145 Ų | 145 | 71.5 Ų | 71.5 | 68% | 0.678 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -59.5 | -44.9 | 176.3 | -71.2 | -174 | 161.9 | 0 | 0 | 111.9 | A112 G113 T118 N119 E120 | A112-E116 PolarHBondContact O-N 3.13Å; G113-E116 PolarHBondContact O-N 2.75Å; E116-T118 PolarHBondContact O-N 2.96Å; E116-N119 PolarHBondContact O-N 3.08Å; E116-E120 PolarHBondContact O-N 3.38Å |
| 117 | C | 95.5 | Very high | 91 | Very high | 73 Ų | 73 | 71.9 Ų | 71.9 | 49% | 0.493 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -60.5 | -45 | 175.4 | -179.6 | 0 | 0 | 0 | 0 | 112.1 | G113 F114 S115 N119 E120 V121 | G113-C117 WeakPolarHBondContact O-CB 3.3Å; G113-C117 PolarHBondContact O-N 2.83Å; F114-C117 PolarHBondContact O-N 3.05Å; S115-C117 PolarHBondContact O-N 3.01Å; C117-N119 VanDerWaalsContact C-N 3.33Å; C117-N119 PolarHBondContact O-N 3.29Å; C117-E120 PolarHBondContact O-N 3.45Å; C117-V121 WeakPolarHBondContact O-CG2 3.16Å; C117-V121 PolarHBondContact O-N 2.81Å |
| 118 | T | 95.7 | Very high | 91.5 | Very high | 28 Ų | 28 | 72 Ų | 72 | 17% | 0.172 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -63.1 | -40.6 | 178.6 | -59 | 0 | 0 | 0 | 0 | 111.4 | F114 S115 E116 V121 T122 L143 | F114-T118 WeakPolarHBondContact CE1-OG1 3.23Å; F114-T118 WeakPolarHBondContact O-CB 3.45Å; F114-T118 PolarHBondContact O-N 3.39Å; F114-T118 PolarHBondContact O-OG1 3.31Å; S115-T118 PolarHBondContact O-N 2.61Å; E116-T118 PolarHBondContact O-N 2.96Å; T118-V121 PolarHBondContact O-N 3.01Å; T118-T122 WeakPolarHBondContact O-CB 3.45Å; T118-T122 PolarHBondContact O-N 3.1Å; T118-T122 PolarHBondContact O-OG1 3.08Å; T118-L143 HydrophobicContact CG2-CB 4.02Å; T118-L143 HydrophobicContact CG2-CD1 4.18Å |
| 119 | N | 95.3 | Very high | 91.5 | Very high | 100 Ų | 100 | 79.7 Ų | 79.7 | 54% | 0.535 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -63.3 | -42.3 | 174.9 | -77.3 | -61.9 | 0 | 0 | 0 | 111.4 | S115 E116 C117 T122 R123 | S115-N119 WeakPolarHBondContact O-CB 3.36Å; S115-N119 PolarHBondContact O-N 3.39Å; S115-N119 PolarHBondContact O-ND2 2.82Å; S115-N119 PolarHBondContact OG-ND2 3Å; E116-N119 PolarHBondContact O-N 3.08Å; C117-N119 VanDerWaalsContact C-N 3.33Å; C117-N119 PolarHBondContact O-N 3.29Å; N119-T122 WeakPolarHBondContact O-CB 3.22Å; N119-T122 PolarHBondContact O-N 2.89Å; N119-R123 WeakPolarHBondContact O-CB 3.22Å; N119-R123 PolarHBondContact O-N 3.07Å |
| 120 | E | 96.8 | Very high | 91.4 | Very high | 92 Ų | 92 | 77.3 Ų | 77.3 | 43% | 0.43 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -67.4 | -40.3 | 177.8 | -173.8 | 58.4 | -165 | 0 | 0 | 112.2 | E116 C117 T122 R123 F124 | E116-E120 PolarHBondContact O-N 3.38Å; C117-E120 PolarHBondContact O-N 3.45Å; E120-T122 VanDerWaalsContact C-N 3.29Å; E120-T122 PolarHBondContact O-N 3.48Å; E120-R123 PolarHBondContact O-N 3.22Å; E120-R123 IonicContact OE1-CZ 3.43Å; E120-R123 IonicContact OE1-NE 3.31Å; E120-R123 PolarHBondContact OE1-NE 3.25Å; E120-R123 IonicContact OE1-NH2 2.75Å; E120-R123 PolarHBondContact OE1-NH2 3.38Å; E120-R123 IonicContact OE2-CZ 3.66Å; E120-R123 IonicContact OE2-NE 2.84Å; E120-R123 PolarHBondContact OE2-NE 3.11Å; E120-R123 IonicContact OE2-NH2 3.77Å; E120-F124 WeakPolarHBondContact O-CB 3.06Å; E120-F124 PolarHBondContact O-N 2.87Å |
| 121 | V | 95.4 | Very high | 91.3 | Very high | 41 Ų | 41 | 73.6 Ų | 73.6 | 25% | 0.248 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -59.8 | -42.6 | 172 | 171.2 | 0 | 0 | 0 | 0 | 110.5 | C117 T118 F124 L125 L139 L143 | C117-V121 WeakPolarHBondContact O-CG2 3.16Å; C117-V121 PolarHBondContact O-N 2.81Å; T118-V121 PolarHBondContact O-N 3.01Å; V121-F124 PolarHBondContact O-N 3.18Å; V121-L125 HydrophobicContact CG1-CD1 3.71Å; V121-L125 HydrophobicContact CG1-CG 4.27Å; V121-L125 WeakPolarHBondContact O-CB 3.24Å; V121-L125 WeakPolarHBondContact O-CG 3.38Å; V121-L125 PolarHBondContact O-N 3.28Å; V121-L139 HydrophobicContact CG1-CD2 4.16Å; V121-L143 HydrophobicContact CB-CD1 4.28Å; V121-L143 HydrophobicContact CG1-CD1 3.93Å |
| 122 | T | 93.4 | Very high | 91.4 | Very high | 48 Ų | 48 | 77.4 Ų | 77.4 | 29% | 0.294 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -62.1 | -44.5 | 176.7 | -55.2 | 0 | 0 | 0 | 0 | 111.4 | T118 N119 E120 S126 L140 | T118-T122 WeakPolarHBondContact O-CB 3.45Å; T118-T122 PolarHBondContact O-N 3.1Å; T118-T122 PolarHBondContact O-OG1 3.08Å; N119-T122 WeakPolarHBondContact O-CB 3.22Å; N119-T122 PolarHBondContact O-N 2.89Å; E120-T122 VanDerWaalsContact C-N 3.29Å; E120-T122 PolarHBondContact O-N 3.48Å; T122-S126 WeakPolarHBondContact O-CB 3.33Å; T122-S126 PolarHBondContact O-N 3.13Å; T122-S126 VanDerWaalsContact O-N 3.12Å; T122-S126 PolarHBondContact O-OG 2.99Å; T122-L140 HydrophobicContact CG2-CD1 4.37Å; T122-L140 VanDerWaalsContact OG1-CD2 3.24Å; T122-L140 WeakPolarHBondContact OG1-CD2 3.41Å |
| 123 | R | 94.4 | Very high | 91.5 | Very high | 145 Ų | 145 | 79.4 Ų | 79.4 | 55% | 0.547 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -61.5 | -50.5 | 176.3 | -167.3 | -177.7 | 78.2 | 89.6 | 2.2 | 111.3 | N119 E120 L125 S126 T127 | N119-R123 WeakPolarHBondContact O-CB 3.22Å; N119-R123 PolarHBondContact O-N 3.07Å; E120-R123 PolarHBondContact O-N 3.22Å; E120-R123 IonicContact OE1-CZ 3.43Å; E120-R123 IonicContact OE1-NE 3.31Å; E120-R123 PolarHBondContact OE1-NE 3.25Å; E120-R123 IonicContact OE1-NH2 2.75Å; E120-R123 PolarHBondContact OE1-NH2 3.38Å; E120-R123 IonicContact OE2-CZ 3.66Å; E120-R123 IonicContact OE2-NE 2.84Å; E120-R123 PolarHBondContact OE2-NE 3.11Å; E120-R123 IonicContact OE2-NH2 3.77Å; R123-L125 PolarHBondContact O-N 3.45Å; R123-S126 WeakPolarHBondContact O-CB 3.45Å; R123-S126 PolarHBondContact O-N 2.83Å; R123-S126 VanDerWaalsContact O-N 3.08Å; R123-T127 PolarHBondContact O-N 3Å; R123-T127 VanDerWaalsContact O-N 3.12Å; R123-T127 PolarHBondContact O-OG1 3.23Å |
| 124 | F | 94.3 | Very high | 91.5 | Very high | 119 Ų | 119 | 83.1 Ų | 83.1 | 52% | 0.522 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -56.9 | -48.9 | 178.7 | 176.6 | -101.5 | 0 | 0 | 0 | 111.8 | E120 V121 S126 T127 C128 | E120-F124 WeakPolarHBondContact O-CB 3.06Å; E120-F124 PolarHBondContact O-N 2.87Å; V121-F124 PolarHBondContact O-N 3.18Å; F124-S126 PolarHBondContact O-N 2.91Å; F124-T127 PolarHBondContact O-N 3.47Å; F124-T127 VanDerWaalsContact O-N 3.11Å; F124-T127 PolarHBondContact O-OG1 3.47Å; F124-C128 VanDerWaalsContact CE1-SG 3.5Å; F124-C128 WeakPolarHBondContact CE2-SG 3.35Å; F124-C128 WeakPolarHBondContact CZ-SG 3.35Å; F124-C128 WeakPolarHBondContact O-CB 3.31Å; F124-C128 PolarHBondContact O-N 3.34Å; F124-C128 PolarHBondContact O-SG 2.93Å |
| 125 | L | 92.6 | Very high | 91.4 | Very high | 12 Ų | 12 | 85.6 Ų | 85.6 | 6% | 0.063 | 48% | 0.478 | C | S | . | . | H | α-helix | trans | -66.1 | -22.1 | 179.1 | -69.1 | 172 | 0 | 0 | 0 | 113.4 | V121 R123 V131 R136 L139 L140 | V121-L125 HydrophobicContact CG1-CD1 3.71Å; V121-L125 HydrophobicContact CG1-CG 4.27Å; V121-L125 WeakPolarHBondContact O-CB 3.24Å; V121-L125 WeakPolarHBondContact O-CG 3.38Å; V121-L125 PolarHBondContact O-N 3.28Å; R123-L125 PolarHBondContact O-N 3.45Å; L125-V131 HydrophobicContact CD2-CG1 4.26Å; L125-R136 HydrophobicContact CB-CG 4.04Å; L125-R136 HydrophobicContact CD1-CG 4.02Å; L125-R136 PolarHBondContact O-NE 2.89Å; L125-R136 PolarHBondContact O-NH2 3.17Å; L125-L139 HydrophobicContact CD1-CD2 3.82Å; L125-L140 HydrophobicContact CD1-CD2 4.29Å; L125-L140 HydrophobicContact CD1-CG 4.42Å |
| 126 | S | 88.5 | Confident | 91.4 | Very high | 89 Ų | 89 | 85.8 Ų | 85.8 | 62% | 0.622 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -79.2 | -31.6 | 175.5 | -57.3 | 0 | 0 | 0 | 0 | 111.7 | T122 R123 F124 | T122-S126 WeakPolarHBondContact O-CB 3.33Å; T122-S126 PolarHBondContact O-N 3.13Å; T122-S126 VanDerWaalsContact O-N 3.12Å; T122-S126 PolarHBondContact O-OG 2.99Å; R123-S126 WeakPolarHBondContact O-CB 3.45Å; R123-S126 PolarHBondContact O-N 2.83Å; R123-S126 VanDerWaalsContact O-N 3.08Å; F124-S126 PolarHBondContact O-N 2.91Å |
| 127 | T | 89.6 | Confident | 91.3 | Very high | 94 Ų | 94 | 83.3 Ų | 83.3 | 58% | 0.577 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -88.8 | -17.2 | 176.6 | 52 | 0 | 0 | 0 | 0 | 114 | R123 F124 E129 | R123-T127 PolarHBondContact O-N 3Å; R123-T127 VanDerWaalsContact O-N 3.12Å; R123-T127 PolarHBondContact O-OG1 3.23Å; F124-T127 PolarHBondContact O-N 3.47Å; F124-T127 VanDerWaalsContact O-N 3.11Å; F124-T127 PolarHBondContact O-OG1 3.47Å; T127-E129 PolarHBondContact O-N 3.47Å |
| 128 | C | 85.5 | Confident | 91.3 | Very high | 33 Ų | 33 | 88 Ų | 88 | 22% | 0.223 | 47% | 0.474 | C | S | . | . | trans | -82.5 | 108 | 178 | -75.8 | 0 | 0 | 0 | 0 | 112.1 | F124 V131 | F124-C128 VanDerWaalsContact CE1-SG 3.5Å; F124-C128 WeakPolarHBondContact CE2-SG 3.35Å; F124-C128 WeakPolarHBondContact CZ-SG 3.35Å; F124-C128 WeakPolarHBondContact O-CB 3.31Å; F124-C128 PolarHBondContact O-N 3.34Å; F124-C128 PolarHBondContact O-SG 2.93Å; C128-V131 HydrophobicContact CB-CG2 4.08Å | ||
| 129 | E | 83 | Confident | 91.3 | Very high | 198 Ų | 198 | 90 Ų | 90 | 93% | 0.925 | 48% | 0.483 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.6 | 137.3 | 167.5 | -61 | -169.5 | 140 | 0 | 0 | 110.4 | T127 | T127-E129 PolarHBondContact O-N 3.47Š|
| 130 | G | 82 | Confident | 91.2 | Very high | 87 Ų | 87 | 87.5 Ų | 87.5 | 90% | 0.897 | 47% | 0.469 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 99.9 | -7.6 | 178 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||
| 131 | V | 84.8 | Confident | 91.1 | Very high | 50 Ų | 50 | 85 Ų | 85 | 30% | 0.303 | 47% | 0.469 | S | S | . | . | trans | -80.8 | 126.3 | 171.8 | -177.8 | 0 | 0 | 0 | 0 | 110.3 | L125 C128 T133 | L125-V131 HydrophobicContact CD2-CG1 4.26Å; C128-V131 HydrophobicContact CB-CG2 4.08Å; V131-T133 PolarHBondContact O-N 3.01Å | ||
| 132 | N | 90.4 | Very high | 91.2 | Very high | 102 Ų | 102 | 89 Ų | 89 | 55% | 0.545 | 48% | 0.484 | S | S | . | . | trans | -58 | 130.4 | 177.9 | -173.9 | -64.2 | 0 | 0 | 0 | 111.3 | E134 V135 R136 | N132-E134 PolarHBondContact O-N 2.98Å; N132-E134 VanDerWaalsContact OD1-CB 3.3Å; N132-E134 WeakPolarHBondContact OD1-CB 3.49Å; N132-E134 PolarHBondContact OD1-N 3.39Å; N132-V135 HydrophobicContact CB-CB 4.45Å; N132-V135 HydrophobicContact CB-CG2 4.08Å; N132-V135 PolarHBondContact O-N 3.45Å; N132-V135 VanDerWaalsContact O-N 3.1Å; N132-R136 PolarHBondContact O-N 3.44Å; N132-R136 VanDerWaalsContact O-N 3.11Å | ||
| 133 | T | 89.5 | Confident | 91.3 | Very high | 95 Ų | 95 | 88.1 Ų | 88.1 | 58% | 0.583 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -56.8 | -34.9 | -177.6 | -53.1 | 0 | 0 | 0 | 0 | 113 | V131 R136 T137 | V131-T133 PolarHBondContact O-N 3.01Å; T133-R136 WeakPolarHBondContact O-CB 3.37Å; T133-R136 PolarHBondContact O-N 3.1Å; T133-T137 PolarHBondContact O-N 2.87Å; T133-T137 PolarHBondContact O-OG1 3.08Å; T133-T137 VanDerWaalsContact O-OG1 3.09Å |
| 134 | E | 92.8 | Very high | 91.1 | Very high | 111 Ų | 111 | 83.8 Ų | 83.8 | 52% | 0.519 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -71.8 | -36.5 | 179.7 | -171.1 | 156.1 | 174.1 | 0 | 0 | 112.4 | N132 R136 T137 R138 | N132-E134 PolarHBondContact O-N 2.98Å; N132-E134 VanDerWaalsContact OD1-CB 3.3Å; N132-E134 WeakPolarHBondContact OD1-CB 3.49Å; N132-E134 PolarHBondContact OD1-N 3.39Å; E134-R136 VanDerWaalsContact C-N 3.34Å; E134-T137 PolarHBondContact O-N 3.33Å; E134-R138 WeakPolarHBondContact O-CB 3.35Å; E134-R138 VanDerWaalsContact O-CG 3.26Å; E134-R138 WeakPolarHBondContact O-CG 3.24Å; E134-R138 PolarHBondContact O-N 3.02Å; E134-R138 IonicContact OE1-CZ 3.47Å; E134-R138 IonicContact OE1-NE 3.43Å; E134-R138 PolarHBondContact OE1-NE 3.06Å; E134-R138 IonicContact OE1-NH2 2.72Å; E134-R138 PolarHBondContact OE1-NH2 3.4Å |
| 135 | V | 92.3 | Very high | 91.1 | Very high | 86 Ų | 86 | 81.8 Ų | 81.8 | 52% | 0.521 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -64.6 | -42.2 | 173.6 | 177.7 | 0 | 0 | 0 | 0 | 110.3 | N132 R138 L139 | N132-V135 HydrophobicContact CB-CB 4.45Å; N132-V135 HydrophobicContact CB-CG2 4.08Å; N132-V135 PolarHBondContact O-N 3.45Å; N132-V135 VanDerWaalsContact O-N 3.1Å; V135-R138 PolarHBondContact O-N 3.37Å; V135-L139 WeakPolarHBondContact O-CB 3.41Å; V135-L139 PolarHBondContact O-N 3.3Å |
| 136 | R | 91.6 | Very high | 91.1 | Very high | 53 Ų | 53 | 83 Ų | 83 | 20% | 0.2 | 48% | 0.482 | C | S | . | . | H | α-helix | trans | -57.3 | -50.9 | 174.7 | -176.5 | -175.4 | -63.8 | 106 | -0.2 | 111.1 | L125 N132 T133 E134 R138 L139 L140 | L125-R136 HydrophobicContact CB-CG 4.04Å; L125-R136 HydrophobicContact CD1-CG 4.02Å; L125-R136 PolarHBondContact O-NE 2.89Å; L125-R136 PolarHBondContact O-NH2 3.17Å; N132-R136 PolarHBondContact O-N 3.44Å; N132-R136 VanDerWaalsContact O-N 3.11Å; T133-R136 WeakPolarHBondContact O-CB 3.37Å; T133-R136 PolarHBondContact O-N 3.1Å; E134-R136 VanDerWaalsContact C-N 3.34Å; R136-R138 PolarHBondContact O-N 3.25Å; R136-L139 PolarHBondContact O-N 3.28Å; R136-L140 HydrophobicContact CG-CD1 4.13Å; R136-L140 WeakPolarHBondContact O-CG 3.33Å; R136-L140 PolarHBondContact O-N 2.75Å |
| 137 | T | 93.1 | Very high | 91 | Very high | 93 Ų | 93 | 81 Ų | 81 | 57% | 0.571 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -63.3 | -42.3 | 179.7 | -56.4 | 0 | 0 | 0 | 0 | 112.1 | T133 E134 G141 | T133-T137 PolarHBondContact O-N 2.87Å; T133-T137 PolarHBondContact O-OG1 3.08Å; T133-T137 VanDerWaalsContact O-OG1 3.09Å; E134-T137 PolarHBondContact O-N 3.33Å; T137-G141 PolarHBondContact O-N 3.43Å |
| 138 | R | 96.2 | Very high | 90.9 | Very high | 173 Ų | 173 | 81.1 Ų | 81.1 | 65% | 0.653 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -63.5 | -42.3 | 177.7 | -73.5 | 178.2 | -172.1 | -163.3 | 5.3 | 112.1 | E134 V135 R136 H142 | E134-R138 WeakPolarHBondContact O-CB 3.35Å; E134-R138 VanDerWaalsContact O-CG 3.26Å; E134-R138 WeakPolarHBondContact O-CG 3.24Å; E134-R138 PolarHBondContact O-N 3.02Å; E134-R138 IonicContact OE1-CZ 3.47Å; E134-R138 IonicContact OE1-NE 3.43Å; E134-R138 PolarHBondContact OE1-NE 3.06Å; E134-R138 IonicContact OE1-NH2 2.72Å; E134-R138 PolarHBondContact OE1-NH2 3.4Å; V135-R138 PolarHBondContact O-N 3.37Å; R136-R138 PolarHBondContact O-N 3.25Å; R138-H142 WeakPolarHBondContact O-CB 3.46Å; R138-H142 PolarHBondContact O-N 3.02Å |
| 139 | L | 95.2 | Very high | 90.9 | Very high | 69 Ų | 69 | 85.9 Ų | 85.9 | 36% | 0.361 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -65.2 | -48.7 | 178.4 | 178 | 57.8 | 0 | 0 | 0 | 111.7 | V121 L125 V135 R136 G141 H142 L143 | V121-L139 HydrophobicContact CG1-CD2 4.16Å; L125-L139 HydrophobicContact CD1-CD2 3.82Å; V135-L139 WeakPolarHBondContact O-CB 3.41Å; V135-L139 PolarHBondContact O-N 3.3Å; R136-L139 PolarHBondContact O-N 3.28Å; L139-G141 VanDerWaalsContact C-N 3.34Å; L139-G141 PolarHBondContact O-N 3.02Å; L139-H142 WeakPolarHBondContact O-CB 3.17Å; L139-H142 PolarHBondContact O-N 2.89Å; L139-L143 HydrophobicContact CD1-CD1 4.45Å; L139-L143 HydrophobicContact CD1-CG 4.49Å; L139-L143 HydrophobicContact CG-CD1 4.4Å; L139-L143 WeakPolarHBondContact O-CG 3.43Å; L139-L143 PolarHBondContact O-N 2.87Å |
| 140 | L | 94.4 | Very high | 90.9 | Very high | 47 Ų | 47 | 77.2 Ų | 77.2 | 25% | 0.246 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -64.2 | -39.6 | 177.9 | -66.2 | 178.9 | 0 | 0 | 0 | 111.8 | T122 L125 R136 H142 L143 A144 | T122-L140 HydrophobicContact CG2-CD1 4.37Å; T122-L140 VanDerWaalsContact OG1-CD2 3.24Å; T122-L140 WeakPolarHBondContact OG1-CD2 3.41Å; L125-L140 HydrophobicContact CD1-CD2 4.29Å; L125-L140 HydrophobicContact CD1-CG 4.42Å; R136-L140 HydrophobicContact CG-CD1 4.13Å; R136-L140 WeakPolarHBondContact O-CG 3.33Å; R136-L140 PolarHBondContact O-N 2.75Å; L140-H142 VanDerWaalsContact C-N 3.33Å; L140-H142 PolarHBondContact O-N 3.27Å; L140-L143 HydrophobicContact CD2-CD1 4.45Å; L140-L143 PolarHBondContact O-N 2.95Å; L140-A144 WeakPolarHBondContact O-CB 3.28Å; L140-A144 PolarHBondContact O-N 2.85Å |
| 141 | G | 94.7 | Very high | 90.7 | Very high | 41 Ų | 41 | 76.4 Ų | 76.4 | 42% | 0.423 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -61.8 | -39.5 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | T137 L139 A144 S145 | T137-G141 PolarHBondContact O-N 3.43Å; L139-G141 VanDerWaalsContact C-N 3.34Å; L139-G141 PolarHBondContact O-N 3.02Å; G141-A144 PolarHBondContact O-N 3.29Å; G141-S145 PolarHBondContact O-N 3.28Å |
| 142 | H | 96.1 | Very high | 90.1 | Very high | 125 Ų | 125 | 77.1 Ų | 77.1 | 58% | 0.579 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -64.7 | -45.5 | 175.1 | -179.3 | 67.9 | 0 | 0 | 0 | 112.2 | R138 L139 L140 A144 S145 C146 | R138-H142 WeakPolarHBondContact O-CB 3.46Å; R138-H142 PolarHBondContact O-N 3.02Å; L139-H142 WeakPolarHBondContact O-CB 3.17Å; L139-H142 PolarHBondContact O-N 2.89Å; L140-H142 VanDerWaalsContact C-N 3.33Å; L140-H142 PolarHBondContact O-N 3.27Å; H142-A144 VanDerWaalsContact C-N 3.34Å; H142-A144 PolarHBondContact O-N 3.09Å; H142-S145 PolarHBondContact O-N 3.21Å; H142-C146 WeakPolarHBondContact O-CB 3.21Å; H142-C146 PolarHBondContact O-N 3.47Å |
| 143 | L | 95.4 | Very high | 88.9 | Confident | 28 Ų | 28 | 76.6 Ų | 76.6 | 15% | 0.147 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -61.5 | -41.8 | 177.1 | -69 | 170.6 | 0 | 0 | 0 | 111.7 | F114 T118 V121 L139 L140 C146 M147 | F114-L143 HydrophobicContact CZ-CD2 4.01Å; T118-L143 HydrophobicContact CG2-CB 4.02Å; T118-L143 HydrophobicContact CG2-CD1 4.18Å; V121-L143 HydrophobicContact CB-CD1 4.28Å; V121-L143 HydrophobicContact CG1-CD1 3.93Å; L139-L143 HydrophobicContact CD1-CD1 4.45Å; L139-L143 HydrophobicContact CD1-CG 4.49Å; L139-L143 HydrophobicContact CG-CD1 4.4Å; L139-L143 WeakPolarHBondContact O-CG 3.43Å; L139-L143 PolarHBondContact O-N 2.87Å; L140-L143 HydrophobicContact CD2-CD1 4.45Å; L140-L143 PolarHBondContact O-N 2.95Å; L143-C146 WeakPolarHBondContact O-CB 3.44Å; L143-C146 PolarHBondContact O-N 3.01Å; L143-M147 PolarHBondContact O-N 3.05Å |
| 144 | A | 91.7 | Very high | 87.5 | Confident | 55 Ų | 55 | 75.9 Ų | 75.9 | 46% | 0.455 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -61.5 | -45.3 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112 | L140 G141 H142 C146 M147 T148 | L140-A144 WeakPolarHBondContact O-CB 3.28Å; L140-A144 PolarHBondContact O-N 2.85Å; G141-A144 PolarHBondContact O-N 3.29Å; H142-A144 VanDerWaalsContact C-N 3.34Å; H142-A144 PolarHBondContact O-N 3.09Å; A144-C146 VanDerWaalsContact C-N 3.3Å; A144-C146 PolarHBondContact O-N 3.45Å; A144-M147 WeakPolarHBondContact O-CB 3.43Å; A144-M147 PolarHBondContact O-N 3.35Å; A144-T148 PolarHBondContact O-N 3.21Å; A144-T148 PolarHBondContact O-OG1 3.43Å |
| 145 | S | 93.1 | Very high | 85.4 | Confident | 77 Ų | 77 | 79.6 Ų | 79.6 | 54% | 0.538 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -62.4 | -37.3 | 175.8 | -175.3 | 0 | 0 | 0 | 0 | 112.4 | G141 H142 T148 Q149 | G141-S145 PolarHBondContact O-N 3.28Å; H142-S145 PolarHBondContact O-N 3.21Å; S145-T148 PolarHBondContact O-N 3.2Å; S145-Q149 PolarHBondContact O-N 3.44Å |
| 146 | C | 92.3 | Very high | 83.2 | Confident | 36 Ų | 36 | 79.6 Ų | 79.6 | 24% | 0.243 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -64.4 | -44.3 | 176.6 | -163 | 0 | 0 | 0 | 0 | 110.7 | F114 H142 L143 A144 T148 Q149 I150 | F114-C146 HydrophobicContact CZ-CB 3.93Å; H142-C146 WeakPolarHBondContact O-CB 3.21Å; H142-C146 PolarHBondContact O-N 3.47Å; L143-C146 WeakPolarHBondContact O-CB 3.44Å; L143-C146 PolarHBondContact O-N 3.01Å; A144-C146 VanDerWaalsContact C-N 3.3Å; A144-C146 PolarHBondContact O-N 3.45Å; C146-T148 VanDerWaalsContact C-N 3.35Å; C146-T148 PolarHBondContact O-N 3.01Å; C146-Q149 WeakPolarHBondContact O-CB 3.44Å; C146-Q149 PolarHBondContact O-N 3.44Å; C146-Q149 VanDerWaalsContact O-N 3.12Å; C146-I150 WeakPolarHBondContact O-CD1 3.36Å; C146-I150 VanDerWaalsContact O-CG1 3.28Å; C146-I150 WeakPolarHBondContact O-CG1 3.41Å; C146-I150 PolarHBondContact O-N 3.41Å |
| 147 | M | 88.2 | Confident | 80.8 | Confident | 48 Ų | 48 | 82.1 Ų | 82.1 | 24% | 0.236 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -60.2 | -42.4 | 175.2 | -170.5 | 61.6 | 166.9 | 0 | 0 | 112.1 | T111 F114 L143 A144 Q149 I150 N151 | T111-M147 HydrophobicContact CG2-CE 4.17Å; T111-M147 HydrophobicContact CG2-SD 4.32Å; F114-M147 HydrophobicContact CD1-CB 4.25Å; F114-M147 HydrophobicContact CD1-CG 4.46Å; F114-M147 HydrophobicContact CD1-SD 3.64Å; F114-M147 HydrophobicContact CE1-CB 3.94Å; F114-M147 HydrophobicContact CE1-SD 4.3Å; F114-M147 HydrophobicContact CG-SD 4.43Å; L143-M147 PolarHBondContact O-N 3.05Å; A144-M147 WeakPolarHBondContact O-CB 3.43Å; A144-M147 PolarHBondContact O-N 3.35Å; M147-Q149 VanDerWaalsContact C-N 3.32Å; M147-Q149 PolarHBondContact O-N 3.35Å; M147-I150 PolarHBondContact O-N 3.32Å; M147-N151 PolarHBondContact O-N 3.37Å; M147-N151 PolarHBondContact O-ND2 3.45Å |
| 148 | T | 87 | Confident | 78 | Confident | 97 Ų | 97 | 85.6 Ų | 85.6 | 60% | 0.595 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -63 | -38.9 | 175.1 | -53.5 | 0 | 0 | 0 | 0 | 111.7 | A144 S145 C146 N151 A152 | A144-T148 PolarHBondContact O-N 3.21Å; A144-T148 PolarHBondContact O-OG1 3.43Å; S145-T148 PolarHBondContact O-N 3.2Å; C146-T148 VanDerWaalsContact C-N 3.35Å; C146-T148 PolarHBondContact O-N 3.01Å; T148-N151 PolarHBondContact O-N 2.93Å; T148-A152 VanDerWaalsContact O-CB 3.3Å; T148-A152 WeakPolarHBondContact O-CB 3.49Å; T148-A152 PolarHBondContact O-N 2.96Å |
| 149 | Q | 84.9 | Confident | 75.4 | Confident | 133 Ų | 133 | 84.8 Ų | 84.8 | 62% | 0.621 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -65.8 | -43.7 | 176.3 | -177.3 | 179.3 | 87 | 0 | 0 | 112.1 | S145 C146 M147 N151 A152 M153 | S145-Q149 PolarHBondContact O-N 3.44Å; C146-Q149 WeakPolarHBondContact O-CB 3.44Å; C146-Q149 PolarHBondContact O-N 3.44Å; C146-Q149 VanDerWaalsContact O-N 3.12Å; M147-Q149 VanDerWaalsContact C-N 3.32Å; M147-Q149 PolarHBondContact O-N 3.35Å; Q149-N151 VanDerWaalsContact C-N 3.28Å; Q149-N151 PolarHBondContact O-N 3Å; Q149-A152 PolarHBondContact O-N 3.41Å; Q149-M153 PolarHBondContact O-N 2.99Å |
| 150 | I | 82.9 | Confident | 72.6 | Confident | 16 Ų | 16 | 89.7 Ų | 89.7 | 8% | 0.082 | 49% | 0.486 | C | S | . | . | H | α-helix | trans | -58.8 | -42.5 | 176 | -66.3 | 158.5 | 0 | 0 | 0 | 110.2 | L107 Y110 T111 F114 C146 M147 | L107-I150 HydrophobicContact CD1-CG2 4.43Å; Y110-I150 HydrophobicContact CD1-CG2 4.19Å; Y110-I150 HydrophobicContact CE1-CD1 3.79Å; Y110-I150 HydrophobicContact CE1-CG1 4.23Å; Y110-I150 HydrophobicContact CE1-CG2 4.09Å; T111-I150 HydrophobicContact CG2-CG2 3.63Å; F114-I150 HydrophobicContact CD1-CD1 4.48Å; F114-I150 HydrophobicContact CD2-CD1 4.12Å; F114-I150 HydrophobicContact CE2-CD1 4.23Å; F114-I150 HydrophobicContact CG-CD1 4.25Å; F114-I150 HydrophobicContact CZ-CD1 4.48Å; C146-I150 WeakPolarHBondContact O-CD1 3.36Å; C146-I150 VanDerWaalsContact O-CG1 3.28Å; C146-I150 WeakPolarHBondContact O-CG1 3.41Å; C146-I150 PolarHBondContact O-N 3.41Å; M147-I150 PolarHBondContact O-N 3.32Å |
| 151 | N | 77.8 | Confident | 69.8 | Low | 69 Ų | 69 | 94.2 Ų | 94.2 | 37% | 0.369 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -72.9 | -35.1 | 176.4 | -74.8 | -67.7 | 0 | 0 | 0 | 113.4 | M147 T148 Q149 M153 N154 | M147-N151 PolarHBondContact O-N 3.37Å; M147-N151 PolarHBondContact O-ND2 3.45Å; T148-N151 PolarHBondContact O-N 2.93Å; Q149-N151 VanDerWaalsContact C-N 3.28Å; Q149-N151 PolarHBondContact O-N 3Å; N151-M153 PolarHBondContact O-N 2.91Å; N151-N154 WeakPolarHBondContact O-CB 3.45Å; N151-N154 PolarHBondContact O-N 3.46Å |
| 152 | A | 73.4 | Confident | 67.3 | Low | 66 Ų | 66 | 98.1 Ų | 98.1 | 55% | 0.545 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -65.2 | -30.6 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | T148 Q149 N154 Y155 | T148-A152 VanDerWaalsContact O-CB 3.3Å; T148-A152 WeakPolarHBondContact O-CB 3.49Å; T148-A152 PolarHBondContact O-N 2.96Å; Q149-A152 PolarHBondContact O-N 3.41Å; A152-N154 PolarHBondContact O-N 2.94Å; A152-Y155 PolarHBondContact O-N 3.13Å |
| 153 | M | 63.8 | Low | 64.5 | Low | 91 Ų | 91 | 98.4 Ų | 98.4 | 45% | 0.448 | 54% | 0.537 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.8 | -15.2 | 173.5 | -148.7 | 152.7 | 78.9 | 0 | 0 | 113.1 | M96 L100 Q149 N151 | M96-M153 HydrophobicContact CE-CE 3.68Å; M96-M153 HydrophobicContact CE-CG 4.14Å; M96-M153 HydrophobicContact CE-SD 3.33Å; M96-M153 WeakPolarHBondContact CE-SD 3.44Å; M96-M153 HydrophobicContact CG-CG 4.47Å; M96-M153 HydrophobicContact SD-CE 4.22Å; M96-M153 HydrophobicContact SD-CG 3.51Å; M96-M153 VanDerWaalsContact SD-CG 3.51Å; M96-M153 HydrophobicContact SD-SD 3.55Å; L100-M153 VanDerWaalsContact CD1-O 3.25Å; L100-M153 WeakPolarHBondContact CD1-O 3.5Å; Q149-M153 PolarHBondContact O-N 2.99Å; N151-M153 PolarHBondContact O-N 2.91Å |
| 154 | N | 60.4 | Low | 61.8 | Low | 79 Ų | 79 | 100.5 Ų | 100.5 | 42% | 0.422 | 57% | 0.566 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -78.2 | -24.5 | 177.7 | -161.1 | -6.2 | 0 | 0 | 0 | 112.9 | L107 N151 A152 P156 | L107-N154 HydrophobicContact CD2-CB 4.13Å; N151-N154 WeakPolarHBondContact O-CB 3.45Å; N151-N154 PolarHBondContact O-N 3.46Å; A152-N154 PolarHBondContact O-N 2.94Å; N154-P156 WeakPolarHBondContact O-CD 3.4Å |
| 155 | Y | 48.5 | Very low | 59.5 | Low | 190 Ų | 190 | 103.5 Ų | 103.5 | 75% | 0.745 | 58% | 0.581 | S | S | * | * | S | Bend | trans | -98 | 100.3 | 173.3 | -82.7 | -89.7 | 0 | 0 | 0 | 109.7 | A152 T157 | A152-Y155 PolarHBondContact O-N 3.13Å; Y155-T157 PolarHBondContact O-N 3.36Å |
| 156 | P | 45.8 | Very low | 57.1 | Low | 86 Ų | 86 | 105.9 Ų | 105.9 | 56% | 0.558 | 60% | 0.595 | S | S | * | * | trans | -58.7 | 115.9 | 155.2 | 26.6 | -29.4 | 0 | 0 | 0 | 105.9 | N154 Q158 | N154-P156 WeakPolarHBondContact O-CD 3.4Å; P156-Q158 VanDerWaalsContact C-N 3.28Å; P156-Q158 PolarHBondContact O-N 2.88Å | ||
| 157 | T | 41.2 | Very low | 54.6 | Low | 106 Ų | 106 | 113.1 Ų | 113.1 | 65% | 0.65 | 62% | 0.624 | S | S | * | * | trans | -52.2 | 96.9 | 169 | -42.5 | 0 | 0 | 0 | 0 | 107.7 | Y155 H159 | Y155-T157 PolarHBondContact O-N 3.36Å; T157-H159 WeakPolarHBondContact CG2-ND1 3.49Å; T157-H159 PolarHBondContact O-N 3.02Å | ||
| 158 | Q | 36.1 | Very low | 52.4 | Low | 166 Ų | 166 | 121.7 Ų | 121.7 | 78% | 0.776 | 65% | 0.654 | S | S | * | * | trans | -55.3 | 96.2 | 151.1 | -97.3 | -79.7 | -35.8 | 0 | 0 | 104.5 | P156 Q160 | P156-Q158 VanDerWaalsContact C-N 3.28Å; P156-Q158 PolarHBondContact O-N 2.88Å; Q158-Q160 PolarHBondContact O-N 3.47Å | ||
| 159 | H | 40.2 | Very low | 49.9 | Very low | 155 Ų | 155 | 121.8 Ų | 121.8 | 72% | 0.718 | 67% | 0.665 | S | S | * | * | trans | -63.5 | 88.8 | 166.1 | -88.9 | 63.2 | 0 | 0 | 0 | 106.2 | T157 I161 | T157-H159 WeakPolarHBondContact CG2-ND1 3.49Å; T157-H159 PolarHBondContact O-N 3.02Å; H159-I161 PolarHBondContact O-N 3.47Å | ||
| 160 | Q | 37.2 | Very low | 47.5 | Very low | 173 Ų | 173 | 124.9 Ų | 124.9 | 81% | 0.808 | 68% | 0.676 | S | S | * | * | trans | -62.5 | 115.4 | 155.8 | -72.8 | -173.8 | 46.4 | 0 | 0 | 106.2 | Q158 P162 | Q158-Q160 PolarHBondContact O-N 3.47Å; Q160-P162 WeakPolarHBondContact O-CD 3.43Å | ||
| 161 | I | 34.4 | Very low | 45.3 | Very low | 141 Ų | 141 | 127.3 Ų | 127.3 | 72% | 0.723 | 71% | 0.705 | S | S | * | * | trans | -68.5 | 120.1 | 174.4 | -48 | 164 | 0 | 0 | 0 | 106 | H159 T163 | H159-I161 PolarHBondContact O-N 3.47Å; I161-T163 HydrophobicContact CG2-CG2 4.12Å; I161-T163 PolarHBondContact O-N 3.4Å | ||
| 162 | P | 42.6 | Very low | 43.3 | Very low | 124 Ų | 124 | 133.3 Ų | 133.3 | 81% | 0.805 | 73% | 0.731 | S | S | * | * | trans | -83.4 | 109.5 | 171.4 | 9.2 | 6.9 | 0 | 0 | 0 | 108.6 | Q160 | Q160-P162 WeakPolarHBondContact O-CD 3.43Š| ||
| 163 | T | 38.3 | Very low | 41.3 | Very low | 130 Ų | 130 | 134.9 Ų | 134.9 | 80% | 0.798 | 74% | 0.738 | S | S | * | * | trans | -132.1 | 105.9 | 165.9 | 52.4 | 0 | 0 | 0 | 0 | 110.3 | I161 | I161-T163 HydrophobicContact CG2-CG2 4.12Å; I161-T163 PolarHBondContact O-N 3.4Å | ||
| 164 | G | 37.6 | Very low | 39.9 | Very low | 72 Ų | 72 | 138.7 Ų | 138.7 | 74% | 0.742 | 76% | 0.757 | S | S | * | * | trans | 129.1 | 141 | 152.7 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 165 | P | 44.2 | Very low | 38.6 | Very low | 119 Ų | 119 | 142 Ų | 142 | 77% | 0.773 | 78% | 0.78 | S | S | * | * | trans | -86.4 | 168.9 | -157.4 | 37 | -36.8 | 0 | 0 | 0 | 115.1 | H167 | P165-H167 PolarHBondContact O-N 3.26Š| ||
| 166 | P | 42.8 | Very low | 37.8 | Very low | 127 Ų | 127 | 140.5 Ų | 140.5 | 83% | 0.825 | 78% | 0.779 | S | S | * | * | trans | -82.3 | 118.6 | -171 | 32.7 | -30.4 | 0 | 0 | 0 | 111.1 | ||||
| 167 | H | 38.8 | Very low | 37.3 | Very low | 188 Ų | 188 | 144.1 Ų | 144.1 | 87% | 0.87 | 79% | 0.792 | S | S | * | * | trans | -87.1 | 112.7 | 158.9 | -102 | -91.8 | 0 | 0 | 0 | 109.4 | P165 | P165-H167 PolarHBondContact O-N 3.26Š| ||
| 168 | R | 43.1 | Very low | 37.4 | Very low | 228 Ų | 228 | 143.8 Ų | 143.8 | 86% | 0.86 | 79% | 0.791 | S | S | * | * | trans | -57.6 | 129.4 | 160 | -90.8 | -177.2 | 162.9 | 160.1 | -4.2 | 109.4 | ||||
| 169 | A | 33.3 | Very low | 37 | Very low | 99 Ų | 99 | 143.1 Ų | 143.1 | 82% | 0.818 | 79% | 0.793 | S | S | * | * | trans | -143.3 | 135.7 | 153.3 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 170 | F | 35.8 | Very low | 36.7 | Very low | 197 Ų | 197 | 139.8 Ų | 139.8 | 86% | 0.864 | 79% | 0.788 | S | S | * | * | trans | -78.5 | 153.3 | -169.5 | -84.9 | -112.4 | 0 | 0 | 0 | 113.5 | ||||
| 171 | G | 35.5 | Very low | 36.7 | Very low | 67 Ų | 67 | 136.5 Ų | 136.5 | 69% | 0.691 | 78% | 0.783 | S | S | * | * | trans | 68.5 | 126.7 | 149.2 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 172 | Q | 35.9 | Very low | 37.3 | Very low | 196 Ų | 196 | 135.9 Ų | 135.9 | 92% | 0.916 | 79% | 0.789 | S | S | * | * | -170.1 | 161.7 | 73.7 | -82.9 | -75.5 | -21 | 0 | 0 | 110.6 | |||||
| 173 | S | 31.6 | Very low | 37 | Very low | 98 Ų | 98 | 138.7 Ų | 138.7 | 69% | 0.685 | 79% | 0.791 | S | S | * | * | trans | -84.4 | 160.8 | -171.2 | -170.2 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 174 | M | 35.4 | Very low | 36.7 | Very low | 171 Ų | 171 | 136.2 Ų | 136.2 | 84% | 0.842 | 79% | 0.791 | S | S | * | * | trans | 44.4 | 127.9 | 151.6 | -92 | -161.1 | -172.1 | 0 | 0 | 120.4 | ||||
| 175 | V | 32.9 | Very low | 36.6 | Very low | 149 Ų | 149 | 139.9 Ų | 139.9 | 90% | 0.903 | 79% | 0.794 | S | S | * | * | -162.6 | 145.8 | 98.4 | -128.2 | 0 | 0 | 0 | 0 | 111.7 | |||||
| 176 | H | 31.9 | Very low | 36.2 | Very low | 159 Ų | 159 | 141.1 Ų | 141.1 | 74% | 0.736 | 80% | 0.799 | S | S | * | * | trans | -111.5 | 134.1 | 175.5 | 159 | -158.6 | 0 | 0 | 0 | 107.9 | ||||
| 177 | I | 34.9 | Very low | 36.2 | Very low | 162 Ų | 162 | 143.8 Ų | 143.8 | 83% | 0.831 | 80% | 0.803 | S | S | * | * | trans | -160.3 | 141 | 141.5 | -62.2 | -159.6 | 0 | 0 | 0 | 109.3 | ||||
| 178 | P | 43.4 | Very low | 36.5 | Very low | 98 Ų | 98 | 140.5 Ų | 140.5 | 64% | 0.636 | 80% | 0.798 | S | S | * | * | trans | -99.2 | 159.6 | -178.8 | 38.1 | -31.5 | 0 | 0 | 0 | 113.8 | ||||
| 179 | N | 28 | Very low | 36.3 | Very low | 153 Ų | 153 | 137.3 Ų | 137.3 | 82% | 0.818 | 80% | 0.797 | S | S | * | * | trans | -158.8 | 130.5 | 159.3 | -159.2 | 30.1 | 0 | 0 | 0 | 116.4 | ||||
| 180 | S | 32.8 | Very low | 36.8 | Very low | 85 Ų | 85 | 138 Ų | 138 | 59% | 0.594 | 79% | 0.793 | S | S | * | * | trans | 52.5 | 118.7 | 144.2 | 65.2 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 181 | S | 38.4 | Very low | 36.6 | Very low | 103 Ų | 103 | 134.6 Ų | 134.6 | 72% | 0.72 | 79% | 0.793 | S | S | * | * | trans | -44.8 | 168 | 144.9 | 48.3 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 182 | P | 46.7 | Very low | 36.6 | Very low | 129 Ų | 129 | 141.4 Ų | 141.4 | 84% | 0.838 | 80% | 0.803 | S | S | * | * | -134.7 | 155.7 | 107.8 | 32.7 | -19.1 | 0 | 0 | 0 | 115.1 | |||||
| 183 | Q | 35.8 | Very low | 36.3 | Very low | 182 Ų | 182 | 136 Ų | 136 | 85% | 0.85 | 80% | 0.8 | S | S | * | * | trans | -67.7 | 152.1 | 176.4 | -67.6 | 170.6 | -11.9 | 0 | 0 | 112.7 | ||||
| 184 | G | 32.6 | Very low | 36.1 | Very low | 78 Ų | 78 | 135 Ų | 135 | 80% | 0.804 | 81% | 0.805 | S | S | * | * | trans | -152.3 | 92.6 | 162 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 185 | N | 34.7 | Very low | 36.1 | Very low | 150 Ų | 150 | 132.5 Ų | 132.5 | 80% | 0.802 | 81% | 0.805 | S | S | * | * | trans | -71.7 | 132.9 | 171.5 | -84.2 | 15.8 | 0 | 0 | 0 | 110.9 | ||||
| 186 | V | 36.3 | Very low | 36.7 | Very low | 145 Ų | 145 | 131 Ų | 131 | 88% | 0.879 | 80% | 0.798 | S | S | * | * | trans | -147.2 | 132.4 | 139.4 | -79.7 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 187 | M | 43.1 | Very low | 36.6 | Very low | 183 Ų | 183 | 132.8 Ų | 132.8 | 90% | 0.901 | 81% | 0.807 | S | S | * | * | trans | -79.8 | 168.3 | -178 | -91 | -174.4 | 139.3 | 0 | 0 | 113.2 | ||||
| 188 | P | 45.2 | Very low | 36.3 | Very low | 119 Ų | 119 | 130.6 Ų | 130.6 | 77% | 0.773 | 81% | 0.806 | S | S | * | * | trans | -91.4 | 154.9 | -167.1 | 35.8 | -31.4 | 0 | 0 | 0 | 113.3 | ||||
| 189 | L | 38.5 | Very low | 35.8 | Very low | 160 Ų | 160 | 134.8 Ų | 134.8 | 84% | 0.838 | 82% | 0.819 | S | S | * | * | trans | -114.2 | 132.1 | 173.4 | -161.5 | 75.2 | 0 | 0 | 0 | 111.1 | ||||
| 190 | P | 43 | Very low | 35.8 | Very low | 113 Ų | 113 | 133 Ų | 133 | 73% | 0.734 | 82% | 0.819 | S | S | * | * | trans | -103.4 | 139.7 | 173.2 | 36.2 | -26.5 | 0 | 0 | 0 | 111.4 | ||||
| 191 | C | 31.9 | Very low | 36.2 | Very low | 126 Ų | 126 | 134.9 Ų | 134.9 | 85% | 0.851 | 83% | 0.829 | S | S | * | * | trans | -134.7 | 133 | 165.9 | -63.5 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 192 | K | 34.6 | Very low | 36.4 | Very low | 210 Ų | 210 | 138.5 Ų | 138.5 | 91% | 0.913 | 83% | 0.834 | S | S | * | * | trans | -118.5 | 136.5 | -170.1 | 170.5 | 175.2 | 165.5 | -177.8 | 0 | 109.1 | ||||
| 193 | G | 30.9 | Very low | 36.1 | Very low | 83 Ų | 83 | 138.1 Ų | 138.1 | 86% | 0.856 | 83% | 0.83 | S | S | * | * | trans | 85 | 124.8 | 143.4 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 194 | G | 27.8 | Very low | 36.7 | Very low | 76 Ų | 76 | 133 Ų | 133 | 78% | 0.784 | 81% | 0.811 | S | S | * | * | trans | 175.9 | 80.7 | 166.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 195 | S | 34.6 | Very low | 37.5 | Very low | 120 Ų | 120 | 137.4 Ų | 137.4 | 84% | 0.839 | 81% | 0.808 | S | S | * | * | trans | 10.4 | 158.7 | 155.5 | -45.6 | 0 | 0 | 0 | 0 | 124.5 | ||||
| 196 | P | 45.6 | Very low | 38.2 | Very low | 118 Ų | 118 | 134 Ų | 134 | 77% | 0.766 | 79% | 0.792 | S | S | * | * | trans | -96.7 | 142.1 | -168.7 | 37 | -28.9 | 0 | 0 | 0 | 112.8 | ||||
| 197 | Q | 29.7 | Very low | 38.8 | Very low | 196 Ų | 196 | 136.8 Ų | 136.8 | 92% | 0.916 | 79% | 0.789 | S | S | * | * | trans | -150.7 | 135.8 | 160.8 | -92 | -168.7 | 32.9 | 0 | 0 | 113.7 | ||||
| 198 | S | 27.6 | Very low | 39.5 | Very low | 116 Ų | 116 | 131.3 Ų | 131.3 | 81% | 0.811 | 78% | 0.779 | S | S | * | * | trans | 85.1 | 108.1 | 146.3 | -149.3 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 199 | M | 33.5 | Very low | 40.1 | Very low | 186 Ų | 186 | 127.9 Ų | 127.9 | 92% | 0.916 | 77% | 0.765 | S | S | * | * | trans | -63.9 | 135.2 | 164.8 | -56.9 | -75.1 | -176.4 | 0 | 0 | 110.5 | ||||
| 200 | S | 28.6 | Very low | 40.9 | Very low | 116 Ų | 116 | 124.3 Ų | 124.3 | 81% | 0.811 | 74% | 0.743 | S | S | * | * | trans | -145.2 | 122.7 | 154.7 | -166 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 201 | P | 41.3 | Very low | 42 | Very low | 123 Ų | 123 | 123.1 Ų | 123.1 | 80% | 0.799 | 73% | 0.728 | S | S | * | * | trans | -103.1 | 88.3 | -168.7 | 36.6 | -26.7 | 0 | 0 | 0 | 110.3 | ||||
| 202 | E | 43 | Very low | 43.4 | Very low | 180 Ų | 180 | 119.6 Ų | 119.6 | 84% | 0.841 | 70% | 0.7 | S | S | * | * | trans | -168.4 | 87.3 | 156.8 | -129.4 | 176.7 | 83.8 | 0 | 0 | 111.2 | ||||
| 203 | T | 39.2 | Very low | 45 | Very low | 121 Ų | 121 | 112.8 Ų | 112.8 | 74% | 0.742 | 68% | 0.676 | S | S | * | * | trans | -143.9 | 95.2 | 151.6 | 53.2 | 0 | 0 | 0 | 0 | 108.9 | K205 | T203-K205 VanDerWaalsContact C-N 3.32Å; T203-K205 PolarHBondContact O-N 2.89Å | ||
| 204 | T | 49.4 | Very low | 46.2 | Very low | 75 Ų | 75 | 113.5 Ų | 113.5 | 46% | 0.46 | 67% | 0.666 | S | S | . | * | trans | -60.6 | 95.6 | 165.1 | -55.8 | 0 | 0 | 0 | 0 | 107.8 | V206 H211 | T204-V206 PolarHBondContact O-N 3.13Å; T204-H211 HydrophobicContact CG2-CB 4.05Å | ||
| 205 | K | 49.2 | Very low | 47.7 | Very low | 169 Ų | 169 | 112 Ų | 112 | 74% | 0.735 | 65% | 0.645 | S | S | * | * | trans | -75.5 | 111.6 | 174.5 | -73.7 | -153.3 | 177.9 | -176.1 | 0 | 108.9 | T203 | T203-K205 VanDerWaalsContact C-N 3.32Å; T203-K205 PolarHBondContact O-N 2.89Å | ||
| 206 | V | 49.3 | Very low | 48.6 | Very low | 78 Ų | 78 | 113.9 Ų | 113.9 | 47% | 0.473 | 65% | 0.652 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -78 | 119.9 | 172.1 | 177.6 | 0 | 0 | 0 | 0 | 108.2 | T204 | T204-V206 PolarHBondContact O-N 3.13Å |
| 207 | Y | 49.1 | Very low | 49.4 | Very low | 204 Ų | 204 | 113 Ų | 113 | 80% | 0.8 | 64% | 0.641 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -117.7 | 118.1 | 169.3 | -153.4 | -93.4 | 0 | 0 | 0 | 107.7 | G209 F210 | Y207-G209 VanDerWaalsContact C-N 3.33Å; Y207-G209 PolarHBondContact O-N 3.35Å; Y207-F210 PolarHBondContact O-N 3.21Å |
| 208 | G | 56.3 | Low | 50.9 | Low | 69 Ų | 69 | 106.5 Ų | 106.5 | 71% | 0.711 | 63% | 0.627 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 65.8 | 23.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 116.6 | F210 | G208-F210 WeakPolarHBondContact O-CD2 3.25Å; G208-F210 WeakPolarHBondContact O-CE2 3.24Å |
| 209 | G | 58.8 | Low | 52.6 | Low | 46 Ų | 46 | 107.2 Ų | 107.2 | 47% | 0.474 | 62% | 0.617 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 89.4 | 4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | Y207 | Y207-G209 VanDerWaalsContact C-N 3.33Å; Y207-G209 PolarHBondContact O-N 3.35Å |
| 210 | F | 55.3 | Low | 54 | Low | 86 Ų | 86 | 105.1 Ų | 105.1 | 38% | 0.377 | 60% | 0.603 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -107.5 | 140 | 175.3 | -56.2 | -79.6 | 0 | 0 | 0 | 110.5 | Y207 G208 I224 | Y207-F210 PolarHBondContact O-N 3.21Å; G208-F210 WeakPolarHBondContact O-CD2 3.25Å; G208-F210 WeakPolarHBondContact O-CE2 3.24Å; F210-I224 HydrophobicContact CD1-CB 4.34Å; F210-I224 HydrophobicContact CD1-CG1 3.81Å; F210-I224 HydrophobicContact CE1-CB 4.28Å; F210-I224 HydrophobicContact CE1-CD1 4.42Å; F210-I224 HydrophobicContact CE1-CG1 3.79Å; F210-I224 HydrophobicContact CE1-CG2 4.05Å |
| 211 | H | 67 | Low | 55.8 | Low | 88 Ų | 88 | 101.9 Ų | 101.9 | 41% | 0.407 | 58% | 0.583 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -91.8 | 122.2 | 175.4 | -70.2 | -117.3 | 0 | 0 | 0 | 108.9 | T204 L223 | T204-H211 HydrophobicContact CG2-CB 4.05Å; H211-L223 HydrophobicContact CB-CB 4.17Å; H211-L223 HydrophobicContact CB-CD1 4.28Å; H211-L223 PolarHBondContact N-O 2.83Å; H211-L223 WeakPolarHBondContact O-CD1 3.42Å; H211-L223 PolarHBondContact O-N 2.94Å |
| 212 | L | 59.8 | Low | 57 | Low | 52 Ų | 52 | 102.6 Ų | 102.6 | 27% | 0.272 | 57% | 0.574 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -92.7 | 128.8 | 170.2 | -92.1 | 77 | 0 | 0 | 0 | 109.8 | F220 A221 F222 | L212-F220 HydrophobicContact CD2-CB 4.39Å; L212-F220 HydrophobicContact CD2-CD1 4.43Å; L212-A221 WeakPolarHBondContact CA-O 3.46Å; L212-F222 HydrophobicContact CD1-CD1 3.47Å; L212-F222 VanDerWaalsContact CD1-CD1 3.47Å; L212-F222 HydrophobicContact CD1-CE1 3.46Å; L212-F222 VanDerWaalsContact CD1-CE1 3.46Å; L212-F222 HydrophobicContact CD1-CG 4.44Å; L212-F222 HydrophobicContact CD1-CZ 4.4Å; L212-F222 HydrophobicContact CD2-CE1 4.17Å; L212-F222 HydrophobicContact CD2-CZ 4.34Å; L212-F222 HydrophobicContact CG-CD1 4.02Å; L212-F222 HydrophobicContact CG-CE1 3.95Å; L212-F222 HydrophobicContact CG-CZ 4.46Å |
| 213 | V | 68.9 | Low | 58 | Low | 66 Ų | 66 | 97.1 Ų | 97.1 | 40% | 0.4 | 55% | 0.55 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -121 | 129.4 | 172.3 | 179.8 | 0 | 0 | 0 | 0 | 108.8 | A215 A221 L223 | V213-A215 PolarHBondContact O-N 3.29Å; V213-A221 PolarHBondContact N-O 3.2Å; V213-A221 VanDerWaalsContact N-O 3.09Å; V213-A221 PolarHBondContact O-N 3.27Å; V213-A221 VanDerWaalsContact O-N 3.1Å; V213-L223 HydrophobicContact CB-CD1 4.06Å; V213-L223 HydrophobicContact CG2-CD1 3.42Å; V213-L223 VanDerWaalsContact CG2-CD1 3.42Å |
| 214 | P | 56 | Low | 59.1 | Low | 99 Ų | 99 | 97 Ų | 97 | 64% | 0.643 | 54% | 0.544 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -69.6 | 127.6 | 174.2 | 26.4 | -30.5 | 0 | 0 | 0 | 110.2 | ||
| 215 | A | 59.8 | Low | 59.1 | Low | 43 Ų | 43 | 97.8 Ų | 97.8 | 36% | 0.355 | 55% | 0.55 | S | S | . | * | trans | -85.1 | 157.6 | 172.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | V213 D217 G218 Q219 | V213-A215 PolarHBondContact O-N 3.29Å; A215-D217 WeakPolarHBondContact CB-OD1 3.29Å; A215-D217 PolarHBondContact O-N 2.99Å; A215-D217 VanDerWaalsContact O-N 3.08Å; A215-G218 PolarHBondContact O-N 3.32Å; A215-G218 VanDerWaalsContact O-N 3.12Å; A215-Q219 WeakPolarHBondContact CB-O 3.42Å; A215-Q219 PolarHBondContact N-O 3.38Å | ||
| 216 | T | 52.1 | Low | 59 | Low | 161 Ų | 161 | 94.9 Ų | 94.9 | 99% | 0.988 | 54% | 0.543 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.5 | -6.5 | -174.8 | 48.4 | 0 | 0 | 0 | 0 | 114.4 | ||
| 217 | D | 63.2 | Low | 59.2 | Low | 100 Ų | 100 | 96.4 Ų | 96.4 | 54% | 0.535 | 56% | 0.564 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -105.3 | 6.1 | 177.6 | 68.7 | -15.4 | 0 | 0 | 0 | 113.4 | A215 Q219 | A215-D217 WeakPolarHBondContact CB-OD1 3.29Å; A215-D217 PolarHBondContact O-N 2.99Å; A215-D217 VanDerWaalsContact O-N 3.08Å; D217-Q219 VanDerWaalsContact C-N 3.33Å; D217-Q219 WeakPolarHBondContact OD1-CB 3.47Å; D217-Q219 PolarHBondContact OD1-N 3.22Å; D217-Q219 WeakPolarHBondContact OD2-CG 3.25Å; D217-Q219 PolarHBondContact OD2-NE2 3.19Å |
| 218 | G | 61.4 | Low | 59 | Low | 59 Ų | 59 | 90.1 Ų | 90.1 | 61% | 0.608 | 55% | 0.554 | S | S | * | * | S | Bend | trans | 82.9 | 3.9 | -178.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | A215 | A215-G218 PolarHBondContact O-N 3.32Å; A215-G218 VanDerWaalsContact O-N 3.12Å |
| 219 | Q | 62.3 | Low | 58.6 | Low | 130 Ų | 130 | 94 Ų | 94 | 61% | 0.607 | 55% | 0.551 | S | S | * | * | P | Polyproline II helix | trans | -83.6 | 153.2 | 170.9 | -60.3 | -170.9 | 60.1 | 0 | 0 | 111.3 | A215 D217 | A215-Q219 WeakPolarHBondContact CB-O 3.42Å; A215-Q219 PolarHBondContact N-O 3.38Å; D217-Q219 VanDerWaalsContact C-N 3.33Å; D217-Q219 WeakPolarHBondContact OD1-CB 3.47Å; D217-Q219 PolarHBondContact OD1-N 3.22Å; D217-Q219 WeakPolarHBondContact OD2-CG 3.25Å; D217-Q219 PolarHBondContact OD2-NE2 3.19Å |
| 220 | F | 64.3 | Low | 58 | Low | 143 Ų | 143 | 97.4 Ų | 97.4 | 63% | 0.627 | 56% | 0.563 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -103.7 | 124.3 | 177.4 | -63.6 | -84.3 | 0 | 0 | 0 | 110 | L212 | L212-F220 HydrophobicContact CD2-CB 4.39Å; L212-F220 HydrophobicContact CD2-CD1 4.43Å |
| 221 | A | 65.6 | Low | 57.6 | Low | 48 Ų | 48 | 99.3 Ų | 99.3 | 40% | 0.397 | 58% | 0.584 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -98.4 | 135.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 110.7 | L212 V213 | L212-A221 WeakPolarHBondContact CA-O 3.46Å; V213-A221 PolarHBondContact N-O 3.2Å; V213-A221 VanDerWaalsContact N-O 3.09Å; V213-A221 PolarHBondContact O-N 3.27Å; V213-A221 VanDerWaalsContact O-N 3.1Å |
| 222 | F | 66.4 | Low | 56.5 | Low | 138 Ų | 138 | 102.7 Ų | 102.7 | 61% | 0.605 | 61% | 0.605 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -98.3 | 120.6 | 173.7 | -64.1 | -96.7 | 0 | 0 | 0 | 109.4 | L212 | L212-F222 HydrophobicContact CD1-CD1 3.47Å; L212-F222 VanDerWaalsContact CD1-CD1 3.47Å; L212-F222 HydrophobicContact CD1-CE1 3.46Å; L212-F222 VanDerWaalsContact CD1-CE1 3.46Å; L212-F222 HydrophobicContact CD1-CG 4.44Å; L212-F222 HydrophobicContact CD1-CZ 4.4Å; L212-F222 HydrophobicContact CD2-CE1 4.17Å; L212-F222 HydrophobicContact CD2-CZ 4.34Å; L212-F222 HydrophobicContact CG-CD1 4.02Å; L212-F222 HydrophobicContact CG-CE1 3.95Å; L212-F222 HydrophobicContact CG-CZ 4.46Å |
| 223 | L | 64.9 | Low | 56 | Low | 65 Ų | 65 | 101.8 Ų | 101.8 | 34% | 0.34 | 61% | 0.608 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -90.6 | 118 | 170.2 | -68.7 | 104.6 | 0 | 0 | 0 | 109.7 | H211 V213 V235 | H211-L223 HydrophobicContact CB-CB 4.17Å; H211-L223 HydrophobicContact CB-CD1 4.28Å; H211-L223 PolarHBondContact N-O 2.83Å; H211-L223 WeakPolarHBondContact O-CD1 3.42Å; H211-L223 PolarHBondContact O-N 2.94Å; V213-L223 HydrophobicContact CB-CD1 4.06Å; V213-L223 HydrophobicContact CG2-CD1 3.42Å; V213-L223 VanDerWaalsContact CG2-CD1 3.42Å; L223-V235 HydrophobicContact CD2-CG1 4.27Å |
| 224 | I | 62 | Low | 54.8 | Low | 117 Ų | 117 | 104.7 Ų | 104.7 | 60% | 0.6 | 63% | 0.628 | S | S | * | * | trans | -96.6 | 115.6 | 172.3 | -57.3 | 179.4 | 0 | 0 | 0 | 107.9 | F210 N226 | F210-I224 HydrophobicContact CD1-CB 4.34Å; F210-I224 HydrophobicContact CD1-CG1 3.81Å; F210-I224 HydrophobicContact CE1-CB 4.28Å; F210-I224 HydrophobicContact CE1-CD1 4.42Å; F210-I224 HydrophobicContact CE1-CG1 3.79Å; F210-I224 HydrophobicContact CE1-CG2 4.05Å; I224-N226 PolarHBondContact O-N 3.24Å; I224-N226 VanDerWaalsContact O-N 3.13Å | ||
| 225 | P | 50 | Low | 54.5 | Low | 93 Ų | 93 | 105.1 Ų | 105.1 | 60% | 0.604 | 63% | 0.629 | S | S | * | * | trans | -66.2 | 112.3 | 172.2 | -14.6 | 28.3 | 0 | 0 | 0 | 109.3 | A227 | P225-A227 PolarHBondContact O-N 2.78Š| ||
| 226 | N | 47.7 | Very low | 53.9 | Low | 107 Ų | 107 | 109.9 Ų | 109.9 | 57% | 0.572 | 65% | 0.647 | S | S | * | * | trans | -82.8 | 113.9 | 174.6 | -168 | 4 | 0 | 0 | 0 | 108.9 | I224 A228 | I224-N226 PolarHBondContact O-N 3.24Å; I224-N226 VanDerWaalsContact O-N 3.13Å; N226-A228 PolarHBondContact O-N 2.87Å | ||
| 227 | A | 51.4 | Low | 53.7 | Low | 111 Ų | 111 | 105.8 Ų | 105.8 | 92% | 0.917 | 62% | 0.623 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.3 | -0.9 | -179.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | P225 | P225-A227 PolarHBondContact O-N 2.78Š|
| 228 | A | 45.9 | Very low | 53 | Low | 71 Ų | 71 | 107.2 Ų | 107.2 | 59% | 0.587 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.6 | -5.2 | -178 | 0 | 0 | 0 | 0 | 0 | 114.9 | N226 | N226-A228 PolarHBondContact O-N 2.87Š|
| 229 | F | 47.9 | Very low | 52.4 | Low | 151 Ų | 151 | 113.7 Ų | 113.7 | 66% | 0.662 | 64% | 0.643 | S | S | * | * | S | Bend | trans | -134.3 | 129.9 | -178.8 | -66 | -83.3 | 0 | 0 | 0 | 112.1 | ||
| 230 | T | 45.8 | Very low | 51.3 | Low | 117 Ų | 117 | 112.3 Ų | 112.3 | 72% | 0.718 | 65% | 0.653 | S | S | * | * | trans | -52.6 | 160.6 | 169.7 | 48.3 | 0 | 0 | 0 | 0 | 112 | N232 G233 | T230-N232 PolarHBondContact O-N 2.99Å; T230-G233 PolarHBondContact O-N 2.95Å | ||
| 231 | P | 46.8 | Very low | 50 | Low | 126 Ų | 126 | 112.8 Ų | 112.8 | 82% | 0.818 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.7 | 2.2 | -156.7 | -17 | 28.2 | 0 | 0 | 0 | 118 | ||
| 232 | N | 45.3 | Very low | 49 | Very low | 160 Ų | 160 | 118.8 Ų | 118.8 | 86% | 0.856 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -127.1 | 25.4 | -172.6 | -71.3 | -46.8 | 0 | 0 | 0 | 113.5 | T230 | T230-N232 PolarHBondContact O-N 2.99Š|
| 233 | G | 48.7 | Very low | 47.6 | Very low | 32 Ų | 32 | 118.8 Ų | 118.8 | 33% | 0.33 | 69% | 0.693 | S | S | . | * | S | Bend | trans | -89.9 | 149.7 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | T230 V235 | T230-G233 PolarHBondContact O-N 2.95Å; G233-V235 PolarHBondContact O-N 3.3Å |
| 234 | P | 43.9 | Very low | 46.6 | Very low | 127 Ų | 127 | 123.2 Ų | 123.2 | 83% | 0.825 | 72% | 0.717 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 126.1 | 179.6 | 25.1 | -31.6 | 0 | 0 | 0 | 111.4 | ||
| 235 | V | 49.4 | Very low | 45.5 | Very low | 108 Ų | 108 | 123.9 Ų | 123.9 | 66% | 0.655 | 73% | 0.727 | S | S | * | * | P | Polyproline II helix | trans | -80.3 | 121.4 | 179.2 | -177.8 | 0 | 0 | 0 | 0 | 109 | L223 G233 P237 | L223-V235 HydrophobicContact CD2-CG1 4.27Å; G233-V235 PolarHBondContact O-N 3.3Å; V235-P237 WeakPolarHBondContact O-CD 3.45Å |
| 236 | I | 47.2 | Very low | 45 | Very low | 143 Ų | 143 | 125.6 Ų | 125.6 | 73% | 0.733 | 74% | 0.738 | S | S | * | * | P | Polyproline II helix | trans | -92 | 117.4 | 178.7 | -55.4 | 178.6 | 0 | 0 | 0 | 108.7 | ||
| 237 | P | 47.2 | Very low | 44.7 | Very low | 75 Ų | 75 | 127 Ų | 127 | 49% | 0.487 | 75% | 0.75 | S | S | . | * | P | Polyproline II helix | trans | -72 | 129.9 | 174.1 | -7.6 | 23.7 | 0 | 0 | 0 | 109.8 | V235 Y239 | V235-P237 WeakPolarHBondContact O-CD 3.45Å; P237-Y239 HydrophobicContact CB-CE1 4.01Å; P237-Y239 HydrophobicContact CB-CE2 4.17Å |
| 238 | V | 48 | Very low | 44.1 | Very low | 131 Ų | 131 | 127.7 Ų | 127.7 | 79% | 0.794 | 75% | 0.746 | S | S | * | * | trans | -102 | 109.2 | 171.3 | 178.5 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 239 | Y | 49.5 | Very low | 43.7 | Very low | 195 Ų | 195 | 129.1 Ų | 129.1 | 77% | 0.765 | 76% | 0.757 | S | S | * | * | trans | -85.3 | 135.2 | 175.7 | -44 | -83.8 | 0 | 0 | 0 | 109.6 | P237 | P237-Y239 HydrophobicContact CB-CE1 4.01Å; P237-Y239 HydrophobicContact CB-CE2 4.17Å | ||
| 240 | A | 38.7 | Very low | 43.1 | Very low | 100 Ų | 100 | 126.5 Ų | 126.5 | 83% | 0.826 | 76% | 0.763 | S | S | * | * | trans | -107.2 | 94.5 | 171.1 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 241 | N | 37.4 | Very low | 42.8 | Very low | 153 Ų | 153 | 127.6 Ų | 127.6 | 82% | 0.818 | 77% | 0.77 | S | S | * | * | -171.7 | 153 | 128 | -133 | 5.2 | 0 | 0 | 0 | 115 | |||||
| 242 | Q | 44.9 | Very low | 42.1 | Very low | 175 Ų | 175 | 126.8 Ų | 126.8 | 82% | 0.818 | 77% | 0.767 | S | S | * | * | trans | -51.3 | 127.8 | 169.9 | -65.7 | 171.9 | -25.5 | 0 | 0 | 113.4 | ||||
| 243 | V | 36.6 | Very low | 41.8 | Very low | 138 Ų | 138 | 125.6 Ų | 125.6 | 84% | 0.836 | 77% | 0.768 | S | S | * | * | trans | -162.7 | 136 | 137.8 | 166.4 | 0 | 0 | 0 | 0 | 108.3 | T245 | V243-T245 PolarHBondContact O-N 2.98Š| ||
| 244 | N | 44.5 | Very low | 41.1 | Very low | 158 Ų | 158 | 127.8 Ų | 127.8 | 85% | 0.845 | 79% | 0.791 | S | S | * | * | trans | -39.2 | 121.8 | 176 | -81.7 | -3.2 | 0 | 0 | 0 | 115.6 | ||||
| 245 | T | 37.9 | Very low | 40.7 | Very low | 130 Ų | 130 | 126.2 Ų | 126.2 | 80% | 0.798 | 79% | 0.788 | S | S | * | * | trans | -156 | 150.7 | 143.6 | 38.5 | 0 | 0 | 0 | 0 | 110.3 | V243 | V243-T245 PolarHBondContact O-N 2.98Š| ||
| 246 | P | 40.7 | Very low | 40.3 | Very low | 129 Ų | 129 | 127.1 Ų | 127.1 | 84% | 0.838 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -84.3 | 126.3 | -170.2 | 28.6 | -23.1 | 0 | 0 | 0 | 112.1 | ||
| 247 | V | 40.4 | Very low | 40.2 | Very low | 136 Ų | 136 | 127.4 Ų | 127.4 | 82% | 0.824 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -87.9 | 142.4 | 170 | -94.6 | 0 | 0 | 0 | 0 | 110.7 | ||
| 248 | P | 38.8 | Very low | 39.8 | Very low | 127 Ų | 127 | 127.3 Ų | 127.3 | 83% | 0.825 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -71.1 | 139.3 | -179.4 | 29.1 | -32 | 0 | 0 | 0 | 111.3 | A250 | P248-A250 PolarHBondContact O-N 3.03Š|
| 249 | A | 37.9 | Very low | 39.2 | Very low | 100 Ų | 100 | 128.8 Ų | 128.8 | 83% | 0.826 | 82% | 0.821 | S | S | * | * | trans | -62.7 | 113.4 | -175.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 250 | A | 35.3 | Very low | 39.1 | Very low | 96 Ų | 96 | 125.2 Ų | 125.2 | 79% | 0.793 | 83% | 0.825 | S | S | * | * | trans | -87.5 | 119.6 | 157.6 | 0 | 0 | 0 | 0 | 0 | 108.5 | P248 | P248-A250 PolarHBondContact O-N 3.03Š| ||
| 251 | V | 40.1 | Very low | 39.1 | Very low | 141 Ų | 141 | 126.8 Ų | 126.8 | 86% | 0.855 | 82% | 0.819 | S | S | * | * | trans | -65.7 | 131.9 | -175.9 | -30.2 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 252 | S | 32.3 | Very low | 39.8 | Very low | 109 Ų | 109 | 125.3 Ų | 125.3 | 76% | 0.762 | 82% | 0.821 | S | S | * | * | trans | -122.9 | 139.5 | 165.4 | -81.9 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 253 | P | 38.5 | Very low | 39.9 | Very low | 135 Ų | 135 | 121.4 Ų | 121.4 | 88% | 0.877 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 134.9 | -177.3 | -8.9 | 25.1 | 0 | 0 | 0 | 110.7 | ||
| 254 | G | 34.1 | Very low | 40.4 | Very low | 78 Ų | 78 | 125.9 Ų | 125.9 | 80% | 0.804 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -62.6 | 147 | -167.6 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||
| 255 | A | 35 | Very low | 40.8 | Very low | 93 Ų | 93 | 127.5 Ų | 127.5 | 77% | 0.769 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -95.2 | 135.9 | 160.7 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||
| 256 | P | 41.4 | Very low | 41.6 | Very low | 128 Ų | 128 | 127.3 Ų | 127.3 | 83% | 0.831 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -75.8 | 134.9 | 170.2 | 29.3 | -29.6 | 0 | 0 | 0 | 110.4 | ||
| 257 | T | 45.3 | Very low | 42.1 | Very low | 148 Ų | 148 | 130.2 Ų | 130.2 | 91% | 0.908 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -69.8 | 137 | 168.3 | 44.1 | 0 | 0 | 0 | 0 | 110.2 | ||
| 258 | G | 38.1 | Very low | 42.2 | Very low | 74 Ų | 74 | 129.9 Ų | 129.9 | 76% | 0.763 | 80% | 0.799 | S | S | * | * | trans | 179.6 | 102.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 259 | N | 34.8 | Very low | 42.4 | Very low | 161 Ų | 161 | 130.1 Ų | 130.1 | 86% | 0.861 | 80% | 0.798 | S | S | * | * | trans | 55.7 | 112.9 | 156.2 | -85.6 | 13.5 | 0 | 0 | 0 | 121.2 | D261 | N259-D261 PolarHBondContact O-N 3.39Š| ||
| 260 | S | 48.4 | Very low | 42.6 | Very low | 120 Ų | 120 | 131.7 Ų | 131.7 | 84% | 0.839 | 80% | 0.796 | S | S | * | * | trans | -44.6 | 112.5 | 140.2 | -37.7 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 261 | D | 37.9 | Very low | 43 | Very low | 133 Ų | 133 | 133.8 Ų | 133.8 | 71% | 0.711 | 80% | 0.796 | S | S | * | * | trans | -153.9 | 121.1 | 146.4 | -150.6 | -91.3 | 0 | 0 | 0 | 110.3 | N259 V263 | N259-D261 PolarHBondContact O-N 3.39Å; D261-V263 VanDerWaalsContact C-N 3.34Å; D261-V263 PolarHBondContact O-N 2.74Å; D261-V263 WeakPolarHBondContact OD1-CG2 3.44Å | ||
| 262 | S | 52.2 | Low | 43.2 | Very low | 122 Ų | 122 | 133.4 Ų | 133.4 | 85% | 0.853 | 79% | 0.793 | S | S | * | * | trans | -68 | 87.4 | 173.2 | -64.7 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 263 | V | 48.4 | Very low | 43.9 | Very low | 94 Ų | 94 | 135 Ų | 135 | 57% | 0.57 | 80% | 0.795 | S | S | * | * | trans | -107.2 | 71.1 | 167.1 | -178.2 | 0 | 0 | 0 | 0 | 109.3 | D261 R265 | D261-V263 VanDerWaalsContact C-N 3.34Å; D261-V263 PolarHBondContact O-N 2.74Å; D261-V263 WeakPolarHBondContact OD1-CG2 3.44Å; V263-R265 HydrophobicContact CG1-CB 4.33Å; V263-R265 HydrophobicContact CG1-CG 3.73Å; V263-R265 PolarHBondContact O-N 3.45Å | ||
| 264 | W | 45.5 | Very low | 44.3 | Very low | 231 Ų | 231 | 135 Ų | 135 | 88% | 0.875 | 79% | 0.789 | S | S | * | * | trans | -70.5 | 108.7 | 148.1 | -99.5 | 95.6 | 0 | 0 | 0 | 107.1 | ||||
| 265 | R | 54.3 | Low | 45.1 | Very low | 193 Ų | 193 | 139.4 Ų | 139.4 | 73% | 0.728 | 79% | 0.788 | S | S | * | * | trans | -115.4 | 117.1 | 164.7 | -82.6 | 179.5 | -174.8 | -91.6 | 0.4 | 108.2 | V263 | V263-R265 HydrophobicContact CG1-CB 4.33Å; V263-R265 HydrophobicContact CG1-CG 3.73Å; V263-R265 PolarHBondContact O-N 3.45Å | ||
| 266 | P | 54.9 | Low | 46 | Very low | 125 Ų | 125 | 143.3 Ų | 143.3 | 81% | 0.812 | 79% | 0.789 | S | S | * | * | trans | -70.1 | 133.5 | 170 | 9.7 | 2.2 | 0 | 0 | 0 | 108.9 | ||||
| 267 | W | 50.5 | Low | 46.4 | Very low | 190 Ų | 190 | 144.6 Ų | 144.6 | 72% | 0.72 | 79% | 0.785 | S | S | * | * | trans | -114 | 0 | 159.5 | 37.3 | -104.2 | 0 | 0 | 0 | 108.5 | E43 R47 | E43-W267 WeakPolarHBondContact OE1-CH2 3.34Å; E43-W267 WeakPolarHBondContact OE1-CZ2 2.94Å; E43-W267 WeakPolarHBondContact OE1-CZ3 3.39Å; E43-W267 WeakPolarHBondContact OE2-CZ2 3.48Å; R47-W267 HydrophobicContact CG-CH2 3.96Å; R47-W267 HydrophobicContact CG-CZ3 4.16Å; R47-W267 VanDerWaalsContact NE-CZ3 3.27Å |
Retrieved 267 of 267 residues in 1018 ms
(Link to these results)