| 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 | 36 | Very low | 42.2 | Very low | 238 Ų | 238 | 131.5 Ų | 131.5 | 100% | 1.172 | 71% | 0.705 | S | S | * | * | 0 | 122.3 | 0 | -72.7 | 163.9 | 94 | 0 | 0 | 106.8 | |||||
| 2 | M | 33 | Very low | 42.4 | Very low | 170 Ų | 170 | 129.8 Ų | 129.8 | 84% | 0.837 | 71% | 0.711 | S | S | * | * | trans | -110.5 | 116.3 | -171 | -170.6 | 131 | 108.1 | 0 | 0 | 107.3 | I4 | M2-I4 HydrophobicContact CG-CD1 4.38Å; M2-I4 HydrophobicContact CG-CG1 4.29Å | ||
| 3 | L | 33.9 | Very low | 42.5 | Very low | 123 Ų | 123 | 133.7 Ų | 133.7 | 64% | 0.644 | 72% | 0.717 | S | S | * | * | trans | -129 | 106.1 | 172.6 | -84.7 | 158.6 | 0 | 0 | 0 | 106.6 | ||||
| 4 | I | 47.1 | Very low | 42.4 | Very low | 99 Ų | 99 | 135.9 Ų | 135.9 | 51% | 0.508 | 72% | 0.721 | S | S | . | * | trans | -106.4 | 128.6 | 172.7 | -57.5 | 178.6 | 0 | 0 | 0 | 104.6 | M2 Q6 M117 | M2-I4 HydrophobicContact CG-CD1 4.38Å; M2-I4 HydrophobicContact CG-CG1 4.29Å; I4-Q6 PolarHBondContact O-N 3.18Å; I4-Q6 VanDerWaalsContact O-N 3.1Å; I4-M117 HydrophobicContact CB-CE 4.5Å; I4-M117 HydrophobicContact CB-SD 4.35Å; I4-M117 HydrophobicContact CD1-CE 4.3Å; I4-M117 HydrophobicContact CG1-CE 4Å; I4-M117 HydrophobicContact CG1-SD 4.26Å; I4-M117 HydrophobicContact CG2-CE 3.98Å; I4-M117 HydrophobicContact CG2-SD 3.97Å | ||
| 5 | L | 46.4 | Very low | 42.9 | Very low | 77 Ų | 77 | 134.8 Ų | 134.8 | 40% | 0.403 | 72% | 0.721 | S | S | . | * | trans | -48.7 | 114.5 | 179.1 | -70.9 | 157.5 | 0 | 0 | 0 | 110.8 | L7 S121 | L5-L7 PolarHBondContact O-N 3.43Å; L5-L7 VanDerWaalsContact O-N 3.1Å; L5-S121 VanDerWaalsContact CD1-CB 3.44Å; L5-S121 WeakPolarHBondContact CD1-OG 3.39Å | ||
| 6 | Q | 49.7 | Very low | 42.7 | Very low | 168 Ų | 168 | 138.3 Ų | 138.3 | 79% | 0.785 | 73% | 0.727 | S | S | * | * | trans | -76.4 | 90.4 | 167.7 | -80.7 | -77.8 | 0 | 0 | 0 | 108.1 | I4 Q8 | I4-Q6 PolarHBondContact O-N 3.18Å; I4-Q6 VanDerWaalsContact O-N 3.1Å; Q6-Q8 PolarHBondContact O-N 2.93Å | ||
| 7 | L | 46.5 | Very low | 42.6 | Very low | 139 Ų | 139 | 133.7 Ų | 133.7 | 73% | 0.728 | 72% | 0.721 | S | S | * | * | trans | -67.5 | 88 | 159 | -81.5 | 153.9 | 0 | 0 | 0 | 107.5 | L5 S9 | L5-L7 PolarHBondContact O-N 3.43Å; L5-L7 VanDerWaalsContact O-N 3.1Å; L7-S9 VanDerWaalsContact C-N 3.32Å; L7-S9 PolarHBondContact O-N 2.96Å | ||
| 8 | Q | 47.2 | Very low | 42.4 | Very low | 154 Ų | 154 | 137.1 Ų | 137.1 | 72% | 0.72 | 73% | 0.731 | S | S | * | * | trans | -64.9 | 95.3 | 167 | -96.1 | -110.2 | 2.8 | 0 | 0 | 108.6 | Q6 V10 | Q6-Q8 PolarHBondContact O-N 2.93Å; Q8-V10 PolarHBondContact O-N 3.1Å | ||
| 9 | S | 41.4 | Very low | 42.5 | Very low | 98 Ų | 98 | 139.3 Ų | 139.3 | 69% | 0.685 | 74% | 0.737 | S | S | * | * | trans | 33.2 | 85.4 | 149.4 | -159.9 | 0 | 0 | 0 | 0 | 116.3 | L7 A11 | L7-S9 VanDerWaalsContact C-N 3.32Å; L7-S9 PolarHBondContact O-N 2.96Å; S9-A11 PolarHBondContact O-N 3.1Å | ||
| 10 | V | 42 | Very low | 42.3 | Very low | 100 Ų | 100 | 141.1 Ų | 141.1 | 61% | 0.606 | 74% | 0.741 | S | S | * | * | trans | -86.8 | 65.5 | 160.9 | -171.3 | 0 | 0 | 0 | 0 | 108.1 | Q8 S12 F13 | Q8-V10 PolarHBondContact O-N 3.1Å; V10-S12 VanDerWaalsContact C-N 3.31Å; V10-F13 HydrophobicContact CG1-CD2 3.82Å | ||
| 11 | A | 41.5 | Very low | 42.6 | Very low | 81 Ų | 81 | 142 Ų | 142 | 67% | 0.669 | 75% | 0.745 | S | S | * | * | trans | -88.4 | 11.3 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | S9 | S9-A11 PolarHBondContact O-N 3.1Š| ||
| 12 | S | 44.5 | Very low | 43.2 | Very low | 111 Ų | 111 | 136.5 Ų | 136.5 | 78% | 0.776 | 73% | 0.725 | S | S | * | * | trans | -128.5 | 10.1 | -168.2 | -65.2 | 0 | 0 | 0 | 0 | 117 | V10 H14 | V10-S12 VanDerWaalsContact C-N 3.31Å; S12-H14 VanDerWaalsContact C-N 3.32Å; S12-H14 PolarHBondContact O-N 2.77Å | ||
| 13 | F | 43.8 | Very low | 43.6 | Very low | 180 Ų | 180 | 131.8 Ų | 131.8 | 79% | 0.789 | 72% | 0.72 | S | S | * | * | trans | -80.4 | 85.7 | 167.8 | -91.8 | -84.2 | 0 | 0 | 0 | 110.6 | V10 V15 | V10-F13 HydrophobicContact CG1-CD2 3.82Å; F13-V15 VanDerWaalsContact C-N 3.31Å; F13-V15 PolarHBondContact O-N 2.59Å | ||
| 14 | H | 41.4 | Very low | 44.4 | Very low | 165 Ų | 165 | 130.5 Ų | 130.5 | 76% | 0.764 | 73% | 0.726 | S | S | * | * | trans | -65.1 | 89.5 | 164.5 | -176.8 | 90 | 0 | 0 | 0 | 109 | S12 K16 | S12-H14 VanDerWaalsContact C-N 3.32Å; S12-H14 PolarHBondContact O-N 2.77Å; H14-K16 PolarHBondContact O-N 3.07Å | ||
| 15 | V | 49 | Very low | 44.3 | Very low | 119 Ų | 119 | 130.4 Ų | 130.4 | 72% | 0.721 | 73% | 0.732 | S | S | * | * | trans | -82.7 | 105.3 | 168.8 | 174.1 | 0 | 0 | 0 | 0 | 108.1 | F13 G17 | F13-V15 VanDerWaalsContact C-N 3.31Å; F13-V15 PolarHBondContact O-N 2.59Å; V15-G17 PolarHBondContact O-N 3.1Å | ||
| 16 | K | 39.6 | Very low | 44.3 | Very low | 191 Ų | 191 | 138.7 Ų | 138.7 | 83% | 0.83 | 76% | 0.759 | S | S | * | * | trans | -82 | 100 | 164.1 | -173.8 | 155.6 | -179.2 | 171 | 0 | 107.6 | H14 | H14-K16 PolarHBondContact O-N 3.07Š| ||
| 17 | G | 40.8 | Very low | 44.2 | Very low | 60 Ų | 60 | 135.1 Ų | 135.1 | 62% | 0.619 | 75% | 0.752 | S | S | * | * | trans | 178.2 | 85.3 | -179.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | V15 Q19 | V15-G17 PolarHBondContact O-N 3.1Å; G17-Q19 PolarHBondContact O-N 2.95Å | ||
| 18 | E | 40.3 | Very low | 44.1 | Very low | 194 Ų | 194 | 136.9 Ų | 136.9 | 91% | 0.907 | 76% | 0.761 | S | S | * | * | trans | -57.9 | 117.1 | 170.3 | -68.9 | 158.6 | 89.2 | 0 | 0 | 110.8 | ||||
| 19 | Q | 44.2 | Very low | 43.7 | Very low | 180 Ų | 180 | 138.2 Ų | 138.2 | 84% | 0.841 | 77% | 0.772 | S | S | * | * | trans | -156.2 | 117.2 | 131.6 | -133.2 | 177.6 | 84 | 0 | 0 | 111.7 | G17 | G17-Q19 PolarHBondContact O-N 2.95Š| ||
| 20 | E | 38.7 | Very low | 43.7 | Very low | 174 Ų | 174 | 136.8 Ų | 136.8 | 81% | 0.813 | 77% | 0.773 | S | S | * | * | trans | -62.4 | 116.9 | 175.7 | -169.6 | -169.2 | 143.7 | 0 | 0 | 111.2 | ||||
| 21 | I | 47 | Very low | 43.5 | Very low | 161 Ų | 161 | 139.8 Ų | 139.8 | 83% | 0.826 | 79% | 0.786 | S | S | * | * | trans | -138.2 | 125.3 | 153 | -50.6 | 179.7 | 0 | 0 | 0 | 109.5 | ||||
| 22 | V | 49.3 | Very low | 43.7 | Very low | 123 Ų | 123 | 141.5 Ų | 141.5 | 75% | 0.745 | 79% | 0.793 | S | S | * | * | trans | -69.2 | 132.4 | -170.1 | 167 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 23 | G | 40.8 | Very low | 43.4 | Very low | 71 Ų | 71 | 139.7 Ų | 139.7 | 73% | 0.732 | 79% | 0.792 | S | S | * | * | trans | 66.2 | 103.9 | 132.1 | 0 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 24 | A | 51.5 | Low | 43.2 | Very low | 95 Ų | 95 | 139.6 Ų | 139.6 | 79% | 0.785 | 80% | 0.799 | S | S | * | * | 172.7 | 136.3 | 101 | 0 | 0 | 0 | 0 | 0 | 111 | |||||
| 25 | P | 44.6 | Very low | 43.2 | Very low | 98 Ų | 98 | 135.6 Ų | 135.6 | 64% | 0.636 | 79% | 0.794 | S | S | * | * | trans | -79 | 150 | 178.4 | 33.6 | -33.1 | 0 | 0 | 0 | 111.2 | S27 | P25-S27 PolarHBondContact O-N 2.71Š| ||
| 26 | W | 45.7 | Very low | 42.9 | Very low | 251 Ų | 251 | 135.9 Ų | 135.9 | 95% | 0.951 | 80% | 0.796 | S | S | * | * | S | Bend | trans | -66.9 | 44.3 | -173.4 | 29.2 | -81.1 | 0 | 0 | 0 | 114.4 | ||
| 27 | S | 47.5 | Very low | 43.3 | Very low | 92 Ų | 92 | 133.8 Ų | 133.8 | 64% | 0.643 | 79% | 0.794 | S | S | * | * | trans | -97.7 | 19.3 | -172.1 | -54.2 | 0 | 0 | 0 | 0 | 115.5 | P25 | P25-S27 PolarHBondContact O-N 2.71Š| ||
| 28 | L | 46 | Very low | 43.5 | Very low | 176 Ų | 176 | 141.6 Ų | 141.6 | 92% | 0.921 | 81% | 0.807 | S | S | * | * | trans | -113.4 | 58.7 | 174.3 | -69.4 | -179.8 | 0 | 0 | 0 | 112 | G30 | L28-G30 PolarHBondContact O-N 3.14Š| ||
| 29 | L | 37.2 | Very low | 43.8 | Very low | 182 Ų | 182 | 136.4 Ų | 136.4 | 95% | 0.953 | 80% | 0.797 | S | S | * | * | trans | -90.1 | 86.4 | 156 | -163.6 | 74.4 | 0 | 0 | 0 | 107.2 | ||||
| 30 | G | 42 | Very low | 43.8 | Very low | 69 Ų | 69 | 134.7 Ų | 134.7 | 71% | 0.711 | 79% | 0.794 | S | S | * | * | trans | -131.2 | 99.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 108.8 | L28 | L28-G30 PolarHBondContact O-N 3.14Š| ||
| 31 | D | 39.1 | Very low | 44.7 | Very low | 162 Ų | 162 | 135.7 Ų | 135.7 | 87% | 0.866 | 80% | 0.795 | S | S | * | * | trans | -21.1 | 124.5 | 162.8 | -123.4 | -87.3 | 0 | 0 | 0 | 114.3 | ||||
| 32 | S | 45.8 | Very low | 44.3 | Very low | 118 Ų | 118 | 130.5 Ų | 130.5 | 83% | 0.825 | 78% | 0.782 | S | S | * | * | trans | 172.1 | 112 | 138.9 | -77.7 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 33 | G | 37.4 | Very low | 44.3 | Very low | 73 Ų | 73 | 130.8 Ų | 130.8 | 75% | 0.753 | 79% | 0.788 | S | S | * | * | 69.4 | 108.1 | 127.1 | 0 | 0 | 0 | 0 | 0 | 119.6 | |||||
| 34 | L | 39.1 | Very low | 44.6 | Very low | 177 Ų | 177 | 132.7 Ų | 132.7 | 93% | 0.927 | 79% | 0.79 | S | S | * | * | 74.7 | 94.2 | 121.2 | -153.3 | 143.1 | 0 | 0 | 0 | 117.2 | |||||
| 35 | A | 42 | Very low | 44.4 | Very low | 82 Ų | 82 | 132.5 Ų | 132.5 | 68% | 0.678 | 79% | 0.788 | S | S | * | * | 176 | 106.4 | 124.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | N37 | A35-N37 PolarHBondContact O-N 3.44Š| |||
| 36 | T | 41.5 | Very low | 44.5 | Very low | 124 Ų | 124 | 135.7 Ų | 135.7 | 76% | 0.761 | 79% | 0.792 | S | S | * | * | trans | -59.7 | 111.3 | 160.7 | 43.9 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 37 | N | 48.1 | Very low | 44.3 | Very low | 147 Ų | 147 | 130.1 Ų | 130.1 | 79% | 0.786 | 79% | 0.786 | S | S | * | * | trans | -144.8 | 85.5 | 154 | -81.5 | -61.5 | 0 | 0 | 0 | 107.8 | A35 A39 | A35-N37 PolarHBondContact O-N 3.44Å; N37-A39 PolarHBondContact O-N 3.4Å | ||
| 38 | Y | 46.8 | Very low | 44.5 | Very low | 224 Ų | 224 | 134.1 Ų | 134.1 | 88% | 0.878 | 79% | 0.791 | S | S | * | * | trans | -66.8 | 90.6 | 158.7 | -73.4 | -90.7 | 0 | 0 | 0 | 106.9 | D40 | Y38-D40 PolarHBondContact O-N 2.84Š| ||
| 39 | A | 45.8 | Very low | 44.4 | Very low | 85 Ų | 85 | 133.7 Ų | 133.7 | 70% | 0.702 | 79% | 0.785 | S | S | * | * | trans | -74 | 87 | 165.5 | 0 | 0 | 0 | 0 | 0 | 107.7 | N37 K41 | N37-A39 PolarHBondContact O-N 3.4Å; A39-K41 PolarHBondContact O-N 3.43Å | ||
| 40 | D | 44.6 | Very low | 44.2 | Very low | 145 Ų | 145 | 133.2 Ų | 133.2 | 78% | 0.775 | 78% | 0.782 | S | S | * | * | trans | -56.3 | 102.6 | 163.9 | -176.9 | 73.5 | 0 | 0 | 0 | 108.6 | Y38 | Y38-D40 PolarHBondContact O-N 2.84Š| ||
| 41 | K | 56.3 | Low | 44.6 | Very low | 195 Ų | 195 | 134.5 Ų | 134.5 | 85% | 0.848 | 78% | 0.781 | S | S | * | * | trans | -100.7 | 80.1 | 163.2 | -73.6 | -74.2 | -175.5 | 178.6 | 0 | 105.9 | A39 C43 | A39-K41 PolarHBondContact O-N 3.43Å; K41-C43 PolarHBondContact O-N 2.92Å | ||
| 42 | G | 40.2 | Very low | 44.3 | Very low | 52 Ų | 52 | 136.8 Ų | 136.8 | 54% | 0.536 | 79% | 0.786 | S | S | . | * | trans | -48.6 | 129.7 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | S44 | G42-S44 PolarHBondContact O-N 3.09Š| ||
| 43 | C | 48.8 | Very low | 43.9 | Very low | 129 Ų | 129 | 134.9 Ų | 134.9 | 87% | 0.872 | 79% | 0.785 | S | S | * | * | trans | -69.5 | 107.6 | 166.4 | -167.5 | 0 | 0 | 0 | 0 | 108 | K41 A45 | K41-C43 PolarHBondContact O-N 2.92Å; C43-A45 PolarHBondContact O-N 2.99Å | ||
| 44 | S | 46.1 | Very low | 44.2 | Very low | 111 Ų | 111 | 139.2 Ų | 139.2 | 78% | 0.776 | 79% | 0.79 | S | S | * | * | trans | -71.7 | 93.2 | -179 | 174.1 | 0 | 0 | 0 | 0 | 110.9 | G42 K46 | G42-S44 PolarHBondContact O-N 3.09Å; S44-K46 PolarHBondContact O-N 2.97Å | ||
| 45 | A | 48.9 | Very low | 44.5 | Very low | 91 Ų | 91 | 137.5 Ų | 137.5 | 75% | 0.752 | 78% | 0.782 | S | S | * | * | trans | -69 | 97.3 | 168.2 | 0 | 0 | 0 | 0 | 0 | 110.1 | C43 T47 | C43-A45 PolarHBondContact O-N 2.99Å; A45-T47 PolarHBondContact O-N 2.92Å; A45-T47 VanDerWaalsContact O-N 3.13Å | ||
| 46 | K | 44.9 | Very low | 44.7 | Very low | 165 Ų | 165 | 140.6 Ų | 140.6 | 72% | 0.717 | 79% | 0.787 | S | S | * | * | trans | -76.8 | 95.5 | 173.6 | -168.2 | 169.6 | -171 | 166 | 0 | 109.3 | S44 K48 | S44-K46 PolarHBondContact O-N 2.97Å; K46-K48 HydrophobicContact CG-CG 4.45Å; K46-K48 PolarHBondContact O-N 3Å; K46-K48 VanDerWaalsContact O-N 3.09Å | ||
| 47 | T | 43 | Very low | 44.7 | Very low | 134 Ų | 134 | 140.1 Ų | 140.1 | 82% | 0.822 | 79% | 0.789 | S | S | * | * | trans | -65.9 | 101.2 | 166.8 | 43.3 | 0 | 0 | 0 | 0 | 109.3 | A45 Q49 | A45-T47 PolarHBondContact O-N 2.92Å; A45-T47 VanDerWaalsContact O-N 3.13Å; T47-Q49 PolarHBondContact O-N 3.08Å | ||
| 48 | K | 50.6 | Low | 44.1 | Very low | 175 Ų | 175 | 138 Ų | 138 | 76% | 0.761 | 79% | 0.792 | S | S | * | * | trans | -88.1 | 96.7 | 167.5 | -85.7 | 174.1 | 172.1 | -84.7 | 0 | 108.4 | K46 | K46-K48 HydrophobicContact CG-CG 4.45Å; K46-K48 PolarHBondContact O-N 3Å; K46-K48 VanDerWaalsContact O-N 3.09Å | ||
| 49 | Q | 44.4 | Very low | 44.2 | Very low | 167 Ų | 167 | 131.9 Ų | 131.9 | 78% | 0.78 | 79% | 0.787 | S | S | * | * | trans | -49.9 | 129 | 166.9 | -169.9 | -162 | -37.2 | 0 | 0 | 111 | T47 S51 | T47-Q49 PolarHBondContact O-N 3.08Å; Q49-S51 PolarHBondContact O-N 3.42Å | ||
| 50 | L | 33.3 | Very low | 44.2 | Very low | 172 Ų | 172 | 134.7 Ų | 134.7 | 90% | 0.901 | 79% | 0.791 | S | S | * | * | trans | -56.7 | 123.1 | 166.7 | -86.8 | 140.5 | 0 | 0 | 0 | 110.5 | ||||
| 51 | S | 49.4 | Very low | 44.4 | Very low | 97 Ų | 97 | 138.4 Ų | 138.4 | 68% | 0.678 | 79% | 0.794 | S | S | * | * | trans | -153 | 113.5 | 158.7 | -61.6 | 0 | 0 | 0 | 0 | 108.9 | Q49 | Q49-S51 PolarHBondContact O-N 3.42Š| ||
| 52 | Q | 32.9 | Very low | 43.8 | Very low | 209 Ų | 209 | 133.6 Ų | 133.6 | 98% | 0.977 | 79% | 0.79 | S | S | * | * | trans | -49.1 | 137.8 | 170.4 | -73.4 | 151.5 | -90 | 0 | 0 | 111.8 | ||||
| 53 | G | 37.4 | Very low | 44.1 | Very low | 78 Ų | 78 | 140 Ų | 140 | 80% | 0.804 | 81% | 0.806 | S | S | * | * | trans | -172.3 | 105 | 171.2 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 54 | L | 44.2 | Very low | 43.8 | Very low | 164 Ų | 164 | 138.7 Ų | 138.7 | 86% | 0.859 | 80% | 0.796 | S | S | * | * | trans | -52.3 | 156.9 | 179 | -79.2 | 139.4 | 0 | 0 | 0 | 114.4 | ||||
| 55 | N | 45.8 | Very low | 44 | Very low | 141 Ų | 141 | 141.8 Ų | 141.8 | 75% | 0.754 | 80% | 0.801 | S | S | * | * | trans | 106.9 | 107.7 | 140.5 | 76.3 | 13.1 | 0 | 0 | 0 | 121.9 | ||||
| 56 | D | 44.9 | Very low | 44 | Very low | 147 Ų | 147 | 143.3 Ų | 143.3 | 79% | 0.786 | 80% | 0.801 | S | S | * | * | trans | 57.1 | 107.2 | 132.1 | -51.1 | -31.1 | 0 | 0 | 0 | 123 | ||||
| 57 | S | 42.6 | Very low | 44.3 | Very low | 115 Ų | 115 | 143.9 Ų | 143.9 | 80% | 0.804 | 81% | 0.806 | S | S | * | * | 74 | 132.9 | 125.2 | -62.5 | 0 | 0 | 0 | 0 | 121.3 | |||||
| 58 | A | 36.2 | Very low | 44.3 | Very low | 102 Ų | 102 | 144 Ų | 144 | 84% | 0.843 | 80% | 0.801 | S | S | * | * | trans | 82.5 | 88.2 | 157.3 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 59 | A | 48.5 | Very low | 44.2 | Very low | 95 Ų | 95 | 146.7 Ų | 146.7 | 79% | 0.785 | 81% | 0.807 | S | S | * | * | trans | -172.7 | 118.9 | 134.2 | 0 | 0 | 0 | 0 | 0 | 110.8 | R61 | A59-R61 PolarHBondContact O-N 3.23Š| ||
| 60 | D | 44.3 | Very low | 44.8 | Very low | 144 Ų | 144 | 142.3 Ų | 142.3 | 77% | 0.77 | 80% | 0.795 | S | S | * | * | trans | -1.7 | 115.6 | 136.4 | 179.6 | 49.3 | 0 | 0 | 0 | 115.5 | ||||
| 61 | R | 48.9 | Very low | 45.7 | Very low | 224 Ų | 224 | 139.7 Ų | 139.7 | 85% | 0.845 | 79% | 0.789 | S | S | * | * | trans | 175.6 | 130.9 | 134.4 | -99.8 | 169.4 | 147.6 | 113.5 | -0.2 | 113.5 | A59 | A59-R61 PolarHBondContact O-N 3.23Š| ||
| 62 | A | 43.5 | Very low | 46.3 | Very low | 94 Ų | 94 | 140.8 Ų | 140.8 | 78% | 0.777 | 79% | 0.792 | S | S | * | * | trans | -9.8 | 119.5 | 163.3 | 0 | 0 | 0 | 0 | 0 | 116.7 | P64 | A62-P64 VanDerWaalsContact O-CD 3.29Å; A62-P64 WeakPolarHBondContact O-CD 3.29Å | ||
| 63 | Q | 47.4 | Very low | 47.9 | Very low | 185 Ų | 185 | 136.1 Ų | 136.1 | 86% | 0.864 | 77% | 0.773 | S | S | * | * | trans | -65.2 | 119.8 | 163.4 | -62.1 | -166 | -79.2 | 0 | 0 | 109 | M65 | Q63-M65 PolarHBondContact O-N 3.46Š| ||
| 64 | P | 43.5 | Very low | 49 | Very low | 103 Ų | 103 | 137.5 Ų | 137.5 | 67% | 0.669 | 77% | 0.767 | S | S | * | * | trans | -76.9 | 110.3 | 163.1 | 30.3 | -25.2 | 0 | 0 | 0 | 106.5 | A62 T66 | A62-P64 VanDerWaalsContact O-CD 3.29Å; A62-P64 WeakPolarHBondContact O-CD 3.29Å; P64-T66 HydrophobicContact CB-CG2 4.31Å; P64-T66 PolarHBondContact O-N 2.83Å | ||
| 65 | M | 49.4 | Very low | 50 | Low | 175 Ų | 175 | 134 Ų | 134 | 86% | 0.862 | 75% | 0.749 | S | S | * | * | trans | -59.5 | 83.7 | 158.1 | 46.7 | -109.4 | -86.9 | 0 | 0 | 108.4 | Q63 Q67 | Q63-M65 PolarHBondContact O-N 3.46Å; M65-Q67 PolarHBondContact O-N 3.37Å | ||
| 66 | T | 49.2 | Very low | 50.9 | Low | 123 Ų | 123 | 128.9 Ų | 128.9 | 76% | 0.755 | 73% | 0.73 | S | S | * | * | trans | -74.2 | 73.9 | 166.4 | 52.3 | 0 | 0 | 0 | 0 | 107 | P64 D68 | P64-T66 HydrophobicContact CB-CG2 4.31Å; P64-T66 PolarHBondContact O-N 2.83Å; T66-D68 PolarHBondContact O-N 3.39Å | ||
| 67 | Q | 50.8 | Low | 52 | Low | 178 Ų | 178 | 123.8 Ų | 123.8 | 83% | 0.832 | 70% | 0.7 | S | S | * | * | trans | -63.2 | 100 | 156.2 | -175.5 | 174.9 | -2.2 | 0 | 0 | 104.6 | M65 R69 | M65-Q67 PolarHBondContact O-N 3.37Å; Q67-R69 VanDerWaalsContact C-N 3.26Å; Q67-R69 PolarHBondContact O-N 3.49Å | ||
| 68 | D | 43.4 | Very low | 52.9 | Low | 135 Ų | 135 | 121.7 Ų | 121.7 | 72% | 0.722 | 68% | 0.679 | S | S | * | * | trans | -50.7 | 98.8 | 170.5 | -175.7 | 47.6 | 0 | 0 | 0 | 106.6 | T66 S70 | T66-D68 PolarHBondContact O-N 3.39Å; D68-S70 PolarHBondContact O-N 3.4Å | ||
| 69 | R | 48.6 | Very low | 54.2 | Low | 233 Ų | 233 | 121.9 Ų | 121.9 | 88% | 0.879 | 67% | 0.674 | S | S | * | * | trans | -71 | 78.6 | 168.9 | -173.4 | 176.1 | -172.9 | 150.3 | 0.9 | 103.6 | Q67 C71 | Q67-R69 VanDerWaalsContact C-N 3.26Å; Q67-R69 PolarHBondContact O-N 3.49Å; R69-C71 PolarHBondContact O-N 2.99Å | ||
| 70 | S | 57.1 | Low | 54.7 | Low | 75 Ų | 75 | 124.5 Ų | 124.5 | 52% | 0.524 | 67% | 0.67 | S | S | . | * | trans | -39.8 | 113.8 | 166.3 | 175.1 | 0 | 0 | 0 | 0 | 105 | D68 V72 | D68-S70 PolarHBondContact O-N 3.4Å; S70-V72 WeakPolarHBondContact O-CG2 3.47Å; S70-V72 PolarHBondContact O-N 3.29Å | ||
| 71 | C | 52.1 | Low | 55 | Low | 116 Ų | 116 | 127.2 Ų | 127.2 | 78% | 0.784 | 67% | 0.67 | S | S | * | * | trans | -66.6 | 86.7 | 173.8 | -160.8 | 0 | 0 | 0 | 0 | 104 | R69 L73 | R69-C71 PolarHBondContact O-N 2.99Å; C71-L73 PolarHBondContact O-N 2.99Å | ||
| 72 | V | 60.7 | Low | 55.2 | Low | 120 Ų | 120 | 120.2 Ų | 120.2 | 73% | 0.727 | 66% | 0.66 | S | S | * | * | trans | -65.7 | 95.9 | -179.4 | 179.9 | 0 | 0 | 0 | 0 | 104.7 | S70 | S70-V72 WeakPolarHBondContact O-CG2 3.47Å; S70-V72 PolarHBondContact O-N 3.29Å | ||
| 73 | L | 66.3 | Low | 55.7 | Low | 112 Ų | 112 | 122.1 Ų | 122.1 | 59% | 0.586 | 66% | 0.662 | S | S | * | * | trans | -56.1 | 134.5 | 166.7 | -84 | 107.6 | 0 | 0 | 0 | 106.6 | C71 D75 G76 | C71-L73 PolarHBondContact O-N 2.99Å; L73-D75 PolarHBondContact O-N 3.46Å; L73-G76 PolarHBondContact O-N 3.27Å | ||
| 74 | P | 62.3 | Low | 55.8 | Low | 106 Ų | 106 | 116.9 Ų | 116.9 | 69% | 0.688 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.8 | -19.5 | 174.8 | 23.3 | -32.6 | 0 | 0 | 0 | 112 | W77 | P74-W77 PolarHBondContact O-NE1 3.49Å; P74-W77 VanDerWaalsContact O-NE1 3.17Å |
| 75 | D | 65 | Low | 55.8 | Low | 90 Ų | 90 | 116.5 Ų | 116.5 | 48% | 0.481 | 64% | 0.644 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -104.8 | 6.9 | 179.3 | -53 | -49.8 | 0 | 0 | 0 | 114.4 | L73 W77 I78 | L73-D75 PolarHBondContact O-N 3.46Å; D75-W77 PolarHBondContact O-N 2.85Å; D75-W77 VanDerWaalsContact O-N 3.15Å; D75-I78 HydrophobicContact CB-CD1 4.13Å; D75-I78 WeakPolarHBondContact O-CB 3.46Å; D75-I78 PolarHBondContact O-N 2.95Å |
| 76 | G | 65.1 | Low | 55.7 | Low | 34 Ų | 34 | 113.7 Ų | 113.7 | 35% | 0.351 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -58 | -32 | -178 | 0 | 0 | 0 | 0 | 0 | 113.1 | L73 I78 S79 | L73-G76 PolarHBondContact O-N 3.27Å; G76-I78 PolarHBondContact O-N 3.39Å; G76-S79 PolarHBondContact O-N 2.84Å |
| 77 | W | 66.7 | Low | 55.4 | Low | 40 Ų | 40 | 113.2 Ų | 113.2 | 15% | 0.152 | 64% | 0.635 | C | S | . | * | H | α-helix | trans | -66.7 | -19 | 176.5 | 70.8 | -76.7 | 0 | 0 | 0 | 114.2 | P74 D75 F122 N133 R136 L137 | P74-W77 PolarHBondContact O-NE1 3.49Å; P74-W77 VanDerWaalsContact O-NE1 3.17Å; D75-W77 PolarHBondContact O-N 2.85Å; D75-W77 VanDerWaalsContact O-N 3.15Å; W77-F122 HydrophobicContact CH2-CE1 4.25Å; W77-F122 HydrophobicContact CH2-CZ 4.35Å; W77-N133 HydrophobicContact CB-CB 3.91Å; W77-N133 VanDerWaalsContact CB-CG 3.47Å; W77-R136 HydrophobicContact CE3-CB 3.85Å; W77-R136 HydrophobicContact CH2-CB 3.95Å; W77-R136 HydrophobicContact CZ3-CB 3.33Å; W77-R136 HydrophobicContact CZ3-CG 4.4Å; W77-L137 HydrophobicContact CE3-CD2 4.33Å; W77-L137 HydrophobicContact CE3-CG 4.19Å; W77-L137 HydrophobicContact CZ3-CD2 4.44Å; W77-L137 HydrophobicContact CZ3-CG 4.44Å |
| 78 | I | 62.6 | Low | 55.3 | Low | 72 Ų | 72 | 110.6 Ų | 110.6 | 37% | 0.369 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -86.2 | -25.7 | 178.5 | -52 | 175.5 | 0 | 0 | 0 | 110.6 | D75 G76 R81 | D75-I78 HydrophobicContact CB-CD1 4.13Å; D75-I78 WeakPolarHBondContact O-CB 3.46Å; D75-I78 PolarHBondContact O-N 2.95Å; G76-I78 PolarHBondContact O-N 3.39Å; I78-R81 VanDerWaalsContact O-CG 3.23Å; I78-R81 WeakPolarHBondContact O-CG 3.12Å |
| 79 | S | 62 | Low | 55.6 | Low | 105 Ų | 105 | 111.1 Ų | 111.1 | 73% | 0.734 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -77.9 | -25.8 | -179.4 | -62.8 | 0 | 0 | 0 | 0 | 112.9 | G76 R81 | G76-S79 PolarHBondContact O-N 2.84Å; S79-R81 PolarHBondContact O-N 3.29Å |
| 80 | E | 59.4 | Low | 55.8 | Low | 150 Ų | 150 | 103.7 Ų | 103.7 | 70% | 0.701 | 60% | 0.604 | S | S | * | * | trans | -78.5 | 58.5 | 175.5 | -161.7 | 175.3 | -179.4 | 0 | 0 | 110.9 | A82 | E80-A82 PolarHBondContact O-N 3.32Š| ||
| 81 | R | 51.4 | Low | 55.7 | Low | 201 Ų | 201 | 104.2 Ų | 104.2 | 76% | 0.758 | 60% | 0.604 | S | S | * | * | trans | -76 | 78.4 | 172.6 | -63.6 | -163.6 | -93.6 | -162.9 | -6 | 109.5 | I78 S79 V83 | I78-R81 VanDerWaalsContact O-CG 3.23Å; I78-R81 WeakPolarHBondContact O-CG 3.12Å; S79-R81 PolarHBondContact O-N 3.29Å; R81-V83 PolarHBondContact O-N 3.39Å; R81-V83 VanDerWaalsContact O-N 3.16Å | ||
| 82 | A | 52.8 | Low | 56 | Low | 78 Ų | 78 | 100.2 Ų | 100.2 | 65% | 0.645 | 58% | 0.577 | S | S | * | * | trans | -70.5 | 102.5 | 158.8 | 0 | 0 | 0 | 0 | 0 | 107.1 | E80 P84 | E80-A82 PolarHBondContact O-N 3.32Å; A82-P84 WeakPolarHBondContact O-CD 3.23Å; A82-P84 WeakPolarHBondContact O-CG 3.34Å | ||
| 83 | V | 53.5 | Low | 56.1 | Low | 134 Ų | 134 | 95.9 Ų | 95.9 | 81% | 0.812 | 55% | 0.552 | S | S | * | * | trans | -55.2 | 107.9 | 175.8 | 175 | 0 | 0 | 0 | 0 | 109 | R81 | R81-V83 PolarHBondContact O-N 3.39Å; R81-V83 VanDerWaalsContact O-N 3.16Å | ||
| 84 | P | 50.2 | Low | 56 | Low | 74 Ų | 74 | 95.5 Ų | 95.5 | 48% | 0.481 | 56% | 0.558 | S | S | . | * | trans | -81.8 | 131.2 | 174.7 | -2.5 | 22.6 | 0 | 0 | 0 | 108.2 | A82 H141 | A82-P84 WeakPolarHBondContact O-CD 3.23Å; A82-P84 WeakPolarHBondContact O-CG 3.34Å; P84-H141 WeakPolarHBondContact CD-CE1 3.41Å | ||
| 85 | S | 43.8 | Very low | 56.4 | Low | 96 Ų | 96 | 93.2 Ų | 93.2 | 67% | 0.671 | 54% | 0.536 | S | S | * | . | trans | -54.7 | 133.6 | 178.7 | -160.1 | 0 | 0 | 0 | 0 | 111.4 | T87 | S85-T87 PolarHBondContact O-N 3.47Å; S85-T87 PolarHBondContact O-OG1 3.5Å; S85-T87 VanDerWaalsContact O-OG1 3.08Å | ||
| 86 | P | 46.1 | Very low | 56.4 | Low | 115 Ų | 115 | 89.1 Ų | 89.1 | 75% | 0.747 | 51% | 0.514 | S | S | * | . | trans | -68.5 | 95.7 | -173.9 | 26.4 | -32.1 | 0 | 0 | 0 | 110.3 | ||||
| 87 | T | 44 | Very low | 56.5 | Low | 113 Ų | 113 | 95 Ų | 95 | 69% | 0.693 | 53% | 0.525 | S | S | * | . | trans | -111.8 | 90.8 | 179.3 | -36.4 | 0 | 0 | 0 | 0 | 108.7 | S85 | S85-T87 PolarHBondContact O-N 3.47Å; S85-T87 PolarHBondContact O-OG1 3.5Å; S85-T87 VanDerWaalsContact O-OG1 3.08Å | ||
| 88 | L | 48 | Very low | 56.3 | Low | 123 Ų | 123 | 100.7 Ų | 100.7 | 64% | 0.644 | 55% | 0.554 | S | S | * | * | S | Bend | trans | 44.2 | 110.4 | 145.9 | -74.8 | 153 | 0 | 0 | 0 | 118.3 | ||
| 89 | F | 50.5 | Low | 56.3 | Low | 147 Ų | 147 | 101.7 Ų | 101.7 | 65% | 0.645 | 56% | 0.559 | S | S | * | * | trans | 78.6 | 135.5 | 160.9 | -54.6 | -73.9 | 0 | 0 | 0 | 118.1 | T91 | F89-T91 PolarHBondContact O-N 2.86Š| ||
| 90 | P | 53.2 | Low | 56.4 | Low | 76 Ų | 76 | 97.2 Ų | 97.2 | 49% | 0.494 | 53% | 0.528 | S | S | . | . | trans | -79.1 | 68.6 | 177.8 | 35 | -34.5 | 0 | 0 | 0 | 110.4 | ||||
| 91 | T | 54.7 | Low | 56.4 | Low | 86 Ų | 86 | 95.1 Ų | 95.1 | 53% | 0.528 | 53% | 0.528 | S | S | . | . | trans | -89.8 | 116.5 | 166.5 | -53.9 | 0 | 0 | 0 | 0 | 106.3 | F89 Q142 | F89-T91 PolarHBondContact O-N 2.86Å; T91-Q142 PolarHBondContact O-OE1 3.09Å | ||
| 92 | P | 58.7 | Low | 56.6 | Low | 32 Ų | 32 | 89.2 Ų | 89.2 | 21% | 0.208 | 52% | 0.522 | C | S | . | . | trans | -51.5 | 132.1 | 171.9 | 22.7 | -32.1 | 0 | 0 | 0 | 107.2 | S94 I105 | P92-S94 PolarHBondContact O-N 2.89Å; P92-I105 HydrophobicContact CB-CD1 4.02Å | ||
| 93 | P | 61.7 | Low | 56.9 | Low | 30 Ų | 30 | 88 Ų | 88 | 20% | 0.195 | 51% | 0.506 | C | S | . | . | trans | -44.2 | 135.8 | -180 | -29.3 | 28.6 | 0 | 0 | 0 | 110.7 | W95 L96 R97 | P93-W95 HydrophobicContact CB-CD2 4.45Å; P93-W95 HydrophobicContact CB-CG 4.05Å; P93-W95 PolarHBondContact O-N 3.38Å; P93-L96 HydrophobicContact CB-CD1 4.47Å; P93-L96 HydrophobicContact CG-CD1 4Å; P93-L96 WeakPolarHBondContact O-CA 3.46Å; P93-L96 WeakPolarHBondContact O-CB 3.26Å; P93-L96 PolarHBondContact O-N 3.4Å; P93-R97 PolarHBondContact O-N 2.79Å | ||
| 94 | S | 65 | Low | 57.2 | Low | 104 Ų | 104 | 87.7 Ų | 87.7 | 73% | 0.727 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -52.1 | -33.6 | -176.1 | 50.8 | 0 | 0 | 0 | 0 | 112.5 | P92 R97 E98 | P92-S94 PolarHBondContact O-N 2.89Å; S94-R97 PolarHBondContact O-N 3.01Å; S94-E98 PolarHBondContact O-N 3.03Å |
| 95 | W | 69.1 | Low | 57.7 | Low | 58 Ų | 58 | 85.3 Ų | 85.3 | 22% | 0.22 | 48% | 0.483 | C | S | . | . | H | α-helix | trans | -61.8 | -40.8 | 173.9 | 72.1 | -92.9 | 0 | 0 | 0 | 112.6 | P93 R97 E98 I99 V129 Q135 I139 | P93-W95 HydrophobicContact CB-CD2 4.45Å; P93-W95 HydrophobicContact CB-CG 4.05Å; P93-W95 PolarHBondContact O-N 3.38Å; W95-R97 VanDerWaalsContact C-N 3.31Å; W95-R97 PolarHBondContact O-N 3.26Å; W95-E98 WeakPolarHBondContact O-CA 3.49Å; W95-E98 VanDerWaalsContact O-CB 3.26Å; W95-E98 WeakPolarHBondContact O-CB 3.29Å; W95-E98 PolarHBondContact O-N 3.31Å; W95-I99 HydrophobicContact CE3-CD1 3.27Å; W95-I99 HydrophobicContact CE3-CG1 3.98Å; W95-I99 HydrophobicContact CH2-CD1 4.47Å; W95-I99 HydrophobicContact CZ3-CD1 3.23Å; W95-I99 HydrophobicContact CZ3-CG1 4.32Å; W95-I99 WeakPolarHBondContact O-CG1 3.33Å; W95-I99 PolarHBondContact O-N 3.36Å; W95-V129 HydrophobicContact CZ3-CG1 4.32Å; W95-Q135 HydrophobicContact CD2-CG 4.47Å; W95-Q135 HydrophobicContact CE3-CG 4.25Å; W95-Q135 HydrophobicContact CH2-CB 3.42Å; W95-Q135 VanDerWaalsContact CH2-CB 3.42Å; W95-Q135 HydrophobicContact CH2-CG 3.5Å; W95-Q135 HydrophobicContact CZ2-CB 3.75Å; W95-Q135 HydrophobicContact CZ2-CG 3.69Å; W95-Q135 HydrophobicContact CZ3-CB 4.05Å; W95-Q135 HydrophobicContact CZ3-CG 3.73Å; W95-I139 HydrophobicContact CH2-CD1 3.92Å; W95-I139 HydrophobicContact CH2-CG1 4.09Å; W95-I139 HydrophobicContact CZ2-CD1 4.48Å; W95-I139 HydrophobicContact CZ2-CG1 4.17Å |
| 96 | L | 65.7 | Low | 58.6 | Low | 3 Ų | 3 | 84.7 Ų | 84.7 | 2% | 0.016 | 47% | 0.47 | C | S | . | . | H | α-helix | trans | -61.6 | -39.3 | 177.7 | -88 | 170.6 | 0 | 0 | 0 | 112.4 | P93 E98 A100 I105 V129 I139 | P93-L96 HydrophobicContact CB-CD1 4.47Å; P93-L96 HydrophobicContact CG-CD1 4Å; P93-L96 WeakPolarHBondContact O-CA 3.46Å; P93-L96 WeakPolarHBondContact O-CB 3.26Å; P93-L96 PolarHBondContact O-N 3.4Å; L96-E98 PolarHBondContact O-N 2.91Å; L96-A100 CarbonylContact O-C 3.58Å; L96-A100 WeakPolarHBondContact O-CA 3.14Å; L96-A100 WeakPolarHBondContact O-CB 3.45Å; L96-A100 PolarHBondContact O-N 3.35Å; L96-I105 HydrophobicContact CD1-CD1 3.3Å; L96-I105 HydrophobicContact CG-CD1 4.4Å; L96-V129 HydrophobicContact CD2-CG1 3.41Å; L96-V129 VanDerWaalsContact CD2-CG1 3.41Å; L96-I139 HydrophobicContact CD1-CD1 4.5Å; L96-I139 HydrophobicContact CD1-CG1 3.67Å; L96-I139 HydrophobicContact CD2-CD1 4.09Å; L96-I139 HydrophobicContact CD2-CG1 4.15Å; L96-I139 HydrophobicContact CG-CG1 4.36Å |
| 97 | R | 66.8 | Low | 59.4 | Low | 157 Ų | 157 | 82.5 Ų | 82.5 | 59% | 0.592 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -65.5 | -28.5 | 174.7 | -173.3 | 179.4 | -71.7 | 158.2 | -1.7 | 111.8 | P93 S94 W95 P101 | P93-R97 PolarHBondContact O-N 2.79Å; S94-R97 PolarHBondContact O-N 3.01Å; W95-R97 VanDerWaalsContact C-N 3.31Å; W95-R97 PolarHBondContact O-N 3.26Å; R97-P101 VanDerWaalsContact O-CA 3.26Å; R97-P101 WeakPolarHBondContact O-CA 3.22Å; R97-P101 WeakPolarHBondContact O-CB 3.46Å |
| 98 | E | 63.9 | Low | 60.7 | Low | 161 Ų | 161 | 78.2 Ų | 78.2 | 75% | 0.752 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -75.5 | -46.9 | -179.7 | -170.2 | 179 | 171.8 | 0 | 0 | 112.3 | S94 W95 L96 | S94-E98 PolarHBondContact O-N 3.03Å; W95-E98 WeakPolarHBondContact O-CA 3.49Å; W95-E98 VanDerWaalsContact O-CB 3.26Å; W95-E98 WeakPolarHBondContact O-CB 3.29Å; W95-E98 PolarHBondContact O-N 3.31Å; L96-E98 PolarHBondContact O-N 2.91Å |
| 99 | I | 62.5 | Low | 61.9 | Low | 93 Ų | 93 | 76.4 Ų | 76.4 | 48% | 0.477 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -83.9 | -27.3 | 178.5 | 36.9 | 167.7 | 0 | 0 | 0 | 113.4 | W95 V129 | W95-I99 HydrophobicContact CE3-CD1 3.27Å; W95-I99 HydrophobicContact CE3-CG1 3.98Å; W95-I99 HydrophobicContact CH2-CD1 4.47Å; W95-I99 HydrophobicContact CZ3-CD1 3.23Å; W95-I99 HydrophobicContact CZ3-CG1 4.32Å; W95-I99 WeakPolarHBondContact O-CG1 3.33Å; W95-I99 PolarHBondContact O-N 3.36Å; I99-V129 HydrophobicContact CD1-CB 4.41Å; I99-V129 HydrophobicContact CD1-CG1 3.21Å; I99-V129 WeakPolarHBondContact CD1-O 3.44Å; I99-V129 HydrophobicContact CG1-CG1 3.97Å |
| 100 | A | 62.7 | Low | 63 | Low | 11 Ų | 11 | 71.3 Ų | 71.3 | 9% | 0.091 | 41% | 0.407 | C | S | . | . | trans | -137.3 | 68.9 | -176.7 | 0 | 0 | 0 | 0 | 0 | 110.5 | L96 A102 V103 V129 | L96-A100 CarbonylContact O-C 3.58Å; L96-A100 WeakPolarHBondContact O-CA 3.14Å; L96-A100 WeakPolarHBondContact O-CB 3.45Å; L96-A100 PolarHBondContact O-N 3.35Å; A100-A102 PolarHBondContact O-N 3.45Å; A100-A102 VanDerWaalsContact O-N 3.07Å; A100-V103 HydrophobicContact CB-CB 3.75Å; A100-V103 HydrophobicContact CB-CG2 3.46Å; A100-V103 VanDerWaalsContact CB-CG2 3.46Å; A100-V103 PolarHBondContact O-N 2.79Å; A100-V129 HydrophobicContact CB-CG1 4.22Å; A100-V129 HydrophobicContact CB-CG2 4.18Å | ||
| 101 | P | 60.2 | Low | 64.2 | Low | 106 Ų | 106 | 70.8 Ų | 70.8 | 69% | 0.688 | 40% | 0.4 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.7 | -22.1 | -179.2 | 22.7 | -32.5 | 0 | 0 | 0 | 113 | R97 | R97-P101 VanDerWaalsContact O-CA 3.26Å; R97-P101 WeakPolarHBondContact O-CA 3.22Å; R97-P101 WeakPolarHBondContact O-CB 3.46Å |
| 102 | A | 56.1 | Low | 65.5 | Low | 77 Ų | 77 | 71.2 Ų | 71.2 | 64% | 0.636 | 40% | 0.404 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.4 | -9.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | A100 N104 | A100-A102 PolarHBondContact O-N 3.45Å; A100-A102 VanDerWaalsContact O-N 3.07Å; A102-N104 PolarHBondContact O-N 3.37Å; A102-N104 VanDerWaalsContact O-N 3.1Å |
| 103 | V | 58.6 | Low | 66.6 | Low | 51 Ų | 51 | 77.7 Ų | 77.7 | 31% | 0.309 | 44% | 0.436 | S | S | . | . | trans | -82.6 | 95.4 | 179.9 | 172.6 | 0 | 0 | 0 | 0 | 108.8 | A100 I105 L125 | A100-V103 HydrophobicContact CB-CB 3.75Å; A100-V103 HydrophobicContact CB-CG2 3.46Å; A100-V103 VanDerWaalsContact CB-CG2 3.46Å; A100-V103 PolarHBondContact O-N 2.79Å; V103-I105 HydrophobicContact CG1-CD1 4.44Å; V103-I105 HydrophobicContact CG1-CG1 3.71Å; V103-I105 PolarHBondContact O-N 2.97Å; V103-L125 HydrophobicContact CB-CD1 4.43Å; V103-L125 HydrophobicContact CG1-CD1 3.71Å; V103-L125 HydrophobicContact CG1-CD2 4.23Å; V103-L125 HydrophobicContact CG2-CD1 3.93Å | ||
| 104 | N | 59.1 | Low | 67.4 | Low | 128 Ų | 128 | 79.7 Ų | 79.7 | 68% | 0.684 | 44% | 0.442 | S | S | * | . | trans | -78.5 | 106.3 | 163.1 | -171.6 | 40.6 | 0 | 0 | 0 | 108.4 | A102 E106 | A102-N104 PolarHBondContact O-N 3.37Å; A102-N104 VanDerWaalsContact O-N 3.1Å; N104-E106 PolarHBondContact O-N 3.06Å; N104-E106 VanDerWaalsContact O-N 3.08Å | ||
| 105 | I | 61.2 | Low | 68.1 | Low | 25 Ų | 25 | 81.4 Ų | 81.4 | 13% | 0.128 | 43% | 0.432 | C | S | . | . | trans | -78.3 | 90.9 | 175.5 | -57.5 | -175.7 | 0 | 0 | 0 | 107.1 | P92 L96 V103 Q142 L143 | P92-I105 HydrophobicContact CB-CD1 4.02Å; L96-I105 HydrophobicContact CD1-CD1 3.3Å; L96-I105 HydrophobicContact CG-CD1 4.4Å; V103-I105 HydrophobicContact CG1-CD1 4.44Å; V103-I105 HydrophobicContact CG1-CG1 3.71Å; V103-I105 PolarHBondContact O-N 2.97Å; I105-Q142 HydrophobicContact CG2-CG 4.37Å; I105-L143 HydrophobicContact CG2-CD2 3.27Å; I105-L143 HydrophobicContact CG2-CG 3.67Å | ||
| 106 | E | 63 | Low | 68.5 | Low | 83 Ų | 83 | 84.8 Ų | 84.8 | 39% | 0.388 | 46% | 0.455 | S | S | . | . | P | Polyproline II helix | trans | -73.8 | 128.4 | 172.1 | -165.1 | 173.1 | 167.1 | 0 | 0 | 108.8 | N104 F108 L143 | N104-E106 PolarHBondContact O-N 3.06Å; N104-E106 VanDerWaalsContact O-N 3.08Å; E106-F108 PolarHBondContact O-N 3.24Å; E106-L143 VanDerWaalsContact O-CD2 3.29Å; E106-L143 WeakPolarHBondContact O-CD2 3.23Å |
| 107 | P | 63.4 | Low | 69.1 | Low | 69 Ų | 69 | 88.4 Ų | 88.4 | 45% | 0.448 | 47% | 0.473 | S | S | . | . | P | Polyproline II helix | trans | -60.2 | 135.9 | 177.2 | 24.1 | -32.1 | 0 | 0 | 0 | 109.8 | D109 | P107-D109 PolarHBondContact O-N 2.73Š|
| 108 | F | 69.9 | Low | 69.7 | Low | 23 Ų | 23 | 82.2 Ų | 82.2 | 10% | 0.101 | 45% | 0.45 | C | S | . | . | P | Polyproline II helix | trans | -75.1 | 125.9 | 175.2 | -176.9 | -119.7 | 0 | 0 | 0 | 108.8 | E106 G110 D111 K114 W115 F118 L143 L144 | E106-F108 PolarHBondContact O-N 3.24Å; F108-G110 VanDerWaalsContact CE1-CA 3.45Å; F108-G110 PolarHBondContact O-N 3.18Å; F108-D111 WeakPolarHBondContact CZ-O 3.32Å; F108-K114 HydrophobicContact CE2-CB 3.74Å; F108-W115 HydrophobicContact CZ-CB 4.33Å; F108-W115 HydrophobicContact CZ-CG 4.25Å; F108-F118 HydrophobicContact CB-CD2 3.7Å; F108-F118 HydrophobicContact CB-CE2 3.7Å; F108-F118 HydrophobicContact CB-CG 4.48Å; F108-F118 HydrophobicContact CB-CZ 4.48Å; F108-F118 HydrophobicContact CD1-CD2 4.35Å; F108-F118 HydrophobicContact CD1-CG 4.34Å; F108-F118 HydrophobicContact CD2-CB 3.78Å; F108-F118 AromaticContact CD2-CD2 3.69Å; F108-F118 HydrophobicContact CD2-CD2 3.69Å; F108-F118 AromaticContact CD2-CG 3.83Å; F108-F118 HydrophobicContact CD2-CG 3.83Å; F108-F118 HydrophobicContact CE2-CB 3.66Å; F108-F118 HydrophobicContact CE2-CD2 4.4Å; F108-F118 HydrophobicContact CE2-CG 4.08Å; F108-F118 HydrophobicContact CG-CB 4.41Å; F108-F118 AromaticContact CG-CD2 3.67Å; F108-F118 HydrophobicContact CG-CD2 3.67Å; F108-F118 HydrophobicContact CG-CE2 4.05Å; F108-F118 AromaticContact CG-CG 3.97Å; F108-F118 HydrophobicContact CG-CG 3.97Å; F108-F118 HydrophobicContact CZ-CB 4.21Å; F108-F118 HydrophobicContact CZ-CG 4.45Å; F108-L143 PolarHBondContact N-O 3Å; F108-L144 HydrophobicContact CD1-CD2 4.4Å |
| 109 | D | 73.3 | Confident | 70.4 | Confident | 85 Ų | 85 | 78.7 Ų | 78.7 | 46% | 0.455 | 44% | 0.435 | S | S | . | . | trans | -74 | -3.5 | -179.7 | 53.3 | 10 | 0 | 0 | 0 | 113.8 | P107 D111 K114 | P107-D109 PolarHBondContact O-N 2.73Å; D109-D111 VanDerWaalsContact C-N 3.29Å; D109-D111 VanDerWaalsContact OD1-CB 3.23Å; D109-D111 WeakPolarHBondContact OD1-CB 3.46Å; D109-D111 PolarHBondContact OD1-N 3.3Å; D109-D111 VanDerWaalsContact OD2-OD2 3.08Å; D109-K114 IonicContact OD1-NZ 3.95Å; D109-K114 IonicContact OD2-NZ 2.59Å; D109-K114 PolarHBondContact OD2-NZ 3.2Å | ||
| 110 | G | 75.2 | Confident | 71.3 | Confident | 39 Ų | 39 | 77.8 Ų | 77.8 | 40% | 0.402 | 43% | 0.434 | S | S | . | . | trans | 81.3 | 6 | -175.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | F108 P112 | F108-G110 VanDerWaalsContact CE1-CA 3.45Å; F108-G110 PolarHBondContact O-N 3.18Å; G110-P112 WeakPolarHBondContact O-CD 3.15Å | ||
| 111 | D | 77.9 | Confident | 71.8 | Confident | 66 Ų | 66 | 78.7 Ų | 78.7 | 35% | 0.353 | 44% | 0.44 | S | S | . | . | trans | -65.3 | 117.6 | -178.8 | -81.7 | -16.5 | 0 | 0 | 0 | 110.8 | F108 D109 L113 K114 W115 | F108-D111 WeakPolarHBondContact CZ-O 3.32Å; D109-D111 VanDerWaalsContact C-N 3.29Å; D109-D111 VanDerWaalsContact OD1-CB 3.23Å; D109-D111 WeakPolarHBondContact OD1-CB 3.46Å; D109-D111 PolarHBondContact OD1-N 3.3Å; D109-D111 VanDerWaalsContact OD2-OD2 3.08Å; D111-L113 PolarHBondContact O-N 2.84Å; D111-L113 VanDerWaalsContact O-N 3.09Å; D111-K114 HydrophobicContact CB-CB 4.24Å; D111-K114 HydrophobicContact CB-CD 4.1Å; D111-K114 HydrophobicContact CB-CG 4.16Å; D111-K114 PolarHBondContact O-N 2.77Å; D111-K114 IonicContact OD2-NZ 2.77Å; D111-K114 PolarHBondContact OD2-NZ 2.96Å; D111-W115 PolarHBondContact O-N 3.32Å | ||
| 112 | P | 80.8 | Confident | 72.6 | Confident | 95 Ų | 95 | 75 Ų | 75 | 62% | 0.617 | 41% | 0.413 | S | S | * | . | G | 310 helix | trans | -60.5 | -26.2 | 179.4 | -24.5 | 35 | 0 | 0 | 0 | 113.4 | G110 K114 W115 | G110-P112 WeakPolarHBondContact O-CD 3.15Å; P112-K114 VanDerWaalsContact C-N 3.27Å; P112-K114 PolarHBondContact O-N 3.47Å; P112-W115 HydrophobicContact CB-CE3 4.38Å; P112-W115 WeakPolarHBondContact O-CB 3.17Å; P112-W115 PolarHBondContact O-N 3.37Å |
| 113 | L | 83.4 | Confident | 73.6 | Confident | 168 Ų | 168 | 75.4 Ų | 75.4 | 88% | 0.88 | 40% | 0.404 | S | S | * | . | G | 310 helix | trans | -66.6 | -28.8 | 175.6 | -66.6 | 176.2 | 0 | 0 | 0 | 112.8 | D111 | D111-L113 PolarHBondContact O-N 2.84Å; D111-L113 VanDerWaalsContact O-N 3.09Å |
| 114 | K | 77.3 | Confident | 74.5 | Confident | 71 Ų | 71 | 79.5 Ų | 79.5 | 31% | 0.309 | 42% | 0.418 | S | S | . | . | G | 310 helix | trans | -93.9 | -1.3 | 179.8 | -66.5 | 177.9 | -175.4 | 132.9 | 0 | 112.2 | F108 D109 D111 P112 N116 M117 F118 | F108-K114 HydrophobicContact CE2-CB 3.74Å; D109-K114 IonicContact OD1-NZ 3.95Å; D109-K114 IonicContact OD2-NZ 2.59Å; D109-K114 PolarHBondContact OD2-NZ 3.2Å; D111-K114 HydrophobicContact CB-CB 4.24Å; D111-K114 HydrophobicContact CB-CD 4.1Å; D111-K114 HydrophobicContact CB-CG 4.16Å; D111-K114 PolarHBondContact O-N 2.77Å; D111-K114 IonicContact OD2-NZ 2.77Å; D111-K114 PolarHBondContact OD2-NZ 2.96Å; P112-K114 VanDerWaalsContact C-N 3.27Å; P112-K114 PolarHBondContact O-N 3.47Å; K114-N116 PolarHBondContact O-N 3.34Å; K114-M117 WeakPolarHBondContact O-CB 3.22Å; K114-M117 PolarHBondContact O-N 2.8Å; K114-M117 VanDerWaalsContact O-N 3.14Å; K114-F118 WeakPolarHBondContact O-CB 3.47Å; K114-F118 PolarHBondContact O-N 3.12Å |
| 115 | W | 79.8 | Confident | 75.2 | Confident | 141 Ų | 141 | 74.6 Ų | 74.6 | 53% | 0.534 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -64 | -41.3 | -171.9 | -143 | -8.4 | 0 | 0 | 0 | 113.2 | F108 D111 P112 M117 F118 I119 | F108-W115 HydrophobicContact CZ-CB 4.33Å; F108-W115 HydrophobicContact CZ-CG 4.25Å; D111-W115 PolarHBondContact O-N 3.32Å; P112-W115 HydrophobicContact CB-CE3 4.38Å; P112-W115 WeakPolarHBondContact O-CB 3.17Å; P112-W115 PolarHBondContact O-N 3.37Å; W115-M117 VanDerWaalsContact C-N 3.33Å; W115-M117 PolarHBondContact O-N 3.06Å; W115-F118 WeakPolarHBondContact O-CB 3.23Å; W115-F118 PolarHBondContact O-N 3.34Å; W115-I119 HydrophobicContact CG-CD1 4.36Å; W115-I119 WeakPolarHBondContact O-CB 3.5Å; W115-I119 VanDerWaalsContact O-CG1 3.23Å; W115-I119 WeakPolarHBondContact O-CG1 3.2Å; W115-I119 PolarHBondContact O-N 3.21Å |
| 116 | N | 78.4 | Confident | 75.8 | Confident | 128 Ų | 128 | 73.6 Ų | 73.6 | 68% | 0.684 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -60.2 | -44.8 | 174.7 | -75.4 | -32.6 | 0 | 0 | 0 | 111.3 | K114 I119 T120 | K114-N116 PolarHBondContact O-N 3.34Å; N116-I119 PolarHBondContact O-N 3.21Å; N116-T120 WeakPolarHBondContact O-CB 3.26Å; N116-T120 PolarHBondContact O-N 3.47Å; N116-T120 PolarHBondContact O-OG1 2.85Å |
| 117 | M | 78.8 | Confident | 76.3 | Confident | 80 Ų | 80 | 75.4 Ų | 75.4 | 39% | 0.394 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -65 | -41.2 | 178.2 | -173.4 | 175 | -67.7 | 0 | 0 | 111.6 | I4 K114 W115 S121 | I4-M117 HydrophobicContact CB-CE 4.5Å; I4-M117 HydrophobicContact CB-SD 4.35Å; I4-M117 HydrophobicContact CD1-CE 4.3Å; I4-M117 HydrophobicContact CG1-CE 4Å; I4-M117 HydrophobicContact CG1-SD 4.26Å; I4-M117 HydrophobicContact CG2-CE 3.98Å; I4-M117 HydrophobicContact CG2-SD 3.97Å; K114-M117 WeakPolarHBondContact O-CB 3.22Å; K114-M117 PolarHBondContact O-N 2.8Å; K114-M117 VanDerWaalsContact O-N 3.14Å; W115-M117 VanDerWaalsContact C-N 3.33Å; W115-M117 PolarHBondContact O-N 3.06Å; M117-S121 VanDerWaalsContact O-CB 3.29Å; M117-S121 WeakPolarHBondContact O-CB 3.08Å; M117-S121 PolarHBondContact O-N 3.09Å; M117-S121 PolarHBondContact O-OG 3.5Å |
| 118 | F | 77.9 | Confident | 76.6 | Confident | 27 Ų | 27 | 78.3 Ų | 78.3 | 12% | 0.118 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -59.7 | -51.4 | 174 | 175.2 | -98.9 | 0 | 0 | 0 | 111.6 | F108 K114 W115 T120 S121 F122 L143 L144 | F108-F118 HydrophobicContact CB-CD2 3.7Å; F108-F118 HydrophobicContact CB-CE2 3.7Å; F108-F118 HydrophobicContact CB-CG 4.48Å; F108-F118 HydrophobicContact CB-CZ 4.48Å; F108-F118 HydrophobicContact CD1-CD2 4.35Å; F108-F118 HydrophobicContact CD1-CG 4.34Å; F108-F118 HydrophobicContact CD2-CB 3.78Å; F108-F118 AromaticContact CD2-CD2 3.69Å; F108-F118 HydrophobicContact CD2-CD2 3.69Å; F108-F118 AromaticContact CD2-CG 3.83Å; F108-F118 HydrophobicContact CD2-CG 3.83Å; F108-F118 HydrophobicContact CE2-CB 3.66Å; F108-F118 HydrophobicContact CE2-CD2 4.4Å; F108-F118 HydrophobicContact CE2-CG 4.08Å; F108-F118 HydrophobicContact CG-CB 4.41Å; F108-F118 AromaticContact CG-CD2 3.67Å; F108-F118 HydrophobicContact CG-CD2 3.67Å; F108-F118 HydrophobicContact CG-CE2 4.05Å; F108-F118 AromaticContact CG-CG 3.97Å; F108-F118 HydrophobicContact CG-CG 3.97Å; F108-F118 HydrophobicContact CZ-CB 4.21Å; F108-F118 HydrophobicContact CZ-CG 4.45Å; K114-F118 WeakPolarHBondContact O-CB 3.47Å; K114-F118 PolarHBondContact O-N 3.12Å; W115-F118 WeakPolarHBondContact O-CB 3.23Å; W115-F118 PolarHBondContact O-N 3.34Å; F118-T120 PolarHBondContact O-N 3.32Å; F118-S121 PolarHBondContact O-N 3.08Å; F118-F122 WeakPolarHBondContact O-CB 3.47Å; F118-F122 PolarHBondContact O-N 2.87Å; F118-L143 HydrophobicContact CE2-CB 3.76Å; F118-L143 HydrophobicContact CE2-CD1 3.8Å; F118-L143 HydrophobicContact CE2-CD2 4.06Å; F118-L143 HydrophobicContact CE2-CG 4.09Å; F118-L143 HydrophobicContact CZ-CB 3.9Å; F118-L143 HydrophobicContact CZ-CD1 4.07Å; F118-L144 HydrophobicContact CE1-CD2 4.41Å; F118-L144 HydrophobicContact CZ-CD2 4.25Å; F118-L144 HydrophobicContact CZ-CG 4.45Å |
| 119 | I | 78.4 | Confident | 76.4 | Confident | 87 Ų | 87 | 78.2 Ų | 78.2 | 45% | 0.446 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -61.5 | -45.6 | -179.1 | -68.6 | 164.5 | 0 | 0 | 0 | 110.6 | W115 N116 F122 N123 | W115-I119 HydrophobicContact CG-CD1 4.36Å; W115-I119 WeakPolarHBondContact O-CB 3.5Å; W115-I119 VanDerWaalsContact O-CG1 3.23Å; W115-I119 WeakPolarHBondContact O-CG1 3.2Å; W115-I119 PolarHBondContact O-N 3.21Å; N116-I119 PolarHBondContact O-N 3.21Å; I119-F122 PolarHBondContact O-N 2.98Å; I119-N123 VanDerWaalsContact O-CB 3.22Å; I119-N123 WeakPolarHBondContact O-CB 3.44Å; I119-N123 PolarHBondContact O-N 3.14Å |
| 120 | T | 81.7 | Confident | 76 | Confident | 74 Ų | 74 | 74.2 Ų | 74.2 | 45% | 0.454 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -60.2 | -48.9 | 177.1 | -60 | 0 | 0 | 0 | 0 | 111 | N116 F118 N123 F124 | N116-T120 WeakPolarHBondContact O-CB 3.26Å; N116-T120 PolarHBondContact O-N 3.47Å; N116-T120 PolarHBondContact O-OG1 2.85Å; F118-T120 PolarHBondContact O-N 3.32Å; T120-N123 PolarHBondContact O-N 3.09Å; T120-F124 HydrophobicContact CG2-CD2 3.73Å; T120-F124 HydrophobicContact CG2-CE2 3.5Å; T120-F124 VanDerWaalsContact CG2-CE2 3.5Å; T120-F124 WeakPolarHBondContact O-CD2 3.37Å; T120-F124 PolarHBondContact O-N 3.4Å |
| 121 | S | 74.2 | Confident | 75.6 | Confident | 30 Ų | 30 | 75.9 Ų | 75.9 | 21% | 0.21 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -66.3 | -40.8 | -178.5 | -54.1 | 0 | 0 | 0 | 0 | 112.1 | L5 M117 F118 F124 L125 | L5-S121 VanDerWaalsContact CD1-CB 3.44Å; L5-S121 WeakPolarHBondContact CD1-OG 3.39Å; M117-S121 VanDerWaalsContact O-CB 3.29Å; M117-S121 WeakPolarHBondContact O-CB 3.08Å; M117-S121 PolarHBondContact O-N 3.09Å; M117-S121 PolarHBondContact O-OG 3.5Å; F118-S121 PolarHBondContact O-N 3.08Å; S121-F124 PolarHBondContact O-N 3.16Å; S121-L125 VanDerWaalsContact O-CB 3.23Å; S121-L125 WeakPolarHBondContact O-CB 3.43Å; S121-L125 PolarHBondContact O-N 3.14Å |
| 122 | F | 75.9 | Confident | 75.3 | Confident | 28 Ų | 28 | 76.2 Ų | 76.2 | 12% | 0.123 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -63.4 | -42.2 | 174.4 | 178.6 | -102.4 | 0 | 0 | 0 | 111.4 | W77 F118 I119 L125 V126 I139 L140 L143 | W77-F122 HydrophobicContact CH2-CE1 4.25Å; W77-F122 HydrophobicContact CH2-CZ 4.35Å; F118-F122 WeakPolarHBondContact O-CB 3.47Å; F118-F122 PolarHBondContact O-N 2.87Å; I119-F122 PolarHBondContact O-N 2.98Å; F122-L125 PolarHBondContact O-N 3.45Å; F122-V126 HydrophobicContact CD1-CG2 4.21Å; F122-V126 HydrophobicContact CD2-CG2 3.96Å; F122-V126 HydrophobicContact CE1-CG2 3.74Å; F122-V126 HydrophobicContact CE2-CG2 3.47Å; F122-V126 VanDerWaalsContact CE2-CG2 3.47Å; F122-V126 HydrophobicContact CG-CG2 4.32Å; F122-V126 HydrophobicContact CZ-CG2 3.34Å; F122-V126 VanDerWaalsContact O-CB 3.26Å; F122-V126 WeakPolarHBondContact O-CB 3.39Å; F122-V126 WeakPolarHBondContact O-CG2 3.46Å; F122-V126 PolarHBondContact O-N 2.9Å; F122-I139 HydrophobicContact CD2-CG2 4.12Å; F122-I139 HydrophobicContact CE2-CB 4.3Å; F122-I139 HydrophobicContact CE2-CG2 3.86Å; F122-L140 HydrophobicContact CE1-CD1 4.12Å; F122-L140 HydrophobicContact CE2-CB 3.85Å; F122-L140 HydrophobicContact CE2-CD1 3.88Å; F122-L140 HydrophobicContact CE2-CG 4.49Å; F122-L140 HydrophobicContact CZ-CB 3.77Å; F122-L140 HydrophobicContact CZ-CD1 3.66Å; F122-L140 HydrophobicContact CZ-CG 4.23Å; F122-L143 HydrophobicContact CD2-CD1 3.67Å; F122-L143 HydrophobicContact CE2-CD1 4.32Å |
| 123 | N | 78.2 | Confident | 74.9 | Confident | 85 Ų | 85 | 75.8 Ų | 75.8 | 46% | 0.455 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -61.4 | -50.5 | 177.2 | -170 | -54 | 0 | 0 | 0 | 110.7 | I119 T120 L125 V126 H127 | I119-N123 VanDerWaalsContact O-CB 3.22Å; I119-N123 WeakPolarHBondContact O-CB 3.44Å; I119-N123 PolarHBondContact O-N 3.14Å; T120-N123 PolarHBondContact O-N 3.09Å; N123-L125 VanDerWaalsContact C-N 3.33Å; N123-L125 PolarHBondContact O-N 2.98Å; N123-V126 PolarHBondContact O-N 3.47Å; N123-H127 WeakPolarHBondContact O-CB 3.46Å; N123-H127 PolarHBondContact O-CD2 2.95Å; N123-H127 PolarHBondContact O-N 3.18Å; N123-H127 PolarHBondContact OD1-CD2 3.17Å |
| 124 | F | 76.4 | Confident | 74.5 | Confident | 138 Ų | 138 | 71.2 Ų | 71.2 | 61% | 0.605 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -56.7 | -46.9 | 174.2 | -79.7 | -67.8 | 0 | 0 | 0 | 111.9 | T120 S121 H127 D128 | T120-F124 HydrophobicContact CG2-CD2 3.73Å; T120-F124 HydrophobicContact CG2-CE2 3.5Å; T120-F124 VanDerWaalsContact CG2-CE2 3.5Å; T120-F124 WeakPolarHBondContact O-CD2 3.37Å; T120-F124 PolarHBondContact O-N 3.4Å; S121-F124 PolarHBondContact O-N 3.16Å; F124-H127 PolarHBondContact O-N 3.4Å; F124-D128 WeakPolarHBondContact O-CB 3.4Å; F124-D128 PolarHBondContact O-N 3.22Å |
| 125 | L | 74.7 | Confident | 74.3 | Confident | 24 Ų | 24 | 70.3 Ų | 70.3 | 13% | 0.126 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -62.9 | -46.5 | -179.1 | -177.7 | 63.5 | 0 | 0 | 0 | 112.1 | V103 S121 F122 N123 H127 D128 V129 I139 | V103-L125 HydrophobicContact CB-CD1 4.43Å; V103-L125 HydrophobicContact CG1-CD1 3.71Å; V103-L125 HydrophobicContact CG1-CD2 4.23Å; V103-L125 HydrophobicContact CG2-CD1 3.93Å; S121-L125 VanDerWaalsContact O-CB 3.23Å; S121-L125 WeakPolarHBondContact O-CB 3.43Å; S121-L125 PolarHBondContact O-N 3.14Å; F122-L125 PolarHBondContact O-N 3.45Å; N123-L125 VanDerWaalsContact C-N 3.33Å; N123-L125 PolarHBondContact O-N 2.98Å; L125-H127 VanDerWaalsContact C-N 3.34Å; L125-H127 PolarHBondContact O-N 2.99Å; L125-D128 PolarHBondContact O-N 3.17Å; L125-V129 HydrophobicContact CD1-CB 3.98Å; L125-V129 HydrophobicContact CD1-CG1 4.38Å; L125-V129 HydrophobicContact CD1-CG2 3.61Å; L125-V129 WeakPolarHBondContact O-CA 3.26Å; L125-V129 WeakPolarHBondContact O-CB 3.46Å; L125-V129 PolarHBondContact O-N 3.44Å; L125-I139 HydrophobicContact CD2-CG2 3.61Å; L125-I139 HydrophobicContact CG-CD1 4.39Å; L125-I139 HydrophobicContact CG-CG2 4.38Å |
| 126 | V | 72.9 | Confident | 74.2 | Confident | 4 Ų | 4 | 65.9 Ų | 65.9 | 2% | 0.024 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -67.6 | -34.4 | -179.4 | 155.8 | 0 | 0 | 0 | 0 | 112.3 | F122 N123 A130 R136 I139 | F122-V126 HydrophobicContact CD1-CG2 4.21Å; F122-V126 HydrophobicContact CD2-CG2 3.96Å; F122-V126 HydrophobicContact CE1-CG2 3.74Å; F122-V126 HydrophobicContact CE2-CG2 3.47Å; F122-V126 VanDerWaalsContact CE2-CG2 3.47Å; F122-V126 HydrophobicContact CG-CG2 4.32Å; F122-V126 HydrophobicContact CZ-CG2 3.34Å; F122-V126 VanDerWaalsContact O-CB 3.26Å; F122-V126 WeakPolarHBondContact O-CB 3.39Å; F122-V126 WeakPolarHBondContact O-CG2 3.46Å; F122-V126 PolarHBondContact O-N 2.9Å; N123-V126 PolarHBondContact O-N 3.47Å; V126-A130 CarbonylContact O-C 3.33Å; V126-A130 WeakPolarHBondContact O-CB 3.29Å; V126-A130 PolarHBondContact O-N 2.92Å; V126-R136 HydrophobicContact CB-CG 4.44Å; V126-R136 HydrophobicContact CG1-CB 3.99Å; V126-R136 HydrophobicContact CG1-CG 3.52Å; V126-R136 HydrophobicContact CG2-CB 4.15Å; V126-R136 HydrophobicContact CG2-CG 4.34Å; V126-I139 HydrophobicContact CG2-CD1 4.4Å |
| 127 | H | 74.5 | Confident | 74 | Confident | 121 Ų | 121 | 61.4 Ų | 61.4 | 56% | 0.56 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -78.7 | -34.2 | 178.2 | -82.5 | -90.5 | 0 | 0 | 0 | 113.1 | N123 F124 L125 | N123-H127 WeakPolarHBondContact O-CB 3.46Å; N123-H127 PolarHBondContact O-CD2 2.95Å; N123-H127 PolarHBondContact O-N 3.18Å; N123-H127 PolarHBondContact OD1-CD2 3.17Å; F124-H127 PolarHBondContact O-N 3.4Å; L125-H127 VanDerWaalsContact C-N 3.34Å; L125-H127 PolarHBondContact O-N 2.99Å |
| 128 | D | 68.9 | Low | 73.7 | Confident | 131 Ų | 131 | 59.2 Ų | 59.2 | 70% | 0.701 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -84.8 | -39.2 | -177.9 | -165.9 | 51.5 | 0 | 0 | 0 | 112.4 | F124 L125 | F124-D128 WeakPolarHBondContact O-CB 3.4Å; F124-D128 PolarHBondContact O-N 3.22Å; L125-D128 PolarHBondContact O-N 3.17Å |
| 129 | V | 65.2 | Low | 73.3 | Confident | 20 Ų | 20 | 58 Ų | 58 | 12% | 0.121 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -107.4 | -29.2 | -166.9 | -178.6 | 0 | 0 | 0 | 0 | 112.7 | W95 L96 I99 A100 L125 | W95-V129 HydrophobicContact CZ3-CG1 4.32Å; L96-V129 HydrophobicContact CD2-CG1 3.41Å; L96-V129 VanDerWaalsContact CD2-CG1 3.41Å; I99-V129 HydrophobicContact CD1-CB 4.41Å; I99-V129 HydrophobicContact CD1-CG1 3.21Å; I99-V129 WeakPolarHBondContact CD1-O 3.44Å; I99-V129 HydrophobicContact CG1-CG1 3.97Å; A100-V129 HydrophobicContact CB-CG1 4.22Å; A100-V129 HydrophobicContact CB-CG2 4.18Å; L125-V129 HydrophobicContact CD1-CB 3.98Å; L125-V129 HydrophobicContact CD1-CG1 4.38Å; L125-V129 HydrophobicContact CD1-CG2 3.61Å; L125-V129 WeakPolarHBondContact O-CA 3.26Å; L125-V129 WeakPolarHBondContact O-CB 3.46Å; L125-V129 PolarHBondContact O-N 3.44Å |
| 130 | A | 65 | Low | 73.1 | Confident | 1 Ų | 1 | 55.7 Ų | 55.7 | 1% | 0.008 | 32% | 0.322 | C | S | . | . | trans | -107.9 | 95.7 | -174.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | V126 T132 Q135 R136 I139 | V126-A130 CarbonylContact O-C 3.33Å; V126-A130 WeakPolarHBondContact O-CB 3.29Å; V126-A130 PolarHBondContact O-N 2.92Å; A130-T132 VanDerWaalsContact C-N 3.26Å; A130-T132 PolarHBondContact O-N 3.15Å; A130-Q135 HydrophobicContact CB-CB 3.74Å; A130-R136 HydrophobicContact CB-CB 4.46Å; A130-R136 HydrophobicContact CB-CG 3.61Å; A130-R136 PolarHBondContact O-NE 2.72Å; A130-R136 VanDerWaalsContact O-NE 3.16Å; A130-R136 PolarHBondContact O-NH2 2.92Å; A130-I139 HydrophobicContact CB-CD1 3.84Å | ||
| 131 | G | 67.7 | Low | 72.6 | Confident | 74 Ų | 74 | 56.5 Ų | 56.5 | 76% | 0.763 | 32% | 0.32 | S | S | * | . | trans | -72.7 | -12.9 | 174.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 132 | T | 71.7 | Confident | 72.2 | Confident | 73 Ų | 73 | 56.5 Ų | 56.5 | 45% | 0.448 | 32% | 0.317 | S | S | . | . | S | Bend | trans | -130.2 | 144.5 | -176.9 | 65.7 | 0 | 0 | 0 | 0 | 112.7 | A130 A134 Q135 R136 | A130-T132 VanDerWaalsContact C-N 3.26Å; A130-T132 PolarHBondContact O-N 3.15Å; T132-A134 PolarHBondContact O-N 2.94Å; T132-A134 VanDerWaalsContact O-N 3.17Å; T132-Q135 VanDerWaalsContact N-OE1 3.12Å; T132-Q135 WeakPolarHBondContact O-CB 3.41Å; T132-Q135 PolarHBondContact O-N 3.28Å; T132-Q135 WeakPolarHBondContact OG1-CB 3.47Å; T132-Q135 WeakPolarHBondContact OG1-CG 3.47Å; T132-Q135 PolarHBondContact OG1-N 3.23Å; T132-Q135 PolarHBondContact OG1-OE1 2.88Å; T132-R136 WeakPolarHBondContact O-CG 3.34Å; T132-R136 PolarHBondContact O-N 3.02Å; T132-R136 VanDerWaalsContact O-N 3.14Å |
| 133 | N | 72.6 | Confident | 71.9 | Confident | 87 Ų | 87 | 55.8 Ų | 55.8 | 47% | 0.465 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -54.4 | -36.8 | 179.2 | -68.7 | -18.6 | 0 | 0 | 0 | 113.4 | W77 Q135 R136 L137 | W77-N133 HydrophobicContact CB-CB 3.91Å; W77-N133 VanDerWaalsContact CB-CG 3.47Å; N133-Q135 VanDerWaalsContact C-N 3.34Å; N133-Q135 PolarHBondContact O-N 2.94Å; N133-R136 WeakPolarHBondContact O-CB 3.48Å; N133-R136 PolarHBondContact O-N 2.96Å; N133-L137 WeakPolarHBondContact O-CG 3.37Å; N133-L137 PolarHBondContact O-N 3.16Å |
| 134 | A | 74.7 | Confident | 71.4 | Confident | 72 Ų | 72 | 54.8 Ų | 54.8 | 60% | 0.595 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -62.1 | -39.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | T132 A138 | T132-A134 PolarHBondContact O-N 2.94Å; T132-A134 VanDerWaalsContact O-N 3.17Å; A134-A138 WeakPolarHBondContact O-CB 3.2Å; A134-A138 PolarHBondContact O-N 3.22Å |
| 135 | Q | 73.4 | Confident | 70.6 | Confident | 52 Ų | 52 | 53.7 Ų | 53.7 | 24% | 0.243 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -66 | -42 | 174.5 | -76.6 | 169.2 | -32.7 | 0 | 0 | 111.5 | W95 A130 T132 N133 L137 A138 I139 | W95-Q135 HydrophobicContact CD2-CG 4.47Å; W95-Q135 HydrophobicContact CE3-CG 4.25Å; W95-Q135 HydrophobicContact CH2-CB 3.42Å; W95-Q135 VanDerWaalsContact CH2-CB 3.42Å; W95-Q135 HydrophobicContact CH2-CG 3.5Å; W95-Q135 HydrophobicContact CZ2-CB 3.75Å; W95-Q135 HydrophobicContact CZ2-CG 3.69Å; W95-Q135 HydrophobicContact CZ3-CB 4.05Å; W95-Q135 HydrophobicContact CZ3-CG 3.73Å; A130-Q135 HydrophobicContact CB-CB 3.74Å; T132-Q135 VanDerWaalsContact N-OE1 3.12Å; T132-Q135 WeakPolarHBondContact O-CB 3.41Å; T132-Q135 PolarHBondContact O-N 3.28Å; T132-Q135 WeakPolarHBondContact OG1-CB 3.47Å; T132-Q135 WeakPolarHBondContact OG1-CG 3.47Å; T132-Q135 PolarHBondContact OG1-N 3.23Å; T132-Q135 PolarHBondContact OG1-OE1 2.88Å; N133-Q135 VanDerWaalsContact C-N 3.34Å; N133-Q135 PolarHBondContact O-N 2.94Å; Q135-L137 VanDerWaalsContact C-N 3.32Å; Q135-L137 PolarHBondContact O-N 3.39Å; Q135-A138 PolarHBondContact O-N 2.81Å; Q135-I139 VanDerWaalsContact O-CG1 3.29Å; Q135-I139 WeakPolarHBondContact O-CG1 3.49Å; Q135-I139 PolarHBondContact O-N 2.91Å |
| 136 | R | 76.7 | Confident | 69.3 | Low | 47 Ų | 47 | 61.2 Ų | 61.2 | 18% | 0.177 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -59.9 | -44.9 | 177.9 | -53.8 | -176.1 | 167.7 | -156 | -9 | 111.2 | W77 V126 A130 T132 N133 I139 L140 | W77-R136 HydrophobicContact CE3-CB 3.85Å; W77-R136 HydrophobicContact CH2-CB 3.95Å; W77-R136 HydrophobicContact CZ3-CB 3.33Å; W77-R136 HydrophobicContact CZ3-CG 4.4Å; V126-R136 HydrophobicContact CB-CG 4.44Å; V126-R136 HydrophobicContact CG1-CB 3.99Å; V126-R136 HydrophobicContact CG1-CG 3.52Å; V126-R136 HydrophobicContact CG2-CB 4.15Å; V126-R136 HydrophobicContact CG2-CG 4.34Å; A130-R136 HydrophobicContact CB-CB 4.46Å; A130-R136 HydrophobicContact CB-CG 3.61Å; A130-R136 PolarHBondContact O-NE 2.72Å; A130-R136 VanDerWaalsContact O-NE 3.16Å; A130-R136 PolarHBondContact O-NH2 2.92Å; T132-R136 WeakPolarHBondContact O-CG 3.34Å; T132-R136 PolarHBondContact O-N 3.02Å; T132-R136 VanDerWaalsContact O-N 3.14Å; N133-R136 WeakPolarHBondContact O-CB 3.48Å; N133-R136 PolarHBondContact O-N 2.96Å; R136-I139 PolarHBondContact O-N 3.01Å; R136-L140 WeakPolarHBondContact O-CB 3.27Å; R136-L140 PolarHBondContact O-N 3.05Å |
| 137 | L | 73.7 | Confident | 68 | Low | 34 Ų | 34 | 71.4 Ų | 71.4 | 18% | 0.178 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -63.9 | -45.7 | 174.6 | -73.2 | 167 | 0 | 0 | 0 | 111.3 | W77 N133 Q135 I139 L140 H141 | W77-L137 HydrophobicContact CE3-CD2 4.33Å; W77-L137 HydrophobicContact CE3-CG 4.19Å; W77-L137 HydrophobicContact CZ3-CD2 4.44Å; W77-L137 HydrophobicContact CZ3-CG 4.44Å; N133-L137 WeakPolarHBondContact O-CG 3.37Å; N133-L137 PolarHBondContact O-N 3.16Å; Q135-L137 VanDerWaalsContact C-N 3.32Å; Q135-L137 PolarHBondContact O-N 3.39Å; L137-I139 VanDerWaalsContact C-N 3.31Å; L137-I139 PolarHBondContact O-N 3Å; L137-L140 WeakPolarHBondContact O-CB 2.98Å; L137-L140 PolarHBondContact O-N 2.86Å; L137-L140 VanDerWaalsContact O-N 3.09Å; L137-H141 WeakPolarHBondContact O-CB 3.42Å; L137-H141 PolarHBondContact O-CD2 2.78Å; L137-H141 PolarHBondContact O-N 3.13Å |
| 138 | A | 73 | Confident | 67.7 | Low | 35 Ų | 35 | 69 Ų | 69 | 29% | 0.289 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -58.2 | -42 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | A134 Q135 Q142 | A134-A138 WeakPolarHBondContact O-CB 3.2Å; A134-A138 PolarHBondContact O-N 3.22Å; Q135-A138 PolarHBondContact O-N 2.81Å; A138-Q142 WeakPolarHBondContact O-CB 3.23Å; A138-Q142 PolarHBondContact O-N 2.75Å; A138-Q142 VanDerWaalsContact O-N 3.09Å |
| 139 | I | 70.9 | Confident | 67.6 | Low | 0 Ų | 0 | 65.7 Ų | 65.7 | 0% | 0 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -62.8 | -46.5 | 174.5 | -63.7 | 165.4 | 0 | 0 | 0 | 110.6 | W95 L96 F122 L125 V126 A130 Q135 R136 L137 H141 Q142 L143 | W95-I139 HydrophobicContact CH2-CD1 3.92Å; W95-I139 HydrophobicContact CH2-CG1 4.09Å; W95-I139 HydrophobicContact CZ2-CD1 4.48Å; W95-I139 HydrophobicContact CZ2-CG1 4.17Å; L96-I139 HydrophobicContact CD1-CD1 4.5Å; L96-I139 HydrophobicContact CD1-CG1 3.67Å; L96-I139 HydrophobicContact CD2-CD1 4.09Å; L96-I139 HydrophobicContact CD2-CG1 4.15Å; L96-I139 HydrophobicContact CG-CG1 4.36Å; F122-I139 HydrophobicContact CD2-CG2 4.12Å; F122-I139 HydrophobicContact CE2-CB 4.3Å; F122-I139 HydrophobicContact CE2-CG2 3.86Å; L125-I139 HydrophobicContact CD2-CG2 3.61Å; L125-I139 HydrophobicContact CG-CD1 4.39Å; L125-I139 HydrophobicContact CG-CG2 4.38Å; V126-I139 HydrophobicContact CG2-CD1 4.4Å; A130-I139 HydrophobicContact CB-CD1 3.84Å; Q135-I139 VanDerWaalsContact O-CG1 3.29Å; Q135-I139 WeakPolarHBondContact O-CG1 3.49Å; Q135-I139 PolarHBondContact O-N 2.91Å; R136-I139 PolarHBondContact O-N 3.01Å; L137-I139 VanDerWaalsContact C-N 3.31Å; L137-I139 PolarHBondContact O-N 3Å; I139-H141 PolarHBondContact O-N 3.17Å; I139-Q142 WeakPolarHBondContact O-CB 3.45Å; I139-Q142 PolarHBondContact O-N 3.03Å; I139-Q142 VanDerWaalsContact O-N 3.14Å; I139-L143 HydrophobicContact CG2-CD1 3.83Å; I139-L143 PolarHBondContact O-N 3.36Å |
| 140 | L | 74.1 | Confident | 67.7 | Low | 40 Ų | 40 | 68.2 Ų | 68.2 | 21% | 0.209 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -59.4 | -47.4 | -179.9 | -174.9 | 68.4 | 0 | 0 | 0 | 111.5 | F122 R136 L137 Q142 L143 L144 | F122-L140 HydrophobicContact CE1-CD1 4.12Å; F122-L140 HydrophobicContact CE2-CB 3.85Å; F122-L140 HydrophobicContact CE2-CD1 3.88Å; F122-L140 HydrophobicContact CE2-CG 4.49Å; F122-L140 HydrophobicContact CZ-CB 3.77Å; F122-L140 HydrophobicContact CZ-CD1 3.66Å; F122-L140 HydrophobicContact CZ-CG 4.23Å; R136-L140 WeakPolarHBondContact O-CB 3.27Å; R136-L140 PolarHBondContact O-N 3.05Å; L137-L140 WeakPolarHBondContact O-CB 2.98Å; L137-L140 PolarHBondContact O-N 2.86Å; L137-L140 VanDerWaalsContact O-N 3.09Å; L140-Q142 PolarHBondContact O-N 2.78Å; L140-L143 PolarHBondContact O-N 3.26Å; L140-L144 HydrophobicContact CD1-CD1 3.54Å; L140-L144 HydrophobicContact CD1-CG 4.2Å; L140-L144 HydrophobicContact CD2-CD1 4.47Å; L140-L144 HydrophobicContact CG-CD1 3.78Å; L140-L144 WeakPolarHBondContact O-CB 3.29Å; L140-L144 PolarHBondContact O-N 3.47Å |
| 141 | H | 70 | Confident | 67.9 | Low | 90 Ų | 90 | 72.2 Ų | 72.2 | 42% | 0.417 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -59.4 | -36.5 | 176.5 | -87.2 | -89.4 | 0 | 0 | 0 | 112 | P84 L137 I139 | P84-H141 WeakPolarHBondContact CD-CE1 3.41Å; L137-H141 WeakPolarHBondContact O-CB 3.42Å; L137-H141 PolarHBondContact O-CD2 2.78Å; L137-H141 PolarHBondContact O-N 3.13Å; I139-H141 PolarHBondContact O-N 3.17Å |
| 142 | Q | 67.2 | Low | 67.9 | Low | 30 Ų | 30 | 72.1 Ų | 72.1 | 14% | 0.14 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -71.3 | -34.1 | 179.6 | -168.7 | 55.2 | 81.6 | 0 | 0 | 112.8 | T91 I105 A138 I139 L140 | T91-Q142 PolarHBondContact O-OE1 3.09Å; I105-Q142 HydrophobicContact CG2-CG 4.37Å; A138-Q142 WeakPolarHBondContact O-CB 3.23Å; A138-Q142 PolarHBondContact O-N 2.75Å; A138-Q142 VanDerWaalsContact O-N 3.09Å; I139-Q142 WeakPolarHBondContact O-CB 3.45Å; I139-Q142 PolarHBondContact O-N 3.03Å; I139-Q142 VanDerWaalsContact O-N 3.14Å; L140-Q142 PolarHBondContact O-N 2.78Å |
| 143 | L | 68.2 | Low | 67.7 | Low | 13 Ų | 13 | 72 Ų | 72 | 7% | 0.068 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -81.4 | -32 | -177.9 | -80.8 | 170.3 | 0 | 0 | 0 | 113.7 | I105 E106 F108 F118 F122 I139 L140 | I105-L143 HydrophobicContact CG2-CD2 3.27Å; I105-L143 HydrophobicContact CG2-CG 3.67Å; E106-L143 VanDerWaalsContact O-CD2 3.29Å; E106-L143 WeakPolarHBondContact O-CD2 3.23Å; F108-L143 PolarHBondContact N-O 3Å; F118-L143 HydrophobicContact CE2-CB 3.76Å; F118-L143 HydrophobicContact CE2-CD1 3.8Å; F118-L143 HydrophobicContact CE2-CD2 4.06Å; F118-L143 HydrophobicContact CE2-CG 4.09Å; F118-L143 HydrophobicContact CZ-CB 3.9Å; F118-L143 HydrophobicContact CZ-CD1 4.07Å; F122-L143 HydrophobicContact CD2-CD1 3.67Å; F122-L143 HydrophobicContact CE2-CD1 4.32Å; I139-L143 HydrophobicContact CG2-CD1 3.83Å; I139-L143 PolarHBondContact O-N 3.36Å; L140-L143 PolarHBondContact O-N 3.26Å |
| 144 | L | 67.1 | Low | 67.3 | Low | 64 Ų | 64 | 70.9 Ų | 70.9 | 34% | 0.335 | 35% | 0.354 | S | S | . | . | trans | -96.7 | 24.9 | -175.4 | -70.9 | 176.7 | 0 | 0 | 0 | 113.9 | F108 F118 L140 Y146 | F108-L144 HydrophobicContact CD1-CD2 4.4Å; F118-L144 HydrophobicContact CE1-CD2 4.41Å; F118-L144 HydrophobicContact CZ-CD2 4.25Å; F118-L144 HydrophobicContact CZ-CG 4.45Å; L140-L144 HydrophobicContact CD1-CD1 3.54Å; L140-L144 HydrophobicContact CD1-CG 4.2Å; L140-L144 HydrophobicContact CD2-CD1 4.47Å; L140-L144 HydrophobicContact CG-CD1 3.78Å; L140-L144 WeakPolarHBondContact O-CB 3.29Å; L140-L144 PolarHBondContact O-N 3.47Å; L144-Y146 PolarHBondContact O-N 3.46Å | ||
| 145 | Y | 60.8 | Low | 66.8 | Low | 116 Ų | 116 | 70.8 Ų | 70.8 | 46% | 0.455 | 34% | 0.336 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62 | 13 | -173.3 | -166.9 | -100.9 | 0 | 0 | 0 | 116 | ||
| 146 | Y | 47.9 | Very low | 66.2 | Low | 182 Ų | 182 | 72.4 Ų | 72.4 | 71% | 0.714 | 34% | 0.344 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -127.5 | 21.3 | -174 | -86.7 | -80.9 | 0 | 0 | 0 | 116.1 | L144 | L144-Y146 PolarHBondContact O-N 3.46Š|
| 147 | L | 44.8 | Very low | 65.2 | Low | 218 Ų | 218 | 74.7 Ų | 74.7 | 100% | 1.141 | 36% | 0.359 | S | S | * | . | trans | -127.6 | 0 | 170 | -97.5 | 134.1 | 0 | 0 | 0 | 111.6 |
Retrieved 147 of 147 residues in 94.7 ms
(Link to these results)