| 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 | 35.8 | Very low | 30.5 | Very low | 222 Ų | 222 | 149.6 Ų | 149.6 | 100% | 1.094 | 82% | 0.818 | S | S | * | * | 0 | 60.3 | 0 | -84.5 | -176.8 | 142.4 | 0 | 0 | 107 | |||||
| 2 | D | 30 | Very low | 30.6 | Very low | 145 Ų | 145 | 154.5 Ų | 154.5 | 78% | 0.775 | 83% | 0.826 | S | S | * | * | 74.6 | 95.8 | 70 | -49.3 | -23.7 | 0 | 0 | 0 | 108 | |||||
| 3 | S | 29.7 | Very low | 30.1 | Very low | 102 Ų | 102 | 154.2 Ų | 154.2 | 71% | 0.713 | 82% | 0.824 | S | S | * | * | 81.2 | 122.1 | 89.5 | 83 | 0 | 0 | 0 | 0 | 114.3 | |||||
| 4 | E | 31.8 | Very low | 30 | Very low | 178 Ų | 178 | 156.7 Ų | 156.7 | 83% | 0.832 | 82% | 0.824 | S | S | * | * | trans | 70.5 | 126.9 | 136.4 | -95.5 | 175.4 | 169.2 | 0 | 0 | 123.2 | ||||
| 5 | Y | 27 | Very low | 30 | Very low | 199 Ų | 199 | 153.3 Ų | 153.3 | 78% | 0.78 | 81% | 0.813 | S | S | * | * | 80.1 | 111.9 | 125.7 | -145.4 | -89.7 | 0 | 0 | 0 | 120.7 | |||||
| 6 | S | 29.8 | Very low | 30.3 | Very low | 109 Ų | 109 | 154.9 Ų | 154.9 | 76% | 0.762 | 81% | 0.814 | S | S | * | * | -177.6 | 120.4 | 119.5 | 59.1 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 7 | D | 29.8 | Very low | 30.6 | Very low | 137 Ų | 137 | 154.4 Ų | 154.4 | 73% | 0.733 | 81% | 0.812 | S | S | * | * | trans | -54.5 | 151.6 | 162 | -88.2 | -41.2 | 0 | 0 | 0 | 113.5 | ||||
| 8 | S | 29.5 | Very low | 30.5 | Very low | 110 Ų | 110 | 155.1 Ų | 155.1 | 77% | 0.769 | 82% | 0.816 | S | S | * | * | 155.8 | 120.9 | 122.3 | 49.4 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 9 | L | 31.8 | Very low | 30.6 | Very low | 177 Ų | 177 | 157.4 Ų | 157.4 | 93% | 0.927 | 81% | 0.814 | S | S | * | * | trans | -168.2 | 95.8 | 137 | -105.3 | 156.4 | 0 | 0 | 0 | 109.5 | ||||
| 10 | D | 31.2 | Very low | 30.9 | Very low | 157 Ų | 157 | 155.1 Ų | 155.1 | 84% | 0.84 | 81% | 0.809 | S | S | * | * | trans | -55.3 | 145.7 | 163.3 | -84.6 | -42.4 | 0 | 0 | 0 | 112.2 | ||||
| 11 | S | 29.6 | Very low | 31.3 | Very low | 110 Ų | 110 | 153.6 Ų | 153.6 | 77% | 0.769 | 80% | 0.802 | S | S | * | * | -166.3 | 132.1 | 126.8 | 46.6 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 12 | F | 30.8 | Very low | 31.4 | Very low | 208 Ų | 208 | 150.5 Ų | 150.5 | 91% | 0.912 | 79% | 0.788 | S | S | * | * | trans | 91.3 | 96.8 | 157.1 | -96.6 | -97 | 0 | 0 | 0 | 120.1 | ||||
| 13 | N | 25.2 | Very low | 31.6 | Very low | 151 Ų | 151 | 153.1 Ų | 153.1 | 81% | 0.807 | 79% | 0.793 | S | S | * | * | trans | -100.1 | 133.8 | 170.6 | -147.8 | 6.2 | 0 | 0 | 0 | 108.8 | ||||
| 14 | F | 28.5 | Very low | 32.1 | Very low | 189 Ų | 189 | 154 Ų | 154 | 83% | 0.829 | 79% | 0.794 | S | S | * | * | trans | -149.5 | 81.9 | 159.9 | -147.2 | -95.1 | 0 | 0 | 0 | 111.7 | ||||
| 15 | T | 30.3 | Very low | 32.4 | Very low | 106 Ų | 106 | 151.6 Ų | 151.6 | 65% | 0.65 | 79% | 0.787 | S | S | * | * | trans | 48.6 | 104.4 | 139.1 | 56.6 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 16 | E | 33.3 | Very low | 32.6 | Very low | 179 Ų | 179 | 149.2 Ų | 149.2 | 84% | 0.836 | 79% | 0.788 | S | S | * | * | trans | -72 | 152.9 | 141.7 | -124.9 | 168.9 | 173.8 | 0 | 0 | 110.4 | ||||
| 17 | D | 35.6 | Very low | 33.1 | Very low | 145 Ų | 145 | 154 Ų | 154 | 78% | 0.775 | 80% | 0.795 | S | S | * | * | trans | 73.6 | 102.6 | 162.7 | -58.2 | -24.7 | 0 | 0 | 0 | 121.3 | ||||
| 18 | L | 30 | Very low | 33.5 | Very low | 168 Ų | 168 | 153 Ų | 153 | 88% | 0.88 | 80% | 0.795 | S | S | * | * | -165.3 | 102.4 | 124.7 | -156.4 | 64.4 | 0 | 0 | 0 | 112.3 | |||||
| 19 | Y | 31.2 | Very low | 34.2 | Very low | 198 Ų | 198 | 156.2 Ų | 156.2 | 78% | 0.776 | 80% | 0.797 | S | S | * | * | trans | -79.6 | 139.6 | 163 | -143.8 | -98.6 | 0 | 0 | 0 | 108.8 | D21 | Y19-D21 WeakPolarHBondContact CE1-OD1 3.33Š| ||
| 20 | P | 36.8 | Very low | 34.8 | Very low | 111 Ų | 111 | 154.2 Ų | 154.2 | 72% | 0.721 | 79% | 0.787 | S | S | * | * | trans | -127.5 | 130 | 132.2 | 32 | -21.2 | 0 | 0 | 0 | 111.1 | I22 | P20-I22 PolarHBondContact O-N 2.94Š| ||
| 21 | D | 40.5 | Very low | 35.3 | Very low | 124 Ų | 124 | 153.3 Ų | 153.3 | 66% | 0.663 | 78% | 0.782 | S | S | * | * | trans | -46.5 | 126.9 | 155.7 | -75.8 | -55.9 | 0 | 0 | 0 | 109.6 | Y19 | Y19-D21 WeakPolarHBondContact CE1-OD1 3.33Š| ||
| 22 | I | 38 | Very low | 36.2 | Very low | 157 Ų | 157 | 155.4 Ų | 155.4 | 81% | 0.805 | 78% | 0.784 | S | S | * | * | trans | 168.7 | 91.4 | 145.6 | -80.2 | 145.6 | 0 | 0 | 0 | 105.7 | P20 | P20-I22 PolarHBondContact O-N 2.94Š| ||
| 23 | F | 33.9 | Very low | 37.1 | Very low | 200 Ų | 200 | 152.4 Ų | 152.4 | 88% | 0.877 | 78% | 0.776 | S | S | * | * | trans | -165.5 | 61.9 | 137.8 | -112.4 | -78.1 | 0 | 0 | 0 | 108.3 | ||||
| 24 | V | 40.2 | Very low | 38.5 | Very low | 121 Ų | 121 | 149.1 Ų | 149.1 | 73% | 0.733 | 76% | 0.764 | S | S | * | * | trans | -73.6 | 134.1 | 160 | 170.1 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 25 | N | 37.8 | Very low | 40.2 | Very low | 127 Ų | 127 | 149 Ų | 149 | 68% | 0.679 | 77% | 0.765 | S | S | * | * | trans | 86.3 | 92 | 169.8 | -53.8 | -26.9 | 0 | 0 | 0 | 117.6 | ||||
| 26 | N | 31.9 | Very low | 42.1 | Very low | 149 Ų | 149 | 147.3 Ų | 147.3 | 80% | 0.797 | 75% | 0.752 | S | S | * | * | 171.9 | 55 | 119 | -82.9 | -18.2 | 0 | 0 | 0 | 110.7 | T28 | N26-T28 PolarHBondContact O-N 2.67Š| |||
| 27 | F | 40.3 | Very low | 44.2 | Very low | 209 Ų | 209 | 143.4 Ų | 143.4 | 92% | 0.917 | 73% | 0.734 | S | S | * | * | trans | -88.1 | 84.9 | 150.6 | -115.2 | -95 | 0 | 0 | 0 | 105.9 | E29 | F27-E29 PolarHBondContact O-N 2.95Š| ||
| 28 | T | 38.2 | Very low | 46.4 | Very low | 118 Ų | 118 | 141.5 Ų | 141.5 | 72% | 0.724 | 73% | 0.729 | S | S | * | * | trans | -38.6 | 125.5 | 156.5 | -20.8 | 0 | 0 | 0 | 0 | 106.7 | N26 L30 | N26-T28 PolarHBondContact O-N 2.67Å; T28-L30 PolarHBondContact O-N 2.82Å | ||
| 29 | E | 43.6 | Very low | 48.5 | Very low | 176 Ų | 176 | 135.5 Ų | 135.5 | 82% | 0.822 | 70% | 0.697 | S | S | * | * | trans | -49.5 | 94.1 | 164.8 | -73.6 | -179 | 148.7 | 0 | 0 | 107.6 | F27 N31 | F27-E29 PolarHBondContact O-N 2.95Å; E29-N31 VanDerWaalsContact C-N 3.26Å; E29-N31 PolarHBondContact O-N 3.28Å | ||
| 30 | L | 43.8 | Very low | 50.9 | Low | 136 Ų | 136 | 126.8 Ų | 126.8 | 71% | 0.712 | 66% | 0.664 | S | S | * | * | trans | -69.8 | 100.6 | 165.7 | -167.5 | 76.5 | 0 | 0 | 0 | 102.7 | T28 L32 | T28-L30 PolarHBondContact O-N 2.82Å; L30-L32 HydrophobicContact CD2-CD1 4.35Å; L30-L32 PolarHBondContact O-N 3.36Å | ||
| 31 | N | 42.3 | Very low | 53.3 | Low | 138 Ų | 138 | 125.8 Ų | 125.8 | 74% | 0.738 | 65% | 0.651 | S | S | * | * | trans | -48.3 | 92.4 | 170.7 | -74.2 | -57 | 0 | 0 | 0 | 108.2 | E29 L33 | E29-N31 VanDerWaalsContact C-N 3.26Å; E29-N31 PolarHBondContact O-N 3.28Å; N31-L33 PolarHBondContact O-N 3.21Å | ||
| 32 | L | 48.4 | Very low | 55.5 | Low | 154 Ų | 154 | 123.5 Ų | 123.5 | 81% | 0.806 | 64% | 0.642 | S | S | * | * | trans | -81.8 | 54.6 | 179.8 | -144.2 | 102.4 | 0 | 0 | 0 | 107.9 | L30 | L30-L32 HydrophobicContact CD2-CD1 4.35Å; L30-L32 PolarHBondContact O-N 3.36Å | ||
| 33 | L | 49.7 | Very low | 57.8 | Low | 144 Ų | 144 | 116 Ų | 116 | 75% | 0.754 | 60% | 0.604 | S | S | * | * | trans | -66.3 | 125.5 | 159.5 | -67 | 176.3 | 0 | 0 | 0 | 105.2 | N31 E35 | N31-L33 PolarHBondContact O-N 3.21Å; L33-E35 PolarHBondContact O-N 3.13Å | ||
| 34 | P | 55.1 | Low | 60.5 | Low | 83 Ų | 83 | 108 Ų | 108 | 54% | 0.539 | 57% | 0.57 | S | S | . | * | trans | -54.7 | 114 | 175.6 | 20.8 | -30.1 | 0 | 0 | 0 | 107.9 | I36 D102 | P34-I36 PolarHBondContact O-N 3.28Å; P34-I36 VanDerWaalsContact O-N 3.09Å; P34-D102 HydrophobicContact CB-CB 4.35Å | ||
| 35 | E | 62.4 | Low | 62.9 | Low | 185 Ų | 185 | 106.1 Ų | 106.1 | 86% | 0.864 | 56% | 0.558 | S | S | * | * | trans | -68 | 111.6 | -178.5 | -168 | 176.4 | -177 | 0 | 0 | 107.6 | L33 Q37 | L33-E35 PolarHBondContact O-N 3.13Å; E35-Q37 PolarHBondContact O-N 3.36Å; E35-Q37 VanDerWaalsContact O-N 3.09Å | ||
| 36 | I | 71.2 | Confident | 65.5 | Low | 72 Ų | 72 | 103.1 Ų | 103.1 | 37% | 0.369 | 54% | 0.542 | S | S | . | . | trans | -58.7 | 118.5 | -180 | -57.6 | 176.3 | 0 | 0 | 0 | 107.5 | P34 Q40 I41 | P34-I36 PolarHBondContact O-N 3.28Å; P34-I36 VanDerWaalsContact O-N 3.09Å; I36-Q40 HydrophobicContact CG2-CB 3.62Å; I36-I41 HydrophobicContact CB-CG1 4.39Å; I36-I41 HydrophobicContact CG2-CD1 4.5Å; I36-I41 HydrophobicContact CG2-CG1 3.64Å | ||
| 37 | Q | 77.9 | Confident | 68.3 | Low | 97 Ų | 97 | 96.6 Ų | 96.6 | 45% | 0.453 | 51% | 0.506 | S | S | . | . | trans | -64.8 | 145.5 | -179 | -63.9 | -174 | -7.3 | 0 | 0 | 109.5 | E35 I39 Q40 I41 | E35-Q37 PolarHBondContact O-N 3.36Å; E35-Q37 VanDerWaalsContact O-N 3.09Å; Q37-I39 HydrophobicContact CB-CG2 3.85Å; Q37-I39 PolarHBondContact O-N 3.28Å; Q37-Q40 HydrophobicContact CB-CG 4.45Å; Q37-Q40 WeakPolarHBondContact O-CB 3.48Å; Q37-Q40 PolarHBondContact O-N 2.92Å; Q37-I41 PolarHBondContact O-N 3.27Å | ||
| 38 | P | 81.1 | Confident | 70.8 | Confident | 104 Ų | 104 | 88.1 Ų | 88.1 | 68% | 0.675 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -50.3 | -30.2 | 178.4 | -29.1 | 34.5 | 0 | 0 | 0 | 113.4 | I41 V42 | P38-I41 WeakPolarHBondContact O-CB 2.93Å; P38-I41 PolarHBondContact O-N 3.14Å; P38-V42 WeakPolarHBondContact O-CG2 3.35Å; P38-V42 PolarHBondContact O-N 3.4Å |
| 39 | I | 75.1 | Confident | 73.4 | Confident | 42 Ų | 42 | 86.3 Ų | 86.3 | 22% | 0.215 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -70.8 | -39.3 | 176.1 | -175.2 | 60.8 | 0 | 0 | 0 | 114.5 | Q37 I41 V42 S43 L283 L287 | Q37-I39 HydrophobicContact CB-CG2 3.85Å; Q37-I39 PolarHBondContact O-N 3.28Å; I39-I41 PolarHBondContact O-N 3.41Å; I39-V42 HydrophobicContact CD1-CB 4.43Å; I39-V42 PolarHBondContact O-N 3.41Å; I39-S43 WeakPolarHBondContact O-CB 3.39Å; I39-S43 PolarHBondContact O-N 3.23Å; I39-S43 PolarHBondContact O-OG 2.92Å; I39-L283 HydrophobicContact CB-CD1 4.37Å; I39-L283 HydrophobicContact CD1-CD1 3.04Å; I39-L283 HydrophobicContact CD1-CG 4.46Å; I39-L283 HydrophobicContact CG1-CB 4.47Å; I39-L283 HydrophobicContact CG1-CD1 3.23Å; I39-L283 HydrophobicContact CG1-CG 4.35Å; I39-L287 HydrophobicContact CD1-CD2 4.36Å |
| 40 | Q | 81.4 | Confident | 75.8 | Confident | 16 Ų | 16 | 78 Ų | 78 | 8% | 0.075 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -63.7 | -38.3 | 175 | -71.2 | 168.2 | -40.3 | 0 | 0 | 109 | I36 Q37 S43 L44 L99 | I36-Q40 HydrophobicContact CG2-CB 3.62Å; Q37-Q40 HydrophobicContact CB-CG 4.45Å; Q37-Q40 WeakPolarHBondContact O-CB 3.48Å; Q37-Q40 PolarHBondContact O-N 2.92Å; Q40-S43 PolarHBondContact O-N 3.34Å; Q40-L44 WeakPolarHBondContact O-CB 3.46Å; Q40-L44 WeakPolarHBondContact O-CG 3.38Å; Q40-L44 PolarHBondContact O-N 3.38Å; Q40-L99 HydrophobicContact CG-CD1 4.11Å |
| 41 | I | 86.3 | Confident | 78.2 | Confident | 89 Ų | 89 | 73.1 Ų | 73.1 | 46% | 0.456 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -58.8 | -51.1 | 172.7 | -56.1 | 178.2 | 0 | 0 | 0 | 111 | I36 Q37 P38 I39 S43 L44 V45 | I36-I41 HydrophobicContact CB-CG1 4.39Å; I36-I41 HydrophobicContact CG2-CD1 4.5Å; I36-I41 HydrophobicContact CG2-CG1 3.64Å; Q37-I41 PolarHBondContact O-N 3.27Å; P38-I41 WeakPolarHBondContact O-CB 2.93Å; P38-I41 PolarHBondContact O-N 3.14Å; I39-I41 PolarHBondContact O-N 3.41Å; I41-S43 VanDerWaalsContact C-N 3.28Å; I41-S43 PolarHBondContact O-N 3.32Å; I41-L44 PolarHBondContact O-N 2.9Å; I41-V45 HydrophobicContact CG2-CG2 4.5Å; I41-V45 WeakPolarHBondContact O-CG2 3.45Å; I41-V45 PolarHBondContact O-N 3.48Å |
| 42 | V | 86.5 | Confident | 80.7 | Confident | 76 Ų | 76 | 72.4 Ų | 72.4 | 46% | 0.461 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -57.1 | -44.5 | 177.9 | 170.3 | 0 | 0 | 0 | 0 | 111.1 | P38 I39 V45 L46 | P38-V42 WeakPolarHBondContact O-CG2 3.35Å; P38-V42 PolarHBondContact O-N 3.4Å; I39-V42 HydrophobicContact CD1-CB 4.43Å; I39-V42 PolarHBondContact O-N 3.41Å; V42-V45 PolarHBondContact O-N 2.89Å; V42-L46 HydrophobicContact CG1-CD1 4.22Å; V42-L46 WeakPolarHBondContact O-CG 3.41Å; V42-L46 PolarHBondContact O-N 3.18Å |
| 43 | S | 85.9 | Confident | 82.8 | Confident | 1 Ų | 1 | 69.3 Ų | 69.3 | 1% | 0.007 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -66.4 | -41.6 | -179 | -56.6 | 0 | 0 | 0 | 0 | 112 | I39 Q40 I41 V45 L46 Y47 V286 | I39-S43 WeakPolarHBondContact O-CB 3.39Å; I39-S43 PolarHBondContact O-N 3.23Å; I39-S43 PolarHBondContact O-OG 2.92Å; Q40-S43 PolarHBondContact O-N 3.34Å; I41-S43 VanDerWaalsContact C-N 3.28Å; I41-S43 PolarHBondContact O-N 3.32Å; S43-V45 VanDerWaalsContact C-N 3.35Å; S43-V45 PolarHBondContact O-N 3.23Å; S43-L46 PolarHBondContact O-N 3.03Å; S43-Y47 WeakPolarHBondContact O-CB 3.42Å; S43-Y47 VanDerWaalsContact O-CG 3.28Å; S43-Y47 PolarHBondContact O-N 3.24Å; S43-V286 VanDerWaalsContact CB-CG1 3.45Å; S43-V286 WeakPolarHBondContact OG-CG1 3.37Å |
| 44 | L | 90.8 | Very high | 84.8 | Confident | 31 Ų | 31 | 62.5 Ų | 62.5 | 16% | 0.162 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -62 | -40.4 | 173.6 | -74.2 | 167.8 | 0 | 0 | 0 | 112 | Q40 I41 Y47 A48 M96 L99 A100 | Q40-L44 WeakPolarHBondContact O-CB 3.46Å; Q40-L44 WeakPolarHBondContact O-CG 3.38Å; Q40-L44 PolarHBondContact O-N 3.38Å; I41-L44 PolarHBondContact O-N 2.9Å; L44-Y47 PolarHBondContact O-N 3.37Å; L44-A48 WeakPolarHBondContact O-CB 3.26Å; L44-A48 PolarHBondContact O-N 3.32Å; L44-M96 HydrophobicContact CD2-CB 3.94Å; L44-M96 HydrophobicContact CD2-CE 4.42Å; L44-M96 HydrophobicContact CD2-CG 4.3Å; L44-M96 WeakPolarHBondContact CD2-O 3.41Å; L44-L99 HydrophobicContact CD2-CB 4.29Å; L44-L99 HydrophobicContact CD2-CD2 3.99Å; L44-L99 HydrophobicContact CD2-CG 4.29Å; L44-L99 HydrophobicContact CG-CD2 3.99Å; L44-L99 HydrophobicContact CG-CG 4.31Å; L44-A100 HydrophobicContact CD1-CB 4.12Å; L44-A100 HydrophobicContact CD2-CB 4.48Å |
| 45 | V | 91.9 | Very high | 86.7 | Confident | 81 Ų | 81 | 60.3 Ų | 60.3 | 49% | 0.491 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -63.5 | -45.4 | 174.5 | 170.8 | 0 | 0 | 0 | 0 | 110.7 | I41 V42 S43 Y47 A48 L49 | I41-V45 HydrophobicContact CG2-CG2 4.5Å; I41-V45 WeakPolarHBondContact O-CG2 3.45Å; I41-V45 PolarHBondContact O-N 3.48Å; V42-V45 PolarHBondContact O-N 2.89Å; S43-V45 VanDerWaalsContact C-N 3.35Å; S43-V45 PolarHBondContact O-N 3.23Å; V45-Y47 PolarHBondContact O-N 2.95Å; V45-A48 PolarHBondContact O-N 3.37Å; V45-L49 HydrophobicContact CG1-CD1 4.29Å; V45-L49 WeakPolarHBondContact O-CG 3.3Å; V45-L49 PolarHBondContact O-N 3.39Å |
| 46 | L | 90.8 | Very high | 88.2 | Confident | 65 Ų | 65 | 55.1 Ų | 55.1 | 34% | 0.34 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -62.2 | -43.7 | 176.9 | -68.7 | 174.5 | 0 | 0 | 0 | 111.8 | V42 S43 L49 V50 L287 C290 | V42-L46 HydrophobicContact CG1-CD1 4.22Å; V42-L46 WeakPolarHBondContact O-CG 3.41Å; V42-L46 PolarHBondContact O-N 3.18Å; S43-L46 PolarHBondContact O-N 3.03Å; L46-L49 WeakPolarHBondContact O-CB 3.48Å; L46-L49 PolarHBondContact O-N 2.8Å; L46-V50 WeakPolarHBondContact O-CG2 3.3Å; L46-V50 PolarHBondContact O-N 3.18Å; L46-L287 HydrophobicContact CD1-CD2 4.28Å; L46-C290 HydrophobicContact CB-CB 4.48Å; L46-C290 HydrophobicContact CD1-CB 4.31Å |
| 47 | Y | 91.8 | Very high | 89.2 | Confident | 11 Ų | 11 | 52.6 Ų | 52.6 | 4% | 0.043 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -59.4 | -45.5 | 173.8 | -79 | -6.4 | 0 | 0 | 0 | 112.5 | S43 L44 V45 L49 V50 V51 L92 M96 L99 V289 C290 Y293 | S43-Y47 WeakPolarHBondContact O-CB 3.42Å; S43-Y47 VanDerWaalsContact O-CG 3.28Å; S43-Y47 PolarHBondContact O-N 3.24Å; L44-Y47 PolarHBondContact O-N 3.37Å; V45-Y47 PolarHBondContact O-N 2.95Å; Y47-L49 VanDerWaalsContact C-N 3.34Å; Y47-L49 PolarHBondContact O-N 3.43Å; Y47-V50 WeakPolarHBondContact O-CB 3.41Å; Y47-V50 PolarHBondContact O-N 3.23Å; Y47-V51 WeakPolarHBondContact O-CG2 3.38Å; Y47-V51 PolarHBondContact O-N 2.74Å; Y47-L92 HydrophobicContact CD1-CD1 4.42Å; Y47-L92 HydrophobicContact CD1-CD2 3.65Å; Y47-L92 HydrophobicContact CD1-CG 4.43Å; Y47-L92 HydrophobicContact CD2-CD2 3.77Å; Y47-L92 HydrophobicContact CE1-CD2 4.34Å; Y47-L92 HydrophobicContact CE2-CD2 4.48Å; Y47-L92 HydrophobicContact CG-CD2 3.32Å; Y47-L92 HydrophobicContact CG-CG 4.5Å; Y47-M96 HydrophobicContact CD2-CG 3.88Å; Y47-M96 HydrophobicContact CG-CG 4.34Å; Y47-L99 HydrophobicContact CD2-CD2 3.88Å; Y47-L99 HydrophobicContact CE2-CD2 3.63Å; Y47-V289 VanDerWaalsContact OH-CG1 3.28Å; Y47-V289 WeakPolarHBondContact OH-CG1 3.48Å; Y47-C290 HydrophobicContact CD1-CB 4.27Å; Y47-C290 VanDerWaalsContact CD1-SG 3.56Å; Y47-C290 HydrophobicContact CE1-CB 3.9Å; Y47-C290 WeakPolarHBondContact CE1-SG 3.16Å; Y47-Y293 HydrophobicContact CE1-CD2 4.31Å |
| 48 | A | 93.7 | Very high | 89.9 | Confident | 32 Ų | 32 | 48.1 Ų | 48.1 | 26% | 0.264 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -60.9 | -43.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | L44 V45 V50 V51 L52 M96 | L44-A48 WeakPolarHBondContact O-CB 3.26Å; L44-A48 PolarHBondContact O-N 3.32Å; V45-A48 PolarHBondContact O-N 3.37Å; A48-V50 VanDerWaalsContact C-N 3.31Å; A48-V50 PolarHBondContact O-N 2.93Å; A48-V51 PolarHBondContact O-N 3.18Å; A48-L52 WeakPolarHBondContact O-CB 3.4Å; A48-L52 VanDerWaalsContact O-CG 3.24Å; A48-L52 WeakPolarHBondContact O-CG 3.48Å; A48-L52 PolarHBondContact O-N 2.95Å; A48-M96 HydrophobicContact CB-CE 4.17Å |
| 49 | L | 92.9 | Very high | 90.5 | Very high | 79 Ų | 79 | 45.1 Ų | 45.1 | 41% | 0.414 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -61.1 | -39.6 | 174.9 | -71.1 | 172.9 | 0 | 0 | 0 | 112 | V45 L46 Y47 L52 L53 | V45-L49 HydrophobicContact CG1-CD1 4.29Å; V45-L49 WeakPolarHBondContact O-CG 3.3Å; V45-L49 PolarHBondContact O-N 3.39Å; L46-L49 WeakPolarHBondContact O-CB 3.48Å; L46-L49 PolarHBondContact O-N 2.8Å; Y47-L49 VanDerWaalsContact C-N 3.34Å; Y47-L49 PolarHBondContact O-N 3.43Å; L49-L52 PolarHBondContact O-N 3.29Å; L49-L53 VanDerWaalsContact O-CB 3.31Å; L49-L53 WeakPolarHBondContact O-CB 3.35Å; L49-L53 VanDerWaalsContact O-CG 3.26Å; L49-L53 WeakPolarHBondContact O-CG 3.43Å; L49-L53 PolarHBondContact O-N 3Å |
| 50 | V | 92.4 | Very high | 91.2 | Very high | 2 Ų | 2 | 46.5 Ų | 46.5 | 1% | 0.012 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -61.2 | -46.7 | 174.8 | 171.4 | 0 | 0 | 0 | 0 | 110.7 | L46 Y47 A48 G54 L92 F294 C297 | L46-V50 WeakPolarHBondContact O-CG2 3.3Å; L46-V50 PolarHBondContact O-N 3.18Å; Y47-V50 WeakPolarHBondContact O-CB 3.41Å; Y47-V50 PolarHBondContact O-N 3.23Å; A48-V50 VanDerWaalsContact C-N 3.31Å; A48-V50 PolarHBondContact O-N 2.93Å; V50-G54 VanDerWaalsContact O-CA 3.27Å; V50-G54 WeakPolarHBondContact O-CA 3.38Å; V50-G54 PolarHBondContact O-N 3.18Å; V50-L92 HydrophobicContact CB-CD1 3.74Å; V50-L92 HydrophobicContact CG1-CD1 3.29Å; V50-F294 HydrophobicContact CG2-CB 4.22Å; V50-F294 HydrophobicContact CG2-CD2 3.89Å; V50-C297 VanDerWaalsContact CA-SG 3.51Å; V50-C297 WeakPolarHBondContact CG1-SG 3.42Å; V50-C297 PolarHBondContact O-SG 3.01Å |
| 51 | V | 94.6 | Very high | 91.6 | Very high | 33 Ų | 33 | 45.9 Ų | 45.9 | 20% | 0.2 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -63.4 | -48.4 | 178.2 | 175.3 | 0 | 0 | 0 | 0 | 111 | Y47 A48 L53 V55 L92 P93 | Y47-V51 WeakPolarHBondContact O-CG2 3.38Å; Y47-V51 PolarHBondContact O-N 2.74Å; A48-V51 PolarHBondContact O-N 3.18Å; V51-L53 VanDerWaalsContact C-N 3.33Å; V51-L53 PolarHBondContact O-N 3.38Å; V51-V55 HydrophobicContact CG1-CG2 4.02Å; V51-V55 VanDerWaalsContact O-CB 3.32Å; V51-V55 WeakPolarHBondContact O-CB 3.48Å; V51-V55 WeakPolarHBondContact O-CG2 3.3Å; V51-V55 PolarHBondContact O-N 3.26Å; V51-L92 HydrophobicContact CG2-CB 3.95Å; V51-L92 HydrophobicContact CG2-CD2 4.32Å; V51-P93 HydrophobicContact CG2-CG 4.16Å |
| 52 | L | 94.3 | Very high | 91.8 | Very high | 123 Ų | 123 | 43.2 Ų | 43.2 | 64% | 0.644 | 26% | 0.255 | S | S | * | . | H | α-helix | trans | -65.6 | -31.2 | -176.4 | -71.7 | 174.3 | 0 | 0 | 0 | 113.6 | A48 L49 P56 | A48-L52 WeakPolarHBondContact O-CB 3.4Å; A48-L52 VanDerWaalsContact O-CG 3.24Å; A48-L52 WeakPolarHBondContact O-CG 3.48Å; A48-L52 PolarHBondContact O-N 2.95Å; L49-L52 PolarHBondContact O-N 3.29Å; L52-P56 VanDerWaalsContact O-CD 3.26Å; L52-P56 WeakPolarHBondContact O-CD 3.39Å; L52-P56 WeakPolarHBondContact O-CG 3.43Å |
| 53 | L | 92.3 | Very high | 92 | Very high | 90 Ų | 90 | 45.9 Ų | 45.9 | 47% | 0.471 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -92.6 | -42.6 | 177.7 | -63.3 | 174.4 | 0 | 0 | 0 | 111.8 | L49 V51 G57 C297 | L49-L53 VanDerWaalsContact O-CB 3.31Å; L49-L53 WeakPolarHBondContact O-CB 3.35Å; L49-L53 VanDerWaalsContact O-CG 3.26Å; L49-L53 WeakPolarHBondContact O-CG 3.43Å; L49-L53 PolarHBondContact O-N 3Å; V51-L53 VanDerWaalsContact C-N 3.33Å; V51-L53 PolarHBondContact O-N 3.38Å; L53-G57 PolarHBondContact O-N 2.98Å; L53-G57 VanDerWaalsContact O-N 3.14Å; L53-C297 HydrophobicContact CB-CB 4.44Å |
| 54 | G | 93.2 | Very high | 91.9 | Very high | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -74.8 | -44.1 | -170.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | V50 N58 C297 | V50-G54 VanDerWaalsContact O-CA 3.27Å; V50-G54 WeakPolarHBondContact O-CA 3.38Å; V50-G54 PolarHBondContact O-N 3.18Å; G54-N58 VanDerWaalsContact O-CB 3.26Å; G54-N58 WeakPolarHBondContact O-CB 3.26Å; G54-N58 PolarHBondContact O-N 2.94Å; G54-N58 PolarHBondContact O-ND2 3.43Å; G54-C297 WeakPolarHBondContact CA-SG 3.26Å; G54-C297 PolarHBondContact N-SG 3.18Å |
| 55 | V | 95.1 | Very high | 91.6 | Very high | 38 Ų | 38 | 44.8 Ų | 44.8 | 23% | 0.23 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -61.9 | -57.8 | 179.6 | 175.5 | 0 | 0 | 0 | 0 | 111.5 | V51 G57 A59 L86 C89 L90 | V51-V55 HydrophobicContact CG1-CG2 4.02Å; V51-V55 VanDerWaalsContact O-CB 3.32Å; V51-V55 WeakPolarHBondContact O-CB 3.48Å; V51-V55 WeakPolarHBondContact O-CG2 3.3Å; V51-V55 PolarHBondContact O-N 3.26Å; V55-G57 VanDerWaalsContact C-N 3.34Å; V55-G57 PolarHBondContact O-N 3.49Å; V55-A59 WeakPolarHBondContact O-CB 3.25Å; V55-A59 PolarHBondContact O-N 2.91Å; V55-L86 HydrophobicContact CB-CD1 4.37Å; V55-L86 HydrophobicContact CG1-CD1 4.05Å; V55-L86 HydrophobicContact CG2-CD1 4.47Å; V55-C89 HydrophobicContact CG2-CB 3.78Å; V55-L90 HydrophobicContact CG1-CD2 4.45Å; V55-L90 HydrophobicContact CG2-CD2 4.17Å |
| 56 | P | 93.7 | Very high | 91.4 | Very high | 76 Ų | 76 | 42.4 Ų | 42.4 | 49% | 0.494 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -66.7 | -36.8 | -179.5 | 25.5 | -33.2 | 0 | 0 | 0 | 112.2 | L52 L60 | L52-P56 VanDerWaalsContact O-CD 3.26Å; L52-P56 WeakPolarHBondContact O-CD 3.39Å; L52-P56 WeakPolarHBondContact O-CG 3.43Å; P56-L60 WeakPolarHBondContact O-CB 3.49Å; P56-L60 PolarHBondContact O-N 3.41Å |
| 57 | G | 91.5 | Very high | 91 | Very high | 19 Ų | 19 | 46.8 Ų | 46.8 | 20% | 0.196 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -61.9 | -51.4 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | L53 V55 L60 V61 | L53-G57 PolarHBondContact O-N 2.98Å; L53-G57 VanDerWaalsContact O-N 3.14Å; V55-G57 VanDerWaalsContact C-N 3.34Å; V55-G57 PolarHBondContact O-N 3.49Å; G57-L60 PolarHBondContact O-N 3.47Å; G57-V61 WeakPolarHBondContact O-CG2 3.39Å; G57-V61 PolarHBondContact O-N 3.2Å; G57-V61 VanDerWaalsContact O-N 3.12Å |
| 58 | N | 93.6 | Very high | 90.5 | Very high | 2 Ų | 2 | 48.9 Ų | 48.9 | 1% | 0.011 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -72.3 | -34.6 | 179.6 | -71.3 | -62.7 | 0 | 0 | 0 | 112.2 | G54 L60 V61 L62 D85 L86 S296 P300 | G54-N58 VanDerWaalsContact O-CB 3.26Å; G54-N58 WeakPolarHBondContact O-CB 3.26Å; G54-N58 PolarHBondContact O-N 2.94Å; G54-N58 PolarHBondContact O-ND2 3.43Å; N58-L60 VanDerWaalsContact C-N 3.34Å; N58-L60 PolarHBondContact O-N 2.89Å; N58-V61 PolarHBondContact O-N 3.29Å; N58-L62 WeakPolarHBondContact O-CG 3.3Å; N58-L62 PolarHBondContact O-N 2.74Å; N58-D85 HydrophobicContact CB-CB 4.46Å; N58-D85 WeakPolarHBondContact OD1-CB 3.34Å; N58-L86 HydrophobicContact CB-CB 4.11Å; N58-S296 PolarHBondContact ND2-O 2.78Å; N58-P300 WeakPolarHBondContact OD1-CG 3.35Å |
| 59 | A | 93.4 | Very high | 89.8 | Confident | 41 Ų | 41 | 49.3 Ų | 49.3 | 34% | 0.339 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -60.9 | -41.5 | 172 | 0 | 0 | 0 | 0 | 0 | 112.1 | V55 L62 W63 | V55-A59 WeakPolarHBondContact O-CB 3.25Å; V55-A59 PolarHBondContact O-N 2.91Å; A59-L62 PolarHBondContact O-N 2.97Å; A59-W63 WeakPolarHBondContact O-CB 3.38Å; A59-W63 PolarHBondContact O-N 3.4Å |
| 60 | L | 90.2 | Very high | 89.3 | Confident | 71 Ų | 71 | 52.7 Ų | 52.7 | 37% | 0.372 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -62.5 | -43.6 | 174.2 | 178.2 | 63.9 | 0 | 0 | 0 | 111.6 | P56 G57 N58 W63 V64 M314 | P56-L60 WeakPolarHBondContact O-CB 3.49Å; P56-L60 PolarHBondContact O-N 3.41Å; G57-L60 PolarHBondContact O-N 3.47Å; N58-L60 VanDerWaalsContact C-N 3.34Å; N58-L60 PolarHBondContact O-N 2.89Å; L60-W63 PolarHBondContact O-N 2.87Å; L60-V64 HydrophobicContact CD1-CG2 4.02Å; L60-V64 HydrophobicContact CG-CG2 4.4Å; L60-V64 WeakPolarHBondContact O-CB 3.41Å; L60-V64 VanDerWaalsContact O-CG2 3.31Å; L60-V64 WeakPolarHBondContact O-CG2 3.4Å; L60-V64 PolarHBondContact O-N 3.33Å; L60-M314 HydrophobicContact CD2-SD 4Å |
| 61 | V | 89 | Confident | 89 | Confident | 4 Ų | 4 | 62.4 Ų | 62.4 | 2% | 0.024 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -61.6 | -45 | 176.6 | 177.8 | 0 | 0 | 0 | 0 | 110.5 | G57 N58 W63 V64 T65 A82 P300 F310 | G57-V61 WeakPolarHBondContact O-CG2 3.39Å; G57-V61 PolarHBondContact O-N 3.2Å; G57-V61 VanDerWaalsContact O-N 3.12Å; N58-V61 PolarHBondContact O-N 3.29Å; V61-W63 PolarHBondContact O-N 3.1Å; V61-V64 PolarHBondContact O-N 3.32Å; V61-T65 HydrophobicContact CG1-CG2 4.14Å; V61-T65 WeakPolarHBondContact O-CB 3.49Å; V61-T65 VanDerWaalsContact O-CG2 3.25Å; V61-T65 WeakPolarHBondContact O-CG2 3.4Å; V61-T65 PolarHBondContact O-N 3Å; V61-T65 PolarHBondContact O-OG1 3.12Å; V61-A82 HydrophobicContact CB-CB 3.79Å; V61-A82 HydrophobicContact CG1-CB 3.58Å; V61-P300 HydrophobicContact CG2-CB 4.08Å; V61-P300 HydrophobicContact CG2-CG 4.19Å; V61-F310 HydrophobicContact CB-CZ 4.25Å; V61-F310 HydrophobicContact CG1-CE2 4.12Å; V61-F310 HydrophobicContact CG1-CZ 4.11Å; V61-F310 HydrophobicContact CG2-CE1 4.34Å; V61-F310 HydrophobicContact CG2-CZ 3.73Å |
| 62 | L | 91.3 | Very high | 88.7 | Confident | 33 Ų | 33 | 62.8 Ų | 62.8 | 17% | 0.173 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -58.6 | -47 | 175.3 | -77.7 | 175.9 | 0 | 0 | 0 | 111.8 | N58 A59 T65 G66 L79 A82 L83 L86 | N58-L62 WeakPolarHBondContact O-CG 3.3Å; N58-L62 PolarHBondContact O-N 2.74Å; A59-L62 PolarHBondContact O-N 2.97Å; L62-T65 PolarHBondContact O-N 3.5Å; L62-T65 PolarHBondContact O-OG1 2.76Å; L62-G66 PolarHBondContact O-N 2.99Å; L62-L79 HydrophobicContact CD2-CD1 3.65Å; L62-L79 HydrophobicContact CD2-CG 4.16Å; L62-L79 VanDerWaalsContact CD2-O 3.22Å; L62-L79 WeakPolarHBondContact CD2-O 3.24Å; L62-A82 HydrophobicContact CD2-CB 3.88Å; L62-A82 HydrophobicContact CG-CB 3.75Å; L62-L83 HydrophobicContact CD2-CB 4.08Å; L62-L86 HydrophobicContact CD1-CB 4.3Å; L62-L86 HydrophobicContact CD1-CD2 3.49Å; L62-L86 VanDerWaalsContact CD1-CD2 3.49Å |
| 63 | W | 89.4 | Confident | 88.4 | Confident | 132 Ų | 132 | 57.3 Ų | 57.3 | 50% | 0.5 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -60.5 | -52 | 178.4 | 178.6 | -93.3 | 0 | 0 | 0 | 111.9 | A59 L60 V61 T65 G66 F67 | A59-W63 WeakPolarHBondContact O-CB 3.38Å; A59-W63 PolarHBondContact O-N 3.4Å; L60-W63 PolarHBondContact O-N 2.87Å; V61-W63 PolarHBondContact O-N 3.1Å; W63-T65 VanDerWaalsContact C-N 3.35Å; W63-T65 PolarHBondContact O-N 3Å; W63-G66 PolarHBondContact O-N 3.39Å; W63-F67 AromaticContact CD2-CD2 3.85Å; W63-F67 HydrophobicContact CD2-CD2 3.85Å; W63-F67 HydrophobicContact CD2-CE2 4.45Å; W63-F67 AromaticContact CE3-CD2 3.57Å; W63-F67 HydrophobicContact CE3-CD2 3.57Å; W63-F67 AromaticContact CE3-CE2 3.73Å; W63-F67 HydrophobicContact CE3-CE2 3.73Å; W63-F67 HydrophobicContact CG-CD2 4.4Å; W63-F67 HydrophobicContact CH2-CD2 4.47Å; W63-F67 AromaticContact CZ3-CD2 3.91Å; W63-F67 HydrophobicContact CZ3-CD2 3.91Å; W63-F67 AromaticContact CZ3-CE2 3.91Å; W63-F67 HydrophobicContact CZ3-CE2 3.91Å; W63-F67 WeakPolarHBondContact O-CB 3.4Å; W63-F67 PolarHBondContact O-N 3.42Å |
| 64 | V | 84.9 | Confident | 88 | Confident | 2 Ų | 2 | 54.8 Ų | 54.8 | 1% | 0.012 | 29% | 0.291 | C | S | . | . | I | π-helix | trans | -62.2 | -43.3 | -178.8 | 170.8 | 0 | 0 | 0 | 0 | 111 | L60 V61 C68 M69 F310 | L60-V64 HydrophobicContact CD1-CG2 4.02Å; L60-V64 HydrophobicContact CG-CG2 4.4Å; L60-V64 WeakPolarHBondContact O-CB 3.41Å; L60-V64 VanDerWaalsContact O-CG2 3.31Å; L60-V64 WeakPolarHBondContact O-CG2 3.4Å; L60-V64 PolarHBondContact O-N 3.33Å; V61-V64 PolarHBondContact O-N 3.32Å; V64-C68 HydrophobicContact CG1-CB 4.41Å; V64-C68 CarbonylContact O-C 3.57Å; V64-C68 WeakPolarHBondContact O-CA 3.42Å; V64-C68 WeakPolarHBondContact O-CB 3.48Å; V64-C68 PolarHBondContact O-N 2.94Å; V64-M69 HydrophobicContact CG1-CG 4.12Å; V64-M69 HydrophobicContact CG1-SD 4.17Å; V64-M69 WeakPolarHBondContact O-CG 3.28Å; V64-M69 PolarHBondContact O-N 2.79Å; V64-F310 HydrophobicContact CG1-CE2 4.42Å |
| 65 | T | 84.8 | Confident | 87.7 | Confident | 6 Ų | 6 | 55 Ų | 55 | 4% | 0.037 | 29% | 0.293 | C | S | . | . | I | π-helix | trans | -76.3 | -29.6 | -177.5 | 56.4 | 0 | 0 | 0 | 0 | 113.5 | V61 L62 W63 M69 F78 L79 F310 | V61-T65 HydrophobicContact CG1-CG2 4.14Å; V61-T65 WeakPolarHBondContact O-CB 3.49Å; V61-T65 VanDerWaalsContact O-CG2 3.25Å; V61-T65 WeakPolarHBondContact O-CG2 3.4Å; V61-T65 PolarHBondContact O-N 3Å; V61-T65 PolarHBondContact O-OG1 3.12Å; L62-T65 PolarHBondContact O-N 3.5Å; L62-T65 PolarHBondContact O-OG1 2.76Å; W63-T65 VanDerWaalsContact C-N 3.35Å; W63-T65 PolarHBondContact O-N 3Å; T65-M69 HydrophobicContact CG2-SD 3.97Å; T65-F78 HydrophobicContact CG2-CB 3.77Å; T65-L79 WeakPolarHBondContact OG1-CD1 3.44Å; T65-F310 HydrophobicContact CG2-CE2 4.24Å |
| 66 | G | 86.4 | Confident | 87.5 | Confident | 32 Ų | 32 | 53.8 Ų | 53.8 | 33% | 0.33 | 29% | 0.285 | S | S | . | . | I | π-helix | trans | -82 | -40.3 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114 | L62 W63 | L62-G66 PolarHBondContact O-N 2.99Å; W63-G66 PolarHBondContact O-N 3.39Å |
| 67 | F | 83.6 | Confident | 87.2 | Confident | 157 Ų | 157 | 51 Ų | 51 | 69% | 0.689 | 27% | 0.265 | S | S | * | . | I | π-helix | trans | -115.1 | -30.7 | -170.8 | -60.3 | -74.9 | 0 | 0 | 0 | 114.2 | W63 | W63-F67 AromaticContact CD2-CD2 3.85Å; W63-F67 HydrophobicContact CD2-CD2 3.85Å; W63-F67 HydrophobicContact CD2-CE2 4.45Å; W63-F67 AromaticContact CE3-CD2 3.57Å; W63-F67 HydrophobicContact CE3-CD2 3.57Å; W63-F67 AromaticContact CE3-CE2 3.73Å; W63-F67 HydrophobicContact CE3-CE2 3.73Å; W63-F67 HydrophobicContact CG-CD2 4.4Å; W63-F67 HydrophobicContact CH2-CD2 4.47Å; W63-F67 AromaticContact CZ3-CD2 3.91Å; W63-F67 HydrophobicContact CZ3-CD2 3.91Å; W63-F67 AromaticContact CZ3-CE2 3.91Å; W63-F67 HydrophobicContact CZ3-CE2 3.91Å; W63-F67 WeakPolarHBondContact O-CB 3.4Å; W63-F67 PolarHBondContact O-N 3.42Å |
| 68 | C | 80.3 | Confident | 86.9 | Confident | 55 Ų | 55 | 51.6 Ų | 51.6 | 37% | 0.372 | 26% | 0.262 | S | S | . | . | I | π-helix | trans | -101 | -17.2 | -174.3 | -53.6 | 0 | 0 | 0 | 0 | 114.6 | V64 S317 | V64-C68 HydrophobicContact CG1-CB 4.41Å; V64-C68 CarbonylContact O-C 3.57Å; V64-C68 WeakPolarHBondContact O-CA 3.42Å; V64-C68 WeakPolarHBondContact O-CB 3.48Å; V64-C68 PolarHBondContact O-N 2.94Å; C68-S317 WeakPolarHBondContact CB-OG 3.38Å; C68-S317 PolarHBondContact SG-OG 3.42Å; C68-S317 VanDerWaalsContact SG-OG 3.37Å |
| 69 | M | 79.6 | Confident | 86.8 | Confident | 40 Ų | 40 | 54.2 Ų | 54.2 | 20% | 0.197 | 28% | 0.275 | C | S | . | . | S | Bend | trans | -106.4 | 137.8 | -179 | -68.8 | -175.9 | 72.4 | 0 | 0 | 111.1 | V64 T65 R71 | V64-M69 HydrophobicContact CG1-CG 4.12Å; V64-M69 HydrophobicContact CG1-SD 4.17Å; V64-M69 WeakPolarHBondContact O-CG 3.28Å; V64-M69 PolarHBondContact O-N 2.79Å; T65-M69 HydrophobicContact CG2-SD 3.97Å; M69-R71 PolarHBondContact O-N 3.23Å |
| 70 | N | 82 | Confident | 86.7 | Confident | 150 Ų | 150 | 53.3 Ų | 53.3 | 80% | 0.802 | 27% | 0.265 | S | S | * | . | trans | -58.7 | 137.3 | 170.6 | -69.7 | -11 | 0 | 0 | 0 | 110.5 | S72 S75 | N70-S72 PolarHBondContact O-N 3.11Å; N70-S75 PolarHBondContact O-OG 3.34Å | ||
| 71 | R | 86 | Confident | 86.7 | Confident | 206 Ų | 206 | 50 Ų | 50 | 78% | 0.777 | 25% | 0.247 | S | C | * | . | trans | -54.3 | 108.4 | 176.4 | -74.3 | -91.9 | -178.5 | 135.7 | -0.7 | 110 | M69 | M69-R71 PolarHBondContact O-N 3.23Š| ||
| 72 | S | 88 | Confident | 86.9 | Confident | 42 Ų | 42 | 49.9 Ų | 49.9 | 29% | 0.294 | 25% | 0.247 | S | C | . | . | trans | -137.4 | 160.9 | 178.3 | 66.4 | 0 | 0 | 0 | 0 | 109.6 | N70 T74 S75 I76 | N70-S72 PolarHBondContact O-N 3.11Å; S72-T74 PolarHBondContact O-N 3.42Å; S72-S75 PolarHBondContact N-OG 3.01Å; S72-S75 PolarHBondContact O-N 3.34Å; S72-S75 VanDerWaalsContact O-N 3.13Å; S72-S75 PolarHBondContact O-OG 3.49Å; S72-S75 WeakPolarHBondContact OG-CB 3.39Å; S72-S75 PolarHBondContact OG-N 2.97Å; S72-S75 VanDerWaalsContact OG-N 3.15Å; S72-S75 PolarHBondContact OG-OG 3.47Å; S72-I76 WeakPolarHBondContact O-CG1 3.2Å; S72-I76 PolarHBondContact O-N 2.96Å | ||
| 73 | V | 88.4 | Confident | 87.1 | Confident | 7 Ų | 7 | 51.7 Ų | 51.7 | 4% | 0.042 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -56.5 | -40.1 | 176.8 | 171.4 | 0 | 0 | 0 | 0 | 111.4 | I76 W77 R151 A156 | V73-I76 PolarHBondContact O-N 3.39Å; V73-W77 HydrophobicContact CG1-CD2 4.44Å; V73-W77 VanDerWaalsContact CG1-CE2 3.48Å; V73-W77 HydrophobicContact CG1-CZ2 3.55Å; V73-W77 VanDerWaalsContact O-CG 3.29Å; V73-W77 PolarHBondContact O-N 2.97Å; V73-W77 VanDerWaalsContact O-N 3.15Å; V73-R151 HydrophobicContact CB-CG 4.45Å; V73-R151 HydrophobicContact CG1-CG 4.46Å; V73-R151 VanDerWaalsContact CG1-CZ 3.46Å; V73-R151 VanDerWaalsContact CG1-NH2 3.28Å; V73-R151 HydrophobicContact CG2-CG 3.89Å; V73-A156 HydrophobicContact CB-CB 4.05Å; V73-A156 HydrophobicContact CG1-CB 3.71Å; V73-A156 HydrophobicContact CG2-CB 3.87Å |
| 74 | T | 83.8 | Confident | 87.3 | Confident | 37 Ų | 37 | 45.4 Ų | 45.4 | 23% | 0.227 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -68.5 | -37.3 | 178 | -47.2 | 0 | 0 | 0 | 0 | 112.6 | S72 I76 W77 F78 | S72-T74 PolarHBondContact O-N 3.42Å; T74-I76 VanDerWaalsContact C-N 3.31Å; T74-W77 PolarHBondContact O-N 3.12Å; T74-F78 HydrophobicContact CG2-CD2 4.13Å; T74-F78 HydrophobicContact CG2-CE2 3.65Å; T74-F78 HydrophobicContact CG2-CZ 4.22Å; T74-F78 WeakPolarHBondContact O-CD2 3.35Å; T74-F78 PolarHBondContact O-N 3.03Å |
| 75 | S | 86.1 | Confident | 87.7 | Confident | 4 Ų | 4 | 45.3 Ų | 45.3 | 3% | 0.028 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -68.5 | -33.2 | 176.6 | 72.1 | 0 | 0 | 0 | 0 | 111.5 | N70 S72 F78 L79 | N70-S75 PolarHBondContact O-OG 3.34Å; S72-S75 PolarHBondContact N-OG 3.01Å; S72-S75 PolarHBondContact O-N 3.34Å; S72-S75 VanDerWaalsContact O-N 3.13Å; S72-S75 PolarHBondContact O-OG 3.49Å; S72-S75 WeakPolarHBondContact OG-CB 3.39Å; S72-S75 PolarHBondContact OG-N 2.97Å; S72-S75 VanDerWaalsContact OG-N 3.15Å; S72-S75 PolarHBondContact OG-OG 3.47Å; S75-F78 PolarHBondContact O-N 2.9Å; S75-L79 VanDerWaalsContact O-CB 3.27Å; S75-L79 WeakPolarHBondContact O-CB 3.35Å; S75-L79 PolarHBondContact O-N 3.49Å |
| 76 | I | 90.8 | Very high | 88.2 | Confident | 14 Ų | 14 | 46.3 Ų | 46.3 | 7% | 0.072 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -65.4 | -41.1 | 174.2 | -68.3 | 168.7 | 0 | 0 | 0 | 111.7 | S72 V73 T74 L79 N80 P153 A156 | S72-I76 WeakPolarHBondContact O-CG1 3.2Å; S72-I76 PolarHBondContact O-N 2.96Å; V73-I76 PolarHBondContact O-N 3.39Å; T74-I76 VanDerWaalsContact C-N 3.31Å; I76-L79 PolarHBondContact O-N 2.91Å; I76-N80 PolarHBondContact O-N 3.44Å; I76-N80 PolarHBondContact O-ND2 3.09Å; I76-P153 HydrophobicContact CD1-CB 3.75Å; I76-P153 WeakPolarHBondContact CD1-O 3.3Å; I76-A156 HydrophobicContact CB-CB 4.44Å; I76-A156 HydrophobicContact CD1-CB 4.12Å; I76-A156 HydrophobicContact CG2-CB 4.25Å |
| 77 | W | 87.3 | Confident | 88.6 | Confident | 17 Ų | 17 | 47.6 Ų | 47.6 | 6% | 0.064 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -60 | -49 | 174.6 | -57.2 | 151.1 | 0 | 0 | 0 | 112.1 | V73 T74 L79 N80 L81 L132 I133 D136 A156 A159 C160 | V73-W77 HydrophobicContact CG1-CD2 4.44Å; V73-W77 VanDerWaalsContact CG1-CE2 3.48Å; V73-W77 HydrophobicContact CG1-CZ2 3.55Å; V73-W77 VanDerWaalsContact O-CG 3.29Å; V73-W77 PolarHBondContact O-N 2.97Å; V73-W77 VanDerWaalsContact O-N 3.15Å; T74-W77 PolarHBondContact O-N 3.12Å; W77-L79 VanDerWaalsContact C-N 3.35Å; W77-L79 PolarHBondContact O-N 3.34Å; W77-N80 PolarHBondContact O-N 2.66Å; W77-L81 PolarHBondContact O-N 3.36Å; W77-L132 HydrophobicContact CE3-CD2 3.95Å; W77-L132 HydrophobicContact CE3-CG 4.45Å; W77-L132 HydrophobicContact CH2-CD1 4.05Å; W77-L132 HydrophobicContact CH2-CD2 3.44Å; W77-L132 VanDerWaalsContact CH2-CD2 3.44Å; W77-L132 HydrophobicContact CH2-CG 3.68Å; W77-L132 HydrophobicContact CZ2-CD1 4.46Å; W77-L132 HydrophobicContact CZ2-CD2 4.32Å; W77-L132 HydrophobicContact CZ2-CG 4.1Å; W77-L132 HydrophobicContact CZ3-CD2 3.22Å; W77-L132 HydrophobicContact CZ3-CG 3.88Å; W77-I133 HydrophobicContact CB-CD1 4.2Å; W77-I133 HydrophobicContact CB-CG1 4.05Å; W77-I133 HydrophobicContact CG-CG1 4.03Å; W77-D136 PolarHBondContact NE1-OD2 3.4Å; W77-A156 HydrophobicContact CH2-CB 3.67Å; W77-A156 HydrophobicContact CZ2-CB 3.96Å; W77-A156 HydrophobicContact CZ3-CB 4.05Å; W77-A156 WeakPolarHBondContact CZ3-O 3.09Å; W77-A159 HydrophobicContact CH2-CB 3.94Å; W77-A159 HydrophobicContact CZ3-CB 4.32Å; W77-C160 VanDerWaalsContact CE3-SG 3.54Å; W77-C160 WeakPolarHBondContact CZ3-SG 3.46Å |
| 78 | F | 86 | Confident | 89 | Confident | 31 Ų | 31 | 40.2 Ų | 40.2 | 14% | 0.136 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -66.3 | -36.7 | 178.8 | -68 | -41.4 | 0 | 0 | 0 | 112.8 | T65 T74 S75 L81 A82 Y303 F310 | T65-F78 HydrophobicContact CG2-CB 3.77Å; T74-F78 HydrophobicContact CG2-CD2 4.13Å; T74-F78 HydrophobicContact CG2-CE2 3.65Å; T74-F78 HydrophobicContact CG2-CZ 4.22Å; T74-F78 WeakPolarHBondContact O-CD2 3.35Å; T74-F78 PolarHBondContact O-N 3.03Å; S75-F78 PolarHBondContact O-N 2.9Å; F78-L81 PolarHBondContact O-N 3.1Å; F78-A82 VanDerWaalsContact O-CB 3.28Å; F78-A82 WeakPolarHBondContact O-CB 3.23Å; F78-A82 PolarHBondContact O-N 3.49Å; F78-Y303 HydrophobicContact CD1-CD2 4.35Å; F78-Y303 HydrophobicContact CD1-CE1 4.17Å; F78-Y303 AromaticContact CD1-CE2 3.76Å; F78-Y303 HydrophobicContact CD1-CE2 3.76Å; F78-Y303 AromaticContact CD1-CZ 3.65Å; F78-Y303 AromaticContact CE1-CD1 3.97Å; F78-Y303 HydrophobicContact CE1-CD1 3.97Å; F78-Y303 HydrophobicContact CE1-CD2 4.4Å; F78-Y303 AromaticContact CE1-CE1 3.53Å; F78-Y303 HydrophobicContact CE1-CE1 3.53Å; F78-Y303 AromaticContact CE1-CE2 3.97Å; F78-Y303 HydrophobicContact CE1-CE2 3.97Å; F78-Y303 HydrophobicContact CE1-CG 4.4Å; F78-Y303 AromaticContact CE1-CZ 3.5Å; F78-Y303 VanDerWaalsContact CE1-CZ 3.5Å; F78-Y303 HydrophobicContact CZ-CE1 4.4Å; F78-F310 HydrophobicContact CD2-CD2 4.49Å |
| 79 | L | 90.8 | Very high | 89.7 | Confident | 57 Ų | 57 | 37.6 Ų | 37.6 | 30% | 0.298 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -60.9 | -47 | 175.8 | -174.7 | 79.2 | 0 | 0 | 0 | 111.1 | L62 T65 S75 I76 W77 L83 | L62-L79 HydrophobicContact CD2-CD1 3.65Å; L62-L79 HydrophobicContact CD2-CG 4.16Å; L62-L79 VanDerWaalsContact CD2-O 3.22Å; L62-L79 WeakPolarHBondContact CD2-O 3.24Å; T65-L79 WeakPolarHBondContact OG1-CD1 3.44Å; S75-L79 VanDerWaalsContact O-CB 3.27Å; S75-L79 WeakPolarHBondContact O-CB 3.35Å; S75-L79 PolarHBondContact O-N 3.49Å; I76-L79 PolarHBondContact O-N 2.91Å; W77-L79 VanDerWaalsContact C-N 3.35Å; W77-L79 PolarHBondContact O-N 3.34Å; L79-L83 WeakPolarHBondContact O-CB 3.13Å; L79-L83 PolarHBondContact O-N 3.18Å |
| 80 | N | 92.8 | Very high | 90.4 | Very high | 22 Ų | 22 | 40.2 Ų | 40.2 | 12% | 0.118 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -68.9 | -36.1 | -179.8 | -81 | -94 | 0 | 0 | 0 | 112.4 | I76 W77 L83 T84 Q129 C160 W164 | I76-N80 PolarHBondContact O-N 3.44Å; I76-N80 PolarHBondContact O-ND2 3.09Å; W77-N80 PolarHBondContact O-N 2.66Å; N80-L83 PolarHBondContact O-N 3.38Å; N80-T84 WeakPolarHBondContact O-CB 3.48Å; N80-T84 PolarHBondContact O-N 2.98Å; N80-T84 PolarHBondContact O-OG1 3.43Å; N80-Q129 PolarHBondContact O-OE1 3.04Å; N80-C160 PolarHBondContact ND2-SG 3.49Å; N80-W164 PolarHBondContact OD1-NE1 3.05Å |
| 81 | L | 90.1 | Very high | 90.9 | Very high | 1 Ų | 1 | 33.4 Ų | 33.4 | 1% | 0.005 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -68.3 | -46.4 | 178.4 | -165.3 | 73.3 | 0 | 0 | 0 | 110.5 | W77 F78 L83 T84 D85 Q129 N299 Y303 | W77-L81 PolarHBondContact O-N 3.36Å; F78-L81 PolarHBondContact O-N 3.1Å; L81-L83 VanDerWaalsContact C-N 3.28Å; L81-L83 PolarHBondContact O-N 2.88Å; L81-T84 WeakPolarHBondContact O-CB 3.4Å; L81-T84 PolarHBondContact O-N 3.37Å; L81-T84 VanDerWaalsContact O-N 3.12Å; L81-D85 WeakPolarHBondContact O-CB 3.33Å; L81-D85 PolarHBondContact O-N 3.06Å; L81-Q129 HydrophobicContact CD1-CB 4.27Å; L81-N299 HydrophobicContact CD2-CB 4.21Å; L81-Y303 HydrophobicContact CD2-CE2 4.16Å; L81-Y303 WeakPolarHBondContact CD2-OH 3.49Å |
| 82 | A | 92.3 | Very high | 91.1 | Very high | 2 Ų | 2 | 23.6 Ų | 23.6 | 2% | 0.017 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -63.5 | -33.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | V61 L62 F78 L86 | V61-A82 HydrophobicContact CB-CB 3.79Å; V61-A82 HydrophobicContact CG1-CB 3.58Å; L62-A82 HydrophobicContact CD2-CB 3.88Å; L62-A82 HydrophobicContact CG-CB 3.75Å; F78-A82 VanDerWaalsContact O-CB 3.28Å; F78-A82 WeakPolarHBondContact O-CB 3.23Å; F78-A82 PolarHBondContact O-N 3.49Å; A82-L86 WeakPolarHBondContact O-CB 3.47Å; A82-L86 PolarHBondContact O-N 3.41Å |
| 83 | L | 95 | Very high | 91.3 | Very high | 71 Ų | 71 | 24.2 Ų | 24.2 | 37% | 0.372 | 13% | 0.131 | S | C | . | . | H | α-helix | trans | -64.2 | -45.5 | 172.5 | -180 | 62.3 | 0 | 0 | 0 | 111.3 | L62 L79 N80 L81 L86 L87 W164 | L62-L83 HydrophobicContact CD2-CB 4.08Å; L79-L83 WeakPolarHBondContact O-CB 3.13Å; L79-L83 PolarHBondContact O-N 3.18Å; N80-L83 PolarHBondContact O-N 3.38Å; L81-L83 VanDerWaalsContact C-N 3.28Å; L81-L83 PolarHBondContact O-N 2.88Å; L83-L86 PolarHBondContact O-N 2.91Å; L83-L87 HydrophobicContact CD1-CD1 4.46Å; L83-L87 HydrophobicContact CG-CD1 4.32Å; L83-L87 VanDerWaalsContact O-CG 3.3Å; L83-L87 WeakPolarHBondContact O-CG 3.39Å; L83-L87 PolarHBondContact O-N 3.46Å; L83-W164 HydrophobicContact CD2-CZ2 4.13Å; L83-W164 HydrophobicContact CG-CZ2 4.39Å |
| 84 | T | 94.5 | Very high | 91.5 | Very high | 0 Ų | 0 | 26.9 Ų | 26.9 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -63.5 | -47.3 | 179.9 | -53.4 | 0 | 0 | 0 | 0 | 111 | N80 L81 L87 C88 V122 C125 S126 Q129 | N80-T84 WeakPolarHBondContact O-CB 3.48Å; N80-T84 PolarHBondContact O-N 2.98Å; N80-T84 PolarHBondContact O-OG1 3.43Å; L81-T84 WeakPolarHBondContact O-CB 3.4Å; L81-T84 PolarHBondContact O-N 3.37Å; L81-T84 VanDerWaalsContact O-N 3.12Å; T84-L87 PolarHBondContact O-N 3.39Å; T84-C88 PolarHBondContact O-N 3.23Å; T84-V122 HydrophobicContact CG2-CB 3.81Å; T84-V122 HydrophobicContact CG2-CG1 4.12Å; T84-V122 WeakPolarHBondContact CG2-O 3.21Å; T84-C125 HydrophobicContact CG2-CB 3.54Å; T84-S126 WeakPolarHBondContact CG2-OG 3.39Å; T84-Q129 PolarHBondContact OG1-NE2 2.94Å |
| 85 | D | 93.8 | Very high | 91.8 | Very high | 0 Ų | 0 | 26.6 Ų | 26.6 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -67.1 | -37.3 | 179 | -71.3 | -36 | 0 | 0 | 0 | 112.2 | N58 L81 C88 C89 S296 N299 | N58-D85 HydrophobicContact CB-CB 4.46Å; N58-D85 WeakPolarHBondContact OD1-CB 3.34Å; L81-D85 WeakPolarHBondContact O-CB 3.33Å; L81-D85 PolarHBondContact O-N 3.06Å; D85-C88 WeakPolarHBondContact O-CB 3.26Å; D85-C88 PolarHBondContact O-N 3.04Å; D85-C89 PolarHBondContact O-N 2.96Å; D85-C89 PolarHBondContact O-SG 3.22Å; D85-S296 WeakPolarHBondContact OD1-CA 3.49Å; D85-S296 VanDerWaalsContact OD1-CB 3.32Å; D85-S296 WeakPolarHBondContact OD1-CB 3.12Å; D85-S296 PolarHBondContact OD1-OG 2.91Å; D85-N299 PolarHBondContact OD1-ND2 3.03Å; D85-N299 WeakPolarHBondContact OD2-CB 3.17Å; D85-N299 PolarHBondContact OD2-ND2 3.42Å |
| 86 | L | 94.9 | Very high | 92 | Very high | 28 Ų | 28 | 28.5 Ų | 28.5 | 15% | 0.147 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -63.8 | -44.4 | 175 | -177.1 | 63.4 | 0 | 0 | 0 | 111.3 | V55 N58 L62 A82 L83 C88 C89 L90 | V55-L86 HydrophobicContact CB-CD1 4.37Å; V55-L86 HydrophobicContact CG1-CD1 4.05Å; V55-L86 HydrophobicContact CG2-CD1 4.47Å; N58-L86 HydrophobicContact CB-CB 4.11Å; L62-L86 HydrophobicContact CD1-CB 4.3Å; L62-L86 HydrophobicContact CD1-CD2 3.49Å; L62-L86 VanDerWaalsContact CD1-CD2 3.49Å; A82-L86 WeakPolarHBondContact O-CB 3.47Å; A82-L86 PolarHBondContact O-N 3.41Å; L83-L86 PolarHBondContact O-N 2.91Å; L86-C88 VanDerWaalsContact C-N 3.28Å; L86-C88 PolarHBondContact O-N 3.35Å; L86-C89 PolarHBondContact O-N 2.96Å; L86-L90 HydrophobicContact CD1-CD1 4.18Å; L86-L90 HydrophobicContact CD1-CG 4.18Å; L86-L90 HydrophobicContact CD2-CD1 4.46Å; L86-L90 HydrophobicContact CG-CD1 3.87Å; L86-L90 HydrophobicContact CG-CG 4.3Å; L86-L90 WeakPolarHBondContact O-CB 3.38Å; L86-L90 VanDerWaalsContact O-CG 3.23Å; L86-L90 WeakPolarHBondContact O-CG 3.4Å; L86-L90 PolarHBondContact O-N 3.37Å |
| 87 | L | 94.4 | Very high | 92.1 | Very high | 59 Ų | 59 | 30.4 Ų | 30.4 | 31% | 0.309 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -60 | -40.6 | 175.6 | -71.6 | 168.5 | 0 | 0 | 0 | 111.7 | L83 T84 L90 S91 V122 W164 | L83-L87 HydrophobicContact CD1-CD1 4.46Å; L83-L87 HydrophobicContact CG-CD1 4.32Å; L83-L87 VanDerWaalsContact O-CG 3.3Å; L83-L87 WeakPolarHBondContact O-CG 3.39Å; L83-L87 PolarHBondContact O-N 3.46Å; T84-L87 PolarHBondContact O-N 3.39Å; L87-L90 PolarHBondContact O-N 3.41Å; L87-S91 PolarHBondContact O-N 3.26Å; L87-S91 VanDerWaalsContact O-N 3.09Å; L87-V122 HydrophobicContact CB-CG1 4.27Å; L87-W164 HydrophobicContact CD1-CH2 3.77Å; L87-W164 HydrophobicContact CD1-CZ3 4.49Å |
| 88 | C | 93.2 | Very high | 92.2 | Very high | 1 Ų | 1 | 30.1 Ų | 30.1 | 1% | 0.007 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -61.8 | -47.3 | 174.9 | -170.5 | 0 | 0 | 0 | 0 | 112 | T84 D85 L86 L90 S91 V122 Y293 S296 | T84-C88 PolarHBondContact O-N 3.23Å; D85-C88 WeakPolarHBondContact O-CB 3.26Å; D85-C88 PolarHBondContact O-N 3.04Å; L86-C88 VanDerWaalsContact C-N 3.28Å; L86-C88 PolarHBondContact O-N 3.35Å; C88-L90 VanDerWaalsContact C-N 3.34Å; C88-L90 PolarHBondContact O-N 3.13Å; C88-S91 PolarHBondContact O-N 2.97Å; C88-S91 PolarHBondContact O-OG 3.4Å; C88-V122 HydrophobicContact CB-CB 4.22Å; C88-V122 HydrophobicContact CB-CG1 4.34Å; C88-V122 HydrophobicContact CB-CG2 3.86Å; C88-Y293 WeakPolarHBondContact O-CE1 3.33Å; C88-Y293 WeakPolarHBondContact SG-CD1 3.48Å; C88-Y293 WeakPolarHBondContact SG-CE1 3.35Å; C88-S296 PolarHBondContact SG-OG 3.04Å; C88-S296 VanDerWaalsContact SG-OG 3.42Å |
| 89 | C | 94.3 | Very high | 92.3 | Very high | 0 Ų | 0 | 29 Ų | 29 | 0% | 0 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -67.1 | -34.7 | 178.1 | -64.5 | 0 | 0 | 0 | 0 | 112.5 | V55 D85 L86 L92 | V55-C89 HydrophobicContact CG2-CB 3.78Å; D85-C89 PolarHBondContact O-N 2.96Å; D85-C89 PolarHBondContact O-SG 3.22Å; L86-C89 PolarHBondContact O-N 2.96Å; C89-L92 VanDerWaalsContact O-CB 3.3Å; C89-L92 WeakPolarHBondContact O-CB 3.44Å; C89-L92 PolarHBondContact O-N 2.91Å |
| 90 | L | 93.6 | Very high | 92.2 | Very high | 96 Ų | 96 | 27.8 Ų | 27.8 | 50% | 0.503 | 16% | 0.156 | S | C | . | . | H | α-helix | trans | -74.1 | -24 | 179 | -71.7 | 174 | 0 | 0 | 0 | 113.5 | V55 L86 L87 C88 L92 P93 | V55-L90 HydrophobicContact CG1-CD2 4.45Å; V55-L90 HydrophobicContact CG2-CD2 4.17Å; L86-L90 HydrophobicContact CD1-CD1 4.18Å; L86-L90 HydrophobicContact CD1-CG 4.18Å; L86-L90 HydrophobicContact CD2-CD1 4.46Å; L86-L90 HydrophobicContact CG-CD1 3.87Å; L86-L90 HydrophobicContact CG-CG 4.3Å; L86-L90 WeakPolarHBondContact O-CB 3.38Å; L86-L90 VanDerWaalsContact O-CG 3.23Å; L86-L90 WeakPolarHBondContact O-CG 3.4Å; L86-L90 PolarHBondContact O-N 3.37Å; L87-L90 PolarHBondContact O-N 3.41Å; C88-L90 VanDerWaalsContact C-N 3.34Å; C88-L90 PolarHBondContact O-N 3.13Å; L90-L92 VanDerWaalsContact C-N 3.28Å; L90-P93 WeakPolarHBondContact O-CD 3.22Å |
| 91 | S | 92.5 | Very high | 92 | Very high | 6 Ų | 6 | 31.6 Ų | 31.6 | 4% | 0.042 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -76.9 | -18.2 | 174.5 | 63.8 | 0 | 0 | 0 | 0 | 113.1 | L87 C88 L94 | L87-S91 PolarHBondContact O-N 3.26Å; L87-S91 VanDerWaalsContact O-N 3.09Å; C88-S91 PolarHBondContact O-N 2.97Å; C88-S91 PolarHBondContact O-OG 3.4Å; S91-L94 WeakPolarHBondContact O-CB 3.19Å; S91-L94 PolarHBondContact O-N 3.41Å |
| 92 | L | 91.8 | Very high | 91.8 | Very high | 0 Ų | 0 | 35.2 Ų | 35.2 | 0% | 0 | 19% | 0.192 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -64.6 | -42 | -171.3 | -145.1 | 160.9 | 0 | 0 | 0 | 114.1 | Y47 V50 V51 C89 L90 L94 L95 M96 Y293 | Y47-L92 HydrophobicContact CD1-CD1 4.42Å; Y47-L92 HydrophobicContact CD1-CD2 3.65Å; Y47-L92 HydrophobicContact CD1-CG 4.43Å; Y47-L92 HydrophobicContact CD2-CD2 3.77Å; Y47-L92 HydrophobicContact CE1-CD2 4.34Å; Y47-L92 HydrophobicContact CE2-CD2 4.48Å; Y47-L92 HydrophobicContact CG-CD2 3.32Å; Y47-L92 HydrophobicContact CG-CG 4.5Å; V50-L92 HydrophobicContact CB-CD1 3.74Å; V50-L92 HydrophobicContact CG1-CD1 3.29Å; V51-L92 HydrophobicContact CG2-CB 3.95Å; V51-L92 HydrophobicContact CG2-CD2 4.32Å; C89-L92 VanDerWaalsContact O-CB 3.3Å; C89-L92 WeakPolarHBondContact O-CB 3.44Å; C89-L92 PolarHBondContact O-N 2.91Å; L90-L92 VanDerWaalsContact C-N 3.28Å; L92-L94 PolarHBondContact O-N 2.72Å; L92-L94 VanDerWaalsContact O-N 3.13Å; L92-L95 WeakPolarHBondContact O-CA 3.26Å; L92-L95 WeakPolarHBondContact O-CB 3.4Å; L92-L95 PolarHBondContact O-N 2.99Å; L92-M96 HydrophobicContact CD2-CG 3.98Å; L92-M96 HydrophobicContact CD2-SD 4.2Å; L92-M96 PolarHBondContact O-N 3.45Å; L92-M96 VanDerWaalsContact O-N 3.11Å; L92-Y293 HydrophobicContact CB-CE1 4.47Å; L92-Y293 HydrophobicContact CD1-CD1 3.54Å; L92-Y293 HydrophobicContact CD1-CD2 4.27Å; L92-Y293 HydrophobicContact CD1-CE1 4.21Å; L92-Y293 HydrophobicContact CD1-CG 3.59Å; L92-Y293 HydrophobicContact CG-CD1 4.01Å; L92-Y293 HydrophobicContact CG-CD2 4.42Å; L92-Y293 HydrophobicContact CG-CE1 4.2Å; L92-Y293 HydrophobicContact CG-CG 4.14Å |
| 93 | P | 92.1 | Very high | 91.5 | Very high | 56 Ų | 56 | 37.4 Ų | 37.4 | 36% | 0.364 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -54.5 | -32.2 | 174.5 | -28.2 | 36.8 | 0 | 0 | 0 | 114.3 | V51 L90 L95 M96 V97 | V51-P93 HydrophobicContact CG2-CG 4.16Å; L90-P93 WeakPolarHBondContact O-CD 3.22Å; P93-L95 PolarHBondContact O-N 2.83Å; P93-M96 PolarHBondContact O-N 3.48Å; P93-V97 PolarHBondContact O-N 3.15Å |
| 94 | L | 91.9 | Very high | 91.3 | Very high | 63 Ų | 63 | 35.7 Ų | 35.7 | 33% | 0.33 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -69.5 | -20 | 176.4 | -61.3 | 174.5 | 0 | 0 | 0 | 112.9 | S91 L92 P98 F107 V115 | S91-L94 WeakPolarHBondContact O-CB 3.19Å; S91-L94 PolarHBondContact O-N 3.41Å; L92-L94 PolarHBondContact O-N 2.72Å; L92-L94 VanDerWaalsContact O-N 3.13Å; L94-P98 WeakPolarHBondContact O-CD 3.35Å; L94-F107 HydrophobicContact CB-CE2 4.49Å; L94-F107 HydrophobicContact CD2-CD1 4.23Å; L94-F107 HydrophobicContact CD2-CD2 4.42Å; L94-F107 HydrophobicContact CD2-CE1 3.96Å; L94-F107 HydrophobicContact CD2-CE2 4.16Å; L94-F107 HydrophobicContact CD2-CG 4.45Å; L94-F107 HydrophobicContact CD2-CZ 3.92Å; L94-F107 WeakPolarHBondContact O-CE2 3.48Å; L94-V115 HydrophobicContact CB-CG2 4.02Å; L94-V115 HydrophobicContact CD1-CG2 3.55Å; L94-V115 HydrophobicContact CG-CG2 4.44Å |
| 95 | L | 89.3 | Confident | 91.3 | Very high | 31 Ų | 31 | 35.9 Ų | 35.9 | 16% | 0.162 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -92.1 | -21.9 | 172.6 | -65.1 | -178.3 | 0 | 0 | 0 | 113.1 | L92 P93 L99 V115 Y293 | L92-L95 WeakPolarHBondContact O-CA 3.26Å; L92-L95 WeakPolarHBondContact O-CB 3.4Å; L92-L95 PolarHBondContact O-N 2.99Å; P93-L95 PolarHBondContact O-N 2.83Å; L95-L99 WeakPolarHBondContact O-CB 3.32Å; L95-L99 PolarHBondContact O-N 3.2Å; L95-V115 HydrophobicContact CD1-CG1 4.44Å; L95-V115 HydrophobicContact CD2-CG1 3.59Å; L95-V115 HydrophobicContact CG-CG1 3.91Å; L95-Y293 HydrophobicContact CD1-CE2 3.58Å; L95-Y293 WeakPolarHBondContact CD1-OH 3.44Å |
| 96 | M | 91.3 | Very high | 91.3 | Very high | 44 Ų | 44 | 40.3 Ų | 40.3 | 22% | 0.217 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -67.8 | -38.1 | 175.9 | -67.3 | 173.9 | 68.4 | 0 | 0 | 111.9 | L44 Y47 A48 L92 P93 L99 A100 | L44-M96 HydrophobicContact CD2-CB 3.94Å; L44-M96 HydrophobicContact CD2-CE 4.42Å; L44-M96 HydrophobicContact CD2-CG 4.3Å; L44-M96 WeakPolarHBondContact CD2-O 3.41Å; Y47-M96 HydrophobicContact CD2-CG 3.88Å; Y47-M96 HydrophobicContact CG-CG 4.34Å; A48-M96 HydrophobicContact CB-CE 4.17Å; L92-M96 HydrophobicContact CD2-CG 3.98Å; L92-M96 HydrophobicContact CD2-SD 4.2Å; L92-M96 PolarHBondContact O-N 3.45Å; L92-M96 VanDerWaalsContact O-N 3.11Å; P93-M96 PolarHBondContact O-N 3.48Å; M96-L99 PolarHBondContact O-N 3.45Å; M96-A100 PolarHBondContact O-N 2.88Å |
| 97 | V | 92.1 | Very high | 91.2 | Very high | 53 Ų | 53 | 42.8 Ų | 42.8 | 32% | 0.321 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -63.3 | -53 | -178.4 | 176 | 0 | 0 | 0 | 0 | 111.8 | P93 L99 A100 H101 F107 | P93-V97 PolarHBondContact O-N 3.15Å; V97-L99 VanDerWaalsContact C-N 3.28Å; V97-L99 PolarHBondContact O-N 3.36Å; V97-A100 PolarHBondContact O-N 3.39Å; V97-A100 VanDerWaalsContact O-N 3.12Å; V97-H101 PolarHBondContact O-CD2 2.86Å; V97-H101 VanDerWaalsContact O-CD2 3.31Å; V97-H101 PolarHBondContact O-N 2.97Å; V97-H101 VanDerWaalsContact O-N 3.1Å; V97-F107 HydrophobicContact CB-CE2 4.06Å; V97-F107 HydrophobicContact CB-CZ 3.9Å; V97-F107 HydrophobicContact CG1-CE2 4.33Å; V97-F107 HydrophobicContact CG1-CZ 4.09Å; V97-F107 HydrophobicContact CG2-CZ 4.01Å |
| 98 | P | 89.4 | Confident | 91.2 | Very high | 11 Ų | 11 | 41 Ų | 41 | 7% | 0.071 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -58.2 | -40.2 | 175.6 | -23.4 | 33.2 | 0 | 0 | 0 | 112.6 | L94 A100 H101 D102 D103 H104 W105 | L94-P98 WeakPolarHBondContact O-CD 3.35Å; P98-A100 PolarHBondContact O-N 3.41Å; P98-H101 CarbonylContact O-C 3.4Å; P98-H101 PolarHBondContact O-N 3.17Å; P98-H101 VanDerWaalsContact O-N 3.09Å; P98-D102 PolarHBondContact O-N 3.42Å; P98-D103 WeakPolarHBondContact O-CA 3.28Å; P98-D103 PolarHBondContact O-N 3.15Å; P98-H104 WeakPolarHBondContact CA-O 3.32Å; P98-H104 WeakPolarHBondContact CB-O 3.26Å; P98-W105 HydrophobicContact CB-CE3 4.43Å; P98-W105 HydrophobicContact CG-CE3 3.49Å; P98-W105 VanDerWaalsContact CG-CE3 3.49Å; P98-W105 HydrophobicContact CG-CZ3 3.73Å |
| 99 | L | 87.8 | Confident | 91.3 | Very high | 8 Ų | 8 | 45 Ų | 45 | 4% | 0.042 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -62.1 | -31.9 | 179 | -174.8 | 63.8 | 0 | 0 | 0 | 113 | Q40 L44 Y47 L95 M96 V97 V286 | Q40-L99 HydrophobicContact CG-CD1 4.11Å; L44-L99 HydrophobicContact CD2-CB 4.29Å; L44-L99 HydrophobicContact CD2-CD2 3.99Å; L44-L99 HydrophobicContact CD2-CG 4.29Å; L44-L99 HydrophobicContact CG-CD2 3.99Å; L44-L99 HydrophobicContact CG-CG 4.31Å; Y47-L99 HydrophobicContact CD2-CD2 3.88Å; Y47-L99 HydrophobicContact CE2-CD2 3.63Å; L95-L99 WeakPolarHBondContact O-CB 3.32Å; L95-L99 PolarHBondContact O-N 3.2Å; M96-L99 PolarHBondContact O-N 3.45Å; V97-L99 VanDerWaalsContact C-N 3.28Å; V97-L99 PolarHBondContact O-N 3.36Å; L99-V286 HydrophobicContact CD1-CG1 4.26Å; L99-V286 HydrophobicContact CD1-CG2 4.38Å; L99-V286 HydrophobicContact CD2-CG1 4.38Å |
| 100 | A | 89.2 | Confident | 91.4 | Very high | 31 Ų | 31 | 51.1 Ų | 51.1 | 26% | 0.256 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -82 | -21.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | L44 M96 V97 P98 | L44-A100 HydrophobicContact CD1-CB 4.12Å; L44-A100 HydrophobicContact CD2-CB 4.48Å; M96-A100 PolarHBondContact O-N 2.88Å; V97-A100 PolarHBondContact O-N 3.39Å; V97-A100 VanDerWaalsContact O-N 3.12Å; P98-A100 PolarHBondContact O-N 3.41Å |
| 101 | H | 88 | Confident | 91.4 | Very high | 102 Ų | 102 | 47.7 Ų | 47.7 | 47% | 0.472 | 26% | 0.264 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -111.6 | 41.7 | -176.8 | -72.4 | -86.2 | 0 | 0 | 0 | 112.1 | V97 P98 D103 H104 H106 | V97-H101 PolarHBondContact O-CD2 2.86Å; V97-H101 VanDerWaalsContact O-CD2 3.31Å; V97-H101 PolarHBondContact O-N 2.97Å; V97-H101 VanDerWaalsContact O-N 3.1Å; P98-H101 CarbonylContact O-C 3.4Å; P98-H101 PolarHBondContact O-N 3.17Å; P98-H101 VanDerWaalsContact O-N 3.09Å; H101-D103 PolarHBondContact O-N 2.93Å; H101-H104 HydrophobicContact CB-CB 4.3Å; H101-H104 WeakPolarHBondContact O-CB 3.32Å; H101-H104 PolarHBondContact O-N 2.88Å; H101-H106 AromaticContact CG-NE2 3.81Å |
| 102 | D | 85.6 | Confident | 91.6 | Very high | 77 Ų | 77 | 47.4 Ų | 47.4 | 41% | 0.412 | 26% | 0.262 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 53.6 | 47.3 | 176.4 | -174.6 | 48.9 | 0 | 0 | 0 | 113.2 | P34 P98 H104 K187 | P34-D102 HydrophobicContact CB-CB 4.35Å; P98-D102 PolarHBondContact O-N 3.42Å; D102-H104 PolarHBondContact O-N 3.3Å; D102-H104 VanDerWaalsContact O-N 3.14Å; D102-K187 WeakPolarHBondContact O-CE 3.1Å; D102-K187 PolarHBondContact O-NZ 3.12Å; D102-K187 IonicContact OD1-NZ 2.7Å; D102-K187 IonicContact OD2-NZ 2.96Å; D102-K187 PolarHBondContact OD2-NZ 2.71Å |
| 103 | D | 87.5 | Confident | 91.8 | Very high | 49 Ų | 49 | 49.2 Ų | 49.2 | 26% | 0.262 | 27% | 0.273 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 61.5 | 15.1 | -176.8 | -63.9 | -46.5 | 0 | 0 | 0 | 115.5 | P98 H101 W105 Y282 | P98-D103 WeakPolarHBondContact O-CA 3.28Å; P98-D103 PolarHBondContact O-N 3.15Å; H101-D103 PolarHBondContact O-N 2.93Å; D103-W105 PolarHBondContact O-N 2.65Å; D103-Y282 VanDerWaalsContact CG-OH 3.25Å; D103-Y282 PolarHBondContact OD1-OH 3.47Å; D103-Y282 WeakPolarHBondContact OD2-CE2 3.48Å; D103-Y282 VanDerWaalsContact OD2-CZ 3.28Å; D103-Y282 PolarHBondContact OD2-OH 3.25Å |
| 104 | H | 90.9 | Very high | 91.9 | Very high | 35 Ų | 35 | 50.8 Ų | 50.8 | 16% | 0.162 | 28% | 0.278 | C | S | . | . | trans | -69.7 | 125.5 | 175.6 | -171.7 | 99.5 | 0 | 0 | 0 | 112 | P98 H101 D102 H106 H186 R188 | P98-H104 WeakPolarHBondContact CA-O 3.32Å; P98-H104 WeakPolarHBondContact CB-O 3.26Å; H101-H104 HydrophobicContact CB-CB 4.3Å; H101-H104 WeakPolarHBondContact O-CB 3.32Å; H101-H104 PolarHBondContact O-N 2.88Å; D102-H104 PolarHBondContact O-N 3.3Å; D102-H104 VanDerWaalsContact O-N 3.14Å; H104-H106 AromaticContact CD2-CD2 3.64Å; H104-H106 AromaticContact CD2-CE1 3.19Å; H104-H106 PolarHBondContact CD2-CE1 3.34Å; H104-H106 AromaticContact CD2-CG 3.72Å; H104-H106 AromaticContact CD2-ND1 3.44Å; H104-H106 PolarHBondContact CD2-ND1 2.84Å; H104-H106 AromaticContact CD2-NE2 3.32Å; H104-H106 PolarHBondContact CD2-NE2 3.46Å; H104-H106 VanDerWaalsContact CD2-NE2 3.32Å; H104-H106 AromaticContact CG-NE2 3.99Å; H104-H106 AromaticContact NE2-CE1 3.76Å; H104-H106 AromaticContact NE2-ND1 3.75Å; H104-H106 PolarHBondContact O-CD2 3.1Å; H104-H186 PolarHBondContact CE1-O 2.89Å; H104-H186 PolarHBondContact ND1-O 3.14Å; H104-R188 CarbonylContact C-O 3.48Å; H104-R188 WeakPolarHBondContact CA-O 3.24Å | ||
| 105 | W | 94.4 | Very high | 92 | Very high | 4 Ų | 4 | 48.1 Ų | 48.1 | 2% | 0.015 | 26% | 0.264 | C | S | . | . | trans | -93 | 111.1 | 179.4 | -173.3 | -102.9 | 0 | 0 | 0 | 112.4 | P98 D103 F107 G108 A111 C112 V115 R188 C190 | P98-W105 HydrophobicContact CB-CE3 4.43Å; P98-W105 HydrophobicContact CG-CE3 3.49Å; P98-W105 VanDerWaalsContact CG-CE3 3.49Å; P98-W105 HydrophobicContact CG-CZ3 3.73Å; D103-W105 PolarHBondContact O-N 2.65Å; W105-F107 HydrophobicContact CD2-CD2 4.32Å; W105-F107 HydrophobicContact CE3-CD2 4.27Å; W105-F107 HydrophobicContact CH2-CB 4.5Å; W105-F107 AromaticContact CH2-CD2 3.79Å; W105-F107 HydrophobicContact CH2-CD2 3.79Å; W105-F107 HydrophobicContact CZ2-CB 3.74Å; W105-F107 AromaticContact CZ2-CD2 3.83Å; W105-F107 HydrophobicContact CZ2-CD2 3.83Å; W105-F107 HydrophobicContact CZ2-CG 4.26Å; W105-F107 HydrophobicContact CZ3-CD2 4.02Å; W105-G108 PolarHBondContact NE1-O 3.11Å; W105-A111 VanDerWaalsContact CZ2-C 3.49Å; W105-A111 HydrophobicContact CZ2-CB 3.79Å; W105-C112 VanDerWaalsContact CZ2-CA 3.49Å; W105-C112 HydrophobicContact CZ2-CB 4.06Å; W105-C112 VanDerWaalsContact CZ2-N 3.31Å; W105-V115 HydrophobicContact CH2-CB 4.23Å; W105-V115 HydrophobicContact CH2-CG2 4.12Å; W105-R188 PolarHBondContact N-O 3.4Å; W105-C190 HydrophobicContact CB-CB 4.18Å; W105-C190 HydrophobicContact CD2-CB 3.52Å; W105-C190 HydrophobicContact CE3-CB 3.63Å; W105-C190 HydrophobicContact CG-CB 3.75Å; W105-C190 HydrophobicContact CZ3-CB 4.28Å | ||
| 106 | H | 92.6 | Very high | 92.3 | Very high | 92 Ų | 92 | 49.4 Ų | 49.4 | 43% | 0.426 | 27% | 0.268 | S | S | . | . | trans | -92.7 | -15.8 | -175.6 | -66.2 | -82.9 | 0 | 0 | 0 | 115 | H101 H104 | H101-H106 AromaticContact CG-NE2 3.81Å; H104-H106 AromaticContact CD2-CD2 3.64Å; H104-H106 AromaticContact CD2-CE1 3.19Å; H104-H106 PolarHBondContact CD2-CE1 3.34Å; H104-H106 AromaticContact CD2-CG 3.72Å; H104-H106 AromaticContact CD2-ND1 3.44Å; H104-H106 PolarHBondContact CD2-ND1 2.84Å; H104-H106 AromaticContact CD2-NE2 3.32Å; H104-H106 PolarHBondContact CD2-NE2 3.46Å; H104-H106 VanDerWaalsContact CD2-NE2 3.32Å; H104-H106 AromaticContact CG-NE2 3.99Å; H104-H106 AromaticContact NE2-CE1 3.76Å; H104-H106 AromaticContact NE2-ND1 3.75Å; H104-H106 PolarHBondContact O-CD2 3.1Å | ||
| 107 | F | 93.9 | Very high | 92.4 | Very high | 81 Ų | 81 | 47.3 Ų | 47.3 | 36% | 0.355 | 26% | 0.258 | S | S | . | . | S | Bend | trans | -96.3 | 2.4 | -162 | -53.3 | -73.6 | 0 | 0 | 0 | 115.1 | L94 V97 W105 A111 | L94-F107 HydrophobicContact CB-CE2 4.49Å; L94-F107 HydrophobicContact CD2-CD1 4.23Å; L94-F107 HydrophobicContact CD2-CD2 4.42Å; L94-F107 HydrophobicContact CD2-CE1 3.96Å; L94-F107 HydrophobicContact CD2-CE2 4.16Å; L94-F107 HydrophobicContact CD2-CG 4.45Å; L94-F107 HydrophobicContact CD2-CZ 3.92Å; L94-F107 WeakPolarHBondContact O-CE2 3.48Å; V97-F107 HydrophobicContact CB-CE2 4.06Å; V97-F107 HydrophobicContact CB-CZ 3.9Å; V97-F107 HydrophobicContact CG1-CE2 4.33Å; V97-F107 HydrophobicContact CG1-CZ 4.09Å; V97-F107 HydrophobicContact CG2-CZ 4.01Å; W105-F107 HydrophobicContact CD2-CD2 4.32Å; W105-F107 HydrophobicContact CE3-CD2 4.27Å; W105-F107 HydrophobicContact CH2-CB 4.5Å; W105-F107 AromaticContact CH2-CD2 3.79Å; W105-F107 HydrophobicContact CH2-CD2 3.79Å; W105-F107 HydrophobicContact CZ2-CB 3.74Å; W105-F107 AromaticContact CZ2-CD2 3.83Å; W105-F107 HydrophobicContact CZ2-CD2 3.83Å; W105-F107 HydrophobicContact CZ2-CG 4.26Å; W105-F107 HydrophobicContact CZ3-CD2 4.02Å; F107-A111 HydrophobicContact CB-CB 3.49Å; F107-A111 VanDerWaalsContact CB-CB 3.49Å; F107-A111 VanDerWaalsContact O-CB 3.31Å; F107-A111 WeakPolarHBondContact O-CB 3.27Å |
| 108 | G | 94.2 | Very high | 92.6 | Very high | 20 Ų | 20 | 46.8 Ų | 46.8 | 21% | 0.206 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | 78.6 | 175.5 | 179.3 | 0 | 0 | 0 | 0 | 0 | 114.6 | W105 L110 A111 C112 E180 | W105-G108 PolarHBondContact NE1-O 3.11Å; G108-L110 PolarHBondContact O-N 2.94Å; G108-A111 PolarHBondContact O-N 3.31Å; G108-C112 PolarHBondContact O-N 3.09Å; G108-E180 WeakPolarHBondContact CA-OE2 3.24Å |
| 109 | P | 95.1 | Very high | 92.8 | Very high | 87 Ų | 87 | 46.9 Ų | 46.9 | 57% | 0.565 | 25% | 0.253 | S | S | * | . | H | α-helix | trans | -70.6 | -39.1 | -165.4 | 23.3 | -33.4 | 0 | 0 | 0 | 112.5 | A111 C112 T113 E180 | P109-A111 VanDerWaalsContact C-N 3.34Å; P109-A111 PolarHBondContact O-N 3.07Å; P109-C112 WeakPolarHBondContact O-CB 3.29Å; P109-C112 PolarHBondContact O-N 3.36Å; P109-C112 VanDerWaalsContact O-N 3.15Å; P109-T113 PolarHBondContact O-N 3.43Å; P109-T113 PolarHBondContact O-OG1 3.48Å; P109-E180 WeakPolarHBondContact CA-OE2 3.39Å; P109-E180 HydrophobicContact CB-CB 4.3Å; P109-E180 VanDerWaalsContact CD-OE2 3.3Å; P109-E180 WeakPolarHBondContact CD-OE2 3.38Å |
| 110 | L | 95.5 | Very high | 93.1 | Very high | 128 Ų | 128 | 47.1 Ų | 47.1 | 67% | 0.67 | 25% | 0.253 | S | S | * | . | H | α-helix | trans | -59.6 | -45.7 | 178.1 | 177.7 | 63.5 | 0 | 0 | 0 | 111.4 | G108 C112 T113 L114 | G108-L110 PolarHBondContact O-N 2.94Å; L110-C112 VanDerWaalsContact C-N 3.3Å; L110-C112 PolarHBondContact O-N 3.38Å; L110-T113 PolarHBondContact O-N 3.35Å; L110-L114 HydrophobicContact CD1-CD1 4.1Å; L110-L114 HydrophobicContact CD1-CG 4.2Å; L110-L114 HydrophobicContact CG-CD1 3.98Å; L110-L114 HydrophobicContact CG-CG 4.44Å; L110-L114 WeakPolarHBondContact O-CB 3.22Å; L110-L114 VanDerWaalsContact O-CG 3.3Å; L110-L114 WeakPolarHBondContact O-CG 3.32Å; L110-L114 PolarHBondContact O-N 2.89Å |
| 111 | A | 94.9 | Very high | 93.5 | Very high | 23 Ų | 23 | 46.6 Ų | 46.6 | 19% | 0.19 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -65.4 | -36.4 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | W105 F107 G108 P109 L114 V115 | W105-A111 VanDerWaalsContact CZ2-C 3.49Å; W105-A111 HydrophobicContact CZ2-CB 3.79Å; F107-A111 HydrophobicContact CB-CB 3.49Å; F107-A111 VanDerWaalsContact CB-CB 3.49Å; F107-A111 VanDerWaalsContact O-CB 3.31Å; F107-A111 WeakPolarHBondContact O-CB 3.27Å; G108-A111 PolarHBondContact O-N 3.31Å; P109-A111 VanDerWaalsContact C-N 3.34Å; P109-A111 PolarHBondContact O-N 3.07Å; A111-L114 PolarHBondContact O-N 3.37Å; A111-V115 WeakPolarHBondContact O-CB 3.4Å; A111-V115 VanDerWaalsContact O-CG2 3.29Å; A111-V115 WeakPolarHBondContact O-CG2 3.16Å; A111-V115 PolarHBondContact O-N 3.35Å |
| 112 | C | 95.8 | Very high | 93.8 | Very high | 0 Ų | 0 | 41.9 Ų | 41.9 | 0% | 0 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -60.1 | -51.1 | 176.1 | 174.2 | 0 | 0 | 0 | 0 | 110.9 | W105 G108 P109 L110 L114 V115 K116 Q179 C190 | W105-C112 VanDerWaalsContact CZ2-CA 3.49Å; W105-C112 HydrophobicContact CZ2-CB 4.06Å; W105-C112 VanDerWaalsContact CZ2-N 3.31Å; G108-C112 PolarHBondContact O-N 3.09Å; P109-C112 WeakPolarHBondContact O-CB 3.29Å; P109-C112 PolarHBondContact O-N 3.36Å; P109-C112 VanDerWaalsContact O-N 3.15Å; L110-C112 VanDerWaalsContact C-N 3.3Å; L110-C112 PolarHBondContact O-N 3.38Å; C112-L114 PolarHBondContact O-N 3.47Å; C112-V115 PolarHBondContact O-N 3.09Å; C112-K116 WeakPolarHBondContact O-CB 3.43Å; C112-K116 WeakPolarHBondContact O-CG 3.25Å; C112-K116 PolarHBondContact O-N 3.25Å; C112-Q179 VanDerWaalsContact SG-C 3.54Å; C112-Q179 PolarHBondContact SG-O 3Å; C112-C190 WeakPolarHBondContact CA-SG 3.38Å; C112-C190 HydrophobicContact CB-CB 3.76Å; C112-C190 WeakPolarHBondContact CB-SG 3.46Å; C112-C190 WeakPolarHBondContact SG-CA 3.46Å; C112-C190 WeakPolarHBondContact SG-CB 3.36Å; C112-C190 CovalentContact SG-SG 2.03Å; C112-C190 PolarHBondContact SG-SG 2.88Å |
| 113 | T | 96.3 | Very high | 94.2 | Very high | 38 Ų | 38 | 38.2 Ų | 38.2 | 23% | 0.233 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -59.5 | -45.3 | 177.4 | -58.1 | 0 | 0 | 0 | 0 | 111.9 | P109 L110 G117 F175 A178 | P109-T113 PolarHBondContact O-N 3.43Å; P109-T113 PolarHBondContact O-OG1 3.48Å; L110-T113 PolarHBondContact O-N 3.35Å; T113-G117 PolarHBondContact O-N 2.89Å; T113-F175 HydrophobicContact CG2-CB 4.47Å; T113-F175 HydrophobicContact CG2-CD1 4.15Å; T113-F175 WeakPolarHBondContact CG2-O 3.49Å; T113-A178 PolarHBondContact OG1-O 3.34Å; T113-A178 VanDerWaalsContact OG1-O 3.05Å |
| 114 | L | 94.9 | Very high | 94.7 | Very high | 90 Ų | 90 | 36.1 Ų | 36.1 | 47% | 0.471 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -66.2 | -45.7 | 179.8 | -72.1 | 176.8 | 0 | 0 | 0 | 112.5 | L110 A111 C112 L118 | L110-L114 HydrophobicContact CD1-CD1 4.1Å; L110-L114 HydrophobicContact CD1-CG 4.2Å; L110-L114 HydrophobicContact CG-CD1 3.98Å; L110-L114 HydrophobicContact CG-CG 4.44Å; L110-L114 WeakPolarHBondContact O-CB 3.22Å; L110-L114 VanDerWaalsContact O-CG 3.3Å; L110-L114 WeakPolarHBondContact O-CG 3.32Å; L110-L114 PolarHBondContact O-N 2.89Å; A111-L114 PolarHBondContact O-N 3.37Å; C112-L114 PolarHBondContact O-N 3.47Å; L114-L118 WeakPolarHBondContact O-CA 3.27Å; L114-L118 WeakPolarHBondContact O-CB 3.25Å; L114-L118 PolarHBondContact O-N 3.03Å |
| 115 | V | 94.3 | Very high | 94.9 | Very high | 6 Ų | 6 | 34.5 Ų | 34.5 | 4% | 0.036 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -67.7 | -46.6 | -177.5 | 170.8 | 0 | 0 | 0 | 0 | 111.1 | L94 L95 W105 A111 C112 F119 | L94-V115 HydrophobicContact CB-CG2 4.02Å; L94-V115 HydrophobicContact CD1-CG2 3.55Å; L94-V115 HydrophobicContact CG-CG2 4.44Å; L95-V115 HydrophobicContact CD1-CG1 4.44Å; L95-V115 HydrophobicContact CD2-CG1 3.59Å; L95-V115 HydrophobicContact CG-CG1 3.91Å; W105-V115 HydrophobicContact CH2-CB 4.23Å; W105-V115 HydrophobicContact CH2-CG2 4.12Å; A111-V115 WeakPolarHBondContact O-CB 3.4Å; A111-V115 VanDerWaalsContact O-CG2 3.29Å; A111-V115 WeakPolarHBondContact O-CG2 3.16Å; A111-V115 PolarHBondContact O-N 3.35Å; C112-V115 PolarHBondContact O-N 3.09Å; V115-F119 WeakPolarHBondContact O-CB 3.41Å; V115-F119 PolarHBondContact O-N 3.26Å |
| 116 | K | 93.7 | Very high | 94.9 | Very high | 58 Ų | 58 | 34.4 Ų | 34.4 | 25% | 0.252 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -65.7 | -44 | 177.6 | -67.5 | -70.5 | -172.3 | 176.1 | 0 | 111.4 | C112 F119 Y120 A178 C190 L192 | C112-K116 WeakPolarHBondContact O-CB 3.43Å; C112-K116 WeakPolarHBondContact O-CG 3.25Å; C112-K116 PolarHBondContact O-N 3.25Å; K116-F119 PolarHBondContact O-N 2.85Å; K116-Y120 VanDerWaalsContact O-CD2 3.26Å; K116-Y120 WeakPolarHBondContact O-CD2 3.31Å; K116-A178 HydrophobicContact CB-CB 3.69Å; K116-A178 HydrophobicContact CG-CB 4.21Å; K116-C190 WeakPolarHBondContact CE-O 3.19Å; K116-C190 VanDerWaalsContact CG-SG 3.57Å; K116-C190 PolarHBondContact NZ-O 2.8Å; K116-L192 HydrophobicContact CB-CD2 4.29Å |
| 117 | G | 95.1 | Very high | 95 | Very high | 0 Ų | 0 | 30 Ų | 30 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -66.2 | -44.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | T113 F119 Y120 L121 | T113-G117 PolarHBondContact O-N 2.89Å; G117-F119 VanDerWaalsContact C-N 3.29Å; G117-F119 PolarHBondContact O-N 2.88Å; G117-Y120 PolarHBondContact O-N 2.94Å; G117-L121 WeakPolarHBondContact O-CB 3.49Å; G117-L121 PolarHBondContact O-N 2.79Å |
| 118 | L | 94.8 | Very high | 95.1 | Very high | 42 Ų | 42 | 28 Ų | 28 | 22% | 0.22 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -59.4 | -40.2 | 177.3 | -179.2 | 61.4 | 0 | 0 | 0 | 111.5 | L114 Y120 L121 V122 | L114-L118 WeakPolarHBondContact O-CA 3.27Å; L114-L118 WeakPolarHBondContact O-CB 3.25Å; L114-L118 PolarHBondContact O-N 3.03Å; L118-Y120 VanDerWaalsContact C-N 3.32Å; L118-Y120 PolarHBondContact O-N 3.18Å; L118-L121 HydrophobicContact CD1-CD2 4.12Å; L118-L121 WeakPolarHBondContact O-CB 3.25Å; L118-L121 PolarHBondContact O-N 3.33Å; L118-V122 HydrophobicContact CD1-CG1 3.88Å; L118-V122 HydrophobicContact CG-CG1 4.27Å; L118-V122 WeakPolarHBondContact O-CG1 3.32Å; L118-V122 WeakPolarHBondContact O-CG2 3.38Å; L118-V122 PolarHBondContact O-N 2.93Å |
| 119 | F | 94.4 | Very high | 95.1 | Very high | 14 Ų | 14 | 27.3 Ų | 27.3 | 6% | 0.061 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -55.9 | -43.7 | 177.3 | 176.3 | -107.6 | 0 | 0 | 0 | 113 | V115 K116 G117 V122 M123 W258 L261 V289 A292 Y293 | V115-F119 WeakPolarHBondContact O-CB 3.41Å; V115-F119 PolarHBondContact O-N 3.26Å; K116-F119 PolarHBondContact O-N 2.85Å; G117-F119 VanDerWaalsContact C-N 3.29Å; G117-F119 PolarHBondContact O-N 2.88Å; F119-V122 WeakPolarHBondContact O-CG2 3.29Å; F119-M123 PolarHBondContact O-N 3.08Å; F119-W258 HydrophobicContact CE1-CZ3 4.25Å; F119-W258 HydrophobicContact CE2-CH2 4.1Å; F119-W258 HydrophobicContact CE2-CZ3 4.3Å; F119-W258 HydrophobicContact CZ-CH2 4.12Å; F119-W258 AromaticContact CZ-CZ3 3.84Å; F119-W258 HydrophobicContact CZ-CZ3 3.84Å; F119-L261 HydrophobicContact CE1-CD2 3.7Å; F119-L261 HydrophobicContact CZ-CD2 3.61Å; F119-V289 HydrophobicContact CZ-CG1 4.48Å; F119-A292 HydrophobicContact CE2-CB 4.48Å; F119-A292 HydrophobicContact CZ-CB 4.2Å; F119-Y293 HydrophobicContact CD2-CD2 4.46Å; F119-Y293 AromaticContact CD2-CE1 3.99Å; F119-Y293 HydrophobicContact CD2-CE1 3.99Å; F119-Y293 AromaticContact CD2-CE2 3.63Å; F119-Y293 HydrophobicContact CD2-CE2 3.63Å; F119-Y293 AromaticContact CD2-CZ 3.34Å; F119-Y293 WeakPolarHBondContact CD2-OH 2.99Å; F119-Y293 AromaticContact CE2-CD2 3.92Å; F119-Y293 HydrophobicContact CE2-CD2 3.92Å; F119-Y293 HydrophobicContact CE2-CE1 4.27Å; F119-Y293 AromaticContact CE2-CE2 3.45Å; F119-Y293 HydrophobicContact CE2-CE2 3.45Å; F119-Y293 VanDerWaalsContact CE2-CE2 3.45Å; F119-Y293 HydrophobicContact CE2-CG 4.49Å; F119-Y293 AromaticContact CE2-CZ 3.66Å; F119-Y293 HydrophobicContact CZ-CE2 4.5Å |
| 120 | Y | 94.9 | Very high | 94.9 | Very high | 13 Ų | 13 | 23.5 Ų | 23.5 | 5% | 0.051 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -81 | -29.8 | 176.1 | -66.6 | -77.3 | 0 | 0 | 0 | 113 | K116 G117 L118 M123 Y124 Q174 L192 R206 | K116-Y120 VanDerWaalsContact O-CD2 3.26Å; K116-Y120 WeakPolarHBondContact O-CD2 3.31Å; G117-Y120 PolarHBondContact O-N 2.94Å; L118-Y120 VanDerWaalsContact C-N 3.32Å; L118-Y120 PolarHBondContact O-N 3.18Å; Y120-M123 HydrophobicContact CD1-CE 4.14Å; Y120-M123 HydrophobicContact CD1-SD 4.09Å; Y120-M123 WeakPolarHBondContact O-CB 3.13Å; Y120-M123 PolarHBondContact O-N 3.16Å; Y120-Y124 WeakPolarHBondContact O-CD2 3.34Å; Y120-Y124 PolarHBondContact O-N 2.81Å; Y120-Q174 HydrophobicContact CD1-CG 4.48Å; Y120-Q174 HydrophobicContact CD2-CB 3.69Å; Y120-Q174 HydrophobicContact CD2-CG 3.43Å; Y120-Q174 VanDerWaalsContact CD2-CG 3.43Å; Y120-Q174 HydrophobicContact CE2-CB 4.37Å; Y120-Q174 HydrophobicContact CE2-CG 3.89Å; Y120-Q174 HydrophobicContact CG-CB 4.24Å; Y120-Q174 HydrophobicContact CG-CG 3.76Å; Y120-L192 HydrophobicContact CE2-CD1 3.67Å; Y120-R206 VanDerWaalsContact CE1-CD 3.44Å; Y120-R206 PolarHBondContact OH-NH1 3.36Å |
| 121 | L | 96.3 | Very high | 94.9 | Very high | 20 Ų | 20 | 18.7 Ų | 18.7 | 11% | 0.105 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -58.7 | -48.2 | 171.7 | 176 | 63.1 | 0 | 0 | 0 | 110.7 | G117 L118 M123 Y124 C125 W164 A167 L168 F175 | G117-L121 WeakPolarHBondContact O-CB 3.49Å; G117-L121 PolarHBondContact O-N 2.79Å; L118-L121 HydrophobicContact CD1-CD2 4.12Å; L118-L121 WeakPolarHBondContact O-CB 3.25Å; L118-L121 PolarHBondContact O-N 3.33Å; L121-M123 VanDerWaalsContact C-N 3.34Å; L121-M123 PolarHBondContact O-N 3.49Å; L121-Y124 PolarHBondContact O-N 2.92Å; L121-C125 WeakPolarHBondContact O-CB 3.42Å; L121-C125 PolarHBondContact O-N 3.41Å; L121-C125 PolarHBondContact O-SG 3.45Å; L121-W164 HydrophobicContact CD2-CZ3 4.28Å; L121-W164 HydrophobicContact CG-CZ3 4.43Å; L121-A167 HydrophobicContact CD1-CB 3.83Å; L121-L168 HydrophobicContact CD1-CB 4.17Å; L121-L168 HydrophobicContact CD1-CD1 4.49Å; L121-F175 HydrophobicContact CB-CE2 4.47Å |
| 122 | V | 94.6 | Very high | 94.9 | Very high | 2 Ų | 2 | 19.3 Ų | 19.3 | 1% | 0.012 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -66.6 | -35.9 | 178.4 | -60.9 | 0 | 0 | 0 | 0 | 111.7 | T84 L87 C88 L118 F119 C125 S126 | T84-V122 HydrophobicContact CG2-CB 3.81Å; T84-V122 HydrophobicContact CG2-CG1 4.12Å; T84-V122 WeakPolarHBondContact CG2-O 3.21Å; L87-V122 HydrophobicContact CB-CG1 4.27Å; C88-V122 HydrophobicContact CB-CB 4.22Å; C88-V122 HydrophobicContact CB-CG1 4.34Å; C88-V122 HydrophobicContact CB-CG2 3.86Å; L118-V122 HydrophobicContact CD1-CG1 3.88Å; L118-V122 HydrophobicContact CG-CG1 4.27Å; L118-V122 WeakPolarHBondContact O-CG1 3.32Å; L118-V122 WeakPolarHBondContact O-CG2 3.38Å; L118-V122 PolarHBondContact O-N 2.93Å; F119-V122 WeakPolarHBondContact O-CG2 3.29Å; V122-C125 PolarHBondContact O-N 2.86Å; V122-S126 WeakPolarHBondContact O-CB 3.38Å; V122-S126 PolarHBondContact O-N 2.95Å; V122-S126 PolarHBondContact O-OG 3.16Å; V122-S126 VanDerWaalsContact O-OG 3.12Å |
| 123 | M | 94.8 | Very high | 94.6 | Very high | 0 Ų | 0 | 20 Ų | 20 | 0% | 0 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -55.6 | -55.3 | 171.1 | -177 | -164.9 | 74.7 | 0 | 0 | 111.3 | F119 Y120 L121 S126 I127 R206 W258 | F119-M123 PolarHBondContact O-N 3.08Å; Y120-M123 HydrophobicContact CD1-CE 4.14Å; Y120-M123 HydrophobicContact CD1-SD 4.09Å; Y120-M123 WeakPolarHBondContact O-CB 3.13Å; Y120-M123 PolarHBondContact O-N 3.16Å; L121-M123 VanDerWaalsContact C-N 3.34Å; L121-M123 PolarHBondContact O-N 3.49Å; M123-S126 PolarHBondContact O-N 3.2Å; M123-I127 WeakPolarHBondContact O-CG2 3.3Å; M123-I127 PolarHBondContact O-N 2.86Å; M123-R206 HydrophobicContact CE-CG 4.12Å; M123-W258 HydrophobicContact CB-CE3 4.27Å; M123-W258 HydrophobicContact CB-CH2 3.39Å; M123-W258 HydrophobicContact CB-CZ2 3.93Å; M123-W258 HydrophobicContact CB-CZ3 3.59Å; M123-W258 HydrophobicContact CG-CD2 3.97Å; M123-W258 HydrophobicContact CG-CE3 3.56Å; M123-W258 HydrophobicContact CG-CH2 3.63Å; M123-W258 HydrophobicContact CG-CZ2 4.01Å; M123-W258 HydrophobicContact CG-CZ3 3.38Å; M123-W258 HydrophobicContact SD-CE3 3.81Å; M123-W258 HydrophobicContact SD-CZ3 3.74Å |
| 124 | Y | 96.9 | Very high | 94.4 | Very high | 6 Ų | 6 | 18.1 Ų | 18.1 | 2% | 0.024 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -63.6 | -42.1 | -179.5 | -79.6 | -65.1 | 0 | 0 | 0 | 111.9 | Y120 L121 S126 I127 L128 G170 R206 M209 | Y120-Y124 WeakPolarHBondContact O-CD2 3.34Å; Y120-Y124 PolarHBondContact O-N 2.81Å; L121-Y124 PolarHBondContact O-N 2.92Å; Y124-S126 PolarHBondContact O-N 3.08Å; Y124-I127 WeakPolarHBondContact O-CG2 3.33Å; Y124-L128 VanDerWaalsContact O-CB 3.24Å; Y124-L128 WeakPolarHBondContact O-CB 3.47Å; Y124-L128 WeakPolarHBondContact O-CG 3.39Å; Y124-L128 PolarHBondContact O-N 3.41Å; Y124-G170 VanDerWaalsContact CE2-C 3.43Å; Y124-G170 VanDerWaalsContact CE2-O 3.25Å; Y124-G170 WeakPolarHBondContact CE2-O 3.26Å; Y124-R206 WeakPolarHBondContact OH-CA 3.31Å; Y124-M209 HydrophobicContact CE1-CB 4.06Å |
| 125 | C | 96.2 | Very high | 94.3 | Very high | 0 Ų | 0 | 16.3 Ų | 16.3 | 0% | 0 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -57.4 | -50.1 | 175.1 | -83.9 | 0 | 0 | 0 | 0 | 111.2 | T84 L121 V122 Q129 A167 | T84-C125 HydrophobicContact CG2-CB 3.54Å; L121-C125 WeakPolarHBondContact O-CB 3.42Å; L121-C125 PolarHBondContact O-N 3.41Å; L121-C125 PolarHBondContact O-SG 3.45Å; V122-C125 PolarHBondContact O-N 2.86Å; C125-Q129 VanDerWaalsContact O-CB 3.31Å; C125-Q129 WeakPolarHBondContact O-CB 3.43Å; C125-Q129 WeakPolarHBondContact O-CG 3.44Å; C125-Q129 PolarHBondContact O-N 2.97Å; C125-Q129 PolarHBondContact O-NE2 3.05Å; C125-Q129 VanDerWaalsContact O-NE2 3.13Å; C125-A167 HydrophobicContact CB-CB 4.28Å; C125-A167 WeakPolarHBondContact SG-CB 3.45Å |
| 126 | S | 93.7 | Very high | 94.2 | Very high | 2 Ų | 2 | 16.8 Ų | 16.8 | 1% | 0.014 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -61.3 | -48.3 | -178.8 | -70.4 | 0 | 0 | 0 | 0 | 111.8 | T84 V122 M123 Y124 Q129 L130 | T84-S126 WeakPolarHBondContact CG2-OG 3.39Å; V122-S126 WeakPolarHBondContact O-CB 3.38Å; V122-S126 PolarHBondContact O-N 2.95Å; V122-S126 PolarHBondContact O-OG 3.16Å; V122-S126 VanDerWaalsContact O-OG 3.12Å; M123-S126 PolarHBondContact O-N 3.2Å; Y124-S126 PolarHBondContact O-N 3.08Å; S126-Q129 PolarHBondContact O-N 2.94Å; S126-L130 WeakPolarHBondContact O-CG 3.39Å; S126-L130 PolarHBondContact O-N 3.23Å |
| 127 | I | 94.9 | Very high | 93.9 | Very high | 0 Ų | 0 | 16.8 Ų | 16.8 | 0% | 0 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -69.3 | -40.1 | -178.1 | -167.5 | 50.8 | 0 | 0 | 0 | 113.1 | M123 Y124 Q129 L130 V131 P214 I218 F254 F255 | M123-I127 WeakPolarHBondContact O-CG2 3.3Å; M123-I127 PolarHBondContact O-N 2.86Å; Y124-I127 WeakPolarHBondContact O-CG2 3.33Å; I127-Q129 VanDerWaalsContact C-N 3.3Å; I127-Q129 PolarHBondContact O-N 3.49Å; I127-L130 HydrophobicContact CD1-CB 4.45Å; I127-L130 HydrophobicContact CD1-CD1 4.31Å; I127-L130 WeakPolarHBondContact O-CB 3.32Å; I127-L130 PolarHBondContact O-N 2.97Å; I127-L130 VanDerWaalsContact O-N 3.17Å; I127-V131 WeakPolarHBondContact O-CG2 3.43Å; I127-V131 PolarHBondContact O-N 3.39Å; I127-P214 HydrophobicContact CD1-CB 3.67Å; I127-P214 HydrophobicContact CG1-CB 3.28Å; I127-P214 HydrophobicContact CG1-CG 3.61Å; I127-P214 HydrophobicContact CG2-CG 4.41Å; I127-I218 HydrophobicContact CD1-CD1 3.83Å; I127-F254 HydrophobicContact CB-CE1 3.9Å; I127-F254 HydrophobicContact CB-CE2 4Å; I127-F254 HydrophobicContact CB-CZ 3.52Å; I127-F254 HydrophobicContact CD1-CD1 3.67Å; I127-F254 HydrophobicContact CD1-CE1 3.54Å; I127-F254 HydrophobicContact CD1-CG 4.28Å; I127-F254 HydrophobicContact CD1-CZ 4.04Å; I127-F254 HydrophobicContact CG1-CD1 4.46Å; I127-F254 HydrophobicContact CG1-CE1 3.83Å; I127-F254 HydrophobicContact CG1-CZ 4Å; I127-F254 HydrophobicContact CG2-CZ 4.44Å; I127-F255 HydrophobicContact CD1-CE1 4.26Å; I127-F255 HydrophobicContact CD1-CZ 3.9Å |
| 128 | L | 96.3 | Very high | 93.7 | Very high | 40 Ų | 40 | 18.7 Ų | 18.7 | 21% | 0.209 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -67 | -33.5 | 176.8 | -70.4 | 175 | 0 | 0 | 0 | 111.5 | Y124 V131 L132 V163 L166 A167 | Y124-L128 VanDerWaalsContact O-CB 3.24Å; Y124-L128 WeakPolarHBondContact O-CB 3.47Å; Y124-L128 WeakPolarHBondContact O-CG 3.39Å; Y124-L128 PolarHBondContact O-N 3.41Å; L128-V131 PolarHBondContact O-N 2.76Å; L128-L132 WeakPolarHBondContact O-CB 3.15Å; L128-L132 PolarHBondContact O-N 3.39Å; L128-V163 HydrophobicContact CB-CB 4.47Å; L128-V163 HydrophobicContact CB-CG1 3.58Å; L128-V163 HydrophobicContact CB-CG2 4.23Å; L128-V163 HydrophobicContact CD1-CG1 4.35Å; L128-L166 HydrophobicContact CD1-CB 3.87Å; L128-A167 HydrophobicContact CD1-CB 4.24Å |
| 129 | Q | 93.4 | Very high | 93.5 | Very high | 4 Ų | 4 | 19.2 Ų | 19.2 | 2% | 0.019 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -65.6 | -40 | 171.1 | -74.6 | 170.7 | 59.5 | 0 | 0 | 111.8 | N80 L81 T84 C125 S126 I127 L132 I133 V163 | N80-Q129 PolarHBondContact O-OE1 3.04Å; L81-Q129 HydrophobicContact CD1-CB 4.27Å; T84-Q129 PolarHBondContact OG1-NE2 2.94Å; C125-Q129 VanDerWaalsContact O-CB 3.31Å; C125-Q129 WeakPolarHBondContact O-CB 3.43Å; C125-Q129 WeakPolarHBondContact O-CG 3.44Å; C125-Q129 PolarHBondContact O-N 2.97Å; C125-Q129 PolarHBondContact O-NE2 3.05Å; C125-Q129 VanDerWaalsContact O-NE2 3.13Å; S126-Q129 PolarHBondContact O-N 2.94Å; I127-Q129 VanDerWaalsContact C-N 3.3Å; I127-Q129 PolarHBondContact O-N 3.49Å; Q129-L132 PolarHBondContact O-N 2.69Å; Q129-I133 WeakPolarHBondContact O-CB 3.27Å; Q129-I133 WeakPolarHBondContact O-CD1 3.12Å; Q129-I133 VanDerWaalsContact O-CG1 3.23Å; Q129-I133 WeakPolarHBondContact O-CG1 3.48Å; Q129-I133 PolarHBondContact O-N 2.85Å; Q129-V163 HydrophobicContact CG-CG1 3.98Å |
| 130 | L | 92 | Very high | 93.2 | Very high | 8 Ų | 8 | 21.1 Ų | 21.1 | 4% | 0.042 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -63.5 | -40.9 | 173.7 | -66.8 | 179.4 | 0 | 0 | 0 | 112.1 | S126 I127 I133 S134 I218 V250 F254 | S126-L130 WeakPolarHBondContact O-CG 3.39Å; S126-L130 PolarHBondContact O-N 3.23Å; I127-L130 HydrophobicContact CD1-CB 4.45Å; I127-L130 HydrophobicContact CD1-CD1 4.31Å; I127-L130 WeakPolarHBondContact O-CB 3.32Å; I127-L130 PolarHBondContact O-N 2.97Å; I127-L130 VanDerWaalsContact O-N 3.17Å; L130-I133 PolarHBondContact O-N 3.44Å; L130-S134 WeakPolarHBondContact O-CB 3.35Å; L130-S134 PolarHBondContact O-N 2.92Å; L130-S134 PolarHBondContact O-OG 2.96Å; L130-I218 HydrophobicContact CB-CD1 3.97Å; L130-V250 HydrophobicContact CD1-CG1 4.37Å; L130-V250 HydrophobicContact CD2-CG1 3.47Å; L130-V250 VanDerWaalsContact CD2-CG1 3.47Å; L130-F254 HydrophobicContact CD1-CB 3.74Å; L130-F254 HydrophobicContact CD1-CD2 3.96Å; L130-F254 HydrophobicContact CD1-CG 3.86Å |
| 131 | V | 95.4 | Very high | 92.8 | Very high | 27 Ų | 27 | 22.6 Ų | 22.6 | 16% | 0.164 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -58.6 | -49.5 | 171.8 | 170.7 | 0 | 0 | 0 | 0 | 110.2 | I127 L128 I133 S134 V135 P214 V217 I218 | I127-V131 WeakPolarHBondContact O-CG2 3.43Å; I127-V131 PolarHBondContact O-N 3.39Å; L128-V131 PolarHBondContact O-N 2.76Å; V131-I133 PolarHBondContact O-N 3.33Å; V131-S134 WeakPolarHBondContact O-CB 3.34Å; V131-S134 PolarHBondContact O-N 3.47Å; V131-S134 VanDerWaalsContact O-N 3.11Å; V131-V135 HydrophobicContact CG1-CG2 4.34Å; V131-V135 WeakPolarHBondContact O-CG2 3.29Å; V131-V135 PolarHBondContact O-N 3.45Å; V131-P214 HydrophobicContact CG2-CB 3.72Å; V131-V217 HydrophobicContact CG1-CG1 3.76Å; V131-I218 HydrophobicContact CG2-CD1 3.97Å; V131-I218 HydrophobicContact CG2-CG1 3.9Å |
| 132 | L | 94.3 | Very high | 92.5 | Very high | 35 Ų | 35 | 27.3 Ų | 27.3 | 18% | 0.183 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -60.3 | -44.3 | -179.3 | -177.6 | 57.2 | 0 | 0 | 0 | 112.3 | W77 L128 Q129 S134 V135 D136 A159 V163 | W77-L132 HydrophobicContact CE3-CD2 3.95Å; W77-L132 HydrophobicContact CE3-CG 4.45Å; W77-L132 HydrophobicContact CH2-CD1 4.05Å; W77-L132 HydrophobicContact CH2-CD2 3.44Å; W77-L132 VanDerWaalsContact CH2-CD2 3.44Å; W77-L132 HydrophobicContact CH2-CG 3.68Å; W77-L132 HydrophobicContact CZ2-CD1 4.46Å; W77-L132 HydrophobicContact CZ2-CD2 4.32Å; W77-L132 HydrophobicContact CZ2-CG 4.1Å; W77-L132 HydrophobicContact CZ3-CD2 3.22Å; W77-L132 HydrophobicContact CZ3-CG 3.88Å; L128-L132 WeakPolarHBondContact O-CB 3.15Å; L128-L132 PolarHBondContact O-N 3.39Å; Q129-L132 PolarHBondContact O-N 2.69Å; L132-S134 VanDerWaalsContact C-N 3.32Å; L132-S134 PolarHBondContact O-N 3.05Å; L132-V135 PolarHBondContact O-N 3.47Å; L132-D136 WeakPolarHBondContact O-CB 3.14Å; L132-D136 PolarHBondContact O-N 3.02Å; L132-A159 HydrophobicContact CD1-CB 4.23Å; L132-A159 HydrophobicContact CD2-CB 3.97Å; L132-V163 HydrophobicContact CD2-CG2 3.87Å |
| 133 | I | 90.3 | Very high | 92.2 | Very high | 14 Ų | 14 | 33.3 Ų | 33.3 | 7% | 0.072 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -62.3 | -41.4 | 175.1 | -68.1 | 163.8 | 0 | 0 | 0 | 110.5 | W77 Q129 L130 V131 D136 R137 I247 | W77-I133 HydrophobicContact CB-CD1 4.2Å; W77-I133 HydrophobicContact CB-CG1 4.05Å; W77-I133 HydrophobicContact CG-CG1 4.03Å; Q129-I133 WeakPolarHBondContact O-CB 3.27Å; Q129-I133 WeakPolarHBondContact O-CD1 3.12Å; Q129-I133 VanDerWaalsContact O-CG1 3.23Å; Q129-I133 WeakPolarHBondContact O-CG1 3.48Å; Q129-I133 PolarHBondContact O-N 2.85Å; L130-I133 PolarHBondContact O-N 3.44Å; V131-I133 PolarHBondContact O-N 3.33Å; I133-D136 PolarHBondContact O-N 3.33Å; I133-R137 WeakPolarHBondContact O-CG 3.19Å; I133-R137 PolarHBondContact O-N 2.96Å; I133-I247 HydrophobicContact CG2-CD1 4.19Å; I133-I247 HydrophobicContact CG2-CG1 4.45Å |
| 134 | S | 91 | Very high | 91.7 | Very high | 0 Ų | 0 | 36 Ų | 36 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -65.1 | -42.8 | 179.4 | -56.6 | 0 | 0 | 0 | 0 | 112 | L130 V131 L132 R137 L138 H222 | L130-S134 WeakPolarHBondContact O-CB 3.35Å; L130-S134 PolarHBondContact O-N 2.92Å; L130-S134 PolarHBondContact O-OG 2.96Å; V131-S134 WeakPolarHBondContact O-CB 3.34Å; V131-S134 PolarHBondContact O-N 3.47Å; V131-S134 VanDerWaalsContact O-N 3.11Å; L132-S134 VanDerWaalsContact C-N 3.32Å; L132-S134 PolarHBondContact O-N 3.05Å; S134-R137 PolarHBondContact O-N 3.13Å; S134-L138 PolarHBondContact O-N 3.45Å; S134-H222 PolarHBondContact OG-CE1 3.48Å |
| 135 | V | 93.5 | Very high | 91.3 | Very high | 52 Ų | 52 | 40.8 Ų | 40.8 | 32% | 0.315 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -66.3 | -42.9 | 175.2 | 173 | 0 | 0 | 0 | 0 | 110.9 | V131 L132 R137 L138 L139 V217 | V131-V135 HydrophobicContact CG1-CG2 4.34Å; V131-V135 WeakPolarHBondContact O-CG2 3.29Å; V131-V135 PolarHBondContact O-N 3.45Å; L132-V135 PolarHBondContact O-N 3.47Å; V135-R137 VanDerWaalsContact C-N 3.26Å; V135-R137 PolarHBondContact O-N 2.92Å; V135-L138 WeakPolarHBondContact O-CB 3.1Å; V135-L138 PolarHBondContact O-N 3.05Å; V135-L138 VanDerWaalsContact O-N 3.1Å; V135-L139 HydrophobicContact CG1-CD1 4.24Å; V135-L139 HydrophobicContact CG1-CG 4.42Å; V135-L139 WeakPolarHBondContact O-CG 3.49Å; V135-L139 PolarHBondContact O-N 2.79Å; V135-V217 HydrophobicContact CG2-CG1 4.49Å |
| 136 | D | 90.9 | Very high | 91.1 | Very high | 15 Ų | 15 | 46.4 Ų | 46.4 | 8% | 0.08 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -57.3 | -40.7 | 174.2 | -179.7 | 61.5 | 0 | 0 | 0 | 111.3 | W77 L132 I133 L139 L140 R151 | W77-D136 PolarHBondContact NE1-OD2 3.4Å; L132-D136 WeakPolarHBondContact O-CB 3.14Å; L132-D136 PolarHBondContact O-N 3.02Å; I133-D136 PolarHBondContact O-N 3.33Å; D136-L139 PolarHBondContact O-N 3.02Å; D136-L140 VanDerWaalsContact O-CG 3.3Å; D136-L140 WeakPolarHBondContact O-CG 3.4Å; D136-L140 PolarHBondContact O-N 2.95Å; D136-R151 IonicContact OD1-CZ 3Å; D136-R151 IonicContact OD1-NE 2.76Å; D136-R151 PolarHBondContact OD1-NE 2.88Å; D136-R151 IonicContact OD1-NH2 3.26Å; D136-R151 PolarHBondContact OD1-NH2 3.49Å; D136-R151 IonicContact OD2-CZ 3.35Å; D136-R151 IonicContact OD2-NE 3.97Å; D136-R151 IonicContact OD2-NH2 3.79Å; D136-R151 PolarHBondContact OD2-NH2 3.34Å |
| 137 | R | 88.5 | Confident | 90.8 | Very high | 58 Ų | 58 | 46.7 Ų | 46.7 | 22% | 0.219 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -65 | -42 | 173.9 | -68.3 | -41 | -176.2 | -177.1 | -4.8 | 113.2 | I133 S134 V135 L139 L140 V141 V225 I247 | I133-R137 WeakPolarHBondContact O-CG 3.19Å; I133-R137 PolarHBondContact O-N 2.96Å; S134-R137 PolarHBondContact O-N 3.13Å; V135-R137 VanDerWaalsContact C-N 3.26Å; V135-R137 PolarHBondContact O-N 2.92Å; R137-L139 VanDerWaalsContact C-N 3.31Å; R137-L139 PolarHBondContact O-N 3.45Å; R137-L140 PolarHBondContact O-N 2.76Å; R137-V141 WeakPolarHBondContact O-CG2 3.49Å; R137-V141 PolarHBondContact O-N 2.85Å; R137-V225 HydrophobicContact CB-CG2 4.48Å; R137-I247 HydrophobicContact CG-CD1 3.41Å; R137-I247 VanDerWaalsContact CG-CD1 3.41Å |
| 138 | L | 90.7 | Very high | 90.4 | Very high | 40 Ų | 40 | 54.6 Ų | 54.6 | 21% | 0.209 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -58.7 | -45.6 | 175.2 | 176.6 | 62.5 | 0 | 0 | 0 | 111.1 | S134 V135 V141 K142 C221 V224 V225 | S134-L138 PolarHBondContact O-N 3.45Å; V135-L138 WeakPolarHBondContact O-CB 3.1Å; V135-L138 PolarHBondContact O-N 3.05Å; V135-L138 VanDerWaalsContact O-N 3.1Å; L138-V141 PolarHBondContact O-N 2.95Å; L138-K142 HydrophobicContact CD1-CG 3.83Å; L138-K142 WeakPolarHBondContact O-CB 3.3Å; L138-K142 PolarHBondContact O-N 3.29Å; L138-C221 HydrophobicContact CB-CB 4.39Å; L138-C221 HydrophobicContact CD2-CB 4.47Å; L138-V224 HydrophobicContact CD1-CB 3.82Å; L138-V224 HydrophobicContact CD1-CG1 3.42Å; L138-V224 VanDerWaalsContact CD1-CG1 3.42Å; L138-V225 HydrophobicContact CB-CG2 4.24Å; L138-V225 HydrophobicContact CD1-CG2 4.25Å |
| 139 | L | 91.2 | Very high | 90 | Very high | 54 Ų | 54 | 57.8 Ų | 57.8 | 28% | 0.283 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -63.4 | -43.3 | 178.1 | -68.4 | 175.5 | 0 | 0 | 0 | 112.2 | V135 D136 R137 V141 K142 K143 C147 | V135-L139 HydrophobicContact CG1-CD1 4.24Å; V135-L139 HydrophobicContact CG1-CG 4.42Å; V135-L139 WeakPolarHBondContact O-CG 3.49Å; V135-L139 PolarHBondContact O-N 2.79Å; D136-L139 PolarHBondContact O-N 3.02Å; R137-L139 VanDerWaalsContact C-N 3.31Å; R137-L139 PolarHBondContact O-N 3.45Å; L139-V141 PolarHBondContact O-N 2.93Å; L139-K142 PolarHBondContact O-N 3.06Å; L139-K143 HydrophobicContact CD2-CD 4.28Å; L139-K143 CarbonylContact O-C 3.56Å; L139-K143 VanDerWaalsContact O-C 3.31Å; L139-K143 WeakPolarHBondContact O-CA 3.22Å; L139-K143 PolarHBondContact O-N 2.89Å; L139-C147 VanDerWaalsContact C-SG 3.58Å |
| 140 | L | 87.8 | Confident | 89.8 | Confident | 54 Ų | 54 | 60.7 Ų | 60.7 | 28% | 0.283 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -59.8 | -27.3 | 176.8 | -76.2 | 169 | 0 | 0 | 0 | 113.3 | D136 R137 C147 | D136-L140 VanDerWaalsContact O-CG 3.3Å; D136-L140 WeakPolarHBondContact O-CG 3.4Å; D136-L140 PolarHBondContact O-N 2.95Å; R137-L140 PolarHBondContact O-N 2.76Å; L140-C147 HydrophobicContact CD2-CB 3.81Å |
| 141 | V | 86.9 | Confident | 89.7 | Confident | 43 Ų | 43 | 63.4 Ų | 63.4 | 26% | 0.261 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -92.1 | -41.9 | 179.7 | 173.3 | 0 | 0 | 0 | 0 | 112.2 | R137 L138 L139 V225 T228 | R137-V141 WeakPolarHBondContact O-CG2 3.49Å; R137-V141 PolarHBondContact O-N 2.85Å; L138-V141 PolarHBondContact O-N 2.95Å; L139-V141 PolarHBondContact O-N 2.93Å; V141-V225 HydrophobicContact CB-CG2 4.5Å; V141-V225 HydrophobicContact CG2-CG1 4.2Å; V141-V225 HydrophobicContact CG2-CG2 4.35Å; V141-T228 HydrophobicContact CG1-CG2 3.47Å; V141-T228 VanDerWaalsContact CG1-CG2 3.47Å |
| 142 | K | 88.7 | Confident | 89.6 | Confident | 120 Ų | 120 | 69.7 Ų | 69.7 | 52% | 0.522 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -85.1 | -33.7 | -176.7 | -74.2 | -68.1 | -169 | -177.4 | 0 | 113.7 | L138 L139 V224 T228 | L138-K142 HydrophobicContact CD1-CG 3.83Å; L138-K142 WeakPolarHBondContact O-CB 3.3Å; L138-K142 PolarHBondContact O-N 3.29Å; L139-K142 PolarHBondContact O-N 3.06Å; K142-V224 HydrophobicContact CD-CG1 4.43Å; K142-V224 HydrophobicContact CG-CG1 4.42Å; K142-T228 WeakPolarHBondContact CE-OG1 3.47Å; K142-T228 PolarHBondContact NZ-OG1 3.24Å |
| 143 | K | 88.2 | Confident | 89.5 | Confident | 127 Ų | 127 | 70.3 Ų | 70.3 | 55% | 0.552 | 35% | 0.346 | S | S | * | . | S | Bend | trans | -128.6 | 47.9 | -173.5 | -62.1 | -171.3 | 177.8 | -177.6 | 0 | 110.8 | L139 V145 W146 C147 | L139-K143 HydrophobicContact CD2-CD 4.28Å; L139-K143 CarbonylContact O-C 3.56Å; L139-K143 VanDerWaalsContact O-C 3.31Å; L139-K143 WeakPolarHBondContact O-CA 3.22Å; L139-K143 PolarHBondContact O-N 2.89Å; K143-V145 VanDerWaalsContact C-N 3.33Å; K143-V145 PolarHBondContact O-N 3.09Å; K143-W146 HydrophobicContact CB-CB 4.15Å; K143-W146 PolarHBondContact O-N 2.88Å; K143-W146 VanDerWaalsContact O-N 3.13Å; K143-C147 PolarHBondContact O-N 3.03Å |
| 144 | A | 85.9 | Confident | 89.6 | Confident | 56 Ų | 56 | 78 Ų | 78 | 46% | 0.463 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -54.1 | -44.1 | -175 | 0 | 0 | 0 | 0 | 0 | 113.6 | C147 Q148 | A144-C147 PolarHBondContact O-N 3.43Å; A144-Q148 PolarHBondContact O-N 3.32Å |
| 145 | V | 88.5 | Confident | 89.7 | Confident | 107 Ų | 107 | 82.2 Ų | 82.2 | 65% | 0.648 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -63.2 | -43.6 | 178.7 | -179.8 | 0 | 0 | 0 | 0 | 111.4 | K143 Q148 N149 | K143-V145 VanDerWaalsContact C-N 3.33Å; K143-V145 PolarHBondContact O-N 3.09Å; V145-Q148 PolarHBondContact O-N 3.48Å; V145-N149 PolarHBondContact O-N 2.85Å |
| 146 | W | 90.9 | Very high | 89.7 | Confident | 119 Ų | 119 | 80 Ų | 80 | 45% | 0.451 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -63.5 | -44.3 | 175.9 | -179.4 | 88.6 | 0 | 0 | 0 | 111 | K143 Q148 N149 N150 | K143-W146 HydrophobicContact CB-CB 4.15Å; K143-W146 PolarHBondContact O-N 2.88Å; K143-W146 VanDerWaalsContact O-N 3.13Å; W146-Q148 VanDerWaalsContact C-N 3.28Å; W146-Q148 PolarHBondContact O-N 3.44Å; W146-N149 PolarHBondContact O-N 3.06Å; W146-N150 HydrophobicContact CD2-CB 4Å; W146-N150 HydrophobicContact CG-CB 4.44Å; W146-N150 HydrophobicContact CH2-CB 4.32Å; W146-N150 HydrophobicContact CZ2-CB 3.8Å; W146-N150 WeakPolarHBondContact O-CB 3.3Å; W146-N150 PolarHBondContact O-N 2.9Å |
| 147 | C | 87.4 | Confident | 89.9 | Confident | 7 Ų | 7 | 81.3 Ų | 81.3 | 5% | 0.047 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -61.4 | -37.8 | 176.6 | -72 | 0 | 0 | 0 | 0 | 111.9 | L139 L140 K143 A144 N149 R151 | L139-C147 VanDerWaalsContact C-SG 3.58Å; L140-C147 HydrophobicContact CD2-CB 3.81Å; K143-C147 PolarHBondContact O-N 3.03Å; A144-C147 PolarHBondContact O-N 3.43Å; C147-N149 VanDerWaalsContact C-N 3.27Å; C147-N149 PolarHBondContact O-N 3.08Å; C147-R151 HydrophobicContact CB-CB 4.23Å; C147-R151 WeakPolarHBondContact O-CB 3.44Å; C147-R151 PolarHBondContact O-N 3.3Å |
| 148 | Q | 86 | Confident | 90.3 | Very high | 166 Ų | 166 | 87.6 Ų | 87.6 | 78% | 0.776 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -62 | -36.1 | 178.2 | -172.7 | 170.2 | -7.8 | 0 | 0 | 112.5 | A144 V145 W146 | A144-Q148 PolarHBondContact O-N 3.32Å; V145-Q148 PolarHBondContact O-N 3.48Å; W146-Q148 VanDerWaalsContact C-N 3.28Å; W146-Q148 PolarHBondContact O-N 3.44Å |
| 149 | N | 89.2 | Confident | 90.5 | Very high | 108 Ų | 108 | 87 Ų | 87 | 58% | 0.578 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -93.3 | -33.1 | -175.7 | -67.5 | 5.7 | 0 | 0 | 0 | 113.3 | V145 W146 C147 | V145-N149 PolarHBondContact O-N 2.85Å; W146-N149 PolarHBondContact O-N 3.06Å; C147-N149 VanDerWaalsContact C-N 3.27Å; C147-N149 PolarHBondContact O-N 3.08Å |
| 150 | N | 88.2 | Confident | 90.8 | Very high | 65 Ų | 65 | 84.7 Ų | 84.7 | 35% | 0.348 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -109.9 | -22.1 | -169.3 | -111.9 | 55.9 | 0 | 0 | 0 | 114.5 | W146 R152 Q155 | W146-N150 HydrophobicContact CD2-CB 4Å; W146-N150 HydrophobicContact CG-CB 4.44Å; W146-N150 HydrophobicContact CH2-CB 4.32Å; W146-N150 HydrophobicContact CZ2-CB 3.8Å; W146-N150 WeakPolarHBondContact O-CB 3.3Å; W146-N150 PolarHBondContact O-N 2.9Å; N150-R152 PolarHBondContact O-N 3.37Å; N150-Q155 PolarHBondContact O-OE1 3.44Å |
| 151 | R | 90.3 | Very high | 91.2 | Very high | 64 Ų | 64 | 85.5 Ų | 85.5 | 24% | 0.242 | 42% | 0.418 | C | S | . | . | trans | -73.1 | 91.6 | -173.3 | -173.8 | 174.3 | 176.3 | -86.9 | 3.8 | 111.7 | V73 D136 C147 | V73-R151 HydrophobicContact CB-CG 4.45Å; V73-R151 HydrophobicContact CG1-CG 4.46Å; V73-R151 VanDerWaalsContact CG1-CZ 3.46Å; V73-R151 VanDerWaalsContact CG1-NH2 3.28Å; V73-R151 HydrophobicContact CG2-CG 3.89Å; D136-R151 IonicContact OD1-CZ 3Å; D136-R151 IonicContact OD1-NE 2.76Å; D136-R151 PolarHBondContact OD1-NE 2.88Å; D136-R151 IonicContact OD1-NH2 3.26Å; D136-R151 PolarHBondContact OD1-NH2 3.49Å; D136-R151 IonicContact OD2-CZ 3.35Å; D136-R151 IonicContact OD2-NE 3.97Å; D136-R151 IonicContact OD2-NH2 3.79Å; D136-R151 PolarHBondContact OD2-NH2 3.34Å; C147-R151 HydrophobicContact CB-CB 4.23Å; C147-R151 WeakPolarHBondContact O-CB 3.44Å; C147-R151 PolarHBondContact O-N 3.3Å | ||
| 152 | R | 92.9 | Very high | 91.7 | Very high | 159 Ų | 159 | 85.8 Ų | 85.8 | 60% | 0.6 | 43% | 0.425 | S | S | * | . | trans | -109.3 | 147.9 | -174.9 | -65.9 | -179.8 | -174.8 | -157 | 1.9 | 113 | N150 K154 Q155 A156 | N150-R152 PolarHBondContact O-N 3.37Å; R152-K154 VanDerWaalsContact C-N 3.26Å; R152-K154 PolarHBondContact O-N 3.28Å; R152-Q155 PolarHBondContact O-N 2.79Å; R152-Q155 VanDerWaalsContact O-N 3.14Å; R152-A156 PolarHBondContact O-N 2.89Å | ||
| 153 | P | 92 | Very high | 92.2 | Very high | 49 Ų | 49 | 80.6 Ų | 80.6 | 32% | 0.318 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -55.7 | -36.1 | 176.7 | -27 | 35.2 | 0 | 0 | 0 | 114.3 | I76 Q155 A156 A157 | I76-P153 HydrophobicContact CD1-CB 3.75Å; I76-P153 WeakPolarHBondContact CD1-O 3.3Å; P153-Q155 VanDerWaalsContact C-N 3.33Å; P153-Q155 PolarHBondContact O-N 3.07Å; P153-A156 WeakPolarHBondContact O-CB 3.5Å; P153-A156 PolarHBondContact O-N 3.37Å; P153-A157 PolarHBondContact O-N 3.46Å |
| 154 | K | 93.3 | Very high | 92.6 | Very high | 176 Ų | 176 | 77.3 Ų | 77.3 | 77% | 0.765 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -60.5 | -40.5 | 177.9 | -68.4 | -172.9 | 177.7 | -175.3 | 0 | 112.6 | R152 A157 W158 | R152-K154 VanDerWaalsContact C-N 3.26Å; R152-K154 PolarHBondContact O-N 3.28Å; K154-A157 PolarHBondContact O-N 2.88Å; K154-W158 VanDerWaalsContact O-CD1 3.28Å; K154-W158 PolarHBondContact O-N 3.06Å |
| 155 | Q | 93.6 | Very high | 93.2 | Very high | 88 Ų | 88 | 78.3 Ų | 78.3 | 41% | 0.411 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -68.6 | -37.7 | 177.3 | -67.6 | 168 | -28.4 | 0 | 0 | 111.5 | N150 R152 P153 A157 W158 A159 | N150-Q155 PolarHBondContact O-OE1 3.44Å; R152-Q155 PolarHBondContact O-N 2.79Å; R152-Q155 VanDerWaalsContact O-N 3.14Å; P153-Q155 VanDerWaalsContact C-N 3.33Å; P153-Q155 PolarHBondContact O-N 3.07Å; Q155-A157 VanDerWaalsContact C-N 3.33Å; Q155-W158 PolarHBondContact O-N 3.01Å; Q155-A159 WeakPolarHBondContact O-CB 3.42Å; Q155-A159 PolarHBondContact O-N 3.23Å |
| 156 | A | 93.1 | Very high | 93.7 | Very high | 5 Ų | 5 | 78 Ų | 78 | 4% | 0.041 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -63.3 | -40.2 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112 | V73 I76 W77 R152 P153 A159 C160 | V73-A156 HydrophobicContact CB-CB 4.05Å; V73-A156 HydrophobicContact CG1-CB 3.71Å; V73-A156 HydrophobicContact CG2-CB 3.87Å; I76-A156 HydrophobicContact CB-CB 4.44Å; I76-A156 HydrophobicContact CD1-CB 4.12Å; I76-A156 HydrophobicContact CG2-CB 4.25Å; W77-A156 HydrophobicContact CH2-CB 3.67Å; W77-A156 HydrophobicContact CZ2-CB 3.96Å; W77-A156 HydrophobicContact CZ3-CB 4.05Å; W77-A156 WeakPolarHBondContact CZ3-O 3.09Å; R152-A156 PolarHBondContact O-N 2.89Å; P153-A156 WeakPolarHBondContact O-CB 3.5Å; P153-A156 PolarHBondContact O-N 3.37Å; A156-A159 PolarHBondContact O-N 3.27Å; A156-C160 PolarHBondContact O-N 3.3Å; A156-C160 PolarHBondContact O-SG 2.84Å |
| 157 | A | 94.7 | Very high | 94 | Very high | 42 Ų | 42 | 72.3 Ų | 72.3 | 35% | 0.347 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -60.8 | -46.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | P153 K154 Q155 A159 C160 V161 | P153-A157 PolarHBondContact O-N 3.46Å; K154-A157 PolarHBondContact O-N 2.88Å; Q155-A157 VanDerWaalsContact C-N 3.33Å; A157-A159 VanDerWaalsContact C-N 3.32Å; A157-A159 PolarHBondContact O-N 3.09Å; A157-C160 WeakPolarHBondContact O-CB 3.34Å; A157-C160 PolarHBondContact O-N 3.46Å; A157-V161 WeakPolarHBondContact O-CG2 3.38Å; A157-V161 PolarHBondContact O-N 3.22Å |
| 158 | W | 96.3 | Very high | 94.5 | Very high | 191 Ų | 191 | 76.3 Ų | 76.3 | 72% | 0.723 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -62.4 | -37.4 | 174.8 | -80.1 | 115.5 | 0 | 0 | 0 | 113.1 | K154 Q155 C160 V161 A162 | K154-W158 VanDerWaalsContact O-CD1 3.28Å; K154-W158 PolarHBondContact O-N 3.06Å; Q155-W158 PolarHBondContact O-N 3.01Å; W158-C160 VanDerWaalsContact C-N 3.35Å; W158-V161 HydrophobicContact CE3-CB 4.43Å; W158-V161 PolarHBondContact O-N 3.43Å; W158-A162 PolarHBondContact O-N 3.43Å |
| 159 | A | 96.3 | Very high | 95 | Very high | 28 Ų | 28 | 73.7 Ų | 73.7 | 23% | 0.231 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -64.7 | -38.1 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | W77 L132 Q155 A156 A157 A162 V163 | W77-A159 HydrophobicContact CH2-CB 3.94Å; W77-A159 HydrophobicContact CZ3-CB 4.32Å; L132-A159 HydrophobicContact CD1-CB 4.23Å; L132-A159 HydrophobicContact CD2-CB 3.97Å; Q155-A159 WeakPolarHBondContact O-CB 3.42Å; Q155-A159 PolarHBondContact O-N 3.23Å; A156-A159 PolarHBondContact O-N 3.27Å; A157-A159 VanDerWaalsContact C-N 3.32Å; A157-A159 PolarHBondContact O-N 3.09Å; A159-A162 PolarHBondContact O-N 3.08Å; A159-V163 WeakPolarHBondContact O-CG2 3.45Å; A159-V163 PolarHBondContact O-N 3.45Å |
| 160 | C | 95.9 | Very high | 95.3 | Very high | 4 Ų | 4 | 69 Ų | 69 | 3% | 0.027 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -62.1 | -46.5 | 171.5 | -73.1 | 0 | 0 | 0 | 0 | 111.7 | W77 N80 A156 A157 W158 A162 V163 W164 | W77-C160 VanDerWaalsContact CE3-SG 3.54Å; W77-C160 WeakPolarHBondContact CZ3-SG 3.46Å; N80-C160 PolarHBondContact ND2-SG 3.49Å; A156-C160 PolarHBondContact O-N 3.3Å; A156-C160 PolarHBondContact O-SG 2.84Å; A157-C160 WeakPolarHBondContact O-CB 3.34Å; A157-C160 PolarHBondContact O-N 3.46Å; W158-C160 VanDerWaalsContact C-N 3.35Å; C160-A162 VanDerWaalsContact C-N 3.28Å; C160-A162 PolarHBondContact O-N 2.93Å; C160-V163 WeakPolarHBondContact O-CA 3Å; C160-V163 WeakPolarHBondContact O-CB 2.99Å; C160-V163 PolarHBondContact O-N 3.03Å; C160-W164 PolarHBondContact O-N 3.4Å |
| 161 | V | 97.1 | Very high | 95.7 | Very high | 72 Ų | 72 | 65.9 Ų | 65.9 | 44% | 0.436 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -56.8 | -45.3 | 176.2 | 173.4 | 0 | 0 | 0 | 0 | 110.7 | A157 W158 V163 W164 C165 | A157-V161 WeakPolarHBondContact O-CG2 3.38Å; A157-V161 PolarHBondContact O-N 3.22Å; W158-V161 HydrophobicContact CE3-CB 4.43Å; W158-V161 PolarHBondContact O-N 3.43Å; V161-V163 VanDerWaalsContact C-N 3.31Å; V161-V163 PolarHBondContact O-N 2.89Å; V161-W164 PolarHBondContact O-N 3.13Å; V161-C165 PolarHBondContact O-N 2.97Å; V161-C165 PolarHBondContact O-SG 3.33Å; V161-C165 VanDerWaalsContact O-SG 3.32Å |
| 162 | A | 97.9 | Very high | 96 | Very high | 48 Ų | 48 | 66.5 Ų | 66.5 | 40% | 0.397 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -59.5 | -40.9 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | W158 A159 C160 C165 L166 | W158-A162 PolarHBondContact O-N 3.43Å; A159-A162 PolarHBondContact O-N 3.08Å; C160-A162 VanDerWaalsContact C-N 3.28Å; C160-A162 PolarHBondContact O-N 2.93Å; A162-C165 PolarHBondContact O-N 2.9Å; A162-L166 WeakPolarHBondContact O-CB 3.14Å; A162-L166 VanDerWaalsContact O-CG 3.26Å; A162-L166 WeakPolarHBondContact O-CG 3.28Å; A162-L166 PolarHBondContact O-N 3.5Å |
| 163 | V | 97.9 | Very high | 96.1 | Very high | 11 Ų | 11 | 60.3 Ų | 60.3 | 7% | 0.067 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -61 | -45.9 | 174.5 | 166.5 | 0 | 0 | 0 | 0 | 111.6 | L128 Q129 L132 A159 C160 V161 C165 L166 A167 | L128-V163 HydrophobicContact CB-CB 4.47Å; L128-V163 HydrophobicContact CB-CG1 3.58Å; L128-V163 HydrophobicContact CB-CG2 4.23Å; L128-V163 HydrophobicContact CD1-CG1 4.35Å; Q129-V163 HydrophobicContact CG-CG1 3.98Å; L132-V163 HydrophobicContact CD2-CG2 3.87Å; A159-V163 WeakPolarHBondContact O-CG2 3.45Å; A159-V163 PolarHBondContact O-N 3.45Å; C160-V163 WeakPolarHBondContact O-CA 3Å; C160-V163 WeakPolarHBondContact O-CB 2.99Å; C160-V163 PolarHBondContact O-N 3.03Å; V161-V163 VanDerWaalsContact C-N 3.31Å; V161-V163 PolarHBondContact O-N 2.89Å; V163-C165 VanDerWaalsContact C-N 3.35Å; V163-C165 PolarHBondContact O-N 3.47Å; V163-L166 PolarHBondContact O-N 2.88Å; V163-A167 VanDerWaalsContact O-CB 3.28Å; V163-A167 WeakPolarHBondContact O-CB 3.31Å; V163-A167 PolarHBondContact O-N 3.49Å |
| 164 | W | 97.9 | Very high | 96.2 | Very high | 59 Ų | 59 | 58 Ų | 58 | 22% | 0.223 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -60.8 | -43.2 | 176.9 | -80.7 | 97.6 | 0 | 0 | 0 | 112 | N80 L83 L87 L121 C160 V161 A167 L168 | N80-W164 PolarHBondContact OD1-NE1 3.05Å; L83-W164 HydrophobicContact CD2-CZ2 4.13Å; L83-W164 HydrophobicContact CG-CZ2 4.39Å; L87-W164 HydrophobicContact CD1-CH2 3.77Å; L87-W164 HydrophobicContact CD1-CZ3 4.49Å; L121-W164 HydrophobicContact CD2-CZ3 4.28Å; L121-W164 HydrophobicContact CG-CZ3 4.43Å; C160-W164 PolarHBondContact O-N 3.4Å; V161-W164 PolarHBondContact O-N 3.13Å; W164-A167 PolarHBondContact O-N 3.25Å; W164-L168 WeakPolarHBondContact O-CB 3.34Å; W164-L168 PolarHBondContact O-N 3.35Å |
| 165 | C | 98.2 | Very high | 96.3 | Very high | 77 Ų | 77 | 52 Ų | 52 | 52% | 0.52 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -63.1 | -43.4 | 176 | -65.6 | 0 | 0 | 0 | 0 | 112.2 | V161 A162 V163 L168 L169 | V161-C165 PolarHBondContact O-N 2.97Å; V161-C165 PolarHBondContact O-SG 3.33Å; V161-C165 VanDerWaalsContact O-SG 3.32Å; A162-C165 PolarHBondContact O-N 2.9Å; V163-C165 VanDerWaalsContact C-N 3.35Å; V163-C165 PolarHBondContact O-N 3.47Å; C165-L168 PolarHBondContact O-N 3.15Å; C165-L169 WeakPolarHBondContact O-CB 3.48Å; C165-L169 PolarHBondContact O-N 3.42Å |
| 166 | L | 97.9 | Very high | 96.4 | Very high | 100 Ų | 100 | 52.7 Ų | 52.7 | 52% | 0.524 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -66.9 | -37.9 | 177.4 | -71.6 | 172.2 | 0 | 0 | 0 | 112.1 | L128 A162 V163 L169 G170 | L128-L166 HydrophobicContact CD1-CB 3.87Å; A162-L166 WeakPolarHBondContact O-CB 3.14Å; A162-L166 VanDerWaalsContact O-CG 3.26Å; A162-L166 WeakPolarHBondContact O-CG 3.28Å; A162-L166 PolarHBondContact O-N 3.5Å; V163-L166 PolarHBondContact O-N 2.88Å; L166-L169 PolarHBondContact O-N 2.89Å; L166-G170 PolarHBondContact O-N 3.07Å |
| 167 | A | 98 | Very high | 96.5 | Very high | 0 Ų | 0 | 55.9 Ų | 55.9 | 0% | 0 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -67.4 | -39.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | L121 C125 L128 V163 W164 G170 S171 | L121-A167 HydrophobicContact CD1-CB 3.83Å; C125-A167 HydrophobicContact CB-CB 4.28Å; C125-A167 WeakPolarHBondContact SG-CB 3.45Å; L128-A167 HydrophobicContact CD1-CB 4.24Å; V163-A167 VanDerWaalsContact O-CB 3.28Å; V163-A167 WeakPolarHBondContact O-CB 3.31Å; V163-A167 PolarHBondContact O-N 3.49Å; W164-A167 PolarHBondContact O-N 3.25Å; A167-G170 PolarHBondContact O-N 3.49Å; A167-S171 WeakPolarHBondContact O-CB 3.45Å; A167-S171 PolarHBondContact O-N 3.29Å; A167-S171 PolarHBondContact O-OG 3.37Å |
| 168 | L | 97.4 | Very high | 96.5 | Very high | 90 Ų | 90 | 54 Ų | 54 | 47% | 0.471 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -61.7 | -48.6 | 172.6 | -175.5 | 61.8 | 0 | 0 | 0 | 110.6 | L121 W164 C165 G170 S171 I172 F175 | L121-L168 HydrophobicContact CD1-CB 4.17Å; L121-L168 HydrophobicContact CD1-CD1 4.49Å; W164-L168 WeakPolarHBondContact O-CB 3.34Å; W164-L168 PolarHBondContact O-N 3.35Å; C165-L168 PolarHBondContact O-N 3.15Å; L168-G170 VanDerWaalsContact C-N 3.31Å; L168-G170 PolarHBondContact O-N 2.84Å; L168-S171 WeakPolarHBondContact CA-OG 3.33Å; L168-S171 PolarHBondContact O-N 2.92Å; L168-S171 VanDerWaalsContact O-N 3.09Å; L168-S171 PolarHBondContact O-OG 2.78Å; L168-I172 VanDerWaalsContact O-CG1 3.3Å; L168-I172 WeakPolarHBondContact O-CG1 3.16Å; L168-I172 PolarHBondContact O-N 3.22Å; L168-I172 VanDerWaalsContact O-N 3.1Å; L168-F175 HydrophobicContact CD1-CE2 4.11Å |
| 169 | L | 97.5 | Very high | 96.5 | Very high | 112 Ų | 112 | 49.6 Ų | 49.6 | 59% | 0.586 | 27% | 0.274 | S | S | * | . | H | α-helix | trans | -56.5 | -44.7 | 176.7 | -179.2 | 62 | 0 | 0 | 0 | 112.1 | C165 L166 S171 I172 | C165-L169 WeakPolarHBondContact O-CB 3.48Å; C165-L169 PolarHBondContact O-N 3.42Å; L166-L169 PolarHBondContact O-N 2.89Å; L169-S171 VanDerWaalsContact C-N 3.31Å; L169-S171 PolarHBondContact O-N 3.35Å; L169-I172 HydrophobicContact CD1-CD1 3.84Å; L169-I172 WeakPolarHBondContact O-CG1 3.4Å |
| 170 | G | 95.7 | Very high | 96.4 | Very high | 8 Ų | 8 | 50.2 Ų | 50.2 | 8% | 0.082 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -68 | -27.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | Y124 L166 A167 L168 Q174 | Y124-G170 VanDerWaalsContact CE2-C 3.43Å; Y124-G170 VanDerWaalsContact CE2-O 3.25Å; Y124-G170 WeakPolarHBondContact CE2-O 3.26Å; L166-G170 PolarHBondContact O-N 3.07Å; A167-G170 PolarHBondContact O-N 3.49Å; L168-G170 VanDerWaalsContact C-N 3.31Å; L168-G170 PolarHBondContact O-N 2.84Å; G170-Q174 PolarHBondContact O-OE1 3.36Å |
| 171 | S | 96.7 | Very high | 96.3 | Very high | 0 Ų | 0 | 52.8 Ų | 52.8 | 0% | 0 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -92.5 | -4.2 | -179.3 | 52.6 | 0 | 0 | 0 | 0 | 114.4 | A167 L168 L169 P173 Q174 F175 | A167-S171 WeakPolarHBondContact O-CB 3.45Å; A167-S171 PolarHBondContact O-N 3.29Å; A167-S171 PolarHBondContact O-OG 3.37Å; L168-S171 WeakPolarHBondContact CA-OG 3.33Å; L168-S171 PolarHBondContact O-N 2.92Å; L168-S171 VanDerWaalsContact O-N 3.09Å; L168-S171 PolarHBondContact O-OG 2.78Å; L169-S171 VanDerWaalsContact C-N 3.31Å; L169-S171 PolarHBondContact O-N 3.35Å; S171-P173 VanDerWaalsContact C-CD 3.46Å; S171-Q174 VanDerWaalsContact C-OE1 3.27Å; S171-Q174 VanDerWaalsContact CA-OE1 3.31Å; S171-Q174 PolarHBondContact O-N 3.18Å; S171-Q174 PolarHBondContact O-OE1 3.05Å; S171-Q174 VanDerWaalsContact O-OE1 3.05Å; S171-F175 VanDerWaalsContact O-CD2 3.29Å; S171-F175 WeakPolarHBondContact O-CD2 3.35Å; S171-F175 PolarHBondContact O-N 3.36Å |
| 172 | I | 96.1 | Very high | 96.1 | Very high | 78 Ų | 78 | 57.5 Ų | 57.5 | 40% | 0.4 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -49.8 | -48.4 | 178.9 | -66.3 | -177.8 | 0 | 0 | 0 | 112.5 | L168 L169 Q174 F175 V176 | L168-I172 VanDerWaalsContact O-CG1 3.3Å; L168-I172 WeakPolarHBondContact O-CG1 3.16Å; L168-I172 PolarHBondContact O-N 3.22Å; L168-I172 VanDerWaalsContact O-N 3.1Å; L169-I172 HydrophobicContact CD1-CD1 3.84Å; L169-I172 WeakPolarHBondContact O-CG1 3.4Å; I172-Q174 PolarHBondContact O-N 2.86Å; I172-Q174 VanDerWaalsContact O-N 3.16Å; I172-F175 PolarHBondContact O-N 3.12Å; I172-F175 VanDerWaalsContact O-N 3.08Å; I172-V176 HydrophobicContact CG2-CG2 3.94Å; I172-V176 WeakPolarHBondContact O-CG2 3.47Å; I172-V176 PolarHBondContact O-N 3.45Å |
| 173 | P | 94.6 | Very high | 95.6 | Very high | 29 Ų | 29 | 59.4 Ų | 59.4 | 19% | 0.188 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -55.5 | -37.9 | -179.5 | -25.5 | 35.1 | 0 | 0 | 0 | 112.2 | S171 V176 Y177 I202 | S171-P173 VanDerWaalsContact C-CD 3.46Å; P173-V176 PolarHBondContact O-N 3.04Å; P173-Y177 HydrophobicContact CB-CD2 4.31Å; P173-Y177 WeakPolarHBondContact O-CB 3.48Å; P173-Y177 WeakPolarHBondContact O-CD2 3.46Å; P173-Y177 PolarHBondContact O-N 3.35Å; P173-I202 HydrophobicContact CB-CD1 4.41Å; P173-I202 HydrophobicContact CB-CG1 4.48Å; P173-I202 HydrophobicContact CB-CG2 4.09Å |
| 174 | Q | 94.3 | Very high | 95 | Very high | 0 Ų | 0 | 61.7 Ų | 61.7 | 0% | 0 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -73.7 | -31.3 | -177.6 | -64.8 | 79.6 | 4.3 | 0 | 0 | 111.9 | Y120 G170 S171 I172 A178 L192 | Y120-Q174 HydrophobicContact CD1-CG 4.48Å; Y120-Q174 HydrophobicContact CD2-CB 3.69Å; Y120-Q174 HydrophobicContact CD2-CG 3.43Å; Y120-Q174 VanDerWaalsContact CD2-CG 3.43Å; Y120-Q174 HydrophobicContact CE2-CB 4.37Å; Y120-Q174 HydrophobicContact CE2-CG 3.89Å; Y120-Q174 HydrophobicContact CG-CB 4.24Å; Y120-Q174 HydrophobicContact CG-CG 3.76Å; G170-Q174 PolarHBondContact O-OE1 3.36Å; S171-Q174 VanDerWaalsContact C-OE1 3.27Å; S171-Q174 VanDerWaalsContact CA-OE1 3.31Å; S171-Q174 PolarHBondContact O-N 3.18Å; S171-Q174 PolarHBondContact O-OE1 3.05Å; S171-Q174 VanDerWaalsContact O-OE1 3.05Å; I172-Q174 PolarHBondContact O-N 2.86Å; I172-Q174 VanDerWaalsContact O-N 3.16Å; Q174-A178 WeakPolarHBondContact O-CB 3.34Å; Q174-A178 PolarHBondContact O-N 2.88Å; Q174-A178 VanDerWaalsContact O-N 3.15Å; Q174-L192 HydrophobicContact CB-CD2 4.16Å; Q174-L192 HydrophobicContact CG-CD2 4.4Å |
| 175 | F | 96 | Very high | 94.3 | Very high | 49 Ų | 49 | 67.5 Ų | 67.5 | 22% | 0.215 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -68.8 | -37.1 | 168 | -74.1 | -79.5 | 0 | 0 | 0 | 112.2 | T113 L121 L168 S171 I172 | T113-F175 HydrophobicContact CG2-CB 4.47Å; T113-F175 HydrophobicContact CG2-CD1 4.15Å; T113-F175 WeakPolarHBondContact CG2-O 3.49Å; L121-F175 HydrophobicContact CB-CE2 4.47Å; L168-F175 HydrophobicContact CD1-CE2 4.11Å; S171-F175 VanDerWaalsContact O-CD2 3.29Å; S171-F175 WeakPolarHBondContact O-CD2 3.35Å; S171-F175 PolarHBondContact O-N 3.36Å; I172-F175 PolarHBondContact O-N 3.12Å; I172-F175 VanDerWaalsContact O-N 3.08Å |
| 176 | V | 95.4 | Very high | 93.8 | Very high | 103 Ų | 103 | 71.4 Ų | 71.4 | 62% | 0.624 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -74.3 | -42.2 | -177.5 | 172.1 | 0 | 0 | 0 | 0 | 112.2 | I172 P173 | I172-V176 HydrophobicContact CG2-CG2 3.94Å; I172-V176 WeakPolarHBondContact O-CG2 3.47Å; I172-V176 PolarHBondContact O-N 3.45Å; P173-V176 PolarHBondContact O-N 3.04Å |
| 177 | Y | 94.8 | Very high | 93.4 | Very high | 72 Ų | 72 | 68.8 Ų | 68.8 | 28% | 0.282 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -91.3 | -7.9 | -176.3 | -70.8 | -76 | 0 | 0 | 0 | 113.6 | P173 Q179 A193 Y194 I202 | P173-Y177 HydrophobicContact CB-CD2 4.31Å; P173-Y177 WeakPolarHBondContact O-CB 3.48Å; P173-Y177 WeakPolarHBondContact O-CD2 3.46Å; P173-Y177 PolarHBondContact O-N 3.35Å; Y177-Q179 PolarHBondContact O-N 2.91Å; Y177-A193 WeakPolarHBondContact CD1-O 3.4Å; Y177-A193 PolarHBondContact O-N 2.91Å; Y177-Y194 HydrophobicContact CD1-CD1 4.09Å; Y177-Y194 AromaticContact CD2-CD1 3.8Å; Y177-Y194 HydrophobicContact CD2-CD1 3.8Å; Y177-Y194 AromaticContact CD2-CE1 3.92Å; Y177-Y194 HydrophobicContact CD2-CE1 3.92Å; Y177-Y194 HydrophobicContact CE2-CD1 4.47Å; Y177-Y194 AromaticContact CG-CD1 3.6Å; Y177-Y194 HydrophobicContact CG-CD1 3.6Å; Y177-Y194 AromaticContact CG-CE1 3.92Å; Y177-Y194 HydrophobicContact CG-CE1 3.92Å; Y177-I202 HydrophobicContact CD2-CD1 3.71Å; Y177-I202 HydrophobicContact CE2-CD1 3.27Å |
| 178 | A | 95.3 | Very high | 93.2 | Very high | 4 Ų | 4 | 73.5 Ų | 73.5 | 3% | 0.033 | 37% | 0.367 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -74.1 | 117.3 | 172.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | T113 K116 Q174 V191 L192 | T113-A178 PolarHBondContact OG1-O 3.34Å; T113-A178 VanDerWaalsContact OG1-O 3.05Å; K116-A178 HydrophobicContact CB-CB 3.69Å; K116-A178 HydrophobicContact CG-CB 4.21Å; Q174-A178 WeakPolarHBondContact O-CB 3.34Å; Q174-A178 PolarHBondContact O-N 2.88Å; Q174-A178 VanDerWaalsContact O-N 3.15Å; A178-V191 WeakPolarHBondContact CA-O 3.32Å; A178-L192 HydrophobicContact CB-CD2 4Å |
| 179 | Q | 95.1 | Very high | 93 | Very high | 97 Ų | 97 | 70.5 Ų | 70.5 | 45% | 0.453 | 35% | 0.35 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -144.6 | 152.5 | 179 | 61 | 175.5 | -0 | 0 | 0 | 112 | C112 Y177 I181 V191 A193 | C112-Q179 VanDerWaalsContact SG-C 3.54Å; C112-Q179 PolarHBondContact SG-O 3Å; Y177-Q179 PolarHBondContact O-N 2.91Å; Q179-I181 HydrophobicContact CG-CG2 4.06Å; Q179-V191 PolarHBondContact N-O 3.23Å; Q179-V191 PolarHBondContact O-N 2.86Å; Q179-V191 VanDerWaalsContact O-N 3.1Å; Q179-A193 HydrophobicContact CG-CB 3.73Å |
| 180 | E | 95 | Very high | 92.8 | Very high | 41 Ų | 41 | 65.8 Ų | 65.8 | 19% | 0.192 | 33% | 0.327 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.5 | 124 | 169 | -178.7 | 179.4 | 156.8 | 0 | 0 | 109.2 | G108 P109 R188 E189 | G108-E180 WeakPolarHBondContact CA-OE2 3.24Å; P109-E180 WeakPolarHBondContact CA-OE2 3.39Å; P109-E180 HydrophobicContact CB-CB 4.3Å; P109-E180 VanDerWaalsContact CD-OE2 3.3Å; P109-E180 WeakPolarHBondContact CD-OE2 3.38Å; E180-R188 HydrophobicContact CG-CB 4.11Å; E180-R188 WeakPolarHBondContact OE1-CD 3.43Å; E180-R188 IonicContact OE1-CZ 2.76Å; E180-R188 IonicContact OE1-NE 2.71Å; E180-R188 PolarHBondContact OE1-NE 3.22Å; E180-E189 WeakPolarHBondContact CA-O 3.49Å |
| 181 | I | 93.5 | Very high | 92.7 | Very high | 58 Ų | 58 | 67.3 Ų | 67.3 | 30% | 0.297 | 34% | 0.335 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.4 | 146.3 | 177 | 62.7 | 166.6 | 0 | 0 | 0 | 110.5 | Q179 R188 E189 V191 | Q179-I181 HydrophobicContact CG-CG2 4.06Å; I181-R188 CarbonylContact O-C 3.31Å; I181-R188 VanDerWaalsContact O-CA 3.29Å; I181-R188 WeakPolarHBondContact O-CA 3.42Å; I181-E189 HydrophobicContact CG1-CB 4.1Å; I181-E189 PolarHBondContact N-O 3.2Å; I181-E189 PolarHBondContact O-N 3.37Å; I181-V191 HydrophobicContact CD1-CG1 4.03Å; I181-V191 HydrophobicContact CD1-CG2 3.71Å; I181-V191 HydrophobicContact CG1-CG1 4.28Å; I181-V191 HydrophobicContact CG1-CG2 3.84Å; I181-V191 HydrophobicContact CG2-CG2 3.89Å |
| 182 | K | 92.9 | Very high | 92.4 | Very high | 171 Ų | 171 | 69 Ų | 69 | 74% | 0.743 | 34% | 0.343 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -86.8 | 131.4 | 172.7 | -62.8 | -178.7 | -178.5 | -179.5 | 0 | 109.5 | R188 | K182-R188 HydrophobicContact CG-CG 4.43Å |
| 183 | K | 87.6 | Confident | 92.1 | Very high | 89 Ų | 89 | 66.9 Ų | 66.9 | 39% | 0.387 | 34% | 0.338 | S | S | . | . | trans | -119.8 | 77.1 | 175.2 | -169.2 | 174.9 | -177.4 | 169.9 | 0 | 108.9 | K187 E189 | K183-K187 HydrophobicContact CB-CG 4.43Å; K183-K187 HydrophobicContact CD-CD 4.42Å; K183-K187 PolarHBondContact N-O 3.24Å; K183-K187 WeakPolarHBondContact O-CB 3.26Å; K183-E189 HydrophobicContact CD-CG 4.34Å; K183-E189 WeakPolarHBondContact CD-OE1 3.16Å; K183-E189 WeakPolarHBondContact CE-OE1 2.87Å; K183-E189 IonicContact NZ-OE1 3.24Å; K183-E189 PolarHBondContact NZ-OE1 3.12Å; K183-E189 IonicContact NZ-OE2 3.82Å; K183-E189 PolarHBondContact NZ-OE2 3.47Å | ||
| 184 | G | 85.7 | Confident | 91.9 | Very high | 58 Ų | 58 | 67.6 Ų | 67.6 | 60% | 0.598 | 34% | 0.337 | S | S | * | . | S | Bend | trans | 86.6 | -168.8 | -168.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||
| 185 | E | 83.4 | Confident | 91.5 | Very high | 181 Ų | 181 | 70.4 Ų | 70.4 | 85% | 0.846 | 36% | 0.357 | S | S | * | . | S | Bend | trans | -72.9 | -36.2 | -172 | -65.9 | -117.6 | 124.2 | 0 | 0 | 113.2 | ||
| 186 | H | 87.1 | Confident | 90.9 | Very high | 160 Ų | 160 | 77.1 Ų | 77.1 | 74% | 0.741 | 39% | 0.386 | S | S | * | . | S | Bend | trans | -117 | -1.9 | -169.6 | -57.5 | -49.6 | 0 | 0 | 0 | 114.9 | H104 | H104-H186 PolarHBondContact CE1-O 2.89Å; H104-H186 PolarHBondContact ND1-O 3.14Å |
| 187 | K | 90.2 | Very high | 90.5 | Very high | 44 Ų | 44 | 80.7 Ų | 80.7 | 19% | 0.191 | 40% | 0.396 | C | S | . | . | trans | -116 | 133.3 | -179 | -176.3 | 174.1 | -176.2 | 168.5 | 0 | 111.3 | D102 K183 E189 | D102-K187 WeakPolarHBondContact O-CE 3.1Å; D102-K187 PolarHBondContact O-NZ 3.12Å; D102-K187 IonicContact OD1-NZ 2.7Å; D102-K187 IonicContact OD2-NZ 2.96Å; D102-K187 PolarHBondContact OD2-NZ 2.71Å; K183-K187 HydrophobicContact CB-CG 4.43Å; K183-K187 HydrophobicContact CD-CD 4.42Å; K183-K187 PolarHBondContact N-O 3.24Å; K183-K187 WeakPolarHBondContact O-CB 3.26Å; K187-E189 VanDerWaalsContact CE-OE1 3.26Å; K187-E189 WeakPolarHBondContact CE-OE1 3.22Å; K187-E189 IonicContact NZ-OE1 3.81Å | ||
| 188 | R | 94.1 | Very high | 90.3 | Very high | 99 Ų | 99 | 77.9 Ų | 77.9 | 37% | 0.374 | 39% | 0.387 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.3 | 138.9 | 176 | -57.4 | -160.6 | -71.3 | -101.1 | -0.9 | 108.4 | H104 W105 E180 I181 K182 | H104-R188 CarbonylContact C-O 3.48Å; H104-R188 WeakPolarHBondContact CA-O 3.24Å; W105-R188 PolarHBondContact N-O 3.4Å; E180-R188 HydrophobicContact CG-CB 4.11Å; E180-R188 WeakPolarHBondContact OE1-CD 3.43Å; E180-R188 IonicContact OE1-CZ 2.76Å; E180-R188 IonicContact OE1-NE 2.71Å; E180-R188 PolarHBondContact OE1-NE 3.22Å; I181-R188 CarbonylContact O-C 3.31Å; I181-R188 VanDerWaalsContact O-CA 3.29Å; I181-R188 WeakPolarHBondContact O-CA 3.42Å; K182-R188 HydrophobicContact CG-CG 4.43Å |
| 189 | E | 92.6 | Very high | 90.1 | Very high | 27 Ų | 27 | 78.6 Ų | 78.6 | 13% | 0.126 | 39% | 0.391 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.5 | 144.8 | -178 | -68 | -178.5 | 173.8 | 0 | 0 | 109.3 | E180 I181 K183 K187 V191 | E180-E189 WeakPolarHBondContact CA-O 3.49Å; I181-E189 HydrophobicContact CG1-CB 4.1Å; I181-E189 PolarHBondContact N-O 3.2Å; I181-E189 PolarHBondContact O-N 3.37Å; K183-E189 HydrophobicContact CD-CG 4.34Å; K183-E189 WeakPolarHBondContact CD-OE1 3.16Å; K183-E189 WeakPolarHBondContact CE-OE1 2.87Å; K183-E189 IonicContact NZ-OE1 3.24Å; K183-E189 PolarHBondContact NZ-OE1 3.12Å; K183-E189 IonicContact NZ-OE2 3.82Å; K183-E189 PolarHBondContact NZ-OE2 3.47Å; K187-E189 VanDerWaalsContact CE-OE1 3.26Å; K187-E189 WeakPolarHBondContact CE-OE1 3.22Å; K187-E189 IonicContact NZ-OE1 3.81Å; E189-V191 HydrophobicContact CB-CG1 4.17Å |
| 190 | C | 93.8 | Very high | 90 | Very high | 14 Ų | 14 | 80.4 Ų | 80.4 | 10% | 0.095 | 39% | 0.394 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.6 | 108.9 | 175.3 | 174.4 | 0 | 0 | 0 | 0 | 110.4 | W105 C112 K116 | W105-C190 HydrophobicContact CB-CB 4.18Å; W105-C190 HydrophobicContact CD2-CB 3.52Å; W105-C190 HydrophobicContact CE3-CB 3.63Å; W105-C190 HydrophobicContact CG-CB 3.75Å; W105-C190 HydrophobicContact CZ3-CB 4.28Å; C112-C190 WeakPolarHBondContact CA-SG 3.38Å; C112-C190 HydrophobicContact CB-CB 3.76Å; C112-C190 WeakPolarHBondContact CB-SG 3.46Å; C112-C190 WeakPolarHBondContact SG-CA 3.46Å; C112-C190 WeakPolarHBondContact SG-CB 3.36Å; C112-C190 CovalentContact SG-SG 2.03Å; C112-C190 PolarHBondContact SG-SG 2.88Å; K116-C190 WeakPolarHBondContact CE-O 3.19Å; K116-C190 VanDerWaalsContact CG-SG 3.57Å; K116-C190 PolarHBondContact NZ-O 2.8Å |
| 191 | V | 91.8 | Very high | 89.9 | Confident | 40 Ų | 40 | 82 Ų | 82 | 24% | 0.242 | 41% | 0.407 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.2 | 162.3 | -170.9 | -56.9 | 0 | 0 | 0 | 0 | 112.2 | A178 Q179 I181 E189 A193 | A178-V191 WeakPolarHBondContact CA-O 3.32Å; Q179-V191 PolarHBondContact N-O 3.23Å; Q179-V191 PolarHBondContact O-N 2.86Å; Q179-V191 VanDerWaalsContact O-N 3.1Å; I181-V191 HydrophobicContact CD1-CG1 4.03Å; I181-V191 HydrophobicContact CD1-CG2 3.71Å; I181-V191 HydrophobicContact CG1-CG1 4.28Å; I181-V191 HydrophobicContact CG1-CG2 3.84Å; I181-V191 HydrophobicContact CG2-CG2 3.89Å; E189-V191 HydrophobicContact CB-CG1 4.17Å; V191-A193 HydrophobicContact CG2-CB 4.22Å |
| 192 | L | 91.4 | Very high | 90 | Very high | 35 Ų | 35 | 80 Ų | 80 | 18% | 0.183 | 40% | 0.398 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.4 | 98.5 | 165.7 | -68.4 | 163.3 | 0 | 0 | 0 | 107.8 | K116 Y120 Q174 A178 Y194 | K116-L192 HydrophobicContact CB-CD2 4.29Å; Y120-L192 HydrophobicContact CE2-CD1 3.67Å; Q174-L192 HydrophobicContact CB-CD2 4.16Å; Q174-L192 HydrophobicContact CG-CD2 4.4Å; A178-L192 HydrophobicContact CB-CD2 4Å; L192-Y194 HydrophobicContact CB-CD2 4.41Å; L192-Y194 HydrophobicContact CB-CE1 4.44Å; L192-Y194 HydrophobicContact CB-CE2 3.8Å; L192-Y194 HydrophobicContact CD1-CE2 4.46Å; L192-Y194 PolarHBondContact O-N 3.01Å; L192-Y194 VanDerWaalsContact O-N 3.14Å |
| 193 | A | 90.6 | Very high | 90 | Very high | 34 Ų | 34 | 72 Ų | 72 | 28% | 0.281 | 36% | 0.363 | S | S | . | . | trans | -90.5 | 75.8 | -172.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | Y177 Q179 V191 | Y177-A193 WeakPolarHBondContact CD1-O 3.4Å; Y177-A193 PolarHBondContact O-N 2.91Å; Q179-A193 HydrophobicContact CG-CB 3.73Å; V191-A193 HydrophobicContact CG2-CB 4.22Å | ||
| 194 | Y | 88.8 | Confident | 90.4 | Very high | 44 Ų | 44 | 70 Ų | 70 | 17% | 0.173 | 36% | 0.36 | C | S | . | . | trans | -71.7 | 139.5 | 175 | -55.6 | -56.9 | 0 | 0 | 0 | 111.6 | Y177 L192 S199 I202 R206 | Y177-Y194 HydrophobicContact CD1-CD1 4.09Å; Y177-Y194 AromaticContact CD2-CD1 3.8Å; Y177-Y194 HydrophobicContact CD2-CD1 3.8Å; Y177-Y194 AromaticContact CD2-CE1 3.92Å; Y177-Y194 HydrophobicContact CD2-CE1 3.92Å; Y177-Y194 HydrophobicContact CE2-CD1 4.47Å; Y177-Y194 AromaticContact CG-CD1 3.6Å; Y177-Y194 HydrophobicContact CG-CD1 3.6Å; Y177-Y194 AromaticContact CG-CE1 3.92Å; Y177-Y194 HydrophobicContact CG-CE1 3.92Å; L192-Y194 HydrophobicContact CB-CD2 4.41Å; L192-Y194 HydrophobicContact CB-CE1 4.44Å; L192-Y194 HydrophobicContact CB-CE2 3.8Å; L192-Y194 HydrophobicContact CD1-CE2 4.46Å; L192-Y194 PolarHBondContact O-N 3.01Å; L192-Y194 VanDerWaalsContact O-N 3.14Å; Y194-S199 WeakPolarHBondContact CB-OG 3.37Å; Y194-I202 HydrophobicContact CD1-CD1 3.72Å; Y194-I202 HydrophobicContact CD1-CG2 4.34Å; Y194-I202 HydrophobicContact CE1-CB 4.46Å; Y194-I202 HydrophobicContact CE1-CD1 4Å; Y194-I202 HydrophobicContact CE1-CG2 3.72Å; Y194-R206 PolarHBondContact OH-NH1 3.39Å | ||
| 195 | S | 87.4 | Confident | 90.8 | Very high | 59 Ų | 59 | 71.7 Ų | 71.7 | 41% | 0.413 | 35% | 0.351 | S | S | . | . | trans | -70.1 | 150.1 | 167 | 75.8 | 0 | 0 | 0 | 0 | 110.2 | E197 S198 S199 | S195-E197 PolarHBondContact O-N 3.32Å; S195-S198 WeakPolarHBondContact CA-OG 3.41Å; S195-S198 PolarHBondContact N-OG 2.82Å; S195-S198 PolarHBondContact O-N 3.09Å; S195-S198 PolarHBondContact O-OG 2.96Å; S195-S198 VanDerWaalsContact OG-CB 3.25Å; S195-S198 WeakPolarHBondContact OG-CB 3.35Å; S195-S198 PolarHBondContact OG-N 3.29Å; S195-S198 PolarHBondContact OG-OG 2.7Å; S195-S199 PolarHBondContact O-N 3.49Å; S195-S199 PolarHBondContact O-OG 2.9Å | ||
| 196 | K | 83.1 | Confident | 91.4 | Very high | 189 Ų | 189 | 63.1 Ų | 63.1 | 82% | 0.822 | 31% | 0.311 | S | S | * | . | H | α-helix | trans | -50.3 | -37.1 | -179.4 | -69.9 | -176 | 179.3 | 178.9 | 0 | 113.4 | ||
| 197 | E | 87.3 | Confident | 91.8 | Very high | 179 Ų | 179 | 57.9 Ų | 57.9 | 84% | 0.836 | 29% | 0.286 | S | S | * | . | H | α-helix | trans | -75.2 | -34.8 | 179 | -61 | -177.3 | -179.3 | 0 | 0 | 112.4 | S195 P201 | S195-E197 PolarHBondContact O-N 3.32Å; E197-P201 VanDerWaalsContact O-CD 3.32Å; E197-P201 WeakPolarHBondContact O-CD 3.48Å; E197-P201 WeakPolarHBondContact O-CG 3.28Å |
| 198 | S | 89.5 | Confident | 92.1 | Very high | 13 Ų | 13 | 59.1 Ų | 59.1 | 9% | 0.091 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -84.1 | -23.4 | -177.9 | 66.3 | 0 | 0 | 0 | 0 | 114.7 | S195 W200 P201 I202 | S195-S198 WeakPolarHBondContact CA-OG 3.41Å; S195-S198 PolarHBondContact N-OG 2.82Å; S195-S198 PolarHBondContact O-N 3.09Å; S195-S198 PolarHBondContact O-OG 2.96Å; S195-S198 VanDerWaalsContact OG-CB 3.25Å; S195-S198 WeakPolarHBondContact OG-CB 3.35Å; S195-S198 PolarHBondContact OG-N 3.29Å; S195-S198 PolarHBondContact OG-OG 2.7Å; S198-W200 PolarHBondContact O-N 3.5Å; S198-P201 VanDerWaalsContact O-CD 3.29Å; S198-P201 WeakPolarHBondContact O-CD 3.39Å; S198-P201 WeakPolarHBondContact O-CG 3.47Å; S198-I202 WeakPolarHBondContact O-CB 3.22Å; S198-I202 WeakPolarHBondContact O-CD1 3.2Å; S198-I202 WeakPolarHBondContact O-CG1 3.25Å; S198-I202 PolarHBondContact O-N 2.75Å; S198-I202 VanDerWaalsContact O-N 3.09Å |
| 199 | S | 90.3 | Very high | 92.1 | Very high | 19 Ų | 19 | 57.9 Ų | 57.9 | 13% | 0.133 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -61.6 | -50.4 | -169.7 | -50.4 | 0 | 0 | 0 | 0 | 112.9 | Y194 S195 V203 | Y194-S199 WeakPolarHBondContact CB-OG 3.37Å; S195-S199 PolarHBondContact O-N 3.49Å; S195-S199 PolarHBondContact O-OG 2.9Å; S199-V203 WeakPolarHBondContact O-CB 3.23Å; S199-V203 VanDerWaalsContact O-CG2 3.28Å; S199-V203 WeakPolarHBondContact O-CG2 3.49Å; S199-V203 PolarHBondContact O-N 3.31Å |
| 200 | W | 93.1 | Very high | 92.1 | Very high | 135 Ų | 135 | 56.6 Ų | 56.6 | 51% | 0.511 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -58.9 | -56.7 | 177.6 | -81.2 | 96.2 | 0 | 0 | 0 | 113.3 | S198 I202 V203 S204 F266 L269 | S198-W200 PolarHBondContact O-N 3.5Å; W200-I202 VanDerWaalsContact C-N 3.31Å; W200-I202 PolarHBondContact O-N 3.07Å; W200-V203 PolarHBondContact O-N 3.35Å; W200-S204 VanDerWaalsContact O-CB 3.3Å; W200-S204 WeakPolarHBondContact O-CB 3.43Å; W200-S204 PolarHBondContact O-N 2.94Å; W200-S204 PolarHBondContact O-OG 3.41Å; W200-S204 VanDerWaalsContact O-OG 3.08Å; W200-F266 HydrophobicContact CZ3-CD1 4.28Å; W200-F266 HydrophobicContact CZ3-CE1 4.43Å; W200-L269 HydrophobicContact CD2-CD1 4.19Å; W200-L269 HydrophobicContact CE3-CD1 4.22Å; W200-L269 HydrophobicContact CZ2-CB 4.36Å |
| 201 | P | 94.6 | Very high | 92.1 | Very high | 73 Ų | 73 | 56.7 Ų | 56.7 | 47% | 0.474 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -62.3 | -36.3 | -177.8 | 20.2 | -30.3 | 0 | 0 | 0 | 112.8 | E197 S198 F205 | E197-P201 VanDerWaalsContact O-CD 3.32Å; E197-P201 WeakPolarHBondContact O-CD 3.48Å; E197-P201 WeakPolarHBondContact O-CG 3.28Å; S198-P201 VanDerWaalsContact O-CD 3.29Å; S198-P201 WeakPolarHBondContact O-CD 3.39Å; S198-P201 WeakPolarHBondContact O-CG 3.47Å; P201-F205 WeakPolarHBondContact O-CB 3.32Å; P201-F205 PolarHBondContact O-N 3.21Å |
| 202 | I | 94.1 | Very high | 92.3 | Very high | 18 Ų | 18 | 57.4 Ų | 57.4 | 9% | 0.092 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -67.9 | -47.5 | 178.8 | -68.2 | 168.9 | 0 | 0 | 0 | 111.4 | P173 Y177 Y194 S198 W200 F205 R206 | P173-I202 HydrophobicContact CB-CD1 4.41Å; P173-I202 HydrophobicContact CB-CG1 4.48Å; P173-I202 HydrophobicContact CB-CG2 4.09Å; Y177-I202 HydrophobicContact CD2-CD1 3.71Å; Y177-I202 HydrophobicContact CE2-CD1 3.27Å; Y194-I202 HydrophobicContact CD1-CD1 3.72Å; Y194-I202 HydrophobicContact CD1-CG2 4.34Å; Y194-I202 HydrophobicContact CE1-CB 4.46Å; Y194-I202 HydrophobicContact CE1-CD1 4Å; Y194-I202 HydrophobicContact CE1-CG2 3.72Å; S198-I202 WeakPolarHBondContact O-CB 3.22Å; S198-I202 WeakPolarHBondContact O-CD1 3.2Å; S198-I202 WeakPolarHBondContact O-CG1 3.25Å; S198-I202 PolarHBondContact O-N 2.75Å; S198-I202 VanDerWaalsContact O-N 3.09Å; W200-I202 VanDerWaalsContact C-N 3.31Å; W200-I202 PolarHBondContact O-N 3.07Å; I202-F205 PolarHBondContact O-N 3.4Å; I202-R206 VanDerWaalsContact O-CB 3.31Å; I202-R206 WeakPolarHBondContact O-CB 3.03Å; I202-R206 PolarHBondContact O-N 3.29Å |
| 203 | V | 93.9 | Very high | 92.5 | Very high | 3 Ų | 3 | 59.7 Ų | 59.7 | 2% | 0.018 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -66.9 | -41.5 | 179.6 | 174.4 | 0 | 0 | 0 | 0 | 110.8 | S199 W200 R206 F207 D265 F266 L269 | S199-V203 WeakPolarHBondContact O-CB 3.23Å; S199-V203 VanDerWaalsContact O-CG2 3.28Å; S199-V203 WeakPolarHBondContact O-CG2 3.49Å; S199-V203 PolarHBondContact O-N 3.31Å; W200-V203 PolarHBondContact O-N 3.35Å; V203-R206 PolarHBondContact O-N 3.4Å; V203-F207 WeakPolarHBondContact O-CB 3.31Å; V203-F207 PolarHBondContact O-N 3.08Å; V203-D265 HydrophobicContact CG1-CB 3.81Å; V203-F266 HydrophobicContact CG1-CD1 4.24Å; V203-F266 HydrophobicContact CG1-CD2 4.49Å; V203-F266 HydrophobicContact CG1-CE1 4.07Å; V203-F266 HydrophobicContact CG1-CE2 4.32Å; V203-F266 HydrophobicContact CG1-CG 4.44Å; V203-F266 HydrophobicContact CG1-CZ 4.11Å; V203-L269 HydrophobicContact CB-CD1 3.5Å; V203-L269 HydrophobicContact CB-CG 4.44Å; V203-L269 HydrophobicContact CG1-CD1 3.68Å; V203-L269 HydrophobicContact CG2-CD1 3.65Å; V203-L269 HydrophobicContact CG2-CD2 4.22Å; V203-L269 HydrophobicContact CG2-CG 4.09Å |
| 204 | S | 95.3 | Very high | 92.7 | Very high | 45 Ų | 45 | 58.3 Ų | 58.3 | 32% | 0.315 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -62.7 | -45.7 | 174.9 | -65.6 | 0 | 0 | 0 | 0 | 112.1 | W200 R206 F207 V208 | W200-S204 VanDerWaalsContact O-CB 3.3Å; W200-S204 WeakPolarHBondContact O-CB 3.43Å; W200-S204 PolarHBondContact O-N 2.94Å; W200-S204 PolarHBondContact O-OG 3.41Å; W200-S204 VanDerWaalsContact O-OG 3.08Å; S204-R206 VanDerWaalsContact C-N 3.31Å; S204-R206 PolarHBondContact O-N 3.25Å; S204-F207 PolarHBondContact O-N 3.11Å; S204-V208 WeakPolarHBondContact O-CG2 3.42Å; S204-V208 PolarHBondContact O-N 3.32Å |
| 205 | F | 95.1 | Very high | 93 | Very high | 94 Ų | 94 | 59.7 Ų | 59.7 | 41% | 0.412 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -58.2 | -45.7 | 174.4 | 172.3 | -96.8 | 0 | 0 | 0 | 111.2 | P201 I202 F207 V208 M209 | P201-F205 WeakPolarHBondContact O-CB 3.32Å; P201-F205 PolarHBondContact O-N 3.21Å; I202-F205 PolarHBondContact O-N 3.4Å; F205-F207 PolarHBondContact O-N 2.97Å; F205-V208 PolarHBondContact O-N 2.93Å; F205-M209 HydrophobicContact CD2-CG 3.8Å; F205-M209 HydrophobicContact CE1-CG 4.3Å; F205-M209 HydrophobicContact CE2-CG 3.48Å; F205-M209 VanDerWaalsContact CE2-CG 3.48Å; F205-M209 HydrophobicContact CE2-SD 4.47Å; F205-M209 HydrophobicContact CG-CG 4.35Å; F205-M209 HydrophobicContact CZ-CB 4.41Å; F205-M209 HydrophobicContact CZ-CG 3.76Å; F205-M209 WeakPolarHBondContact O-CB 2.99Å; F205-M209 WeakPolarHBondContact O-CG 3.31Å; F205-M209 PolarHBondContact O-N 2.91Å |
| 206 | R | 95.1 | Very high | 93.3 | Very high | 2 Ų | 2 | 62.3 Ų | 62.3 | 1% | 0.008 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -59.2 | -45.9 | 177.2 | -179.5 | 174.4 | 61.9 | -162.1 | -0.8 | 112 | Y120 M123 Y124 Y194 I202 V203 S204 G210 D265 | Y120-R206 VanDerWaalsContact CE1-CD 3.44Å; Y120-R206 PolarHBondContact OH-NH1 3.36Å; M123-R206 HydrophobicContact CE-CG 4.12Å; Y124-R206 WeakPolarHBondContact OH-CA 3.31Å; Y194-R206 PolarHBondContact OH-NH1 3.39Å; I202-R206 VanDerWaalsContact O-CB 3.31Å; I202-R206 WeakPolarHBondContact O-CB 3.03Å; I202-R206 PolarHBondContact O-N 3.29Å; V203-R206 PolarHBondContact O-N 3.4Å; S204-R206 VanDerWaalsContact C-N 3.31Å; S204-R206 PolarHBondContact O-N 3.25Å; R206-G210 VanDerWaalsContact O-CA 3.27Å; R206-G210 WeakPolarHBondContact O-CA 3.3Å; R206-G210 PolarHBondContact O-N 3.09Å; R206-D265 IonicContact CZ-OD1 3.54Å; R206-D265 IonicContact CZ-OD2 2.74Å; R206-D265 VanDerWaalsContact CZ-OD2 3.24Å; R206-D265 IonicContact NE-OD2 3.5Å; R206-D265 PolarHBondContact NE-OD2 3.4Å; R206-D265 IonicContact NH2-OD1 3.51Å; R206-D265 PolarHBondContact NH2-OD1 2.99Å; R206-D265 IonicContact NH2-OD2 3.56Å; R206-D265 PolarHBondContact NH2-OD2 3.06Å |
| 207 | F | 95.9 | Very high | 94 | Very high | 49 Ų | 49 | 55.7 Ų | 55.7 | 22% | 0.215 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -65.4 | -43.7 | 178 | -179.2 | -121.8 | 0 | 0 | 0 | 112.2 | V203 S204 F205 F211 I212 H262 F266 | V203-F207 WeakPolarHBondContact O-CB 3.31Å; V203-F207 PolarHBondContact O-N 3.08Å; S204-F207 PolarHBondContact O-N 3.11Å; F205-F207 PolarHBondContact O-N 2.97Å; F207-F211 HydrophobicContact CD2-CB 3.9Å; F207-F211 HydrophobicContact CD2-CD1 4.39Å; F207-F211 HydrophobicContact CD2-CG 4.26Å; F207-F211 HydrophobicContact CE2-CB 4.08Å; F207-F211 AromaticContact CE2-CD1 3.7Å; F207-F211 HydrophobicContact CE2-CD1 3.7Å; F207-F211 HydrophobicContact CE2-CE1 4.34Å; F207-F211 AromaticContact CE2-CG 3.97Å; F207-F211 HydrophobicContact CE2-CG 3.97Å; F207-F211 HydrophobicContact CZ-CD1 4.27Å; F207-F211 WeakPolarHBondContact O-CA 3.31Å; F207-F211 WeakPolarHBondContact O-CB 3.48Å; F207-F211 PolarHBondContact O-N 2.88Å; F207-I212 HydrophobicContact CD1-CG1 3.91Å; F207-I212 HydrophobicContact CE1-CD1 3.76Å; F207-I212 HydrophobicContact CE1-CG1 3.51Å; F207-I212 HydrophobicContact CE2-CD1 4.33Å; F207-I212 HydrophobicContact CE2-CG1 4.27Å; F207-I212 HydrophobicContact CG-CG1 4.46Å; F207-I212 HydrophobicContact CZ-CD1 3.6Å; F207-I212 HydrophobicContact CZ-CG1 3.73Å; F207-I212 PolarHBondContact O-N 3.3Å; F207-H262 HydrophobicContact CD2-CB 3.67Å; F207-H262 AromaticContact CD2-CG 3.74Å; F207-H262 HydrophobicContact CE2-CB 3.97Å; F207-F266 HydrophobicContact CB-CE2 3.74Å; F207-F266 HydrophobicContact CB-CZ 3.96Å; F207-F266 AromaticContact CD1-CE2 3.75Å; F207-F266 HydrophobicContact CD1-CE2 3.75Å; F207-F266 HydrophobicContact CD1-CZ 4.02Å; F207-F266 HydrophobicContact CD2-CE2 4.21Å; F207-F266 HydrophobicContact CE1-CE2 4.36Å; F207-F266 AromaticContact CG-CE2 3.65Å; F207-F266 HydrophobicContact CG-CE2 3.65Å; F207-F266 HydrophobicContact CG-CZ 4.15Å |
| 208 | V | 96 | Very high | 94.3 | Very high | 70 Ų | 70 | 47.2 Ų | 47.2 | 42% | 0.424 | 24% | 0.238 | S | C | . | . | I | π-helix | trans | -65.2 | -50.4 | 179.7 | 172 | 0 | 0 | 0 | 0 | 110.9 | S204 F205 I212 L213 | S204-V208 WeakPolarHBondContact O-CG2 3.42Å; S204-V208 PolarHBondContact O-N 3.32Å; F205-V208 PolarHBondContact O-N 2.93Å; V208-I212 PolarHBondContact O-N 3.24Å; V208-L213 WeakPolarHBondContact O-CB 3.38Å; V208-L213 PolarHBondContact O-N 3.49Å |
| 209 | M | 94.8 | Very high | 94.4 | Very high | 74 Ų | 74 | 48.9 Ų | 48.9 | 37% | 0.365 | 25% | 0.248 | S | C | . | . | I | π-helix | trans | -80.3 | -33.6 | -173.9 | -64 | -58.5 | -70.3 | 0 | 0 | 113.4 | Y124 F205 L213 P214 | Y124-M209 HydrophobicContact CE1-CB 4.06Å; F205-M209 HydrophobicContact CD2-CG 3.8Å; F205-M209 HydrophobicContact CE1-CG 4.3Å; F205-M209 HydrophobicContact CE2-CG 3.48Å; F205-M209 VanDerWaalsContact CE2-CG 3.48Å; F205-M209 HydrophobicContact CE2-SD 4.47Å; F205-M209 HydrophobicContact CG-CG 4.35Å; F205-M209 HydrophobicContact CZ-CB 4.41Å; F205-M209 HydrophobicContact CZ-CG 3.76Å; F205-M209 WeakPolarHBondContact O-CB 2.99Å; F205-M209 WeakPolarHBondContact O-CG 3.31Å; F205-M209 PolarHBondContact O-N 2.91Å; M209-L213 HydrophobicContact CE-CD2 4.02Å; M209-L213 HydrophobicContact SD-CD2 3.77Å; M209-P214 VanDerWaalsContact O-CD 3.26Å; M209-P214 WeakPolarHBondContact O-CD 3.25Å; M209-P214 WeakPolarHBondContact O-CG 3.44Å |
| 210 | G | 92.4 | Very high | 94.5 | Very high | 0 Ų | 0 | 52.7 Ų | 52.7 | 0% | 0 | 27% | 0.266 | C | S | . | . | I | π-helix | trans | -86.7 | -17.7 | -179.5 | 0 | 0 | 0 | 0 | 0 | 114 | R206 | R206-G210 VanDerWaalsContact O-CA 3.27Å; R206-G210 WeakPolarHBondContact O-CA 3.3Å; R206-G210 PolarHBondContact O-N 3.09Å |
| 211 | F | 93.7 | Very high | 94.5 | Very high | 16 Ų | 16 | 46.7 Ų | 46.7 | 7% | 0.07 | 24% | 0.244 | C | C | . | . | I | π-helix | trans | -133.6 | -66.9 | -173.6 | -162.3 | -87.6 | 0 | 0 | 0 | 113.3 | F207 P214 F215 F255 L259 H262 | F207-F211 HydrophobicContact CD2-CB 3.9Å; F207-F211 HydrophobicContact CD2-CD1 4.39Å; F207-F211 HydrophobicContact CD2-CG 4.26Å; F207-F211 HydrophobicContact CE2-CB 4.08Å; F207-F211 AromaticContact CE2-CD1 3.7Å; F207-F211 HydrophobicContact CE2-CD1 3.7Å; F207-F211 HydrophobicContact CE2-CE1 4.34Å; F207-F211 AromaticContact CE2-CG 3.97Å; F207-F211 HydrophobicContact CE2-CG 3.97Å; F207-F211 HydrophobicContact CZ-CD1 4.27Å; F207-F211 WeakPolarHBondContact O-CA 3.31Å; F207-F211 WeakPolarHBondContact O-CB 3.48Å; F207-F211 PolarHBondContact O-N 2.88Å; F211-P214 WeakPolarHBondContact O-CD 3.23Å; F211-F215 WeakPolarHBondContact O-CB 3.29Å; F211-F215 PolarHBondContact O-N 3.45Å; F211-F255 HydrophobicContact CD1-CD1 4.31Å; F211-F255 HydrophobicContact CD1-CE1 4.5Å; F211-F255 AromaticContact CD2-CD1 3.74Å; F211-F255 HydrophobicContact CD2-CD1 3.74Å; F211-F255 HydrophobicContact CD2-CE1 4.18Å; F211-F255 HydrophobicContact CE1-CD1 4.01Å; F211-F255 HydrophobicContact CE2-CB 4.17Å; F211-F255 AromaticContact CE2-CD1 3.46Å; F211-F255 HydrophobicContact CE2-CD1 3.46Å; F211-F255 VanDerWaalsContact CE2-CD1 3.46Å; F211-F255 HydrophobicContact CE2-CE1 4.33Å; F211-F255 HydrophobicContact CE2-CG 4.31Å; F211-F255 HydrophobicContact CG-CD1 4.17Å; F211-F255 HydrophobicContact CG-CE1 4.28Å; F211-F255 HydrophobicContact CZ-CB 4.06Å; F211-F255 AromaticContact CZ-CD1 3.57Å; F211-F255 HydrophobicContact CZ-CD1 3.57Å; F211-F255 HydrophobicContact CZ-CE1 4.48Å; F211-F255 HydrophobicContact CZ-CG 4.25Å; F211-F255 WeakPolarHBondContact O-CE1 3.37Å; F211-L259 HydrophobicContact CE1-CD1 4.06Å; F211-L259 HydrophobicContact CE2-CB 3.71Å; F211-L259 HydrophobicContact CE2-CD1 4.18Å; F211-L259 HydrophobicContact CZ-CB 3.7Å; F211-L259 HydrophobicContact CZ-CD1 3.64Å; F211-L259 HydrophobicContact CZ-CD2 4.47Å; F211-L259 HydrophobicContact CZ-CG 4.13Å; F211-H262 AromaticContact CD2-CD2 3.35Å; F211-H262 WeakPolarHBondContact CD2-CD2 3.37Å; F211-H262 AromaticContact CD2-NE2 3.76Å; F211-H262 AromaticContact CG-CD2 3.85Å |
| 212 | I | 95.3 | Very high | 94.2 | Very high | 54 Ų | 54 | 44 Ų | 44 | 28% | 0.277 | 23% | 0.225 | S | C | . | . | I | π-helix | trans | -67.3 | -52.3 | -167.4 | -63.1 | -68 | 0 | 0 | 0 | 113.1 | F207 V208 F215 F216 | F207-I212 HydrophobicContact CD1-CG1 3.91Å; F207-I212 HydrophobicContact CE1-CD1 3.76Å; F207-I212 HydrophobicContact CE1-CG1 3.51Å; F207-I212 HydrophobicContact CE2-CD1 4.33Å; F207-I212 HydrophobicContact CE2-CG1 4.27Å; F207-I212 HydrophobicContact CG-CG1 4.46Å; F207-I212 HydrophobicContact CZ-CD1 3.6Å; F207-I212 HydrophobicContact CZ-CG1 3.73Å; F207-I212 PolarHBondContact O-N 3.3Å; V208-I212 PolarHBondContact O-N 3.24Å; I212-F215 WeakPolarHBondContact O-CB 3.23Å; I212-F215 PolarHBondContact O-N 2.98Å; I212-F216 HydrophobicContact CG2-CD2 3.75Å; I212-F216 HydrophobicContact CG2-CE2 3.58Å; I212-F216 VanDerWaalsContact O-CD2 3.22Å; I212-F216 WeakPolarHBondContact O-CD2 3.38Å; I212-F216 PolarHBondContact O-N 3.28Å; I212-F216 VanDerWaalsContact O-N 3.09Å |
| 213 | L | 95.8 | Very high | 94 | Very high | 84 Ų | 84 | 48.3 Ų | 48.3 | 44% | 0.44 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -61.5 | -50.1 | -179.2 | 171.9 | 70.3 | 0 | 0 | 0 | 111 | V208 M209 F215 F216 V217 | V208-L213 WeakPolarHBondContact O-CB 3.38Å; V208-L213 PolarHBondContact O-N 3.49Å; M209-L213 HydrophobicContact CE-CD2 4.02Å; M209-L213 HydrophobicContact SD-CD2 3.77Å; L213-F215 VanDerWaalsContact C-N 3.31Å; L213-F215 PolarHBondContact O-N 2.88Å; L213-F216 PolarHBondContact O-N 2.89Å; L213-V217 HydrophobicContact CD1-CG2 4.32Å; L213-V217 WeakPolarHBondContact O-CG2 3.46Å; L213-V217 PolarHBondContact O-N 3.01Å; L213-V217 VanDerWaalsContact O-N 3.09Å |
| 214 | P | 95.7 | Very high | 93.9 | Very high | 5 Ų | 5 | 50.2 Ų | 50.2 | 3% | 0.032 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -58 | -40.3 | 173.6 | -26.4 | 34.5 | 0 | 0 | 0 | 114.1 | I127 V131 M209 F211 F216 V217 I218 | I127-P214 HydrophobicContact CD1-CB 3.67Å; I127-P214 HydrophobicContact CG1-CB 3.28Å; I127-P214 HydrophobicContact CG1-CG 3.61Å; I127-P214 HydrophobicContact CG2-CG 4.41Å; V131-P214 HydrophobicContact CG2-CB 3.72Å; M209-P214 VanDerWaalsContact O-CD 3.26Å; M209-P214 WeakPolarHBondContact O-CD 3.25Å; M209-P214 WeakPolarHBondContact O-CG 3.44Å; F211-P214 WeakPolarHBondContact O-CD 3.23Å; P214-F216 PolarHBondContact O-N 3.3Å; P214-V217 PolarHBondContact O-N 3.38Å; P214-I218 VanDerWaalsContact O-CB 3.32Å; P214-I218 WeakPolarHBondContact O-CB 3.14Å; P214-I218 WeakPolarHBondContact O-CD1 3.37Å; P214-I218 WeakPolarHBondContact O-CG1 3.35Å; P214-I218 PolarHBondContact O-N 3.45Å |
| 215 | F | 94.3 | Very high | 93.5 | Very high | 72 Ų | 72 | 48.3 Ų | 48.3 | 32% | 0.316 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -55.2 | -53 | 177.5 | 177.3 | -94.2 | 0 | 0 | 0 | 111.3 | F211 I212 L213 V217 I218 V219 F255 | F211-F215 WeakPolarHBondContact O-CB 3.29Å; F211-F215 PolarHBondContact O-N 3.45Å; I212-F215 WeakPolarHBondContact O-CB 3.23Å; I212-F215 PolarHBondContact O-N 2.98Å; L213-F215 VanDerWaalsContact C-N 3.31Å; L213-F215 PolarHBondContact O-N 2.88Å; F215-V217 PolarHBondContact O-N 3.03Å; F215-I218 PolarHBondContact O-N 3.15Å; F215-V219 HydrophobicContact CD1-CG2 4.26Å; F215-V219 HydrophobicContact CD2-CG2 4.37Å; F215-V219 HydrophobicContact CE1-CG2 3.94Å; F215-V219 HydrophobicContact CE2-CG2 4.05Å; F215-V219 HydrophobicContact CG-CG2 4.46Å; F215-V219 HydrophobicContact CZ-CG2 3.83Å; F215-V219 WeakPolarHBondContact O-CB 3.4Å; F215-V219 VanDerWaalsContact O-CG2 3.26Å; F215-V219 WeakPolarHBondContact O-CG2 3.4Å; F215-V219 PolarHBondContact O-N 2.89Å; F215-F255 HydrophobicContact CB-CD1 4.43Å; F215-F255 HydrophobicContact CB-CE1 3.65Å; F215-F255 HydrophobicContact CB-CE2 4.13Å; F215-F255 HydrophobicContact CB-CZ 3.49Å; F215-F255 VanDerWaalsContact CB-CZ 3.49Å; F215-F255 HydrophobicContact CD2-CD1 4.08Å; F215-F255 AromaticContact CD2-CD2 3.67Å; F215-F255 HydrophobicContact CD2-CD2 3.67Å; F215-F255 HydrophobicContact CD2-CE1 4.01Å; F215-F255 AromaticContact CD2-CE2 3.54Å; F215-F255 HydrophobicContact CD2-CE2 3.54Å; F215-F255 AromaticContact CD2-CG 3.95Å; F215-F255 HydrophobicContact CD2-CG 3.95Å; F215-F255 AromaticContact CD2-CZ 3.77Å; F215-F255 HydrophobicContact CD2-CZ 3.77Å; F215-F255 HydrophobicContact CE2-CD2 4.27Å; F215-F255 HydrophobicContact CE2-CE2 4.45Å; F215-F255 HydrophobicContact CG-CE1 4.34Å; F215-F255 HydrophobicContact CG-CE2 4.3Å; F215-F255 HydrophobicContact CG-CZ 4.13Å |
| 216 | F | 94.8 | Very high | 93.1 | Very high | 114 Ų | 114 | 49.5 Ų | 49.5 | 50% | 0.5 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -63.7 | -43.5 | -180 | -76.7 | -65.4 | 0 | 0 | 0 | 112.4 | I212 L213 P214 I218 V219 I220 | I212-F216 HydrophobicContact CG2-CD2 3.75Å; I212-F216 HydrophobicContact CG2-CE2 3.58Å; I212-F216 VanDerWaalsContact O-CD2 3.22Å; I212-F216 WeakPolarHBondContact O-CD2 3.38Å; I212-F216 PolarHBondContact O-N 3.28Å; I212-F216 VanDerWaalsContact O-N 3.09Å; L213-F216 PolarHBondContact O-N 2.89Å; P214-F216 PolarHBondContact O-N 3.3Å; F216-I218 VanDerWaalsContact C-N 3.34Å; F216-I218 PolarHBondContact O-N 3.17Å; F216-V219 PolarHBondContact O-N 3Å; F216-I220 WeakPolarHBondContact O-CB 3.43Å; F216-I220 WeakPolarHBondContact O-CD1 3.42Å; F216-I220 WeakPolarHBondContact O-CG1 3.01Å; F216-I220 PolarHBondContact O-N 3.26Å |
| 217 | V | 96.2 | Very high | 92.7 | Very high | 51 Ų | 51 | 51.3 Ų | 51.3 | 31% | 0.309 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -58.9 | -47.5 | 177.6 | 173.9 | 0 | 0 | 0 | 0 | 110.8 | V131 V135 L213 P214 F215 C221 | V131-V217 HydrophobicContact CG1-CG1 3.76Å; V135-V217 HydrophobicContact CG2-CG1 4.49Å; L213-V217 HydrophobicContact CD1-CG2 4.32Å; L213-V217 WeakPolarHBondContact O-CG2 3.46Å; L213-V217 PolarHBondContact O-N 3.01Å; L213-V217 VanDerWaalsContact O-N 3.09Å; P214-V217 PolarHBondContact O-N 3.38Å; F215-V217 PolarHBondContact O-N 3.03Å; V217-C221 WeakPolarHBondContact O-CB 3.34Å; V217-C221 PolarHBondContact O-N 3.35Å; V217-C221 PolarHBondContact O-SG 3.16Å |
| 218 | I | 93.8 | Very high | 92.2 | Very high | 1 Ų | 1 | 50.6 Ų | 50.6 | 1% | 0.005 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -63.7 | -47.7 | 179.8 | -69.9 | 168.8 | 0 | 0 | 0 | 110.7 | I127 L130 V131 P214 F215 F216 C221 H222 V251 F255 | I127-I218 HydrophobicContact CD1-CD1 3.83Å; L130-I218 HydrophobicContact CB-CD1 3.97Å; V131-I218 HydrophobicContact CG2-CD1 3.97Å; V131-I218 HydrophobicContact CG2-CG1 3.9Å; P214-I218 VanDerWaalsContact O-CB 3.32Å; P214-I218 WeakPolarHBondContact O-CB 3.14Å; P214-I218 WeakPolarHBondContact O-CD1 3.37Å; P214-I218 WeakPolarHBondContact O-CG1 3.35Å; P214-I218 PolarHBondContact O-N 3.45Å; F215-I218 PolarHBondContact O-N 3.15Å; F216-I218 VanDerWaalsContact C-N 3.34Å; F216-I218 PolarHBondContact O-N 3.17Å; I218-C221 PolarHBondContact O-N 3.43Å; I218-H222 WeakPolarHBondContact CG2-ND1 3.4Å; I218-H222 PolarHBondContact O-N 3.42Å; I218-H222 PolarHBondContact O-ND1 3.1Å; I218-V251 HydrophobicContact CG2-CB 4.23Å; I218-V251 HydrophobicContact CG2-CG1 3.58Å; I218-V251 HydrophobicContact CG2-CG2 3.55Å; I218-F255 HydrophobicContact CD1-CE2 4.35Å; I218-F255 HydrophobicContact CD1-CZ 4.28Å |
| 219 | V | 91.6 | Very high | 91.5 | Very high | 47 Ų | 47 | 48.2 Ų | 48.2 | 29% | 0.285 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -61 | -49.4 | -180 | 168.3 | 0 | 0 | 0 | 0 | 110.6 | F215 F216 C221 H222 L223 | F215-V219 HydrophobicContact CD1-CG2 4.26Å; F215-V219 HydrophobicContact CD2-CG2 4.37Å; F215-V219 HydrophobicContact CE1-CG2 3.94Å; F215-V219 HydrophobicContact CE2-CG2 4.05Å; F215-V219 HydrophobicContact CG-CG2 4.46Å; F215-V219 HydrophobicContact CZ-CG2 3.83Å; F215-V219 WeakPolarHBondContact O-CB 3.4Å; F215-V219 VanDerWaalsContact O-CG2 3.26Å; F215-V219 WeakPolarHBondContact O-CG2 3.4Å; F215-V219 PolarHBondContact O-N 2.89Å; F216-V219 PolarHBondContact O-N 3Å; V219-C221 PolarHBondContact O-N 2.97Å; V219-H222 PolarHBondContact O-N 3.46Å; V219-L223 HydrophobicContact CG1-CD1 3.72Å; V219-L223 HydrophobicContact CG1-CG 4.13Å; V219-L223 WeakPolarHBondContact O-CB 3.31Å; V219-L223 VanDerWaalsContact O-CG 3.27Å; V219-L223 WeakPolarHBondContact O-CG 3.04Å; V219-L223 PolarHBondContact O-N 3.38Å |
| 220 | I | 93.5 | Very high | 90.8 | Very high | 100 Ų | 100 | 52.7 Ų | 52.7 | 51% | 0.513 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -59.5 | -47 | 179.1 | -68 | 165.8 | 0 | 0 | 0 | 110.6 | F216 H222 L223 V224 | F216-I220 WeakPolarHBondContact O-CB 3.43Å; F216-I220 WeakPolarHBondContact O-CD1 3.42Å; F216-I220 WeakPolarHBondContact O-CG1 3.01Å; F216-I220 PolarHBondContact O-N 3.26Å; I220-H222 VanDerWaalsContact C-N 3.29Å; I220-H222 PolarHBondContact O-N 3.03Å; I220-L223 PolarHBondContact O-N 3.46Å; I220-V224 VanDerWaalsContact O-CG2 3.3Å; I220-V224 WeakPolarHBondContact O-CG2 3.26Å; I220-V224 PolarHBondContact O-N 2.86Å |
| 221 | C | 92.9 | Very high | 90.1 | Very high | 9 Ų | 9 | 63 Ų | 63 | 6% | 0.061 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -55 | -47.1 | 177 | -73.2 | 0 | 0 | 0 | 0 | 111.4 | L138 V217 I218 V219 V224 V225 | L138-C221 HydrophobicContact CB-CB 4.39Å; L138-C221 HydrophobicContact CD2-CB 4.47Å; V217-C221 WeakPolarHBondContact O-CB 3.34Å; V217-C221 PolarHBondContact O-N 3.35Å; V217-C221 PolarHBondContact O-SG 3.16Å; I218-C221 PolarHBondContact O-N 3.43Å; V219-C221 PolarHBondContact O-N 2.97Å; C221-V224 PolarHBondContact O-N 2.86Å; C221-V225 WeakPolarHBondContact O-CB 3.22Å; C221-V225 VanDerWaalsContact O-CG2 3.26Å; C221-V225 WeakPolarHBondContact O-CG2 3.49Å; C221-V225 PolarHBondContact O-N 3.4Å |
| 222 | H | 88.3 | Confident | 89 | Confident | 17 Ų | 17 | 63.5 Ų | 63.5 | 8% | 0.079 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -72.9 | -35.5 | -177.3 | -72.7 | 107.9 | 0 | 0 | 0 | 113.8 | S134 I218 V219 I220 V224 V225 Y226 L244 I247 | S134-H222 PolarHBondContact OG-CE1 3.48Å; I218-H222 WeakPolarHBondContact CG2-ND1 3.4Å; I218-H222 PolarHBondContact O-N 3.42Å; I218-H222 PolarHBondContact O-ND1 3.1Å; V219-H222 PolarHBondContact O-N 3.46Å; I220-H222 VanDerWaalsContact C-N 3.29Å; I220-H222 PolarHBondContact O-N 3.03Å; H222-V224 VanDerWaalsContact C-N 3.31Å; H222-V224 PolarHBondContact O-N 3.35Å; H222-V225 PolarHBondContact O-N 3.05Å; H222-Y226 VanDerWaalsContact O-CB 3.24Å; H222-Y226 WeakPolarHBondContact O-CB 3.33Å; H222-Y226 PolarHBondContact O-N 2.84Å; H222-L244 HydrophobicContact CB-CD1 4.15Å; H222-L244 WeakPolarHBondContact CD2-CD1 3.36Å; H222-I247 WeakPolarHBondContact CE1-CG2 3.26Å; H222-I247 WeakPolarHBondContact NE2-CG2 3.39Å |
| 223 | L | 90.2 | Very high | 87.6 | Confident | 108 Ų | 108 | 66.6 Ų | 66.6 | 57% | 0.565 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -61.6 | -42 | 172.6 | -71.6 | 175.2 | 0 | 0 | 0 | 111.1 | V219 I220 Y226 S227 | V219-L223 HydrophobicContact CG1-CD1 3.72Å; V219-L223 HydrophobicContact CG1-CG 4.13Å; V219-L223 WeakPolarHBondContact O-CB 3.31Å; V219-L223 VanDerWaalsContact O-CG 3.27Å; V219-L223 WeakPolarHBondContact O-CG 3.04Å; V219-L223 PolarHBondContact O-N 3.38Å; I220-L223 PolarHBondContact O-N 3.46Å; L223-Y226 PolarHBondContact O-N 3.49Å; L223-S227 WeakPolarHBondContact O-CB 3.44Å; L223-S227 PolarHBondContact O-N 3.06Å; L223-S227 PolarHBondContact O-OG 3.41Å |
| 224 | V | 90.6 | Very high | 86 | Confident | 42 Ų | 42 | 67 Ų | 67 | 26% | 0.255 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -67.8 | -41.6 | 176.3 | 176.7 | 0 | 0 | 0 | 0 | 111.5 | L138 K142 I220 C221 H222 S227 T228 | L138-V224 HydrophobicContact CD1-CB 3.82Å; L138-V224 HydrophobicContact CD1-CG1 3.42Å; L138-V224 VanDerWaalsContact CD1-CG1 3.42Å; K142-V224 HydrophobicContact CD-CG1 4.43Å; K142-V224 HydrophobicContact CG-CG1 4.42Å; I220-V224 VanDerWaalsContact O-CG2 3.3Å; I220-V224 WeakPolarHBondContact O-CG2 3.26Å; I220-V224 PolarHBondContact O-N 2.86Å; C221-V224 PolarHBondContact O-N 2.86Å; H222-V224 VanDerWaalsContact C-N 3.31Å; H222-V224 PolarHBondContact O-N 3.35Å; V224-S227 WeakPolarHBondContact CA-OG 3.21Å; V224-S227 PolarHBondContact O-OG 3.09Å; V224-T228 VanDerWaalsContact O-CB 3.3Å; V224-T228 WeakPolarHBondContact O-CB 3.39Å; V224-T228 PolarHBondContact O-N 2.03Å; V224-T228 PolarHBondContact O-OG1 2.9Å |
| 225 | V | 88.4 | Confident | 84.3 | Confident | 6 Ų | 6 | 78.8 Ų | 78.8 | 4% | 0.036 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -61.8 | -45.5 | 174.7 | 164.3 | 0 | 0 | 0 | 0 | 111.3 | R137 L138 V141 C221 H222 T229 L244 | R137-V225 HydrophobicContact CB-CG2 4.48Å; L138-V225 HydrophobicContact CB-CG2 4.24Å; L138-V225 HydrophobicContact CD1-CG2 4.25Å; V141-V225 HydrophobicContact CB-CG2 4.5Å; V141-V225 HydrophobicContact CG2-CG1 4.2Å; V141-V225 HydrophobicContact CG2-CG2 4.35Å; C221-V225 WeakPolarHBondContact O-CB 3.22Å; C221-V225 VanDerWaalsContact O-CG2 3.26Å; C221-V225 WeakPolarHBondContact O-CG2 3.49Å; C221-V225 PolarHBondContact O-N 3.4Å; H222-V225 PolarHBondContact O-N 3.05Å; V225-T229 VanDerWaalsContact O-CB 3.25Å; V225-T229 WeakPolarHBondContact O-CB 3.09Å; V225-T229 PolarHBondContact O-N 3.27Å; V225-T229 PolarHBondContact O-OG1 3.24Å; V225-L244 HydrophobicContact CG1-CD1 4.29Å |
| 226 | Y | 86.7 | Confident | 82.8 | Confident | 119 Ų | 119 | 77.6 Ų | 77.6 | 47% | 0.467 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -62.6 | -50.5 | 179.8 | 176.1 | -98.3 | 0 | 0 | 0 | 111.5 | H222 L223 T228 T229 R230 L244 | H222-Y226 VanDerWaalsContact O-CB 3.24Å; H222-Y226 WeakPolarHBondContact O-CB 3.33Å; H222-Y226 PolarHBondContact O-N 2.84Å; L223-Y226 PolarHBondContact O-N 3.49Å; Y226-T228 PolarHBondContact O-N 3.46Å; Y226-T229 PolarHBondContact O-N 2.9Å; Y226-R230 WeakPolarHBondContact O-CB 3.34Å; Y226-R230 PolarHBondContact O-N 3.45Å; Y226-L244 HydrophobicContact CD2-CD2 3.95Å |
| 227 | S | 86.6 | Confident | 81.7 | Confident | 40 Ų | 40 | 76 Ų | 76 | 28% | 0.28 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -62.4 | -41 | 179.4 | 56.7 | 0 | 0 | 0 | 0 | 112.3 | L223 V224 R230 R231 | L223-S227 WeakPolarHBondContact O-CB 3.44Å; L223-S227 PolarHBondContact O-N 3.06Å; L223-S227 PolarHBondContact O-OG 3.41Å; V224-S227 WeakPolarHBondContact CA-OG 3.21Å; V224-S227 PolarHBondContact O-OG 3.09Å; S227-R230 PolarHBondContact O-N 2.9Å; S227-R231 WeakPolarHBondContact O-CG 3.2Å; S227-R231 PolarHBondContact O-N 2.9Å |
| 228 | T | 84.8 | Confident | 80.4 | Confident | 34 Ų | 34 | 77.3 Ų | 77.3 | 21% | 0.209 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -70.3 | -42 | 179.1 | -51.7 | 0 | 0 | 0 | 0 | 111.5 | V141 K142 V224 Y226 R230 R231 G232 | V141-T228 HydrophobicContact CG1-CG2 3.47Å; V141-T228 VanDerWaalsContact CG1-CG2 3.47Å; K142-T228 WeakPolarHBondContact CE-OG1 3.47Å; K142-T228 PolarHBondContact NZ-OG1 3.24Å; V224-T228 VanDerWaalsContact O-CB 3.3Å; V224-T228 WeakPolarHBondContact O-CB 3.39Å; V224-T228 PolarHBondContact O-N 2.03Å; V224-T228 PolarHBondContact O-OG1 2.9Å; Y226-T228 PolarHBondContact O-N 3.46Å; T228-R230 VanDerWaalsContact C-N 3.3Å; T228-R230 PolarHBondContact O-N 3.46Å; T228-R231 PolarHBondContact O-N 3.42Å; T228-G232 PolarHBondContact O-N 2.93Å; T228-G232 VanDerWaalsContact O-N 3.12Å |
| 229 | T | 82 | Confident | 79.1 | Confident | 19 Ų | 19 | 86.8 Ų | 86.8 | 12% | 0.117 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -66.4 | -31.9 | 177.6 | -59.5 | 0 | 0 | 0 | 0 | 112.4 | V225 Y226 R231 R237 S240 | V225-T229 VanDerWaalsContact O-CB 3.25Å; V225-T229 WeakPolarHBondContact O-CB 3.09Å; V225-T229 PolarHBondContact O-N 3.27Å; V225-T229 PolarHBondContact O-OG1 3.24Å; Y226-T229 PolarHBondContact O-N 2.9Å; T229-R231 VanDerWaalsContact C-N 3.3Å; T229-R231 PolarHBondContact O-N 3.41Å; T229-R237 HydrophobicContact CG2-CG 4.07Å; T229-R237 PolarHBondContact O-NE 3.31Å; T229-S240 WeakPolarHBondContact CG2-OG 3.18Å; T229-S240 PolarHBondContact OG1-OG 2.9Å |
| 230 | R | 79 | Confident | 78.2 | Confident | 168 Ų | 168 | 86 Ų | 86 | 63% | 0.634 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -66.7 | -31.1 | 175 | -175.1 | 174.6 | 170.5 | 178.3 | -4.3 | 112.3 | Y226 S227 T228 R237 | Y226-R230 WeakPolarHBondContact O-CB 3.34Å; Y226-R230 PolarHBondContact O-N 3.45Å; S227-R230 PolarHBondContact O-N 2.9Å; T228-R230 VanDerWaalsContact C-N 3.3Å; T228-R230 PolarHBondContact O-N 3.46Å; R230-R237 PolarHBondContact O-NH2 3.41Å |
| 231 | R | 77.9 | Confident | 77.3 | Confident | 217 Ų | 217 | 86.6 Ų | 86.6 | 82% | 0.819 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -88.2 | -23.4 | -179.4 | -66.7 | 175.8 | -178.5 | 160.8 | 0.5 | 114 | S227 T228 T229 | S227-R231 WeakPolarHBondContact O-CG 3.2Å; S227-R231 PolarHBondContact O-N 2.9Å; T228-R231 PolarHBondContact O-N 3.42Å; T229-R231 VanDerWaalsContact C-N 3.3Å; T229-R231 PolarHBondContact O-N 3.41Å |
| 232 | G | 69.9 | Low | 76.5 | Confident | 27 Ų | 27 | 90.8 Ų | 90.8 | 28% | 0.278 | 45% | 0.446 | S | S | . | . | S | Bend | trans | -83.1 | 171.7 | -176.5 | 0 | 0 | 0 | 0 | 0 | 116.1 | T228 R237 | T228-G232 PolarHBondContact O-N 2.93Å; T228-G232 VanDerWaalsContact O-N 3.12Å; G232-R237 PolarHBondContact O-NH2 2.93Å |
| 233 | P | 66.6 | Low | 75.7 | Confident | 118 Ų | 118 | 91.8 Ų | 91.8 | 77% | 0.766 | 45% | 0.454 | S | S | * | . | trans | -58.2 | 153 | -175.1 | -22.5 | 31.7 | 0 | 0 | 0 | 115.2 | R235 | P233-R235 PolarHBondContact O-N 3.23Š| ||
| 234 | S | 61.7 | Low | 75.1 | Confident | 92 Ų | 92 | 87.7 Ų | 87.7 | 64% | 0.643 | 43% | 0.432 | S | S | * | . | G | 310 helix | trans | -66.1 | -33.7 | -172.4 | 60.2 | 0 | 0 | 0 | 0 | 115.1 | G236 R237 | S234-G236 VanDerWaalsContact C-N 3.26Å; S234-G236 PolarHBondContact O-N 3.12Å; S234-G236 VanDerWaalsContact O-N 3.11Å; S234-R237 WeakPolarHBondContact O-CB 3.38Å; S234-R237 PolarHBondContact O-N 3.43Å; S234-R237 VanDerWaalsContact O-N 3.08Å |
| 235 | R | 59.9 | Low | 74.7 | Confident | 253 Ų | 253 | 93.7 Ų | 93.7 | 96% | 0.955 | 45% | 0.45 | S | S | * | . | G | 310 helix | trans | -61 | -24.2 | -169.6 | -71.1 | 175.6 | 88.9 | 135.8 | -1.9 | 115 | P233 | P233-R235 PolarHBondContact O-N 3.23Š|
| 236 | G | 64.5 | Low | 74.2 | Confident | 48 Ų | 48 | 94.1 Ų | 94.1 | 50% | 0.495 | 45% | 0.453 | S | S | . | . | G | 310 helix | trans | -106.7 | -6.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 115.2 | S234 A238 R239 S240 | S234-G236 VanDerWaalsContact C-N 3.26Å; S234-G236 PolarHBondContact O-N 3.12Å; S234-G236 VanDerWaalsContact O-N 3.11Å; G236-A238 PolarHBondContact O-N 3.31Å; G236-R239 PolarHBondContact O-N 3.15Å; G236-S240 PolarHBondContact O-N 3.09Å; G236-S240 VanDerWaalsContact O-N 3.16Å |
| 237 | R | 70.4 | Confident | 73.7 | Confident | 79 Ų | 79 | 89.1 Ų | 89.1 | 30% | 0.298 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -68.3 | -38.1 | -166.7 | -168.1 | 179.8 | -74.8 | 178.6 | -5.3 | 112.8 | T229 R230 G232 S234 K241 | T229-R237 HydrophobicContact CG2-CG 4.07Å; T229-R237 PolarHBondContact O-NE 3.31Å; R230-R237 PolarHBondContact O-NH2 3.41Å; G232-R237 PolarHBondContact O-NH2 2.93Å; S234-R237 WeakPolarHBondContact O-CB 3.38Å; S234-R237 PolarHBondContact O-N 3.43Å; S234-R237 VanDerWaalsContact O-N 3.08Å; R237-K241 HydrophobicContact CG-CD 4.29Å; R237-K241 HydrophobicContact CG-CG 4.5Å; R237-K241 WeakPolarHBondContact O-CB 3.13Å; R237-K241 VanDerWaalsContact O-CG 3.26Å; R237-K241 WeakPolarHBondContact O-CG 3.27Å; R237-K241 PolarHBondContact O-N 3.48Å |
| 238 | A | 69 | Low | 73.5 | Confident | 79 Ų | 79 | 90 Ų | 90 | 65% | 0.653 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -67.4 | -43.3 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | G236 R242 | G236-A238 PolarHBondContact O-N 3.31Å; A238-R242 PolarHBondContact O-N 3.41Å; A238-R242 VanDerWaalsContact O-N 3.08Å |
| 239 | R | 67.8 | Low | 73.6 | Confident | 201 Ų | 201 | 90.7 Ų | 90.7 | 76% | 0.758 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -65.4 | -44.5 | 177 | -171.5 | 177.7 | -178.2 | 173 | 1 | 111.3 | G236 R242 T243 | G236-R239 PolarHBondContact O-N 3.15Å; R239-R242 PolarHBondContact O-N 2.88Å; R239-T243 PolarHBondContact O-N 3.38Å; R239-T243 PolarHBondContact O-OG1 3.42Å |
| 240 | S | 71.9 | Confident | 73.7 | Confident | 29 Ų | 29 | 90 Ų | 90 | 20% | 0.203 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -61.9 | -49 | 176 | -179 | 0 | 0 | 0 | 0 | 112.1 | T229 G236 R242 T243 L244 | T229-S240 WeakPolarHBondContact CG2-OG 3.18Å; T229-S240 PolarHBondContact OG1-OG 2.9Å; G236-S240 PolarHBondContact O-N 3.09Å; G236-S240 VanDerWaalsContact O-N 3.16Å; S240-R242 VanDerWaalsContact C-N 3.26Å; S240-R242 PolarHBondContact O-N 3.25Å; S240-T243 PolarHBondContact O-N 2.85Å; S240-L244 VanDerWaalsContact O-CB 3.32Å; S240-L244 WeakPolarHBondContact O-CB 3.44Å; S240-L244 PolarHBondContact O-N 2.92Å |
| 241 | K | 74.6 | Confident | 74 | Confident | 114 Ų | 114 | 82.5 Ų | 82.5 | 50% | 0.496 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -56 | -39.1 | 176 | -79.7 | -179.6 | 176 | -172.6 | 0 | 112.6 | R237 R245 | R237-K241 HydrophobicContact CG-CD 4.29Å; R237-K241 HydrophobicContact CG-CG 4.5Å; R237-K241 WeakPolarHBondContact O-CB 3.13Å; R237-K241 VanDerWaalsContact O-CG 3.26Å; R237-K241 WeakPolarHBondContact O-CG 3.27Å; R237-K241 PolarHBondContact O-N 3.48Å; K241-R245 WeakPolarHBondContact O-CB 3.44Å; K241-R245 PolarHBondContact O-N 3.39Å |
| 242 | R | 75.1 | Confident | 74.5 | Confident | 96 Ų | 96 | 76.6 Ų | 76.6 | 36% | 0.362 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -66.9 | -50.4 | 177.5 | -175.9 | -179.5 | -176 | 148.7 | 3.4 | 111.8 | A238 R239 S240 L244 R245 V246 V306 K308 | A238-R242 PolarHBondContact O-N 3.41Å; A238-R242 VanDerWaalsContact O-N 3.08Å; R239-R242 PolarHBondContact O-N 2.88Å; S240-R242 VanDerWaalsContact C-N 3.26Å; S240-R242 PolarHBondContact O-N 3.25Å; R242-L244 VanDerWaalsContact C-N 3.28Å; R242-L244 PolarHBondContact O-N 2.99Å; R242-R245 WeakPolarHBondContact O-CB 3.28Å; R242-R245 PolarHBondContact O-N 3.5Å; R242-R245 VanDerWaalsContact O-N 3.13Å; R242-V246 WeakPolarHBondContact O-CG2 3.48Å; R242-V246 PolarHBondContact O-N 3.13Å; R242-V306 PolarHBondContact NE-O 3.44Å; R242-V306 PolarHBondContact NH2-O 3.47Å; R242-V306 VanDerWaalsContact NH2-O 3.09Å; R242-K308 VanDerWaalsContact NH2-N 3.15Å |
| 243 | T | 72.4 | Confident | 75.5 | Confident | 39 Ų | 39 | 76.3 Ų | 76.3 | 24% | 0.239 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -60.4 | -41 | 178 | -64.7 | 0 | 0 | 0 | 0 | 111.4 | R239 S240 R245 V246 I247 | R239-T243 PolarHBondContact O-N 3.38Å; R239-T243 PolarHBondContact O-OG1 3.42Å; S240-T243 PolarHBondContact O-N 2.85Å; T243-R245 PolarHBondContact O-N 3.25Å; T243-V246 PolarHBondContact O-N 3.25Å; T243-I247 HydrophobicContact CG2-CD1 3.98Å; T243-I247 WeakPolarHBondContact O-CG1 3.36Å; T243-I247 PolarHBondContact O-N 3.01Å; T243-I247 VanDerWaalsContact O-N 3.09Å |
| 244 | L | 77.6 | Confident | 76.6 | Confident | 21 Ų | 21 | 70.8 Ų | 70.8 | 11% | 0.11 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -58.5 | -45.3 | 172.7 | 178.5 | 62 | 0 | 0 | 0 | 111.6 | H222 V225 Y226 S240 R242 V246 I247 V248 | H222-L244 HydrophobicContact CB-CD1 4.15Å; H222-L244 WeakPolarHBondContact CD2-CD1 3.36Å; V225-L244 HydrophobicContact CG1-CD1 4.29Å; Y226-L244 HydrophobicContact CD2-CD2 3.95Å; S240-L244 VanDerWaalsContact O-CB 3.32Å; S240-L244 WeakPolarHBondContact O-CB 3.44Å; S240-L244 PolarHBondContact O-N 2.92Å; R242-L244 VanDerWaalsContact C-N 3.28Å; R242-L244 PolarHBondContact O-N 2.99Å; L244-V246 PolarHBondContact O-N 3.41Å; L244-I247 PolarHBondContact O-N 3.45Å; L244-V248 HydrophobicContact CD1-CG2 4.13Å; L244-V248 HydrophobicContact CG-CG2 4.42Å; L244-V248 WeakPolarHBondContact O-CB 3.41Å; L244-V248 VanDerWaalsContact O-CG2 3.3Å; L244-V248 WeakPolarHBondContact O-CG2 3.22Å; L244-V248 PolarHBondContact O-N 3.41Å |
| 245 | R | 81.4 | Confident | 78.1 | Confident | 168 Ų | 168 | 67 Ų | 67 | 63% | 0.634 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -58.8 | -45.8 | 176.3 | -172.9 | -171.3 | -61.2 | 171.4 | -2.7 | 112.1 | K241 R242 T243 I247 V248 V249 | K241-R245 WeakPolarHBondContact O-CB 3.44Å; K241-R245 PolarHBondContact O-N 3.39Å; R242-R245 WeakPolarHBondContact O-CB 3.28Å; R242-R245 PolarHBondContact O-N 3.5Å; R242-R245 VanDerWaalsContact O-N 3.13Å; T243-R245 PolarHBondContact O-N 3.25Å; R245-I247 VanDerWaalsContact C-N 3.33Å; R245-I247 PolarHBondContact O-N 3.11Å; R245-V248 PolarHBondContact O-N 3.37Å; R245-V249 VanDerWaalsContact O-CG2 3.32Å; R245-V249 WeakPolarHBondContact O-CG2 3.31Å; R245-V249 PolarHBondContact O-N 2.84Å |
| 246 | V | 78 | Confident | 79.7 | Confident | 16 Ų | 16 | 60.6 Ų | 60.6 | 10% | 0.097 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -56.4 | -50.7 | 176.8 | 179.2 | 0 | 0 | 0 | 0 | 109.8 | R242 T243 L244 V248 V249 V250 I302 Y303 V306 | R242-V246 WeakPolarHBondContact O-CG2 3.48Å; R242-V246 PolarHBondContact O-N 3.13Å; T243-V246 PolarHBondContact O-N 3.25Å; L244-V246 PolarHBondContact O-N 3.41Å; V246-V248 PolarHBondContact O-N 3.08Å; V246-V249 PolarHBondContact O-N 3.35Å; V246-V250 HydrophobicContact CG1-CG2 4.44Å; V246-V250 WeakPolarHBondContact O-CG2 3.24Å; V246-V250 PolarHBondContact O-N 2.86Å; V246-I302 HydrophobicContact CG1-CG2 4.22Å; V246-Y303 HydrophobicContact CG1-CD1 4.29Å; V246-Y303 HydrophobicContact CG1-CE1 4.49Å; V246-V306 HydrophobicContact CB-CB 4.47Å; V246-V306 HydrophobicContact CB-CG1 4.15Å; V246-V306 HydrophobicContact CG2-CB 3.76Å; V246-V306 HydrophobicContact CG2-CG1 3.39Å |
| 247 | I | 76.8 | Confident | 81.1 | Confident | 14 Ų | 14 | 58.6 Ų | 58.6 | 7% | 0.072 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -66.7 | -42.2 | -175.2 | -59.8 | 164 | 0 | 0 | 0 | 110.7 | I133 R137 H222 T243 L244 R245 V249 V250 V251 | I133-I247 HydrophobicContact CG2-CD1 4.19Å; I133-I247 HydrophobicContact CG2-CG1 4.45Å; R137-I247 HydrophobicContact CG-CD1 3.41Å; R137-I247 VanDerWaalsContact CG-CD1 3.41Å; H222-I247 WeakPolarHBondContact CE1-CG2 3.26Å; H222-I247 WeakPolarHBondContact NE2-CG2 3.39Å; T243-I247 HydrophobicContact CG2-CD1 3.98Å; T243-I247 WeakPolarHBondContact O-CG1 3.36Å; T243-I247 PolarHBondContact O-N 3.01Å; T243-I247 VanDerWaalsContact O-N 3.09Å; L244-I247 PolarHBondContact O-N 3.45Å; R245-I247 VanDerWaalsContact C-N 3.33Å; R245-I247 PolarHBondContact O-N 3.11Å; I247-V249 VanDerWaalsContact C-N 3.3Å; I247-V249 PolarHBondContact O-N 3.36Å; I247-V250 PolarHBondContact O-N 3.25Å; I247-V251 HydrophobicContact CG2-CG2 3.94Å; I247-V251 VanDerWaalsContact O-CB 3.29Å; I247-V251 WeakPolarHBondContact O-CB 3.22Å; I247-V251 WeakPolarHBondContact O-CG2 3.29Å; I247-V251 PolarHBondContact O-N 3.42Å |
| 248 | V | 82.5 | Confident | 82.3 | Confident | 57 Ų | 57 | 54.9 Ų | 54.9 | 35% | 0.345 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -58 | -43.1 | 175.1 | 169.4 | 0 | 0 | 0 | 0 | 111.2 | L244 R245 V246 V251 L252 | L244-V248 HydrophobicContact CD1-CG2 4.13Å; L244-V248 HydrophobicContact CG-CG2 4.42Å; L244-V248 WeakPolarHBondContact O-CB 3.41Å; L244-V248 VanDerWaalsContact O-CG2 3.3Å; L244-V248 WeakPolarHBondContact O-CG2 3.22Å; L244-V248 PolarHBondContact O-N 3.41Å; R245-V248 PolarHBondContact O-N 3.37Å; V246-V248 PolarHBondContact O-N 3.08Å; V248-V251 PolarHBondContact O-N 3.01Å; V248-L252 HydrophobicContact CG1-CD1 3.84Å; V248-L252 HydrophobicContact CG1-CG 4.29Å; V248-L252 WeakPolarHBondContact O-CB 3.41Å; V248-L252 VanDerWaalsContact O-CG 3.25Å; V248-L252 WeakPolarHBondContact O-CG 3.4Å; V248-L252 PolarHBondContact O-N 3.45Å |
| 249 | V | 86.4 | Confident | 83.6 | Confident | 50 Ų | 50 | 54 Ų | 54 | 30% | 0.303 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -62.4 | -49.2 | 176.5 | 172.5 | 0 | 0 | 0 | 0 | 111 | R245 V246 I247 V251 L252 S253 I302 | R245-V249 VanDerWaalsContact O-CG2 3.32Å; R245-V249 WeakPolarHBondContact O-CG2 3.31Å; R245-V249 PolarHBondContact O-N 2.84Å; V246-V249 PolarHBondContact O-N 3.35Å; I247-V249 VanDerWaalsContact C-N 3.3Å; I247-V249 PolarHBondContact O-N 3.36Å; V249-V251 VanDerWaalsContact C-N 3.29Å; V249-V251 PolarHBondContact O-N 3.28Å; V249-L252 PolarHBondContact O-N 3.46Å; V249-S253 WeakPolarHBondContact O-CB 3.11Å; V249-S253 PolarHBondContact O-N 3.41Å; V249-S253 PolarHBondContact O-OG 3.21Å; V249-S253 VanDerWaalsContact O-OG 3.06Å; V249-I302 HydrophobicContact CB-CG2 4.37Å; V249-I302 HydrophobicContact CG1-CD1 4.05Å; V249-I302 HydrophobicContact CG1-CG1 4.03Å; V249-I302 HydrophobicContact CG1-CG2 3.96Å |
| 250 | V | 83.9 | Confident | 84.9 | Confident | 4 Ų | 4 | 46.6 Ų | 46.6 | 2% | 0.024 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -58.2 | -43.4 | 177.6 | 176.7 | 0 | 0 | 0 | 0 | 111.5 | L130 V246 I247 S253 F254 I302 Y303 | L130-V250 HydrophobicContact CD1-CG1 4.37Å; L130-V250 HydrophobicContact CD2-CG1 3.47Å; L130-V250 VanDerWaalsContact CD2-CG1 3.47Å; V246-V250 HydrophobicContact CG1-CG2 4.44Å; V246-V250 WeakPolarHBondContact O-CG2 3.24Å; V246-V250 PolarHBondContact O-N 2.86Å; I247-V250 PolarHBondContact O-N 3.25Å; V250-S253 PolarHBondContact O-N 3.3Å; V250-F254 PolarHBondContact O-N 3.12Å; V250-I302 HydrophobicContact CG2-CB 4.17Å; V250-I302 HydrophobicContact CG2-CD1 4.11Å; V250-I302 HydrophobicContact CG2-CG2 3.5Å; V250-I302 VanDerWaalsContact CG2-CG2 3.5Å; V250-Y303 HydrophobicContact CG2-CE1 4.15Å |
| 251 | V | 85.1 | Confident | 86 | Confident | 10 Ų | 10 | 45.3 Ų | 45.3 | 6% | 0.061 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -63.3 | -48 | 179.3 | 166.8 | 0 | 0 | 0 | 0 | 111.1 | I218 I247 V248 V249 S253 F254 F255 | I218-V251 HydrophobicContact CG2-CB 4.23Å; I218-V251 HydrophobicContact CG2-CG1 3.58Å; I218-V251 HydrophobicContact CG2-CG2 3.55Å; I247-V251 HydrophobicContact CG2-CG2 3.94Å; I247-V251 VanDerWaalsContact O-CB 3.29Å; I247-V251 WeakPolarHBondContact O-CB 3.22Å; I247-V251 WeakPolarHBondContact O-CG2 3.29Å; I247-V251 PolarHBondContact O-N 3.42Å; V248-V251 PolarHBondContact O-N 3.01Å; V249-V251 VanDerWaalsContact C-N 3.29Å; V249-V251 PolarHBondContact O-N 3.28Å; V251-S253 VanDerWaalsContact C-N 3.34Å; V251-F254 WeakPolarHBondContact O-CB 3.29Å; V251-F254 PolarHBondContact O-N 2.83Å; V251-F255 HydrophobicContact CG1-CD2 3.76Å; V251-F255 HydrophobicContact CG1-CE2 3.58Å; V251-F255 WeakPolarHBondContact O-CD2 3.45Å; V251-F255 PolarHBondContact O-N 3.38Å; V251-F255 VanDerWaalsContact O-N 3.08Å |
| 252 | L | 88.8 | Confident | 86.9 | Confident | 93 Ų | 93 | 40 Ų | 40 | 49% | 0.487 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -63.2 | -42.5 | 177.2 | -70.6 | 173.5 | 0 | 0 | 0 | 111.2 | V248 V249 F254 F255 L256 | V248-L252 HydrophobicContact CG1-CD1 3.84Å; V248-L252 HydrophobicContact CG1-CG 4.29Å; V248-L252 WeakPolarHBondContact O-CB 3.41Å; V248-L252 VanDerWaalsContact O-CG 3.25Å; V248-L252 WeakPolarHBondContact O-CG 3.4Å; V248-L252 PolarHBondContact O-N 3.45Å; V249-L252 PolarHBondContact O-N 3.46Å; L252-F254 VanDerWaalsContact C-N 3.3Å; L252-F254 PolarHBondContact O-N 3.4Å; L252-F255 PolarHBondContact O-N 3.17Å; L252-L256 VanDerWaalsContact O-CB 3.31Å; L252-L256 WeakPolarHBondContact O-CB 2.96Å; L252-L256 WeakPolarHBondContact O-CG 3.44Å; L252-L256 PolarHBondContact O-N 3.31Å |
| 253 | S | 90.2 | Very high | 87.9 | Confident | 22 Ų | 22 | 39.4 Ų | 39.4 | 15% | 0.154 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -59.3 | -39.7 | 174.8 | -66.2 | 0 | 0 | 0 | 0 | 112.2 | V249 V250 V251 C257 N295 | V249-S253 WeakPolarHBondContact O-CB 3.11Å; V249-S253 PolarHBondContact O-N 3.41Å; V249-S253 PolarHBondContact O-OG 3.21Å; V249-S253 VanDerWaalsContact O-OG 3.06Å; V250-S253 PolarHBondContact O-N 3.3Å; V251-S253 VanDerWaalsContact C-N 3.34Å; S253-C257 VanDerWaalsContact O-CB 3.22Å; S253-C257 WeakPolarHBondContact O-CB 3.09Å; S253-C257 PolarHBondContact O-N 3.25Å; S253-C257 PolarHBondContact O-SG 3.41Å; S253-N295 PolarHBondContact O-ND2 2.85Å |
| 254 | F | 90.3 | Very high | 88.8 | Confident | 1 Ų | 1 | 38.3 Ų | 38.3 | 0% | 0.004 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -59.6 | -58.2 | 172.9 | -175.3 | -83.9 | 0 | 0 | 0 | 111.3 | I127 L130 V250 V251 L252 L256 C257 W258 N295 | I127-F254 HydrophobicContact CB-CE1 3.9Å; I127-F254 HydrophobicContact CB-CE2 4Å; I127-F254 HydrophobicContact CB-CZ 3.52Å; I127-F254 HydrophobicContact CD1-CD1 3.67Å; I127-F254 HydrophobicContact CD1-CE1 3.54Å; I127-F254 HydrophobicContact CD1-CG 4.28Å; I127-F254 HydrophobicContact CD1-CZ 4.04Å; I127-F254 HydrophobicContact CG1-CD1 4.46Å; I127-F254 HydrophobicContact CG1-CE1 3.83Å; I127-F254 HydrophobicContact CG1-CZ 4Å; I127-F254 HydrophobicContact CG2-CZ 4.44Å; L130-F254 HydrophobicContact CD1-CB 3.74Å; L130-F254 HydrophobicContact CD1-CD2 3.96Å; L130-F254 HydrophobicContact CD1-CG 3.86Å; V250-F254 PolarHBondContact O-N 3.12Å; V251-F254 WeakPolarHBondContact O-CB 3.29Å; V251-F254 PolarHBondContact O-N 2.83Å; L252-F254 VanDerWaalsContact C-N 3.3Å; L252-F254 PolarHBondContact O-N 3.4Å; F254-L256 VanDerWaalsContact C-N 3.32Å; F254-L256 PolarHBondContact O-N 3.4Å; F254-C257 PolarHBondContact O-N 2.89Å; F254-C257 VanDerWaalsContact O-N 3.11Å; F254-W258 AromaticContact CD1-CD1 3.9Å; F254-W258 HydrophobicContact CD1-CG 4.49Å; F254-W258 AromaticContact CD2-CD1 3.46Å; F254-W258 VanDerWaalsContact CD2-CD1 3.46Å; F254-W258 AromaticContact CD2-NE1 3.53Å; F254-W258 HydrophobicContact CE1-CB 4.21Å; F254-W258 AromaticContact CE1-CD1 3.74Å; F254-W258 HydrophobicContact CE1-CG 4.02Å; F254-W258 AromaticContact CE2-CD1 3.3Å; F254-W258 HydrophobicContact CE2-CD2 4.43Å; F254-W258 AromaticContact CE2-CE2 3.93Å; F254-W258 HydrophobicContact CE2-CG 4.1Å; F254-W258 AromaticContact CE2-NE1 3.19Å; F254-W258 AromaticContact CG-CD1 3.75Å; F254-W258 HydrophobicContact CZ-CB 4.42Å; F254-W258 AromaticContact CZ-CD1 3.41Å; F254-W258 VanDerWaalsContact CZ-CD1 3.41Å; F254-W258 HydrophobicContact CZ-CD2 4.22Å; F254-W258 AromaticContact CZ-CG 3.78Å; F254-W258 HydrophobicContact CZ-CG 3.78Å; F254-W258 AromaticContact CZ-NE1 3.68Å; F254-W258 PolarHBondContact O-N 3.22Å; F254-N295 VanDerWaalsContact CA-ND2 3.27Å; F254-N295 WeakPolarHBondContact CA-ND2 3.48Å; F254-N295 PolarHBondContact N-ND2 3.41Å |
| 255 | F | 93 | Very high | 89.5 | Confident | 12 Ų | 12 | 37.8 Ų | 37.8 | 5% | 0.053 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -63.9 | -37.7 | -174.9 | -68.9 | -63.3 | 0 | 0 | 0 | 112.8 | I127 F211 F215 I218 V251 L252 C257 L259 | I127-F255 HydrophobicContact CD1-CE1 4.26Å; I127-F255 HydrophobicContact CD1-CZ 3.9Å; F211-F255 HydrophobicContact CD1-CD1 4.31Å; F211-F255 HydrophobicContact CD1-CE1 4.5Å; F211-F255 AromaticContact CD2-CD1 3.74Å; F211-F255 HydrophobicContact CD2-CD1 3.74Å; F211-F255 HydrophobicContact CD2-CE1 4.18Å; F211-F255 HydrophobicContact CE1-CD1 4.01Å; F211-F255 HydrophobicContact CE2-CB 4.17Å; F211-F255 AromaticContact CE2-CD1 3.46Å; F211-F255 HydrophobicContact CE2-CD1 3.46Å; F211-F255 VanDerWaalsContact CE2-CD1 3.46Å; F211-F255 HydrophobicContact CE2-CE1 4.33Å; F211-F255 HydrophobicContact CE2-CG 4.31Å; F211-F255 HydrophobicContact CG-CD1 4.17Å; F211-F255 HydrophobicContact CG-CE1 4.28Å; F211-F255 HydrophobicContact CZ-CB 4.06Å; F211-F255 AromaticContact CZ-CD1 3.57Å; F211-F255 HydrophobicContact CZ-CD1 3.57Å; F211-F255 HydrophobicContact CZ-CE1 4.48Å; F211-F255 HydrophobicContact CZ-CG 4.25Å; F211-F255 WeakPolarHBondContact O-CE1 3.37Å; F215-F255 HydrophobicContact CB-CD1 4.43Å; F215-F255 HydrophobicContact CB-CE1 3.65Å; F215-F255 HydrophobicContact CB-CE2 4.13Å; F215-F255 HydrophobicContact CB-CZ 3.49Å; F215-F255 VanDerWaalsContact CB-CZ 3.49Å; F215-F255 HydrophobicContact CD2-CD1 4.08Å; F215-F255 AromaticContact CD2-CD2 3.67Å; F215-F255 HydrophobicContact CD2-CD2 3.67Å; F215-F255 HydrophobicContact CD2-CE1 4.01Å; F215-F255 AromaticContact CD2-CE2 3.54Å; F215-F255 HydrophobicContact CD2-CE2 3.54Å; F215-F255 AromaticContact CD2-CG 3.95Å; F215-F255 HydrophobicContact CD2-CG 3.95Å; F215-F255 AromaticContact CD2-CZ 3.77Å; F215-F255 HydrophobicContact CD2-CZ 3.77Å; F215-F255 HydrophobicContact CE2-CD2 4.27Å; F215-F255 HydrophobicContact CE2-CE2 4.45Å; F215-F255 HydrophobicContact CG-CE1 4.34Å; F215-F255 HydrophobicContact CG-CE2 4.3Å; F215-F255 HydrophobicContact CG-CZ 4.13Å; I218-F255 HydrophobicContact CD1-CE2 4.35Å; I218-F255 HydrophobicContact CD1-CZ 4.28Å; V251-F255 HydrophobicContact CG1-CD2 3.76Å; V251-F255 HydrophobicContact CG1-CE2 3.58Å; V251-F255 WeakPolarHBondContact O-CD2 3.45Å; V251-F255 PolarHBondContact O-N 3.38Å; V251-F255 VanDerWaalsContact O-N 3.08Å; L252-F255 PolarHBondContact O-N 3.17Å; F255-C257 VanDerWaalsContact C-N 3.34Å; F255-C257 PolarHBondContact O-N 3.19Å; F255-L259 WeakPolarHBondContact O-CB 3.44Å; F255-L259 PolarHBondContact O-N 3.26Å |
| 256 | L | 94 | Very high | 90 | Very high | 119 Ų | 119 | 32.4 Ų | 32.4 | 62% | 0.623 | 18% | 0.176 | S | C | * | . | H | α-helix | trans | -65.6 | -36.6 | 175.7 | -69.8 | 172.1 | 0 | 0 | 0 | 112.4 | L252 F254 P260 L291 | L252-L256 VanDerWaalsContact O-CB 3.31Å; L252-L256 WeakPolarHBondContact O-CB 2.96Å; L252-L256 WeakPolarHBondContact O-CG 3.44Å; L252-L256 PolarHBondContact O-N 3.31Å; F254-L256 VanDerWaalsContact C-N 3.32Å; F254-L256 PolarHBondContact O-N 3.4Å; L256-P260 WeakPolarHBondContact O-CD 3.3Å; L256-L291 WeakPolarHBondContact O-CD2 3.45Å |
| 257 | C | 94.4 | Very high | 90.6 | Very high | 6 Ų | 6 | 34.7 Ų | 34.7 | 4% | 0.041 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -74.2 | -39 | 179.4 | -77.9 | 0 | 0 | 0 | 0 | 113.4 | S253 F254 F255 L291 A292 N295 | S253-C257 VanDerWaalsContact O-CB 3.22Å; S253-C257 WeakPolarHBondContact O-CB 3.09Å; S253-C257 PolarHBondContact O-N 3.25Å; S253-C257 PolarHBondContact O-SG 3.41Å; F254-C257 PolarHBondContact O-N 2.89Å; F254-C257 VanDerWaalsContact O-N 3.11Å; F255-C257 VanDerWaalsContact C-N 3.34Å; F255-C257 PolarHBondContact O-N 3.19Å; C257-L291 HydrophobicContact CB-CG 4.36Å; C257-L291 VanDerWaalsContact CB-O 3.25Å; C257-L291 WeakPolarHBondContact CB-O 3.34Å; C257-L291 PolarHBondContact SG-O 3.19Å; C257-L291 VanDerWaalsContact SG-O 3.35Å; C257-A292 PolarHBondContact O-N 3.44Å; C257-N295 HydrophobicContact CB-CB 3.76Å |
| 258 | W | 95 | Very high | 91 | Very high | 2 Ų | 2 | 37.3 Ų | 37.3 | 1% | 0.008 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -91.7 | -23.9 | -173.5 | -71.9 | 95.4 | 0 | 0 | 0 | 113.7 | F119 M123 F254 L261 H262 A292 | F119-W258 HydrophobicContact CE1-CZ3 4.25Å; F119-W258 HydrophobicContact CE2-CH2 4.1Å; F119-W258 HydrophobicContact CE2-CZ3 4.3Å; F119-W258 HydrophobicContact CZ-CH2 4.12Å; F119-W258 AromaticContact CZ-CZ3 3.84Å; F119-W258 HydrophobicContact CZ-CZ3 3.84Å; M123-W258 HydrophobicContact CB-CE3 4.27Å; M123-W258 HydrophobicContact CB-CH2 3.39Å; M123-W258 HydrophobicContact CB-CZ2 3.93Å; M123-W258 HydrophobicContact CB-CZ3 3.59Å; M123-W258 HydrophobicContact CG-CD2 3.97Å; M123-W258 HydrophobicContact CG-CE3 3.56Å; M123-W258 HydrophobicContact CG-CH2 3.63Å; M123-W258 HydrophobicContact CG-CZ2 4.01Å; M123-W258 HydrophobicContact CG-CZ3 3.38Å; M123-W258 HydrophobicContact SD-CE3 3.81Å; M123-W258 HydrophobicContact SD-CZ3 3.74Å; F254-W258 AromaticContact CD1-CD1 3.9Å; F254-W258 HydrophobicContact CD1-CG 4.49Å; F254-W258 AromaticContact CD2-CD1 3.46Å; F254-W258 VanDerWaalsContact CD2-CD1 3.46Å; F254-W258 AromaticContact CD2-NE1 3.53Å; F254-W258 HydrophobicContact CE1-CB 4.21Å; F254-W258 AromaticContact CE1-CD1 3.74Å; F254-W258 HydrophobicContact CE1-CG 4.02Å; F254-W258 AromaticContact CE2-CD1 3.3Å; F254-W258 HydrophobicContact CE2-CD2 4.43Å; F254-W258 AromaticContact CE2-CE2 3.93Å; F254-W258 HydrophobicContact CE2-CG 4.1Å; F254-W258 AromaticContact CE2-NE1 3.19Å; F254-W258 AromaticContact CG-CD1 3.75Å; F254-W258 HydrophobicContact CZ-CB 4.42Å; F254-W258 AromaticContact CZ-CD1 3.41Å; F254-W258 VanDerWaalsContact CZ-CD1 3.41Å; F254-W258 HydrophobicContact CZ-CD2 4.22Å; F254-W258 AromaticContact CZ-CG 3.78Å; F254-W258 HydrophobicContact CZ-CG 3.78Å; F254-W258 AromaticContact CZ-NE1 3.68Å; F254-W258 PolarHBondContact O-N 3.22Å; W258-L261 HydrophobicContact CE3-CD2 4.03Å; W258-L261 HydrophobicContact CZ3-CD2 3.98Å; W258-L261 PolarHBondContact O-N 3.25Å; W258-H262 PolarHBondContact O-CD2 2.96Å; W258-H262 VanDerWaalsContact O-CD2 3.29Å; W258-H262 PolarHBondContact O-N 3.49Å; W258-A292 HydrophobicContact CD2-CB 4.06Å; W258-A292 HydrophobicContact CE3-CB 3.83Å; W258-A292 HydrophobicContact CH2-CB 4.16Å; W258-A292 HydrophobicContact CZ2-CB 4.4Å; W258-A292 HydrophobicContact CZ3-CB 3.88Å |
| 259 | L | 95.5 | Very high | 91.2 | Very high | 61 Ų | 61 | 36.4 Ų | 36.4 | 32% | 0.319 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -58.2 | -45.6 | -178.8 | 177 | 62 | 0 | 0 | 0 | 113.4 | F211 F255 L261 H262 I263 | F211-L259 HydrophobicContact CE1-CD1 4.06Å; F211-L259 HydrophobicContact CE2-CB 3.71Å; F211-L259 HydrophobicContact CE2-CD1 4.18Å; F211-L259 HydrophobicContact CZ-CB 3.7Å; F211-L259 HydrophobicContact CZ-CD1 3.64Å; F211-L259 HydrophobicContact CZ-CD2 4.47Å; F211-L259 HydrophobicContact CZ-CG 4.13Å; F255-L259 WeakPolarHBondContact O-CB 3.44Å; F255-L259 PolarHBondContact O-N 3.26Å; L259-L261 PolarHBondContact O-N 2.94Å; L259-H262 PolarHBondContact O-N 2.93Å; L259-I263 HydrophobicContact CD1-CD1 3.94Å; L259-I263 HydrophobicContact CD1-CG1 4.04Å; L259-I263 HydrophobicContact CD2-CD1 4.43Å; L259-I263 HydrophobicContact CG-CD1 3.8Å; L259-I263 HydrophobicContact CG-CG1 4.34Å; L259-I263 WeakPolarHBondContact O-CG1 3.32Å; L259-I263 PolarHBondContact O-N 2.65Å |
| 260 | P | 95.8 | Very high | 91.1 | Very high | 44 Ų | 44 | 37.4 Ų | 37.4 | 29% | 0.286 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -59.4 | -36.6 | -179.9 | -28.9 | 40.5 | 0 | 0 | 0 | 112.5 | L256 I263 M264 A288 L291 | L256-P260 WeakPolarHBondContact O-CD 3.3Å; P260-I263 PolarHBondContact O-N 2.95Å; P260-M264 VanDerWaalsContact O-CG 3.31Å; P260-M264 WeakPolarHBondContact O-CG 3.26Å; P260-M264 PolarHBondContact O-N 3.16Å; P260-A288 HydrophobicContact CB-CB 4.01Å; P260-L291 HydrophobicContact CG-CD2 3.74Å |
| 261 | L | 94.7 | Very high | 91.1 | Very high | 3 Ų | 3 | 38.7 Ų | 38.7 | 2% | 0.016 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -65.3 | -45.1 | 177.7 | -177.1 | 66.7 | 0 | 0 | 0 | 111.6 | F119 W258 L259 I263 M264 D265 A288 V289 A292 | F119-L261 HydrophobicContact CE1-CD2 3.7Å; F119-L261 HydrophobicContact CZ-CD2 3.61Å; W258-L261 HydrophobicContact CE3-CD2 4.03Å; W258-L261 HydrophobicContact CZ3-CD2 3.98Å; W258-L261 PolarHBondContact O-N 3.25Å; L259-L261 PolarHBondContact O-N 2.94Å; L261-I263 VanDerWaalsContact C-N 3.3Å; L261-I263 PolarHBondContact O-N 3.23Å; L261-M264 PolarHBondContact O-N 3.07Å; L261-D265 PolarHBondContact O-N 2.98Å; L261-A288 HydrophobicContact CB-CB 4.28Å; L261-A288 HydrophobicContact CD1-CB 4.37Å; L261-V289 HydrophobicContact CD1-CG2 3.7Å; L261-A292 HydrophobicContact CD2-CB 4.13Å |
| 262 | H | 94.9 | Very high | 90.5 | Very high | 2 Ų | 2 | 42.6 Ų | 42.6 | 1% | 0.009 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -62.7 | -38 | 175.9 | -70 | -52.3 | 0 | 0 | 0 | 112.7 | F207 F211 W258 L259 D265 F266 | F207-H262 HydrophobicContact CD2-CB 3.67Å; F207-H262 AromaticContact CD2-CG 3.74Å; F207-H262 HydrophobicContact CE2-CB 3.97Å; F211-H262 AromaticContact CD2-CD2 3.35Å; F211-H262 WeakPolarHBondContact CD2-CD2 3.37Å; F211-H262 AromaticContact CD2-NE2 3.76Å; F211-H262 AromaticContact CG-CD2 3.85Å; W258-H262 PolarHBondContact O-CD2 2.96Å; W258-H262 VanDerWaalsContact O-CD2 3.29Å; W258-H262 PolarHBondContact O-N 3.49Å; L259-H262 PolarHBondContact O-N 2.93Å; H262-D265 IonicContact ND1-OD2 3.89Å; H262-D265 WeakPolarHBondContact O-CB 3.31Å; H262-D265 PolarHBondContact O-N 3.36Å; H262-F266 WeakPolarHBondContact O-CD2 3.28Å; H262-F266 PolarHBondContact O-N 3.21Å |
| 263 | I | 94.7 | Very high | 89.4 | Confident | 84 Ų | 84 | 45.2 Ų | 45.2 | 43% | 0.431 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -62.9 | -46.3 | 174.3 | -67.6 | 169.2 | 0 | 0 | 0 | 110 | L259 P260 L261 D265 F266 I267 | L259-I263 HydrophobicContact CD1-CD1 3.94Å; L259-I263 HydrophobicContact CD1-CG1 4.04Å; L259-I263 HydrophobicContact CD2-CD1 4.43Å; L259-I263 HydrophobicContact CG-CD1 3.8Å; L259-I263 HydrophobicContact CG-CG1 4.34Å; L259-I263 WeakPolarHBondContact O-CG1 3.32Å; L259-I263 PolarHBondContact O-N 2.65Å; P260-I263 PolarHBondContact O-N 2.95Å; L261-I263 VanDerWaalsContact C-N 3.3Å; L261-I263 PolarHBondContact O-N 3.23Å; I263-D265 VanDerWaalsContact C-N 3.3Å; I263-D265 PolarHBondContact O-N 2.9Å; I263-F266 PolarHBondContact O-N 3.05Å; I263-F266 VanDerWaalsContact O-N 3.16Å; I263-I267 HydrophobicContact CG2-CD1 3.74Å; I263-I267 HydrophobicContact CG2-CG1 4.33Å; I263-I267 WeakPolarHBondContact O-CG1 3.48Å; I263-I267 PolarHBondContact O-N 2.8Å |
| 264 | M | 92.7 | Very high | 87.9 | Confident | 16 Ų | 16 | 53.1 Ų | 53.1 | 8% | 0.079 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -60.8 | -38.8 | 177.7 | -72 | -52.5 | -56.9 | 0 | 0 | 112.3 | P260 L261 F266 I267 E268 I281 A284 Q285 A288 | P260-M264 VanDerWaalsContact O-CG 3.31Å; P260-M264 WeakPolarHBondContact O-CG 3.26Å; P260-M264 PolarHBondContact O-N 3.16Å; L261-M264 PolarHBondContact O-N 3.07Å; M264-F266 VanDerWaalsContact C-N 3.31Å; M264-F266 PolarHBondContact O-N 2.91Å; M264-I267 PolarHBondContact O-N 3.33Å; M264-I267 HydrophobicContact SD-CD1 4.01Å; M264-E268 WeakPolarHBondContact O-CB 3.47Å; M264-E268 PolarHBondContact O-N 3.43Å; M264-I281 HydrophobicContact CE-CG2 3.93Å; M264-I281 WeakPolarHBondContact CE-O 2.96Å; M264-A284 HydrophobicContact CE-CB 3.7Å; M264-A284 HydrophobicContact SD-CB 3.55Å; M264-A284 VanDerWaalsContact SD-CB 3.55Å; M264-Q285 HydrophobicContact CE-CB 4.16Å; M264-A288 HydrophobicContact CG-CB 3.91Å |
| 265 | D | 91.2 | Very high | 86.5 | Confident | 9 Ų | 9 | 56 Ų | 56 | 5% | 0.048 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -58.4 | -41.7 | 175.1 | -64.2 | -41.6 | 0 | 0 | 0 | 112.1 | V203 R206 L261 H262 I263 L269 | V203-D265 HydrophobicContact CG1-CB 3.81Å; R206-D265 IonicContact CZ-OD1 3.54Å; R206-D265 IonicContact CZ-OD2 2.74Å; R206-D265 VanDerWaalsContact CZ-OD2 3.24Å; R206-D265 IonicContact NE-OD2 3.5Å; R206-D265 PolarHBondContact NE-OD2 3.4Å; R206-D265 IonicContact NH2-OD1 3.51Å; R206-D265 PolarHBondContact NH2-OD1 2.99Å; R206-D265 IonicContact NH2-OD2 3.56Å; R206-D265 PolarHBondContact NH2-OD2 3.06Å; L261-D265 PolarHBondContact O-N 2.98Å; H262-D265 IonicContact ND1-OD2 3.89Å; H262-D265 WeakPolarHBondContact O-CB 3.31Å; H262-D265 PolarHBondContact O-N 3.36Å; I263-D265 VanDerWaalsContact C-N 3.3Å; I263-D265 PolarHBondContact O-N 2.9Å; D265-L269 WeakPolarHBondContact O-CG 3.27Å; D265-L269 PolarHBondContact O-N 3.49Å; D265-L269 VanDerWaalsContact O-N 3.12Å |
| 266 | F | 92.9 | Very high | 84.8 | Confident | 55 Ų | 55 | 58 Ų | 58 | 24% | 0.241 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -73.6 | -35.5 | 176.8 | -78.5 | -71.7 | 0 | 0 | 0 | 112.8 | W200 V203 F207 H262 I263 M264 E268 L269 A270 | W200-F266 HydrophobicContact CZ3-CD1 4.28Å; W200-F266 HydrophobicContact CZ3-CE1 4.43Å; V203-F266 HydrophobicContact CG1-CD1 4.24Å; V203-F266 HydrophobicContact CG1-CD2 4.49Å; V203-F266 HydrophobicContact CG1-CE1 4.07Å; V203-F266 HydrophobicContact CG1-CE2 4.32Å; V203-F266 HydrophobicContact CG1-CG 4.44Å; V203-F266 HydrophobicContact CG1-CZ 4.11Å; F207-F266 HydrophobicContact CB-CE2 3.74Å; F207-F266 HydrophobicContact CB-CZ 3.96Å; F207-F266 AromaticContact CD1-CE2 3.75Å; F207-F266 HydrophobicContact CD1-CE2 3.75Å; F207-F266 HydrophobicContact CD1-CZ 4.02Å; F207-F266 HydrophobicContact CD2-CE2 4.21Å; F207-F266 HydrophobicContact CE1-CE2 4.36Å; F207-F266 AromaticContact CG-CE2 3.65Å; F207-F266 HydrophobicContact CG-CE2 3.65Å; F207-F266 HydrophobicContact CG-CZ 4.15Å; H262-F266 WeakPolarHBondContact O-CD2 3.28Å; H262-F266 PolarHBondContact O-N 3.21Å; I263-F266 PolarHBondContact O-N 3.05Å; I263-F266 VanDerWaalsContact O-N 3.16Å; M264-F266 VanDerWaalsContact C-N 3.31Å; M264-F266 PolarHBondContact O-N 2.91Å; F266-E268 VanDerWaalsContact C-N 3.31Å; F266-L269 HydrophobicContact CD1-CD1 4.32Å; F266-L269 PolarHBondContact O-N 2.87Å; F266-A270 WeakPolarHBondContact O-CB 3.31Å; F266-A270 PolarHBondContact O-N 2.86Å |
| 267 | I | 90.5 | Very high | 83.3 | Confident | 64 Ų | 64 | 58.5 Ų | 58.5 | 33% | 0.328 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -62.3 | -43.6 | 173.4 | -69.3 | 170.8 | 0 | 0 | 0 | 109.8 | I263 M264 L269 A270 T271 | I263-I267 HydrophobicContact CG2-CD1 3.74Å; I263-I267 HydrophobicContact CG2-CG1 4.33Å; I263-I267 WeakPolarHBondContact O-CG1 3.48Å; I263-I267 PolarHBondContact O-N 2.8Å; M264-I267 PolarHBondContact O-N 3.33Å; M264-I267 HydrophobicContact SD-CD1 4.01Å; I267-L269 VanDerWaalsContact C-N 3.32Å; I267-L269 PolarHBondContact O-N 3.23Å; I267-A270 PolarHBondContact O-N 2.76Å; I267-T271 VanDerWaalsContact O-CB 3.26Å; I267-T271 WeakPolarHBondContact O-CB 3.38Å; I267-T271 PolarHBondContact O-N 2.82Å; I267-T271 PolarHBondContact O-OG1 3.32Å |
| 268 | E | 84.8 | Confident | 82.4 | Confident | 70 Ų | 70 | 60 Ų | 60 | 33% | 0.327 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -59.5 | -41.7 | 175.5 | 172.7 | 165.7 | -173.8 | 0 | 0 | 111.6 | M264 F266 F276 Q285 | M264-E268 WeakPolarHBondContact O-CB 3.47Å; M264-E268 PolarHBondContact O-N 3.43Å; F266-E268 VanDerWaalsContact C-N 3.31Å; E268-F276 HydrophobicContact CB-CE2 4.22Å; E268-F276 HydrophobicContact CG-CD2 4.24Å; E268-F276 HydrophobicContact CG-CE2 3.5Å; E268-F276 HydrophobicContact CG-CZ 4.24Å; E268-F276 WeakPolarHBondContact OE1-CZ 3.42Å; E268-Q285 PolarHBondContact OE2-NE2 3.29Å |
| 269 | L | 85.7 | Confident | 81.4 | Confident | 38 Ų | 38 | 64.4 Ų | 64.4 | 20% | 0.199 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -66.2 | -36.9 | 174.3 | -72.5 | -178.6 | 0 | 0 | 0 | 114.3 | W200 V203 D265 F266 I267 | W200-L269 HydrophobicContact CD2-CD1 4.19Å; W200-L269 HydrophobicContact CE3-CD1 4.22Å; W200-L269 HydrophobicContact CZ2-CB 4.36Å; V203-L269 HydrophobicContact CB-CD1 3.5Å; V203-L269 HydrophobicContact CB-CG 4.44Å; V203-L269 HydrophobicContact CG1-CD1 3.68Å; V203-L269 HydrophobicContact CG2-CD1 3.65Å; V203-L269 HydrophobicContact CG2-CD2 4.22Å; V203-L269 HydrophobicContact CG2-CG 4.09Å; D265-L269 WeakPolarHBondContact O-CG 3.27Å; D265-L269 PolarHBondContact O-N 3.49Å; D265-L269 VanDerWaalsContact O-N 3.12Å; F266-L269 HydrophobicContact CD1-CD1 4.32Å; F266-L269 PolarHBondContact O-N 2.87Å; I267-L269 VanDerWaalsContact C-N 3.32Å; I267-L269 PolarHBondContact O-N 3.23Å |
| 270 | A | 86.1 | Confident | 80.7 | Confident | 70 Ų | 70 | 71.4 Ų | 71.4 | 58% | 0.579 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -84.5 | -17.1 | -175.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | F266 I267 | F266-A270 WeakPolarHBondContact O-CB 3.31Å; F266-A270 PolarHBondContact O-N 2.86Å; I267-A270 PolarHBondContact O-N 2.76Å |
| 271 | T | 82.4 | Confident | 80.1 | Confident | 31 Ų | 31 | 70.7 Ų | 70.7 | 19% | 0.19 | 37% | 0.37 | C | S | . | . | S | Bend | trans | -88.8 | 126 | -175.5 | -58.6 | 0 | 0 | 0 | 0 | 110.7 | I267 I281 | I267-T271 VanDerWaalsContact O-CB 3.26Å; I267-T271 WeakPolarHBondContact O-CB 3.38Å; I267-T271 PolarHBondContact O-N 2.82Å; I267-T271 PolarHBondContact O-OG1 3.32Å; T271-I281 HydrophobicContact CG2-CD1 3.95Å |
| 272 | P | 73.6 | Confident | 79.5 | Confident | 92 Ų | 92 | 73 Ų | 73 | 60% | 0.597 | 38% | 0.379 | S | S | * | . | trans | -59.7 | 146.7 | 173 | -22 | 32.5 | 0 | 0 | 0 | 112.1 | H274 S275 F276 | P272-H274 PolarHBondContact O-N 2.87Å; P272-S275 PolarHBondContact O-N 2.61Å; P272-F276 PolarHBondContact O-N 3.34Å | ||
| 273 | L | 64.3 | Low | 78.8 | Confident | 149 Ų | 149 | 75.7 Ų | 75.7 | 78% | 0.78 | 39% | 0.393 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -49 | -32.6 | -176.1 | -75.4 | 159.3 | 0 | 0 | 0 | 114.6 | S275 F276 | L273-S275 VanDerWaalsContact C-N 3.34Å; L273-S275 PolarHBondContact O-N 2.89Å; L273-F276 WeakPolarHBondContact O-CB 3.33Å; L273-F276 PolarHBondContact O-N 2.87Å |
| 274 | H | 58.9 | Low | 78.4 | Confident | 187 Ų | 187 | 73.4 Ų | 73.4 | 87% | 0.866 | 39% | 0.387 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.2 | -22.3 | -179.5 | -161.4 | -59.7 | 0 | 0 | 0 | 113.7 | P272 | P272-H274 PolarHBondContact O-N 2.87Š|
| 275 | S | 61.7 | Low | 78.2 | Confident | 62 Ų | 62 | 74.9 Ų | 74.9 | 43% | 0.434 | 39% | 0.393 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -97.4 | -8.6 | 178.5 | -62.3 | 0 | 0 | 0 | 0 | 112.8 | P272 L273 H277 S278 | P272-S275 PolarHBondContact O-N 2.61Å; L273-S275 VanDerWaalsContact C-N 3.34Å; L273-S275 PolarHBondContact O-N 2.89Å; S275-H277 VanDerWaalsContact C-N 3.31Å; S275-H277 PolarHBondContact O-N 3.13Å; S275-S278 WeakPolarHBondContact O-CB 3.46Å; S275-S278 PolarHBondContact O-N 3.25Å; S275-S278 VanDerWaalsContact O-N 3.15Å; S275-S278 PolarHBondContact O-OG 3.14Å |
| 276 | F | 57.3 | Low | 77.9 | Confident | 53 Ų | 53 | 75.2 Ų | 75.2 | 23% | 0.232 | 40% | 0.396 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -65.1 | -31.8 | -176.5 | -175.3 | -114.9 | 0 | 0 | 0 | 113.1 | E268 P272 L273 S278 | E268-F276 HydrophobicContact CB-CE2 4.22Å; E268-F276 HydrophobicContact CG-CD2 4.24Å; E268-F276 HydrophobicContact CG-CE2 3.5Å; E268-F276 HydrophobicContact CG-CZ 4.24Å; E268-F276 WeakPolarHBondContact OE1-CZ 3.42Å; P272-F276 PolarHBondContact O-N 3.34Å; L273-F276 WeakPolarHBondContact O-CB 3.33Å; L273-F276 PolarHBondContact O-N 2.87Å; F276-S278 PolarHBondContact O-N 3.11Å |
| 277 | H | 61.7 | Low | 77.6 | Confident | 130 Ų | 130 | 75.8 Ų | 75.8 | 60% | 0.602 | 40% | 0.401 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.6 | 14.1 | 177.4 | -68.4 | 8.7 | 0 | 0 | 0 | 113.2 | S275 P279 | S275-H277 VanDerWaalsContact C-N 3.31Å; S275-H277 PolarHBondContact O-N 3.13Å; H277-P279 WeakPolarHBondContact O-CD 3.25Å |
| 278 | S | 75.6 | Confident | 77.7 | Confident | 39 Ų | 39 | 73 Ų | 73 | 27% | 0.273 | 39% | 0.387 | S | S | . | . | trans | -62.2 | 129.4 | 171.8 | 73.4 | 0 | 0 | 0 | 0 | 109.2 | S275 F276 R280 I281 Y282 | S275-S278 WeakPolarHBondContact O-CB 3.46Å; S275-S278 PolarHBondContact O-N 3.25Å; S275-S278 VanDerWaalsContact O-N 3.15Å; S275-S278 PolarHBondContact O-OG 3.14Å; F276-S278 PolarHBondContact O-N 3.11Å; S278-R280 PolarHBondContact O-N 3.42Å; S278-I281 PolarHBondContact O-N 3.06Å; S278-I281 WeakPolarHBondContact OG-CD1 3.49Å; S278-I281 VanDerWaalsContact OG-CG1 3.26Å; S278-I281 WeakPolarHBondContact OG-CG1 3.47Å; S278-Y282 PolarHBondContact O-N 3.37Å | ||
| 279 | P | 75.4 | Confident | 78 | Confident | 94 Ų | 94 | 70.9 Ų | 70.9 | 61% | 0.61 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -54.6 | -27.6 | -178 | -29.5 | 34.9 | 0 | 0 | 0 | 113.5 | H277 L283 | H277-P279 WeakPolarHBondContact O-CD 3.25Å; P279-L283 WeakPolarHBondContact O-CB 3.42Å; P279-L283 PolarHBondContact O-N 3.06Å |
| 280 | R | 80.6 | Confident | 78.2 | Confident | 207 Ų | 207 | 69.4 Ų | 69.4 | 78% | 0.781 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -70.6 | -41.6 | 179.5 | -62.4 | -178.4 | -176.2 | 179.3 | 1.4 | 113.4 | S278 A284 | S278-R280 PolarHBondContact O-N 3.42Å; R280-A284 WeakPolarHBondContact O-CB 3.4Å; R280-A284 PolarHBondContact O-N 2.95Å |
| 281 | I | 83.3 | Confident | 78.5 | Confident | 29 Ų | 29 | 69.2 Ų | 69.2 | 15% | 0.149 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -70.6 | -44.8 | 179.8 | -69.6 | 175.6 | 0 | 0 | 0 | 109.7 | M264 T271 S278 L283 A284 Q285 | M264-I281 HydrophobicContact CE-CG2 3.93Å; M264-I281 WeakPolarHBondContact CE-O 2.96Å; T271-I281 HydrophobicContact CG2-CD1 3.95Å; S278-I281 PolarHBondContact O-N 3.06Å; S278-I281 WeakPolarHBondContact OG-CD1 3.49Å; S278-I281 VanDerWaalsContact OG-CG1 3.26Å; S278-I281 WeakPolarHBondContact OG-CG1 3.47Å; I281-L283 PolarHBondContact O-N 2.76Å; I281-A284 PolarHBondContact O-N 3.24Å; I281-Q285 WeakPolarHBondContact O-CB 3.22Å; I281-Q285 PolarHBondContact O-N 3.24Å |
| 282 | Y | 81.5 | Confident | 79.1 | Confident | 53 Ų | 53 | 67.7 Ų | 67.7 | 21% | 0.208 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -56.4 | -50.7 | 174.2 | 178 | -96.8 | 0 | 0 | 0 | 111.5 | D103 S278 A284 Q285 V286 | D103-Y282 VanDerWaalsContact CG-OH 3.25Å; D103-Y282 PolarHBondContact OD1-OH 3.47Å; D103-Y282 WeakPolarHBondContact OD2-CE2 3.48Å; D103-Y282 VanDerWaalsContact OD2-CZ 3.28Å; D103-Y282 PolarHBondContact OD2-OH 3.25Å; S278-Y282 PolarHBondContact O-N 3.37Å; Y282-A284 PolarHBondContact O-N 3.48Å; Y282-Q285 WeakPolarHBondContact O-CB 3.31Å; Y282-Q285 PolarHBondContact O-N 2.94Å; Y282-Q285 VanDerWaalsContact O-N 3.15Å; Y282-V286 HydrophobicContact CD1-CG2 4.27Å; Y282-V286 HydrophobicContact CE1-CG2 3.88Å; Y282-V286 HydrophobicContact CE2-CG2 4.31Å; Y282-V286 WeakPolarHBondContact O-CG2 3.49Å; Y282-V286 PolarHBondContact O-N 3.22Å |
| 283 | L | 80.1 | Confident | 80 | Confident | 57 Ų | 57 | 63.3 Ų | 63.3 | 30% | 0.298 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -51.4 | -51 | 173.4 | 154.8 | 64.2 | 0 | 0 | 0 | 112.2 | I39 P279 I281 Q285 V286 L287 | I39-L283 HydrophobicContact CB-CD1 4.37Å; I39-L283 HydrophobicContact CD1-CD1 3.04Å; I39-L283 HydrophobicContact CD1-CG 4.46Å; I39-L283 HydrophobicContact CG1-CB 4.47Å; I39-L283 HydrophobicContact CG1-CD1 3.23Å; I39-L283 HydrophobicContact CG1-CG 4.35Å; P279-L283 WeakPolarHBondContact O-CB 3.42Å; P279-L283 PolarHBondContact O-N 3.06Å; I281-L283 PolarHBondContact O-N 2.76Å; L283-Q285 VanDerWaalsContact C-N 3.29Å; L283-Q285 PolarHBondContact O-N 3.38Å; L283-V286 PolarHBondContact O-N 3.29Å; L283-L287 HydrophobicContact CD1-CD1 3.6Å; L283-L287 HydrophobicContact CD1-CG 3.94Å; L283-L287 HydrophobicContact CG-CD1 4.45Å; L283-L287 WeakPolarHBondContact O-CG 3.38Å; L283-L287 PolarHBondContact O-N 3.35Å |
| 284 | A | 87.1 | Confident | 81.3 | Confident | 36 Ų | 36 | 59.7 Ų | 59.7 | 30% | 0.298 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -64.6 | -35.8 | -178.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | M264 R280 I281 Y282 A288 | M264-A284 HydrophobicContact CE-CB 3.7Å; M264-A284 HydrophobicContact SD-CB 3.55Å; M264-A284 VanDerWaalsContact SD-CB 3.55Å; R280-A284 WeakPolarHBondContact O-CB 3.4Å; R280-A284 PolarHBondContact O-N 2.95Å; I281-A284 PolarHBondContact O-N 3.24Å; Y282-A284 PolarHBondContact O-N 3.48Å; A284-A288 WeakPolarHBondContact O-CB 3.43Å; A284-A288 PolarHBondContact O-N 3.46Å |
| 285 | Q | 87.3 | Confident | 82.9 | Confident | 47 Ų | 47 | 50.9 Ų | 50.9 | 22% | 0.22 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -66.2 | -47.6 | 176 | -173.1 | 167.9 | 19.2 | 0 | 0 | 111.5 | M264 E268 I281 Y282 L283 L287 A288 V289 | M264-Q285 HydrophobicContact CE-CB 4.16Å; E268-Q285 PolarHBondContact OE2-NE2 3.29Å; I281-Q285 WeakPolarHBondContact O-CB 3.22Å; I281-Q285 PolarHBondContact O-N 3.24Å; Y282-Q285 WeakPolarHBondContact O-CB 3.31Å; Y282-Q285 PolarHBondContact O-N 2.94Å; Y282-Q285 VanDerWaalsContact O-N 3.15Å; L283-Q285 VanDerWaalsContact C-N 3.29Å; L283-Q285 PolarHBondContact O-N 3.38Å; Q285-L287 PolarHBondContact O-N 3.36Å; Q285-A288 PolarHBondContact O-N 2.9Å; Q285-V289 WeakPolarHBondContact O-CG2 3.43Å; Q285-V289 PolarHBondContact O-N 2.88Å |
| 286 | V | 84.9 | Confident | 84.2 | Confident | 16 Ų | 16 | 48 Ų | 48 | 10% | 0.097 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -59.7 | -47.6 | 177.6 | 176.7 | 0 | 0 | 0 | 0 | 110.6 | S43 L99 Y282 L283 A288 V289 C290 | S43-V286 VanDerWaalsContact CB-CG1 3.45Å; S43-V286 WeakPolarHBondContact OG-CG1 3.37Å; L99-V286 HydrophobicContact CD1-CG1 4.26Å; L99-V286 HydrophobicContact CD1-CG2 4.38Å; L99-V286 HydrophobicContact CD2-CG1 4.38Å; Y282-V286 HydrophobicContact CD1-CG2 4.27Å; Y282-V286 HydrophobicContact CE1-CG2 3.88Å; Y282-V286 HydrophobicContact CE2-CG2 4.31Å; Y282-V286 WeakPolarHBondContact O-CG2 3.49Å; Y282-V286 PolarHBondContact O-N 3.22Å; L283-V286 PolarHBondContact O-N 3.29Å; V286-A288 PolarHBondContact O-N 2.9Å; V286-V289 PolarHBondContact O-N 2.97Å; V286-C290 PolarHBondContact O-N 3.41Å; V286-C290 PolarHBondContact O-SG 2.92Å |
| 287 | L | 86.6 | Confident | 85.7 | Confident | 68 Ų | 68 | 45.7 Ų | 45.7 | 36% | 0.356 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -63 | -39 | 177.4 | -71.8 | -178.3 | 0 | 0 | 0 | 112.9 | I39 L46 L283 Q285 V289 C290 L291 | I39-L287 HydrophobicContact CD1-CD2 4.36Å; L46-L287 HydrophobicContact CD1-CD2 4.28Å; L283-L287 HydrophobicContact CD1-CD1 3.6Å; L283-L287 HydrophobicContact CD1-CG 3.94Å; L283-L287 HydrophobicContact CG-CD1 4.45Å; L283-L287 WeakPolarHBondContact O-CG 3.38Å; L283-L287 PolarHBondContact O-N 3.35Å; Q285-L287 PolarHBondContact O-N 3.36Å; L287-V289 VanDerWaalsContact C-N 3.33Å; L287-C290 WeakPolarHBondContact O-CB 3.44Å; L287-C290 PolarHBondContact O-N 3.15Å; L287-L291 PolarHBondContact O-N 2.91Å |
| 288 | A | 93 | Very high | 86.9 | Confident | 4 Ų | 4 | 41 Ų | 41 | 3% | 0.033 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -63.8 | -40 | 176 | 0 | 0 | 0 | 0 | 0 | 111.7 | P260 L261 M264 A284 Q285 V286 L291 A292 | P260-A288 HydrophobicContact CB-CB 4.01Å; L261-A288 HydrophobicContact CB-CB 4.28Å; L261-A288 HydrophobicContact CD1-CB 4.37Å; M264-A288 HydrophobicContact CG-CB 3.91Å; A284-A288 WeakPolarHBondContact O-CB 3.43Å; A284-A288 PolarHBondContact O-N 3.46Å; Q285-A288 PolarHBondContact O-N 2.9Å; V286-A288 PolarHBondContact O-N 2.9Å; A288-L291 PolarHBondContact O-N 2.9Å; A288-A292 PolarHBondContact O-N 3.4Å |
| 289 | V | 91 | Very high | 87.2 | Confident | 26 Ų | 26 | 39.3 Ų | 39.3 | 16% | 0.158 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -65.4 | -43.8 | 173.1 | 176 | 0 | 0 | 0 | 0 | 110.8 | Y47 F119 L261 Q285 V286 L287 L291 A292 Y293 | Y47-V289 VanDerWaalsContact OH-CG1 3.28Å; Y47-V289 WeakPolarHBondContact OH-CG1 3.48Å; F119-V289 HydrophobicContact CZ-CG1 4.48Å; L261-V289 HydrophobicContact CD1-CG2 3.7Å; Q285-V289 WeakPolarHBondContact O-CG2 3.43Å; Q285-V289 PolarHBondContact O-N 2.88Å; V286-V289 PolarHBondContact O-N 2.97Å; L287-V289 VanDerWaalsContact C-N 3.33Å; V289-L291 VanDerWaalsContact C-N 3.3Å; V289-L291 PolarHBondContact O-N 3.32Å; V289-A292 PolarHBondContact O-N 2.81Å; V289-Y293 HydrophobicContact CG1-CD2 3.68Å; V289-Y293 HydrophobicContact CG1-CE2 3.63Å; V289-Y293 VanDerWaalsContact O-CD2 3.31Å; V289-Y293 WeakPolarHBondContact O-CD2 3.24Å; V289-Y293 PolarHBondContact O-N 3.01Å |
| 290 | C | 89.9 | Confident | 87.4 | Confident | 7 Ų | 7 | 35.4 Ų | 35.4 | 5% | 0.047 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -53.7 | -47.1 | 172.2 | -64.3 | 0 | 0 | 0 | 0 | 112.2 | L46 Y47 V286 L287 A292 Y293 F294 | L46-C290 HydrophobicContact CB-CB 4.48Å; L46-C290 HydrophobicContact CD1-CB 4.31Å; Y47-C290 HydrophobicContact CD1-CB 4.27Å; Y47-C290 VanDerWaalsContact CD1-SG 3.56Å; Y47-C290 HydrophobicContact CE1-CB 3.9Å; Y47-C290 WeakPolarHBondContact CE1-SG 3.16Å; V286-C290 PolarHBondContact O-N 3.41Å; V286-C290 PolarHBondContact O-SG 2.92Å; L287-C290 WeakPolarHBondContact O-CB 3.44Å; L287-C290 PolarHBondContact O-N 3.15Å; C290-A292 PolarHBondContact O-N 2.77Å; C290-Y293 PolarHBondContact O-N 3.14Å; C290-F294 WeakPolarHBondContact O-CB 3.14Å; C290-F294 PolarHBondContact O-N 3.31Å |
| 291 | L | 92.7 | Very high | 87.1 | Confident | 66 Ų | 66 | 29.7 Ų | 29.7 | 35% | 0.346 | 16% | 0.157 | S | C | . | . | H | α-helix | trans | -67.4 | -37.6 | -178.6 | -164 | 72.2 | 0 | 0 | 0 | 112.2 | L256 C257 P260 L287 A288 V289 F294 N295 | L256-L291 WeakPolarHBondContact O-CD2 3.45Å; C257-L291 HydrophobicContact CB-CG 4.36Å; C257-L291 VanDerWaalsContact CB-O 3.25Å; C257-L291 WeakPolarHBondContact CB-O 3.34Å; C257-L291 PolarHBondContact SG-O 3.19Å; C257-L291 VanDerWaalsContact SG-O 3.35Å; P260-L291 HydrophobicContact CG-CD2 3.74Å; L287-L291 PolarHBondContact O-N 2.91Å; A288-L291 PolarHBondContact O-N 2.9Å; V289-L291 VanDerWaalsContact C-N 3.3Å; V289-L291 PolarHBondContact O-N 3.32Å; L291-F294 WeakPolarHBondContact O-CB 3.15Å; L291-F294 PolarHBondContact O-N 3.37Å; L291-N295 PolarHBondContact O-N 3.46Å |
| 292 | A | 94.1 | Very high | 86.8 | Confident | 0 Ų | 0 | 29 Ų | 29 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -60.5 | -47 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | F119 C257 W258 L261 A288 V289 C290 F294 N295 | F119-A292 HydrophobicContact CE2-CB 4.48Å; F119-A292 HydrophobicContact CZ-CB 4.2Å; C257-A292 PolarHBondContact O-N 3.44Å; W258-A292 HydrophobicContact CD2-CB 4.06Å; W258-A292 HydrophobicContact CE3-CB 3.83Å; W258-A292 HydrophobicContact CH2-CB 4.16Å; W258-A292 HydrophobicContact CZ2-CB 4.4Å; W258-A292 HydrophobicContact CZ3-CB 3.88Å; L261-A292 HydrophobicContact CD2-CB 4.13Å; A288-A292 PolarHBondContact O-N 3.4Å; V289-A292 PolarHBondContact O-N 2.81Å; C290-A292 PolarHBondContact O-N 2.77Å; A292-F294 VanDerWaalsContact C-N 3.33Å; A292-F294 PolarHBondContact O-N 3.4Å; A292-N295 WeakPolarHBondContact O-CB 3.33Å; A292-N295 PolarHBondContact O-N 3.22Å |
| 293 | Y | 92.2 | Very high | 86.2 | Confident | 0 Ų | 0 | 27.1 Ų | 27.1 | 0% | 0 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -64.7 | -35.5 | 175.2 | -86.5 | -70 | 0 | 0 | 0 | 113.3 | Y47 C88 L92 L95 F119 V289 C290 N295 S296 | Y47-Y293 HydrophobicContact CE1-CD2 4.31Å; C88-Y293 WeakPolarHBondContact O-CE1 3.33Å; C88-Y293 WeakPolarHBondContact SG-CD1 3.48Å; C88-Y293 WeakPolarHBondContact SG-CE1 3.35Å; L92-Y293 HydrophobicContact CB-CE1 4.47Å; L92-Y293 HydrophobicContact CD1-CD1 3.54Å; L92-Y293 HydrophobicContact CD1-CD2 4.27Å; L92-Y293 HydrophobicContact CD1-CE1 4.21Å; L92-Y293 HydrophobicContact CD1-CG 3.59Å; L92-Y293 HydrophobicContact CG-CD1 4.01Å; L92-Y293 HydrophobicContact CG-CD2 4.42Å; L92-Y293 HydrophobicContact CG-CE1 4.2Å; L92-Y293 HydrophobicContact CG-CG 4.14Å; L95-Y293 HydrophobicContact CD1-CE2 3.58Å; L95-Y293 WeakPolarHBondContact CD1-OH 3.44Å; F119-Y293 HydrophobicContact CD2-CD2 4.46Å; F119-Y293 AromaticContact CD2-CE1 3.99Å; F119-Y293 HydrophobicContact CD2-CE1 3.99Å; F119-Y293 AromaticContact CD2-CE2 3.63Å; F119-Y293 HydrophobicContact CD2-CE2 3.63Å; F119-Y293 AromaticContact CD2-CZ 3.34Å; F119-Y293 WeakPolarHBondContact CD2-OH 2.99Å; F119-Y293 AromaticContact CE2-CD2 3.92Å; F119-Y293 HydrophobicContact CE2-CD2 3.92Å; F119-Y293 HydrophobicContact CE2-CE1 4.27Å; F119-Y293 AromaticContact CE2-CE2 3.45Å; F119-Y293 HydrophobicContact CE2-CE2 3.45Å; F119-Y293 VanDerWaalsContact CE2-CE2 3.45Å; F119-Y293 HydrophobicContact CE2-CG 4.49Å; F119-Y293 AromaticContact CE2-CZ 3.66Å; F119-Y293 HydrophobicContact CZ-CE2 4.5Å; V289-Y293 HydrophobicContact CG1-CD2 3.68Å; V289-Y293 HydrophobicContact CG1-CE2 3.63Å; V289-Y293 VanDerWaalsContact O-CD2 3.31Å; V289-Y293 WeakPolarHBondContact O-CD2 3.24Å; V289-Y293 PolarHBondContact O-N 3.01Å; C290-Y293 PolarHBondContact O-N 3.14Å; Y293-N295 PolarHBondContact O-N 3.47Å; Y293-N295 VanDerWaalsContact O-N 3.13Å; Y293-S296 PolarHBondContact O-N 3.39Å; Y293-S296 VanDerWaalsContact O-N 3.08Å |
| 294 | F | 91.6 | Very high | 85.6 | Confident | 73 Ų | 73 | 26.6 Ų | 26.6 | 32% | 0.32 | 15% | 0.145 | S | C | . | . | H | α-helix | trans | -59.9 | -25 | 177.8 | -168 | -107.5 | 0 | 0 | 0 | 112.7 | V50 C290 L291 A292 S296 C297 L298 | V50-F294 HydrophobicContact CG2-CB 4.22Å; V50-F294 HydrophobicContact CG2-CD2 3.89Å; C290-F294 WeakPolarHBondContact O-CB 3.14Å; C290-F294 PolarHBondContact O-N 3.31Å; L291-F294 WeakPolarHBondContact O-CB 3.15Å; L291-F294 PolarHBondContact O-N 3.37Å; A292-F294 VanDerWaalsContact C-N 3.33Å; A292-F294 PolarHBondContact O-N 3.4Å; F294-S296 PolarHBondContact O-N 2.75Å; F294-C297 PolarHBondContact O-N 3.3Å; F294-C297 VanDerWaalsContact O-N 3.09Å; F294-L298 HydrophobicContact CD1-CD1 4.01Å; F294-L298 HydrophobicContact CD1-CD2 4.24Å; F294-L298 HydrophobicContact CD1-CG 4Å; F294-L298 HydrophobicContact CE1-CD1 4.15Å; F294-L298 HydrophobicContact CE1-CD2 3.63Å; F294-L298 HydrophobicContact CE1-CG 3.91Å; F294-L298 HydrophobicContact CZ-CD2 4.22Å; F294-L298 PolarHBondContact O-N 3.46Å |
| 295 | N | 92.3 | Very high | 84.4 | Confident | 2 Ų | 2 | 29.7 Ų | 29.7 | 1% | 0.011 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -52.5 | -41.7 | 173.3 | -174.2 | -111.9 | 0 | 0 | 0 | 112.9 | S253 F254 C257 L291 A292 Y293 C297 L298 | S253-N295 PolarHBondContact O-ND2 2.85Å; F254-N295 VanDerWaalsContact CA-ND2 3.27Å; F254-N295 WeakPolarHBondContact CA-ND2 3.48Å; F254-N295 PolarHBondContact N-ND2 3.41Å; C257-N295 HydrophobicContact CB-CB 3.76Å; L291-N295 PolarHBondContact O-N 3.46Å; A292-N295 WeakPolarHBondContact O-CB 3.33Å; A292-N295 PolarHBondContact O-N 3.22Å; Y293-N295 PolarHBondContact O-N 3.47Å; Y293-N295 VanDerWaalsContact O-N 3.13Å; N295-C297 PolarHBondContact O-N 2.85Å; N295-L298 PolarHBondContact O-N 3.49Å; N295-L298 VanDerWaalsContact O-N 3.11Å |
| 296 | S | 90.8 | Very high | 83.1 | Confident | 2 Ų | 2 | 28.9 Ų | 28.9 | 1% | 0.014 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -68.2 | -20.1 | -177.5 | -70.1 | 0 | 0 | 0 | 0 | 113.5 | N58 D85 C88 Y293 F294 | N58-S296 PolarHBondContact ND2-O 2.78Å; D85-S296 WeakPolarHBondContact OD1-CA 3.49Å; D85-S296 VanDerWaalsContact OD1-CB 3.32Å; D85-S296 WeakPolarHBondContact OD1-CB 3.12Å; D85-S296 PolarHBondContact OD1-OG 2.91Å; C88-S296 PolarHBondContact SG-OG 3.04Å; C88-S296 VanDerWaalsContact SG-OG 3.42Å; Y293-S296 PolarHBondContact O-N 3.39Å; Y293-S296 VanDerWaalsContact O-N 3.08Å; F294-S296 PolarHBondContact O-N 2.75Å |
| 297 | C | 87.7 | Confident | 81.9 | Confident | 4 Ų | 4 | 28.6 Ų | 28.6 | 3% | 0.027 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -86.2 | -24.1 | 173.9 | -60.8 | 0 | 0 | 0 | 0 | 113.2 | V50 L53 G54 F294 N295 N299 | V50-C297 VanDerWaalsContact CA-SG 3.51Å; V50-C297 WeakPolarHBondContact CG1-SG 3.42Å; V50-C297 PolarHBondContact O-SG 3.01Å; L53-C297 HydrophobicContact CB-CB 4.44Å; G54-C297 WeakPolarHBondContact CA-SG 3.26Å; G54-C297 PolarHBondContact N-SG 3.18Å; F294-C297 PolarHBondContact O-N 3.3Å; F294-C297 VanDerWaalsContact O-N 3.09Å; N295-C297 PolarHBondContact O-N 2.85Å; C297-N299 VanDerWaalsContact C-N 3.34Å |
| 298 | L | 86.7 | Confident | 80.5 | Confident | 32 Ų | 32 | 31.1 Ų | 31.1 | 17% | 0.168 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -72 | -31 | -178.3 | -69.9 | 177 | 0 | 0 | 0 | 111.9 | F294 N295 L301 I302 | F294-L298 HydrophobicContact CD1-CD1 4.01Å; F294-L298 HydrophobicContact CD1-CD2 4.24Å; F294-L298 HydrophobicContact CD1-CG 4Å; F294-L298 HydrophobicContact CE1-CD1 4.15Å; F294-L298 HydrophobicContact CE1-CD2 3.63Å; F294-L298 HydrophobicContact CE1-CG 3.91Å; F294-L298 HydrophobicContact CZ-CD2 4.22Å; F294-L298 PolarHBondContact O-N 3.46Å; N295-L298 PolarHBondContact O-N 3.49Å; N295-L298 VanDerWaalsContact O-N 3.11Å; L298-L301 PolarHBondContact O-N 3.44Å; L298-I302 HydrophobicContact CB-CD1 3.94Å; L298-I302 WeakPolarHBondContact O-CB 3.42Å; L298-I302 WeakPolarHBondContact O-CD1 3.41Å; L298-I302 WeakPolarHBondContact O-CG1 3.19Å; L298-I302 PolarHBondContact O-N 3.26Å |
| 299 | N | 82.4 | Confident | 78.9 | Confident | 3 Ų | 3 | 34.7 Ų | 34.7 | 2% | 0.016 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -59.3 | -52.6 | -173.5 | -68.6 | -27.1 | 0 | 0 | 0 | 112.9 | L81 D85 C297 L301 I302 Y303 | L81-N299 HydrophobicContact CD2-CB 4.21Å; D85-N299 PolarHBondContact OD1-ND2 3.03Å; D85-N299 WeakPolarHBondContact OD2-CB 3.17Å; D85-N299 PolarHBondContact OD2-ND2 3.42Å; C297-N299 VanDerWaalsContact C-N 3.34Å; N299-L301 PolarHBondContact O-N 2.87Å; N299-I302 PolarHBondContact O-N 2.96Å; N299-Y303 HydrophobicContact CB-CE2 4.29Å; N299-Y303 WeakPolarHBondContact O-CD2 3.39Å; N299-Y303 PolarHBondContact O-N 2.91Å; N299-Y303 VanDerWaalsContact O-N 3.07Å |
| 300 | P | 79.4 | Confident | 77.4 | Confident | 12 Ų | 12 | 33.7 Ų | 33.7 | 8% | 0.078 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -57.6 | -43.9 | 172.9 | -25.6 | 34.3 | 0 | 0 | 0 | 113.7 | N58 V61 I302 Y303 V304 | N58-P300 WeakPolarHBondContact OD1-CG 3.35Å; V61-P300 HydrophobicContact CG2-CB 4.08Å; V61-P300 HydrophobicContact CG2-CG 4.19Å; P300-I302 PolarHBondContact O-N 3.22Å; P300-Y303 PolarHBondContact O-N 3.37Å; P300-V304 WeakPolarHBondContact O-CG2 3.4Å; P300-V304 PolarHBondContact O-N 3.43Å |
| 301 | L | 75.3 | Confident | 76.3 | Confident | 87 Ų | 87 | 37.7 Ų | 37.7 | 46% | 0.455 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -61.1 | -45.6 | -179.8 | -66.8 | 174.1 | 0 | 0 | 0 | 111.2 | L298 N299 Y303 V304 C305 | L298-L301 PolarHBondContact O-N 3.44Å; N299-L301 PolarHBondContact O-N 2.87Å; L301-Y303 VanDerWaalsContact C-N 3.3Å; L301-Y303 PolarHBondContact O-N 2.95Å; L301-V304 PolarHBondContact O-N 3.27Å; L301-C305 VanDerWaalsContact O-CB 3.28Å; L301-C305 WeakPolarHBondContact O-CB 3.43Å; L301-C305 PolarHBondContact O-N 3.47Å; L301-C305 PolarHBondContact O-SG 2.93Å |
| 302 | I | 75.8 | Confident | 75 | Confident | 14 Ų | 14 | 37.4 Ų | 37.4 | 7% | 0.072 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -63.8 | -38.5 | 178.3 | -65.5 | 162.8 | 0 | 0 | 0 | 110.6 | V246 V249 V250 L298 N299 P300 V306 | V246-I302 HydrophobicContact CG1-CG2 4.22Å; V249-I302 HydrophobicContact CB-CG2 4.37Å; V249-I302 HydrophobicContact CG1-CD1 4.05Å; V249-I302 HydrophobicContact CG1-CG1 4.03Å; V249-I302 HydrophobicContact CG1-CG2 3.96Å; V250-I302 HydrophobicContact CG2-CB 4.17Å; V250-I302 HydrophobicContact CG2-CD1 4.11Å; V250-I302 HydrophobicContact CG2-CG2 3.5Å; V250-I302 VanDerWaalsContact CG2-CG2 3.5Å; L298-I302 HydrophobicContact CB-CD1 3.94Å; L298-I302 WeakPolarHBondContact O-CB 3.42Å; L298-I302 WeakPolarHBondContact O-CD1 3.41Å; L298-I302 WeakPolarHBondContact O-CG1 3.19Å; L298-I302 PolarHBondContact O-N 3.26Å; N299-I302 PolarHBondContact O-N 2.96Å; P300-I302 PolarHBondContact O-N 3.22Å; I302-V306 HydrophobicContact CG2-CB 4.5Å; I302-V306 HydrophobicContact CG2-CG2 4.13Å; I302-V306 WeakPolarHBondContact O-CA 2.98Å; I302-V306 VanDerWaalsContact O-CB 3.23Å; I302-V306 WeakPolarHBondContact O-CB 3.26Å; I302-V306 WeakPolarHBondContact O-CG2 3.4Å; I302-V306 PolarHBondContact O-N 3.42Å |
| 303 | Y | 69.7 | Low | 73.5 | Confident | 13 Ų | 13 | 38.2 Ų | 38.2 | 5% | 0.051 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -66.1 | -39.6 | 177 | -62.4 | -32.3 | 0 | 0 | 0 | 113.4 | F78 L81 V246 V250 N299 P300 L301 G307 | F78-Y303 HydrophobicContact CD1-CD2 4.35Å; F78-Y303 HydrophobicContact CD1-CE1 4.17Å; F78-Y303 AromaticContact CD1-CE2 3.76Å; F78-Y303 HydrophobicContact CD1-CE2 3.76Å; F78-Y303 AromaticContact CD1-CZ 3.65Å; F78-Y303 AromaticContact CE1-CD1 3.97Å; F78-Y303 HydrophobicContact CE1-CD1 3.97Å; F78-Y303 HydrophobicContact CE1-CD2 4.4Å; F78-Y303 AromaticContact CE1-CE1 3.53Å; F78-Y303 HydrophobicContact CE1-CE1 3.53Å; F78-Y303 AromaticContact CE1-CE2 3.97Å; F78-Y303 HydrophobicContact CE1-CE2 3.97Å; F78-Y303 HydrophobicContact CE1-CG 4.4Å; F78-Y303 AromaticContact CE1-CZ 3.5Å; F78-Y303 VanDerWaalsContact CE1-CZ 3.5Å; F78-Y303 HydrophobicContact CZ-CE1 4.4Å; L81-Y303 HydrophobicContact CD2-CE2 4.16Å; L81-Y303 WeakPolarHBondContact CD2-OH 3.49Å; V246-Y303 HydrophobicContact CG1-CD1 4.29Å; V246-Y303 HydrophobicContact CG1-CE1 4.49Å; V250-Y303 HydrophobicContact CG2-CE1 4.15Å; N299-Y303 HydrophobicContact CB-CE2 4.29Å; N299-Y303 WeakPolarHBondContact O-CD2 3.39Å; N299-Y303 PolarHBondContact O-N 2.91Å; N299-Y303 VanDerWaalsContact O-N 3.07Å; P300-Y303 PolarHBondContact O-N 3.37Å; L301-Y303 VanDerWaalsContact C-N 3.3Å; L301-Y303 PolarHBondContact O-N 2.95Å; Y303-G307 VanDerWaalsContact O-CA 3.22Å; Y303-G307 WeakPolarHBondContact O-CA 3.26Å; Y303-G307 PolarHBondContact O-N 3.24Å |
| 304 | V | 67.3 | Low | 72.1 | Confident | 46 Ų | 46 | 39 Ų | 39 | 28% | 0.279 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -73.9 | -44.4 | 178.3 | 175.8 | 0 | 0 | 0 | 0 | 111.7 | P300 L301 F310 M314 | P300-V304 WeakPolarHBondContact O-CG2 3.4Å; P300-V304 PolarHBondContact O-N 3.43Å; L301-V304 PolarHBondContact O-N 3.27Å; V304-F310 HydrophobicContact CG2-CD1 4.37Å; V304-F310 HydrophobicContact CG2-CE1 4.14Å; V304-M314 HydrophobicContact CB-CE 4.36Å; V304-M314 HydrophobicContact CG1-CE 3.88Å; V304-M314 HydrophobicContact CG2-CE 3.57Å; V304-M314 HydrophobicContact CG2-SD 3.85Å |
| 305 | C | 62.2 | Low | 71.1 | Confident | 101 Ų | 101 | 37.9 Ų | 37.9 | 68% | 0.682 | 21% | 0.211 | S | C | * | . | H | α-helix | trans | -72.7 | -35.6 | -177.7 | -66.6 | 0 | 0 | 0 | 0 | 112.3 | L301 | L301-C305 VanDerWaalsContact O-CB 3.28Å; L301-C305 WeakPolarHBondContact O-CB 3.43Å; L301-C305 PolarHBondContact O-N 3.47Å; L301-C305 PolarHBondContact O-SG 2.93Å |
| 306 | V | 58.9 | Low | 70.2 | Confident | 30 Ų | 30 | 43.9 Ų | 43.9 | 18% | 0.182 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -111.3 | -28.8 | -169.4 | -160.6 | 0 | 0 | 0 | 0 | 112.6 | R242 V246 I302 | R242-V306 PolarHBondContact NE-O 3.44Å; R242-V306 PolarHBondContact NH2-O 3.47Å; R242-V306 VanDerWaalsContact NH2-O 3.09Å; V246-V306 HydrophobicContact CB-CB 4.47Å; V246-V306 HydrophobicContact CB-CG1 4.15Å; V246-V306 HydrophobicContact CG2-CB 3.76Å; V246-V306 HydrophobicContact CG2-CG1 3.39Å; I302-V306 HydrophobicContact CG2-CB 4.5Å; I302-V306 HydrophobicContact CG2-CG2 4.13Å; I302-V306 WeakPolarHBondContact O-CA 2.98Å; I302-V306 VanDerWaalsContact O-CB 3.23Å; I302-V306 WeakPolarHBondContact O-CB 3.26Å; I302-V306 WeakPolarHBondContact O-CG2 3.4Å; I302-V306 PolarHBondContact O-N 3.42Å |
| 307 | G | 60.4 | Low | 69 | Low | 11 Ų | 11 | 44.5 Ų | 44.5 | 11% | 0.113 | 24% | 0.238 | C | C | . | . | trans | -95.7 | 103.1 | -174.4 | 0 | 0 | 0 | 0 | 0 | 115.8 | Y303 S309 K311 | Y303-G307 VanDerWaalsContact O-CA 3.22Å; Y303-G307 WeakPolarHBondContact O-CA 3.26Å; Y303-G307 PolarHBondContact O-N 3.24Å; G307-S309 PolarHBondContact O-N 2.97Å; G307-K311 VanDerWaalsContact O-CB 3.24Å; G307-K311 WeakPolarHBondContact O-CB 3.15Å; G307-K311 PolarHBondContact O-N 3.48Å | ||
| 308 | K | 58.2 | Low | 68 | Low | 121 Ų | 121 | 49.2 Ų | 49.2 | 53% | 0.526 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -60.1 | -46 | 177.7 | -134.5 | -176.2 | 170.1 | 173.7 | 0 | 112.4 | R242 F310 K311 D312 | R242-K308 VanDerWaalsContact NH2-N 3.15Å; K308-F310 VanDerWaalsContact C-N 3.33Å; K308-F310 PolarHBondContact O-N 3.35Å; K308-K311 PolarHBondContact O-N 3Å; K308-D312 VanDerWaalsContact O-CB 3.26Å; K308-D312 WeakPolarHBondContact O-CB 3.47Å; K308-D312 PolarHBondContact O-N 3.37Å; K308-D312 VanDerWaalsContact O-OD2 3.12Å |
| 309 | S | 58.7 | Low | 67.3 | Low | 79 Ų | 79 | 54.6 Ų | 54.6 | 55% | 0.552 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -67.5 | -34.6 | -173 | 57.7 | 0 | 0 | 0 | 0 | 113.2 | G307 S313 | G307-S309 PolarHBondContact O-N 2.97Å; S309-S313 PolarHBondContact O-N 3.07Å; S309-S313 PolarHBondContact O-OG 3.31Å |
| 310 | F | 60.2 | Low | 66.5 | Low | 5 Ų | 5 | 61.4 Ų | 61.4 | 2% | 0.022 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -71.7 | -50.6 | 173.3 | -176.4 | -98.3 | 0 | 0 | 0 | 110 | V61 V64 T65 F78 V304 K308 D312 S313 M314 | V61-F310 HydrophobicContact CB-CZ 4.25Å; V61-F310 HydrophobicContact CG1-CE2 4.12Å; V61-F310 HydrophobicContact CG1-CZ 4.11Å; V61-F310 HydrophobicContact CG2-CE1 4.34Å; V61-F310 HydrophobicContact CG2-CZ 3.73Å; V64-F310 HydrophobicContact CG1-CE2 4.42Å; T65-F310 HydrophobicContact CG2-CE2 4.24Å; F78-F310 HydrophobicContact CD2-CD2 4.49Å; V304-F310 HydrophobicContact CG2-CD1 4.37Å; V304-F310 HydrophobicContact CG2-CE1 4.14Å; K308-F310 VanDerWaalsContact C-N 3.33Å; K308-F310 PolarHBondContact O-N 3.35Å; F310-D312 VanDerWaalsContact C-N 3.31Å; F310-D312 PolarHBondContact O-N 3.15Å; F310-S313 PolarHBondContact O-N 3.39Å; F310-S313 VanDerWaalsContact O-N 3.09Å; F310-M314 HydrophobicContact CE1-SD 4.03Å; F310-M314 WeakPolarHBondContact O-CB 3.21Å; F310-M314 PolarHBondContact O-N 2.99Å |
| 311 | K | 65.1 | Low | 65.9 | Low | 91 Ų | 91 | 65.3 Ų | 65.3 | 40% | 0.396 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -53.3 | -44.3 | 175.3 | -175 | 176.8 | -176.3 | 169.8 | 0 | 112.9 | G307 K308 S313 N315 | G307-K311 VanDerWaalsContact O-CB 3.24Å; G307-K311 WeakPolarHBondContact O-CB 3.15Å; G307-K311 PolarHBondContact O-N 3.48Å; K308-K311 PolarHBondContact O-N 3Å; K311-S313 PolarHBondContact O-N 3.21Å; K311-N315 WeakPolarHBondContact O-CB 3.21Å; K311-N315 PolarHBondContact O-N 3.28Å; K311-N315 PolarHBondContact O-ND2 3.42Å; K311-N315 PolarHBondContact O-OD1 3.31Å |
| 312 | D | 66.1 | Low | 65.4 | Low | 59 Ų | 59 | 66.8 Ų | 66.8 | 32% | 0.316 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -68.2 | -35.9 | -179.5 | -66 | -22.4 | 0 | 0 | 0 | 111.6 | K308 F310 R316 | K308-D312 VanDerWaalsContact O-CB 3.26Å; K308-D312 WeakPolarHBondContact O-CB 3.47Å; K308-D312 PolarHBondContact O-N 3.37Å; K308-D312 VanDerWaalsContact O-OD2 3.12Å; F310-D312 VanDerWaalsContact C-N 3.31Å; F310-D312 PolarHBondContact O-N 3.15Å; D312-R316 WeakPolarHBondContact O-CG 3.33Å; D312-R316 PolarHBondContact O-N 3.42Å; D312-R316 VanDerWaalsContact O-N 3.12Å; D312-R316 PolarHBondContact O-NH1 3.1Å |
| 313 | S | 61.5 | Low | 64.9 | Low | 18 Ų | 18 | 71.6 Ų | 71.6 | 13% | 0.126 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -71.9 | -45.8 | 176.3 | -54.2 | 0 | 0 | 0 | 0 | 111.3 | S309 F310 K311 N315 R316 S317 | S309-S313 PolarHBondContact O-N 3.07Å; S309-S313 PolarHBondContact O-OG 3.31Å; F310-S313 PolarHBondContact O-N 3.39Å; F310-S313 VanDerWaalsContact O-N 3.09Å; K311-S313 PolarHBondContact O-N 3.21Å; S313-N315 PolarHBondContact O-N 3.01Å; S313-R316 PolarHBondContact O-N 3.33Å; S313-R316 PolarHBondContact OG-NH2 2.77Å; S313-S317 PolarHBondContact O-N 3.27Å; S313-S317 PolarHBondContact O-OG 2.69Å |
| 314 | M | 64.8 | Low | 64.3 | Low | 16 Ų | 16 | 77.4 Ų | 77.4 | 8% | 0.079 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -58.8 | -46.4 | 174.6 | -174.6 | -179.8 | 71.7 | 0 | 0 | 111.6 | L60 V304 F310 R316 S317 M318 | L60-M314 HydrophobicContact CD2-SD 4Å; V304-M314 HydrophobicContact CB-CE 4.36Å; V304-M314 HydrophobicContact CG1-CE 3.88Å; V304-M314 HydrophobicContact CG2-CE 3.57Å; V304-M314 HydrophobicContact CG2-SD 3.85Å; F310-M314 HydrophobicContact CE1-SD 4.03Å; F310-M314 WeakPolarHBondContact O-CB 3.21Å; F310-M314 PolarHBondContact O-N 2.99Å; M314-R316 VanDerWaalsContact C-N 3.31Å; M314-R316 PolarHBondContact O-N 3.09Å; M314-S317 PolarHBondContact O-N 3.12Å; M314-M318 HydrophobicContact CG-SD 4.3Å; M314-M318 WeakPolarHBondContact O-CG 3.44Å; M314-M318 PolarHBondContact O-N 2.84Å |
| 315 | N | 70.4 | Confident | 63.9 | Low | 50 Ų | 50 | 78.8 Ų | 78.8 | 27% | 0.267 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -63.5 | -34.8 | 177.5 | -75.1 | -9.3 | 0 | 0 | 0 | 112.7 | K311 S313 R319 | K311-N315 WeakPolarHBondContact O-CB 3.21Å; K311-N315 PolarHBondContact O-N 3.28Å; K311-N315 PolarHBondContact O-ND2 3.42Å; K311-N315 PolarHBondContact O-OD1 3.31Å; S313-N315 PolarHBondContact O-N 3.01Å; N315-R319 WeakPolarHBondContact O-CB 3.35Å; N315-R319 VanDerWaalsContact O-CG 3.31Å; N315-R319 WeakPolarHBondContact O-CG 3.35Å; N315-R319 VanDerWaalsContact O-CZ 3.27Å; N315-R319 PolarHBondContact O-N 3.29Å; N315-R319 VanDerWaalsContact O-N 3.15Å; N315-R319 PolarHBondContact O-NE 3.09Å |
| 316 | R | 71.8 | Confident | 63.9 | Low | 127 Ų | 127 | 78.8 Ų | 78.8 | 48% | 0.479 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -67 | -46.3 | 173.4 | -78.1 | -173 | -60.7 | -92.5 | -1.1 | 111.2 | D312 S313 M314 R319 H320 | D312-R316 WeakPolarHBondContact O-CG 3.33Å; D312-R316 PolarHBondContact O-N 3.42Å; D312-R316 VanDerWaalsContact O-N 3.12Å; D312-R316 PolarHBondContact O-NH1 3.1Å; S313-R316 PolarHBondContact O-N 3.33Å; S313-R316 PolarHBondContact OG-NH2 2.77Å; M314-R316 VanDerWaalsContact C-N 3.31Å; M314-R316 PolarHBondContact O-N 3.09Å; R316-R319 PolarHBondContact O-N 3.3Å; R316-H320 PolarHBondContact O-CD2 2.87Å; R316-H320 PolarHBondContact O-N 3.5Å |
| 317 | S | 65.4 | Low | 63.4 | Low | 15 Ų | 15 | 82.3 Ų | 82.3 | 11% | 0.105 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -61.5 | -46.4 | 178 | -61.4 | 0 | 0 | 0 | 0 | 112.5 | C68 S313 M314 R319 H320 I321 | C68-S317 WeakPolarHBondContact CB-OG 3.38Å; C68-S317 PolarHBondContact SG-OG 3.42Å; C68-S317 VanDerWaalsContact SG-OG 3.37Å; S313-S317 PolarHBondContact O-N 3.27Å; S313-S317 PolarHBondContact O-OG 2.69Å; M314-S317 PolarHBondContact O-N 3.12Å; S317-R319 VanDerWaalsContact C-N 3.3Å; S317-R319 PolarHBondContact O-N 3.06Å; S317-H320 PolarHBondContact O-N 2.71Å; S317-H320 VanDerWaalsContact O-N 3.16Å; S317-I321 WeakPolarHBondContact O-CG1 3.43Å; S317-I321 PolarHBondContact O-N 3.34Å |
| 318 | M | 68.1 | Low | 62.7 | Low | 104 Ų | 104 | 87.6 Ų | 87.6 | 51% | 0.512 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -61.7 | -39 | 177.4 | -71.5 | -175.2 | 76.8 | 0 | 0 | 111.8 | M314 I321 L322 | M314-M318 HydrophobicContact CG-SD 4.3Å; M314-M318 WeakPolarHBondContact O-CG 3.44Å; M314-M318 PolarHBondContact O-N 2.84Å; M318-I321 PolarHBondContact O-N 2.93Å; M318-L322 VanDerWaalsContact O-CB 3.25Å; M318-L322 WeakPolarHBondContact O-CB 3.45Å; M318-L322 PolarHBondContact O-N 3.28Å |
| 319 | R | 72.5 | Confident | 62.3 | Low | 145 Ų | 145 | 87.5 Ų | 87.5 | 55% | 0.547 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -64.3 | -39.5 | 173.9 | -78.9 | -172.7 | -65.7 | -95.3 | 0.7 | 112.8 | N315 R316 S317 H323 | N315-R319 WeakPolarHBondContact O-CB 3.35Å; N315-R319 VanDerWaalsContact O-CG 3.31Å; N315-R319 WeakPolarHBondContact O-CG 3.35Å; N315-R319 VanDerWaalsContact O-CZ 3.27Å; N315-R319 PolarHBondContact O-N 3.29Å; N315-R319 VanDerWaalsContact O-N 3.15Å; N315-R319 PolarHBondContact O-NE 3.09Å; R316-R319 PolarHBondContact O-N 3.3Å; S317-R319 VanDerWaalsContact C-N 3.3Å; S317-R319 PolarHBondContact O-N 3.06Å; R319-H323 VanDerWaalsContact O-CB 3.23Å; R319-H323 WeakPolarHBondContact O-CB 3.09Å; R319-H323 PolarHBondContact O-N 2.92Å |
| 320 | H | 65.3 | Low | 61.7 | Low | 145 Ų | 145 | 88.3 Ų | 88.3 | 67% | 0.671 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -66.5 | -40.7 | 175.9 | -88.1 | -74.6 | 0 | 0 | 0 | 112.6 | R316 S317 H323 F324 | R316-H320 PolarHBondContact O-CD2 2.87Å; R316-H320 PolarHBondContact O-N 3.5Å; S317-H320 PolarHBondContact O-N 2.71Å; S317-H320 VanDerWaalsContact O-N 3.16Å; H320-H323 PolarHBondContact O-N 2.84Å; H320-F324 VanDerWaalsContact O-CB 3.31Å; H320-F324 WeakPolarHBondContact O-CB 3.45Å; H320-F324 PolarHBondContact O-N 3.06Å |
| 321 | I | 65.9 | Low | 61.1 | Low | 95 Ų | 95 | 92.7 Ų | 92.7 | 49% | 0.487 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -67.2 | -43.6 | 176 | -65.7 | 168.3 | 0 | 0 | 0 | 110.4 | S317 M318 H323 F324 A325 | S317-I321 WeakPolarHBondContact O-CG1 3.43Å; S317-I321 PolarHBondContact O-N 3.34Å; M318-I321 PolarHBondContact O-N 2.93Å; I321-H323 VanDerWaalsContact C-N 3.34Å; I321-H323 PolarHBondContact O-N 2.96Å; I321-F324 PolarHBondContact O-N 3.46Å; I321-A325 VanDerWaalsContact O-CB 3.24Å; I321-A325 WeakPolarHBondContact O-CB 3.4Å; I321-A325 PolarHBondContact O-N 3.09Å |
| 322 | L | 65.8 | Low | 60.1 | Low | 117 Ų | 117 | 98.3 Ų | 98.3 | 61% | 0.613 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.3 | -42.8 | 176.3 | -168 | 74.5 | 0 | 0 | 0 | 110.8 | M318 A325 T326 | M318-L322 VanDerWaalsContact O-CB 3.25Å; M318-L322 WeakPolarHBondContact O-CB 3.45Å; M318-L322 PolarHBondContact O-N 3.28Å; L322-A325 PolarHBondContact O-N 3.09Å; L322-T326 VanDerWaalsContact O-CB 3.29Å; L322-T326 WeakPolarHBondContact O-CB 3.48Å; L322-T326 PolarHBondContact O-N 3.18Å; L322-T326 PolarHBondContact O-OG1 3.28Å |
| 323 | H | 64 | Low | 58.8 | Low | 115 Ų | 115 | 99 Ų | 99 | 53% | 0.532 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -61.5 | -46.1 | 174.8 | -167.4 | -84 | 0 | 0 | 0 | 111.5 | R319 H320 I321 A325 T326 E327 | R319-H323 VanDerWaalsContact O-CB 3.23Å; R319-H323 WeakPolarHBondContact O-CB 3.09Å; R319-H323 PolarHBondContact O-N 2.92Å; H320-H323 PolarHBondContact O-N 2.84Å; I321-H323 VanDerWaalsContact C-N 3.34Å; I321-H323 PolarHBondContact O-N 2.96Å; H323-A325 VanDerWaalsContact C-N 3.32Å; H323-A325 PolarHBondContact O-N 2.9Å; H323-T326 PolarHBondContact O-N 3.46Å; H323-E327 IonicContact CE1-OE1 2.75Å; H323-E327 PolarHBondContact CE1-OE1 2.68Å; H323-E327 IonicContact ND1-OE1 3.68Å; H323-E327 PolarHBondContact ND1-OE1 2.89Å; H323-E327 IonicContact ND1-OE2 3.41Å; H323-E327 WeakPolarHBondContact O-CG 3.33Å; H323-E327 PolarHBondContact O-N 2.92Å |
| 324 | F | 57.4 | Low | 57.8 | Low | 135 Ų | 135 | 103.3 Ų | 103.3 | 59% | 0.592 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -65.3 | -33.1 | 177 | -175.2 | -94.8 | 0 | 0 | 0 | 113 | H320 I321 | H320-F324 VanDerWaalsContact O-CB 3.31Å; H320-F324 WeakPolarHBondContact O-CB 3.45Å; H320-F324 PolarHBondContact O-N 3.06Å; I321-F324 PolarHBondContact O-N 3.46Å |
| 325 | A | 58.3 | Low | 56.9 | Low | 76 Ų | 76 | 110.4 Ų | 110.4 | 63% | 0.628 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -80.3 | -20.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | I321 L322 H323 | I321-A325 VanDerWaalsContact O-CB 3.24Å; I321-A325 WeakPolarHBondContact O-CB 3.4Å; I321-A325 PolarHBondContact O-N 3.09Å; L322-A325 PolarHBondContact O-N 3.09Å; H323-A325 VanDerWaalsContact C-N 3.32Å; H323-A325 PolarHBondContact O-N 2.9Å |
| 326 | T | 62.4 | Low | 55.5 | Low | 101 Ų | 101 | 115.1 Ų | 115.1 | 62% | 0.62 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -93.1 | -18.1 | 175.7 | -45.8 | 0 | 0 | 0 | 0 | 111.5 | L322 H323 D328 | L322-T326 VanDerWaalsContact O-CB 3.29Å; L322-T326 WeakPolarHBondContact O-CB 3.48Å; L322-T326 PolarHBondContact O-N 3.18Å; L322-T326 PolarHBondContact O-OG1 3.28Å; H323-T326 PolarHBondContact O-N 3.46Å; T326-D328 PolarHBondContact O-N 2.97Å |
| 327 | E | 49.4 | Very low | 53.8 | Low | 104 Ų | 104 | 117.2 Ų | 117.2 | 49% | 0.486 | 65% | 0.646 | S | S | . | * | S | Bend | trans | -70.8 | 94.8 | 167.3 | -80.3 | 178 | 163.7 | 0 | 0 | 109.5 | H323 | H323-E327 IonicContact CE1-OE1 2.75Å; H323-E327 PolarHBondContact CE1-OE1 2.68Å; H323-E327 IonicContact ND1-OE1 3.68Å; H323-E327 PolarHBondContact ND1-OE1 2.89Å; H323-E327 IonicContact ND1-OE2 3.41Å; H323-E327 WeakPolarHBondContact O-CG 3.33Å; H323-E327 PolarHBondContact O-N 2.92Å |
| 328 | D | 46.2 | Very low | 52.6 | Low | 122 Ų | 122 | 122.6 Ų | 122.6 | 65% | 0.652 | 68% | 0.678 | S | S | * | * | trans | -53.6 | 139.5 | 170.5 | -82 | -39.1 | 0 | 0 | 0 | 110.9 | T326 A330 | T326-D328 PolarHBondContact O-N 2.97Å; D328-A330 PolarHBondContact O-N 3.2Å | ||
| 329 | P | 48.6 | Very low | 51.1 | Low | 118 Ų | 118 | 127.6 Ų | 127.6 | 77% | 0.766 | 70% | 0.697 | S | S | * | * | G | 310 helix | trans | -62.9 | -3.8 | -180 | 21.9 | -30.5 | 0 | 0 | 0 | 114.8 | S331 | P329-S331 VanDerWaalsContact C-N 3.31Å; P329-S331 PolarHBondContact O-N 2.69Å |
| 330 | A | 46.5 | Very low | 49.4 | Very low | 96 Ų | 96 | 125.1 Ų | 125.1 | 79% | 0.793 | 70% | 0.702 | S | S | * | * | G | 310 helix | trans | -73.7 | -10.9 | -177.5 | 0 | 0 | 0 | 0 | 0 | 115 | D328 | D328-A330 PolarHBondContact O-N 3.2Š|
| 331 | S | 46.7 | Very low | 48 | Very low | 98 Ų | 98 | 124 Ų | 124 | 69% | 0.685 | 71% | 0.705 | S | S | * | * | G | 310 helix | trans | -95.2 | -3.7 | -177.4 | 65.1 | 0 | 0 | 0 | 0 | 115.2 | P329 G333 | P329-S331 VanDerWaalsContact C-N 3.31Å; P329-S331 PolarHBondContact O-N 2.69Å; S331-G333 VanDerWaalsContact C-N 3.34Å; S331-G333 PolarHBondContact O-N 3.34Å |
| 332 | R | 44.7 | Very low | 46.4 | Very low | 208 Ų | 208 | 125.3 Ų | 125.3 | 79% | 0.785 | 72% | 0.723 | S | S | * | * | S | Bend | trans | -82.5 | -2.3 | -178.1 | -85.7 | -175.9 | 176 | 170.7 | 1.1 | 115.4 | ||
| 333 | G | 40 | Very low | 45.2 | Very low | 74 Ų | 74 | 126.2 Ų | 126.2 | 76% | 0.763 | 73% | 0.728 | S | S | * | * | S | Bend | trans | -109.7 | 55.8 | -174.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | S331 | S331-G333 VanDerWaalsContact C-N 3.34Å; S331-G333 PolarHBondContact O-N 3.34Å |
| 334 | S | 39.9 | Very low | 43.8 | Very low | 108 Ų | 108 | 130.1 Ų | 130.1 | 76% | 0.755 | 75% | 0.747 | S | S | * | * | trans | -167.3 | 50.6 | 162.4 | -174.3 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 335 | I | 44.8 | Very low | 42.8 | Very low | 165 Ų | 165 | 133.5 Ų | 133.5 | 85% | 0.846 | 76% | 0.756 | S | S | * | * | trans | -136.4 | 79.7 | 160.6 | -52.7 | 177.9 | 0 | 0 | 0 | 107.4 | ||||
| 336 | N | 41.2 | Very low | 42 | Very low | 149 Ų | 149 | 136.2 Ų | 136.2 | 80% | 0.797 | 76% | 0.764 | S | S | * | * | trans | -159.8 | 85.7 | 154.2 | -91.2 | -18.5 | 0 | 0 | 0 | 106.1 | ||||
| 337 | D | 36 | Very low | 41.1 | Very low | 172 Ų | 172 | 137.8 Ų | 137.8 | 92% | 0.92 | 77% | 0.773 | S | S | * | * | trans | -141.4 | 110.1 | 143.2 | -101.8 | -28.1 | 0 | 0 | 0 | 110.1 | ||||
| 338 | T | 41.8 | Very low | 40.7 | Very low | 127 Ų | 127 | 139 Ų | 139 | 78% | 0.779 | 79% | 0.789 | S | S | * | * | trans | -76.9 | 127 | 178.4 | -43.3 | 0 | 0 | 0 | 0 | 108 | ||||
| 339 | K | 35.8 | Very low | 40.3 | Very low | 209 Ų | 209 | 142.5 Ų | 142.5 | 91% | 0.909 | 80% | 0.798 | S | S | * | * | trans | -135.5 | 84.4 | 155.3 | -130.4 | 178.5 | -174.4 | 178.5 | 0 | 112.1 | ||||
| 340 | S | 37.4 | Very low | 39.8 | Very low | 94 Ų | 94 | 148.5 Ų | 148.5 | 66% | 0.657 | 82% | 0.821 | S | S | * | * | trans | -1.6 | 122.4 | 139.6 | -165.4 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 341 | T | 35.2 | Very low | 39.5 | Very low | 120 Ų | 120 | 151.2 Ų | 151.2 | 74% | 0.736 | 82% | 0.822 | S | S | * | * | trans | 65.8 | 115 | 133.7 | -31 | 0 | 0 | 0 | 0 | 121 | ||||
| 342 | S | 33.4 | Very low | 39.1 | Very low | 123 Ų | 123 | 153.9 Ų | 153.9 | 86% | 0.86 | 83% | 0.83 | S | S | * | * | -157.5 | 135.8 | 117.6 | 49.2 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 343 | N | 39.5 | Very low | 38.8 | Very low | 137 Ų | 137 | 150.9 Ų | 150.9 | 73% | 0.733 | 83% | 0.832 | S | S | * | * | trans | -102 | 120.3 | -172.4 | -171.7 | 21 | 0 | 0 | 0 | 106.1 | ||||
| 344 | E | 34.8 | Very low | 38.7 | Very low | 197 Ų | 197 | 155.5 Ų | 155.5 | 92% | 0.921 | 84% | 0.836 | S | S | * | * | trans | -133.7 | 129.2 | 165.8 | -120.6 | 179.1 | -167.7 | 0 | 0 | 111.7 | ||||
| 345 | R | 36.7 | Very low | 38.6 | Very low | 206 Ų | 206 | 158.4 Ų | 158.4 | 78% | 0.777 | 84% | 0.841 | S | S | * | * | trans | -95.7 | 131.7 | -158.5 | -164.7 | -179.5 | -71.8 | -171.8 | -2.5 | 107.8 | T347 | R345-T347 PolarHBondContact O-N 3.37Š| ||
| 346 | V | 41.9 | Very low | 38.2 | Very low | 132 Ų | 132 | 158 Ų | 158 | 80% | 0.8 | 84% | 0.841 | S | S | * | * | trans | -65.6 | 122.7 | 169.7 | 174.1 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 347 | T | 42.1 | Very low | 38 | Very low | 134 Ų | 134 | 158.6 Ų | 158.6 | 82% | 0.822 | 84% | 0.844 | S | S | * | * | trans | -132.4 | 116.6 | 159.3 | 19.2 | 0 | 0 | 0 | 0 | 110.2 | R345 | R345-T347 PolarHBondContact O-N 3.37Š| ||
| 348 | T | 40.7 | Very low | 38.2 | Very low | 131 Ų | 131 | 157.6 Ų | 157.6 | 80% | 0.804 | 84% | 0.838 | S | S | * | * | trans | -66.3 | 136.3 | 174.1 | -41.1 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 349 | K | 39.4 | Very low | 37.9 | Very low | 195 Ų | 195 | 160.2 Ų | 160.2 | 85% | 0.848 | 84% | 0.843 | S | S | * | * | trans | -68.8 | 126.3 | 165.5 | -70.8 | 177.2 | 174.4 | 179.6 | 0 | 109.9 | ||||
| 350 | I | 37.4 | Very low | 38.1 | Very low | 244 Ų | 244 | 155.7 Ų | 155.7 | 100% | 1.251 | 84% | 0.837 | S | S | * | * | -146.8 | 0 | 112.7 | -62.8 | -165.6 | 0 | 0 | 0 | 106.6 |
Retrieved 350 of 350 residues in 995.2 ms
(Link to these results)