| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 36.4 | Very low | 35.3 | Very low | 244 Ų | 244 | 143.9 Ų | 143.9 | 100% | 1.202 | 78% | 0.782 | S | S | * | * | 0 | 119.6 | 0 | -105.4 | 170.6 | 178.4 | 0 | 0 | 108.3 | |||||
| 2 | S | 39 | Very low | 34.9 | Very low | 113 Ų | 113 | 143.3 Ų | 143.3 | 79% | 0.79 | 78% | 0.777 | S | S | * | * | trans | 55.3 | 83.1 | 168.4 | -167.1 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 3 | K | 35.1 | Very low | 34.7 | Very low | 213 Ų | 213 | 140.5 Ų | 140.5 | 93% | 0.926 | 77% | 0.767 | S | S | * | * | trans | -77.7 | 114.2 | 147.6 | -83.5 | -176.6 | 175.4 | -179.3 | 0 | 107 | ||||
| 4 | S | 40.8 | Very low | 34.3 | Very low | 105 Ų | 105 | 140.4 Ų | 140.4 | 73% | 0.734 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 136.8 | 179.2 | 40.6 | 0 | 0 | 0 | 0 | 111.5 | ||
| 5 | I | 35.3 | Very low | 34 | Very low | 154 Ų | 154 | 140.4 Ų | 140.4 | 79% | 0.79 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -68 | 126.5 | 179.5 | -63.4 | 159.8 | 0 | 0 | 0 | 108.8 | ||
| 6 | P | 36.6 | Very low | 33.8 | Very low | 114 Ų | 114 | 143.6 Ų | 143.6 | 74% | 0.74 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 138.8 | 171.7 | -8.9 | 24.7 | 0 | 0 | 0 | 110.3 | ||
| 7 | N | 34.2 | Very low | 33.4 | Very low | 125 Ų | 125 | 144.8 Ų | 144.8 | 67% | 0.668 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -48.7 | 131.9 | -175 | -76.1 | -34.9 | 0 | 0 | 0 | 114.1 | Q9 D10 | N7-Q9 PolarHBondContact O-N 3.23Å; N7-D10 PolarHBondContact O-N 2.96Å |
| 8 | L | 33.5 | Very low | 33 | Very low | 156 Ų | 156 | 145.4 Ų | 145.4 | 82% | 0.817 | 77% | 0.772 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.1 | 6.2 | 175.7 | -138.7 | 90.5 | 0 | 0 | 0 | 114.1 | S11 | L8-S11 PolarHBondContact O-OG 3.33Š|
| 9 | Q | 33.4 | Very low | 32.9 | Very low | 161 Ų | 161 | 143.9 Ų | 143.9 | 75% | 0.752 | 77% | 0.769 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.1 | -14.7 | -175.4 | -132 | 156.4 | -15.6 | 0 | 0 | 113.3 | N7 S11 | N7-Q9 PolarHBondContact O-N 3.23Å; Q9-S11 VanDerWaalsContact C-N 3.35Å |
| 10 | D | 32.8 | Very low | 32.8 | Very low | 122 Ų | 122 | 144.1 Ų | 144.1 | 65% | 0.652 | 77% | 0.77 | S | S | * | * | G | 310 helix | trans | -89.1 | -3.2 | 173.6 | -68.4 | -35.8 | 0 | 0 | 0 | 113 | N7 L12 | N7-D10 PolarHBondContact O-N 2.96Å; D10-L12 VanDerWaalsContact C-N 3.35Å |
| 11 | S | 30.8 | Very low | 32.8 | Very low | 76 Ų | 76 | 143.8 Ų | 143.8 | 53% | 0.531 | 77% | 0.768 | S | S | . | * | G | 310 helix | trans | -84.1 | -5.8 | 173.8 | 63.1 | 0 | 0 | 0 | 0 | 114.1 | L8 Q9 | L8-S11 PolarHBondContact O-OG 3.33Å; Q9-S11 VanDerWaalsContact C-N 3.35Å |
| 12 | L | 30.6 | Very low | 32.8 | Very low | 137 Ų | 137 | 139.6 Ų | 139.6 | 72% | 0.717 | 75% | 0.749 | S | S | * | * | G | 310 helix | trans | -94 | 5.7 | 175.7 | -75.1 | 165.9 | 0 | 0 | 0 | 113.7 | D10 | D10-L12 VanDerWaalsContact C-N 3.35Š|
| 13 | V | 33.1 | Very low | 32.7 | Very low | 107 Ų | 107 | 140.2 Ų | 140.2 | 65% | 0.648 | 75% | 0.748 | S | S | * | * | S | Bend | trans | -104.4 | -9.5 | 178.8 | -177.4 | 0 | 0 | 0 | 0 | 112.5 | ||
| 14 | N | 28.2 | Very low | 32.8 | Very low | 138 Ų | 138 | 132.5 Ų | 132.5 | 74% | 0.738 | 73% | 0.729 | S | S | * | * | S | Bend | trans | -103.7 | 4.6 | -179.7 | -87.8 | -4.6 | 0 | 0 | 0 | 115.8 | K16 | N14-K16 VanDerWaalsContact C-N 3.28Å; N14-K16 PolarHBondContact O-N 3.48Å |
| 15 | D | 29.5 | Very low | 33.1 | Very low | 141 Ų | 141 | 134.3 Ų | 134.3 | 75% | 0.754 | 74% | 0.735 | S | S | * | * | trans | -92.4 | 37.8 | 171 | -85.5 | -20.4 | 0 | 0 | 0 | 112.6 | ||||
| 16 | K | 31.5 | Very low | 33.8 | Very low | 192 Ų | 192 | 136.3 Ų | 136.3 | 84% | 0.835 | 74% | 0.738 | S | S | * | * | trans | -108.8 | 19.7 | 168.3 | -79.4 | -168.5 | 178.5 | -178.5 | 0 | 113.3 | N14 | N14-K16 VanDerWaalsContact C-N 3.28Å; N14-K16 PolarHBondContact O-N 3.48Å | ||
| 17 | E | 26.5 | Very low | 34.8 | Very low | 164 Ų | 164 | 135.2 Ų | 135.2 | 77% | 0.766 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -98.6 | 126.4 | 158.5 | -73 | -175.5 | 157.4 | 0 | 0 | 108.2 | ||
| 18 | N | 27.5 | Very low | 36.7 | Very low | 156 Ų | 156 | 136.7 Ų | 136.7 | 83% | 0.834 | 73% | 0.727 | S | S | * | * | trans | 92.4 | 35.8 | 175.4 | -54.2 | -32.1 | 0 | 0 | 0 | 119.1 | ||||
| 19 | T | 30.4 | Very low | 38.9 | Very low | 116 Ų | 116 | 134.6 Ų | 134.6 | 71% | 0.712 | 71% | 0.711 | S | S | * | * | trans | -84.4 | 108.2 | 143.2 | -19.5 | 0 | 0 | 0 | 0 | 106.3 | D21 | T19-D21 PolarHBondContact O-N 2.87Š| ||
| 20 | N | 30.3 | Very low | 41.3 | Very low | 148 Ų | 148 | 130.3 Ų | 130.3 | 79% | 0.791 | 70% | 0.696 | S | S | * | * | trans | -56.5 | 87.1 | 162.8 | -78.1 | -36.9 | 0 | 0 | 0 | 107.8 | I22 | N20-I22 PolarHBondContact O-N 3.26Š| ||
| 21 | D | 32.6 | Very low | 43.6 | Very low | 138 Ų | 138 | 125 Ų | 125 | 74% | 0.738 | 67% | 0.668 | S | S | * | * | trans | -60.4 | 96.5 | 155.3 | -84.1 | -26.4 | 0 | 0 | 0 | 104.7 | T19 V23 | T19-D21 PolarHBondContact O-N 2.87Å; D21-V23 PolarHBondContact O-N 3.27Å | ||
| 22 | I | 36.4 | Very low | 46.4 | Very low | 156 Ų | 156 | 122.2 Ų | 122.2 | 80% | 0.8 | 65% | 0.65 | S | S | * | * | trans | -56.5 | 93.1 | 159 | -60.7 | 172 | 0 | 0 | 0 | 103.5 | N20 G24 | N20-I22 PolarHBondContact O-N 3.26Å; I22-G24 PolarHBondContact O-N 3.04Å | ||
| 23 | V | 38 | Very low | 49.2 | Very low | 126 Ų | 126 | 117.5 Ų | 117.5 | 76% | 0.764 | 63% | 0.626 | S | S | * | * | trans | -62 | 89.8 | 171.3 | 178.1 | 0 | 0 | 0 | 0 | 104.1 | D21 V25 | D21-V23 PolarHBondContact O-N 3.27Å; V23-V25 PolarHBondContact O-N 3Å | ||
| 24 | G | 37.2 | Very low | 51.8 | Low | 50 Ų | 50 | 117.8 Ų | 117.8 | 52% | 0.515 | 63% | 0.627 | S | S | . | * | trans | -52.5 | 120.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 106.9 | I22 K26 | I22-G24 PolarHBondContact O-N 3.04Å; G24-K26 VanDerWaalsContact C-N 3.34Å; G24-K26 PolarHBondContact O-N 3.36Å | ||
| 25 | V | 46.8 | Very low | 54.5 | Low | 144 Ų | 144 | 114 Ų | 114 | 87% | 0.873 | 61% | 0.612 | S | S | * | * | trans | -57.5 | 100.6 | 179.7 | 178.3 | 0 | 0 | 0 | 0 | 107.1 | V23 | V23-V25 PolarHBondContact O-N 3Š| ||
| 26 | K | 49.6 | Very low | 57.1 | Low | 195 Ų | 195 | 107.3 Ų | 107.3 | 85% | 0.848 | 58% | 0.576 | S | S | * | * | P | Polyproline II helix | trans | -76.6 | 128.2 | 173.8 | -81.2 | -177.1 | 177.5 | 174.3 | 0 | 107.8 | G24 E28 | G24-K26 VanDerWaalsContact C-N 3.34Å; G24-K26 PolarHBondContact O-N 3.36Å; K26-E28 PolarHBondContact O-N 2.92Å |
| 27 | M | 58.2 | Low | 59.8 | Low | 91 Ų | 91 | 99.5 Ų | 99.5 | 45% | 0.448 | 54% | 0.543 | S | S | . | . | P | Polyproline II helix | trans | -56.1 | 132.5 | 175.3 | -71.3 | -92.9 | -96 | 0 | 0 | 110.1 | K29 E245 | M27-K29 PolarHBondContact O-N 3.48Å; M27-E245 HydrophobicContact CB-CG 4.1Å; M27-E245 VanDerWaalsContact CE-CD 3.46Å; M27-E245 HydrophobicContact CE-CG 3.63Å; M27-E245 WeakPolarHBondContact CE-OE1 3.45Å; M27-E245 HydrophobicContact SD-CG 4.48Å |
| 28 | E | 73.6 | Confident | 62.5 | Low | 157 Ų | 157 | 95.5 Ų | 95.5 | 73% | 0.734 | 53% | 0.53 | S | S | * | . | P | Polyproline II helix | trans | -68.3 | 130.1 | -180 | -168.4 | -177.6 | 174.6 | 0 | 0 | 110.1 | K26 T30 | K26-E28 PolarHBondContact O-N 2.92Å; E28-T30 HydrophobicContact CB-CG2 4.14Å; E28-T30 HydrophobicContact CG-CG2 3.92Å; E28-T30 PolarHBondContact O-N 3.16Å |
| 29 | K | 80.3 | Confident | 65.1 | Low | 112 Ų | 112 | 90.5 Ų | 90.5 | 49% | 0.487 | 50% | 0.503 | S | S | . | . | trans | -76.4 | 84.7 | 179.8 | -72.1 | -176.7 | 174.2 | -172 | 0 | 111.4 | M27 E244 E245 M246 K247 | M27-K29 PolarHBondContact O-N 3.48Å; K29-E244 WeakPolarHBondContact CG-O 3.38Å; K29-E245 CarbonylContact C-O 3.52Å; K29-E245 VanDerWaalsContact CA-O 3.29Å; K29-E245 WeakPolarHBondContact CA-O 3.34Å; K29-M246 WeakPolarHBondContact CD-O 3.42Å; K29-K247 HydrophobicContact CB-CG 4.32Å; K29-K247 VanDerWaalsContact O-CE 3.23Å; K29-K247 WeakPolarHBondContact O-CE 3.5Å; K29-K247 VanDerWaalsContact O-CG 3.22Å; K29-K247 WeakPolarHBondContact O-CG 3.48Å | ||
| 30 | T | 83.1 | Confident | 67.7 | Low | 71 Ų | 71 | 85 Ų | 85 | 44% | 0.436 | 47% | 0.469 | S | S | . | . | trans | -100.1 | -23.2 | -176 | 57.7 | 0 | 0 | 0 | 0 | 113.4 | E28 G32 E245 K247 | E28-T30 HydrophobicContact CB-CG2 4.14Å; E28-T30 HydrophobicContact CG-CG2 3.92Å; E28-T30 PolarHBondContact O-N 3.16Å; T30-G32 PolarHBondContact O-N 3.29Å; T30-E245 PolarHBondContact N-O 2.86Å; T30-K247 WeakPolarHBondContact O-CE 3.41Å | ||
| 31 | I | 81.3 | Confident | 70.4 | Confident | 11 Ų | 11 | 79.1 Ų | 79.1 | 6% | 0.056 | 44% | 0.438 | C | S | . | . | B | Isolated β-bridge | trans | -86.2 | 114.7 | -170 | -54.4 | 179.4 | 0 | 0 | 0 | 111 | S36 I39 M242 E245 M246 K247 | I31-S36 WeakPolarHBondContact CG2-OG 3.49Å; I31-I39 HydrophobicContact CD1-CD1 4.22Å; I31-I39 HydrophobicContact CG2-CD1 4.1Å; I31-M242 HydrophobicContact CD1-CB 4.14Å; I31-M242 HydrophobicContact CD1-CE 3.85Å; I31-M242 HydrophobicContact CD1-SD 4.5Å; I31-E245 HydrophobicContact CD1-CB 3.69Å; I31-E245 HydrophobicContact CG1-CB 4.05Å; I31-E245 PolarHBondContact N-O 2.68Å; I31-M246 HydrophobicContact CB-CG 4.38Å; I31-M246 HydrophobicContact CG2-CG 4.38Å; I31-M246 WeakPolarHBondContact O-CA 3.39Å; I31-K247 PolarHBondContact O-N 3.24Å |
| 32 | G | 88.9 | Confident | 72.6 | Confident | 16 Ų | 16 | 73.2 Ų | 73.2 | 17% | 0.165 | 41% | 0.409 | C | S | . | . | trans | -95.8 | -177.5 | 172 | 0 | 0 | 0 | 0 | 0 | 113.4 | T30 V34 S35 S36 | T30-G32 PolarHBondContact O-N 3.29Å; G32-V34 PolarHBondContact O-N 2.96Å; G32-S35 PolarHBondContact O-N 2.96Å; G32-S36 WeakPolarHBondContact O-CB 3.29Å; G32-S36 PolarHBondContact O-N 2.89Å; G32-S36 PolarHBondContact O-OG 3.34Å | ||
| 33 | L | 90.4 | Very high | 74.7 | Confident | 39 Ų | 39 | 67.8 Ų | 67.8 | 20% | 0.204 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -57 | -50.1 | -179.1 | 177.4 | 59.7 | 0 | 0 | 0 | 114 | S35 S36 I37 D252 I255 A256 | L33-S35 PolarHBondContact O-N 3.05Å; L33-S36 VanDerWaalsContact O-CB 3.3Å; L33-S36 WeakPolarHBondContact O-CB 3.44Å; L33-S36 PolarHBondContact O-N 3.47Å; L33-S36 VanDerWaalsContact O-N 3.14Å; L33-I37 HydrophobicContact CD1-CD1 4.01Å; L33-I37 HydrophobicContact CD1-CG1 4.27Å; L33-I37 HydrophobicContact CG-CD1 4.08Å; L33-I37 WeakPolarHBondContact O-CG1 3.4Å; L33-I37 PolarHBondContact O-N 3.19Å; L33-D252 HydrophobicContact CB-CB 4.13Å; L33-D252 HydrophobicContact CD1-CB 4.09Å; L33-D252 WeakPolarHBondContact CD1-O 3.43Å; L33-D252 PolarHBondContact N-OD2 2.97Å; L33-I255 HydrophobicContact CD1-CB 3.98Å; L33-I255 HydrophobicContact CD1-CG2 3.84Å; L33-I255 HydrophobicContact CD2-CG2 4.19Å; L33-A256 HydrophobicContact CD1-CB 4.16Å |
| 34 | V | 88.4 | Confident | 77.1 | Confident | 112 Ų | 112 | 62 Ų | 62 | 68% | 0.679 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -62.9 | -46 | -178.1 | 178.2 | 0 | 0 | 0 | 0 | 110.4 | G32 S36 I37 T38 | G32-V34 PolarHBondContact O-N 2.96Å; V34-S36 VanDerWaalsContact C-N 3.26Å; V34-S36 PolarHBondContact O-N 3.23Å; V34-I37 PolarHBondContact O-N 3.43Å; V34-T38 PolarHBondContact O-N 3.14Å; V34-T38 PolarHBondContact O-OG1 3.16Å; V34-T38 VanDerWaalsContact O-OG1 3.13Å |
| 35 | S | 83.1 | Confident | 79.4 | Confident | 59 Ų | 59 | 59.9 Ų | 59.9 | 41% | 0.413 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -58.2 | -41 | 174.4 | -52.6 | 0 | 0 | 0 | 0 | 111.5 | G32 L33 T38 I39 | G32-S35 PolarHBondContact O-N 2.96Å; L33-S35 PolarHBondContact O-N 3.05Å; S35-T38 PolarHBondContact O-N 2.78Å; S35-I39 WeakPolarHBondContact O-CB 3.47Å; S35-I39 WeakPolarHBondContact O-CD1 3.35Å; S35-I39 WeakPolarHBondContact O-CG1 3.21Å; S35-I39 PolarHBondContact O-N 3.16Å |
| 36 | S | 85.4 | Confident | 80.9 | Confident | 0 Ų | 0 | 53.6 Ų | 53.6 | 0% | 0 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -61.5 | -45.2 | 177 | -59.1 | 0 | 0 | 0 | 0 | 112.3 | I31 G32 L33 V34 I39 I40 M246 | I31-S36 WeakPolarHBondContact CG2-OG 3.49Å; G32-S36 WeakPolarHBondContact O-CB 3.29Å; G32-S36 PolarHBondContact O-N 2.89Å; G32-S36 PolarHBondContact O-OG 3.34Å; L33-S36 VanDerWaalsContact O-CB 3.3Å; L33-S36 WeakPolarHBondContact O-CB 3.44Å; L33-S36 PolarHBondContact O-N 3.47Å; L33-S36 VanDerWaalsContact O-N 3.14Å; V34-S36 VanDerWaalsContact C-N 3.26Å; V34-S36 PolarHBondContact O-N 3.23Å; S36-I39 PolarHBondContact O-N 3.15Å; S36-I40 WeakPolarHBondContact O-CG1 3.23Å; S36-I40 PolarHBondContact O-N 3Å; S36-M246 WeakPolarHBondContact OG-CE 3.28Å |
| 37 | I | 88.9 | Confident | 82.2 | Confident | 28 Ų | 28 | 44.5 Ų | 44.5 | 14% | 0.144 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -61.7 | -49.4 | 176.1 | -69.7 | 166 | 0 | 0 | 0 | 110.2 | L33 V34 I39 I40 I41 A256 F259 | L33-I37 HydrophobicContact CD1-CD1 4.01Å; L33-I37 HydrophobicContact CD1-CG1 4.27Å; L33-I37 HydrophobicContact CG-CD1 4.08Å; L33-I37 WeakPolarHBondContact O-CG1 3.4Å; L33-I37 PolarHBondContact O-N 3.19Å; V34-I37 PolarHBondContact O-N 3.43Å; I37-I39 VanDerWaalsContact C-N 3.3Å; I37-I39 PolarHBondContact O-N 3.15Å; I37-I40 PolarHBondContact O-N 3.34Å; I37-I41 HydrophobicContact CG2-CD1 3.56Å; I37-I41 HydrophobicContact CG2-CG1 4.18Å; I37-I41 WeakPolarHBondContact O-CB 3.19Å; I37-I41 WeakPolarHBondContact O-CG1 3.41Å; I37-I41 PolarHBondContact O-N 3.35Å; I37-A256 HydrophobicContact CG1-CB 3.92Å; I37-F259 HydrophobicContact CD1-CD1 3.99Å; I37-F259 HydrophobicContact CD1-CG 4.5Å; I37-F259 HydrophobicContact CG1-CD1 4.23Å; I37-F259 HydrophobicContact CG2-CD1 3.71Å; I37-F259 HydrophobicContact CG2-CE1 3.92Å |
| 38 | T | 82.6 | Confident | 83.6 | Confident | 80 Ų | 80 | 40.5 Ų | 40.5 | 49% | 0.491 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -62 | -38.8 | 179.6 | -55.6 | 0 | 0 | 0 | 0 | 111.8 | V34 S35 G42 | V34-T38 PolarHBondContact O-N 3.14Å; V34-T38 PolarHBondContact O-OG1 3.16Å; V34-T38 VanDerWaalsContact O-OG1 3.13Å; S35-T38 PolarHBondContact O-N 2.78Å; T38-G42 WeakPolarHBondContact O-CA 3.4Å; T38-G42 PolarHBondContact O-N 3.01Å |
| 39 | I | 81.2 | Confident | 84.5 | Confident | 52 Ų | 52 | 33 Ų | 33 | 27% | 0.267 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -62.9 | -47.7 | 175.6 | -72 | 163.5 | 0 | 0 | 0 | 110.3 | I31 S35 S36 I37 S43 | I31-I39 HydrophobicContact CD1-CD1 4.22Å; I31-I39 HydrophobicContact CG2-CD1 4.1Å; S35-I39 WeakPolarHBondContact O-CB 3.47Å; S35-I39 WeakPolarHBondContact O-CD1 3.35Å; S35-I39 WeakPolarHBondContact O-CG1 3.21Å; S35-I39 PolarHBondContact O-N 3.16Å; S36-I39 PolarHBondContact O-N 3.15Å; I37-I39 VanDerWaalsContact C-N 3.3Å; I37-I39 PolarHBondContact O-N 3.15Å; I39-S43 WeakPolarHBondContact O-CB 3.42Å; I39-S43 PolarHBondContact O-N 3.18Å; I39-S43 PolarHBondContact O-OG 2.85Å |
| 40 | I | 85 | Confident | 85 | Confident | 1 Ų | 1 | 27.9 Ų | 27.9 | 1% | 0.005 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -67.1 | -52.6 | -179.4 | -67 | 176.1 | 0 | 0 | 0 | 110.7 | S36 I37 G42 S43 I44 L239 A256 I257 | S36-I40 WeakPolarHBondContact O-CG1 3.23Å; S36-I40 PolarHBondContact O-N 3Å; I37-I40 PolarHBondContact O-N 3.34Å; I40-G42 VanDerWaalsContact C-N 3.3Å; I40-G42 PolarHBondContact O-N 2.89Å; I40-S43 PolarHBondContact O-N 3.1Å; I40-I44 HydrophobicContact CG2-CD1 3.48Å; I40-I44 VanDerWaalsContact CG2-CD1 3.48Å; I40-I44 HydrophobicContact CG2-CG1 4.09Å; I40-I44 WeakPolarHBondContact O-CG1 3.4Å; I40-I44 PolarHBondContact O-N 3.49Å; I40-L239 HydrophobicContact CD1-CB 3.99Å; I40-L239 HydrophobicContact CD1-CD2 3.55Å; I40-L239 HydrophobicContact CD1-CG 4.4Å; I40-L239 HydrophobicContact CG1-CB 3.92Å; I40-L239 HydrophobicContact CG1-CD2 4.06Å; I40-A256 HydrophobicContact CD1-CB 4.06Å; I40-I257 HydrophobicContact CD1-CG1 3.75Å |
| 41 | I | 86.6 | Confident | 85.3 | Confident | 24 Ų | 24 | 25 Ų | 25 | 12% | 0.123 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -58.3 | -46.6 | 179.6 | -66.6 | 179.6 | 0 | 0 | 0 | 109.9 | I37 S43 I44 I45 F259 V263 | I37-I41 HydrophobicContact CG2-CD1 3.56Å; I37-I41 HydrophobicContact CG2-CG1 4.18Å; I37-I41 WeakPolarHBondContact O-CB 3.19Å; I37-I41 WeakPolarHBondContact O-CG1 3.41Å; I37-I41 PolarHBondContact O-N 3.35Å; I41-S43 PolarHBondContact O-N 3.37Å; I41-I44 PolarHBondContact O-N 3.35Å; I41-I45 HydrophobicContact CG2-CD1 3.53Å; I41-I45 HydrophobicContact CG2-CG1 4.01Å; I41-I45 WeakPolarHBondContact O-CA 3.43Å; I41-I45 WeakPolarHBondContact O-CB 3.39Å; I41-I45 WeakPolarHBondContact O-CG1 3.39Å; I41-I45 PolarHBondContact O-N 3.04Å; I41-F259 HydrophobicContact CD1-CE1 4.47Å; I41-V263 HydrophobicContact CD1-CB 4.36Å; I41-V263 HydrophobicContact CD1-CG1 4.09Å |
| 42 | G | 80.7 | Confident | 85.8 | Confident | 14 Ų | 14 | 24.5 Ų | 24.5 | 14% | 0.144 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -67 | -21.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | T38 I40 K185 | T38-G42 WeakPolarHBondContact O-CA 3.4Å; T38-G42 PolarHBondContact O-N 3.01Å; I40-G42 VanDerWaalsContact C-N 3.3Å; I40-G42 PolarHBondContact O-N 2.89Å; G42-K185 PolarHBondContact O-NZ 3.08Å |
| 43 | S | 79.7 | Confident | 86.1 | Confident | 41 Ų | 41 | 24 Ų | 24 | 29% | 0.287 | 15% | 0.15 | S | C | . | . | H | α-helix | trans | -85.5 | -41.1 | 175.3 | -62 | 0 | 0 | 0 | 0 | 111.9 | I39 I40 I41 | I39-S43 WeakPolarHBondContact O-CB 3.42Å; I39-S43 PolarHBondContact O-N 3.18Å; I39-S43 PolarHBondContact O-OG 2.85Å; I40-S43 PolarHBondContact O-N 3.1Å; I41-S43 PolarHBondContact O-N 3.37Å |
| 44 | I | 87.3 | Confident | 86.3 | Confident | 4 Ų | 4 | 22.7 Ų | 22.7 | 2% | 0.021 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -75.4 | -51.9 | -179.9 | -57.2 | 169.3 | 0 | 0 | 0 | 110.6 | I40 I41 G46 S232 Y233 A234 W236 V264 Y268 | I40-I44 HydrophobicContact CG2-CD1 3.48Å; I40-I44 VanDerWaalsContact CG2-CD1 3.48Å; I40-I44 HydrophobicContact CG2-CG1 4.09Å; I40-I44 WeakPolarHBondContact O-CG1 3.4Å; I40-I44 PolarHBondContact O-N 3.49Å; I41-I44 PolarHBondContact O-N 3.35Å; I44-G46 VanDerWaalsContact C-N 3.33Å; I44-G46 PolarHBondContact O-N 3.42Å; I44-S232 WeakPolarHBondContact CG2-O 3.48Å; I44-Y233 HydrophobicContact CG2-CD1 4.43Å; I44-A234 WeakPolarHBondContact CA-O 3.29Å; I44-W236 HydrophobicContact CD1-CB 3.77Å; I44-W236 HydrophobicContact CG1-CB 4.22Å; I44-V264 HydrophobicContact CB-CG1 4.48Å; I44-V264 HydrophobicContact CB-CG2 4.21Å; I44-V264 HydrophobicContact CD1-CG2 4.33Å; I44-V264 HydrophobicContact CG2-CB 4.48Å; I44-V264 HydrophobicContact CG2-CG1 3.68Å; I44-V264 HydrophobicContact CG2-CG2 4.28Å; I44-Y268 HydrophobicContact CG2-CE2 4.42Å; I44-Y268 PolarHBondContact O-OH 3.2Å |
| 45 | I | 85.7 | Confident | 86.4 | Confident | 7 Ų | 7 | 17.3 Ų | 17.3 | 4% | 0.036 | 11% | 0.111 | C | C | . | . | S | Bend | trans | -66.6 | 98.5 | 175.1 | -58.7 | -171.8 | 0 | 0 | 0 | 106.9 | I41 K185 L189 V264 V267 Y268 | I41-I45 HydrophobicContact CG2-CD1 3.53Å; I41-I45 HydrophobicContact CG2-CG1 4.01Å; I41-I45 WeakPolarHBondContact O-CA 3.43Å; I41-I45 WeakPolarHBondContact O-CB 3.39Å; I41-I45 WeakPolarHBondContact O-CG1 3.39Å; I41-I45 PolarHBondContact O-N 3.04Å; I45-K185 HydrophobicContact CG2-CD 4.28Å; I45-K185 HydrophobicContact CG2-CG 4.41Å; I45-K185 WeakPolarHBondContact O-CD 3.5Å; I45-K185 WeakPolarHBondContact O-CE 3.49Å; I45-K185 PolarHBondContact O-NZ 3.28Å; I45-L189 HydrophobicContact CG2-CD1 3.27Å; I45-V264 HydrophobicContact CD1-CG2 4.17Å; I45-V264 HydrophobicContact CG1-CG1 4.42Å; I45-V264 HydrophobicContact CG1-CG2 3.78Å; I45-V267 HydrophobicContact CD1-CG1 4.29Å; I45-Y268 WeakPolarHBondContact CA-OH 3.28Å; I45-Y268 HydrophobicContact CG1-CE1 4.31Å |
| 46 | G | 78.4 | Confident | 87 | Confident | 12 Ų | 12 | 14.5 Ų | 14.5 | 12% | 0.124 | 9% | 0.091 | C | C | . | . | S | Bend | trans | -133.5 | -142.6 | -178.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | I44 G48 | I44-G46 VanDerWaalsContact C-N 3.33Å; I44-G46 PolarHBondContact O-N 3.42Å; G46-G48 VanDerWaalsContact C-N 3.34Å |
| 47 | S | 78.4 | Confident | 87.5 | Confident | 4 Ų | 4 | 14.9 Ų | 14.9 | 3% | 0.028 | 9% | 0.093 | C | C | . | . | S | Bend | trans | -78.5 | -16.8 | 175.6 | 46.7 | 0 | 0 | 0 | 0 | 113.8 | I49 F50 I129 T314 | S47-I49 VanDerWaalsContact C-N 3.29Å; S47-I49 PolarHBondContact O-N 3.22Å; S47-F50 WeakPolarHBondContact O-CB 3.28Å; S47-F50 PolarHBondContact O-N 2.95Å; S47-I129 WeakPolarHBondContact OG-CG1 3.24Å; S47-I129 WeakPolarHBondContact OG-CG2 3.48Å; S47-T314 VanDerWaalsContact CB-CG2 3.43Å |
| 48 | G | 87.5 | Confident | 87.8 | Confident | 6 Ų | 6 | 18.3 Ų | 18.3 | 6% | 0.062 | 11% | 0.109 | C | C | . | . | G | 310 helix | trans | -56.9 | -39.8 | -174.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | G46 F50 V51 S52 S232 | G46-G48 VanDerWaalsContact C-N 3.34Å; G48-F50 PolarHBondContact O-N 3.35Å; G48-F50 VanDerWaalsContact O-N 3.13Å; G48-V51 PolarHBondContact O-N 2.95Å; G48-S52 VanDerWaalsContact O-CB 3.29Å; G48-S52 WeakPolarHBondContact O-CB 3.47Å; G48-S52 PolarHBondContact O-N 3.29Å; G48-S52 PolarHBondContact O-OG 2.97Å; G48-S232 WeakPolarHBondContact CA-OG 3.44Å; G48-S232 PolarHBondContact O-OG 3.32Å |
| 49 | I | 91.7 | Very high | 88.3 | Confident | 0 Ų | 0 | 15.8 Ų | 15.8 | 0% | 0 | 9% | 0.092 | C | C | . | . | G | 310 helix | trans | -63.8 | -17.7 | 178.7 | -167.8 | 54.3 | 0 | 0 | 0 | 113.7 | S47 P53 W70 L189 S232 Y268 A271 | S47-I49 VanDerWaalsContact C-N 3.29Å; S47-I49 PolarHBondContact O-N 3.22Å; I49-P53 WeakPolarHBondContact O-CD 3.43Å; I49-P53 WeakPolarHBondContact O-CG 3.29Å; I49-W70 HydrophobicContact CD1-CH2 3.55Å; I49-W70 HydrophobicContact CD1-CZ2 3.89Å; I49-W70 HydrophobicContact CD1-CZ3 4.13Å; I49-L189 HydrophobicContact CG1-CD2 4Å; I49-L189 HydrophobicContact CG2-CD1 4.41Å; I49-L189 HydrophobicContact CG2-CD2 3.95Å; I49-S232 PolarHBondContact N-OG 3.42Å; I49-Y268 HydrophobicContact CB-CD1 4.02Å; I49-Y268 HydrophobicContact CB-CE1 3.68Å; I49-Y268 HydrophobicContact CD1-CD1 3.59Å; I49-Y268 HydrophobicContact CD1-CE1 4.15Å; I49-Y268 HydrophobicContact CD1-CG 3.86Å; I49-Y268 HydrophobicContact CG1-CD1 3.73Å; I49-Y268 HydrophobicContact CG1-CE1 3.93Å; I49-Y268 HydrophobicContact CG1-CG 4.49Å; I49-Y268 HydrophobicContact CG2-CE1 4.28Å; I49-A271 HydrophobicContact CD1-CB 4.42Å; I49-A271 HydrophobicContact CG1-CB 4.41Å |
| 50 | F | 90 | Very high | 89 | Confident | 4 Ų | 4 | 13.3 Ų | 13.3 | 2% | 0.018 | 8% | 0.079 | C | C | . | . | G | 310 helix | trans | -93.2 | -5.9 | 177.8 | -60.7 | -60.3 | 0 | 0 | 0 | 113 | S47 G48 Y136 L189 I192 A291 V310 | S47-F50 WeakPolarHBondContact O-CB 3.28Å; S47-F50 PolarHBondContact O-N 2.95Å; G48-F50 PolarHBondContact O-N 3.35Å; G48-F50 VanDerWaalsContact O-N 3.13Å; F50-Y136 HydrophobicContact CB-CE2 4.1Å; F50-Y136 WeakPolarHBondContact CB-OH 3.35Å; F50-Y136 PolarHBondContact O-OH 2.95Å; F50-L189 HydrophobicContact CZ-CD2 4.39Å; F50-L189 HydrophobicContact CZ-CG 4.47Å; F50-I192 HydrophobicContact CE1-CD1 4.2Å; F50-A291 HydrophobicContact CD1-CB 3.89Å; F50-A291 HydrophobicContact CE1-CB 4.08Å; F50-V310 HydrophobicContact CB-CG1 4.01Å; F50-V310 HydrophobicContact CD1-CG1 4.26Å; F50-V310 HydrophobicContact CD1-CG2 3.78Å; F50-V310 HydrophobicContact CD2-CB 4.47Å; F50-V310 HydrophobicContact CD2-CG1 3.66Å; F50-V310 HydrophobicContact CD2-CG2 4.21Å; F50-V310 HydrophobicContact CE1-CG2 3.64Å; F50-V310 HydrophobicContact CE2-CG1 4.2Å; F50-V310 HydrophobicContact CE2-CG2 4.09Å; F50-V310 HydrophobicContact CG-CG1 3.7Å; F50-V310 HydrophobicContact CG-CG2 4.07Å; F50-V310 HydrophobicContact CZ-CG2 3.81Å |
| 51 | V | 89.6 | Confident | 89.5 | Confident | 12 Ų | 12 | 18.7 Ų | 18.7 | 7% | 0.073 | 11% | 0.105 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -119.9 | -41.5 | -179.4 | -173.5 | 0 | 0 | 0 | 0 | 112.2 | G48 T132 Y373 M376 | G48-V51 PolarHBondContact O-N 2.95Å; V51-T132 HydrophobicContact CG2-CG2 3.37Å; V51-T132 WeakPolarHBondContact CG2-OG1 3.26Å; V51-Y373 HydrophobicContact CG1-CE1 4.25Å; V51-M376 HydrophobicContact CB-CE 3.92Å; V51-M376 HydrophobicContact CG1-CE 3.42Å; V51-M376 VanDerWaalsContact CG1-CE 3.42Å; V51-M376 HydrophobicContact CG1-SD 4.27Å |
| 52 | S | 92.8 | Very high | 89.9 | Confident | 0 Ų | 0 | 17.7 Ų | 17.7 | 0% | 0 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -69.6 | -27.2 | -170.4 | -48.3 | 0 | 0 | 0 | 0 | 115 | G48 T54 G55 I56 S228 S232 | G48-S52 VanDerWaalsContact O-CB 3.29Å; G48-S52 WeakPolarHBondContact O-CB 3.47Å; G48-S52 PolarHBondContact O-N 3.29Å; G48-S52 PolarHBondContact O-OG 2.97Å; S52-T54 VanDerWaalsContact C-N 3.32Å; S52-T54 PolarHBondContact O-N 2.9Å; S52-G55 PolarHBondContact O-N 3.36Å; S52-I56 VanDerWaalsContact O-CG1 3.29Å; S52-I56 WeakPolarHBondContact O-CG1 3.33Å; S52-I56 PolarHBondContact O-N 2.83Å; S52-S228 VanDerWaalsContact CB-O 3.27Å; S52-S228 WeakPolarHBondContact CB-O 3.3Å; S52-S228 PolarHBondContact OG-O 2.98Å; S52-S232 VanDerWaalsContact CB-OG 3.24Å; S52-S232 WeakPolarHBondContact CB-OG 3.46Å; S52-S232 PolarHBondContact OG-OG 3.45Å |
| 53 | P | 94.8 | Very high | 90.5 | Very high | 6 Ų | 6 | 17.6 Ų | 17.6 | 4% | 0.039 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -53.3 | -48.6 | 174.3 | -28.9 | 36.3 | 0 | 0 | 0 | 112.7 | I49 I56 L57 W70 N272 Y275 | I49-P53 WeakPolarHBondContact O-CD 3.43Å; I49-P53 WeakPolarHBondContact O-CG 3.29Å; P53-I56 PolarHBondContact O-N 2.95Å; P53-L57 VanDerWaalsContact O-CB 3.27Å; P53-L57 WeakPolarHBondContact O-CB 3.49Å; P53-L57 PolarHBondContact O-N 3.33Å; P53-W70 HydrophobicContact CG-CZ2 4.17Å; P53-N272 WeakPolarHBondContact CB-OD1 3.21Å; P53-Y275 HydrophobicContact CG-CD2 4.33Å; P53-Y275 HydrophobicContact CG-CE2 3.99Å |
| 54 | T | 93.4 | Very high | 91.3 | Very high | 10 Ų | 10 | 15.9 Ų | 15.9 | 6% | 0.061 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -63.2 | -45.9 | 177.9 | -56 | 0 | 0 | 0 | 0 | 111.4 | S52 I56 L57 E58 I284 V290 Y373 | S52-T54 VanDerWaalsContact C-N 3.32Å; S52-T54 PolarHBondContact O-N 2.9Å; T54-I56 PolarHBondContact O-N 3.22Å; T54-L57 PolarHBondContact O-N 2.93Å; T54-E58 VanDerWaalsContact O-CB 3.28Å; T54-E58 WeakPolarHBondContact O-CB 3.18Å; T54-E58 PolarHBondContact O-N 3.28Å; T54-I284 WeakPolarHBondContact CG2-O 3.5Å; T54-I284 PolarHBondContact OG1-O 3.36Å; T54-V290 WeakPolarHBondContact OG1-CG2 3.46Å; T54-Y373 WeakPolarHBondContact CB-OH 3.29Å; T54-Y373 WeakPolarHBondContact CG2-OH 3.42Å |
| 55 | G | 92.3 | Very high | 91.7 | Very high | 0 Ų | 0 | 15.7 Ų | 15.7 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -65.4 | -35.6 | -179.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | S52 N59 | S52-G55 PolarHBondContact O-N 3.36Å; G55-N59 PolarHBondContact O-ND2 3.43Å |
| 56 | I | 95.4 | Very high | 92.3 | Very high | 0 Ų | 0 | 15.8 Ų | 15.8 | 0% | 0 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -71.1 | -47.5 | 174.9 | -65.5 | 164 | 0 | 0 | 0 | 110 | S52 P53 T54 E58 N59 M60 I69 W70 A225 | S52-I56 VanDerWaalsContact O-CG1 3.29Å; S52-I56 WeakPolarHBondContact O-CG1 3.33Å; S52-I56 PolarHBondContact O-N 2.83Å; P53-I56 PolarHBondContact O-N 2.95Å; T54-I56 PolarHBondContact O-N 3.22Å; I56-E58 VanDerWaalsContact C-N 3.34Å; I56-E58 PolarHBondContact O-N 3.35Å; I56-N59 PolarHBondContact O-N 3.4Å; I56-M60 HydrophobicContact CG2-CG 4.2Å; I56-M60 WeakPolarHBondContact O-CB 3.49Å; I56-M60 PolarHBondContact O-N 3.28Å; I56-I69 HydrophobicContact CD1-CG2 4.42Å; I56-I69 HydrophobicContact CG1-CG2 4.33Å; I56-I69 HydrophobicContact CG2-CB 3.98Å; I56-I69 HydrophobicContact CG2-CG1 4.44Å; I56-I69 HydrophobicContact CG2-CG2 4.02Å; I56-W70 HydrophobicContact CD1-CD2 3.84Å; I56-W70 HydrophobicContact CD1-CG 4.18Å; I56-W70 HydrophobicContact CD1-CH2 4.35Å; I56-W70 HydrophobicContact CD1-CZ2 3.6Å; I56-W70 VanDerWaalsContact CD1-NE1 3.31Å; I56-A225 HydrophobicContact CG2-CB 4.4Å |
| 57 | L | 95.8 | Very high | 93.1 | Very high | 8 Ų | 8 | 16.6 Ų | 16.6 | 4% | 0.042 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -64.7 | -38.1 | -177.2 | -175.3 | 62.2 | 0 | 0 | 0 | 112 | P53 T54 N59 Q61 S66 L281 I284 L285 | P53-L57 VanDerWaalsContact O-CB 3.27Å; P53-L57 WeakPolarHBondContact O-CB 3.49Å; P53-L57 PolarHBondContact O-N 3.33Å; T54-L57 PolarHBondContact O-N 2.93Å; L57-N59 VanDerWaalsContact C-N 3.27Å; L57-N59 PolarHBondContact O-N 3.05Å; L57-Q61 VanDerWaalsContact O-CA 3.26Å; L57-Q61 WeakPolarHBondContact O-CA 3.26Å; L57-Q61 PolarHBondContact O-N 3.02Å; L57-S66 WeakPolarHBondContact CA-OG 3.41Å; L57-L281 HydrophobicContact CD1-CD2 4.05Å; L57-L281 HydrophobicContact CD2-CB 4.15Å; L57-L281 HydrophobicContact CD2-CD2 3.87Å; L57-I284 HydrophobicContact CD2-CB 3.84Å; L57-I284 HydrophobicContact CD2-CD1 4.41Å; L57-I284 HydrophobicContact CD2-CG2 3.66Å; L57-L285 HydrophobicContact CB-CD2 4.08Å; L57-L285 HydrophobicContact CD2-CD2 4.13Å; L57-L285 HydrophobicContact CD2-CG 4.04Å; L57-L285 HydrophobicContact CG-CD2 3.91Å; L57-L285 HydrophobicContact CG-CG 4.23Å |
| 58 | E | 94.5 | Very high | 94 | Very high | 100 Ų | 100 | 20.3 Ų | 20.3 | 47% | 0.467 | 10% | 0.104 | S | C | . | . | H | α-helix | trans | -59.9 | -39.7 | 177 | -176.8 | -179.4 | -170.3 | 0 | 0 | 111.7 | T54 I56 L285 | T54-E58 VanDerWaalsContact O-CB 3.28Å; T54-E58 WeakPolarHBondContact O-CB 3.18Å; T54-E58 PolarHBondContact O-N 3.28Å; I56-E58 VanDerWaalsContact C-N 3.34Å; I56-E58 PolarHBondContact O-N 3.35Å; E58-L285 VanDerWaalsContact CA-CD2 3.47Å; E58-L285 HydrophobicContact CB-CD2 3.8Å |
| 59 | N | 94.1 | Very high | 94.5 | Very high | 26 Ų | 26 | 20.4 Ų | 20.4 | 14% | 0.139 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -83.5 | -37.9 | -177.7 | -76 | -81 | 0 | 0 | 0 | 112.8 | G55 I56 L57 N216 S221 K224 A225 | G55-N59 PolarHBondContact O-ND2 3.43Å; I56-N59 PolarHBondContact O-N 3.4Å; L57-N59 VanDerWaalsContact C-N 3.27Å; L57-N59 PolarHBondContact O-N 3.05Å; N59-N216 WeakPolarHBondContact O-CB 3.48Å; N59-S221 WeakPolarHBondContact O-CB 3.43Å; N59-K224 HydrophobicContact CB-CB 4.48Å; N59-K224 VanDerWaalsContact OD1-CB 3.26Å; N59-K224 WeakPolarHBondContact OD1-CB 3.41Å; N59-K224 WeakPolarHBondContact OD1-CD 3.49Å; N59-A225 HydrophobicContact CB-CB 3.89Å |
| 60 | M | 95.9 | Very high | 94.8 | Very high | 0 Ų | 0 | 20.5 Ų | 20.5 | 0% | 0 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -87.5 | -21.5 | -178.6 | -64.3 | -48.5 | -57.7 | 0 | 0 | 113.7 | I56 S62 A65 I69 S215 N216 W217 I222 A225 | I56-M60 HydrophobicContact CG2-CG 4.2Å; I56-M60 WeakPolarHBondContact O-CB 3.49Å; I56-M60 PolarHBondContact O-N 3.28Å; M60-S62 PolarHBondContact O-N 2.9Å; M60-A65 HydrophobicContact CB-CB 4Å; M60-A65 HydrophobicContact CE-CB 3.75Å; M60-I69 HydrophobicContact CE-CD1 4.49Å; M60-I69 HydrophobicContact CE-CG1 4.37Å; M60-I69 HydrophobicContact CG-CG1 3.68Å; M60-I69 HydrophobicContact SD-CD1 4.02Å; M60-I69 HydrophobicContact SD-CG1 3.8Å; M60-S215 WeakPolarHBondContact O-CA 3.48Å; M60-N216 VanDerWaalsContact CE-O 3.29Å; M60-N216 WeakPolarHBondContact CE-O 3.33Å; M60-N216 PolarHBondContact O-N 2.93Å; M60-W217 HydrophobicContact CE-CE3 4.2Å; M60-W217 HydrophobicContact CE-CZ3 4.24Å; M60-I222 HydrophobicContact CE-CG1 4.23Å; M60-I222 HydrophobicContact SD-CG1 4.26Å; M60-A225 HydrophobicContact CG-CB 3.72Å; M60-A225 HydrophobicContact SD-CB 3.69Å |
| 61 | Q | 94.3 | Very high | 95.1 | Very high | 115 Ų | 115 | 23.8 Ų | 23.8 | 54% | 0.537 | 12% | 0.121 | S | C | . | . | trans | 59.7 | 1.5 | 178.4 | -60.9 | -174.4 | -39.7 | 0 | 0 | 116.4 | L57 G214 N216 | L57-Q61 VanDerWaalsContact O-CA 3.26Å; L57-Q61 WeakPolarHBondContact O-CA 3.26Å; L57-Q61 PolarHBondContact O-N 3.02Å; Q61-G214 VanDerWaalsContact CB-O 3.32Å; Q61-G214 WeakPolarHBondContact CB-O 3.47Å; Q61-N216 HydrophobicContact CB-CB 4.43Å; Q61-N216 HydrophobicContact CG-CB 4.26Å | ||
| 62 | S | 94.6 | Very high | 95.5 | Very high | 2 Ų | 2 | 24.3 Ų | 24.3 | 1% | 0.014 | 13% | 0.129 | C | C | . | . | S | Bend | trans | -137.5 | 152.9 | 174.7 | 109.2 | 0 | 0 | 0 | 0 | 111.9 | M60 A65 S66 P211 E213 S215 | M60-S62 PolarHBondContact O-N 2.9Å; S62-A65 VanDerWaalsContact OG-CB 3.3Å; S62-A65 WeakPolarHBondContact OG-CB 3.24Å; S62-A65 PolarHBondContact OG-N 3.5Å; S62-S66 WeakPolarHBondContact O-CB 3.29Å; S62-S66 PolarHBondContact O-N 3.31Å; S62-S66 VanDerWaalsContact O-N 3.07Å; S62-S66 PolarHBondContact O-OG 2.89Å; S62-P211 WeakPolarHBondContact CB-O 3.48Å; S62-P211 PolarHBondContact OG-O 3.33Å; S62-E213 WeakPolarHBondContact CB-O 3.39Å; S62-S215 WeakPolarHBondContact CB-OG 3.16Å; S62-S215 PolarHBondContact OG-OG 3.33Å |
| 63 | F | 94.4 | Very high | 95.7 | Very high | 12 Ų | 12 | 24.3 Ų | 24.3 | 5% | 0.053 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -63 | -53.4 | 176.5 | 168.1 | -119.5 | 0 | 0 | 0 | 112.9 | A65 S66 L67 F208 P211 V273 I276 L281 | F63-A65 PolarHBondContact O-N 3.35Å; F63-S66 WeakPolarHBondContact O-CA 3.35Å; F63-S66 WeakPolarHBondContact O-CB 3.39Å; F63-S66 PolarHBondContact O-N 3.27Å; F63-S66 VanDerWaalsContact O-N 3.11Å; F63-L67 HydrophobicContact CD2-CD1 4.45Å; F63-L67 HydrophobicContact CD2-CG 4.17Å; F63-L67 HydrophobicContact CE1-CD1 3.72Å; F63-L67 HydrophobicContact CE1-CG 4.44Å; F63-L67 HydrophobicContact CE2-CD1 3.67Å; F63-L67 HydrophobicContact CE2-CD2 3.87Å; F63-L67 HydrophobicContact CE2-CG 3.63Å; F63-L67 HydrophobicContact CZ-CD1 3.26Å; F63-L67 HydrophobicContact CZ-CD2 4.24Å; F63-L67 HydrophobicContact CZ-CG 3.81Å; F63-L67 PolarHBondContact O-N 3.5Å; F63-F208 HydrophobicContact CE1-CD1 4.15Å; F63-F208 HydrophobicContact CE1-CE1 4.18Å; F63-F208 HydrophobicContact CZ-CE1 4.31Å; F63-P211 HydrophobicContact CD1-CB 4.12Å; F63-P211 PolarHBondContact N-O 3.34Å; F63-V273 HydrophobicContact CZ-CG2 4.14Å; F63-I276 HydrophobicContact CD1-CD1 3.66Å; F63-I276 HydrophobicContact CD2-CB 4.32Å; F63-I276 HydrophobicContact CD2-CD1 3.76Å; F63-I276 HydrophobicContact CD2-CG1 4.03Å; F63-I276 HydrophobicContact CD2-CG2 3.56Å; F63-I276 HydrophobicContact CE1-CD1 3.31Å; F63-I276 HydrophobicContact CE1-CG1 4.37Å; F63-I276 HydrophobicContact CE2-CB 4.3Å; F63-I276 HydrophobicContact CE2-CD1 3.39Å; F63-I276 HydrophobicContact CE2-CG1 3.56Å; F63-I276 HydrophobicContact CE2-CG2 3.83Å; F63-I276 HydrophobicContact CG-CD1 3.86Å; F63-I276 HydrophobicContact CG-CG2 4.29Å; F63-I276 HydrophobicContact CZ-CD1 3.13Å; F63-I276 HydrophobicContact CZ-CG1 3.74Å; F63-L281 HydrophobicContact CB-CD1 4.26Å; F63-L281 HydrophobicContact CB-CD2 4.1Å |
| 64 | G | 95.7 | Very high | 95.8 | Very high | 5 Ų | 5 | 24.1 Ų | 24.1 | 5% | 0.052 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -60.7 | -42.8 | -178 | 0 | 0 | 0 | 0 | 0 | 112.3 | S66 L67 I68 P211 | G64-S66 VanDerWaalsContact C-N 3.34Å; G64-L67 PolarHBondContact O-N 3.18Å; G64-I68 WeakPolarHBondContact O-CG1 3.3Å; G64-I68 PolarHBondContact O-N 3.08Å; G64-I68 VanDerWaalsContact O-N 3.11Å; G64-P211 WeakPolarHBondContact CA-O 3.36Å; G64-P211 PolarHBondContact N-O 3.31Å |
| 65 | A | 96.8 | Very high | 96 | Very high | 0 Ų | 0 | 28.1 Ų | 28.1 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -65 | -39.6 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | M60 S62 F63 L67 I68 I69 W217 | M60-A65 HydrophobicContact CB-CB 4Å; M60-A65 HydrophobicContact CE-CB 3.75Å; S62-A65 VanDerWaalsContact OG-CB 3.3Å; S62-A65 WeakPolarHBondContact OG-CB 3.24Å; S62-A65 PolarHBondContact OG-N 3.5Å; F63-A65 PolarHBondContact O-N 3.35Å; A65-L67 PolarHBondContact O-N 2.97Å; A65-I68 WeakPolarHBondContact O-CB 3.43Å; A65-I68 PolarHBondContact O-N 3.4Å; A65-I69 WeakPolarHBondContact O-CG1 3.4Å; A65-I69 PolarHBondContact O-N 3.05Å; A65-I69 VanDerWaalsContact O-N 3.1Å; A65-W217 HydrophobicContact CB-CH2 4.33Å; A65-W217 HydrophobicContact CB-CZ2 4.12Å |
| 66 | S | 97 | Very high | 96.2 | Very high | 9 Ų | 9 | 28.2 Ų | 28.2 | 6% | 0.063 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -61 | -40.8 | 174.4 | -60.3 | 0 | 0 | 0 | 0 | 112.6 | L57 S62 F63 G64 I69 W70 | L57-S66 WeakPolarHBondContact CA-OG 3.41Å; S62-S66 WeakPolarHBondContact O-CB 3.29Å; S62-S66 PolarHBondContact O-N 3.31Å; S62-S66 VanDerWaalsContact O-N 3.07Å; S62-S66 PolarHBondContact O-OG 2.89Å; F63-S66 WeakPolarHBondContact O-CA 3.35Å; F63-S66 WeakPolarHBondContact O-CB 3.39Å; F63-S66 PolarHBondContact O-N 3.27Å; F63-S66 VanDerWaalsContact O-N 3.11Å; G64-S66 VanDerWaalsContact C-N 3.34Å; S66-I69 PolarHBondContact O-N 3.19Å; S66-W70 VanDerWaalsContact O-CD1 3.25Å; S66-W70 PolarHBondContact O-N 3.38Å |
| 67 | L | 96.5 | Very high | 96.2 | Very high | 29 Ų | 29 | 28.2 Ų | 28.2 | 15% | 0.152 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -63.9 | -39.7 | 174.6 | -72.4 | -174.3 | 0 | 0 | 0 | 112.6 | F63 G64 A65 I69 W70 I71 T269 N272 V273 | F63-L67 HydrophobicContact CD2-CD1 4.45Å; F63-L67 HydrophobicContact CD2-CG 4.17Å; F63-L67 HydrophobicContact CE1-CD1 3.72Å; F63-L67 HydrophobicContact CE1-CG 4.44Å; F63-L67 HydrophobicContact CE2-CD1 3.67Å; F63-L67 HydrophobicContact CE2-CD2 3.87Å; F63-L67 HydrophobicContact CE2-CG 3.63Å; F63-L67 HydrophobicContact CZ-CD1 3.26Å; F63-L67 HydrophobicContact CZ-CD2 4.24Å; F63-L67 HydrophobicContact CZ-CG 3.81Å; F63-L67 PolarHBondContact O-N 3.5Å; G64-L67 PolarHBondContact O-N 3.18Å; A65-L67 PolarHBondContact O-N 2.97Å; L67-I69 VanDerWaalsContact C-N 3.26Å; L67-I69 PolarHBondContact O-N 3.15Å; L67-W70 PolarHBondContact O-N 3.39Å; L67-I71 WeakPolarHBondContact O-CG1 3.48Å; L67-I71 PolarHBondContact O-N 2.83Å; L67-T269 HydrophobicContact CD2-CG2 4.07Å; L67-N272 HydrophobicContact CD2-CB 4.11Å; L67-V273 HydrophobicContact CD1-CG2 4.08Å; L67-V273 HydrophobicContact CD2-CG2 4.05Å |
| 68 | I | 97.4 | Very high | 96.2 | Very high | 82 Ų | 82 | 29.7 Ų | 29.7 | 42% | 0.421 | 16% | 0.156 | S | C | . | . | H | α-helix | trans | -59.4 | -41.5 | 174.7 | -68.8 | 174 | 0 | 0 | 0 | 110.2 | G64 A65 I71 G72 F212 W217 | G64-I68 WeakPolarHBondContact O-CG1 3.3Å; G64-I68 PolarHBondContact O-N 3.08Å; G64-I68 VanDerWaalsContact O-N 3.11Å; A65-I68 WeakPolarHBondContact O-CB 3.43Å; A65-I68 PolarHBondContact O-N 3.4Å; I68-I71 PolarHBondContact O-N 2.84Å; I68-G72 PolarHBondContact O-N 2.98Å; I68-F212 HydrophobicContact CD1-CE1 3.59Å; I68-F212 HydrophobicContact CD1-CZ 4.07Å; I68-F212 HydrophobicContact CG1-CE1 4.43Å; I68-W217 HydrophobicContact CD1-CH2 4.14Å |
| 69 | I | 97.6 | Very high | 96.2 | Very high | 9 Ų | 9 | 26 Ų | 26 | 5% | 0.046 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -63.2 | -44.9 | 176.3 | -63.8 | -61.5 | 0 | 0 | 0 | 111.4 | I56 M60 A65 S66 L67 I71 G72 C73 I222 A225 F226 | I56-I69 HydrophobicContact CD1-CG2 4.42Å; I56-I69 HydrophobicContact CG1-CG2 4.33Å; I56-I69 HydrophobicContact CG2-CB 3.98Å; I56-I69 HydrophobicContact CG2-CG1 4.44Å; I56-I69 HydrophobicContact CG2-CG2 4.02Å; M60-I69 HydrophobicContact CE-CD1 4.49Å; M60-I69 HydrophobicContact CE-CG1 4.37Å; M60-I69 HydrophobicContact CG-CG1 3.68Å; M60-I69 HydrophobicContact SD-CD1 4.02Å; M60-I69 HydrophobicContact SD-CG1 3.8Å; A65-I69 WeakPolarHBondContact O-CG1 3.4Å; A65-I69 PolarHBondContact O-N 3.05Å; A65-I69 VanDerWaalsContact O-N 3.1Å; S66-I69 PolarHBondContact O-N 3.19Å; L67-I69 VanDerWaalsContact C-N 3.26Å; L67-I69 PolarHBondContact O-N 3.15Å; I69-I71 PolarHBondContact O-N 3.28Å; I69-G72 PolarHBondContact O-N 3.25Å; I69-C73 WeakPolarHBondContact O-CB 3.27Å; I69-C73 PolarHBondContact O-N 2.96Å; I69-C73 PolarHBondContact O-SG 3.11Å; I69-I222 HydrophobicContact CD1-CG2 4.24Å; I69-A225 HydrophobicContact CD1-CB 4.41Å; I69-A225 HydrophobicContact CG1-CB 4.13Å; I69-A225 HydrophobicContact CG2-CB 4.15Å; I69-F226 HydrophobicContact CD1-CD2 4.12Å; I69-F226 HydrophobicContact CG2-CD2 4.3Å |
| 70 | W | 97.5 | Very high | 96.3 | Very high | 1 Ų | 1 | 24.8 Ų | 24.8 | 0% | 0.004 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -57.4 | -50.5 | 176.4 | -83.7 | 108.2 | 0 | 0 | 0 | 112.2 | I49 P53 I56 S66 L67 G72 C73 G74 S232 Y233 Y268 N272 | I49-W70 HydrophobicContact CD1-CH2 3.55Å; I49-W70 HydrophobicContact CD1-CZ2 3.89Å; I49-W70 HydrophobicContact CD1-CZ3 4.13Å; P53-W70 HydrophobicContact CG-CZ2 4.17Å; I56-W70 HydrophobicContact CD1-CD2 3.84Å; I56-W70 HydrophobicContact CD1-CG 4.18Å; I56-W70 HydrophobicContact CD1-CH2 4.35Å; I56-W70 HydrophobicContact CD1-CZ2 3.6Å; I56-W70 VanDerWaalsContact CD1-NE1 3.31Å; S66-W70 VanDerWaalsContact O-CD1 3.25Å; S66-W70 PolarHBondContact O-N 3.38Å; L67-W70 PolarHBondContact O-N 3.39Å; W70-G72 PolarHBondContact O-N 3.5Å; W70-C73 PolarHBondContact O-N 3.26Å; W70-G74 PolarHBondContact O-N 3.5Å; W70-S232 WeakPolarHBondContact CH2-OG 3.47Å; W70-Y233 AromaticContact CE3-CE2 3.74Å; W70-Y233 HydrophobicContact CE3-CE2 3.74Å; W70-Y233 HydrophobicContact CZ3-CE2 4.02Å; W70-Y233 PolarHBondContact O-OH 2.98Å; W70-Y268 AromaticContact CE3-CD2 3.88Å; W70-Y268 HydrophobicContact CE3-CD2 3.88Å; W70-Y268 HydrophobicContact CE3-CG 4.19Å; W70-Y268 HydrophobicContact CH2-CD2 4.34Å; W70-Y268 AromaticContact CZ3-CD2 3.36Å; W70-Y268 HydrophobicContact CZ3-CD2 3.36Å; W70-Y268 HydrophobicContact CZ3-CE2 4.01Å; W70-Y268 AromaticContact CZ3-CG 3.78Å; W70-Y268 HydrophobicContact CZ3-CG 3.78Å; W70-N272 WeakPolarHBondContact CZ2-ND2 3.39Å; W70-N272 PolarHBondContact NE1-ND2 3.25Å; W70-N272 VanDerWaalsContact NE1-ND2 3.15Å; W70-N272 PolarHBondContact NE1-OD1 3.19Å |
| 71 | I | 97.9 | Very high | 96.1 | Very high | 73 Ų | 73 | 24.8 Ų | 24.8 | 37% | 0.374 | 13% | 0.133 | S | C | . | . | H | α-helix | trans | -63.3 | -44 | 178.8 | -65.2 | 168.4 | 0 | 0 | 0 | 110.4 | L67 I68 I69 C73 G74 I75 T269 | L67-I71 WeakPolarHBondContact O-CG1 3.48Å; L67-I71 PolarHBondContact O-N 2.83Å; I68-I71 PolarHBondContact O-N 2.84Å; I69-I71 PolarHBondContact O-N 3.28Å; I71-C73 PolarHBondContact O-N 3.21Å; I71-G74 PolarHBondContact O-N 3.26Å; I71-G74 VanDerWaalsContact O-N 3.17Å; I71-I75 HydrophobicContact CG2-CD1 3.88Å; I71-I75 HydrophobicContact CG2-CG1 4.45Å; I71-I75 WeakPolarHBondContact O-CG1 3.21Å; I71-I75 PolarHBondContact O-N 3.48Å; I71-T269 HydrophobicContact CD1-CG2 4.36Å; I71-T269 HydrophobicContact CG1-CG2 4.3Å |
| 72 | G | 97.6 | Very high | 96.2 | Very high | 23 Ų | 23 | 22.3 Ų | 22.3 | 24% | 0.237 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -59.6 | -43.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | I68 I69 W70 G74 I75 F76 | I68-G72 PolarHBondContact O-N 2.98Å; I69-G72 PolarHBondContact O-N 3.25Å; W70-G72 PolarHBondContact O-N 3.5Å; G72-G74 VanDerWaalsContact C-N 3.32Å; G72-G74 PolarHBondContact O-N 3.39Å; G72-I75 PolarHBondContact O-N 3.01Å; G72-F76 VanDerWaalsContact O-CB 3.28Å; G72-F76 WeakPolarHBondContact O-CB 3.4Å; G72-F76 PolarHBondContact O-N 3.21Å |
| 73 | C | 96.9 | Very high | 96.2 | Very high | 0 Ų | 0 | 22.2 Ų | 22.2 | 0% | 0 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -62.5 | -39.6 | 175 | -69.8 | 0 | 0 | 0 | 0 | 111.8 | I69 W70 I71 S77 F226 L230 Y233 | I69-C73 WeakPolarHBondContact O-CB 3.27Å; I69-C73 PolarHBondContact O-N 2.96Å; I69-C73 PolarHBondContact O-SG 3.11Å; W70-C73 PolarHBondContact O-N 3.26Å; I71-C73 PolarHBondContact O-N 3.21Å; C73-S77 VanDerWaalsContact O-CB 3.27Å; C73-S77 WeakPolarHBondContact O-CB 3.07Å; C73-S77 PolarHBondContact O-N 3.04Å; C73-S77 PolarHBondContact O-OG 2.78Å; C73-F226 PolarHBondContact SG-O 2.93Å; C73-L230 HydrophobicContact CB-CD2 3.9Å; C73-L230 HydrophobicContact CB-CG 4.38Å; C73-Y233 HydrophobicContact CB-CD2 3.6Å; C73-Y233 HydrophobicContact CB-CE2 3.6Å |
| 74 | G | 96.7 | Very high | 96.1 | Very high | 2 Ų | 2 | 21.6 Ų | 21.6 | 2% | 0.021 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -63.1 | -48 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113 | W70 I71 G72 S77 L78 T265 | W70-G74 PolarHBondContact O-N 3.5Å; I71-G74 PolarHBondContact O-N 3.26Å; I71-G74 VanDerWaalsContact O-N 3.17Å; G72-G74 VanDerWaalsContact C-N 3.32Å; G72-G74 PolarHBondContact O-N 3.39Å; G74-S77 PolarHBondContact O-N 3.29Å; G74-L78 WeakPolarHBondContact O-CB 3.21Å; G74-L78 PolarHBondContact O-N 3.46Å; G74-T265 VanDerWaalsContact CA-OG1 3.29Å; G74-T265 WeakPolarHBondContact CA-OG1 3.47Å |
| 75 | I | 97 | Very high | 96 | Very high | 94 Ų | 94 | 21.4 Ų | 21.4 | 48% | 0.482 | 11% | 0.113 | S | C | . | . | H | α-helix | trans | -63 | -46.7 | 176.5 | -66.4 | 169.6 | 0 | 0 | 0 | 110.5 | I71 G72 S77 L78 L79 | I71-I75 HydrophobicContact CG2-CD1 3.88Å; I71-I75 HydrophobicContact CG2-CG1 4.45Å; I71-I75 WeakPolarHBondContact O-CG1 3.21Å; I71-I75 PolarHBondContact O-N 3.48Å; G72-I75 PolarHBondContact O-N 3.01Å; I75-S77 VanDerWaalsContact C-N 3.33Å; I75-S77 PolarHBondContact O-N 3.35Å; I75-L78 WeakPolarHBondContact O-CB 3.38Å; I75-L78 PolarHBondContact O-N 2.87Å; I75-L79 HydrophobicContact CG2-CD1 4.38Å; I75-L79 WeakPolarHBondContact O-CG 3.39Å; I75-L79 PolarHBondContact O-N 3.44Å |
| 76 | F | 96.5 | Very high | 95.9 | Very high | 3 Ų | 3 | 21.4 Ų | 21.4 | 1% | 0.013 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -57.5 | -48.2 | 177.3 | 179.2 | -100.6 | 0 | 0 | 0 | 111 | G72 L78 L79 G80 F226 L230 W384 Y418 I421 | G72-F76 VanDerWaalsContact O-CB 3.28Å; G72-F76 WeakPolarHBondContact O-CB 3.4Å; G72-F76 PolarHBondContact O-N 3.21Å; F76-L78 VanDerWaalsContact C-N 3.33Å; F76-L78 PolarHBondContact O-N 2.82Å; F76-L79 PolarHBondContact O-N 3.21Å; F76-G80 PolarHBondContact O-N 3.04Å; F76-F226 HydrophobicContact CB-CE1 3.98Å; F76-F226 HydrophobicContact CB-CZ 3.95Å; F76-F226 HydrophobicContact CD1-CE1 4.08Å; F76-F226 AromaticContact CG-CE1 3.95Å; F76-F226 HydrophobicContact CG-CE1 3.95Å; F76-F226 HydrophobicContact CG-CZ 4.35Å; F76-L230 HydrophobicContact CD1-CD1 4Å; F76-L230 HydrophobicContact CD1-CD2 3.57Å; F76-L230 HydrophobicContact CD1-CG 4.44Å; F76-L230 HydrophobicContact CE1-CD1 3.85Å; F76-L230 HydrophobicContact CE1-CD2 4.16Å; F76-W384 AromaticContact CE1-CE3 3.88Å; F76-W384 HydrophobicContact CE1-CE3 3.88Å; F76-W384 HydrophobicContact CE1-CZ3 4.16Å; F76-Y418 HydrophobicContact CD1-CD2 4.47Å; F76-Y418 AromaticContact CD1-CE2 3.69Å; F76-Y418 HydrophobicContact CD1-CE2 3.69Å; F76-Y418 AromaticContact CD2-CD2 3.77Å; F76-Y418 HydrophobicContact CD2-CD2 3.77Å; F76-Y418 AromaticContact CD2-CE2 3.8Å; F76-Y418 HydrophobicContact CD2-CE2 3.8Å; F76-Y418 HydrophobicContact CE1-CD2 4.33Å; F76-Y418 HydrophobicContact CE1-CE1 4.35Å; F76-Y418 AromaticContact CE1-CE2 3.43Å; F76-Y418 HydrophobicContact CE1-CE2 3.43Å; F76-Y418 VanDerWaalsContact CE1-CE2 3.43Å; F76-Y418 AromaticContact CE1-CZ 3.45Å; F76-Y418 VanDerWaalsContact CE1-CZ 3.45Å; F76-Y418 VanDerWaalsContact CE1-OH 3.27Å; F76-Y418 WeakPolarHBondContact CE1-OH 3.3Å; F76-Y418 HydrophobicContact CE2-CD1 4.27Å; F76-Y418 AromaticContact CE2-CD2 3.54Å; F76-Y418 HydrophobicContact CE2-CD2 3.54Å; F76-Y418 HydrophobicContact CE2-CE1 4.23Å; F76-Y418 AromaticContact CE2-CE2 3.5Å; F76-Y418 HydrophobicContact CE2-CE2 3.5Å; F76-Y418 VanDerWaalsContact CE2-CE2 3.5Å; F76-Y418 AromaticContact CE2-CG 3.95Å; F76-Y418 HydrophobicContact CE2-CG 3.95Å; F76-Y418 AromaticContact CE2-CZ 3.87Å; F76-Y418 HydrophobicContact CG-CD2 4.25Å; F76-Y418 AromaticContact CG-CE2 3.9Å; F76-Y418 HydrophobicContact CG-CE2 3.9Å; F76-Y418 HydrophobicContact CZ-CD1 4.24Å; F76-Y418 AromaticContact CZ-CD2 3.87Å; F76-Y418 HydrophobicContact CZ-CD2 3.87Å; F76-Y418 AromaticContact CZ-CE1 3.76Å; F76-Y418 HydrophobicContact CZ-CE1 3.76Å; F76-Y418 AromaticContact CZ-CE2 3.33Å; F76-Y418 HydrophobicContact CZ-CE2 3.33Å; F76-Y418 HydrophobicContact CZ-CG 4.3Å; F76-Y418 AromaticContact CZ-CZ 3.27Å; F76-Y418 WeakPolarHBondContact O-CD2 3.5Å; F76-Y418 WeakPolarHBondContact O-CE2 3.47Å; F76-I421 HydrophobicContact CD2-CB 4.02Å; F76-I421 HydrophobicContact CD2-CD1 4.18Å; F76-I421 HydrophobicContact CD2-CG2 3.58Å; F76-I421 HydrophobicContact CE2-CB 3.78Å; F76-I421 HydrophobicContact CE2-CG2 3.5Å; F76-I421 VanDerWaalsContact CE2-CG2 3.5Å; F76-I421 HydrophobicContact CZ-CG2 4.44Å |
| 77 | S | 95.3 | Very high | 95.7 | Very high | 0 Ų | 0 | 21 Ų | 21 | 0% | 0 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -61.3 | -39.5 | 177.9 | -60.9 | 0 | 0 | 0 | 0 | 112.5 | C73 G74 I75 G80 A81 Y233 | C73-S77 VanDerWaalsContact O-CB 3.27Å; C73-S77 WeakPolarHBondContact O-CB 3.07Å; C73-S77 PolarHBondContact O-N 3.04Å; C73-S77 PolarHBondContact O-OG 2.78Å; G74-S77 PolarHBondContact O-N 3.29Å; I75-S77 VanDerWaalsContact C-N 3.33Å; I75-S77 PolarHBondContact O-N 3.35Å; S77-G80 PolarHBondContact O-N 3.24Å; S77-A81 WeakPolarHBondContact O-CB 3.44Å; S77-A81 PolarHBondContact O-N 3.42Å; S77-Y233 VanDerWaalsContact OG-CB 3.3Å; S77-Y233 WeakPolarHBondContact OG-CB 3.46Å |
| 78 | L | 95.4 | Very high | 95.4 | Very high | 39 Ų | 39 | 19.7 Ų | 19.7 | 20% | 0.204 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -61 | -45.5 | 175.2 | 176.7 | 64.1 | 0 | 0 | 0 | 112.1 | G74 I75 F76 A81 Y82 V258 C261 L262 | G74-L78 WeakPolarHBondContact O-CB 3.21Å; G74-L78 PolarHBondContact O-N 3.46Å; I75-L78 WeakPolarHBondContact O-CB 3.38Å; I75-L78 PolarHBondContact O-N 2.87Å; F76-L78 VanDerWaalsContact C-N 3.33Å; F76-L78 PolarHBondContact O-N 2.82Å; L78-A81 PolarHBondContact O-N 3.32Å; L78-Y82 PolarHBondContact O-N 3.26Å; L78-V258 HydrophobicContact CD1-CB 4.2Å; L78-V258 HydrophobicContact CD1-CG1 4.3Å; L78-V258 HydrophobicContact CD1-CG2 4.02Å; L78-C261 HydrophobicContact CB-CB 4.15Å; L78-C261 HydrophobicContact CD1-CB 3.92Å; L78-L262 HydrophobicContact CD2-CD2 4.23Å |
| 79 | L | 96.2 | Very high | 95.1 | Very high | 22 Ų | 22 | 16 Ų | 16 | 12% | 0.115 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -61.7 | -46.4 | 178 | -66.6 | 175.3 | 0 | 0 | 0 | 111.5 | I75 F76 Y82 C83 F414 I417 Y418 | I75-L79 HydrophobicContact CG2-CD1 4.38Å; I75-L79 WeakPolarHBondContact O-CG 3.39Å; I75-L79 PolarHBondContact O-N 3.44Å; F76-L79 PolarHBondContact O-N 3.21Å; L79-Y82 PolarHBondContact O-N 2.96Å; L79-C83 PolarHBondContact O-N 3.19Å; L79-C83 VanDerWaalsContact O-N 3.14Å; L79-C83 PolarHBondContact O-SG 2.98Å; L79-F414 HydrophobicContact CD2-CB 3.99Å; L79-F414 HydrophobicContact CD2-CD1 3.81Å; L79-F414 HydrophobicContact CD2-CD2 3.81Å; L79-F414 HydrophobicContact CD2-CE1 4.19Å; L79-F414 HydrophobicContact CD2-CE2 4.19Å; L79-F414 HydrophobicContact CD2-CG 3.61Å; L79-F414 HydrophobicContact CD2-CZ 4.37Å; L79-I417 HydrophobicContact CD1-CG2 3.91Å; L79-Y418 HydrophobicContact CB-CD2 4.11Å |
| 80 | G | 94.4 | Very high | 94.8 | Very high | 0 Ų | 0 | 17.4 Ų | 17.4 | 0% | 0 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -61.9 | -46.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112 | F76 S77 Y82 C83 Y84 Y418 | F76-G80 PolarHBondContact O-N 3.04Å; S77-G80 PolarHBondContact O-N 3.24Å; G80-Y82 VanDerWaalsContact C-N 3.34Å; G80-Y82 PolarHBondContact O-N 2.88Å; G80-C83 WeakPolarHBondContact O-CB 3.47Å; G80-C83 PolarHBondContact O-N 3.42Å; G80-C83 VanDerWaalsContact O-N 3.16Å; G80-Y84 WeakPolarHBondContact O-CD2 3.3Å; G80-Y84 PolarHBondContact O-N 3.09Å; G80-Y418 VanDerWaalsContact CA-CD2 3.47Å; G80-Y418 VanDerWaalsContact N-CD2 3.32Å |
| 81 | A | 93.4 | Very high | 94.4 | Very high | 0 Ų | 0 | 18 Ų | 18 | 0% | 0 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -63.1 | -39.5 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | S77 L78 C83 Y84 A85 W236 I257 | S77-A81 WeakPolarHBondContact O-CB 3.44Å; S77-A81 PolarHBondContact O-N 3.42Å; L78-A81 PolarHBondContact O-N 3.32Å; A81-C83 VanDerWaalsContact C-N 3.34Å; A81-C83 PolarHBondContact O-N 2.93Å; A81-Y84 WeakPolarHBondContact O-CB 3.39Å; A81-Y84 PolarHBondContact O-N 3.46Å; A81-A85 PolarHBondContact O-N 2.73Å; A81-W236 HydrophobicContact CB-CB 4.3Å; A81-W236 HydrophobicContact CB-CD2 3.67Å; A81-W236 HydrophobicContact CB-CE3 3.34Å; A81-W236 HydrophobicContact CB-CG 4.1Å; A81-W236 HydrophobicContact CB-CZ3 3.9Å; A81-I257 HydrophobicContact CB-CB 4.45Å; A81-I257 HydrophobicContact CB-CD1 4.48Å; A81-I257 HydrophobicContact CB-CG2 3.22Å |
| 82 | Y | 94.9 | Very high | 93.5 | Very high | 63 Ų | 63 | 19.3 Ų | 19.3 | 25% | 0.247 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -65.7 | -37.3 | 175.2 | -155.8 | -90.1 | 0 | 0 | 0 | 112.4 | L78 L79 G80 Y84 A85 E86 P254 V258 V408 A410 F414 | L78-Y82 PolarHBondContact O-N 3.26Å; L79-Y82 PolarHBondContact O-N 2.96Å; G80-Y82 VanDerWaalsContact C-N 3.34Å; G80-Y82 PolarHBondContact O-N 2.88Å; Y82-Y84 VanDerWaalsContact C-N 3.32Å; Y82-A85 WeakPolarHBondContact O-CB 3.42Å; Y82-A85 PolarHBondContact O-N 3.46Å; Y82-E86 PolarHBondContact O-N 3.39Å; Y82-P254 HydrophobicContact CE2-CB 4.11Å; Y82-V258 HydrophobicContact CD2-CG2 3.75Å; Y82-V258 HydrophobicContact CE2-CG2 3.98Å; Y82-V408 HydrophobicContact CE1-CG1 4.47Å; Y82-A410 HydrophobicContact CD1-CB 3.88Å; Y82-A410 HydrophobicContact CE1-CB 4.32Å; Y82-F414 HydrophobicContact CD1-CD2 4.3Å |
| 83 | C | 95.2 | Very high | 92.4 | Very high | 0 Ų | 0 | 24.5 Ų | 24.5 | 0% | 0 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -64.3 | -38.3 | 173 | -64.8 | 0 | 0 | 0 | 0 | 111.8 | L79 G80 A81 A85 E86 L87 V391 V394 | L79-C83 PolarHBondContact O-N 3.19Å; L79-C83 VanDerWaalsContact O-N 3.14Å; L79-C83 PolarHBondContact O-SG 2.98Å; G80-C83 WeakPolarHBondContact O-CB 3.47Å; G80-C83 PolarHBondContact O-N 3.42Å; G80-C83 VanDerWaalsContact O-N 3.16Å; A81-C83 VanDerWaalsContact C-N 3.34Å; A81-C83 PolarHBondContact O-N 2.93Å; C83-A85 VanDerWaalsContact C-N 3.32Å; C83-A85 PolarHBondContact O-N 3.27Å; C83-E86 WeakPolarHBondContact O-CB 3.39Å; C83-E86 PolarHBondContact O-N 3.07Å; C83-L87 PolarHBondContact O-N 3.28Å; C83-V391 HydrophobicContact CB-CG1 3.9Å; C83-V391 HydrophobicContact CB-CG2 4.31Å; C83-V394 HydrophobicContact CB-CG2 4.17Å |
| 84 | Y | 93.1 | Very high | 91 | Very high | 0 Ų | 0 | 26.1 Ų | 26.1 | 0% | 0 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -67.4 | -30.3 | 173.5 | -92.6 | -115.7 | 0 | 0 | 0 | 113 | G80 A81 Y82 E86 L87 G88 D97 Y100 W236 N237 N240 I387 C390 V391 | G80-Y84 WeakPolarHBondContact O-CD2 3.3Å; G80-Y84 PolarHBondContact O-N 3.09Å; A81-Y84 WeakPolarHBondContact O-CB 3.39Å; A81-Y84 PolarHBondContact O-N 3.46Å; Y82-Y84 VanDerWaalsContact C-N 3.32Å; Y84-E86 VanDerWaalsContact C-N 3.26Å; Y84-E86 PolarHBondContact O-N 3.46Å; Y84-L87 PolarHBondContact O-N 3.19Å; Y84-G88 PolarHBondContact O-N 2.86Å; Y84-D97 HydrophobicContact CE1-CB 4.47Å; Y84-D97 WeakPolarHBondContact CE1-OD1 3.44Å; Y84-Y100 HydrophobicContact CD1-CD2 4.46Å; Y84-Y100 AromaticContact CD1-CE2 3.85Å; Y84-Y100 HydrophobicContact CD1-CE2 3.85Å; Y84-Y100 HydrophobicContact CE1-CD2 4.26Å; Y84-Y100 HydrophobicContact CE1-CE2 4.01Å; Y84-W236 HydrophobicContact CD1-CH2 4.49Å; Y84-W236 AromaticContact CD1-CZ3 3.96Å; Y84-W236 HydrophobicContact CD1-CZ3 3.96Å; Y84-W236 AromaticContact CD2-CH2 3.59Å; Y84-W236 HydrophobicContact CD2-CH2 3.59Å; Y84-W236 AromaticContact CD2-CZ3 3.62Å; Y84-W236 HydrophobicContact CD2-CZ3 3.62Å; Y84-W236 HydrophobicContact CE1-CZ3 4.44Å; Y84-W236 AromaticContact CE2-CH2 3.74Å; Y84-W236 HydrophobicContact CE2-CH2 3.74Å; Y84-W236 HydrophobicContact CE2-CZ3 4.13Å; Y84-W236 AromaticContact CG-CH2 3.99Å; Y84-W236 HydrophobicContact CG-CH2 3.99Å; Y84-W236 AromaticContact CG-CZ3 3.51Å; Y84-W236 HydrophobicContact CG-CZ3 3.51Å; Y84-N237 HydrophobicContact CD1-CB 4.1Å; Y84-N237 HydrophobicContact CE1-CB 4.11Å; Y84-N240 PolarHBondContact O-ND2 3.33Å; Y84-I387 HydrophobicContact CE2-CG2 3.92Å; Y84-C390 HydrophobicContact CE2-CB 4.04Å; Y84-C390 WeakPolarHBondContact OH-CB 3.42Å; Y84-V391 HydrophobicContact CD2-CG2 4.03Å; Y84-V391 HydrophobicContact CE2-CG2 3.74Å |
| 85 | A | 93 | Very high | 89.7 | Confident | 0 Ų | 0 | 26.7 Ų | 26.7 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -61.3 | -38.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | A81 Y82 C83 T89 L253 I257 V408 | A81-A85 PolarHBondContact O-N 2.73Å; Y82-A85 WeakPolarHBondContact O-CB 3.42Å; Y82-A85 PolarHBondContact O-N 3.46Å; C83-A85 VanDerWaalsContact C-N 3.32Å; C83-A85 PolarHBondContact O-N 3.27Å; A85-T89 WeakPolarHBondContact O-CB 3.46Å; A85-T89 VanDerWaalsContact O-CG2 3.32Å; A85-T89 WeakPolarHBondContact O-CG2 3.48Å; A85-T89 PolarHBondContact O-N 2.88Å; A85-T89 VanDerWaalsContact O-N 3.13Å; A85-T89 PolarHBondContact O-OG1 3.49Å; A85-L253 HydrophobicContact CB-CD2 4Å; A85-L253 HydrophobicContact CB-CG 4.09Å; A85-I257 HydrophobicContact CB-CD1 3.96Å; A85-V408 HydrophobicContact CB-CG1 4.13Å |
| 86 | E | 94.5 | Very high | 89 | Confident | 1 Ų | 1 | 22.2 Ų | 22.2 | 1% | 0.005 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -63 | -52 | 170.7 | 170.2 | 169.7 | 171.9 | 0 | 0 | 111.5 | Y82 C83 Y84 G88 T89 M90 R398 R406 V408 A410 | Y82-E86 PolarHBondContact O-N 3.39Å; C83-E86 WeakPolarHBondContact O-CB 3.39Å; C83-E86 PolarHBondContact O-N 3.07Å; Y84-E86 VanDerWaalsContact C-N 3.26Å; Y84-E86 PolarHBondContact O-N 3.46Å; E86-G88 VanDerWaalsContact C-N 3.33Å; E86-G88 PolarHBondContact O-N 2.92Å; E86-T89 PolarHBondContact O-N 3.31Å; E86-T89 PolarHBondContact O-OG1 3.46Å; E86-T89 VanDerWaalsContact O-OG1 3.12Å; E86-M90 VanDerWaalsContact O-CB 3.31Å; E86-M90 WeakPolarHBondContact O-CB 3.3Å; E86-M90 PolarHBondContact O-N 3.39Å; E86-R398 IonicContact OE1-CZ 3.67Å; E86-R398 IonicContact OE1-NH1 3.24Å; E86-R398 PolarHBondContact OE1-NH1 3.17Å; E86-R398 IonicContact OE1-NH2 3.63Å; E86-R398 PolarHBondContact OE1-NH2 2.79Å; E86-R398 IonicContact OE2-CZ 3.63Å; E86-R398 IonicContact OE2-NH1 2.68Å; E86-R398 IonicContact OE2-NH2 3.22Å; E86-R398 PolarHBondContact OE2-NH2 2.93Å; E86-R406 VanDerWaalsContact OE1-CD 3.31Å; E86-R406 WeakPolarHBondContact OE1-CD 3.35Å; E86-R406 IonicContact OE1-NE 3.8Å; E86-V408 WeakPolarHBondContact CB-O 3.35Å; E86-V408 VanDerWaalsContact CG-O 3.31Å; E86-V408 WeakPolarHBondContact CG-O 3.34Å; E86-A410 HydrophobicContact CB-CB 4.26Å; E86-A410 WeakPolarHBondContact OE2-CB 3.45Å; E86-A410 PolarHBondContact OE2-N 3.43Å |
| 87 | L | 93.5 | Very high | 88.6 | Confident | 1 Ų | 1 | 22.4 Ų | 22.4 | 1% | 0.005 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -58.8 | -43.8 | -178.6 | -66.8 | 176.7 | 0 | 0 | 0 | 112.2 | C83 Y84 T89 M90 I91 Y100 C390 I393 V394 | C83-L87 PolarHBondContact O-N 3.28Å; Y84-L87 PolarHBondContact O-N 3.19Å; L87-T89 VanDerWaalsContact C-N 3.35Å; L87-T89 PolarHBondContact O-N 2.9Å; L87-M90 PolarHBondContact O-N 3.41Å; L87-I91 PolarHBondContact O-N 3.32Å; L87-Y100 HydrophobicContact CB-CD1 4.24Å; L87-Y100 HydrophobicContact CB-CD2 3.93Å; L87-Y100 HydrophobicContact CB-CE1 4.16Å; L87-Y100 HydrophobicContact CB-CE2 3.84Å; L87-Y100 HydrophobicContact CB-CG 4.15Å; L87-Y100 HydrophobicContact CD1-CD2 3.93Å; L87-Y100 HydrophobicContact CD1-CE2 4.43Å; L87-Y100 HydrophobicContact CD1-CG 4.36Å; L87-C390 WeakPolarHBondContact CD1-O 3.5Å; L87-I393 HydrophobicContact CD1-CB 4.48Å; L87-I393 HydrophobicContact CD2-CB 4.12Å; L87-I393 HydrophobicContact CD2-CG2 3.76Å; L87-V394 HydrophobicContact CD1-CG2 4.07Å; L87-V394 HydrophobicContact CD2-CG2 3.78Å; L87-V394 HydrophobicContact CG-CG2 3.71Å |
| 88 | G | 89.8 | Confident | 88.2 | Confident | 0 Ų | 0 | 23 Ų | 23 | 0% | 0 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -68.8 | -30.7 | 179.2 | 0 | 0 | 0 | 0 | 0 | 114 | Y84 E86 Y100 | Y84-G88 PolarHBondContact O-N 2.86Å; E86-G88 VanDerWaalsContact C-N 3.33Å; E86-G88 PolarHBondContact O-N 2.92Å; G88-Y100 WeakPolarHBondContact CA-OH 3.43Å; G88-Y100 PolarHBondContact N-OH 3.22Å |
| 89 | T | 91.2 | Very high | 87.9 | Confident | 5 Ų | 5 | 21.5 Ų | 21.5 | 3% | 0.031 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -82.3 | -20.6 | 175.6 | 57.2 | 0 | 0 | 0 | 0 | 113.2 | A85 E86 L87 L253 V408 | A85-T89 WeakPolarHBondContact O-CB 3.46Å; A85-T89 VanDerWaalsContact O-CG2 3.32Å; A85-T89 WeakPolarHBondContact O-CG2 3.48Å; A85-T89 PolarHBondContact O-N 2.88Å; A85-T89 VanDerWaalsContact O-N 3.13Å; A85-T89 PolarHBondContact O-OG1 3.49Å; E86-T89 PolarHBondContact O-N 3.31Å; E86-T89 PolarHBondContact O-OG1 3.46Å; E86-T89 VanDerWaalsContact O-OG1 3.12Å; L87-T89 VanDerWaalsContact C-N 3.35Å; L87-T89 PolarHBondContact O-N 2.9Å; T89-L253 HydrophobicContact CG2-CD2 4.05Å; T89-V408 HydrophobicContact CG2-CB 4.38Å; T89-V408 HydrophobicContact CG2-CG2 3.84Å; T89-V408 PolarHBondContact OG1-N 2.92Å |
| 90 | M | 91.7 | Very high | 87.7 | Confident | 39 Ų | 39 | 20.5 Ų | 20.5 | 19% | 0.192 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -86 | -42 | 175.8 | -168.4 | -179.5 | -165.1 | 0 | 0 | 112.3 | E86 L87 F397 A404 R406 | E86-M90 VanDerWaalsContact O-CB 3.31Å; E86-M90 WeakPolarHBondContact O-CB 3.3Å; E86-M90 PolarHBondContact O-N 3.39Å; L87-M90 PolarHBondContact O-N 3.41Å; M90-F397 HydrophobicContact CE-CD2 4.23Å; M90-F397 HydrophobicContact SD-CD2 3.77Å; M90-F397 HydrophobicContact SD-CE2 4.35Å; M90-A404 HydrophobicContact CE-CB 3.17Å; M90-R406 HydrophobicContact CE-CG 4.29Å; M90-R406 HydrophobicContact SD-CG 4.28Å |
| 91 | I | 87.6 | Confident | 87.6 | Confident | 13 Ų | 13 | 20.7 Ų | 20.7 | 7% | 0.067 | 10% | 0.099 | C | C | . | . | S | Bend | trans | -113.5 | 91 | 178.7 | -55.7 | 168.6 | 0 | 0 | 0 | 108.3 | L87 R93 Y100 E103 F397 | L87-I91 PolarHBondContact O-N 3.32Å; I91-R93 HydrophobicContact CG2-CB 4.32Å; I91-R93 HydrophobicContact CG2-CG 4.3Å; I91-R93 PolarHBondContact O-N 3.22Å; I91-Y100 HydrophobicContact CB-CD1 3.97Å; I91-Y100 HydrophobicContact CB-CE1 4.08Å; I91-Y100 HydrophobicContact CD1-CD1 3.89Å; I91-Y100 HydrophobicContact CG1-CD1 4.5Å; I91-Y100 HydrophobicContact CG2-CD1 4.25Å; I91-E103 HydrophobicContact CD1-CB 3.88Å; I91-E103 HydrophobicContact CD1-CG 3.71Å; I91-E103 HydrophobicContact CG1-CG 4.2Å; I91-F397 HydrophobicContact CD1-CE2 3.87Å; I91-F397 HydrophobicContact CD1-CZ 4.36Å |
| 92 | Q | 79.3 | Confident | 87.6 | Confident | 101 Ų | 101 | 22.1 Ų | 22.1 | 47% | 0.472 | 11% | 0.106 | S | C | . | . | trans | -84.9 | 64 | 178.4 | -62.9 | -175.2 | -10.5 | 0 | 0 | 110.8 | ||||
| 93 | R | 74.4 | Confident | 87.4 | Confident | 131 Ų | 131 | 21.9 Ų | 21.9 | 49% | 0.494 | 11% | 0.108 | S | C | . | . | trans | -120.3 | 132.8 | 171 | -66.9 | -170.4 | -176 | 179.1 | 7.8 | 109.9 | I91 G95 A99 E244 | I91-R93 HydrophobicContact CG2-CB 4.32Å; I91-R93 HydrophobicContact CG2-CG 4.3Å; I91-R93 PolarHBondContact O-N 3.22Å; R93-G95 PolarHBondContact O-N 3.07Å; R93-A99 HydrophobicContact CB-CB 4.24Å; R93-E244 WeakPolarHBondContact CA-OE1 3.43Å | ||
| 94 | S | 67.1 | Low | 87.4 | Confident | 34 Ų | 34 | 23.1 Ų | 23.1 | 24% | 0.238 | 12% | 0.118 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -59.1 | 123.4 | 168.4 | -74.7 | 0 | 0 | 0 | 0 | 110.4 | E244 V331 | S94-E244 PolarHBondContact N-OE1 3.28Å; S94-E244 PolarHBondContact OG-OE1 3.43Å; S94-E244 PolarHBondContact OG-OE2 3.08Å; S94-V331 WeakPolarHBondContact O-CG1 3.33Å |
| 95 | G | 70.7 | Confident | 87.4 | Confident | 15 Ų | 15 | 27.1 Ų | 27.1 | 16% | 0.155 | 14% | 0.135 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 145.6 | -15.6 | -176.9 | 0 | 0 | 0 | 0 | 0 | 114 | R93 D97 Y98 | R93-G95 PolarHBondContact O-N 3.07Å; G95-D97 PolarHBondContact O-N 3.06Å; G95-Y98 PolarHBondContact O-N 3.46Å |
| 96 | G | 82 | Confident | 87.4 | Confident | 0 Ų | 0 | 28.5 Ų | 28.5 | 0% | 0 | 15% | 0.15 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 55.5 | -127 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y98 A99 Y100 | G96-Y98 PolarHBondContact O-N 3.42Å; G96-A99 WeakPolarHBondContact O-CB 3.06Å; G96-A99 PolarHBondContact O-N 3.34Å; G96-Y100 WeakPolarHBondContact O-CD2 3.39Å; G96-Y100 PolarHBondContact O-N 2.93Å |
| 97 | D | 87.1 | Confident | 87.3 | Confident | 6 Ų | 6 | 30.7 Ų | 30.7 | 3% | 0.032 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -52.4 | -40.5 | -175.7 | -42.7 | 14 | 0 | 0 | 0 | 112.7 | Y84 G95 Y100 M101 R113 N237 | Y84-D97 HydrophobicContact CE1-CB 4.47Å; Y84-D97 WeakPolarHBondContact CE1-OD1 3.44Å; G95-D97 PolarHBondContact O-N 3.06Å; D97-Y100 PolarHBondContact O-N 2.9Å; D97-M101 WeakPolarHBondContact O-CG 3.29Å; D97-M101 PolarHBondContact O-N 2.97Å; D97-M101 VanDerWaalsContact O-N 3.12Å; D97-R113 HydrophobicContact CB-CG 4.28Å; D97-R113 VanDerWaalsContact CB-NE 3.32Å; D97-R113 IonicContact OD2-CZ 2.72Å; D97-R113 IonicContact OD2-NE 2.76Å; D97-R113 IonicContact OD2-NH2 2.71Å; D97-R113 PolarHBondContact OD2-NH2 2.97Å; D97-N237 PolarHBondContact OD1-ND2 3.04Å; D97-N237 PolarHBondContact OD2-ND2 3.5Å |
| 98 | Y | 88.5 | Confident | 87.4 | Confident | 12 Ų | 12 | 34.2 Ų | 34.2 | 5% | 0.047 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -62.9 | -47.3 | 177.3 | 165.4 | -106.9 | 0 | 0 | 0 | 111.4 | G95 G96 Y100 M101 L102 G110 L114 V331 E335 H337 | G95-Y98 PolarHBondContact O-N 3.46Å; G96-Y98 PolarHBondContact O-N 3.42Å; Y98-Y100 VanDerWaalsContact C-N 3.31Å; Y98-Y100 PolarHBondContact O-N 3.49Å; Y98-M101 PolarHBondContact O-N 3.49Å; Y98-L102 HydrophobicContact CE1-CD2 4.19Å; Y98-L102 VanDerWaalsContact O-CB 3.3Å; Y98-L102 WeakPolarHBondContact O-CB 3.44Å; Y98-L102 PolarHBondContact O-N 3.3Å; Y98-G110 WeakPolarHBondContact CD2-O 3.49Å; Y98-G110 WeakPolarHBondContact CE2-O 3.31Å; Y98-L114 HydrophobicContact CD2-CB 3.77Å; Y98-L114 HydrophobicContact CE2-CB 4.1Å; Y98-L114 HydrophobicContact CE2-CD2 4.5Å; Y98-V331 HydrophobicContact CD1-CG1 4.1Å; Y98-V331 HydrophobicContact CE1-CG1 4.08Å; Y98-E335 HydrophobicContact CE1-CG 4.1Å; Y98-E335 WeakPolarHBondContact OH-CB 3.32Å; Y98-E335 WeakPolarHBondContact OH-CG 3.4Å; Y98-H337 AromaticContact CE2-ND1 3.49Å; Y98-H337 WeakPolarHBondContact CE2-ND1 3.32Å; Y98-H337 AromaticContact CZ-ND1 3.68Å; Y98-H337 PolarHBondContact OH-CE1 2.83Å; Y98-H337 VanDerWaalsContact OH-CE1 3.28Å; Y98-H337 PolarHBondContact OH-ND1 3.24Å |
| 99 | A | 87.4 | Confident | 87.6 | Confident | 9 Ų | 9 | 37.1 Ų | 37.1 | 7% | 0.074 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -64.9 | -36.6 | -179.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | R93 G96 L102 E103 | R93-A99 HydrophobicContact CB-CB 4.24Å; G96-A99 WeakPolarHBondContact O-CB 3.06Å; G96-A99 PolarHBondContact O-N 3.34Å; A99-L102 PolarHBondContact O-N 2.89Å; A99-E103 WeakPolarHBondContact O-CB 3.38Å; A99-E103 PolarHBondContact O-N 2.98Å |
| 100 | Y | 92.1 | Very high | 87.7 | Confident | 0 Ų | 0 | 36.9 Ų | 36.9 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -65.7 | -46.5 | 176.7 | -52.3 | -29.1 | 0 | 0 | 0 | 111.9 | Y84 L87 G88 I91 G96 D97 Y98 L102 E103 A104 N240 | Y84-Y100 HydrophobicContact CD1-CD2 4.46Å; Y84-Y100 AromaticContact CD1-CE2 3.85Å; Y84-Y100 HydrophobicContact CD1-CE2 3.85Å; Y84-Y100 HydrophobicContact CE1-CD2 4.26Å; Y84-Y100 HydrophobicContact CE1-CE2 4.01Å; L87-Y100 HydrophobicContact CB-CD1 4.24Å; L87-Y100 HydrophobicContact CB-CD2 3.93Å; L87-Y100 HydrophobicContact CB-CE1 4.16Å; L87-Y100 HydrophobicContact CB-CE2 3.84Å; L87-Y100 HydrophobicContact CB-CG 4.15Å; L87-Y100 HydrophobicContact CD1-CD2 3.93Å; L87-Y100 HydrophobicContact CD1-CE2 4.43Å; L87-Y100 HydrophobicContact CD1-CG 4.36Å; G88-Y100 WeakPolarHBondContact CA-OH 3.43Å; G88-Y100 PolarHBondContact N-OH 3.22Å; I91-Y100 HydrophobicContact CB-CD1 3.97Å; I91-Y100 HydrophobicContact CB-CE1 4.08Å; I91-Y100 HydrophobicContact CD1-CD1 3.89Å; I91-Y100 HydrophobicContact CG1-CD1 4.5Å; I91-Y100 HydrophobicContact CG2-CD1 4.25Å; G96-Y100 WeakPolarHBondContact O-CD2 3.39Å; G96-Y100 PolarHBondContact O-N 2.93Å; D97-Y100 PolarHBondContact O-N 2.9Å; Y98-Y100 VanDerWaalsContact C-N 3.31Å; Y98-Y100 PolarHBondContact O-N 3.49Å; Y100-L102 VanDerWaalsContact C-N 3.32Å; Y100-L102 PolarHBondContact O-N 3.47Å; Y100-E103 PolarHBondContact O-N 2.65Å; Y100-A104 VanDerWaalsContact O-CB 3.28Å; Y100-A104 WeakPolarHBondContact O-CB 3.44Å; Y100-A104 PolarHBondContact O-N 3.15Å; Y100-N240 WeakPolarHBondContact OH-CB 3.49Å; Y100-N240 PolarHBondContact OH-ND2 3.12Å |
| 101 | M | 93.8 | Very high | 87.7 | Confident | 5 Ų | 5 | 35.2 Ų | 35.2 | 3% | 0.025 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -64.4 | -39 | 178 | -71.6 | -67.9 | -83.4 | 0 | 0 | 111.8 | D97 Y98 F105 G106 M109 R113 A389 C390 I393 | D97-M101 WeakPolarHBondContact O-CG 3.29Å; D97-M101 PolarHBondContact O-N 2.97Å; D97-M101 VanDerWaalsContact O-N 3.12Å; Y98-M101 PolarHBondContact O-N 3.49Å; M101-F105 HydrophobicContact CE-CD2 4.11Å; M101-F105 HydrophobicContact CE-CE2 4.48Å; M101-F105 PolarHBondContact O-N 3.43Å; M101-F105 HydrophobicContact SD-CD2 3.78Å; M101-F105 HydrophobicContact SD-CE2 3.95Å; M101-G106 PolarHBondContact O-N 2.91Å; M101-M109 HydrophobicContact CE-CB 4.16Å; M101-M109 HydrophobicContact CE-CE 3.51Å; M101-R113 HydrophobicContact CB-CB 4.15Å; M101-R113 HydrophobicContact CG-CB 3.97Å; M101-R113 HydrophobicContact CG-CG 4.03Å; M101-A389 HydrophobicContact CE-CB 4.11Å; M101-C390 WeakPolarHBondContact CG-SG 3.48Å; M101-I393 HydrophobicContact CG-CD1 4.37Å; M101-I393 HydrophobicContact SD-CD1 3.82Å; M101-I393 HydrophobicContact SD-CG1 4.44Å |
| 102 | L | 92.1 | Very high | 88 | Confident | 29 Ų | 29 | 35.5 Ų | 35.5 | 15% | 0.152 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -61.8 | -45.4 | 176.2 | -176.5 | 64.9 | 0 | 0 | 0 | 111.7 | Y98 A99 Y100 G106 E335 | Y98-L102 HydrophobicContact CE1-CD2 4.19Å; Y98-L102 VanDerWaalsContact O-CB 3.3Å; Y98-L102 WeakPolarHBondContact O-CB 3.44Å; Y98-L102 PolarHBondContact O-N 3.3Å; A99-L102 PolarHBondContact O-N 2.89Å; Y100-L102 VanDerWaalsContact C-N 3.32Å; Y100-L102 PolarHBondContact O-N 3.47Å; L102-G106 WeakPolarHBondContact O-CA 3.5Å; L102-G106 PolarHBondContact O-N 2.87Å; L102-E335 HydrophobicContact CD2-CG 4.11Å |
| 103 | E | 91.8 | Very high | 88.7 | Confident | 59 Ų | 59 | 31 Ų | 31 | 28% | 0.276 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -71.8 | -35.7 | -179.7 | -179.5 | 62 | -148.4 | 0 | 0 | 112.7 | I91 A99 Y100 R401 | I91-E103 HydrophobicContact CD1-CB 3.88Å; I91-E103 HydrophobicContact CD1-CG 3.71Å; I91-E103 HydrophobicContact CG1-CG 4.2Å; A99-E103 WeakPolarHBondContact O-CB 3.38Å; A99-E103 PolarHBondContact O-N 2.98Å; Y100-E103 PolarHBondContact O-N 2.65Å; E103-R401 IonicContact OE1-CZ 2.69Å; E103-R401 IonicContact OE1-NH1 2.96Å; E103-R401 PolarHBondContact OE1-NH1 3.32Å; E103-R401 IonicContact OE1-NH2 3.52Å; E103-R401 PolarHBondContact OE1-NH2 3.43Å |
| 104 | A | 93.9 | Very high | 89.5 | Confident | 25 Ų | 25 | 24.9 Ų | 24.9 | 21% | 0.207 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -82.4 | -42.2 | -176.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | Y100 I393 F397 | Y100-A104 VanDerWaalsContact O-CB 3.28Å; Y100-A104 WeakPolarHBondContact O-CB 3.44Å; Y100-A104 PolarHBondContact O-N 3.15Å; A104-I393 HydrophobicContact CB-CB 4.31Å; A104-I393 HydrophobicContact CB-CD1 3.75Å; A104-I393 HydrophobicContact CB-CG1 3.72Å; A104-I393 HydrophobicContact CB-CG2 3.65Å; A104-F397 HydrophobicContact CB-CE1 3.69Å; A104-F397 HydrophobicContact CB-CZ 3.69Å |
| 105 | F | 94.7 | Very high | 90.7 | Very high | 84 Ų | 84 | 24.7 Ų | 24.7 | 37% | 0.368 | 14% | 0.136 | S | C | . | . | H | α-helix | trans | -127 | 1.5 | -169.4 | -56.5 | -57.5 | 0 | 0 | 0 | 113.6 | M101 M109 I393 V396 | M101-F105 HydrophobicContact CE-CD2 4.11Å; M101-F105 HydrophobicContact CE-CE2 4.48Å; M101-F105 PolarHBondContact O-N 3.43Å; M101-F105 HydrophobicContact SD-CD2 3.78Å; M101-F105 HydrophobicContact SD-CE2 3.95Å; F105-M109 HydrophobicContact CB-CB 3.58Å; F105-M109 HydrophobicContact CB-CG 3.61Å; F105-M109 HydrophobicContact CG-CB 4.48Å; F105-M109 HydrophobicContact CG-CG 4.38Å; F105-I393 HydrophobicContact CD2-CG1 4.43Å; F105-I393 HydrophobicContact CE2-CD1 4.33Å; F105-I393 HydrophobicContact CE2-CG1 3.66Å; F105-I393 HydrophobicContact CZ-CG1 4.17Å; F105-V396 HydrophobicContact CE1-CG1 4.49Å; F105-V396 HydrophobicContact CE1-CG2 4.42Å; F105-V396 HydrophobicContact CZ-CG2 4.28Å |
| 106 | G | 92.6 | Very high | 91.7 | Very high | 30 Ų | 30 | 24.5 Ų | 24.5 | 31% | 0.309 | 13% | 0.132 | S | C | . | . | trans | 84.5 | -174.6 | 175 | 0 | 0 | 0 | 0 | 0 | 115 | M101 L102 F108 M109 G110 | M101-G106 PolarHBondContact O-N 2.91Å; L102-G106 WeakPolarHBondContact O-CA 3.5Å; L102-G106 PolarHBondContact O-N 2.87Å; G106-F108 VanDerWaalsContact C-N 3.33Å; G106-F108 PolarHBondContact O-N 2.63Å; G106-M109 PolarHBondContact O-N 3.13Å; G106-G110 PolarHBondContact O-N 3.1Å | ||
| 107 | S | 92.2 | Very high | 92.1 | Very high | 47 Ų | 47 | 25.1 Ų | 25.1 | 33% | 0.329 | 14% | 0.135 | S | C | . | . | H | α-helix | trans | -55.9 | -39.6 | -169.4 | 177.8 | 0 | 0 | 0 | 0 | 114.3 | F111 H337 Y451 | S107-F111 WeakPolarHBondContact O-CB 3.45Å; S107-F111 PolarHBondContact O-N 3.3Å; S107-H337 PolarHBondContact O-CE1 3.49Å; S107-H337 PolarHBondContact OG-CE1 3.41Å; S107-H337 PolarHBondContact OG-NE2 2.67Å; S107-Y451 WeakPolarHBondContact CB-OH 3.45Å; S107-Y451 PolarHBondContact OG-OH 3.11Å |
| 108 | F | 94.6 | Very high | 92.2 | Very high | 75 Ų | 75 | 24.9 Ų | 24.9 | 33% | 0.329 | 13% | 0.133 | S | C | . | . | H | α-helix | trans | -65.6 | -49.5 | -177.9 | 175 | -115.1 | 0 | 0 | 0 | 112.5 | G106 F111 L112 I448 Y451 | G106-F108 VanDerWaalsContact C-N 3.33Å; G106-F108 PolarHBondContact O-N 2.63Å; F108-F111 PolarHBondContact O-N 3.34Å; F108-L112 HydrophobicContact CD1-CD1 4.28Å; F108-L112 HydrophobicContact CE1-CD1 3.63Å; F108-L112 HydrophobicContact CE1-CG 4.48Å; F108-L112 HydrophobicContact CE2-CD1 4.04Å; F108-L112 HydrophobicContact CE2-CG 4.14Å; F108-L112 HydrophobicContact CZ-CD1 3.51Å; F108-L112 HydrophobicContact CZ-CG 4.13Å; F108-L112 PolarHBondContact O-N 2.93Å; F108-I448 HydrophobicContact CE2-CG1 4.17Å; F108-I448 HydrophobicContact CE2-CG2 4.36Å; F108-I448 HydrophobicContact CZ-CD1 4.31Å; F108-I448 HydrophobicContact CZ-CG1 3.99Å; F108-Y451 HydrophobicContact CB-CE1 3.98Å; F108-Y451 AromaticContact CD2-CD1 3.5Å; F108-Y451 HydrophobicContact CD2-CD1 3.5Å; F108-Y451 AromaticContact CD2-CE1 3.68Å; F108-Y451 HydrophobicContact CD2-CE1 3.68Å; F108-Y451 HydrophobicContact CD2-CG 4.02Å; F108-Y451 HydrophobicContact CE2-CD1 4.15Å; F108-Y451 HydrophobicContact CG-CE1 4.3Å; F108-Y451 PolarHBondContact N-OH 3.47Å |
| 109 | M | 94.3 | Very high | 92.2 | Very high | 60 Ų | 60 | 26.1 Ų | 26.1 | 30% | 0.296 | 14% | 0.14 | S | C | . | . | H | α-helix | trans | -71.5 | -34.3 | -179.9 | -70.6 | -56.6 | -65.5 | 0 | 0 | 111.9 | M101 F105 G106 L112 R113 | M101-M109 HydrophobicContact CE-CB 4.16Å; M101-M109 HydrophobicContact CE-CE 3.51Å; F105-M109 HydrophobicContact CB-CB 3.58Å; F105-M109 HydrophobicContact CB-CG 3.61Å; F105-M109 HydrophobicContact CG-CB 4.48Å; F105-M109 HydrophobicContact CG-CG 4.38Å; G106-M109 PolarHBondContact O-N 3.13Å; M109-L112 PolarHBondContact O-N 3.23Å; M109-L112 HydrophobicContact SD-CD1 4.11Å; M109-R113 WeakPolarHBondContact O-CB 3.49Å; M109-R113 PolarHBondContact O-N 3.44Å |
| 110 | G | 92.9 | Very high | 92.3 | Very high | 0 Ų | 0 | 25.9 Ų | 25.9 | 0% | 0 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -55.8 | -51.9 | 167.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | Y98 G106 L112 R113 L114 | Y98-G110 WeakPolarHBondContact CD2-O 3.49Å; Y98-G110 WeakPolarHBondContact CE2-O 3.31Å; G106-G110 PolarHBondContact O-N 3.1Å; G110-L112 PolarHBondContact O-N 3.47Å; G110-R113 PolarHBondContact O-N 3.19Å; G110-L114 PolarHBondContact O-N 3.29Å |
| 111 | F | 93.4 | Very high | 92.2 | Very high | 4 Ų | 4 | 26 Ų | 26 | 2% | 0.018 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -60.1 | -44.6 | 178.3 | -178.9 | -86.6 | 0 | 0 | 0 | 112.5 | S107 F108 R113 L114 W115 H337 G447 V450 Y451 | S107-F111 WeakPolarHBondContact O-CB 3.45Å; S107-F111 PolarHBondContact O-N 3.3Å; F108-F111 PolarHBondContact O-N 3.34Å; F111-R113 VanDerWaalsContact C-N 3.31Å; F111-R113 PolarHBondContact O-N 3Å; F111-L114 WeakPolarHBondContact O-CB 3.35Å; F111-L114 PolarHBondContact O-N 3.38Å; F111-W115 HydrophobicContact CD1-CB 4.37Å; F111-W115 HydrophobicContact CE1-CB 4.07Å; F111-W115 HydrophobicContact CE1-CD2 4.35Å; F111-W115 HydrophobicContact CE1-CE3 4.09Å; F111-W115 HydrophobicContact CE1-CG 4.37Å; F111-W115 AromaticContact CZ-CE3 3.86Å; F111-W115 HydrophobicContact CZ-CE3 3.86Å; F111-W115 HydrophobicContact CZ-CZ3 4.49Å; F111-W115 WeakPolarHBondContact O-CB 3.23Å; F111-W115 PolarHBondContact O-N 2.9Å; F111-H337 HydrophobicContact CD2-CB 3.93Å; F111-H337 WeakPolarHBondContact CE2-O 3.38Å; F111-G447 VanDerWaalsContact CE1-O 3.26Å; F111-G447 WeakPolarHBondContact CE1-O 3.37Å; F111-V450 HydrophobicContact CZ-CB 4.39Å; F111-V450 HydrophobicContact CZ-CG1 3.99Å; F111-Y451 HydrophobicContact CB-CD2 3.47Å; F111-Y451 VanDerWaalsContact CB-CD2 3.47Å; F111-Y451 HydrophobicContact CB-CE2 3.78Å; F111-Y451 HydrophobicContact CB-CG 4.41Å; F111-Y451 AromaticContact CD1-CD2 3.74Å; F111-Y451 HydrophobicContact CD1-CD2 3.74Å; F111-Y451 HydrophobicContact CD1-CG 4.06Å; F111-Y451 AromaticContact CD2-CD2 3.81Å; F111-Y451 HydrophobicContact CD2-CD2 3.81Å; F111-Y451 HydrophobicContact CE1-CD2 4.46Å; F111-Y451 HydrophobicContact CE2-CD2 4.49Å; F111-Y451 AromaticContact CG-CD2 3.38Å; F111-Y451 HydrophobicContact CG-CD2 3.38Å; F111-Y451 HydrophobicContact CG-CE2 4.16Å; F111-Y451 HydrophobicContact CG-CG 4.17Å |
| 112 | L | 93.6 | Very high | 91.9 | Very high | 19 Ų | 19 | 26.1 Ų | 26.1 | 10% | 0.099 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -61 | -40.7 | 177.7 | -76 | -179.3 | 0 | 0 | 0 | 112 | F108 M109 G110 L114 W115 I116 I448 | F108-L112 HydrophobicContact CD1-CD1 4.28Å; F108-L112 HydrophobicContact CE1-CD1 3.63Å; F108-L112 HydrophobicContact CE1-CG 4.48Å; F108-L112 HydrophobicContact CE2-CD1 4.04Å; F108-L112 HydrophobicContact CE2-CG 4.14Å; F108-L112 HydrophobicContact CZ-CD1 3.51Å; F108-L112 HydrophobicContact CZ-CG 4.13Å; F108-L112 PolarHBondContact O-N 2.93Å; M109-L112 PolarHBondContact O-N 3.23Å; M109-L112 HydrophobicContact SD-CD1 4.11Å; G110-L112 PolarHBondContact O-N 3.47Å; L112-L114 VanDerWaalsContact C-N 3.35Å; L112-W115 PolarHBondContact O-N 3.19Å; L112-I116 WeakPolarHBondContact O-CB 3.47Å; L112-I116 WeakPolarHBondContact O-CG1 3.34Å; L112-I116 PolarHBondContact O-N 3.49Å; L112-I448 HydrophobicContact CD2-CG1 4.19Å |
| 113 | R | 92.8 | Very high | 91.9 | Very high | 8 Ų | 8 | 24.8 Ų | 24.8 | 3% | 0.03 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -62.2 | -43.8 | 175.2 | 177.6 | 64.7 | -165.7 | 92.4 | -4 | 111.5 | D97 M101 M109 G110 F111 E117 | D97-R113 HydrophobicContact CB-CG 4.28Å; D97-R113 VanDerWaalsContact CB-NE 3.32Å; D97-R113 IonicContact OD2-CZ 2.72Å; D97-R113 IonicContact OD2-NE 2.76Å; D97-R113 IonicContact OD2-NH2 2.71Å; D97-R113 PolarHBondContact OD2-NH2 2.97Å; M101-R113 HydrophobicContact CB-CB 4.15Å; M101-R113 HydrophobicContact CG-CB 3.97Å; M101-R113 HydrophobicContact CG-CG 4.03Å; M109-R113 WeakPolarHBondContact O-CB 3.49Å; M109-R113 PolarHBondContact O-N 3.44Å; G110-R113 PolarHBondContact O-N 3.19Å; F111-R113 VanDerWaalsContact C-N 3.31Å; F111-R113 PolarHBondContact O-N 3Å; R113-E117 IonicContact CZ-OE2 3.54Å; R113-E117 IonicContact NH1-OE2 3.2Å; R113-E117 PolarHBondContact NH1-OE2 3.16Å; R113-E117 IonicContact NH2-OE2 3.52Å; R113-E117 PolarHBondContact NH2-OE2 3.35Å; R113-E117 PolarHBondContact O-N 3.24Å; R113-E117 VanDerWaalsContact O-N 3.16Å |
| 114 | L | 92.1 | Very high | 91.9 | Very high | 1 Ų | 1 | 22 Ų | 22 | 1% | 0.005 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -61.7 | -47.4 | 175 | 173.1 | 70 | 0 | 0 | 0 | 111.4 | Y98 G110 F111 L112 I116 E117 V118 I328 A332 H337 M338 | Y98-L114 HydrophobicContact CD2-CB 3.77Å; Y98-L114 HydrophobicContact CE2-CB 4.1Å; Y98-L114 HydrophobicContact CE2-CD2 4.5Å; G110-L114 PolarHBondContact O-N 3.29Å; F111-L114 WeakPolarHBondContact O-CB 3.35Å; F111-L114 PolarHBondContact O-N 3.38Å; L112-L114 VanDerWaalsContact C-N 3.35Å; L114-I116 PolarHBondContact O-N 3.47Å; L114-E117 WeakPolarHBondContact O-CB 3.42Å; L114-E117 PolarHBondContact O-N 3Å; L114-E117 VanDerWaalsContact O-N 3.08Å; L114-V118 HydrophobicContact CD1-CG1 3.8Å; L114-V118 WeakPolarHBondContact O-CG2 3.5Å; L114-V118 PolarHBondContact O-N 3.03Å; L114-I328 HydrophobicContact CD1-CG2 3.44Å; L114-I328 VanDerWaalsContact CD1-CG2 3.44Å; L114-A332 HydrophobicContact CD1-CB 3.72Å; L114-A332 HydrophobicContact CD2-CB 3.38Å; L114-A332 HydrophobicContact CG-CB 4.19Å; L114-H337 HydrophobicContact CD2-CB 3.88Å; L114-M338 HydrophobicContact CD2-CE 4.02Å; L114-M338 HydrophobicContact CD2-CG 4.02Å; L114-M338 HydrophobicContact CG-CE 4.26Å |
| 115 | W | 92.3 | Very high | 91.7 | Very high | 30 Ų | 30 | 21.6 Ų | 21.6 | 11% | 0.114 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -57.1 | -49.2 | -179.2 | -177.1 | -101.2 | 0 | 0 | 0 | 111.3 | F111 L112 E117 V118 M119 I443 T446 G447 V450 | F111-W115 HydrophobicContact CD1-CB 4.37Å; F111-W115 HydrophobicContact CE1-CB 4.07Å; F111-W115 HydrophobicContact CE1-CD2 4.35Å; F111-W115 HydrophobicContact CE1-CE3 4.09Å; F111-W115 HydrophobicContact CE1-CG 4.37Å; F111-W115 AromaticContact CZ-CE3 3.86Å; F111-W115 HydrophobicContact CZ-CE3 3.86Å; F111-W115 HydrophobicContact CZ-CZ3 4.49Å; F111-W115 WeakPolarHBondContact O-CB 3.23Å; F111-W115 PolarHBondContact O-N 2.9Å; L112-W115 PolarHBondContact O-N 3.19Å; W115-E117 VanDerWaalsContact C-N 3.28Å; W115-E117 PolarHBondContact O-N 3.5Å; W115-V118 PolarHBondContact O-N 3.02Å; W115-M119 HydrophobicContact CD2-CB 4.5Å; W115-M119 HydrophobicContact CD2-CG 3.7Å; W115-M119 HydrophobicContact CE3-CE 4.09Å; W115-M119 HydrophobicContact CE3-CG 3.77Å; W115-M119 HydrophobicContact CG-CG 4.36Å; W115-M119 HydrophobicContact CH2-CE 3.87Å; W115-M119 HydrophobicContact CH2-CG 3.82Å; W115-M119 HydrophobicContact CH2-SD 3.99Å; W115-M119 HydrophobicContact CZ2-CG 3.78Å; W115-M119 HydrophobicContact CZ2-SD 4.36Å; W115-M119 HydrophobicContact CZ3-CE 3.51Å; W115-M119 HydrophobicContact CZ3-CG 3.83Å; W115-M119 HydrophobicContact CZ3-SD 4.16Å; W115-M119 WeakPolarHBondContact O-CB 3.37Å; W115-M119 WeakPolarHBondContact O-CG 3.22Å; W115-M119 PolarHBondContact O-N 3.1Å; W115-I443 PolarHBondContact NE1-O 3.36Å; W115-T446 PolarHBondContact NE1-OG1 3.14Å; W115-G447 VanDerWaalsContact CD1-CA 3.43Å; W115-V450 HydrophobicContact CE3-CG1 4.32Å; W115-V450 HydrophobicContact CH2-CB 4.14Å; W115-V450 HydrophobicContact CH2-CG1 4.01Å; W115-V450 HydrophobicContact CH2-CG2 3.72Å; W115-V450 HydrophobicContact CZ2-CG2 4.08Å; W115-V450 HydrophobicContact CZ3-CB 4.12Å; W115-V450 HydrophobicContact CZ3-CG1 3.65Å; W115-V450 HydrophobicContact CZ3-CG2 4.22Å |
| 116 | I | 91.9 | Very high | 91.5 | Very high | 12 Ų | 12 | 17.6 Ų | 17.6 | 6% | 0.062 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -54.8 | -46.4 | 173.9 | -75.2 | 168.4 | 0 | 0 | 0 | 111.1 | L112 L114 V120 A121 V382 A386 I444 | L112-I116 WeakPolarHBondContact O-CB 3.47Å; L112-I116 WeakPolarHBondContact O-CG1 3.34Å; L112-I116 PolarHBondContact O-N 3.49Å; L114-I116 PolarHBondContact O-N 3.47Å; I116-V120 WeakPolarHBondContact O-CA 3.37Å; I116-V120 VanDerWaalsContact O-CB 3.31Å; I116-V120 WeakPolarHBondContact O-CB 3.35Å; I116-V120 PolarHBondContact O-N 3.29Å; I116-V120 VanDerWaalsContact O-N 3.07Å; I116-A121 PolarHBondContact O-N 2.96Å; I116-V382 HydrophobicContact CB-CG1 4.18Å; I116-V382 HydrophobicContact CD1-CG1 4.26Å; I116-V382 HydrophobicContact CG1-CG1 3.89Å; I116-V382 HydrophobicContact CG2-CG1 3.42Å; I116-V382 VanDerWaalsContact CG2-CG1 3.42Å; I116-A386 HydrophobicContact CD1-CB 4.17Å; I116-A386 HydrophobicContact CG2-CB 4.13Å; I116-I444 HydrophobicContact CD1-CD1 4.22Å; I116-I444 HydrophobicContact CD1-CG1 3.86Å; I116-I444 HydrophobicContact CD1-CG2 4.21Å; I116-I444 HydrophobicContact CG1-CG1 3.92Å |
| 117 | E | 89.8 | Confident | 91.5 | Very high | 12 Ų | 12 | 16.2 Ų | 16.2 | 6% | 0.056 | 8% | 0.082 | C | C | . | . | I | π-helix | trans | -63.4 | -52.1 | -176.5 | -163.8 | 67 | -177.3 | 0 | 0 | 111.8 | R113 L114 W115 A121 R122 I328 | R113-E117 IonicContact CZ-OE2 3.54Å; R113-E117 IonicContact NH1-OE2 3.2Å; R113-E117 PolarHBondContact NH1-OE2 3.16Å; R113-E117 IonicContact NH2-OE2 3.52Å; R113-E117 PolarHBondContact NH2-OE2 3.35Å; R113-E117 PolarHBondContact O-N 3.24Å; R113-E117 VanDerWaalsContact O-N 3.16Å; L114-E117 WeakPolarHBondContact O-CB 3.42Å; L114-E117 PolarHBondContact O-N 3Å; L114-E117 VanDerWaalsContact O-N 3.08Å; W115-E117 VanDerWaalsContact C-N 3.28Å; W115-E117 PolarHBondContact O-N 3.5Å; E117-A121 PolarHBondContact O-N 3.19Å; E117-R122 HydrophobicContact CG-CG 4.04Å; E117-R122 WeakPolarHBondContact O-CB 3.42Å; E117-R122 VanDerWaalsContact O-CG 3.26Å; E117-R122 WeakPolarHBondContact O-CG 3.32Å; E117-R122 PolarHBondContact O-N 3.05Å; E117-R122 IonicContact OE1-CZ 2.68Å; E117-R122 IonicContact OE1-NE 3.89Å; E117-R122 PolarHBondContact OE1-NE 3.3Å; E117-R122 IonicContact OE1-NH2 3.03Å; E117-R122 PolarHBondContact OE1-NH2 2.58Å; E117-I328 HydrophobicContact CG-CD1 3.88Å |
| 118 | V | 89.5 | Confident | 91.5 | Very high | 1 Ų | 1 | 14 Ų | 14 | 1% | 0.006 | 7% | 0.066 | C | C | . | . | I | π-helix | trans | -85.8 | -24.7 | -168.6 | -59.7 | 0 | 0 | 0 | 0 | 113.6 | L114 W115 P123 I328 F329 M338 | L114-V118 HydrophobicContact CD1-CG1 3.8Å; L114-V118 WeakPolarHBondContact O-CG2 3.5Å; L114-V118 PolarHBondContact O-N 3.03Å; W115-V118 PolarHBondContact O-N 3.02Å; V118-P123 WeakPolarHBondContact O-CD 3.49Å; V118-P123 WeakPolarHBondContact O-CG 3.14Å; V118-I328 HydrophobicContact CG1-CG2 4.02Å; V118-F329 HydrophobicContact CB-CE1 3.83Å; V118-F329 HydrophobicContact CB-CZ 3.79Å; V118-F329 HydrophobicContact CG1-CD1 4.38Å; V118-F329 HydrophobicContact CG1-CE1 3.75Å; V118-F329 HydrophobicContact CG1-CZ 3.91Å; V118-F329 HydrophobicContact CG2-CE1 4.23Å; V118-M338 HydrophobicContact CG2-CE 3.6Å |
| 119 | M | 89.6 | Confident | 91.3 | Very high | 39 Ų | 39 | 11 Ų | 11 | 19% | 0.192 | 5% | 0.053 | C | C | . | . | I | π-helix | trans | -96.9 | -28.1 | 179 | -62.3 | -68.4 | 160.3 | 0 | 0 | 112.7 | W115 F358 Y366 | W115-M119 HydrophobicContact CD2-CB 4.5Å; W115-M119 HydrophobicContact CD2-CG 3.7Å; W115-M119 HydrophobicContact CE3-CE 4.09Å; W115-M119 HydrophobicContact CE3-CG 3.77Å; W115-M119 HydrophobicContact CG-CG 4.36Å; W115-M119 HydrophobicContact CH2-CE 3.87Å; W115-M119 HydrophobicContact CH2-CG 3.82Å; W115-M119 HydrophobicContact CH2-SD 3.99Å; W115-M119 HydrophobicContact CZ2-CG 3.78Å; W115-M119 HydrophobicContact CZ2-SD 4.36Å; W115-M119 HydrophobicContact CZ3-CE 3.51Å; W115-M119 HydrophobicContact CZ3-CG 3.83Å; W115-M119 HydrophobicContact CZ3-SD 4.16Å; W115-M119 WeakPolarHBondContact O-CB 3.37Å; W115-M119 WeakPolarHBondContact O-CG 3.22Å; W115-M119 PolarHBondContact O-N 3.1Å; M119-F358 HydrophobicContact CE-CE1 3.88Å; M119-F358 HydrophobicContact CE-CE2 4.14Å; M119-F358 HydrophobicContact CE-CZ 3.24Å; M119-F358 HydrophobicContact SD-CE1 4.27Å; M119-F358 HydrophobicContact SD-CZ 3.69Å; M119-Y366 WeakPolarHBondContact O-CE2 3.31Å; M119-Y366 PolarHBondContact O-OH 3.22Å |
| 120 | V | 88.9 | Confident | 91.3 | Very high | 4 Ų | 4 | 8.1 Ų | 8.1 | 2% | 0.024 | 4% | 0.039 | C | C | . | . | I | π-helix | trans | -118 | -63.1 | -174.5 | -168.8 | 0 | 0 | 0 | 0 | 111.2 | I116 R122 P123 A124 V382 I443 | I116-V120 WeakPolarHBondContact O-CA 3.37Å; I116-V120 VanDerWaalsContact O-CB 3.31Å; I116-V120 WeakPolarHBondContact O-CB 3.35Å; I116-V120 PolarHBondContact O-N 3.29Å; I116-V120 VanDerWaalsContact O-N 3.07Å; V120-R122 PolarHBondContact O-N 2.86Å; V120-P123 WeakPolarHBondContact O-CD 3.44Å; V120-A124 WeakPolarHBondContact O-CB 3.43Å; V120-A124 PolarHBondContact O-N 3.4Å; V120-V382 HydrophobicContact CB-CG1 4.48Å; V120-V382 HydrophobicContact CG1-CB 4.42Å; V120-V382 HydrophobicContact CG1-CG1 4.36Å; V120-I443 HydrophobicContact CG2-CB 4.34Å; V120-I443 HydrophobicContact CG2-CG2 3.26Å |
| 121 | A | 88.9 | Confident | 91.2 | Very high | 2 Ų | 2 | 8.6 Ų | 8.6 | 2% | 0.017 | 4% | 0.042 | C | C | . | . | I | π-helix | trans | -65.3 | -51 | -163.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | I116 E117 T125 L379 | I116-A121 PolarHBondContact O-N 2.96Å; E117-A121 PolarHBondContact O-N 3.19Å; A121-T125 WeakPolarHBondContact O-CB 3.47Å; A121-T125 PolarHBondContact O-N 2.91Å; A121-T125 PolarHBondContact O-OG1 3.33Å; A121-L379 VanDerWaalsContact CA-CD1 3.44Å; A121-L379 HydrophobicContact CB-CD1 4.03Å |
| 122 | R | 89.2 | Confident | 91.2 | Very high | 8 Ų | 8 | 8.6 Ų | 8.6 | 3% | 0.03 | 4% | 0.042 | C | C | . | . | H | α-helix | trans | -68.5 | -51 | -178.6 | -59.1 | -70.4 | 174.3 | 155.7 | -6.8 | 112.2 | E117 V120 A124 T125 M126 Y238 T324 T325 | E117-R122 HydrophobicContact CG-CG 4.04Å; E117-R122 WeakPolarHBondContact O-CB 3.42Å; E117-R122 VanDerWaalsContact O-CG 3.26Å; E117-R122 WeakPolarHBondContact O-CG 3.32Å; E117-R122 PolarHBondContact O-N 3.05Å; E117-R122 IonicContact OE1-CZ 2.68Å; E117-R122 IonicContact OE1-NE 3.89Å; E117-R122 PolarHBondContact OE1-NE 3.3Å; E117-R122 IonicContact OE1-NH2 3.03Å; E117-R122 PolarHBondContact OE1-NH2 2.58Å; V120-R122 PolarHBondContact O-N 2.86Å; R122-A124 PolarHBondContact O-N 3.43Å; R122-T125 PolarHBondContact O-N 2.78Å; R122-M126 WeakPolarHBondContact O-CB 3.41Å; R122-M126 PolarHBondContact O-N 3.25Å; R122-Y238 PolarHBondContact NH1-OH 3.34Å; R122-T324 PolarHBondContact NH1-OG1 2.77Å; R122-T325 HydrophobicContact CB-CG2 4.23Å; R122-T325 WeakPolarHBondContact CB-OG1 3.37Å; R122-T325 WeakPolarHBondContact CD-OG1 3.39Å; R122-T325 HydrophobicContact CG-CG2 4.27Å; R122-T325 WeakPolarHBondContact CG-OG1 3.38Å |
| 123 | P | 91.6 | Very high | 91.1 | Very high | 0 Ų | 0 | 8.7 Ų | 8.7 | 0% | 0 | 4% | 0.042 | C | C | . | . | H | α-helix | trans | -63.4 | -43.5 | -179.3 | -25.1 | 38.1 | 0 | 0 | 0 | 113.2 | V118 V120 M126 A127 T362 Y366 | V118-P123 WeakPolarHBondContact O-CD 3.49Å; V118-P123 WeakPolarHBondContact O-CG 3.14Å; V120-P123 WeakPolarHBondContact O-CD 3.44Å; P123-M126 PolarHBondContact O-N 3.02Å; P123-A127 WeakPolarHBondContact O-CB 3.44Å; P123-A127 PolarHBondContact O-N 2.94Å; P123-T362 WeakPolarHBondContact CG-OG1 3.38Å; P123-Y366 HydrophobicContact CB-CD2 3.52Å; P123-Y366 HydrophobicContact CB-CE2 3.83Å; P123-Y366 HydrophobicContact CB-CG 4.45Å |
| 124 | A | 90.5 | Very high | 91.2 | Very high | 0 Ų | 0 | 8.3 Ų | 8.3 | 0% | 0 | 4% | 0.04 | C | C | . | . | H | α-helix | trans | -65.3 | -44.8 | 178.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | V120 R122 M126 A127 V128 Y366 L375 L379 | V120-A124 WeakPolarHBondContact O-CB 3.43Å; V120-A124 PolarHBondContact O-N 3.4Å; R122-A124 PolarHBondContact O-N 3.43Å; A124-M126 VanDerWaalsContact C-N 3.3Å; A124-M126 PolarHBondContact O-N 2.87Å; A124-A127 PolarHBondContact O-N 3.26Å; A124-V128 WeakPolarHBondContact O-CG2 3.44Å; A124-V128 PolarHBondContact O-N 3.07Å; A124-Y366 HydrophobicContact CB-CD1 3.95Å; A124-Y366 HydrophobicContact CB-CE1 3.98Å; A124-Y366 HydrophobicContact CB-CG 4.37Å; A124-L375 HydrophobicContact CB-CD1 3.8Å; A124-L375 HydrophobicContact CB-CD2 4.5Å; A124-L375 HydrophobicContact CB-CG 4.23Å; A124-L379 HydrophobicContact CB-CB 4.44Å; A124-L379 HydrophobicContact CB-CD1 4.24Å; A124-L379 HydrophobicContact CB-CD2 4.45Å |
| 125 | T | 90.1 | Very high | 91.2 | Very high | 18 Ų | 18 | 10.6 Ų | 10.6 | 11% | 0.11 | 5% | 0.05 | C | C | . | . | H | α-helix | trans | -57 | -47.9 | 174 | -61.8 | 0 | 0 | 0 | 0 | 110.1 | A121 R122 A127 V128 I129 F231 N321 L379 | A121-T125 WeakPolarHBondContact O-CB 3.47Å; A121-T125 PolarHBondContact O-N 2.91Å; A121-T125 PolarHBondContact O-OG1 3.33Å; R122-T125 PolarHBondContact O-N 2.78Å; T125-A127 VanDerWaalsContact C-N 3.31Å; T125-A127 PolarHBondContact O-N 3.22Å; T125-V128 PolarHBondContact O-N 2.86Å; T125-I129 HydrophobicContact CG2-CD1 3.77Å; T125-I129 HydrophobicContact CG2-CG1 4.25Å; T125-I129 WeakPolarHBondContact O-CG1 3.37Å; T125-I129 PolarHBondContact O-N 3.36Å; T125-F231 HydrophobicContact CG2-CE2 4.03Å; T125-F231 HydrophobicContact CG2-CZ 4.4Å; T125-N321 WeakPolarHBondContact CG2-ND2 3.38Å; T125-L379 WeakPolarHBondContact OG1-CD2 3.37Å |
| 126 | M | 91.1 | Very high | 91.2 | Very high | 0 Ų | 0 | 9.2 Ų | 9.2 | 0% | 0 | 5% | 0.045 | C | C | . | . | H | α-helix | trans | -58.5 | -43.2 | 179.1 | -169 | 169 | 68.4 | 0 | 0 | 112.3 | R122 P123 A124 I129 A130 I160 V318 M322 T359 | R122-M126 WeakPolarHBondContact O-CB 3.41Å; R122-M126 PolarHBondContact O-N 3.25Å; P123-M126 PolarHBondContact O-N 3.02Å; A124-M126 VanDerWaalsContact C-N 3.3Å; A124-M126 PolarHBondContact O-N 2.87Å; M126-I129 PolarHBondContact O-N 2.88Å; M126-A130 VanDerWaalsContact O-CB 3.3Å; M126-A130 WeakPolarHBondContact O-CB 3.37Å; M126-A130 PolarHBondContact O-N 2.93Å; M126-I160 HydrophobicContact CE-CD1 4.21Å; M126-I160 HydrophobicContact CE-CG1 4.39Å; M126-I160 HydrophobicContact CE-CG2 3.72Å; M126-I160 HydrophobicContact CG-CD1 4.33Å; M126-I160 HydrophobicContact CG-CG1 4.25Å; M126-I160 HydrophobicContact SD-CG2 4.28Å; M126-V318 HydrophobicContact CG-CB 4.45Å; M126-V318 HydrophobicContact CG-CG1 3.76Å; M126-V318 HydrophobicContact CG-CG2 4.35Å; M126-V318 HydrophobicContact SD-CG1 3.96Å; M126-M322 HydrophobicContact SD-CE 4.32Å; M126-M322 HydrophobicContact SD-SD 4.24Å; M126-T359 HydrophobicContact CE-CG2 3.95Å; M126-T359 WeakPolarHBondContact CE-O 3.32Å; M126-T359 HydrophobicContact SD-CG2 4.13Å |
| 127 | A | 92.7 | Very high | 91.3 | Very high | 0 Ų | 0 | 11.5 Ų | 11.5 | 0% | 0 | 6% | 0.056 | C | C | . | . | H | α-helix | trans | -62.6 | -46.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | P123 A124 T125 I129 A130 M131 L367 L375 | P123-A127 WeakPolarHBondContact O-CB 3.44Å; P123-A127 PolarHBondContact O-N 2.94Å; A124-A127 PolarHBondContact O-N 3.26Å; T125-A127 VanDerWaalsContact C-N 3.31Å; T125-A127 PolarHBondContact O-N 3.22Å; A127-I129 PolarHBondContact O-N 3.46Å; A127-A130 PolarHBondContact O-N 3.41Å; A127-M131 HydrophobicContact CB-CE 4.22Å; A127-M131 WeakPolarHBondContact O-CB 3.26Å; A127-M131 WeakPolarHBondContact O-CE 3.39Å; A127-M131 WeakPolarHBondContact O-CG 3.34Å; A127-M131 PolarHBondContact O-N 2.89Å; A127-L367 HydrophobicContact CB-CD2 3.85Å; A127-L367 HydrophobicContact CB-CG 4.35Å; A127-L375 HydrophobicContact CB-CD2 4.22Å |
| 128 | V | 91.1 | Very high | 91.5 | Very high | 0 Ų | 0 | 11.4 Ų | 11.4 | 0% | 0 | 6% | 0.057 | C | C | . | . | H | α-helix | trans | -58.7 | -47.1 | 176.6 | 171.9 | 0 | 0 | 0 | 0 | 111 | A124 T125 M131 T132 F231 I372 L375 M376 | A124-V128 WeakPolarHBondContact O-CG2 3.44Å; A124-V128 PolarHBondContact O-N 3.07Å; T125-V128 PolarHBondContact O-N 2.86Å; V128-M131 PolarHBondContact O-N 3.42Å; V128-T132 PolarHBondContact O-N 3.47Å; V128-T132 PolarHBondContact O-OG1 2.87Å; V128-F231 HydrophobicContact CB-CE2 4.35Å; V128-F231 HydrophobicContact CB-CZ 4.03Å; V128-F231 HydrophobicContact CG1-CE1 3.91Å; V128-F231 HydrophobicContact CG1-CE2 4.1Å; V128-F231 HydrophobicContact CG1-CZ 3.47Å; V128-F231 VanDerWaalsContact CG1-CZ 3.47Å; V128-I372 HydrophobicContact CG1-CD1 4.4Å; V128-I372 HydrophobicContact CG1-CG1 4.35Å; V128-I372 HydrophobicContact CG2-CG1 4.21Å; V128-L375 HydrophobicContact CG2-CB 4.45Å; V128-L375 HydrophobicContact CG2-CD2 3.71Å; V128-L375 HydrophobicContact CG2-CG 3.98Å; V128-M376 HydrophobicContact CG1-CE 3.41Å; V128-M376 VanDerWaalsContact CG1-CE 3.41Å; V128-M376 HydrophobicContact CG1-CG 4.34Å; V128-M376 HydrophobicContact CG2-CG 4.26Å |
| 129 | I | 91.3 | Very high | 91.6 | Very high | 12 Ų | 12 | 12.2 Ų | 12.2 | 6% | 0.062 | 6% | 0.06 | C | C | . | . | H | α-helix | trans | -65.4 | -42.7 | 180 | -58.4 | -179.2 | 0 | 0 | 0 | 110.9 | S47 T125 M126 A127 T132 F133 F231 T314 V318 | S47-I129 WeakPolarHBondContact OG-CG1 3.24Å; S47-I129 WeakPolarHBondContact OG-CG2 3.48Å; T125-I129 HydrophobicContact CG2-CD1 3.77Å; T125-I129 HydrophobicContact CG2-CG1 4.25Å; T125-I129 WeakPolarHBondContact O-CG1 3.37Å; T125-I129 PolarHBondContact O-N 3.36Å; M126-I129 PolarHBondContact O-N 2.88Å; A127-I129 PolarHBondContact O-N 3.46Å; I129-T132 WeakPolarHBondContact O-CB 3.32Å; I129-T132 PolarHBondContact O-N 3.24Å; I129-F133 PolarHBondContact O-N 3.29Å; I129-F231 HydrophobicContact CG1-CZ 4.27Å; I129-T314 HydrophobicContact CG2-CG2 4.31Å; I129-T314 WeakPolarHBondContact CG2-O 3.46Å; I129-V318 HydrophobicContact CB-CG2 3.95Å; I129-V318 HydrophobicContact CG2-CG2 3.68Å |
| 130 | A | 93.6 | Very high | 91.6 | Very high | 0 Ų | 0 | 12.5 Ų | 12.5 | 0% | 0 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -67 | -36.4 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | M126 A127 T132 F133 A134 A156 I160 V318 | M126-A130 VanDerWaalsContact O-CB 3.3Å; M126-A130 WeakPolarHBondContact O-CB 3.37Å; M126-A130 PolarHBondContact O-N 2.93Å; A127-A130 PolarHBondContact O-N 3.41Å; A130-T132 VanDerWaalsContact C-N 3.33Å; A130-F133 WeakPolarHBondContact O-CB 3.48Å; A130-F133 PolarHBondContact O-N 2.94Å; A130-A134 PolarHBondContact O-N 3.22Å; A130-A134 VanDerWaalsContact O-N 3.09Å; A130-A156 VanDerWaalsContact C-CB 3.47Å; A130-A156 HydrophobicContact CB-CB 3.88Å; A130-A156 WeakPolarHBondContact O-CB 3.06Å; A130-I160 HydrophobicContact CB-CD1 3.89Å; A130-I160 HydrophobicContact CB-CG1 3.76Å; A130-V318 HydrophobicContact CB-CG2 4.13Å |
| 131 | M | 92.4 | Very high | 91.8 | Very high | 11 Ų | 11 | 17.5 Ų | 17.5 | 5% | 0.054 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -67.1 | -35.9 | 171.7 | -76.8 | -174.5 | -80 | 0 | 0 | 111.9 | A127 V128 A134 K135 V152 A156 L367 I372 L375 | A127-M131 HydrophobicContact CB-CE 4.22Å; A127-M131 WeakPolarHBondContact O-CB 3.26Å; A127-M131 WeakPolarHBondContact O-CE 3.39Å; A127-M131 WeakPolarHBondContact O-CG 3.34Å; A127-M131 PolarHBondContact O-N 2.89Å; V128-M131 PolarHBondContact O-N 3.42Å; M131-A134 PolarHBondContact O-N 2.89Å; M131-K135 WeakPolarHBondContact O-CG 3.47Å; M131-K135 PolarHBondContact O-N 2.89Å; M131-V152 HydrophobicContact CB-CG1 4.43Å; M131-V152 HydrophobicContact CG-CG1 4.46Å; M131-A156 HydrophobicContact CG-CB 4.11Å; M131-L367 HydrophobicContact CE-CD2 4.25Å; M131-L367 HydrophobicContact CG-CD2 3.65Å; M131-L367 HydrophobicContact SD-CD2 4.26Å; M131-I372 HydrophobicContact CB-CD1 3.5Å; M131-I372 VanDerWaalsContact CB-CD1 3.5Å; M131-I372 HydrophobicContact CB-CG1 4.48Å; M131-I372 HydrophobicContact CE-CD1 3.93Å; M131-I372 HydrophobicContact CE-CG1 3.58Å; M131-I372 HydrophobicContact CG-CD1 4.37Å; M131-I372 HydrophobicContact SD-CD1 4.03Å; M131-I372 HydrophobicContact SD-CG1 4.09Å; M131-L375 HydrophobicContact CE-CD2 4Å |
| 132 | T | 91.4 | Very high | 91.8 | Very high | 3 Ų | 3 | 21.3 Ų | 21.3 | 2% | 0.018 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -62.3 | -47 | 173.6 | -51.7 | 0 | 0 | 0 | 0 | 110.7 | V51 V128 I129 A130 A134 K135 Y136 T314 | V51-T132 HydrophobicContact CG2-CG2 3.37Å; V51-T132 WeakPolarHBondContact CG2-OG1 3.26Å; V128-T132 PolarHBondContact O-N 3.47Å; V128-T132 PolarHBondContact O-OG1 2.87Å; I129-T132 WeakPolarHBondContact O-CB 3.32Å; I129-T132 PolarHBondContact O-N 3.24Å; A130-T132 VanDerWaalsContact C-N 3.33Å; T132-A134 VanDerWaalsContact C-N 3.28Å; T132-A134 PolarHBondContact O-N 3.34Å; T132-K135 PolarHBondContact O-N 3.36Å; T132-Y136 HydrophobicContact CG2-CD2 3.81Å; T132-Y136 HydrophobicContact CG2-CE2 3.88Å; T132-Y136 VanDerWaalsContact O-CD2 3.29Å; T132-Y136 WeakPolarHBondContact O-CD2 3.28Å; T132-Y136 PolarHBondContact O-N 3.24Å; T132-T314 HydrophobicContact CG2-CG2 3.65Å |
| 133 | F | 93.2 | Very high | 91.6 | Very high | 22 Ų | 22 | 24.1 Ų | 24.1 | 10% | 0.096 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -50.4 | -50.5 | 172.5 | 165.4 | -95.1 | 0 | 0 | 0 | 111.4 | I129 A130 Y136 I137 L155 C159 A311 T314 F315 | I129-F133 PolarHBondContact O-N 3.29Å; A130-F133 WeakPolarHBondContact O-CB 3.48Å; A130-F133 PolarHBondContact O-N 2.94Å; F133-Y136 PolarHBondContact O-N 3.44Å; F133-I137 HydrophobicContact CD1-CD1 4.47Å; F133-I137 HydrophobicContact CD2-CD1 4.01Å; F133-I137 HydrophobicContact CE1-CD1 3.84Å; F133-I137 HydrophobicContact CE2-CD1 3.3Å; F133-I137 HydrophobicContact CE2-CG1 4.28Å; F133-I137 HydrophobicContact CZ-CD1 3.21Å; F133-I137 HydrophobicContact CZ-CG1 4.41Å; F133-I137 PolarHBondContact O-N 2.94Å; F133-I137 VanDerWaalsContact O-N 3.08Å; F133-L155 HydrophobicContact CE1-CD1 4.34Å; F133-L155 HydrophobicContact CE1-CG 4.13Å; F133-C159 HydrophobicContact CD1-CB 3.65Å; F133-C159 HydrophobicContact CE1-CB 3.68Å; F133-C159 HydrophobicContact CG-CB 4.39Å; F133-C159 HydrophobicContact CZ-CB 4.41Å; F133-A311 HydrophobicContact CD2-CB 4.01Å; F133-A311 HydrophobicContact CE2-CB 4.07Å; F133-T314 WeakPolarHBondContact CA-OG1 3.17Å; F133-T314 VanDerWaalsContact CB-OG1 3.31Å; F133-T314 WeakPolarHBondContact CB-OG1 3.49Å; F133-F315 HydrophobicContact CD2-CD2 4.29Å; F133-F315 AromaticContact CE2-CD2 3.84Å; F133-F315 HydrophobicContact CE2-CD2 3.84Å; F133-F315 HydrophobicContact CZ-CD2 4.24Å |
| 134 | A | 94.4 | Very high | 91.2 | Very high | 0 Ų | 0 | 31.4 Ų | 31.4 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -63.9 | -46.1 | -178.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | A130 M131 T132 Y136 I137 L138 V152 L155 A156 | A130-A134 PolarHBondContact O-N 3.22Å; A130-A134 VanDerWaalsContact O-N 3.09Å; M131-A134 PolarHBondContact O-N 2.89Å; T132-A134 VanDerWaalsContact C-N 3.28Å; T132-A134 PolarHBondContact O-N 3.34Å; A134-Y136 VanDerWaalsContact C-N 3.29Å; A134-Y136 PolarHBondContact O-N 2.78Å; A134-I137 PolarHBondContact O-N 3.44Å; A134-L138 WeakPolarHBondContact O-CB 3.45Å; A134-L138 WeakPolarHBondContact O-CD1 3.36Å; A134-L138 WeakPolarHBondContact O-CG 3.29Å; A134-L138 PolarHBondContact O-N 3.08Å; A134-V152 HydrophobicContact CB-CB 4.48Å; A134-V152 HydrophobicContact CB-CG1 3.91Å; A134-V152 WeakPolarHBondContact CB-O 3.33Å; A134-L155 HydrophobicContact CB-CB 3.87Å; A134-L155 HydrophobicContact CB-CD2 3.97Å; A134-L155 HydrophobicContact CB-CG 3.99Å; A134-A156 HydrophobicContact CB-CB 4.33Å |
| 135 | K | 92 | Very high | 91 | Very high | 48 Ų | 48 | 35.2 Ų | 35.2 | 21% | 0.209 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -58.9 | -40.9 | 178.6 | -74.8 | -178.6 | 174.7 | -172.8 | 0 | 112.6 | M131 T132 Q139 Q147 V152 P288 | M131-K135 WeakPolarHBondContact O-CG 3.47Å; M131-K135 PolarHBondContact O-N 2.89Å; T132-K135 PolarHBondContact O-N 3.36Å; K135-Q139 PolarHBondContact O-N 2.89Å; K135-Q147 VanDerWaalsContact CA-OE1 3.31Å; K135-Q147 PolarHBondContact O-NE2 3.49Å; K135-V152 HydrophobicContact CG-CG1 3.99Å; K135-V152 HydrophobicContact CG-CG2 4.34Å; K135-P288 HydrophobicContact CD-CB 4.25Å |
| 136 | Y | 92.8 | Very high | 90.8 | Very high | 2 Ų | 2 | 40.5 Ų | 40.5 | 1% | 0.008 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -72.4 | -36.7 | -179.2 | -88.8 | -100.4 | 0 | 0 | 0 | 113.3 | F50 T132 F133 A134 P140 A289 V290 A291 V292 P307 V310 | F50-Y136 HydrophobicContact CB-CE2 4.1Å; F50-Y136 WeakPolarHBondContact CB-OH 3.35Å; F50-Y136 PolarHBondContact O-OH 2.95Å; T132-Y136 HydrophobicContact CG2-CD2 3.81Å; T132-Y136 HydrophobicContact CG2-CE2 3.88Å; T132-Y136 VanDerWaalsContact O-CD2 3.29Å; T132-Y136 WeakPolarHBondContact O-CD2 3.28Å; T132-Y136 PolarHBondContact O-N 3.24Å; F133-Y136 PolarHBondContact O-N 3.44Å; A134-Y136 VanDerWaalsContact C-N 3.29Å; A134-Y136 PolarHBondContact O-N 2.78Å; Y136-P140 VanDerWaalsContact O-CD 3.23Å; Y136-P140 WeakPolarHBondContact O-CD 3.49Å; Y136-A289 HydrophobicContact CD1-CB 3.9Å; Y136-A289 HydrophobicContact CD2-CB 3.95Å; Y136-A289 HydrophobicContact CE1-CB 3.77Å; Y136-A289 HydrophobicContact CE2-CB 3.83Å; Y136-A289 HydrophobicContact CG-CB 4Å; Y136-V290 PolarHBondContact OH-N 3.37Å; Y136-A291 HydrophobicContact CE1-CB 4.06Å; Y136-V292 HydrophobicContact CD1-CG2 3.6Å; Y136-V292 HydrophobicContact CE1-CG2 3.86Å; Y136-P307 WeakPolarHBondContact O-CB 3.2Å; Y136-V310 HydrophobicContact CD1-CB 3.5Å; Y136-V310 HydrophobicContact CD1-CG1 3.35Å; Y136-V310 HydrophobicContact CD1-CG2 3.89Å; Y136-V310 HydrophobicContact CD2-CG1 4.01Å; Y136-V310 HydrophobicContact CE1-CB 3.86Å; Y136-V310 HydrophobicContact CE1-CG1 3.55Å; Y136-V310 HydrophobicContact CE1-CG2 3.77Å; Y136-V310 HydrophobicContact CE2-CG1 4.17Å; Y136-V310 HydrophobicContact CG-CB 4.11Å; Y136-V310 HydrophobicContact CG-CG1 3.59Å |
| 137 | I | 93.5 | Very high | 90.8 | Very high | 59 Ų | 59 | 41.7 Ų | 41.7 | 30% | 0.303 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -71.3 | -34.5 | 174.3 | -73.1 | -170.3 | 0 | 0 | 0 | 111.9 | F133 A134 P140 L155 A311 | F133-I137 HydrophobicContact CD1-CD1 4.47Å; F133-I137 HydrophobicContact CD2-CD1 4.01Å; F133-I137 HydrophobicContact CE1-CD1 3.84Å; F133-I137 HydrophobicContact CE2-CD1 3.3Å; F133-I137 HydrophobicContact CE2-CG1 4.28Å; F133-I137 HydrophobicContact CZ-CD1 3.21Å; F133-I137 HydrophobicContact CZ-CG1 4.41Å; F133-I137 PolarHBondContact O-N 2.94Å; F133-I137 VanDerWaalsContact O-N 3.08Å; A134-I137 PolarHBondContact O-N 3.44Å; I137-P140 WeakPolarHBondContact O-CD 3.44Å; I137-L155 HydrophobicContact CB-CD2 4.29Å; I137-L155 HydrophobicContact CG2-CD2 4.05Å; I137-A311 HydrophobicContact CD1-CB 4.01Å; I137-A311 HydrophobicContact CG1-CB 3.83Å |
| 138 | L | 94.1 | Very high | 90.7 | Very high | 11 Ų | 11 | 44.9 Ų | 44.9 | 6% | 0.058 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -77.9 | -23.2 | -179.9 | -68.9 | 168.9 | 0 | 0 | 0 | 112.4 | A134 I141 F142 Q147 V151 V152 L155 | A134-L138 WeakPolarHBondContact O-CB 3.45Å; A134-L138 WeakPolarHBondContact O-CD1 3.36Å; A134-L138 WeakPolarHBondContact O-CG 3.29Å; A134-L138 PolarHBondContact O-N 3.08Å; L138-I141 HydrophobicContact CD2-CD1 4.46Å; L138-I141 WeakPolarHBondContact O-CA 3.48Å; L138-I141 WeakPolarHBondContact O-CB 3.08Å; L138-I141 PolarHBondContact O-N 3.45Å; L138-F142 HydrophobicContact CB-CD2 4.32Å; L138-F142 HydrophobicContact CD2-CD2 4.25Å; L138-F142 HydrophobicContact CD2-CE2 4.02Å; L138-F142 PolarHBondContact O-N 3.23Å; L138-Q147 HydrophobicContact CB-CG 4.35Å; L138-V151 HydrophobicContact CD1-CG1 3.94Å; L138-V151 HydrophobicContact CD2-CG1 3.98Å; L138-V152 HydrophobicContact CD1-CB 4.47Å; L138-V152 HydrophobicContact CD1-CG2 3.75Å; L138-L155 HydrophobicContact CD1-CD2 4.27Å; L138-L155 HydrophobicContact CD2-CD2 4.26Å; L138-L155 HydrophobicContact CG-CD2 3.98Å |
| 139 | Q | 91.2 | Very high | 90.7 | Very high | 18 Ų | 18 | 49.7 Ų | 49.7 | 8% | 0.084 | 28% | 0.279 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -58.6 | -42.7 | -176.8 | -170.8 | 63.9 | 14.8 | 0 | 0 | 113.7 | K135 I141 F142 P143 A289 V292 | K135-Q139 PolarHBondContact O-N 2.89Å; Q139-I141 PolarHBondContact O-N 3.4Å; Q139-F142 CarbonylContact O-C 3.52Å; Q139-F142 VanDerWaalsContact O-C 3.28Å; Q139-F142 PolarHBondContact O-N 3.17Å; Q139-P143 PolarHBondContact NE2-O 2.86Å; Q139-P143 VanDerWaalsContact O-CA 3.29Å; Q139-P143 WeakPolarHBondContact O-CA 3.37Å; Q139-A289 HydrophobicContact CB-CB 4Å; Q139-A289 HydrophobicContact CG-CB 4Å; Q139-V292 HydrophobicContact CB-CG1 4.42Å; Q139-V292 HydrophobicContact CG-CB 4.21Å; Q139-V292 HydrophobicContact CG-CG1 3.97Å |
| 140 | P | 90.1 | Very high | 90.7 | Very high | 45 Ų | 45 | 52 Ų | 52 | 29% | 0.292 | 30% | 0.3 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.6 | -29.3 | 172.2 | -27.2 | 35.4 | 0 | 0 | 0 | 115.2 | Y136 I137 W303 P307 | Y136-P140 VanDerWaalsContact O-CD 3.23Å; Y136-P140 WeakPolarHBondContact O-CD 3.49Å; I137-P140 WeakPolarHBondContact O-CD 3.44Å; P140-W303 HydrophobicContact CB-CH2 3.65Å; P140-W303 HydrophobicContact CB-CZ3 3.99Å; P140-W303 HydrophobicContact CG-CH2 4.09Å; P140-W303 HydrophobicContact CG-CZ3 3.88Å; P140-P307 HydrophobicContact CG-CB 3.91Å; P140-P307 HydrophobicContact CG-CG 3.7Å |
| 141 | I | 91.7 | Very high | 90.7 | Very high | 108 Ų | 108 | 55.2 Ų | 55.2 | 55% | 0.554 | 32% | 0.319 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.7 | -35.9 | -176.5 | -54.2 | 178.5 | 0 | 0 | 0 | 110.2 | L138 Q139 P143 | L138-I141 HydrophobicContact CD2-CD1 4.46Å; L138-I141 WeakPolarHBondContact O-CA 3.48Å; L138-I141 WeakPolarHBondContact O-CB 3.08Å; L138-I141 PolarHBondContact O-N 3.45Å; Q139-I141 PolarHBondContact O-N 3.4Å; I141-P143 VanDerWaalsContact C-CD 3.42Å; I141-P143 WeakPolarHBondContact O-CD 3.22Å |
| 142 | F | 90.4 | Very high | 90.8 | Very high | 83 Ų | 83 | 54.9 Ų | 54.9 | 36% | 0.364 | 32% | 0.318 | S | S | . | . | S | Bend | trans | -123.3 | 67.8 | 179.8 | -58.7 | -79.9 | 0 | 0 | 0 | 110.3 | L138 Q139 C145 Q147 | L138-F142 HydrophobicContact CB-CD2 4.32Å; L138-F142 HydrophobicContact CD2-CD2 4.25Å; L138-F142 HydrophobicContact CD2-CE2 4.02Å; L138-F142 PolarHBondContact O-N 3.23Å; Q139-F142 CarbonylContact O-C 3.52Å; Q139-F142 VanDerWaalsContact O-C 3.28Å; Q139-F142 PolarHBondContact O-N 3.17Å; F142-C145 HydrophobicContact CB-CB 4.39Å; F142-C145 HydrophobicContact CD1-CB 4.46Å; F142-Q147 HydrophobicContact CB-CG 4.32Å |
| 143 | P | 83.9 | Confident | 90.9 | Very high | 66 Ų | 66 | 57.5 Ų | 57.5 | 43% | 0.429 | 33% | 0.327 | S | S | . | . | S | Bend | trans | -65.4 | -43 | -173.9 | 24.1 | -32.9 | 0 | 0 | 0 | 112.8 | Q139 I141 | Q139-P143 PolarHBondContact NE2-O 2.86Å; Q139-P143 VanDerWaalsContact O-CA 3.29Å; Q139-P143 WeakPolarHBondContact O-CA 3.37Å; I141-P143 VanDerWaalsContact C-CD 3.42Å; I141-P143 WeakPolarHBondContact O-CD 3.22Å |
| 144 | D | 84 | Confident | 91 | Very high | 154 Ų | 154 | 60.5 Ų | 60.5 | 82% | 0.824 | 35% | 0.35 | S | S | * | . | S | Bend | trans | -112.8 | 7.9 | -173.1 | -52.9 | -54.4 | 0 | 0 | 0 | 113 | ||
| 145 | C | 87.1 | Confident | 91.1 | Very high | 79 Ų | 79 | 62.7 Ų | 62.7 | 53% | 0.534 | 36% | 0.361 | S | S | . | . | S | Bend | trans | -118.5 | 139.9 | -176.4 | -71.1 | 0 | 0 | 0 | 0 | 111 | F142 Q147 | F142-C145 HydrophobicContact CB-CB 4.39Å; F142-C145 HydrophobicContact CD1-CB 4.46Å; C145-Q147 PolarHBondContact O-N 3.27Å |
| 146 | P | 85 | Confident | 91.3 | Very high | 129 Ų | 129 | 60.4 Ų | 60.4 | 84% | 0.838 | 35% | 0.352 | S | S | * | . | P | Polyproline II helix | trans | -61.6 | 126.8 | 174.2 | 24.6 | -31.6 | 0 | 0 | 0 | 109.9 | ||
| 147 | Q | 90.3 | Very high | 91.5 | Very high | 25 Ų | 25 | 61.1 Ų | 61.1 | 12% | 0.117 | 36% | 0.358 | C | S | . | . | P | Polyproline II helix | trans | -70.7 | 131.5 | 179.8 | -57.9 | 177.2 | 1.5 | 0 | 0 | 110 | K135 L138 F142 C145 N149 V152 | K135-Q147 VanDerWaalsContact CA-OE1 3.31Å; K135-Q147 PolarHBondContact O-NE2 3.49Å; L138-Q147 HydrophobicContact CB-CG 4.35Å; F142-Q147 HydrophobicContact CB-CG 4.32Å; C145-Q147 PolarHBondContact O-N 3.27Å; Q147-N149 PolarHBondContact O-N 3.44Å; Q147-V152 HydrophobicContact CB-CG2 4.08Å |
| 148 | S | 91.6 | Very high | 91.7 | Very high | 68 Ų | 68 | 61.3 Ų | 61.3 | 48% | 0.476 | 36% | 0.362 | S | S | . | . | P | Polyproline II helix | trans | -65.1 | 124.8 | 177 | 173.4 | 0 | 0 | 0 | 0 | 111.1 | A150 V151 V152 | S148-A150 PolarHBondContact O-N 2.99Å; S148-A150 VanDerWaalsContact O-N 3.16Å; S148-A150 PolarHBondContact OG-N 3.25Å; S148-V151 PolarHBondContact O-N 3.38Å; S148-V152 WeakPolarHBondContact O-CG2 3.29Å; S148-V152 PolarHBondContact O-N 3.49Å |
| 149 | N | 89.9 | Confident | 91.7 | Very high | 100 Ų | 100 | 60.9 Ų | 60.9 | 54% | 0.535 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -54.8 | -34.8 | 177.3 | -74.8 | -30.3 | 0 | 0 | 0 | 112.7 | Q147 R153 | Q147-N149 PolarHBondContact O-N 3.44Å; N149-R153 WeakPolarHBondContact O-CB 3.35Å; N149-R153 VanDerWaalsContact O-CG 3.28Å; N149-R153 WeakPolarHBondContact O-CG 3.46Å; N149-R153 PolarHBondContact O-N 3.07Å |
| 150 | A | 92.2 | Very high | 91.9 | Very high | 61 Ų | 61 | 60 Ų | 60 | 50% | 0.504 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -65.3 | -43.7 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | S148 R153 C154 | S148-A150 PolarHBondContact O-N 2.99Å; S148-A150 VanDerWaalsContact O-N 3.16Å; S148-A150 PolarHBondContact OG-N 3.25Å; A150-R153 PolarHBondContact O-N 3.35Å; A150-C154 WeakPolarHBondContact O-CB 3.34Å; A150-C154 PolarHBondContact O-N 2.86Å; A150-C154 PolarHBondContact O-SG 3.46Å |
| 151 | V | 94.2 | Very high | 92.2 | Very high | 67 Ų | 67 | 62.7 Ų | 62.7 | 41% | 0.406 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -66.3 | -43.8 | 179.3 | -179.5 | 0 | 0 | 0 | 0 | 110.6 | L138 S148 R153 C154 L155 | L138-V151 HydrophobicContact CD1-CG1 3.94Å; L138-V151 HydrophobicContact CD2-CG1 3.98Å; S148-V151 PolarHBondContact O-N 3.38Å; V151-R153 VanDerWaalsContact C-N 3.33Å; V151-R153 PolarHBondContact O-N 2.71Å; V151-C154 PolarHBondContact O-N 3.05Å; V151-L155 WeakPolarHBondContact O-CB 3.27Å; V151-L155 PolarHBondContact O-N 2.68Å |
| 152 | V | 93.8 | Very high | 92.3 | Very high | 5 Ų | 5 | 61.5 Ų | 61.5 | 3% | 0.03 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -56.9 | -47.5 | 175.6 | 174.6 | 0 | 0 | 0 | 0 | 110.6 | M131 A134 K135 L138 Q147 S148 L155 A156 | M131-V152 HydrophobicContact CB-CG1 4.43Å; M131-V152 HydrophobicContact CG-CG1 4.46Å; A134-V152 HydrophobicContact CB-CB 4.48Å; A134-V152 HydrophobicContact CB-CG1 3.91Å; A134-V152 WeakPolarHBondContact CB-O 3.33Å; K135-V152 HydrophobicContact CG-CG1 3.99Å; K135-V152 HydrophobicContact CG-CG2 4.34Å; L138-V152 HydrophobicContact CD1-CB 4.47Å; L138-V152 HydrophobicContact CD1-CG2 3.75Å; Q147-V152 HydrophobicContact CB-CG2 4.08Å; S148-V152 WeakPolarHBondContact O-CG2 3.29Å; S148-V152 PolarHBondContact O-N 3.49Å; V152-L155 PolarHBondContact O-N 3.03Å; V152-A156 VanDerWaalsContact O-CB 3.29Å; V152-A156 WeakPolarHBondContact O-CB 3.32Å; V152-A156 PolarHBondContact O-N 3Å |
| 153 | R | 94 | Very high | 92.4 | Very high | 58 Ų | 58 | 57.7 Ų | 57.7 | 22% | 0.219 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -67.5 | -42.1 | -179.9 | -72.8 | 174.1 | -172.4 | 156.3 | 23.5 | 112.9 | N149 A150 V151 L155 A156 A157 L367 T370 | N149-R153 WeakPolarHBondContact O-CB 3.35Å; N149-R153 VanDerWaalsContact O-CG 3.28Å; N149-R153 WeakPolarHBondContact O-CG 3.46Å; N149-R153 PolarHBondContact O-N 3.07Å; A150-R153 PolarHBondContact O-N 3.35Å; V151-R153 VanDerWaalsContact C-N 3.33Å; V151-R153 PolarHBondContact O-N 2.71Å; R153-L155 VanDerWaalsContact C-N 3.34Å; R153-L155 PolarHBondContact O-N 3.02Å; R153-A156 PolarHBondContact O-N 2.73Å; R153-A157 WeakPolarHBondContact O-CB 3.33Å; R153-A157 PolarHBondContact O-N 2.99Å; R153-L367 WeakPolarHBondContact CD-O 3.27Å; R153-L367 WeakPolarHBondContact CG-O 3.35Å; R153-L367 PolarHBondContact NE-O 3.01Å; R153-L367 VanDerWaalsContact NE-O 3.1Å; R153-T370 VanDerWaalsContact NH2-CA 3.25Å; R153-T370 PolarHBondContact NH2-O 3.44Å |
| 154 | C | 95.8 | Very high | 92.8 | Very high | 85 Ų | 85 | 54.8 Ų | 54.8 | 57% | 0.574 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -60.8 | -45.5 | 176.2 | -73 | 0 | 0 | 0 | 0 | 110.9 | A150 V151 A157 V158 | A150-C154 WeakPolarHBondContact O-CB 3.34Å; A150-C154 PolarHBondContact O-N 2.86Å; A150-C154 PolarHBondContact O-SG 3.46Å; V151-C154 PolarHBondContact O-N 3.05Å; C154-A157 PolarHBondContact O-N 3.04Å; C154-V158 WeakPolarHBondContact O-CG2 3.17Å; C154-V158 PolarHBondContact O-N 2.74Å |
| 155 | L | 95.9 | Very high | 93.2 | Very high | 45 Ų | 45 | 54.1 Ų | 54.1 | 24% | 0.236 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -67.5 | -37.8 | 178.6 | -173.9 | 59.6 | 0 | 0 | 0 | 112.2 | F133 A134 I137 L138 V151 V152 R153 V158 C159 | F133-L155 HydrophobicContact CE1-CD1 4.34Å; F133-L155 HydrophobicContact CE1-CG 4.13Å; A134-L155 HydrophobicContact CB-CB 3.87Å; A134-L155 HydrophobicContact CB-CD2 3.97Å; A134-L155 HydrophobicContact CB-CG 3.99Å; I137-L155 HydrophobicContact CB-CD2 4.29Å; I137-L155 HydrophobicContact CG2-CD2 4.05Å; L138-L155 HydrophobicContact CD1-CD2 4.27Å; L138-L155 HydrophobicContact CD2-CD2 4.26Å; L138-L155 HydrophobicContact CG-CD2 3.98Å; V151-L155 WeakPolarHBondContact O-CB 3.27Å; V151-L155 PolarHBondContact O-N 2.68Å; V152-L155 PolarHBondContact O-N 3.03Å; R153-L155 VanDerWaalsContact C-N 3.34Å; R153-L155 PolarHBondContact O-N 3.02Å; L155-V158 PolarHBondContact O-N 3.15Å; L155-C159 PolarHBondContact O-N 3.13Å |
| 156 | A | 95.9 | Very high | 93.3 | Very high | 0 Ų | 0 | 52.5 Ų | 52.5 | 0% | 0 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -62.2 | -42.7 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | A130 M131 A134 V152 R153 C159 I160 L367 | A130-A156 VanDerWaalsContact C-CB 3.47Å; A130-A156 HydrophobicContact CB-CB 3.88Å; A130-A156 WeakPolarHBondContact O-CB 3.06Å; M131-A156 HydrophobicContact CG-CB 4.11Å; A134-A156 HydrophobicContact CB-CB 4.33Å; V152-A156 VanDerWaalsContact O-CB 3.29Å; V152-A156 WeakPolarHBondContact O-CB 3.32Å; V152-A156 PolarHBondContact O-N 3Å; R153-A156 PolarHBondContact O-N 2.73Å; A156-C159 WeakPolarHBondContact O-CB 3.45Å; A156-C159 PolarHBondContact O-N 3.26Å; A156-I160 WeakPolarHBondContact O-CG1 3.42Å; A156-I160 PolarHBondContact O-N 3.42Å; A156-L367 HydrophobicContact CB-CD1 3.99Å; A156-L367 HydrophobicContact CB-CD2 3.77Å |
| 157 | A | 96.9 | Very high | 93.5 | Very high | 17 Ų | 17 | 46.6 Ų | 46.6 | 14% | 0.14 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -63.5 | -42.2 | 176 | 0 | 0 | 0 | 0 | 0 | 111.3 | R153 C154 C159 I160 M161 L367 | R153-A157 WeakPolarHBondContact O-CB 3.33Å; R153-A157 PolarHBondContact O-N 2.99Å; C154-A157 PolarHBondContact O-N 3.04Å; A157-C159 VanDerWaalsContact C-N 3.32Å; A157-C159 PolarHBondContact O-N 3.06Å; A157-I160 PolarHBondContact O-N 3.46Å; A157-M161 HydrophobicContact CB-CE 4.5Å; A157-M161 WeakPolarHBondContact O-CB 3.38Å; A157-M161 VanDerWaalsContact O-CG 3.3Å; A157-M161 WeakPolarHBondContact O-CG 3.13Å; A157-M161 PolarHBondContact O-N 3.3Å; A157-L367 HydrophobicContact CB-CD1 3.72Å |
| 158 | V | 97.1 | Very high | 93.4 | Very high | 63 Ų | 63 | 46.1 Ų | 46.1 | 38% | 0.382 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -58.9 | -43.6 | 174 | 169.8 | 0 | 0 | 0 | 0 | 111 | C154 L155 I160 M161 I162 | C154-V158 WeakPolarHBondContact O-CG2 3.17Å; C154-V158 PolarHBondContact O-N 2.74Å; L155-V158 PolarHBondContact O-N 3.15Å; V158-I160 PolarHBondContact O-N 2.98Å; V158-M161 HydrophobicContact CG2-CE 4.11Å; V158-M161 PolarHBondContact O-N 3.39Å; V158-I162 HydrophobicContact CG1-CD1 3.6Å; V158-I162 HydrophobicContact CG1-CG1 4.24Å; V158-I162 WeakPolarHBondContact O-CB 3.19Å; V158-I162 VanDerWaalsContact O-CG1 3.26Å; V158-I162 WeakPolarHBondContact O-CG1 3.39Å; V158-I162 PolarHBondContact O-N 3.09Å |
| 159 | C | 95.1 | Very high | 93.2 | Very high | 2 Ų | 2 | 45.5 Ų | 45.5 | 1% | 0.014 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -57.5 | -49.9 | 175 | -179.4 | 0 | 0 | 0 | 0 | 112 | F133 L155 A156 A157 M161 I162 L163 F315 | F133-C159 HydrophobicContact CD1-CB 3.65Å; F133-C159 HydrophobicContact CE1-CB 3.68Å; F133-C159 HydrophobicContact CG-CB 4.39Å; F133-C159 HydrophobicContact CZ-CB 4.41Å; L155-C159 PolarHBondContact O-N 3.13Å; A156-C159 WeakPolarHBondContact O-CB 3.45Å; A156-C159 PolarHBondContact O-N 3.26Å; A157-C159 VanDerWaalsContact C-N 3.32Å; A157-C159 PolarHBondContact O-N 3.06Å; C159-M161 PolarHBondContact O-N 3.39Å; C159-I162 PolarHBondContact O-N 2.76Å; C159-L163 WeakPolarHBondContact O-CB 3.18Å; C159-L163 PolarHBondContact O-N 2.92Å; C159-L163 VanDerWaalsContact O-N 3.07Å; C159-F315 VanDerWaalsContact SG-CD2 3.51Å |
| 160 | I | 95.6 | Very high | 92.9 | Very high | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -60.7 | -44.8 | 177.5 | -65.6 | 171.2 | 0 | 0 | 0 | 111 | M126 A130 A156 A157 V158 L163 G164 V318 C360 I364 L367 | M126-I160 HydrophobicContact CE-CD1 4.21Å; M126-I160 HydrophobicContact CE-CG1 4.39Å; M126-I160 HydrophobicContact CE-CG2 3.72Å; M126-I160 HydrophobicContact CG-CD1 4.33Å; M126-I160 HydrophobicContact CG-CG1 4.25Å; M126-I160 HydrophobicContact SD-CG2 4.28Å; A130-I160 HydrophobicContact CB-CD1 3.89Å; A130-I160 HydrophobicContact CB-CG1 3.76Å; A156-I160 WeakPolarHBondContact O-CG1 3.42Å; A156-I160 PolarHBondContact O-N 3.42Å; A157-I160 PolarHBondContact O-N 3.46Å; V158-I160 PolarHBondContact O-N 2.98Å; I160-L163 PolarHBondContact O-N 2.81Å; I160-G164 PolarHBondContact O-N 2.98Å; I160-V318 HydrophobicContact CG1-CG1 4.41Å; I160-C360 HydrophobicContact CG2-CB 4.15Å; I160-I364 HydrophobicContact CG2-CG1 4.21Å; I160-L367 HydrophobicContact CD1-CD1 3.97Å; I160-L367 HydrophobicContact CD1-CG 4.33Å |
| 161 | M | 96 | Very high | 92 | Very high | 102 Ų | 102 | 41.5 Ų | 41.5 | 50% | 0.502 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -65.9 | -42.8 | -178.8 | -72.4 | -173.6 | -64.9 | 0 | 0 | 112.6 | A157 V158 C159 L163 G164 F165 I364 | A157-M161 HydrophobicContact CB-CE 4.5Å; A157-M161 WeakPolarHBondContact O-CB 3.38Å; A157-M161 VanDerWaalsContact O-CG 3.3Å; A157-M161 WeakPolarHBondContact O-CG 3.13Å; A157-M161 PolarHBondContact O-N 3.3Å; V158-M161 HydrophobicContact CG2-CE 4.11Å; V158-M161 PolarHBondContact O-N 3.39Å; C159-M161 PolarHBondContact O-N 3.39Å; M161-L163 VanDerWaalsContact C-N 3.34Å; M161-L163 PolarHBondContact O-N 3.48Å; M161-G164 PolarHBondContact O-N 2.78Å; M161-F165 WeakPolarHBondContact O-CB 3.37Å; M161-F165 PolarHBondContact O-N 3.17Å; M161-I364 HydrophobicContact CG-CD1 3.93Å |
| 162 | I | 94 | Very high | 91.2 | Very high | 83 Ų | 83 | 47.9 Ų | 47.9 | 43% | 0.426 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -60.8 | -47 | 176.3 | -69.9 | 169.1 | 0 | 0 | 0 | 109.7 | V158 C159 F165 V166 F315 | V158-I162 HydrophobicContact CG1-CD1 3.6Å; V158-I162 HydrophobicContact CG1-CG1 4.24Å; V158-I162 WeakPolarHBondContact O-CB 3.19Å; V158-I162 VanDerWaalsContact O-CG1 3.26Å; V158-I162 WeakPolarHBondContact O-CG1 3.39Å; V158-I162 PolarHBondContact O-N 3.09Å; C159-I162 PolarHBondContact O-N 2.76Å; I162-F165 WeakPolarHBondContact O-CB 3.41Å; I162-F165 PolarHBondContact O-N 2.98Å; I162-V166 WeakPolarHBondContact O-CG2 3.41Å; I162-V166 PolarHBondContact O-N 3.47Å; I162-F315 HydrophobicContact CG2-CZ 3.97Å |
| 163 | L | 91.6 | Very high | 90.2 | Very high | 2 Ų | 2 | 55.5 Ų | 55.5 | 1% | 0.01 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -66.3 | -38.6 | 178.2 | -78.5 | 171.6 | 0 | 0 | 0 | 112.4 | C159 I160 M161 F165 V166 N167 F315 V318 N319 M322 | C159-L163 WeakPolarHBondContact O-CB 3.18Å; C159-L163 PolarHBondContact O-N 2.92Å; C159-L163 VanDerWaalsContact O-N 3.07Å; I160-L163 PolarHBondContact O-N 2.81Å; M161-L163 VanDerWaalsContact C-N 3.34Å; M161-L163 PolarHBondContact O-N 3.48Å; L163-F165 VanDerWaalsContact C-N 3.31Å; L163-F165 PolarHBondContact O-N 3.42Å; L163-V166 PolarHBondContact O-N 2.92Å; L163-N167 WeakPolarHBondContact O-CB 3.42Å; L163-N167 PolarHBondContact O-N 3.38Å; L163-N167 PolarHBondContact O-ND2 3.25Å; L163-F315 HydrophobicContact CD1-CD1 3.83Å; L163-F315 HydrophobicContact CD1-CD2 4.19Å; L163-F315 HydrophobicContact CD1-CE1 3.89Å; L163-F315 HydrophobicContact CD1-CE2 4.19Å; L163-F315 HydrophobicContact CD1-CG 4.02Å; L163-F315 HydrophobicContact CD1-CZ 4.06Å; L163-F315 WeakPolarHBondContact CD1-O 3.39Å; L163-F315 HydrophobicContact CD2-CD1 3.63Å; L163-F315 HydrophobicContact CD2-CE1 3.12Å; L163-F315 HydrophobicContact CD2-CZ 3.69Å; L163-F315 HydrophobicContact CG-CD1 3.98Å; L163-F315 HydrophobicContact CG-CE1 3.51Å; L163-F315 HydrophobicContact CG-CE2 4.1Å; L163-F315 HydrophobicContact CG-CZ 3.56Å; L163-V318 HydrophobicContact CB-CG1 4.3Å; L163-V318 HydrophobicContact CD1-CB 3.48Å; L163-V318 VanDerWaalsContact CD1-CB 3.48Å; L163-V318 HydrophobicContact CD1-CG1 3.33Å; L163-V318 HydrophobicContact CG-CG1 4.44Å; L163-N319 HydrophobicContact CD1-CB 4.28Å; L163-N319 HydrophobicContact CD2-CB 3.74Å; L163-M322 HydrophobicContact CB-CE 3.89Å |
| 164 | G | 92.5 | Very high | 89.1 | Confident | 5 Ų | 5 | 52.8 Ų | 52.8 | 5% | 0.052 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -59.4 | -43.3 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | I160 M161 S168 M322 V356 C360 | I160-G164 PolarHBondContact O-N 2.98Å; M161-G164 PolarHBondContact O-N 2.78Å; G164-S168 WeakPolarHBondContact O-CB 3.36Å; G164-S168 PolarHBondContact O-N 3.06Å; G164-S168 PolarHBondContact O-OG 2.94Å; G164-M322 VanDerWaalsContact N-CE 3.31Å; G164-V356 WeakPolarHBondContact O-CG1 3.47Å; G164-C360 VanDerWaalsContact CA-SG 3.58Å |
| 165 | F | 92.6 | Very high | 88 | Confident | 140 Ų | 140 | 51.7 Ų | 51.7 | 61% | 0.614 | 26% | 0.256 | S | S | * | . | H | α-helix | trans | -63.1 | -49.6 | 175.1 | 178.1 | -100.3 | 0 | 0 | 0 | 111.9 | M161 I162 L163 N167 S168 V169 | M161-F165 WeakPolarHBondContact O-CB 3.37Å; M161-F165 PolarHBondContact O-N 3.17Å; I162-F165 WeakPolarHBondContact O-CB 3.41Å; I162-F165 PolarHBondContact O-N 2.98Å; L163-F165 VanDerWaalsContact C-N 3.31Å; L163-F165 PolarHBondContact O-N 3.42Å; F165-N167 VanDerWaalsContact C-N 3.34Å; F165-N167 PolarHBondContact O-N 3.06Å; F165-S168 WeakPolarHBondContact O-CB 3.46Å; F165-S168 PolarHBondContact O-N 3.29Å; F165-S168 VanDerWaalsContact O-N 3.09Å; F165-V169 HydrophobicContact CD1-CG2 4.32Å; F165-V169 HydrophobicContact CD2-CG2 4.38Å; F165-V169 HydrophobicContact CE1-CG2 3.91Å; F165-V169 HydrophobicContact CE2-CG2 3.97Å; F165-V169 HydrophobicContact CZ-CG2 3.72Å; F165-V169 WeakPolarHBondContact O-CG2 3.35Å; F165-V169 PolarHBondContact O-N 3.46Å |
| 166 | V | 89.9 | Confident | 87 | Confident | 46 Ų | 46 | 57.1 Ų | 57.1 | 28% | 0.279 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -58.8 | -45.8 | 179.5 | 171.8 | 0 | 0 | 0 | 0 | 111.2 | I162 L163 S168 V169 S170 | I162-V166 WeakPolarHBondContact O-CG2 3.41Å; I162-V166 PolarHBondContact O-N 3.47Å; L163-V166 PolarHBondContact O-N 2.92Å; V166-S168 VanDerWaalsContact C-N 3.28Å; V166-S168 PolarHBondContact O-N 2.84Å; V166-V169 PolarHBondContact O-N 3.4Å; V166-V169 VanDerWaalsContact O-N 3.15Å; V166-S170 PolarHBondContact O-N 2.95Å |
| 167 | N | 87.8 | Confident | 85.9 | Confident | 4 Ų | 4 | 59.3 Ų | 59.3 | 2% | 0.021 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -66.7 | -29 | 177.9 | -78.1 | -76.8 | 0 | 0 | 0 | 113 | L163 F165 S174 N319 M322 L323 V356 | L163-N167 WeakPolarHBondContact O-CB 3.42Å; L163-N167 PolarHBondContact O-N 3.38Å; L163-N167 PolarHBondContact O-ND2 3.25Å; F165-N167 VanDerWaalsContact C-N 3.34Å; F165-N167 PolarHBondContact O-N 3.06Å; N167-S174 WeakPolarHBondContact OD1-CB 3.44Å; N167-S174 PolarHBondContact OD1-OG 3.26Å; N167-N319 PolarHBondContact ND2-OD1 3.07Å; N167-N319 PolarHBondContact OD1-OD1 3.27Å; N167-M322 HydrophobicContact CB-CG 4.48Å; N167-L323 WeakPolarHBondContact OD1-CD2 3.21Å; N167-L323 WeakPolarHBondContact OD1-CG 3.19Å; N167-V356 HydrophobicContact CB-CG1 4.28Å; N167-V356 HydrophobicContact CB-CG2 4.18Å |
| 168 | S | 88.6 | Confident | 84.7 | Confident | 16 Ų | 16 | 60 Ų | 60 | 11% | 0.112 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -74.9 | -27.5 | 174.2 | -60 | 0 | 0 | 0 | 0 | 112.5 | G164 F165 V166 T351 | G164-S168 WeakPolarHBondContact O-CB 3.36Å; G164-S168 PolarHBondContact O-N 3.06Å; G164-S168 PolarHBondContact O-OG 2.94Å; F165-S168 WeakPolarHBondContact O-CB 3.46Å; F165-S168 PolarHBondContact O-N 3.29Å; F165-S168 VanDerWaalsContact O-N 3.09Å; V166-S168 VanDerWaalsContact C-N 3.28Å; V166-S168 PolarHBondContact O-N 2.84Å; S168-T351 WeakPolarHBondContact O-CB 3.39Å; S168-T351 PolarHBondContact O-OG1 3.41Å |
| 169 | V | 88.4 | Confident | 83.6 | Confident | 55 Ų | 55 | 61.1 Ų | 61.1 | 33% | 0.333 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -85.3 | -46.8 | -179.9 | 174.9 | 0 | 0 | 0 | 0 | 112.3 | F165 V166 K349 | F165-V169 HydrophobicContact CD1-CG2 4.32Å; F165-V169 HydrophobicContact CD2-CG2 4.38Å; F165-V169 HydrophobicContact CE1-CG2 3.91Å; F165-V169 HydrophobicContact CE2-CG2 3.97Å; F165-V169 HydrophobicContact CZ-CG2 3.72Å; F165-V169 WeakPolarHBondContact O-CG2 3.35Å; F165-V169 PolarHBondContact O-N 3.46Å; V166-V169 PolarHBondContact O-N 3.4Å; V166-V169 VanDerWaalsContact O-N 3.15Å; V169-K349 WeakPolarHBondContact O-CD 3.37Å |
| 170 | S | 83.5 | Confident | 82.8 | Confident | 27 Ų | 27 | 66 Ų | 66 | 19% | 0.189 | 32% | 0.316 | C | S | . | . | trans | -160.1 | 118.3 | -179.8 | -173.6 | 0 | 0 | 0 | 0 | 113.3 | V166 R172 W173 S174 | V166-S170 PolarHBondContact O-N 2.95Å; S170-R172 VanDerWaalsContact C-N 3.28Å; S170-R172 PolarHBondContact O-N 3.22Å; S170-R172 PolarHBondContact OG-N 3.41Å; S170-W173 PolarHBondContact O-N 3.46Å; S170-S174 PolarHBondContact O-N 3.22Å | ||
| 171 | V | 73.5 | Confident | 82 | Confident | 50 Ų | 50 | 67.1 Ų | 67.1 | 30% | 0.303 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -61.3 | -37.8 | 172.1 | -174.9 | 0 | 0 | 0 | 0 | 111.3 | W173 S174 T175 L323 T351 | V171-W173 PolarHBondContact O-N 3.01Å; V171-S174 WeakPolarHBondContact O-CB 3.41Å; V171-S174 PolarHBondContact O-N 3.44Å; V171-T175 PolarHBondContact O-N 3.07Å; V171-T175 PolarHBondContact O-OG1 3.41Å; V171-L323 HydrophobicContact CG1-CD2 3.97Å; V171-T351 HydrophobicContact CG2-CG2 3.84Å |
| 172 | R | 76.2 | Confident | 81.1 | Confident | 201 Ų | 201 | 63.3 Ų | 63.3 | 76% | 0.758 | 30% | 0.303 | S | S | * | . | H | α-helix | trans | -63.8 | -42 | -177.9 | -70.5 | -176.4 | -178.9 | 172.2 | 0.4 | 112.8 | S170 T175 R176 | S170-R172 VanDerWaalsContact C-N 3.28Å; S170-R172 PolarHBondContact O-N 3.22Å; S170-R172 PolarHBondContact OG-N 3.41Å; R172-T175 PolarHBondContact O-N 3.11Å; R172-R176 PolarHBondContact O-N 3.29Å; R172-R176 VanDerWaalsContact O-N 3.14Å |
| 173 | W | 73.3 | Confident | 80.4 | Confident | 165 Ų | 165 | 66.7 Ų | 66.7 | 63% | 0.625 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -65.7 | -43.2 | 175.3 | -79.8 | 103.3 | 0 | 0 | 0 | 111 | S170 V171 T175 R176 V177 | S170-W173 PolarHBondContact O-N 3.46Å; V171-W173 PolarHBondContact O-N 3.01Å; W173-T175 VanDerWaalsContact C-N 3.34Å; W173-T175 PolarHBondContact O-N 3.44Å; W173-R176 PolarHBondContact O-N 3.2Å; W173-V177 WeakPolarHBondContact O-CB 3.29Å; W173-V177 VanDerWaalsContact O-CG2 3.28Å; W173-V177 WeakPolarHBondContact O-CG2 3.28Å; W173-V177 PolarHBondContact O-N 3.02Å |
| 174 | S | 71.3 | Confident | 80 | Confident | 0 Ų | 0 | 67.4 Ų | 67.4 | 0% | 0 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -55.8 | -45.8 | 174.8 | 176.5 | 0 | 0 | 0 | 0 | 112.3 | N167 S170 V171 V177 Q178 N319 | N167-S174 WeakPolarHBondContact OD1-CB 3.44Å; N167-S174 PolarHBondContact OD1-OG 3.26Å; S170-S174 PolarHBondContact O-N 3.22Å; V171-S174 WeakPolarHBondContact O-CB 3.41Å; V171-S174 PolarHBondContact O-N 3.44Å; S174-V177 PolarHBondContact O-N 3.42Å; S174-Q178 PolarHBondContact O-N 3.46Å; S174-N319 PolarHBondContact O-ND2 3.18Å; S174-N319 VanDerWaalsContact O-ND2 3.17Å; S174-N319 VanDerWaalsContact OG-CG 3.28Å; S174-N319 PolarHBondContact OG-ND2 3.01Å; S174-N319 PolarHBondContact OG-OD1 3.43Å |
| 175 | T | 72.5 | Confident | 79.5 | Confident | 63 Ų | 63 | 67.6 Ų | 67.6 | 39% | 0.387 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -64.2 | -44.9 | 177.5 | -49.2 | 0 | 0 | 0 | 0 | 112.5 | V171 R172 W173 V177 Q178 D179 | V171-T175 PolarHBondContact O-N 3.07Å; V171-T175 PolarHBondContact O-OG1 3.41Å; R172-T175 PolarHBondContact O-N 3.11Å; W173-T175 VanDerWaalsContact C-N 3.34Å; W173-T175 PolarHBondContact O-N 3.44Å; T175-V177 VanDerWaalsContact C-N 3.32Å; T175-V177 PolarHBondContact O-N 3.26Å; T175-Q178 VanDerWaalsContact O-CB 3.27Å; T175-Q178 WeakPolarHBondContact O-CB 3.26Å; T175-Q178 PolarHBondContact O-N 3.47Å; T175-D179 PolarHBondContact O-N 3.37Å |
| 176 | R | 74.6 | Confident | 79.2 | Confident | 159 Ų | 159 | 64 Ų | 64 | 60% | 0.6 | 30% | 0.302 | S | S | * | . | H | α-helix | trans | -63.5 | -39.6 | 179.2 | -74.4 | -176.1 | 179 | 149.4 | -2.1 | 112.6 | R172 W173 Q178 D179 | R172-R176 PolarHBondContact O-N 3.29Å; R172-R176 VanDerWaalsContact O-N 3.14Å; W173-R176 PolarHBondContact O-N 3.2Å; R176-Q178 VanDerWaalsContact C-N 3.31Å; R176-D179 PolarHBondContact O-N 2.92Å |
| 177 | V | 73 | Confident | 79.1 | Confident | 46 Ų | 46 | 65.8 Ų | 65.8 | 28% | 0.279 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -65.9 | -37.1 | 177.4 | 167.6 | 0 | 0 | 0 | 0 | 110.6 | W173 S174 T175 D179 I180 F181 | W173-V177 WeakPolarHBondContact O-CB 3.29Å; W173-V177 VanDerWaalsContact O-CG2 3.28Å; W173-V177 WeakPolarHBondContact O-CG2 3.28Å; W173-V177 PolarHBondContact O-N 3.02Å; S174-V177 PolarHBondContact O-N 3.42Å; T175-V177 VanDerWaalsContact C-N 3.32Å; T175-V177 PolarHBondContact O-N 3.26Å; V177-D179 PolarHBondContact O-N 3.26Å; V177-I180 PolarHBondContact O-N 3.38Å; V177-F181 HydrophobicContact CB-CE2 4.46Å; V177-F181 HydrophobicContact CG1-CD2 3.82Å; V177-F181 HydrophobicContact CG1-CE1 4.33Å; V177-F181 HydrophobicContact CG1-CE2 3.07Å; V177-F181 HydrophobicContact CG1-CZ 3.4Å; V177-F181 VanDerWaalsContact O-CD2 3.27Å; V177-F181 WeakPolarHBondContact O-CD2 3.35Å; V177-F181 WeakPolarHBondContact O-CG 3.27Å; V177-F181 PolarHBondContact O-N 3.45Å |
| 178 | Q | 72.5 | Confident | 79.3 | Confident | 32 Ų | 32 | 65.6 Ų | 65.6 | 15% | 0.15 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -59 | -42 | 174.6 | -171.1 | 66.8 | 20.7 | 0 | 0 | 113.3 | S174 T175 R176 F181 T182 G316 N319 | S174-Q178 PolarHBondContact O-N 3.46Å; T175-Q178 VanDerWaalsContact O-CB 3.27Å; T175-Q178 WeakPolarHBondContact O-CB 3.26Å; T175-Q178 PolarHBondContact O-N 3.47Å; R176-Q178 VanDerWaalsContact C-N 3.31Å; Q178-F181 PolarHBondContact O-N 3.24Å; Q178-T182 PolarHBondContact O-N 3.28Å; Q178-T182 PolarHBondContact O-OG1 3.39Å; Q178-G316 VanDerWaalsContact CD-O 3.29Å; Q178-G316 PolarHBondContact NE2-O 3.05Å; Q178-G316 PolarHBondContact OE1-O 2.99Å; Q178-N319 PolarHBondContact OE1-ND2 3.4Å |
| 179 | D | 72.5 | Confident | 79.4 | Confident | 86 Ų | 86 | 65 Ų | 65 | 46% | 0.46 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -63 | -45.2 | -178.3 | -67.5 | -22.9 | 0 | 0 | 0 | 110.7 | T175 R176 V177 F181 T182 Y183 | T175-D179 PolarHBondContact O-N 3.37Å; R176-D179 PolarHBondContact O-N 2.92Å; V177-D179 PolarHBondContact O-N 3.26Å; D179-F181 PolarHBondContact O-N 3.1Å; D179-T182 WeakPolarHBondContact O-CB 3.48Å; D179-T182 PolarHBondContact O-N 3.47Å; D179-T182 VanDerWaalsContact O-N 3.11Å; D179-Y183 WeakPolarHBondContact O-CD2 3.31Å; D179-Y183 PolarHBondContact O-N 2.88Å |
| 180 | I | 78.5 | Confident | 79.7 | Confident | 105 Ų | 105 | 66.8 Ų | 66.8 | 54% | 0.538 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -57.6 | -48.6 | 177.4 | -62.9 | 171.9 | 0 | 0 | 0 | 110.6 | V177 T182 Y183 T184 | V177-I180 PolarHBondContact O-N 3.38Å; I180-T182 PolarHBondContact O-N 2.92Å; I180-Y183 PolarHBondContact O-N 3.32Å; I180-T184 PolarHBondContact O-N 3.45Å; I180-T184 PolarHBondContact O-OG1 3.23Å |
| 181 | F | 79.8 | Confident | 80.1 | Confident | 22 Ų | 22 | 68.2 Ų | 68.2 | 10% | 0.096 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -64 | -27.7 | 179.7 | -62.3 | -27.3 | 0 | 0 | 0 | 113.4 | V177 Q178 D179 T184 K185 F312 F315 | V177-F181 HydrophobicContact CB-CE2 4.46Å; V177-F181 HydrophobicContact CG1-CD2 3.82Å; V177-F181 HydrophobicContact CG1-CE1 4.33Å; V177-F181 HydrophobicContact CG1-CE2 3.07Å; V177-F181 HydrophobicContact CG1-CZ 3.4Å; V177-F181 VanDerWaalsContact O-CD2 3.27Å; V177-F181 WeakPolarHBondContact O-CD2 3.35Å; V177-F181 WeakPolarHBondContact O-CG 3.27Å; V177-F181 PolarHBondContact O-N 3.45Å; Q178-F181 PolarHBondContact O-N 3.24Å; D179-F181 PolarHBondContact O-N 3.1Å; F181-T184 PolarHBondContact O-N 3.31Å; F181-K185 PolarHBondContact O-N 3.45Å; F181-F312 WeakPolarHBondContact CB-O 3.46Å; F181-F312 HydrophobicContact CD1-CB 3.59Å; F181-F312 HydrophobicContact CD1-CD1 4.05Å; F181-F312 AromaticContact CD1-CG 3.83Å; F181-F312 HydrophobicContact CD1-CG 3.83Å; F181-F312 HydrophobicContact CE1-CB 3.98Å; F181-F312 AromaticContact CE1-CD1 3.48Å; F181-F312 HydrophobicContact CE1-CD1 3.48Å; F181-F312 VanDerWaalsContact CE1-CD1 3.48Å; F181-F312 HydrophobicContact CE1-CE1 4.08Å; F181-F312 AromaticContact CE1-CG 3.75Å; F181-F312 HydrophobicContact CE1-CG 3.75Å; F181-F312 HydrophobicContact CG-CB 4.33Å; F181-F312 WeakPolarHBondContact CG-O 3.39Å; F181-F312 HydrophobicContact CZ-CD1 4.2Å; F181-F315 HydrophobicContact CD2-CD1 4.46Å; F181-F315 HydrophobicContact CE2-CB 4.36Å; F181-F315 AromaticContact CE2-CD1 3.51Å; F181-F315 HydrophobicContact CE2-CD1 3.51Å; F181-F315 HydrophobicContact CE2-CE1 4.24Å; F181-F315 HydrophobicContact CE2-CG 4.36Å; F181-F315 AromaticContact CZ-CD1 3.91Å; F181-F315 HydrophobicContact CZ-CD1 3.91Å; F181-F315 HydrophobicContact CZ-CE1 4.48Å |
| 182 | T | 75.9 | Confident | 81.2 | Confident | 22 Ų | 22 | 65.9 Ų | 65.9 | 14% | 0.135 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -69.4 | -38 | 176.7 | -59.9 | 0 | 0 | 0 | 0 | 111.8 | Q178 D179 I180 K185 I186 | Q178-T182 PolarHBondContact O-N 3.28Å; Q178-T182 PolarHBondContact O-OG1 3.39Å; D179-T182 WeakPolarHBondContact O-CB 3.48Å; D179-T182 PolarHBondContact O-N 3.47Å; D179-T182 VanDerWaalsContact O-N 3.11Å; I180-T182 PolarHBondContact O-N 2.92Å; T182-K185 VanDerWaalsContact O-CG 3.26Å; T182-K185 WeakPolarHBondContact O-CG 3.28Å; T182-I186 WeakPolarHBondContact O-CG1 3.47Å |
| 183 | Y | 80.3 | Confident | 82.1 | Confident | 155 Ų | 155 | 57 Ų | 57 | 61% | 0.608 | 27% | 0.269 | S | S | * | . | H | α-helix | trans | -68 | -41 | 174.2 | -65.2 | -66.9 | 0 | 0 | 0 | 111.7 | D179 I180 K185 I186 I187 | D179-Y183 WeakPolarHBondContact O-CD2 3.31Å; D179-Y183 PolarHBondContact O-N 2.88Å; I180-Y183 PolarHBondContact O-N 3.32Å; Y183-K185 PolarHBondContact O-N 3.22Å; Y183-I186 PolarHBondContact O-N 2.91Å; Y183-I187 WeakPolarHBondContact O-CG1 3.28Å; Y183-I187 PolarHBondContact O-N 3.04Å; Y183-I187 VanDerWaalsContact O-N 3.08Å |
| 184 | T | 82.7 | Confident | 83.2 | Confident | 17 Ų | 17 | 54 Ų | 54 | 10% | 0.104 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -58.1 | -45.4 | -179.5 | -52.9 | 0 | 0 | 0 | 0 | 112.8 | I180 F181 I186 I187 A188 F309 F312 | I180-T184 PolarHBondContact O-N 3.45Å; I180-T184 PolarHBondContact O-OG1 3.23Å; F181-T184 PolarHBondContact O-N 3.31Å; T184-I186 VanDerWaalsContact C-N 3.34Å; T184-I186 PolarHBondContact O-N 2.94Å; T184-I187 PolarHBondContact O-N 3.38Å; T184-A188 PolarHBondContact O-N 2.99Å; T184-F309 HydrophobicContact CG2-CB 3.74Å; T184-F309 HydrophobicContact CG2-CD1 3.34Å; T184-F309 HydrophobicContact CG2-CE1 4.02Å; T184-F309 HydrophobicContact CG2-CG 3.63Å; T184-F312 HydrophobicContact CG2-CB 4.15Å; T184-F312 HydrophobicContact CG2-CD2 4.15Å |
| 185 | K | 83.2 | Confident | 84.4 | Confident | 9 Ų | 9 | 54.8 Ų | 54.8 | 4% | 0.039 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -68.3 | -32.4 | -179.3 | 69.5 | -173.4 | 177.2 | -165.6 | 0 | 113.3 | G42 I45 F181 T182 Y183 A188 L189 S313 | G42-K185 PolarHBondContact O-NZ 3.08Å; I45-K185 HydrophobicContact CG2-CD 4.28Å; I45-K185 HydrophobicContact CG2-CG 4.41Å; I45-K185 WeakPolarHBondContact O-CD 3.5Å; I45-K185 WeakPolarHBondContact O-CE 3.49Å; I45-K185 PolarHBondContact O-NZ 3.28Å; F181-K185 PolarHBondContact O-N 3.45Å; T182-K185 VanDerWaalsContact O-CG 3.26Å; T182-K185 WeakPolarHBondContact O-CG 3.28Å; Y183-K185 PolarHBondContact O-N 3.22Å; K185-A188 PolarHBondContact O-N 3.3Å; K185-L189 WeakPolarHBondContact O-CG 3.47Å; K185-L189 PolarHBondContact O-N 3.17Å; K185-L189 VanDerWaalsContact O-N 3.1Å; K185-S313 WeakPolarHBondContact CB-OG 3.4Å |
| 186 | I | 85.2 | Confident | 85.5 | Confident | 64 Ų | 64 | 51.9 Ų | 51.9 | 33% | 0.328 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -66.6 | -44.4 | 175.2 | -65.8 | 172.2 | 0 | 0 | 0 | 109.4 | T182 Y183 T184 A188 L189 L190 | T182-I186 WeakPolarHBondContact O-CG1 3.47Å; Y183-I186 PolarHBondContact O-N 2.91Å; T184-I186 VanDerWaalsContact C-N 3.34Å; T184-I186 PolarHBondContact O-N 2.94Å; I186-A188 VanDerWaalsContact C-N 3.35Å; I186-A188 PolarHBondContact O-N 2.8Å; I186-L189 PolarHBondContact O-N 3.35Å; I186-L190 HydrophobicContact CG2-CD1 3.91Å; I186-L190 HydrophobicContact CG2-CG 4.31Å; I186-L190 WeakPolarHBondContact O-CB 3.31Å; I186-L190 VanDerWaalsContact O-CG 3.31Å; I186-L190 WeakPolarHBondContact O-CG 3.39Å; I186-L190 PolarHBondContact O-N 3.45Å |
| 187 | I | 88.7 | Confident | 86.6 | Confident | 84 Ų | 84 | 50 Ų | 50 | 43% | 0.431 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -59.1 | -46.9 | 176.2 | -66.2 | 166.3 | 0 | 0 | 0 | 110.6 | Y183 T184 L189 L190 M191 F309 | Y183-I187 WeakPolarHBondContact O-CG1 3.28Å; Y183-I187 PolarHBondContact O-N 3.04Å; Y183-I187 VanDerWaalsContact O-N 3.08Å; T184-I187 PolarHBondContact O-N 3.38Å; I187-L189 VanDerWaalsContact C-N 3.34Å; I187-L189 PolarHBondContact O-N 2.75Å; I187-L190 PolarHBondContact O-N 3Å; I187-M191 HydrophobicContact CG2-CG 4.44Å; I187-M191 HydrophobicContact CG2-SD 4.14Å; I187-M191 WeakPolarHBondContact O-CG 3.33Å; I187-M191 PolarHBondContact O-N 3.03Å; I187-F309 HydrophobicContact CG2-CE2 3.94Å; I187-F309 HydrophobicContact CG2-CZ 4.45Å |
| 188 | A | 90.4 | Very high | 87.7 | Confident | 0 Ų | 0 | 51.7 Ų | 51.7 | 0% | 0 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -58.2 | -44.7 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | T184 K185 I186 M191 I192 M306 F309 | T184-A188 PolarHBondContact O-N 2.99Å; K185-A188 PolarHBondContact O-N 3.3Å; I186-A188 VanDerWaalsContact C-N 3.35Å; I186-A188 PolarHBondContact O-N 2.8Å; A188-M191 PolarHBondContact O-N 2.91Å; A188-I192 WeakPolarHBondContact O-CG1 3.37Å; A188-I192 PolarHBondContact O-N 3.24Å; A188-I192 VanDerWaalsContact O-N 3.1Å; A188-M306 HydrophobicContact CB-SD 4.29Å; A188-F309 HydrophobicContact CB-CB 3.89Å; A188-F309 HydrophobicContact CB-CD2 3.96Å; A188-F309 HydrophobicContact CB-CG 4.39Å |
| 189 | L | 92.4 | Very high | 88.8 | Confident | 4 Ų | 4 | 51.2 Ų | 51.2 | 2% | 0.021 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -68.7 | -40.3 | 178.3 | -73.8 | 167.1 | 0 | 0 | 0 | 112.5 | I45 I49 F50 K185 I186 I187 M191 I192 I193 V267 A271 | I45-L189 HydrophobicContact CG2-CD1 3.27Å; I49-L189 HydrophobicContact CG1-CD2 4Å; I49-L189 HydrophobicContact CG2-CD1 4.41Å; I49-L189 HydrophobicContact CG2-CD2 3.95Å; F50-L189 HydrophobicContact CZ-CD2 4.39Å; F50-L189 HydrophobicContact CZ-CG 4.47Å; K185-L189 WeakPolarHBondContact O-CG 3.47Å; K185-L189 PolarHBondContact O-N 3.17Å; K185-L189 VanDerWaalsContact O-N 3.1Å; I186-L189 PolarHBondContact O-N 3.35Å; I187-L189 VanDerWaalsContact C-N 3.34Å; I187-L189 PolarHBondContact O-N 2.75Å; L189-M191 VanDerWaalsContact C-N 3.31Å; L189-M191 PolarHBondContact O-N 3.09Å; L189-I192 PolarHBondContact O-N 3Å; L189-I193 WeakPolarHBondContact O-CB 3.47Å; L189-I193 VanDerWaalsContact O-CG1 3.28Å; L189-I193 WeakPolarHBondContact O-CG1 3.19Å; L189-I193 PolarHBondContact O-N 3.06Å; L189-V267 HydrophobicContact CB-CG1 4.47Å; L189-V267 HydrophobicContact CD1-CG1 4.17Å; L189-A271 HydrophobicContact CD2-CB 4.22Å |
| 190 | L | 93 | Very high | 89.9 | Confident | 92 Ų | 92 | 49.9 Ų | 49.9 | 48% | 0.482 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -61.5 | -41.8 | 174.7 | -72.5 | 174.2 | 0 | 0 | 0 | 111.2 | I186 I187 I192 I193 I194 | I186-L190 HydrophobicContact CG2-CD1 3.91Å; I186-L190 HydrophobicContact CG2-CG 4.31Å; I186-L190 WeakPolarHBondContact O-CB 3.31Å; I186-L190 VanDerWaalsContact O-CG 3.31Å; I186-L190 WeakPolarHBondContact O-CG 3.39Å; I186-L190 PolarHBondContact O-N 3.45Å; I187-L190 PolarHBondContact O-N 3Å; L190-I192 PolarHBondContact O-N 3.45Å; L190-I193 PolarHBondContact O-N 3.46Å; L190-I194 WeakPolarHBondContact O-CB 3.26Å; L190-I194 WeakPolarHBondContact O-CD1 3.18Å; L190-I194 WeakPolarHBondContact O-CG1 3.37Å; L190-I194 PolarHBondContact O-N 2.88Å |
| 191 | M | 93.6 | Very high | 90.7 | Very high | 57 Ų | 57 | 48.2 Ų | 48.2 | 28% | 0.281 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -58.3 | -48.6 | 175 | -74.7 | 177.8 | 64.1 | 0 | 0 | 111.6 | I187 A188 L189 T195 Y299 F309 | I187-M191 HydrophobicContact CG2-CG 4.44Å; I187-M191 HydrophobicContact CG2-SD 4.14Å; I187-M191 WeakPolarHBondContact O-CG 3.33Å; I187-M191 PolarHBondContact O-N 3.03Å; A188-M191 PolarHBondContact O-N 2.91Å; L189-M191 VanDerWaalsContact C-N 3.31Å; L189-M191 PolarHBondContact O-N 3.09Å; M191-T195 WeakPolarHBondContact O-CB 3.44Å; M191-T195 PolarHBondContact O-N 2.95Å; M191-T195 PolarHBondContact O-OG1 3.39Å; M191-Y299 HydrophobicContact CE-CD2 4.23Å; M191-Y299 HydrophobicContact CE-CE2 3.68Å; M191-Y299 PolarHBondContact O-OH 3.15Å; M191-Y299 VanDerWaalsContact O-OH 3.11Å; M191-F309 HydrophobicContact SD-CD2 4.4Å; M191-F309 HydrophobicContact SD-CE2 3.82Å |
| 192 | I | 95 | Very high | 91.4 | Very high | 0 Ų | 0 | 52.7 Ų | 52.7 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -59.7 | -49.9 | 178.1 | -68.1 | 164.8 | 0 | 0 | 0 | 110.6 | F50 A188 L189 L190 T195 G196 A274 Y275 A291 F294 M306 | F50-I192 HydrophobicContact CE1-CD1 4.2Å; A188-I192 WeakPolarHBondContact O-CG1 3.37Å; A188-I192 PolarHBondContact O-N 3.24Å; A188-I192 VanDerWaalsContact O-N 3.1Å; L189-I192 PolarHBondContact O-N 3Å; L190-I192 PolarHBondContact O-N 3.45Å; I192-T195 PolarHBondContact O-N 3.39Å; I192-G196 PolarHBondContact O-N 2.99Å; I192-A274 HydrophobicContact CG2-CB 3.78Å; I192-A274 WeakPolarHBondContact O-CB 3.36Å; I192-Y275 HydrophobicContact CD1-CE1 4Å; I192-Y275 HydrophobicContact CG2-CD1 4.25Å; I192-Y275 HydrophobicContact CG2-CE1 3.96Å; I192-A291 HydrophobicContact CD1-CB 4.19Å; I192-F294 HydrophobicContact CB-CE1 4.41Å; I192-F294 HydrophobicContact CG1-CD1 4.26Å; I192-F294 HydrophobicContact CG1-CE1 4.18Å; I192-F294 HydrophobicContact CG2-CE1 4.4Å; I192-F294 HydrophobicContact CG2-CZ 4.28Å; I192-M306 HydrophobicContact CD1-CE 4.17Å; I192-M306 HydrophobicContact CD1-SD 4.27Å; I192-M306 HydrophobicContact CG1-CE 3.87Å |
| 193 | I | 96.4 | Very high | 92.2 | Very high | 16 Ų | 16 | 53.8 Ų | 53.8 | 8% | 0.082 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -63.8 | -48.9 | -177.1 | -69 | 167.9 | 0 | 0 | 0 | 111.6 | L189 L190 T195 G196 F197 V267 L270 A271 | L189-I193 WeakPolarHBondContact O-CB 3.47Å; L189-I193 VanDerWaalsContact O-CG1 3.28Å; L189-I193 WeakPolarHBondContact O-CG1 3.19Å; L189-I193 PolarHBondContact O-N 3.06Å; L190-I193 PolarHBondContact O-N 3.46Å; I193-T195 VanDerWaalsContact C-N 3.27Å; I193-T195 PolarHBondContact O-N 3.16Å; I193-G196 PolarHBondContact O-N 2.9Å; I193-F197 HydrophobicContact CG2-CD2 3.85Å; I193-F197 HydrophobicContact CG2-CE2 3.58Å; I193-F197 VanDerWaalsContact O-CD2 3.28Å; I193-F197 WeakPolarHBondContact O-CD2 3.49Å; I193-F197 PolarHBondContact O-N 3.26Å; I193-V267 HydrophobicContact CD1-CB 4.43Å; I193-V267 HydrophobicContact CD1-CG1 3.97Å; I193-L270 HydrophobicContact CD1-CB 4.14Å; I193-L270 HydrophobicContact CG1-CB 4.03Å; I193-L270 HydrophobicContact CG2-CB 4.11Å; I193-L270 HydrophobicContact CG2-CD1 4.2Å; I193-A271 HydrophobicContact CG1-CB 4.3Å |
| 194 | I | 96.7 | Very high | 92.7 | Very high | 102 Ų | 102 | 50.1 Ų | 50.1 | 52% | 0.523 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -59.6 | -43.4 | 178.8 | -69 | 166.8 | 0 | 0 | 0 | 109.9 | L190 G196 F197 V198 | L190-I194 WeakPolarHBondContact O-CB 3.26Å; L190-I194 WeakPolarHBondContact O-CD1 3.18Å; L190-I194 WeakPolarHBondContact O-CG1 3.37Å; L190-I194 PolarHBondContact O-N 2.88Å; I194-G196 VanDerWaalsContact C-N 3.34Å; I194-G196 PolarHBondContact O-N 2.88Å; I194-F197 PolarHBondContact O-N 3.48Å; I194-V198 WeakPolarHBondContact O-CG2 3.26Å; I194-V198 PolarHBondContact O-N 3.46Å |
| 195 | T | 95.7 | Very high | 93.1 | Very high | 16 Ų | 16 | 51.9 Ų | 51.9 | 10% | 0.098 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -63.2 | -41.8 | 178.4 | -56.8 | 0 | 0 | 0 | 0 | 111.5 | M191 I192 I193 F197 V198 Q199 F294 I298 Y299 | M191-T195 WeakPolarHBondContact O-CB 3.44Å; M191-T195 PolarHBondContact O-N 2.95Å; M191-T195 PolarHBondContact O-OG1 3.39Å; I192-T195 PolarHBondContact O-N 3.39Å; I193-T195 VanDerWaalsContact C-N 3.27Å; I193-T195 PolarHBondContact O-N 3.16Å; T195-F197 VanDerWaalsContact C-N 3.34Å; T195-F197 PolarHBondContact O-N 3.29Å; T195-V198 PolarHBondContact O-N 3.4Å; T195-Q199 HydrophobicContact CG2-CG 4.48Å; T195-Q199 WeakPolarHBondContact O-CG 3.21Å; T195-Q199 PolarHBondContact O-N 2.8Å; T195-F294 HydrophobicContact CG2-CE1 3.88Å; T195-F294 HydrophobicContact CG2-CZ 3.59Å; T195-I298 HydrophobicContact CG2-CB 4.26Å; T195-I298 HydrophobicContact CG2-CG1 4.19Å; T195-I298 HydrophobicContact CG2-CG2 3.63Å; T195-Y299 HydrophobicContact CG2-CE1 4.18Å; T195-Y299 WeakPolarHBondContact OG1-CE1 3.32Å; T195-Y299 PolarHBondContact OG1-OH 2.71Å |
| 196 | G | 96 | Very high | 93.3 | Very high | 1 Ų | 1 | 58 Ų | 58 | 1% | 0.01 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -57.8 | -44.2 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | I192 I193 I194 V198 Q199 I200 | I192-G196 PolarHBondContact O-N 2.99Å; I193-G196 PolarHBondContact O-N 2.9Å; I194-G196 VanDerWaalsContact C-N 3.34Å; I194-G196 PolarHBondContact O-N 2.88Å; G196-V198 VanDerWaalsContact C-N 3.35Å; G196-V198 PolarHBondContact O-N 2.82Å; G196-Q199 PolarHBondContact O-N 2.91Å; G196-I200 VanDerWaalsContact O-CG1 3.31Å; G196-I200 WeakPolarHBondContact O-CG1 3.32Å; G196-I200 PolarHBondContact O-N 3.05Å |
| 197 | F | 96.9 | Very high | 93.3 | Very high | 119 Ų | 119 | 57.6 Ų | 57.6 | 52% | 0.522 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -62 | -40.7 | 175.2 | -79.4 | -65.5 | 0 | 0 | 0 | 112.9 | I193 I194 T195 Q199 I200 G201 L270 | I193-F197 HydrophobicContact CG2-CD2 3.85Å; I193-F197 HydrophobicContact CG2-CE2 3.58Å; I193-F197 VanDerWaalsContact O-CD2 3.28Å; I193-F197 WeakPolarHBondContact O-CD2 3.49Å; I193-F197 PolarHBondContact O-N 3.26Å; I194-F197 PolarHBondContact O-N 3.48Å; T195-F197 VanDerWaalsContact C-N 3.34Å; T195-F197 PolarHBondContact O-N 3.29Å; F197-Q199 VanDerWaalsContact C-N 3.34Å; F197-I200 PolarHBondContact O-N 3Å; F197-G201 PolarHBondContact O-N 2.69Å; F197-L270 HydrophobicContact CE2-CD1 4.32Å; F197-L270 HydrophobicContact CE2-CD2 4.4Å; F197-L270 HydrophobicContact CZ-CD1 4.32Å; F197-L270 HydrophobicContact CZ-CD2 3.84Å |
| 198 | V | 96.9 | Very high | 93.2 | Very high | 83 Ų | 83 | 57.2 Ų | 57.2 | 50% | 0.503 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -61.6 | -44.8 | 174.8 | 176.3 | 0 | 0 | 0 | 0 | 110.5 | I194 T195 G196 I200 G201 L202 | I194-V198 WeakPolarHBondContact O-CG2 3.26Å; I194-V198 PolarHBondContact O-N 3.46Å; T195-V198 PolarHBondContact O-N 3.4Å; G196-V198 VanDerWaalsContact C-N 3.35Å; G196-V198 PolarHBondContact O-N 2.82Å; V198-I200 PolarHBondContact O-N 3.48Å; V198-G201 CarbonylContact O-C 3.28Å; V198-G201 WeakPolarHBondContact O-CA 3.44Å; V198-G201 PolarHBondContact O-N 3.04Å; V198-G201 VanDerWaalsContact O-N 3.1Å; V198-L202 HydrophobicContact CG1-CD1 4.17Å; V198-L202 HydrophobicContact CG1-CG 4.47Å; V198-L202 WeakPolarHBondContact O-CG 3.27Å; V198-L202 PolarHBondContact O-N 2.78Å |
| 199 | Q | 96.1 | Very high | 93.2 | Very high | 22 Ų | 22 | 65.1 Ų | 65.1 | 10% | 0.103 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -65.6 | -38.2 | -178.9 | -69.9 | -62.5 | -10.4 | 0 | 0 | 113.3 | T195 G196 F197 G201 L202 G203 H204 V278 | T195-Q199 HydrophobicContact CG2-CG 4.48Å; T195-Q199 WeakPolarHBondContact O-CG 3.21Å; T195-Q199 PolarHBondContact O-N 2.8Å; G196-Q199 PolarHBondContact O-N 2.91Å; F197-Q199 VanDerWaalsContact C-N 3.34Å; Q199-G201 VanDerWaalsContact C-N 3.31Å; Q199-G201 PolarHBondContact O-N 3.49Å; Q199-L202 PolarHBondContact O-N 2.92Å; Q199-L202 VanDerWaalsContact O-N 3.16Å; Q199-G203 PolarHBondContact O-N 2.79Å; Q199-H204 PolarHBondContact O-N 3.22Å; Q199-H204 VanDerWaalsContact O-N 3.13Å; Q199-H204 PolarHBondContact OE1-CE1 3.44Å; Q199-H204 PolarHBondContact OE1-ND1 3.04Å; Q199-V278 HydrophobicContact CB-CG2 4.5Å; Q199-V278 HydrophobicContact CG-CG2 3.77Å |
| 200 | I | 95.4 | Very high | 93.1 | Very high | 58 Ų | 58 | 67.3 Ų | 67.3 | 30% | 0.297 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -61.2 | -43.8 | 170.8 | -67.1 | 166.8 | 0 | 0 | 0 | 110.2 | G196 F197 V198 L202 G203 V205 F208 V273 T277 | G196-I200 VanDerWaalsContact O-CG1 3.31Å; G196-I200 WeakPolarHBondContact O-CG1 3.32Å; G196-I200 PolarHBondContact O-N 3.05Å; F197-I200 PolarHBondContact O-N 3Å; V198-I200 PolarHBondContact O-N 3.48Å; I200-L202 PolarHBondContact O-N 3.43Å; I200-G203 PolarHBondContact O-N 3.06Å; I200-V205 HydrophobicContact CG2-CG1 4.14Å; I200-F208 HydrophobicContact CD1-CZ 4.31Å; I200-F208 HydrophobicContact CG1-CZ 4.45Å; I200-V273 HydrophobicContact CD1-CG1 4.02Å; I200-T277 HydrophobicContact CD1-CG2 4.04Å; I200-T277 HydrophobicContact CG1-CG2 3.52Å |
| 201 | G | 94.5 | Very high | 93.1 | Very high | 69 Ų | 69 | 64.7 Ų | 64.7 | 71% | 0.711 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -62.5 | -26.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | F197 V198 Q199 G203 | F197-G201 PolarHBondContact O-N 2.69Å; V198-G201 CarbonylContact O-C 3.28Å; V198-G201 WeakPolarHBondContact O-CA 3.44Å; V198-G201 PolarHBondContact O-N 3.04Å; V198-G201 VanDerWaalsContact O-N 3.1Å; Q199-G201 VanDerWaalsContact C-N 3.31Å; Q199-G201 PolarHBondContact O-N 3.49Å; G201-G203 VanDerWaalsContact C-N 3.33Å |
| 202 | L | 94.7 | Very high | 93.1 | Very high | 116 Ų | 116 | 67.2 Ų | 67.2 | 61% | 0.607 | 37% | 0.37 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.6 | -5.7 | 173.7 | -66.6 | 174.2 | 0 | 0 | 0 | 113.5 | V198 Q199 I200 | V198-L202 HydrophobicContact CG1-CD1 4.17Å; V198-L202 HydrophobicContact CG1-CG 4.47Å; V198-L202 WeakPolarHBondContact O-CG 3.27Å; V198-L202 PolarHBondContact O-N 2.78Å; Q199-L202 PolarHBondContact O-N 2.92Å; Q199-L202 VanDerWaalsContact O-N 3.16Å; I200-L202 PolarHBondContact O-N 3.43Å |
| 203 | G | 92.3 | Very high | 93 | Very high | 46 Ų | 46 | 74.3 Ų | 74.3 | 47% | 0.474 | 40% | 0.403 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 96.4 | 8.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 115.7 | Q199 I200 G201 V205 | Q199-G203 PolarHBondContact O-N 2.79Å; I200-G203 PolarHBondContact O-N 3.06Å; G201-G203 VanDerWaalsContact C-N 3.33Å; G203-V205 VanDerWaalsContact C-N 3.26Å; G203-V205 PolarHBondContact O-N 2.92Å |
| 204 | H | 91.3 | Very high | 92.8 | Very high | 77 Ų | 77 | 76 Ų | 76 | 36% | 0.356 | 43% | 0.425 | S | S | . | . | trans | -76.3 | 77.5 | 176.2 | -61.7 | 101.5 | 0 | 0 | 0 | 111 | Q199 T277 | Q199-H204 PolarHBondContact O-N 3.22Å; Q199-H204 VanDerWaalsContact O-N 3.13Å; Q199-H204 PolarHBondContact OE1-CE1 3.44Å; Q199-H204 PolarHBondContact OE1-ND1 3.04Å; H204-T277 WeakPolarHBondContact CB-O 3.39Å | ||
| 205 | V | 90.7 | Very high | 92.7 | Very high | 55 Ų | 55 | 72.4 Ų | 72.4 | 33% | 0.333 | 41% | 0.408 | S | S | . | . | trans | -125.9 | 23.7 | -177 | -62.1 | 0 | 0 | 0 | 0 | 113.2 | I200 G203 E207 F208 | I200-V205 HydrophobicContact CG2-CG1 4.14Å; G203-V205 VanDerWaalsContact C-N 3.26Å; G203-V205 PolarHBondContact O-N 2.92Å; V205-E207 PolarHBondContact O-N 2.81Å; V205-F208 VanDerWaalsContact CA-CD2 3.44Å; V205-F208 HydrophobicContact CB-CB 4.36Å; V205-F208 HydrophobicContact CB-CD2 3.69Å; V205-F208 HydrophobicContact CB-CE2 4.25Å; V205-F208 HydrophobicContact CB-CG 4.26Å; V205-F208 HydrophobicContact CG1-CD2 4.09Å; V205-F208 HydrophobicContact CG1-CE2 4.19Å; V205-F208 WeakPolarHBondContact O-CB 3.22Å; V205-F208 PolarHBondContact O-N 3.41Å | ||
| 206 | E | 88.3 | Confident | 92.6 | Very high | 136 Ų | 136 | 73.7 Ų | 73.7 | 64% | 0.636 | 42% | 0.415 | S | S | * | . | G | 310 helix | trans | -56.7 | -49.9 | -176.5 | -66.7 | 141.6 | -169 | 0 | 0 | 112 | F208 Q209 | E206-F208 PolarHBondContact O-N 2.65Å; E206-Q209 WeakPolarHBondContact O-CB 2.78Å; E206-Q209 WeakPolarHBondContact O-CG 3.21Å; E206-Q209 PolarHBondContact O-N 3.01Å; E206-Q209 VanDerWaalsContact O-N 3.08Å |
| 207 | E | 84 | Confident | 92.6 | Very high | 57 Ų | 57 | 80.1 Ų | 80.1 | 27% | 0.266 | 44% | 0.439 | S | S | . | . | G | 310 helix | trans | -67.2 | -9.2 | 179.7 | -61.2 | -69.7 | -176.9 | 0 | 0 | 113.5 | V205 I276 | V205-E207 PolarHBondContact O-N 2.81Å; E207-I276 HydrophobicContact CB-CB 4.37Å; E207-I276 HydrophobicContact CB-CD1 3.82Å |
| 208 | F | 87.9 | Confident | 92.4 | Very high | 75 Ų | 75 | 78.3 Ų | 78.3 | 33% | 0.329 | 43% | 0.434 | S | S | . | . | G | 310 helix | trans | -86.9 | -11.1 | 175.7 | -60.5 | -103.7 | 0 | 0 | 0 | 112.8 | F63 I200 V205 E206 P211 V273 I276 T277 | F63-F208 HydrophobicContact CE1-CD1 4.15Å; F63-F208 HydrophobicContact CE1-CE1 4.18Å; F63-F208 HydrophobicContact CZ-CE1 4.31Å; I200-F208 HydrophobicContact CD1-CZ 4.31Å; I200-F208 HydrophobicContact CG1-CZ 4.45Å; V205-F208 VanDerWaalsContact CA-CD2 3.44Å; V205-F208 HydrophobicContact CB-CB 4.36Å; V205-F208 HydrophobicContact CB-CD2 3.69Å; V205-F208 HydrophobicContact CB-CE2 4.25Å; V205-F208 HydrophobicContact CB-CG 4.26Å; V205-F208 HydrophobicContact CG1-CD2 4.09Å; V205-F208 HydrophobicContact CG1-CE2 4.19Å; V205-F208 WeakPolarHBondContact O-CB 3.22Å; V205-F208 PolarHBondContact O-N 3.41Å; E206-F208 PolarHBondContact O-N 2.65Å; F208-P211 WeakPolarHBondContact O-CD 3.41Å; F208-V273 HydrophobicContact CE1-CG1 4.03Å; F208-V273 HydrophobicContact CZ-CG1 3.81Å; F208-I276 HydrophobicContact CD2-CD1 3.96Å; F208-I276 HydrophobicContact CE1-CD1 4.18Å; F208-I276 HydrophobicContact CE2-CD1 3.54Å; F208-I276 HydrophobicContact CE2-CG1 4.37Å; F208-I276 HydrophobicContact CG-CD1 4.5Å; F208-I276 HydrophobicContact CZ-CD1 3.67Å; F208-I276 HydrophobicContact CZ-CG1 4.38Å; F208-T277 HydrophobicContact CE2-CG2 3.9Å; F208-T277 HydrophobicContact CZ-CG2 4.06Å |
| 209 | Q | 88.9 | Confident | 92.2 | Very high | 167 Ų | 167 | 76.6 Ų | 76.6 | 78% | 0.78 | 43% | 0.425 | S | S | * | . | S | Bend | trans | -72.5 | -39 | -177.2 | -66.1 | -173.7 | -8.1 | 0 | 0 | 112.5 | E206 | E206-Q209 WeakPolarHBondContact O-CB 2.78Å; E206-Q209 WeakPolarHBondContact O-CG 3.21Å; E206-Q209 PolarHBondContact O-N 3.01Å; E206-Q209 VanDerWaalsContact O-N 3.08Å |
| 210 | A | 90.4 | Very high | 92 | Very high | 49 Ų | 49 | 75.7 Ų | 75.7 | 41% | 0.405 | 42% | 0.421 | S | S | . | . | S | Bend | trans | -130.5 | 60.9 | -179.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | F212 E213 | A210-F212 PolarHBondContact O-N 3.07Å; A210-E213 HydrophobicContact CB-CB 3.99Å; A210-E213 WeakPolarHBondContact CB-OE2 3.39Å; A210-E213 WeakPolarHBondContact O-CB 3.43Å; A210-E213 PolarHBondContact O-N 2.98Å; A210-E213 VanDerWaalsContact O-N 3.08Å |
| 211 | P | 93.1 | Very high | 91.9 | Very high | 38 Ų | 38 | 73.8 Ų | 73.8 | 25% | 0.247 | 41% | 0.413 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -64.7 | -22.7 | -165.7 | 25.7 | -33.7 | 0 | 0 | 0 | 113.4 | S62 F63 G64 F208 | S62-P211 WeakPolarHBondContact CB-O 3.48Å; S62-P211 PolarHBondContact OG-O 3.33Å; F63-P211 HydrophobicContact CD1-CB 4.12Å; F63-P211 PolarHBondContact N-O 3.34Å; G64-P211 WeakPolarHBondContact CA-O 3.36Å; G64-P211 PolarHBondContact N-O 3.31Å; F208-P211 WeakPolarHBondContact O-CD 3.41Å |
| 212 | F | 95 | Very high | 91.9 | Very high | 109 Ų | 109 | 72.2 Ų | 72.2 | 48% | 0.478 | 39% | 0.388 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -104.4 | 4.1 | -178.3 | -61.6 | -74.5 | 0 | 0 | 0 | 113.9 | I68 A210 G214 S215 | I68-F212 HydrophobicContact CD1-CE1 3.59Å; I68-F212 HydrophobicContact CD1-CZ 4.07Å; I68-F212 HydrophobicContact CG1-CE1 4.43Å; A210-F212 PolarHBondContact O-N 3.07Å; F212-G214 PolarHBondContact O-N 3.46Å; F212-S215 VanDerWaalsContact C-OG 3.32Å; F212-S215 WeakPolarHBondContact CA-OG 3.4Å; F212-S215 WeakPolarHBondContact O-CB 3.29Å; F212-S215 PolarHBondContact O-N 2.87Å; F212-S215 PolarHBondContact O-OG 3.46Å |
| 213 | E | 92.6 | Very high | 91.8 | Very high | 150 Ų | 150 | 66.7 Ų | 66.7 | 70% | 0.701 | 36% | 0.359 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.1 | 135 | 179.1 | -170.5 | 168.9 | -171.9 | 0 | 0 | 111 | S62 A210 S215 | S62-E213 WeakPolarHBondContact CB-O 3.39Å; A210-E213 HydrophobicContact CB-CB 3.99Å; A210-E213 WeakPolarHBondContact CB-OE2 3.39Å; A210-E213 WeakPolarHBondContact O-CB 3.43Å; A210-E213 PolarHBondContact O-N 2.98Å; A210-E213 VanDerWaalsContact O-N 3.08Å; E213-S215 VanDerWaalsContact C-N 3.26Å; E213-S215 PolarHBondContact O-N 2.95Å |
| 214 | G | 90.7 | Very high | 91.8 | Very high | 52 Ų | 52 | 67 Ų | 67 | 54% | 0.536 | 35% | 0.347 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 73.1 | 7.6 | -178.2 | 0 | 0 | 0 | 0 | 0 | 115.9 | Q61 F212 N216 | Q61-G214 VanDerWaalsContact CB-O 3.32Å; Q61-G214 WeakPolarHBondContact CB-O 3.47Å; F212-G214 PolarHBondContact O-N 3.46Å; G214-N216 PolarHBondContact O-N 3.35Å |
| 215 | S | 95.2 | Very high | 91.9 | Very high | 26 Ų | 26 | 63.3 Ų | 63.3 | 18% | 0.182 | 33% | 0.33 | C | S | . | . | trans | -56.5 | 128.9 | -176.3 | -60.9 | 0 | 0 | 0 | 0 | 113.5 | M60 S62 F212 E213 | M60-S215 WeakPolarHBondContact O-CA 3.48Å; S62-S215 WeakPolarHBondContact CB-OG 3.16Å; S62-S215 PolarHBondContact OG-OG 3.33Å; F212-S215 VanDerWaalsContact C-OG 3.32Å; F212-S215 WeakPolarHBondContact CA-OG 3.4Å; F212-S215 WeakPolarHBondContact O-CB 3.29Å; F212-S215 PolarHBondContact O-N 2.87Å; F212-S215 PolarHBondContact O-OG 3.46Å; E213-S215 VanDerWaalsContact C-N 3.26Å; E213-S215 PolarHBondContact O-N 2.95Å | ||
| 216 | N | 94.6 | Very high | 92 | Very high | 43 Ų | 43 | 61.8 Ų | 61.8 | 23% | 0.23 | 32% | 0.319 | C | S | . | . | trans | -96.7 | 108.4 | 173.4 | -173.1 | -6.2 | 0 | 0 | 0 | 111.3 | N59 M60 Q61 G214 N218 S221 | N59-N216 WeakPolarHBondContact O-CB 3.48Å; M60-N216 VanDerWaalsContact CE-O 3.29Å; M60-N216 WeakPolarHBondContact CE-O 3.33Å; M60-N216 PolarHBondContact O-N 2.93Å; Q61-N216 HydrophobicContact CB-CB 4.43Å; Q61-N216 HydrophobicContact CG-CB 4.26Å; G214-N216 PolarHBondContact O-N 3.35Å; N216-N218 WeakPolarHBondContact OD1-CB 3.38Å; N216-N218 PolarHBondContact OD1-N 3.44Å; N216-S221 PolarHBondContact ND2-OG 2.91Å | ||
| 217 | W | 94.3 | Very high | 92.2 | Very high | 136 Ų | 136 | 55.5 Ų | 55.5 | 52% | 0.515 | 29% | 0.29 | S | S | . | . | trans | -100.4 | 17.1 | 179.4 | -62.9 | 99 | 0 | 0 | 0 | 113.6 | M60 A65 I68 I222 | M60-W217 HydrophobicContact CE-CE3 4.2Å; M60-W217 HydrophobicContact CE-CZ3 4.24Å; A65-W217 HydrophobicContact CB-CH2 4.33Å; A65-W217 HydrophobicContact CB-CZ2 4.12Å; I68-W217 HydrophobicContact CD1-CH2 4.14Å; W217-I222 HydrophobicContact CE3-CD1 4.08Å; W217-I222 WeakPolarHBondContact O-CD1 3.21Å | ||
| 218 | N | 94.6 | Very high | 92.6 | Very high | 81 Ų | 81 | 52.9 Ų | 52.9 | 43% | 0.433 | 28% | 0.278 | S | S | . | . | trans | -59.6 | 129.5 | 173.7 | -176.8 | -30.9 | 0 | 0 | 0 | 109.5 | N216 G220 S221 I222 | N216-N218 WeakPolarHBondContact OD1-CB 3.38Å; N216-N218 PolarHBondContact OD1-N 3.44Å; N218-G220 PolarHBondContact O-N 2.88Å; N218-G220 VanDerWaalsContact O-N 3.1Å; N218-G220 PolarHBondContact OD1-N 2.74Å; N218-S221 PolarHBondContact O-N 3.39Å; N218-I222 WeakPolarHBondContact O-CG1 3.47Å; N218-I222 PolarHBondContact O-N 3.42Å | ||
| 219 | P | 92.3 | Very high | 92.9 | Very high | 47 Ų | 47 | 49.3 Ų | 49.3 | 31% | 0.305 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -44.8 | -43.4 | 176.3 | -32.7 | 36.7 | 0 | 0 | 0 | 114.3 | I222 A223 F428 | P219-I222 PolarHBondContact O-N 3.32Å; P219-A223 PolarHBondContact O-N 3.47Å; P219-F428 HydrophobicContact CB-CB 4.29Å; P219-F428 HydrophobicContact CB-CD1 3.8Å; P219-F428 HydrophobicContact CB-CD2 3.62Å; P219-F428 HydrophobicContact CB-CE1 3.93Å; P219-F428 HydrophobicContact CB-CE2 3.75Å; P219-F428 HydrophobicContact CB-CG 3.64Å; P219-F428 HydrophobicContact CB-CZ 3.9Å; P219-F428 HydrophobicContact CG-CE1 4.49Å; P219-F428 HydrophobicContact CG-CE2 4.39Å; P219-F428 HydrophobicContact CG-CZ 4.29Å; P219-F428 WeakPolarHBondContact O-CB 3.44Å; P219-F428 WeakPolarHBondContact O-CD2 3.49Å |
| 220 | G | 91.1 | Very high | 93.1 | Very high | 2 Ų | 2 | 41.4 Ų | 41.4 | 2% | 0.021 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -64.1 | -43.1 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | N218 A223 K224 F428 | N218-G220 PolarHBondContact O-N 2.88Å; N218-G220 VanDerWaalsContact O-N 3.1Å; N218-G220 PolarHBondContact OD1-N 2.74Å; G220-A223 PolarHBondContact O-N 2.99Å; G220-K224 PolarHBondContact O-N 2.76Å; G220-K224 VanDerWaalsContact O-N 3.16Å; G220-F428 WeakPolarHBondContact CA-O 3.5Å |
| 221 | S | 93.3 | Very high | 93.1 | Very high | 19 Ų | 19 | 39.9 Ų | 39.9 | 13% | 0.133 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -66.4 | -41.7 | 176.8 | -58.1 | 0 | 0 | 0 | 0 | 111.4 | N59 N216 N218 A223 K224 A225 | N59-S221 WeakPolarHBondContact O-CB 3.43Å; N216-S221 PolarHBondContact ND2-OG 2.91Å; N218-S221 PolarHBondContact O-N 3.39Å; S221-A223 VanDerWaalsContact C-N 3.31Å; S221-A223 PolarHBondContact O-N 3.3Å; S221-K224 PolarHBondContact O-N 3.06Å; S221-A225 WeakPolarHBondContact O-CB 3.46Å; S221-A225 PolarHBondContact O-N 3.31Å |
| 222 | I | 94.6 | Very high | 93.1 | Very high | 36 Ų | 36 | 38.1 Ų | 38.1 | 19% | 0.185 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -58.2 | -45.6 | 176.1 | -65.8 | 169 | 0 | 0 | 0 | 110.2 | M60 I69 W217 N218 P219 A225 F226 | M60-I222 HydrophobicContact CE-CG1 4.23Å; M60-I222 HydrophobicContact SD-CG1 4.26Å; I69-I222 HydrophobicContact CD1-CG2 4.24Å; W217-I222 HydrophobicContact CE3-CD1 4.08Å; W217-I222 WeakPolarHBondContact O-CD1 3.21Å; N218-I222 WeakPolarHBondContact O-CG1 3.47Å; N218-I222 PolarHBondContact O-N 3.42Å; P219-I222 PolarHBondContact O-N 3.32Å; I222-A225 PolarHBondContact O-N 2.92Å; I222-F226 WeakPolarHBondContact O-CB 3.47Å; I222-F226 PolarHBondContact O-N 3.42Å |
| 223 | A | 92.5 | Very high | 93 | Very high | 0 Ų | 0 | 33 Ų | 33 | 0% | 0 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -63.2 | -44.7 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | P219 G220 S221 A225 F226 Y227 L425 F428 | P219-A223 PolarHBondContact O-N 3.47Å; G220-A223 PolarHBondContact O-N 2.99Å; S221-A223 VanDerWaalsContact C-N 3.31Å; S221-A223 PolarHBondContact O-N 3.3Å; A223-A225 PolarHBondContact O-N 2.97Å; A223-F226 PolarHBondContact O-N 3.48Å; A223-Y227 WeakPolarHBondContact O-CD2 3.49Å; A223-Y227 PolarHBondContact O-N 2.68Å; A223-L425 HydrophobicContact CB-CD2 4.38Å; A223-F428 HydrophobicContact CB-CB 3.73Å |
| 224 | K | 91.5 | Very high | 92.7 | Very high | 51 Ų | 51 | 26.8 Ų | 26.8 | 22% | 0.222 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -61.3 | -42.8 | 175.8 | -72.2 | -178.1 | -178.2 | -178.4 | 0 | 112.2 | N59 G220 S221 Y227 S228 T377 G432 | N59-K224 HydrophobicContact CB-CB 4.48Å; N59-K224 VanDerWaalsContact OD1-CB 3.26Å; N59-K224 WeakPolarHBondContact OD1-CB 3.41Å; N59-K224 WeakPolarHBondContact OD1-CD 3.49Å; G220-K224 PolarHBondContact O-N 2.76Å; G220-K224 VanDerWaalsContact O-N 3.16Å; S221-K224 PolarHBondContact O-N 3.06Å; K224-Y227 PolarHBondContact O-N 3.24Å; K224-S228 PolarHBondContact O-N 3.11Å; K224-S228 PolarHBondContact O-OG 3.3Å; K224-S228 VanDerWaalsContact O-OG 3.06Å; K224-T377 HydrophobicContact CG-CG2 4.38Å; K224-G432 VanDerWaalsContact CE-O 3.26Å; K224-G432 WeakPolarHBondContact CE-O 3.36Å; K224-G432 PolarHBondContact NZ-O 3.47Å; K224-G432 VanDerWaalsContact NZ-O 3.09Å |
| 225 | A | 94.2 | Very high | 92.4 | Very high | 0 Ų | 0 | 24.4 Ų | 24.4 | 0% | 0 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -62 | -45.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111 | I56 N59 M60 I69 S221 I222 A223 Y227 S228 G229 | I56-A225 HydrophobicContact CG2-CB 4.4Å; N59-A225 HydrophobicContact CB-CB 3.89Å; M60-A225 HydrophobicContact CG-CB 3.72Å; M60-A225 HydrophobicContact SD-CB 3.69Å; I69-A225 HydrophobicContact CD1-CB 4.41Å; I69-A225 HydrophobicContact CG1-CB 4.13Å; I69-A225 HydrophobicContact CG2-CB 4.15Å; S221-A225 WeakPolarHBondContact O-CB 3.46Å; S221-A225 PolarHBondContact O-N 3.31Å; I222-A225 PolarHBondContact O-N 2.92Å; A223-A225 PolarHBondContact O-N 2.97Å; A225-Y227 PolarHBondContact O-N 3.45Å; A225-S228 WeakPolarHBondContact O-CB 3.47Å; A225-S228 PolarHBondContact O-N 2.97Å; A225-G229 PolarHBondContact O-N 3.33Å |
| 226 | F | 93.7 | Very high | 92 | Very high | 24 Ų | 24 | 23.2 Ų | 23.2 | 11% | 0.105 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -62.5 | -40.9 | 178.9 | -141.5 | -96.3 | 0 | 0 | 0 | 111.6 | I69 C73 F76 I222 A223 G229 L230 L425 | I69-F226 HydrophobicContact CD1-CD2 4.12Å; I69-F226 HydrophobicContact CG2-CD2 4.3Å; C73-F226 PolarHBondContact SG-O 2.93Å; F76-F226 HydrophobicContact CB-CE1 3.98Å; F76-F226 HydrophobicContact CB-CZ 3.95Å; F76-F226 HydrophobicContact CD1-CE1 4.08Å; F76-F226 AromaticContact CG-CE1 3.95Å; F76-F226 HydrophobicContact CG-CE1 3.95Å; F76-F226 HydrophobicContact CG-CZ 4.35Å; I222-F226 WeakPolarHBondContact O-CB 3.47Å; I222-F226 PolarHBondContact O-N 3.42Å; A223-F226 PolarHBondContact O-N 3.48Å; F226-G229 PolarHBondContact O-N 3.11Å; F226-L230 HydrophobicContact CD1-CD1 3.48Å; F226-L230 VanDerWaalsContact CD1-CD1 3.48Å; F226-L230 HydrophobicContact CD1-CD2 4.34Å; F226-L230 HydrophobicContact CD1-CG 3.71Å; F226-L230 HydrophobicContact CE1-CD1 3.8Å; F226-L230 HydrophobicContact CE1-CD2 4.06Å; F226-L230 HydrophobicContact CE1-CG 3.95Å; F226-L230 VanDerWaalsContact O-CB 3.25Å; F226-L230 WeakPolarHBondContact O-CB 3.08Å; F226-L230 WeakPolarHBondContact O-CG 3.2Å; F226-L230 PolarHBondContact O-N 3.22Å; F226-L425 HydrophobicContact CB-CD2 3.83Å; F226-L425 HydrophobicContact CD1-CD1 3.7Å; F226-L425 HydrophobicContact CD1-CD2 3.96Å; F226-L425 HydrophobicContact CD1-CG 4.45Å; F226-L425 HydrophobicContact CE1-CD1 4.12Å; F226-L425 HydrophobicContact CG-CD2 3.99Å |
| 227 | Y | 91.8 | Very high | 91.6 | Very high | 3 Ų | 3 | 21.4 Ų | 21.4 | 1% | 0.012 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -66.6 | -37.6 | 174.8 | -70.1 | -39.2 | 0 | 0 | 0 | 113.6 | A223 K224 A225 G229 L230 F231 T377 G380 F381 W384 L425 T429 | A223-Y227 WeakPolarHBondContact O-CD2 3.49Å; A223-Y227 PolarHBondContact O-N 2.68Å; K224-Y227 PolarHBondContact O-N 3.24Å; A225-Y227 PolarHBondContact O-N 3.45Å; Y227-G229 VanDerWaalsContact C-N 3.35Å; Y227-L230 HydrophobicContact CD1-CD1 4.49Å; Y227-L230 PolarHBondContact O-N 3.1Å; Y227-F231 WeakPolarHBondContact O-CB 3.46Å; Y227-F231 PolarHBondContact O-N 3.43Å; Y227-T377 HydrophobicContact CD2-CG2 4.41Å; Y227-G380 WeakPolarHBondContact CE1-O 3.49Å; Y227-F381 HydrophobicContact CE2-CB 4.25Å; Y227-W384 AromaticContact CD1-CD1 3.65Å; Y227-W384 HydrophobicContact CD1-CG 4.49Å; Y227-W384 HydrophobicContact CE1-CB 4.18Å; Y227-W384 AromaticContact CE1-CD1 3.87Å; Y227-W384 HydrophobicContact CE1-CG 4.35Å; Y227-L425 HydrophobicContact CE1-CD1 4.49Å; Y227-T429 HydrophobicContact CE2-CG2 3.74Å; Y227-T429 WeakPolarHBondContact CE2-OG1 3.39Å; Y227-T429 PolarHBondContact OH-OG1 3.42Å |
| 228 | S | 91.8 | Very high | 90.7 | Very high | 3 Ų | 3 | 17.3 Ų | 17.3 | 2% | 0.021 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -60.7 | -45.8 | 172.7 | -61.2 | 0 | 0 | 0 | 0 | 110.7 | S52 K224 A225 F231 | S52-S228 VanDerWaalsContact CB-O 3.27Å; S52-S228 WeakPolarHBondContact CB-O 3.3Å; S52-S228 PolarHBondContact OG-O 2.98Å; K224-S228 PolarHBondContact O-N 3.11Å; K224-S228 PolarHBondContact O-OG 3.3Å; K224-S228 VanDerWaalsContact O-OG 3.06Å; A225-S228 WeakPolarHBondContact O-CB 3.47Å; A225-S228 PolarHBondContact O-N 2.97Å; S228-F231 WeakPolarHBondContact O-CB 3.4Å; S228-F231 PolarHBondContact O-N 3.42Å |
| 229 | G | 94.4 | Very high | 89.9 | Confident | 0 Ų | 0 | 13.5 Ų | 13.5 | 0% | 0 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -63.9 | -48.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | A225 F226 Y227 F231 S232 Y233 | A225-G229 PolarHBondContact O-N 3.33Å; F226-G229 PolarHBondContact O-N 3.11Å; Y227-G229 VanDerWaalsContact C-N 3.35Å; G229-F231 VanDerWaalsContact C-N 3.25Å; G229-F231 PolarHBondContact O-N 3.14Å; G229-S232 WeakPolarHBondContact O-CA 3.45Å; G229-S232 VanDerWaalsContact O-CB 3.29Å; G229-S232 WeakPolarHBondContact O-CB 3.43Å; G229-S232 PolarHBondContact O-N 3.02Å; G229-Y233 WeakPolarHBondContact O-CD2 3.38Å; G229-Y233 PolarHBondContact O-N 3.04Å |
| 230 | L | 93 | Very high | 89.4 | Confident | 0 Ų | 0 | 11.2 Ų | 11.2 | 0% | 0 | 6% | 0.057 | C | C | . | . | H | α-helix | trans | -62.9 | -29.5 | -179.5 | -74.3 | -177.7 | 0 | 0 | 0 | 113.3 | C73 F76 F226 Y227 S232 Y233 A234 W384 L425 | C73-L230 HydrophobicContact CB-CD2 3.9Å; C73-L230 HydrophobicContact CB-CG 4.38Å; F76-L230 HydrophobicContact CD1-CD1 4Å; F76-L230 HydrophobicContact CD1-CD2 3.57Å; F76-L230 HydrophobicContact CD1-CG 4.44Å; F76-L230 HydrophobicContact CE1-CD1 3.85Å; F76-L230 HydrophobicContact CE1-CD2 4.16Å; F226-L230 HydrophobicContact CD1-CD1 3.48Å; F226-L230 VanDerWaalsContact CD1-CD1 3.48Å; F226-L230 HydrophobicContact CD1-CD2 4.34Å; F226-L230 HydrophobicContact CD1-CG 3.71Å; F226-L230 HydrophobicContact CE1-CD1 3.8Å; F226-L230 HydrophobicContact CE1-CD2 4.06Å; F226-L230 HydrophobicContact CE1-CG 3.95Å; F226-L230 VanDerWaalsContact O-CB 3.25Å; F226-L230 WeakPolarHBondContact O-CB 3.08Å; F226-L230 WeakPolarHBondContact O-CG 3.2Å; F226-L230 PolarHBondContact O-N 3.22Å; Y227-L230 HydrophobicContact CD1-CD1 4.49Å; Y227-L230 PolarHBondContact O-N 3.1Å; L230-S232 PolarHBondContact O-N 2.99Å; L230-Y233 CarbonylContact O-C 3.27Å; L230-Y233 PolarHBondContact O-N 3.23Å; L230-A234 PolarHBondContact O-N 3.09Å; L230-W384 HydrophobicContact CB-CD2 4.39Å; L230-W384 VanDerWaalsContact CB-CE2 3.5Å; L230-W384 HydrophobicContact CB-CH2 4.44Å; L230-W384 HydrophobicContact CB-CZ2 3.57Å; L230-W384 HydrophobicContact CD1-CD2 3.75Å; L230-W384 HydrophobicContact CD1-CE3 4.31Å; L230-W384 HydrophobicContact CD1-CG 3.89Å; L230-W384 HydrophobicContact CD1-CZ2 4.28Å; L230-W384 HydrophobicContact CD2-CH2 4.26Å; L230-W384 HydrophobicContact CD2-CZ2 4.19Å; L230-W384 HydrophobicContact CG-CZ2 4.23Å; L230-W384 WeakPolarHBondContact O-CZ2 3.23Å; L230-L425 HydrophobicContact CD1-CD1 4.34Å |
| 231 | F | 91 | Very high | 88.6 | Confident | 17 Ų | 17 | 12.9 Ų | 12.9 | 8% | 0.075 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -55.4 | -40.1 | 169.5 | 176.9 | -98 | 0 | 0 | 0 | 111.7 | T125 V128 I129 Y227 S228 G229 Y233 A234 M376 L379 | T125-F231 HydrophobicContact CG2-CE2 4.03Å; T125-F231 HydrophobicContact CG2-CZ 4.4Å; V128-F231 HydrophobicContact CB-CE2 4.35Å; V128-F231 HydrophobicContact CB-CZ 4.03Å; V128-F231 HydrophobicContact CG1-CE1 3.91Å; V128-F231 HydrophobicContact CG1-CE2 4.1Å; V128-F231 HydrophobicContact CG1-CZ 3.47Å; V128-F231 VanDerWaalsContact CG1-CZ 3.47Å; I129-F231 HydrophobicContact CG1-CZ 4.27Å; Y227-F231 WeakPolarHBondContact O-CB 3.46Å; Y227-F231 PolarHBondContact O-N 3.43Å; S228-F231 WeakPolarHBondContact O-CB 3.4Å; S228-F231 PolarHBondContact O-N 3.42Å; G229-F231 VanDerWaalsContact C-N 3.25Å; G229-F231 PolarHBondContact O-N 3.14Å; F231-Y233 VanDerWaalsContact C-N 3.31Å; F231-Y233 PolarHBondContact O-N 3.43Å; F231-A234 WeakPolarHBondContact O-CB 3.46Å; F231-A234 PolarHBondContact O-N 3.49Å; F231-M376 HydrophobicContact CD1-CE 3.38Å; F231-M376 HydrophobicContact CD2-CE 4.44Å; F231-M376 HydrophobicContact CE1-CE 3.48Å; F231-M376 VanDerWaalsContact CE1-CE 3.48Å; F231-M376 HydrophobicContact CG-CE 3.9Å; F231-M376 HydrophobicContact CZ-CE 4.08Å; F231-L379 HydrophobicContact CD2-CD2 3.82Å; F231-L379 HydrophobicContact CE2-CD2 3.88Å |
| 232 | S | 92.7 | Very high | 87.7 | Confident | 1 Ų | 1 | 13.5 Ų | 13.5 | 1% | 0.007 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -71.5 | -24.4 | 175.9 | -64.2 | 0 | 0 | 0 | 0 | 114.1 | I44 G48 I49 S52 W70 G229 L230 Y268 | I44-S232 WeakPolarHBondContact CG2-O 3.48Å; G48-S232 WeakPolarHBondContact CA-OG 3.44Å; G48-S232 PolarHBondContact O-OG 3.32Å; I49-S232 PolarHBondContact N-OG 3.42Å; S52-S232 VanDerWaalsContact CB-OG 3.24Å; S52-S232 WeakPolarHBondContact CB-OG 3.46Å; S52-S232 PolarHBondContact OG-OG 3.45Å; W70-S232 WeakPolarHBondContact CH2-OG 3.47Å; G229-S232 WeakPolarHBondContact O-CA 3.45Å; G229-S232 VanDerWaalsContact O-CB 3.29Å; G229-S232 WeakPolarHBondContact O-CB 3.43Å; G229-S232 PolarHBondContact O-N 3.02Å; L230-S232 PolarHBondContact O-N 2.99Å; S232-Y268 VanDerWaalsContact O-CE2 3.25Å; S232-Y268 WeakPolarHBondContact O-CE2 3.3Å; S232-Y268 PolarHBondContact O-OH 3.25Å |
| 233 | Y | 92.5 | Very high | 87.1 | Confident | 1 Ų | 1 | 12 Ų | 12 | 0% | 0.004 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -91 | -1.9 | 177.6 | -76.5 | -83.6 | 0 | 0 | 0 | 113.6 | I44 W70 C73 S77 G229 L230 F231 V264 T265 Y268 | I44-Y233 HydrophobicContact CG2-CD1 4.43Å; W70-Y233 AromaticContact CE3-CE2 3.74Å; W70-Y233 HydrophobicContact CE3-CE2 3.74Å; W70-Y233 HydrophobicContact CZ3-CE2 4.02Å; W70-Y233 PolarHBondContact O-OH 2.98Å; C73-Y233 HydrophobicContact CB-CD2 3.6Å; C73-Y233 HydrophobicContact CB-CE2 3.6Å; S77-Y233 VanDerWaalsContact OG-CB 3.3Å; S77-Y233 WeakPolarHBondContact OG-CB 3.46Å; G229-Y233 WeakPolarHBondContact O-CD2 3.38Å; G229-Y233 PolarHBondContact O-N 3.04Å; L230-Y233 CarbonylContact O-C 3.27Å; L230-Y233 PolarHBondContact O-N 3.23Å; F231-Y233 VanDerWaalsContact C-N 3.31Å; F231-Y233 PolarHBondContact O-N 3.43Å; Y233-V264 HydrophobicContact CD1-CG1 4.08Å; Y233-V264 HydrophobicContact CE1-CG1 3.81Å; Y233-T265 WeakPolarHBondContact CE1-OG1 3.27Å; Y233-T265 VanDerWaalsContact OH-CA 3.28Å; Y233-T265 WeakPolarHBondContact OH-CA 3.24Å; Y233-T265 PolarHBondContact OH-OG1 3.07Å; Y233-Y268 HydrophobicContact CD1-CD2 4.47Å; Y233-Y268 HydrophobicContact CD1-CE2 4.39Å; Y233-Y268 HydrophobicContact CD2-CD2 4.37Å; Y233-Y268 HydrophobicContact CD2-CE2 4.45Å; Y233-Y268 AromaticContact CE1-CD2 3.98Å; Y233-Y268 HydrophobicContact CE1-CD2 3.98Å; Y233-Y268 HydrophobicContact CE1-CE2 4.32Å; Y233-Y268 AromaticContact CE2-CD2 3.86Å; Y233-Y268 HydrophobicContact CE2-CD2 3.86Å; Y233-Y268 HydrophobicContact CE2-CE2 4.38Å; Y233-Y268 HydrophobicContact CG-CE2 4.46Å; Y233-Y268 AromaticContact CZ-CD2 3.66Å |
| 234 | A | 87.6 | Confident | 86.5 | Confident | 20 Ų | 20 | 15.2 Ų | 15.2 | 17% | 0.165 | 8% | 0.076 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -62.6 | 144.8 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | I44 L230 F231 | I44-A234 WeakPolarHBondContact CA-O 3.29Å; L230-A234 PolarHBondContact O-N 3.09Å; F231-A234 WeakPolarHBondContact O-CB 3.46Å; F231-A234 PolarHBondContact O-N 3.49Å |
| 235 | G | 83.4 | Confident | 86 | Confident | 2 Ų | 2 | 14.2 Ų | 14.2 | 2% | 0.021 | 7% | 0.073 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 112.9 | -8.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 115.2 | N237 Y238 | G235-N237 PolarHBondContact O-N 3.48Å; G235-Y238 WeakPolarHBondContact O-CB 3.34Å; G235-Y238 PolarHBondContact O-N 3.15Å; G235-Y238 VanDerWaalsContact O-N 3.12Å |
| 236 | W | 87.7 | Confident | 85.7 | Confident | 1 Ų | 1 | 14.2 Ų | 14.2 | 0% | 0.004 | 7% | 0.073 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -61.3 | -26 | 175.4 | 56.4 | -107.6 | 0 | 0 | 0 | 113.3 | I44 A81 Y84 Y238 W384 I387 | I44-W236 HydrophobicContact CD1-CB 3.77Å; I44-W236 HydrophobicContact CG1-CB 4.22Å; A81-W236 HydrophobicContact CB-CB 4.3Å; A81-W236 HydrophobicContact CB-CD2 3.67Å; A81-W236 HydrophobicContact CB-CE3 3.34Å; A81-W236 HydrophobicContact CB-CG 4.1Å; A81-W236 HydrophobicContact CB-CZ3 3.9Å; Y84-W236 HydrophobicContact CD1-CH2 4.49Å; Y84-W236 AromaticContact CD1-CZ3 3.96Å; Y84-W236 HydrophobicContact CD1-CZ3 3.96Å; Y84-W236 AromaticContact CD2-CH2 3.59Å; Y84-W236 HydrophobicContact CD2-CH2 3.59Å; Y84-W236 AromaticContact CD2-CZ3 3.62Å; Y84-W236 HydrophobicContact CD2-CZ3 3.62Å; Y84-W236 HydrophobicContact CE1-CZ3 4.44Å; Y84-W236 AromaticContact CE2-CH2 3.74Å; Y84-W236 HydrophobicContact CE2-CH2 3.74Å; Y84-W236 HydrophobicContact CE2-CZ3 4.13Å; Y84-W236 AromaticContact CG-CH2 3.99Å; Y84-W236 HydrophobicContact CG-CH2 3.99Å; Y84-W236 AromaticContact CG-CZ3 3.51Å; Y84-W236 HydrophobicContact CG-CZ3 3.51Å; W236-Y238 VanDerWaalsContact C-N 3.32Å; W236-Y238 PolarHBondContact O-N 2.78Å; W236-W384 HydrophobicContact CZ2-CZ3 4.06Å; W236-W384 AromaticContact NE1-CH2 3.74Å; W236-I387 HydrophobicContact CH2-CG2 3.95Å; W236-I387 HydrophobicContact CZ2-CG2 3.98Å |
| 237 | N | 85.3 | Confident | 85.4 | Confident | 6 Ų | 6 | 19.2 Ų | 19.2 | 3% | 0.032 | 9% | 0.094 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -80.5 | -6 | 178.6 | 61.9 | -34.8 | 0 | 0 | 0 | 113.5 | Y84 D97 G235 L239 N240 | Y84-N237 HydrophobicContact CD1-CB 4.1Å; Y84-N237 HydrophobicContact CE1-CB 4.11Å; D97-N237 PolarHBondContact OD1-ND2 3.04Å; D97-N237 PolarHBondContact OD2-ND2 3.5Å; G235-N237 PolarHBondContact O-N 3.48Å; N237-L239 VanDerWaalsContact C-N 3.31Å; N237-L239 PolarHBondContact O-N 3.31Å; N237-N240 VanDerWaalsContact O-CB 3.31Å; N237-N240 WeakPolarHBondContact O-CB 3.49Å; N237-N240 PolarHBondContact O-N 3.41Å |
| 238 | Y | 76.2 | Confident | 85.4 | Confident | 50 Ų | 50 | 22.3 Ų | 22.3 | 20% | 0.196 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -68.1 | -31.3 | -175.7 | -71.2 | 0.8 | 0 | 0 | 0 | 113.3 | R122 G235 W236 N240 C241 | R122-Y238 PolarHBondContact NH1-OH 3.34Å; G235-Y238 WeakPolarHBondContact O-CB 3.34Å; G235-Y238 PolarHBondContact O-N 3.15Å; G235-Y238 VanDerWaalsContact O-N 3.12Å; W236-Y238 VanDerWaalsContact C-N 3.32Å; W236-Y238 PolarHBondContact O-N 2.78Å; Y238-N240 PolarHBondContact O-N 2.86Å; Y238-C241 WeakPolarHBondContact O-CB 3.44Å; Y238-C241 PolarHBondContact O-N 3.47Å |
| 239 | L | 76.9 | Confident | 85.2 | Confident | 0 Ų | 0 | 22.6 Ų | 22.6 | 0% | 0 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -63.6 | -29.7 | 178 | -168 | 64.4 | 0 | 0 | 0 | 111.6 | I40 N237 C241 M242 I243 M246 L253 A256 | I40-L239 HydrophobicContact CD1-CB 3.99Å; I40-L239 HydrophobicContact CD1-CD2 3.55Å; I40-L239 HydrophobicContact CD1-CG 4.4Å; I40-L239 HydrophobicContact CG1-CB 3.92Å; I40-L239 HydrophobicContact CG1-CD2 4.06Å; N237-L239 VanDerWaalsContact C-N 3.31Å; N237-L239 PolarHBondContact O-N 3.31Å; L239-C241 VanDerWaalsContact C-N 3.26Å; L239-C241 PolarHBondContact O-N 3.35Å; L239-M242 CarbonylContact O-C 3.25Å; L239-M242 PolarHBondContact O-N 2.86Å; L239-M242 VanDerWaalsContact O-N 3.09Å; L239-I243 PolarHBondContact O-N 3.28Å; L239-M246 HydrophobicContact CD1-SD 4.05Å; L239-M246 HydrophobicContact CD2-CE 4.04Å; L239-M246 HydrophobicContact CD2-SD 4.06Å; L239-M246 HydrophobicContact CG-CE 4.43Å; L239-M246 HydrophobicContact CG-SD 3.81Å; L239-L253 HydrophobicContact CB-CD1 4.25Å; L239-L253 HydrophobicContact CD2-CD1 3.58Å; L239-L253 HydrophobicContact CG-CD1 3.9Å; L239-A256 HydrophobicContact CD2-CB 4.12Å |
| 240 | N | 82.1 | Confident | 85.1 | Confident | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -62.8 | -30.4 | 173.7 | -74.2 | 86.1 | 0 | 0 | 0 | 113.3 | Y84 Y100 N237 Y238 M242 I243 | Y84-N240 PolarHBondContact O-ND2 3.33Å; Y100-N240 WeakPolarHBondContact OH-CB 3.49Å; Y100-N240 PolarHBondContact OH-ND2 3.12Å; N237-N240 VanDerWaalsContact O-CB 3.31Å; N237-N240 WeakPolarHBondContact O-CB 3.49Å; N237-N240 PolarHBondContact O-N 3.41Å; Y238-N240 PolarHBondContact O-N 2.86Å; N240-M242 PolarHBondContact O-N 2.9Å; N240-I243 WeakPolarHBondContact O-CB 3.45Å |
| 241 | C | 74.2 | Confident | 85.1 | Confident | 37 Ų | 37 | 34.2 Ų | 34.2 | 25% | 0.25 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -71.2 | -21.9 | 176.1 | -63.1 | 0 | 0 | 0 | 0 | 112.6 | Y238 L239 | Y238-C241 WeakPolarHBondContact O-CB 3.44Å; Y238-C241 PolarHBondContact O-N 3.47Å; L239-C241 VanDerWaalsContact C-N 3.26Å; L239-C241 PolarHBondContact O-N 3.35Å |
| 242 | M | 75.3 | Confident | 85.2 | Confident | 32 Ų | 32 | 34 Ų | 34 | 16% | 0.158 | 16% | 0.159 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -108 | 20.6 | -177.8 | -54.1 | -174.3 | 74.4 | 0 | 0 | 111.6 | I31 L239 N240 E244 E245 | I31-M242 HydrophobicContact CD1-CB 4.14Å; I31-M242 HydrophobicContact CD1-CE 3.85Å; I31-M242 HydrophobicContact CD1-SD 4.5Å; L239-M242 CarbonylContact O-C 3.25Å; L239-M242 PolarHBondContact O-N 2.86Å; L239-M242 VanDerWaalsContact O-N 3.09Å; N240-M242 PolarHBondContact O-N 2.9Å; M242-E244 PolarHBondContact O-N 2.77Å; M242-E245 WeakPolarHBondContact CE-OE1 3.15Å; M242-E245 VanDerWaalsContact CE-OE2 3.24Å; M242-E245 WeakPolarHBondContact CE-OE2 3.25Å; M242-E245 WeakPolarHBondContact O-CB 3.38Å; M242-E245 PolarHBondContact O-N 2.91Å |
| 243 | I | 81.1 | Confident | 85.1 | Confident | 3 Ų | 3 | 34 Ų | 34 | 2% | 0.015 | 16% | 0.159 | C | C | . | . | G | 310 helix | trans | -60.6 | -32.5 | -174.4 | -163.9 | 66.8 | 0 | 0 | 0 | 112.9 | L239 N240 E245 M246 P249 L253 | L239-I243 PolarHBondContact O-N 3.28Å; N240-I243 WeakPolarHBondContact O-CB 3.45Å; I243-E245 VanDerWaalsContact C-N 3.29Å; I243-E245 PolarHBondContact O-N 2.88Å; I243-M246 HydrophobicContact CD1-SD 3.7Å; I243-M246 WeakPolarHBondContact O-CB 3.27Å; I243-M246 PolarHBondContact O-N 2.61Å; I243-P249 HydrophobicContact CD1-CB 3.44Å; I243-P249 VanDerWaalsContact CD1-CB 3.44Å; I243-P249 HydrophobicContact CG1-CB 4Å; I243-L253 HydrophobicContact CD1-CD2 3.68Å; I243-L253 HydrophobicContact CD1-CG 4.49Å |
| 244 | E | 79.3 | Confident | 85.1 | Confident | 68 Ų | 68 | 34.7 Ų | 34.7 | 32% | 0.318 | 16% | 0.164 | S | C | . | . | G | 310 helix | trans | -68.9 | -27.5 | 178.3 | -65.6 | -173.7 | -168.3 | 0 | 0 | 112.6 | K29 R93 S94 M242 M246 | K29-E244 WeakPolarHBondContact CG-O 3.38Å; R93-E244 WeakPolarHBondContact CA-OE1 3.43Å; S94-E244 PolarHBondContact N-OE1 3.28Å; S94-E244 PolarHBondContact OG-OE1 3.43Å; S94-E244 PolarHBondContact OG-OE2 3.08Å; M242-E244 PolarHBondContact O-N 2.77Å; E244-M246 VanDerWaalsContact C-N 3.32Å |
| 245 | E | 82.3 | Confident | 85.4 | Confident | 31 Ų | 31 | 37.2 Ų | 37.2 | 15% | 0.145 | 17% | 0.174 | C | C | . | . | G | 310 helix | trans | -83.8 | -7.4 | 178.5 | -60.7 | 172.8 | -126.6 | 0 | 0 | 112.3 | M27 K29 T30 I31 M242 I243 | M27-E245 HydrophobicContact CB-CG 4.1Å; M27-E245 VanDerWaalsContact CE-CD 3.46Å; M27-E245 HydrophobicContact CE-CG 3.63Å; M27-E245 WeakPolarHBondContact CE-OE1 3.45Å; M27-E245 HydrophobicContact SD-CG 4.48Å; K29-E245 CarbonylContact C-O 3.52Å; K29-E245 VanDerWaalsContact CA-O 3.29Å; K29-E245 WeakPolarHBondContact CA-O 3.34Å; T30-E245 PolarHBondContact N-O 2.86Å; I31-E245 HydrophobicContact CD1-CB 3.69Å; I31-E245 HydrophobicContact CG1-CB 4.05Å; I31-E245 PolarHBondContact N-O 2.68Å; M242-E245 WeakPolarHBondContact CE-OE1 3.15Å; M242-E245 VanDerWaalsContact CE-OE2 3.24Å; M242-E245 WeakPolarHBondContact CE-OE2 3.25Å; M242-E245 WeakPolarHBondContact O-CB 3.38Å; M242-E245 PolarHBondContact O-N 2.91Å; I243-E245 VanDerWaalsContact C-N 3.29Å; I243-E245 PolarHBondContact O-N 2.88Å |
| 246 | M | 86.3 | Confident | 85.9 | Confident | 0 Ų | 0 | 37.1 Ų | 37.1 | 0% | 0 | 17% | 0.173 | C | C | . | . | B | Isolated β-bridge | trans | -80 | 134.4 | -179.6 | -65.9 | -174.7 | 68.1 | 0 | 0 | 112.5 | K29 I31 S36 L239 I243 E244 P249 D252 L253 | K29-M246 WeakPolarHBondContact CD-O 3.42Å; I31-M246 HydrophobicContact CB-CG 4.38Å; I31-M246 HydrophobicContact CG2-CG 4.38Å; I31-M246 WeakPolarHBondContact O-CA 3.39Å; S36-M246 WeakPolarHBondContact OG-CE 3.28Å; L239-M246 HydrophobicContact CD1-SD 4.05Å; L239-M246 HydrophobicContact CD2-CE 4.04Å; L239-M246 HydrophobicContact CD2-SD 4.06Å; L239-M246 HydrophobicContact CG-CE 4.43Å; L239-M246 HydrophobicContact CG-SD 3.81Å; I243-M246 HydrophobicContact CD1-SD 3.7Å; I243-M246 WeakPolarHBondContact O-CB 3.27Å; I243-M246 PolarHBondContact O-N 2.61Å; E244-M246 VanDerWaalsContact C-N 3.32Å; M246-P249 HydrophobicContact CB-CB 4.25Å; M246-D252 HydrophobicContact CE-CB 3.95Å; M246-L253 HydrophobicContact CE-CB 4.05Å; M246-L253 HydrophobicContact SD-CB 4.46Å; M246-L253 HydrophobicContact SD-CD1 4.29Å |
| 247 | K | 89.2 | Confident | 86.1 | Confident | 128 Ų | 128 | 37 Ų | 37 | 56% | 0.557 | 17% | 0.173 | S | C | * | . | S | Bend | trans | -63.2 | -51 | 176.9 | -71.1 | -179.7 | 178.6 | 179.5 | 0 | 112.2 | K29 T30 I31 | K29-K247 HydrophobicContact CB-CG 4.32Å; K29-K247 VanDerWaalsContact O-CE 3.23Å; K29-K247 WeakPolarHBondContact O-CE 3.5Å; K29-K247 VanDerWaalsContact O-CG 3.22Å; K29-K247 WeakPolarHBondContact O-CG 3.48Å; T30-K247 WeakPolarHBondContact O-CE 3.41Å; I31-K247 PolarHBondContact O-N 3.24Å |
| 248 | N | 90.4 | Very high | 86.5 | Confident | 68 Ų | 68 | 39 Ų | 39 | 36% | 0.364 | 19% | 0.185 | S | C | . | . | trans | -134 | 78.5 | 178.8 | -170.7 | -7.6 | 0 | 0 | 0 | 111.8 | K250 R251 D252 | N248-K250 PolarHBondContact O-N 2.85Å; N248-R251 PolarHBondContact O-N 2.82Å; N248-R251 PolarHBondContact OD1-N 2.84Å; N248-D252 VanDerWaalsContact O-CB 3.29Å; N248-D252 WeakPolarHBondContact O-CB 3.11Å; N248-D252 PolarHBondContact O-N 3.42Å | ||
| 249 | P | 89.2 | Confident | 87.4 | Confident | 10 Ų | 10 | 41.8 Ų | 41.8 | 7% | 0.065 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -62.3 | -28.7 | -176.1 | 23.7 | -33.6 | 0 | 0 | 0 | 113.5 | I243 M246 R251 L253 | I243-P249 HydrophobicContact CD1-CB 3.44Å; I243-P249 VanDerWaalsContact CD1-CB 3.44Å; I243-P249 HydrophobicContact CG1-CB 4Å; M246-P249 HydrophobicContact CB-CB 4.25Å; P249-R251 PolarHBondContact O-N 2.84Å; P249-L253 WeakPolarHBondContact O-CB 2.9Å; P249-L253 PolarHBondContact O-N 3.38Å |
| 250 | K | 91.2 | Very high | 88.2 | Confident | 112 Ų | 112 | 41.8 Ų | 41.8 | 49% | 0.487 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -65.3 | -39.6 | -179.4 | -61.5 | -171.9 | 170.4 | -164.5 | 0 | 112.5 | N248 P254 P407 V408 | N248-K250 PolarHBondContact O-N 2.85Å; K250-P254 WeakPolarHBondContact O-CD 3.41Å; K250-P254 WeakPolarHBondContact O-CG 3.19Å; K250-P407 HydrophobicContact CB-CB 4.26Å; K250-P407 HydrophobicContact CD-CB 3.56Å; K250-P407 HydrophobicContact CD-CG 4.22Å; K250-P407 VanDerWaalsContact CE-CB 3.44Å; K250-P407 HydrophobicContact CG-CB 3.52Å; K250-P407 HydrophobicContact CG-CG 4.29Å; K250-V408 WeakPolarHBondContact O-CG2 3.47Å |
| 251 | R | 92.8 | Very high | 88.7 | Confident | 132 Ų | 132 | 41.8 Ų | 41.8 | 50% | 0.498 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -93.7 | -48.5 | -178.3 | 179.5 | -175.1 | 172.9 | -82.9 | 0.6 | 111.5 | N248 P249 P254 I255 | N248-R251 PolarHBondContact O-N 2.82Å; N248-R251 PolarHBondContact OD1-N 2.84Å; P249-R251 PolarHBondContact O-N 2.84Å; R251-P254 WeakPolarHBondContact O-CD 3.36Å; R251-P254 WeakPolarHBondContact O-CG 3.45Å; R251-I255 HydrophobicContact CG-CD1 3.85Å; R251-I255 WeakPolarHBondContact O-CD1 3.36Å; R251-I255 VanDerWaalsContact O-CG1 3.28Å; R251-I255 WeakPolarHBondContact O-CG1 3.49Å |
| 252 | D | 93 | Very high | 89.8 | Confident | 12 Ų | 12 | 44.2 Ų | 44.2 | 6% | 0.064 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -78.9 | -32.6 | -164.7 | -63.2 | -12.9 | 0 | 0 | 0 | 111.9 | L33 M246 N248 A256 | L33-D252 HydrophobicContact CB-CB 4.13Å; L33-D252 HydrophobicContact CD1-CB 4.09Å; L33-D252 WeakPolarHBondContact CD1-O 3.43Å; L33-D252 PolarHBondContact N-OD2 2.97Å; M246-D252 HydrophobicContact CE-CB 3.95Å; N248-D252 VanDerWaalsContact O-CB 3.29Å; N248-D252 WeakPolarHBondContact O-CB 3.11Å; N248-D252 PolarHBondContact O-N 3.42Å; D252-A256 WeakPolarHBondContact O-CB 3.49Å; D252-A256 PolarHBondContact O-N 3.44Å |
| 253 | L | 91.4 | Very high | 90.7 | Very high | 0 Ų | 0 | 44.7 Ų | 44.7 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -61.6 | -55.7 | 178.9 | -177.1 | 64.2 | 0 | 0 | 0 | 113.4 | A85 T89 L239 I243 M246 P249 I255 A256 I257 | A85-L253 HydrophobicContact CB-CD2 4Å; A85-L253 HydrophobicContact CB-CG 4.09Å; T89-L253 HydrophobicContact CG2-CD2 4.05Å; L239-L253 HydrophobicContact CB-CD1 4.25Å; L239-L253 HydrophobicContact CD2-CD1 3.58Å; L239-L253 HydrophobicContact CG-CD1 3.9Å; I243-L253 HydrophobicContact CD1-CD2 3.68Å; I243-L253 HydrophobicContact CD1-CG 4.49Å; M246-L253 HydrophobicContact CE-CB 4.05Å; M246-L253 HydrophobicContact SD-CB 4.46Å; M246-L253 HydrophobicContact SD-CD1 4.29Å; P249-L253 WeakPolarHBondContact O-CB 2.9Å; P249-L253 PolarHBondContact O-N 3.38Å; L253-I255 VanDerWaalsContact C-N 3.32Å; L253-I255 PolarHBondContact O-N 2.88Å; L253-A256 PolarHBondContact O-N 3.48Å; L253-I257 HydrophobicContact CD1-CD1 3.66Å; L253-I257 HydrophobicContact CD1-CG1 4.26Å; L253-I257 HydrophobicContact CG-CD1 3.87Å; L253-I257 WeakPolarHBondContact O-CB 3.4Å; L253-I257 WeakPolarHBondContact O-CG1 3.29Å; L253-I257 PolarHBondContact O-N 2.86Å |
| 254 | P | 92.4 | Very high | 91.3 | Very high | 17 Ų | 17 | 44.6 Ų | 44.6 | 11% | 0.11 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -63.7 | -38.5 | -178.6 | 24.3 | -34.4 | 0 | 0 | 0 | 112 | Y82 K250 R251 V258 V408 | Y82-P254 HydrophobicContact CE2-CB 4.11Å; K250-P254 WeakPolarHBondContact O-CD 3.41Å; K250-P254 WeakPolarHBondContact O-CG 3.19Å; R251-P254 WeakPolarHBondContact O-CD 3.36Å; R251-P254 WeakPolarHBondContact O-CG 3.45Å; P254-V258 WeakPolarHBondContact O-CB 3.3Å; P254-V258 VanDerWaalsContact O-CG2 3.27Å; P254-V258 WeakPolarHBondContact O-CG2 3.23Å; P254-V258 PolarHBondContact O-N 3.48Å; P254-V408 HydrophobicContact CB-CG1 4.44Å; P254-V408 HydrophobicContact CG-CG2 4.01Å |
| 255 | I | 94.6 | Very high | 92.2 | Very high | 72 Ų | 72 | 42.2 Ų | 42.2 | 37% | 0.369 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -64.6 | -48 | 177.6 | -62 | 172.8 | 0 | 0 | 0 | 110.1 | L33 R251 L253 I257 V258 F259 | L33-I255 HydrophobicContact CD1-CB 3.98Å; L33-I255 HydrophobicContact CD1-CG2 3.84Å; L33-I255 HydrophobicContact CD2-CG2 4.19Å; R251-I255 HydrophobicContact CG-CD1 3.85Å; R251-I255 WeakPolarHBondContact O-CD1 3.36Å; R251-I255 VanDerWaalsContact O-CG1 3.28Å; R251-I255 WeakPolarHBondContact O-CG1 3.49Å; L253-I255 VanDerWaalsContact C-N 3.32Å; L253-I255 PolarHBondContact O-N 2.88Å; I255-I257 VanDerWaalsContact C-N 3.32Å; I255-I257 PolarHBondContact O-N 2.99Å; I255-V258 PolarHBondContact O-N 3.41Å; I255-F259 VanDerWaalsContact O-CB 3.22Å; I255-F259 WeakPolarHBondContact O-CB 3.21Å; I255-F259 PolarHBondContact O-N 3.32Å |
| 256 | A | 93 | Very high | 92.8 | Very high | 0 Ų | 0 | 45.6 Ų | 45.6 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -60.5 | -43.5 | -179.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | L33 I37 I40 L239 D252 L253 S260 | L33-A256 HydrophobicContact CD1-CB 4.16Å; I37-A256 HydrophobicContact CG1-CB 3.92Å; I40-A256 HydrophobicContact CD1-CB 4.06Å; L239-A256 HydrophobicContact CD2-CB 4.12Å; D252-A256 WeakPolarHBondContact O-CB 3.49Å; D252-A256 PolarHBondContact O-N 3.44Å; L253-A256 PolarHBondContact O-N 3.48Å; A256-S260 WeakPolarHBondContact O-CB 3.33Å; A256-S260 PolarHBondContact O-N 3.46Å; A256-S260 PolarHBondContact O-OG 3.14Å |
| 257 | I | 92 | Very high | 93.3 | Very high | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -63 | -54 | 178.4 | -76.8 | 170.8 | 0 | 0 | 0 | 111.5 | I40 A81 A85 L253 I255 F259 S260 C261 | I40-I257 HydrophobicContact CD1-CG1 3.75Å; A81-I257 HydrophobicContact CB-CB 4.45Å; A81-I257 HydrophobicContact CB-CD1 4.48Å; A81-I257 HydrophobicContact CB-CG2 3.22Å; A85-I257 HydrophobicContact CB-CD1 3.96Å; L253-I257 HydrophobicContact CD1-CD1 3.66Å; L253-I257 HydrophobicContact CD1-CG1 4.26Å; L253-I257 HydrophobicContact CG-CD1 3.87Å; L253-I257 WeakPolarHBondContact O-CB 3.4Å; L253-I257 WeakPolarHBondContact O-CG1 3.29Å; L253-I257 PolarHBondContact O-N 2.86Å; I255-I257 VanDerWaalsContact C-N 3.32Å; I255-I257 PolarHBondContact O-N 2.99Å; I257-F259 PolarHBondContact O-N 3.03Å; I257-S260 PolarHBondContact O-N 2.9Å; I257-C261 WeakPolarHBondContact O-CB 3.37Å; I257-C261 PolarHBondContact O-N 2.89Å; I257-C261 PolarHBondContact O-SG 3.32Å; I257-C261 VanDerWaalsContact O-SG 3.38Å |
| 258 | V | 93.3 | Very high | 93.6 | Very high | 47 Ų | 47 | 40.9 Ų | 40.9 | 29% | 0.285 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -62.3 | -49.2 | -175.2 | 173.1 | 0 | 0 | 0 | 0 | 110.4 | L78 Y82 P254 I255 S260 L262 | L78-V258 HydrophobicContact CD1-CB 4.2Å; L78-V258 HydrophobicContact CD1-CG1 4.3Å; L78-V258 HydrophobicContact CD1-CG2 4.02Å; Y82-V258 HydrophobicContact CD2-CG2 3.75Å; Y82-V258 HydrophobicContact CE2-CG2 3.98Å; P254-V258 WeakPolarHBondContact O-CB 3.3Å; P254-V258 VanDerWaalsContact O-CG2 3.27Å; P254-V258 WeakPolarHBondContact O-CG2 3.23Å; P254-V258 PolarHBondContact O-N 3.48Å; I255-V258 PolarHBondContact O-N 3.41Å; V258-S260 PolarHBondContact O-N 3.23Å; V258-L262 HydrophobicContact CG1-CD1 3.89Å; V258-L262 WeakPolarHBondContact O-CB 3.27Å; V258-L262 VanDerWaalsContact O-CG 3.26Å; V258-L262 WeakPolarHBondContact O-CG 3.4Å; V258-L262 PolarHBondContact O-N 3.29Å; V258-L262 VanDerWaalsContact O-N 3.1Å |
| 259 | F | 95.1 | Very high | 93.9 | Very high | 108 Ų | 108 | 38.7 Ų | 38.7 | 47% | 0.474 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -60.7 | -47.4 | -179.9 | -176.8 | -95.8 | 0 | 0 | 0 | 111.5 | I37 I41 I255 I257 L262 V263 | I37-F259 HydrophobicContact CD1-CD1 3.99Å; I37-F259 HydrophobicContact CD1-CG 4.5Å; I37-F259 HydrophobicContact CG1-CD1 4.23Å; I37-F259 HydrophobicContact CG2-CD1 3.71Å; I37-F259 HydrophobicContact CG2-CE1 3.92Å; I41-F259 HydrophobicContact CD1-CE1 4.47Å; I255-F259 VanDerWaalsContact O-CB 3.22Å; I255-F259 WeakPolarHBondContact O-CB 3.21Å; I255-F259 PolarHBondContact O-N 3.32Å; I257-F259 PolarHBondContact O-N 3.03Å; F259-L262 PolarHBondContact O-N 3.47Å; F259-V263 HydrophobicContact CD1-CG2 4.11Å; F259-V263 HydrophobicContact CE1-CG2 3.73Å; F259-V263 HydrophobicContact CE2-CG2 4.18Å; F259-V263 HydrophobicContact CG-CG2 4.5Å; F259-V263 HydrophobicContact CZ-CG2 3.77Å; F259-V263 WeakPolarHBondContact O-CB 3.29Å; F259-V263 VanDerWaalsContact O-CG2 3.3Å; F259-V263 WeakPolarHBondContact O-CG2 3.48Å; F259-V263 PolarHBondContact O-N 3.44Å |
| 260 | S | 93.1 | Very high | 94.3 | Very high | 0 Ų | 0 | 40.8 Ų | 40.8 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -66 | -45.8 | -177.4 | -55.5 | 0 | 0 | 0 | 0 | 112.1 | A256 I257 V258 L262 V263 V264 | A256-S260 WeakPolarHBondContact O-CB 3.33Å; A256-S260 PolarHBondContact O-N 3.46Å; A256-S260 PolarHBondContact O-OG 3.14Å; I257-S260 PolarHBondContact O-N 2.9Å; V258-S260 PolarHBondContact O-N 3.23Å; S260-L262 VanDerWaalsContact C-N 3.31Å; S260-L262 PolarHBondContact O-N 2.91Å; S260-V263 PolarHBondContact O-N 3.39Å; S260-V264 WeakPolarHBondContact O-CB 3.06Å; S260-V264 WeakPolarHBondContact O-CG2 3.32Å; S260-V264 PolarHBondContact O-N 2.92Å |
| 261 | C | 94 | Very high | 94.5 | Very high | 1 Ų | 1 | 35.5 Ų | 35.5 | 1% | 0.007 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -61.8 | -38.9 | 178.7 | -72.2 | 0 | 0 | 0 | 0 | 112.1 | L78 I257 T265 | L78-C261 HydrophobicContact CB-CB 4.15Å; L78-C261 HydrophobicContact CD1-CB 3.92Å; I257-C261 WeakPolarHBondContact O-CB 3.37Å; I257-C261 PolarHBondContact O-N 2.89Å; I257-C261 PolarHBondContact O-SG 3.32Å; I257-C261 VanDerWaalsContact O-SG 3.38Å; C261-T265 WeakPolarHBondContact O-CB 3.44Å; C261-T265 PolarHBondContact O-N 3.28Å; C261-T265 PolarHBondContact O-OG1 3.37Å |
| 262 | L | 96 | Very high | 94.6 | Very high | 88 Ų | 88 | 29.9 Ų | 29.9 | 46% | 0.461 | 16% | 0.159 | S | C | . | . | H | α-helix | trans | -66.6 | -49 | 176 | -70.8 | 174.5 | 0 | 0 | 0 | 111.7 | L78 V258 F259 S260 V264 T265 I266 | L78-L262 HydrophobicContact CD2-CD2 4.23Å; V258-L262 HydrophobicContact CG1-CD1 3.89Å; V258-L262 WeakPolarHBondContact O-CB 3.27Å; V258-L262 VanDerWaalsContact O-CG 3.26Å; V258-L262 WeakPolarHBondContact O-CG 3.4Å; V258-L262 PolarHBondContact O-N 3.29Å; V258-L262 VanDerWaalsContact O-N 3.1Å; F259-L262 PolarHBondContact O-N 3.47Å; S260-L262 VanDerWaalsContact C-N 3.31Å; S260-L262 PolarHBondContact O-N 2.91Å; L262-V264 VanDerWaalsContact C-N 3.34Å; L262-V264 PolarHBondContact O-N 3.44Å; L262-T265 PolarHBondContact O-N 3.25Å; L262-I266 WeakPolarHBondContact O-CG1 3.44Å; L262-I266 PolarHBondContact O-N 2.95Å |
| 263 | V | 95 | Very high | 94.8 | Very high | 42 Ų | 42 | 30.4 Ų | 30.4 | 26% | 0.255 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -58.6 | -47.3 | 178.4 | 168.9 | 0 | 0 | 0 | 0 | 110.8 | I41 F259 S260 T265 I266 V267 | I41-V263 HydrophobicContact CD1-CB 4.36Å; I41-V263 HydrophobicContact CD1-CG1 4.09Å; F259-V263 HydrophobicContact CD1-CG2 4.11Å; F259-V263 HydrophobicContact CE1-CG2 3.73Å; F259-V263 HydrophobicContact CE2-CG2 4.18Å; F259-V263 HydrophobicContact CG-CG2 4.5Å; F259-V263 HydrophobicContact CZ-CG2 3.77Å; F259-V263 WeakPolarHBondContact O-CB 3.29Å; F259-V263 VanDerWaalsContact O-CG2 3.3Å; F259-V263 WeakPolarHBondContact O-CG2 3.48Å; F259-V263 PolarHBondContact O-N 3.44Å; S260-V263 PolarHBondContact O-N 3.39Å; V263-T265 VanDerWaalsContact C-N 3.3Å; V263-T265 PolarHBondContact O-N 2.94Å; V263-I266 PolarHBondContact O-N 3.44Å; V263-V267 HydrophobicContact CG1-CG2 4.28Å; V263-V267 WeakPolarHBondContact O-CB 3.42Å; V263-V267 VanDerWaalsContact O-CG2 3.29Å; V263-V267 WeakPolarHBondContact O-CG2 3.5Å; V263-V267 PolarHBondContact O-N 2.97Å |
| 264 | V | 94.8 | Very high | 95 | Very high | 0 Ų | 0 | 30.5 Ų | 30.5 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -61.4 | -41.7 | 178.4 | 172.8 | 0 | 0 | 0 | 0 | 111.2 | I44 I45 Y233 S260 L262 I266 V267 Y268 | I44-V264 HydrophobicContact CB-CG1 4.48Å; I44-V264 HydrophobicContact CB-CG2 4.21Å; I44-V264 HydrophobicContact CD1-CG2 4.33Å; I44-V264 HydrophobicContact CG2-CB 4.48Å; I44-V264 HydrophobicContact CG2-CG1 3.68Å; I44-V264 HydrophobicContact CG2-CG2 4.28Å; I45-V264 HydrophobicContact CD1-CG2 4.17Å; I45-V264 HydrophobicContact CG1-CG1 4.42Å; I45-V264 HydrophobicContact CG1-CG2 3.78Å; Y233-V264 HydrophobicContact CD1-CG1 4.08Å; Y233-V264 HydrophobicContact CE1-CG1 3.81Å; S260-V264 WeakPolarHBondContact O-CB 3.06Å; S260-V264 WeakPolarHBondContact O-CG2 3.32Å; S260-V264 PolarHBondContact O-N 2.92Å; L262-V264 VanDerWaalsContact C-N 3.34Å; L262-V264 PolarHBondContact O-N 3.44Å; V264-I266 VanDerWaalsContact C-N 3.32Å; V264-I266 PolarHBondContact O-N 3.47Å; V264-V267 PolarHBondContact O-N 3.15Å; V264-Y268 HydrophobicContact CG1-CD1 4.29Å; V264-Y268 HydrophobicContact CG1-CD2 3.59Å; V264-Y268 HydrophobicContact CG1-CE1 4.11Å; V264-Y268 HydrophobicContact CG1-CE2 3.37Å; V264-Y268 HydrophobicContact CG1-CG 4.07Å; V264-Y268 WeakPolarHBondContact O-CB 3.36Å; V264-Y268 PolarHBondContact O-N 3.36Å |
| 265 | T | 96.5 | Very high | 95.2 | Very high | 18 Ų | 18 | 29.8 Ų | 29.8 | 11% | 0.11 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -62.1 | -42.4 | 178.6 | -57.5 | 0 | 0 | 0 | 0 | 112.1 | G74 Y233 C261 L262 V263 T269 | G74-T265 VanDerWaalsContact CA-OG1 3.29Å; G74-T265 WeakPolarHBondContact CA-OG1 3.47Å; Y233-T265 WeakPolarHBondContact CE1-OG1 3.27Å; Y233-T265 VanDerWaalsContact OH-CA 3.28Å; Y233-T265 WeakPolarHBondContact OH-CA 3.24Å; Y233-T265 PolarHBondContact OH-OG1 3.07Å; C261-T265 WeakPolarHBondContact O-CB 3.44Å; C261-T265 PolarHBondContact O-N 3.28Å; C261-T265 PolarHBondContact O-OG1 3.37Å; L262-T265 PolarHBondContact O-N 3.25Å; V263-T265 VanDerWaalsContact C-N 3.3Å; V263-T265 PolarHBondContact O-N 2.94Å; T265-T269 VanDerWaalsContact O-CB 3.3Å; T265-T269 WeakPolarHBondContact O-CB 3.34Å; T265-T269 PolarHBondContact O-N 3.24Å; T265-T269 PolarHBondContact O-OG1 3.4Å |
| 266 | I | 96.7 | Very high | 95.2 | Very high | 103 Ų | 103 | 27 Ų | 27 | 53% | 0.528 | 14% | 0.144 | S | C | . | . | H | α-helix | trans | -63.1 | -50 | 174.9 | -66.7 | 165.1 | 0 | 0 | 0 | 110 | L262 V263 V264 Y268 T269 L270 | L262-I266 WeakPolarHBondContact O-CG1 3.44Å; L262-I266 PolarHBondContact O-N 2.95Å; V263-I266 PolarHBondContact O-N 3.44Å; V264-I266 VanDerWaalsContact C-N 3.32Å; V264-I266 PolarHBondContact O-N 3.47Å; I266-Y268 PolarHBondContact O-N 2.62Å; I266-T269 PolarHBondContact O-N 3.44Å; I266-L270 HydrophobicContact CG2-CD1 3.64Å; I266-L270 HydrophobicContact CG2-CG 4.17Å; I266-L270 WeakPolarHBondContact O-CB 3.2Å; I266-L270 VanDerWaalsContact O-CG 3.23Å; I266-L270 WeakPolarHBondContact O-CG 3.33Å; I266-L270 PolarHBondContact O-N 2.95Å |
| 267 | V | 95.7 | Very high | 95.3 | Very high | 28 Ų | 28 | 27.4 Ų | 27.4 | 17% | 0.17 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -59 | -46.6 | -179.1 | 168.3 | 0 | 0 | 0 | 0 | 111.6 | I45 L189 I193 V263 V264 L270 A271 | I45-V267 HydrophobicContact CD1-CG1 4.29Å; L189-V267 HydrophobicContact CB-CG1 4.47Å; L189-V267 HydrophobicContact CD1-CG1 4.17Å; I193-V267 HydrophobicContact CD1-CB 4.43Å; I193-V267 HydrophobicContact CD1-CG1 3.97Å; V263-V267 HydrophobicContact CG1-CG2 4.28Å; V263-V267 WeakPolarHBondContact O-CB 3.42Å; V263-V267 VanDerWaalsContact O-CG2 3.29Å; V263-V267 WeakPolarHBondContact O-CG2 3.5Å; V263-V267 PolarHBondContact O-N 2.97Å; V264-V267 PolarHBondContact O-N 3.15Å; V267-L270 PolarHBondContact O-N 3.18Å; V267-A271 VanDerWaalsContact O-CB 3.29Å; V267-A271 WeakPolarHBondContact O-CB 3.33Å; V267-A271 PolarHBondContact O-N 3.16Å |
| 268 | Y | 96.1 | Very high | 95.4 | Very high | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -67 | -42.6 | 179.3 | -72.1 | -8.9 | 0 | 0 | 0 | 112.4 | I44 I45 I49 W70 S232 Y233 V264 I266 A271 N272 | I44-Y268 HydrophobicContact CG2-CE2 4.42Å; I44-Y268 PolarHBondContact O-OH 3.2Å; I45-Y268 WeakPolarHBondContact CA-OH 3.28Å; I45-Y268 HydrophobicContact CG1-CE1 4.31Å; I49-Y268 HydrophobicContact CB-CD1 4.02Å; I49-Y268 HydrophobicContact CB-CE1 3.68Å; I49-Y268 HydrophobicContact CD1-CD1 3.59Å; I49-Y268 HydrophobicContact CD1-CE1 4.15Å; I49-Y268 HydrophobicContact CD1-CG 3.86Å; I49-Y268 HydrophobicContact CG1-CD1 3.73Å; I49-Y268 HydrophobicContact CG1-CE1 3.93Å; I49-Y268 HydrophobicContact CG1-CG 4.49Å; I49-Y268 HydrophobicContact CG2-CE1 4.28Å; W70-Y268 AromaticContact CE3-CD2 3.88Å; W70-Y268 HydrophobicContact CE3-CD2 3.88Å; W70-Y268 HydrophobicContact CE3-CG 4.19Å; W70-Y268 HydrophobicContact CH2-CD2 4.34Å; W70-Y268 AromaticContact CZ3-CD2 3.36Å; W70-Y268 HydrophobicContact CZ3-CD2 3.36Å; W70-Y268 HydrophobicContact CZ3-CE2 4.01Å; W70-Y268 AromaticContact CZ3-CG 3.78Å; W70-Y268 HydrophobicContact CZ3-CG 3.78Å; S232-Y268 VanDerWaalsContact O-CE2 3.25Å; S232-Y268 WeakPolarHBondContact O-CE2 3.3Å; S232-Y268 PolarHBondContact O-OH 3.25Å; Y233-Y268 HydrophobicContact CD1-CD2 4.47Å; Y233-Y268 HydrophobicContact CD1-CE2 4.39Å; Y233-Y268 HydrophobicContact CD2-CD2 4.37Å; Y233-Y268 HydrophobicContact CD2-CE2 4.45Å; Y233-Y268 AromaticContact CE1-CD2 3.98Å; Y233-Y268 HydrophobicContact CE1-CD2 3.98Å; Y233-Y268 HydrophobicContact CE1-CE2 4.32Å; Y233-Y268 AromaticContact CE2-CD2 3.86Å; Y233-Y268 HydrophobicContact CE2-CD2 3.86Å; Y233-Y268 HydrophobicContact CE2-CE2 4.38Å; Y233-Y268 HydrophobicContact CG-CE2 4.46Å; Y233-Y268 AromaticContact CZ-CD2 3.66Å; V264-Y268 HydrophobicContact CG1-CD1 4.29Å; V264-Y268 HydrophobicContact CG1-CD2 3.59Å; V264-Y268 HydrophobicContact CG1-CE1 4.11Å; V264-Y268 HydrophobicContact CG1-CE2 3.37Å; V264-Y268 HydrophobicContact CG1-CG 4.07Å; V264-Y268 WeakPolarHBondContact O-CB 3.36Å; V264-Y268 PolarHBondContact O-N 3.36Å; I266-Y268 PolarHBondContact O-N 2.62Å; Y268-A271 PolarHBondContact O-N 3.38Å; Y268-N272 PolarHBondContact O-N 3.49Å; Y268-N272 PolarHBondContact O-ND2 3.06Å |
| 269 | T | 96.5 | Very high | 95.4 | Very high | 23 Ų | 23 | 26.6 Ų | 26.6 | 14% | 0.141 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -61.6 | -48.2 | 176.5 | -53.8 | 0 | 0 | 0 | 0 | 110.1 | L67 I71 T265 I266 A271 N272 V273 | L67-T269 HydrophobicContact CD2-CG2 4.07Å; I71-T269 HydrophobicContact CD1-CG2 4.36Å; I71-T269 HydrophobicContact CG1-CG2 4.3Å; T265-T269 VanDerWaalsContact O-CB 3.3Å; T265-T269 WeakPolarHBondContact O-CB 3.34Å; T265-T269 PolarHBondContact O-N 3.24Å; T265-T269 PolarHBondContact O-OG1 3.4Å; I266-T269 PolarHBondContact O-N 3.44Å; T269-A271 PolarHBondContact O-N 3.01Å; T269-N272 PolarHBondContact O-N 2.97Å; T269-V273 VanDerWaalsContact O-CG2 3.29Å; T269-V273 WeakPolarHBondContact O-CG2 3.46Å; T269-V273 PolarHBondContact O-N 3.27Å |
| 270 | L | 96.8 | Very high | 95.3 | Very high | 54 Ų | 54 | 23.9 Ų | 23.9 | 28% | 0.283 | 14% | 0.136 | S | C | . | . | H | α-helix | trans | -63.9 | -37.6 | 178.7 | -69.9 | 178 | 0 | 0 | 0 | 112.9 | I193 F197 I266 V267 V273 A274 | I193-L270 HydrophobicContact CD1-CB 4.14Å; I193-L270 HydrophobicContact CG1-CB 4.03Å; I193-L270 HydrophobicContact CG2-CB 4.11Å; I193-L270 HydrophobicContact CG2-CD1 4.2Å; F197-L270 HydrophobicContact CE2-CD1 4.32Å; F197-L270 HydrophobicContact CE2-CD2 4.4Å; F197-L270 HydrophobicContact CZ-CD1 4.32Å; F197-L270 HydrophobicContact CZ-CD2 3.84Å; I266-L270 HydrophobicContact CG2-CD1 3.64Å; I266-L270 HydrophobicContact CG2-CG 4.17Å; I266-L270 WeakPolarHBondContact O-CB 3.2Å; I266-L270 VanDerWaalsContact O-CG 3.23Å; I266-L270 WeakPolarHBondContact O-CG 3.33Å; I266-L270 PolarHBondContact O-N 2.95Å; V267-L270 PolarHBondContact O-N 3.18Å; L270-V273 PolarHBondContact O-N 3.49Å; L270-A274 WeakPolarHBondContact O-CB 3.49Å; L270-A274 PolarHBondContact O-N 3.11Å |
| 271 | A | 96 | Very high | 95.3 | Very high | 0 Ų | 0 | 25.4 Ų | 25.4 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -65.1 | -39.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | I49 L189 I193 V267 Y268 T269 A274 Y275 | I49-A271 HydrophobicContact CD1-CB 4.42Å; I49-A271 HydrophobicContact CG1-CB 4.41Å; L189-A271 HydrophobicContact CD2-CB 4.22Å; I193-A271 HydrophobicContact CG1-CB 4.3Å; V267-A271 VanDerWaalsContact O-CB 3.29Å; V267-A271 WeakPolarHBondContact O-CB 3.33Å; V267-A271 PolarHBondContact O-N 3.16Å; Y268-A271 PolarHBondContact O-N 3.38Å; T269-A271 PolarHBondContact O-N 3.01Å; A271-A274 WeakPolarHBondContact O-CB 3.49Å; A271-A274 PolarHBondContact O-N 3.35Å; A271-Y275 WeakPolarHBondContact O-CD2 3.48Å; A271-Y275 PolarHBondContact O-N 2.93Å |
| 272 | N | 95.8 | Very high | 95.2 | Very high | 14 Ų | 14 | 31.4 Ų | 31.4 | 8% | 0.075 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -69.9 | -38.7 | 175.8 | -77.2 | -90.6 | 0 | 0 | 0 | 112.1 | P53 L67 W70 Y268 T269 A274 Y275 I276 | P53-N272 WeakPolarHBondContact CB-OD1 3.21Å; L67-N272 HydrophobicContact CD2-CB 4.11Å; W70-N272 WeakPolarHBondContact CZ2-ND2 3.39Å; W70-N272 PolarHBondContact NE1-ND2 3.25Å; W70-N272 VanDerWaalsContact NE1-ND2 3.15Å; W70-N272 PolarHBondContact NE1-OD1 3.19Å; Y268-N272 PolarHBondContact O-N 3.49Å; Y268-N272 PolarHBondContact O-ND2 3.06Å; T269-N272 PolarHBondContact O-N 2.97Å; N272-A274 VanDerWaalsContact C-N 3.28Å; N272-A274 PolarHBondContact O-N 3.23Å; N272-Y275 PolarHBondContact O-N 3.44Å; N272-I276 PolarHBondContact O-N 3.28Å |
| 273 | V | 96.3 | Very high | 95.1 | Very high | 24 Ų | 24 | 29.4 Ų | 29.4 | 15% | 0.145 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -59.3 | -41.9 | 170.1 | 172.9 | 0 | 0 | 0 | 0 | 110.4 | F63 L67 I200 F208 T269 L270 I276 T277 | F63-V273 HydrophobicContact CZ-CG2 4.14Å; L67-V273 HydrophobicContact CD1-CG2 4.08Å; L67-V273 HydrophobicContact CD2-CG2 4.05Å; I200-V273 HydrophobicContact CD1-CG1 4.02Å; F208-V273 HydrophobicContact CE1-CG1 4.03Å; F208-V273 HydrophobicContact CZ-CG1 3.81Å; T269-V273 VanDerWaalsContact O-CG2 3.29Å; T269-V273 WeakPolarHBondContact O-CG2 3.46Å; T269-V273 PolarHBondContact O-N 3.27Å; L270-V273 PolarHBondContact O-N 3.49Å; V273-I276 WeakPolarHBondContact O-CG1 3.22Å; V273-T277 WeakPolarHBondContact O-CG2 3.31Å |
| 274 | A | 96.4 | Very high | 95 | Very high | 2 Ų | 2 | 27.7 Ų | 27.7 | 2% | 0.017 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -63.6 | -42.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | I192 L270 A271 N272 I276 T277 F294 | I192-A274 HydrophobicContact CG2-CB 3.78Å; I192-A274 WeakPolarHBondContact O-CB 3.36Å; L270-A274 WeakPolarHBondContact O-CB 3.49Å; L270-A274 PolarHBondContact O-N 3.11Å; A271-A274 WeakPolarHBondContact O-CB 3.49Å; A271-A274 PolarHBondContact O-N 3.35Å; N272-A274 VanDerWaalsContact C-N 3.28Å; N272-A274 PolarHBondContact O-N 3.23Å; A274-I276 VanDerWaalsContact C-N 3.33Å; A274-I276 PolarHBondContact O-N 2.97Å; A274-T277 PolarHBondContact O-N 3.16Å; A274-T277 VanDerWaalsContact O-N 3.15Å; A274-T277 PolarHBondContact O-OG1 2.94Å; A274-F294 WeakPolarHBondContact O-CE2 3.33Å |
| 275 | Y | 95.5 | Very high | 94.9 | Very high | 1 Ų | 1 | 31 Ų | 31 | 0% | 0.004 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -56.3 | -44.9 | -179.4 | -72.5 | -41.7 | 0 | 0 | 0 | 112.9 | P53 I192 A271 N272 T277 V278 V279 V290 A291 F294 | P53-Y275 HydrophobicContact CG-CD2 4.33Å; P53-Y275 HydrophobicContact CG-CE2 3.99Å; I192-Y275 HydrophobicContact CD1-CE1 4Å; I192-Y275 HydrophobicContact CG2-CD1 4.25Å; I192-Y275 HydrophobicContact CG2-CE1 3.96Å; A271-Y275 WeakPolarHBondContact O-CD2 3.48Å; A271-Y275 PolarHBondContact O-N 2.93Å; N272-Y275 PolarHBondContact O-N 3.44Å; Y275-T277 PolarHBondContact O-N 3.35Å; Y275-V278 PolarHBondContact O-N 2.89Å; Y275-V279 PolarHBondContact O-N 3.42Å; Y275-V290 HydrophobicContact CD1-CG1 3.88Å; Y275-V290 HydrophobicContact CD2-CG1 4.14Å; Y275-V290 HydrophobicContact CE1-CG1 4.1Å; Y275-V290 HydrophobicContact CE2-CG1 4.35Å; Y275-V290 HydrophobicContact CG-CG1 3.91Å; Y275-A291 HydrophobicContact CE1-CB 4.2Å; Y275-F294 HydrophobicContact CD1-CB 4.13Å; Y275-F294 AromaticContact CD1-CD2 3.86Å; Y275-F294 HydrophobicContact CD1-CD2 3.86Å; Y275-F294 HydrophobicContact CD1-CG 4.13Å; Y275-F294 HydrophobicContact CE1-CB 4.28Å; Y275-F294 HydrophobicContact CE1-CG 4.4Å |
| 276 | I | 94.5 | Very high | 94.6 | Very high | 14 Ų | 14 | 35.7 Ų | 35.7 | 7% | 0.072 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -71.5 | -15.7 | -177.4 | 63.8 | 139.2 | 0 | 0 | 0 | 114.3 | F63 E207 F208 N272 V273 A274 V278 V279 L281 I284 | F63-I276 HydrophobicContact CD1-CD1 3.66Å; F63-I276 HydrophobicContact CD2-CB 4.32Å; F63-I276 HydrophobicContact CD2-CD1 3.76Å; F63-I276 HydrophobicContact CD2-CG1 4.03Å; F63-I276 HydrophobicContact CD2-CG2 3.56Å; F63-I276 HydrophobicContact CE1-CD1 3.31Å; F63-I276 HydrophobicContact CE1-CG1 4.37Å; F63-I276 HydrophobicContact CE2-CB 4.3Å; F63-I276 HydrophobicContact CE2-CD1 3.39Å; F63-I276 HydrophobicContact CE2-CG1 3.56Å; F63-I276 HydrophobicContact CE2-CG2 3.83Å; F63-I276 HydrophobicContact CG-CD1 3.86Å; F63-I276 HydrophobicContact CG-CG2 4.29Å; F63-I276 HydrophobicContact CZ-CD1 3.13Å; F63-I276 HydrophobicContact CZ-CG1 3.74Å; E207-I276 HydrophobicContact CB-CB 4.37Å; E207-I276 HydrophobicContact CB-CD1 3.82Å; F208-I276 HydrophobicContact CD2-CD1 3.96Å; F208-I276 HydrophobicContact CE1-CD1 4.18Å; F208-I276 HydrophobicContact CE2-CD1 3.54Å; F208-I276 HydrophobicContact CE2-CG1 4.37Å; F208-I276 HydrophobicContact CG-CD1 4.5Å; F208-I276 HydrophobicContact CZ-CD1 3.67Å; F208-I276 HydrophobicContact CZ-CG1 4.38Å; N272-I276 PolarHBondContact O-N 3.28Å; V273-I276 WeakPolarHBondContact O-CG1 3.22Å; A274-I276 VanDerWaalsContact C-N 3.33Å; A274-I276 PolarHBondContact O-N 2.97Å; I276-V278 PolarHBondContact O-N 3.1Å; I276-V279 WeakPolarHBondContact CA-O 3.07Å; I276-L281 HydrophobicContact CG2-CD2 3.81Å; I276-I284 HydrophobicContact CG2-CD1 4.11Å |
| 277 | T | 94.5 | Very high | 94.3 | Very high | 9 Ų | 9 | 31.4 Ų | 31.4 | 6% | 0.055 | 18% | 0.179 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -76.7 | -9.6 | 176.2 | 65 | 0 | 0 | 0 | 0 | 112.6 | I200 H204 F208 V273 A274 Y275 | I200-T277 HydrophobicContact CD1-CG2 4.04Å; I200-T277 HydrophobicContact CG1-CG2 3.52Å; H204-T277 WeakPolarHBondContact CB-O 3.39Å; F208-T277 HydrophobicContact CE2-CG2 3.9Å; F208-T277 HydrophobicContact CZ-CG2 4.06Å; V273-T277 WeakPolarHBondContact O-CG2 3.31Å; A274-T277 PolarHBondContact O-N 3.16Å; A274-T277 VanDerWaalsContact O-N 3.15Å; A274-T277 PolarHBondContact O-OG1 2.94Å; Y275-T277 PolarHBondContact O-N 3.35Å |
| 278 | V | 94.3 | Very high | 93.9 | Very high | 28 Ų | 28 | 32.4 Ų | 32.4 | 17% | 0.17 | 19% | 0.185 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -131.2 | -36.3 | -173.7 | 174.9 | 0 | 0 | 0 | 0 | 112.1 | Q199 Y275 I276 F294 R297 I298 | Q199-V278 HydrophobicContact CB-CG2 4.5Å; Q199-V278 HydrophobicContact CG-CG2 3.77Å; Y275-V278 PolarHBondContact O-N 2.89Å; I276-V278 PolarHBondContact O-N 3.1Å; V278-F294 HydrophobicContact CB-CD2 3.59Å; V278-F294 HydrophobicContact CB-CE2 3.64Å; V278-F294 HydrophobicContact CG1-CD2 3.83Å; V278-F294 HydrophobicContact CG1-CE2 4.18Å; V278-F294 HydrophobicContact CG1-CG 4.36Å; V278-F294 HydrophobicContact CG2-CD2 3.87Å; V278-F294 HydrophobicContact CG2-CE2 3.36Å; V278-F294 HydrophobicContact CG2-CZ 4.03Å; V278-R297 HydrophobicContact CG1-CB 3.57Å; V278-R297 HydrophobicContact CG1-CG 4.14Å; V278-I298 HydrophobicContact CB-CG1 4.38Å; V278-I298 HydrophobicContact CG1-CD1 3.84Å; V278-I298 HydrophobicContact CG1-CG1 3.59Å; V278-I298 HydrophobicContact CG2-CD1 3.9Å; V278-I298 HydrophobicContact CG2-CG1 3.77Å |
| 279 | V | 93.7 | Very high | 93.7 | Very high | 1 Ų | 1 | 32.4 Ų | 32.4 | 1% | 0.006 | 19% | 0.185 | C | C | . | . | S | Bend | trans | -119.5 | 121.6 | -173.9 | -171.7 | 0 | 0 | 0 | 0 | 108.4 | Y275 I276 E283 I284 T293 F294 | Y275-V279 PolarHBondContact O-N 3.42Å; I276-V279 WeakPolarHBondContact CA-O 3.07Å; V279-E283 HydrophobicContact CG1-CB 3.73Å; V279-E283 HydrophobicContact CG1-CG 3.77Å; V279-I284 HydrophobicContact CB-CG1 4.14Å; V279-I284 HydrophobicContact CG1-CG1 3.73Å; V279-T293 HydrophobicContact CG1-CG2 4.03Å; V279-T293 HydrophobicContact CG2-CG2 4.18Å; V279-F294 HydrophobicContact CG2-CB 4Å; V279-F294 HydrophobicContact CG2-CD2 4.37Å |
| 280 | S | 93.2 | Very high | 93.5 | Very high | 51 Ų | 51 | 31.4 Ų | 31.4 | 36% | 0.357 | 18% | 0.179 | S | C | . | . | trans | -63.3 | 156.7 | 178.9 | 68.1 | 0 | 0 | 0 | 0 | 112.2 | N282 E283 I284 | S280-N282 VanDerWaalsContact C-N 3.29Å; S280-N282 PolarHBondContact O-N 3.46Å; S280-E283 PolarHBondContact O-N 2.81Å; S280-E283 WeakPolarHBondContact OG-CB 3.44Å; S280-E283 PolarHBondContact OG-N 3.36Å; S280-I284 WeakPolarHBondContact O-CG1 3.5Å; S280-I284 PolarHBondContact O-N 3.1Å | ||
| 281 | L | 93 | Very high | 93.4 | Very high | 32 Ų | 32 | 28.9 Ų | 28.9 | 17% | 0.168 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -57.7 | -40.5 | -179.7 | -60.9 | -177.3 | 0 | 0 | 0 | 112.9 | L57 F63 I276 E283 I284 L285 | L57-L281 HydrophobicContact CD1-CD2 4.05Å; L57-L281 HydrophobicContact CD2-CB 4.15Å; L57-L281 HydrophobicContact CD2-CD2 3.87Å; F63-L281 HydrophobicContact CB-CD1 4.26Å; F63-L281 HydrophobicContact CB-CD2 4.1Å; I276-L281 HydrophobicContact CG2-CD2 3.81Å; L281-E283 VanDerWaalsContact C-N 3.31Å; L281-E283 PolarHBondContact O-N 2.93Å; L281-I284 PolarHBondContact O-N 3.46Å; L281-L285 WeakPolarHBondContact O-CG 3.36Å; L281-L285 PolarHBondContact O-N 3.35Å |
| 282 | N | 92.3 | Very high | 93.3 | Very high | 128 Ų | 128 | 29 Ų | 29 | 68% | 0.684 | 17% | 0.167 | S | C | * | . | H | α-helix | trans | -63.9 | -36.4 | 176.9 | -73.8 | -33 | 0 | 0 | 0 | 112.6 | S280 L285 T286 | S280-N282 VanDerWaalsContact C-N 3.29Å; S280-N282 PolarHBondContact O-N 3.46Å; N282-L285 PolarHBondContact O-N 3.48Å; N282-T286 WeakPolarHBondContact O-CG2 3.38Å; N282-T286 PolarHBondContact O-N 3.49Å; N282-T286 PolarHBondContact O-OG1 2.9Å |
| 283 | E | 92.5 | Very high | 93.1 | Very high | 46 Ų | 46 | 29.1 Ų | 29.1 | 22% | 0.215 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -72.8 | -36.7 | 178.8 | -168.9 | 174.1 | -166.7 | 0 | 0 | 111.1 | V279 S280 L281 L285 T286 T287 T293 R297 | V279-E283 HydrophobicContact CG1-CB 3.73Å; V279-E283 HydrophobicContact CG1-CG 3.77Å; S280-E283 PolarHBondContact O-N 2.81Å; S280-E283 WeakPolarHBondContact OG-CB 3.44Å; S280-E283 PolarHBondContact OG-N 3.36Å; L281-E283 VanDerWaalsContact C-N 3.31Å; L281-E283 PolarHBondContact O-N 2.93Å; E283-L285 VanDerWaalsContact C-N 3.26Å; E283-L285 PolarHBondContact O-N 3.46Å; E283-T286 WeakPolarHBondContact CA-OG1 3.4Å; E283-T286 PolarHBondContact O-N 3.45Å; E283-T286 PolarHBondContact O-OG1 3.27Å; E283-T287 WeakPolarHBondContact O-CB 3.35Å; E283-T287 WeakPolarHBondContact O-CG2 3.2Å; E283-T287 PolarHBondContact O-N 2.6Å; E283-T293 HydrophobicContact CG-CG2 3.97Å; E283-T293 WeakPolarHBondContact OE1-CG2 3.46Å; E283-R297 IonicContact OE1-CZ 3.88Å; E283-R297 IonicContact OE1-NE 3.57Å; E283-R297 IonicContact OE1-NH2 2.78Å; E283-R297 PolarHBondContact OE1-NH2 3.31Å; E283-R297 IonicContact OE2-NE 3.98Å; E283-R297 IonicContact OE2-NH2 3.57Å |
| 284 | I | 94.2 | Very high | 93.1 | Very high | 6 Ų | 6 | 28 Ų | 28 | 3% | 0.031 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -59.9 | -36.3 | 172.7 | -65.7 | 175.1 | 0 | 0 | 0 | 111.8 | T54 L57 I276 V279 S280 L281 V290 | T54-I284 WeakPolarHBondContact CG2-O 3.5Å; T54-I284 PolarHBondContact OG1-O 3.36Å; L57-I284 HydrophobicContact CD2-CB 3.84Å; L57-I284 HydrophobicContact CD2-CD1 4.41Å; L57-I284 HydrophobicContact CD2-CG2 3.66Å; I276-I284 HydrophobicContact CG2-CD1 4.11Å; V279-I284 HydrophobicContact CB-CG1 4.14Å; V279-I284 HydrophobicContact CG1-CG1 3.73Å; S280-I284 WeakPolarHBondContact O-CG1 3.5Å; S280-I284 PolarHBondContact O-N 3.1Å; L281-I284 PolarHBondContact O-N 3.46Å; I284-V290 HydrophobicContact CG1-CG1 4.16Å; I284-V290 HydrophobicContact CG2-CG2 4.05Å |
| 285 | L | 92.4 | Very high | 93 | Very high | 69 Ų | 69 | 27.9 Ų | 27.9 | 36% | 0.361 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -74.2 | -24.1 | 179.7 | -69.6 | 175.4 | 0 | 0 | 0 | 113.8 | L57 E58 L281 N282 E283 | L57-L285 HydrophobicContact CB-CD2 4.08Å; L57-L285 HydrophobicContact CD2-CD2 4.13Å; L57-L285 HydrophobicContact CD2-CG 4.04Å; L57-L285 HydrophobicContact CG-CD2 3.91Å; L57-L285 HydrophobicContact CG-CG 4.23Å; E58-L285 VanDerWaalsContact CA-CD2 3.47Å; E58-L285 HydrophobicContact CB-CD2 3.8Å; L281-L285 WeakPolarHBondContact O-CG 3.36Å; L281-L285 PolarHBondContact O-N 3.35Å; N282-L285 PolarHBondContact O-N 3.48Å; E283-L285 VanDerWaalsContact C-N 3.26Å; E283-L285 PolarHBondContact O-N 3.46Å |
| 286 | T | 90.3 | Very high | 92.9 | Very high | 116 Ų | 116 | 32 Ų | 32 | 71% | 0.712 | 18% | 0.183 | S | C | * | . | H | α-helix | trans | -103.9 | -28.2 | -173.6 | 49.6 | 0 | 0 | 0 | 0 | 113.1 | N282 E283 | N282-T286 WeakPolarHBondContact O-CG2 3.38Å; N282-T286 PolarHBondContact O-N 3.49Å; N282-T286 PolarHBondContact O-OG1 2.9Å; E283-T286 WeakPolarHBondContact CA-OG1 3.4Å; E283-T286 PolarHBondContact O-N 3.45Å; E283-T286 PolarHBondContact O-OG1 3.27Å |
| 287 | T | 90.8 | Very high | 92.7 | Very high | 14 Ų | 14 | 38.7 Ų | 38.7 | 9% | 0.086 | 21% | 0.207 | C | C | . | . | trans | -76.9 | 132.7 | 179.1 | -173.3 | 0 | 0 | 0 | 0 | 112 | E283 A289 V290 T293 | E283-T287 WeakPolarHBondContact O-CB 3.35Å; E283-T287 WeakPolarHBondContact O-CG2 3.2Å; E283-T287 PolarHBondContact O-N 2.6Å; T287-A289 PolarHBondContact O-N 3.23Å; T287-A289 PolarHBondContact OG1-N 3.48Å; T287-V290 HydrophobicContact CG2-CB 4.24Å; T287-V290 HydrophobicContact CG2-CG2 3.73Å; T287-T293 WeakPolarHBondContact CB-OG1 3.33Å; T287-T293 PolarHBondContact OG1-OG1 2.92Å | ||
| 288 | P | 86.1 | Confident | 92.7 | Very high | 48 Ų | 48 | 41 Ų | 41 | 31% | 0.312 | 22% | 0.219 | S | C | . | . | S | Bend | trans | -75.3 | -10.3 | 174.2 | 33.3 | -37.4 | 0 | 0 | 0 | 113 | K135 | K135-P288 HydrophobicContact CD-CB 4.25Š|
| 289 | A | 91.9 | Very high | 92.6 | Very high | 0 Ų | 0 | 41.9 Ų | 41.9 | 0% | 0 | 22% | 0.219 | C | C | . | . | trans | -145.5 | 77.3 | -174.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | Y136 Q139 T287 A291 V292 T293 | Y136-A289 HydrophobicContact CD1-CB 3.9Å; Y136-A289 HydrophobicContact CD2-CB 3.95Å; Y136-A289 HydrophobicContact CE1-CB 3.77Å; Y136-A289 HydrophobicContact CE2-CB 3.83Å; Y136-A289 HydrophobicContact CG-CB 4Å; Q139-A289 HydrophobicContact CB-CB 4Å; Q139-A289 HydrophobicContact CG-CB 4Å; T287-A289 PolarHBondContact O-N 3.23Å; T287-A289 PolarHBondContact OG1-N 3.48Å; A289-A291 VanDerWaalsContact C-N 3.3Å; A289-A291 PolarHBondContact O-N 3.07Å; A289-V292 HydrophobicContact CB-CB 4.16Å; A289-V292 HydrophobicContact CB-CG2 3.94Å; A289-V292 WeakPolarHBondContact O-CB 3.47Å; A289-V292 PolarHBondContact O-N 2.85Å; A289-T293 PolarHBondContact O-N 2.71Å | ||
| 290 | V | 93.7 | Very high | 92.5 | Very high | 3 Ų | 3 | 43.7 Ų | 43.7 | 2% | 0.018 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -52 | -43.6 | -173.6 | -178.1 | 0 | 0 | 0 | 0 | 113 | T54 Y136 Y275 I284 T287 V292 T293 F294 | T54-V290 WeakPolarHBondContact OG1-CG2 3.46Å; Y136-V290 PolarHBondContact OH-N 3.37Å; Y275-V290 HydrophobicContact CD1-CG1 3.88Å; Y275-V290 HydrophobicContact CD2-CG1 4.14Å; Y275-V290 HydrophobicContact CE1-CG1 4.1Å; Y275-V290 HydrophobicContact CE2-CG1 4.35Å; Y275-V290 HydrophobicContact CG-CG1 3.91Å; I284-V290 HydrophobicContact CG1-CG1 4.16Å; I284-V290 HydrophobicContact CG2-CG2 4.05Å; T287-V290 HydrophobicContact CG2-CB 4.24Å; T287-V290 HydrophobicContact CG2-CG2 3.73Å; V290-V292 VanDerWaalsContact C-N 3.31Å; V290-V292 PolarHBondContact O-N 3.41Å; V290-T293 WeakPolarHBondContact O-CB 3.12Å; V290-T293 PolarHBondContact O-N 2.93Å; V290-F294 WeakPolarHBondContact O-CB 3.26Å; V290-F294 PolarHBondContact O-N 2.99Å |
| 291 | A | 94 | Very high | 92.3 | Very high | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -66.8 | -32.3 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | F50 Y136 I192 Y275 A289 F294 A295 M306 V310 | F50-A291 HydrophobicContact CD1-CB 3.89Å; F50-A291 HydrophobicContact CE1-CB 4.08Å; Y136-A291 HydrophobicContact CE1-CB 4.06Å; I192-A291 HydrophobicContact CD1-CB 4.19Å; Y275-A291 HydrophobicContact CE1-CB 4.2Å; A289-A291 VanDerWaalsContact C-N 3.3Å; A289-A291 PolarHBondContact O-N 3.07Å; A291-F294 PolarHBondContact O-N 2.81Å; A291-A295 WeakPolarHBondContact O-CB 3.46Å; A291-A295 PolarHBondContact O-N 2.96Å; A291-M306 HydrophobicContact CB-CG 3.93Å; A291-M306 HydrophobicContact CB-SD 4.19Å; A291-M306 WeakPolarHBondContact O-CG 3.37Å; A291-V310 HydrophobicContact CB-CG2 4.32Å |
| 292 | V | 93.5 | Very high | 92.2 | Very high | 4 Ų | 4 | 47.4 Ų | 47.4 | 2% | 0.024 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -69.4 | -43.2 | 175.9 | -178.3 | 0 | 0 | 0 | 0 | 109.8 | Y136 Q139 A289 V290 F294 A295 N296 W303 P307 | Y136-V292 HydrophobicContact CD1-CG2 3.6Å; Y136-V292 HydrophobicContact CE1-CG2 3.86Å; Q139-V292 HydrophobicContact CB-CG1 4.42Å; Q139-V292 HydrophobicContact CG-CB 4.21Å; Q139-V292 HydrophobicContact CG-CG1 3.97Å; A289-V292 HydrophobicContact CB-CB 4.16Å; A289-V292 HydrophobicContact CB-CG2 3.94Å; A289-V292 WeakPolarHBondContact O-CB 3.47Å; A289-V292 PolarHBondContact O-N 2.85Å; V290-V292 VanDerWaalsContact C-N 3.31Å; V290-V292 PolarHBondContact O-N 3.41Å; V292-F294 PolarHBondContact O-N 3.18Å; V292-A295 PolarHBondContact O-N 2.9Å; V292-N296 WeakPolarHBondContact O-CB 3.25Å; V292-N296 PolarHBondContact O-N 2.92Å; V292-W303 HydrophobicContact CG1-CE3 3.96Å; V292-W303 HydrophobicContact CG1-CZ3 3.78Å; V292-P307 HydrophobicContact CG2-CB 3.81Å; V292-P307 HydrophobicContact CG2-CG 4.33Å |
| 293 | T | 93.1 | Very high | 92.1 | Very high | 15 Ų | 15 | 44.3 Ų | 44.3 | 9% | 0.092 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -58.4 | -47.9 | 173.7 | -58.8 | 0 | 0 | 0 | 0 | 111.2 | V279 E283 T287 A289 V290 A295 N296 R297 | V279-T293 HydrophobicContact CG1-CG2 4.03Å; V279-T293 HydrophobicContact CG2-CG2 4.18Å; E283-T293 HydrophobicContact CG-CG2 3.97Å; E283-T293 WeakPolarHBondContact OE1-CG2 3.46Å; T287-T293 WeakPolarHBondContact CB-OG1 3.33Å; T287-T293 PolarHBondContact OG1-OG1 2.92Å; A289-T293 PolarHBondContact O-N 2.71Å; V290-T293 WeakPolarHBondContact O-CB 3.12Å; V290-T293 PolarHBondContact O-N 2.93Å; T293-A295 VanDerWaalsContact C-N 3.34Å; T293-A295 PolarHBondContact O-N 3.34Å; T293-N296 PolarHBondContact O-N 2.85Å; T293-R297 WeakPolarHBondContact O-CG 3.48Å; T293-R297 PolarHBondContact O-N 2.78Å |
| 294 | F | 94.8 | Very high | 91.9 | Very high | 0 Ų | 0 | 49 Ų | 49 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -54.4 | -48.6 | 174.6 | 178.2 | -85.2 | 0 | 0 | 0 | 112.1 | I192 T195 A274 Y275 V278 V279 V290 A291 V292 N296 R297 I298 | I192-F294 HydrophobicContact CB-CE1 4.41Å; I192-F294 HydrophobicContact CG1-CD1 4.26Å; I192-F294 HydrophobicContact CG1-CE1 4.18Å; I192-F294 HydrophobicContact CG2-CE1 4.4Å; I192-F294 HydrophobicContact CG2-CZ 4.28Å; T195-F294 HydrophobicContact CG2-CE1 3.88Å; T195-F294 HydrophobicContact CG2-CZ 3.59Å; A274-F294 WeakPolarHBondContact O-CE2 3.33Å; Y275-F294 HydrophobicContact CD1-CB 4.13Å; Y275-F294 AromaticContact CD1-CD2 3.86Å; Y275-F294 HydrophobicContact CD1-CD2 3.86Å; Y275-F294 HydrophobicContact CD1-CG 4.13Å; Y275-F294 HydrophobicContact CE1-CB 4.28Å; Y275-F294 HydrophobicContact CE1-CG 4.4Å; V278-F294 HydrophobicContact CB-CD2 3.59Å; V278-F294 HydrophobicContact CB-CE2 3.64Å; V278-F294 HydrophobicContact CG1-CD2 3.83Å; V278-F294 HydrophobicContact CG1-CE2 4.18Å; V278-F294 HydrophobicContact CG1-CG 4.36Å; V278-F294 HydrophobicContact CG2-CD2 3.87Å; V278-F294 HydrophobicContact CG2-CE2 3.36Å; V278-F294 HydrophobicContact CG2-CZ 4.03Å; V279-F294 HydrophobicContact CG2-CB 4Å; V279-F294 HydrophobicContact CG2-CD2 4.37Å; V290-F294 WeakPolarHBondContact O-CB 3.26Å; V290-F294 PolarHBondContact O-N 2.99Å; A291-F294 PolarHBondContact O-N 2.81Å; V292-F294 PolarHBondContact O-N 3.18Å; F294-N296 PolarHBondContact O-N 2.94Å; F294-R297 PolarHBondContact O-N 3.47Å; F294-I298 PolarHBondContact O-N 3.07Å |
| 295 | A | 94.4 | Very high | 91.7 | Very high | 0 Ų | 0 | 51.3 Ų | 51.3 | 0% | 0 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -65.5 | -37.7 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | A291 V292 T293 R297 I298 Y299 W303 M306 | A291-A295 WeakPolarHBondContact O-CB 3.46Å; A291-A295 PolarHBondContact O-N 2.96Å; V292-A295 PolarHBondContact O-N 2.9Å; T293-A295 VanDerWaalsContact C-N 3.34Å; T293-A295 PolarHBondContact O-N 3.34Å; A295-R297 VanDerWaalsContact C-N 3.29Å; A295-R297 PolarHBondContact O-N 3.32Å; A295-I298 PolarHBondContact O-N 3.2Å; A295-Y299 HydrophobicContact CB-CD2 3.77Å; A295-Y299 HydrophobicContact CB-CE2 4.23Å; A295-Y299 WeakPolarHBondContact O-CB 3.2Å; A295-Y299 PolarHBondContact O-N 3.14Å; A295-W303 HydrophobicContact CB-CB 4.27Å; A295-W303 WeakPolarHBondContact O-CB 3.36Å; A295-M306 HydrophobicContact CB-CB 3.46Å; A295-M306 VanDerWaalsContact CB-CB 3.46Å; A295-M306 HydrophobicContact CB-CE 4.36Å; A295-M306 HydrophobicContact CB-CG 3.89Å |
| 296 | N | 92.9 | Very high | 91.7 | Very high | 88 Ų | 88 | 48.2 Ų | 48.2 | 47% | 0.471 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -62.2 | -37.9 | 178.2 | -166.4 | -4.2 | 0 | 0 | 0 | 111.6 | V292 T293 F294 W303 | V292-N296 WeakPolarHBondContact O-CB 3.25Å; V292-N296 PolarHBondContact O-N 2.92Å; T293-N296 PolarHBondContact O-N 2.85Å; F294-N296 PolarHBondContact O-N 2.94Å; N296-W303 HydrophobicContact CB-CB 4.35Å; N296-W303 HydrophobicContact CB-CG 4.47Å |
| 297 | R | 92.1 | Very high | 91.8 | Very high | 154 Ų | 154 | 43 Ų | 43 | 58% | 0.581 | 22% | 0.224 | S | C | * | . | H | α-helix | trans | -70.1 | -33.5 | 178.9 | -63.2 | -68.1 | -177.4 | -174.4 | -1.3 | 113.6 | V278 E283 T293 F294 A295 | V278-R297 HydrophobicContact CG1-CB 3.57Å; V278-R297 HydrophobicContact CG1-CG 4.14Å; E283-R297 IonicContact OE1-CZ 3.88Å; E283-R297 IonicContact OE1-NE 3.57Å; E283-R297 IonicContact OE1-NH2 2.78Å; E283-R297 PolarHBondContact OE1-NH2 3.31Å; E283-R297 IonicContact OE2-NE 3.98Å; E283-R297 IonicContact OE2-NH2 3.57Å; T293-R297 WeakPolarHBondContact O-CG 3.48Å; T293-R297 PolarHBondContact O-N 2.78Å; F294-R297 PolarHBondContact O-N 3.47Å; A295-R297 VanDerWaalsContact C-N 3.29Å; A295-R297 PolarHBondContact O-N 3.32Å |
| 298 | I | 94.3 | Very high | 91.9 | Very high | 59 Ų | 59 | 45.5 Ų | 45.5 | 30% | 0.303 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -110.2 | -42 | -169 | -57.7 | -53.3 | 0 | 0 | 0 | 114.6 | T195 V278 F294 A295 G300 | T195-I298 HydrophobicContact CG2-CB 4.26Å; T195-I298 HydrophobicContact CG2-CG1 4.19Å; T195-I298 HydrophobicContact CG2-CG2 3.63Å; V278-I298 HydrophobicContact CB-CG1 4.38Å; V278-I298 HydrophobicContact CG1-CD1 3.84Å; V278-I298 HydrophobicContact CG1-CG1 3.59Å; V278-I298 HydrophobicContact CG2-CD1 3.9Å; V278-I298 HydrophobicContact CG2-CG1 3.77Å; F294-I298 PolarHBondContact O-N 3.07Å; A295-I298 PolarHBondContact O-N 3.2Å; I298-G300 VanDerWaalsContact C-N 3.27Å; I298-G300 PolarHBondContact O-N 2.72Å |
| 299 | Y | 92.5 | Very high | 92.1 | Very high | 46 Ų | 46 | 45.2 Ų | 45.2 | 18% | 0.18 | 23% | 0.23 | C | C | . | . | S | Bend | trans | -87.7 | 5 | -167.6 | -60.6 | -33.9 | 0 | 0 | 0 | 114.1 | M191 T195 A295 A302 M306 | M191-Y299 HydrophobicContact CE-CD2 4.23Å; M191-Y299 HydrophobicContact CE-CE2 3.68Å; M191-Y299 PolarHBondContact O-OH 3.15Å; M191-Y299 VanDerWaalsContact O-OH 3.11Å; T195-Y299 HydrophobicContact CG2-CE1 4.18Å; T195-Y299 WeakPolarHBondContact OG1-CE1 3.32Å; T195-Y299 PolarHBondContact OG1-OH 2.71Å; A295-Y299 HydrophobicContact CB-CD2 3.77Å; A295-Y299 HydrophobicContact CB-CE2 4.23Å; A295-Y299 WeakPolarHBondContact O-CB 3.2Å; A295-Y299 PolarHBondContact O-N 3.14Å; Y299-A302 WeakPolarHBondContact O-CB 3.07Å; Y299-A302 PolarHBondContact O-N 3.03Å; Y299-M306 HydrophobicContact CE2-CE 3.91Å |
| 300 | G | 90.1 | Very high | 92.1 | Very high | 38 Ų | 38 | 45.2 Ų | 45.2 | 39% | 0.392 | 23% | 0.23 | S | C | . | . | G | 310 helix | trans | 50.4 | -130 | -179.5 | 0 | 0 | 0 | 0 | 0 | 110.2 | I298 A302 W303 | I298-G300 VanDerWaalsContact C-N 3.27Å; I298-G300 PolarHBondContact O-N 2.72Å; G300-A302 PolarHBondContact O-N 3.27Å; G300-W303 PolarHBondContact O-N 3.33Å; G300-W303 VanDerWaalsContact O-N 3.15Å |
| 301 | P | 89.6 | Confident | 91.9 | Very high | 120 Ų | 120 | 45.4 Ų | 45.4 | 78% | 0.779 | 23% | 0.232 | S | C | * | . | G | 310 helix | trans | -59 | -18.2 | -178.9 | -22.7 | 33 | 0 | 0 | 0 | 115.6 | W303 W304 | P301-W303 VanDerWaalsContact C-N 3.31Å; P301-W304 PolarHBondContact O-NE1 3.06Å |
| 302 | A | 90.3 | Very high | 91.7 | Very high | 41 Ų | 41 | 49.6 Ų | 49.6 | 34% | 0.339 | 25% | 0.25 | S | S | . | . | G | 310 helix | trans | -86.3 | 3.5 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | Y299 G300 W304 I305 | Y299-A302 WeakPolarHBondContact O-CB 3.07Å; Y299-A302 PolarHBondContact O-N 3.03Å; G300-A302 PolarHBondContact O-N 3.27Å; A302-W304 PolarHBondContact O-N 3.23Å; A302-W304 VanDerWaalsContact O-N 3.16Å; A302-I305 HydrophobicContact CB-CD1 4.07Å; A302-I305 WeakPolarHBondContact O-CB 3.45Å; A302-I305 WeakPolarHBondContact O-CG1 3.43Å; A302-I305 PolarHBondContact O-N 2.84Å; A302-I305 VanDerWaalsContact O-N 3.16Å |
| 303 | W | 90.5 | Very high | 91.5 | Very high | 64 Ų | 64 | 49.5 Ų | 49.5 | 24% | 0.242 | 25% | 0.25 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -57.9 | -31.3 | -176.9 | 73.7 | -100.4 | 0 | 0 | 0 | 114 | P140 V292 A295 N296 G300 P301 I305 M306 P307 | P140-W303 HydrophobicContact CB-CH2 3.65Å; P140-W303 HydrophobicContact CB-CZ3 3.99Å; P140-W303 HydrophobicContact CG-CH2 4.09Å; P140-W303 HydrophobicContact CG-CZ3 3.88Å; V292-W303 HydrophobicContact CG1-CE3 3.96Å; V292-W303 HydrophobicContact CG1-CZ3 3.78Å; A295-W303 HydrophobicContact CB-CB 4.27Å; A295-W303 WeakPolarHBondContact O-CB 3.36Å; N296-W303 HydrophobicContact CB-CB 4.35Å; N296-W303 HydrophobicContact CB-CG 4.47Å; G300-W303 PolarHBondContact O-N 3.33Å; G300-W303 VanDerWaalsContact O-N 3.15Å; P301-W303 VanDerWaalsContact C-N 3.31Å; W303-I305 PolarHBondContact O-N 3.32Å; W303-I305 VanDerWaalsContact O-N 3.14Å; W303-M306 PolarHBondContact O-N 3.13Å; W303-M306 VanDerWaalsContact O-N 3.15Å; W303-P307 VanDerWaalsContact O-CD 3.3Å; W303-P307 WeakPolarHBondContact O-CD 3.46Å |
| 304 | W | 88.5 | Confident | 91.4 | Very high | 145 Ų | 145 | 48.8 Ų | 48.8 | 55% | 0.549 | 25% | 0.245 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -66.4 | -12.7 | -178.8 | 66.7 | -91.6 | 0 | 0 | 0 | 113.9 | P301 A302 M306 P307 I308 | P301-W304 PolarHBondContact O-NE1 3.06Å; A302-W304 PolarHBondContact O-N 3.23Å; A302-W304 VanDerWaalsContact O-N 3.16Å; W304-M306 VanDerWaalsContact C-N 3.32Å; W304-P307 VanDerWaalsContact O-CD 3.29Å; W304-P307 WeakPolarHBondContact O-CD 3.4Å; W304-P307 VanDerWaalsContact O-CG 3.24Å; W304-P307 WeakPolarHBondContact O-CG 3.38Å; W304-I308 HydrophobicContact CE3-CD1 3.47Å; W304-I308 VanDerWaalsContact CE3-CD1 3.47Å; W304-I308 HydrophobicContact CZ3-CD1 3.44Å; W304-I308 VanDerWaalsContact CZ3-CD1 3.44Å |
| 305 | I | 90.6 | Very high | 91.1 | Very high | 54 Ų | 54 | 50.4 Ų | 50.4 | 28% | 0.277 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -67.6 | -36.4 | 173.9 | -62 | 175 | 0 | 0 | 0 | 110.7 | A302 W303 I308 F309 | A302-I305 HydrophobicContact CB-CD1 4.07Å; A302-I305 WeakPolarHBondContact O-CB 3.45Å; A302-I305 WeakPolarHBondContact O-CG1 3.43Å; A302-I305 PolarHBondContact O-N 2.84Å; A302-I305 VanDerWaalsContact O-N 3.16Å; W303-I305 PolarHBondContact O-N 3.32Å; W303-I305 VanDerWaalsContact O-N 3.14Å; I305-I308 PolarHBondContact O-N 2.99Å; I305-F309 HydrophobicContact CG2-CD1 4.04Å; I305-F309 HydrophobicContact CG2-CD2 3.88Å; I305-F309 HydrophobicContact CG2-CE1 3.64Å; I305-F309 HydrophobicContact CG2-CE2 3.45Å; I305-F309 VanDerWaalsContact CG2-CE2 3.45Å; I305-F309 HydrophobicContact CG2-CG 4.18Å; I305-F309 HydrophobicContact CG2-CZ 3.33Å; I305-F309 PolarHBondContact O-N 2.94Å |
| 306 | M | 92.3 | Very high | 90.6 | Very high | 4 Ų | 4 | 50.5 Ų | 50.5 | 2% | 0.02 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -62 | -49.7 | -176.5 | -169 | 60.3 | 70.5 | 0 | 0 | 114.2 | A188 I192 A291 A295 Y299 W303 W304 I308 F309 V310 | A188-M306 HydrophobicContact CB-SD 4.29Å; I192-M306 HydrophobicContact CD1-CE 4.17Å; I192-M306 HydrophobicContact CD1-SD 4.27Å; I192-M306 HydrophobicContact CG1-CE 3.87Å; A291-M306 HydrophobicContact CB-CG 3.93Å; A291-M306 HydrophobicContact CB-SD 4.19Å; A291-M306 WeakPolarHBondContact O-CG 3.37Å; A295-M306 HydrophobicContact CB-CB 3.46Å; A295-M306 VanDerWaalsContact CB-CB 3.46Å; A295-M306 HydrophobicContact CB-CE 4.36Å; A295-M306 HydrophobicContact CB-CG 3.89Å; Y299-M306 HydrophobicContact CE2-CE 3.91Å; W303-M306 PolarHBondContact O-N 3.13Å; W303-M306 VanDerWaalsContact O-N 3.15Å; W304-M306 VanDerWaalsContact C-N 3.32Å; M306-I308 PolarHBondContact O-N 3.49Å; M306-F309 PolarHBondContact O-N 3.4Å; M306-F309 VanDerWaalsContact O-N 3.15Å; M306-V310 HydrophobicContact CG-CG2 4.48Å; M306-V310 WeakPolarHBondContact O-CG2 3.34Å; M306-V310 PolarHBondContact O-N 2.81Å; M306-V310 HydrophobicContact SD-CG2 4.32Å |
| 307 | P | 92.6 | Very high | 90.3 | Very high | 6 Ų | 6 | 47.2 Ų | 47.2 | 4% | 0.039 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -59.6 | -34.3 | 176.4 | 21.8 | -32.7 | 0 | 0 | 0 | 112.4 | Y136 P140 V292 W303 W304 A311 | Y136-P307 WeakPolarHBondContact O-CB 3.2Å; P140-P307 HydrophobicContact CG-CB 3.91Å; P140-P307 HydrophobicContact CG-CG 3.7Å; V292-P307 HydrophobicContact CG2-CB 3.81Å; V292-P307 HydrophobicContact CG2-CG 4.33Å; W303-P307 VanDerWaalsContact O-CD 3.3Å; W303-P307 WeakPolarHBondContact O-CD 3.46Å; W304-P307 VanDerWaalsContact O-CD 3.29Å; W304-P307 WeakPolarHBondContact O-CD 3.4Å; W304-P307 VanDerWaalsContact O-CG 3.24Å; W304-P307 WeakPolarHBondContact O-CG 3.38Å; P307-A311 WeakPolarHBondContact O-CB 3.29Å; P307-A311 PolarHBondContact O-N 3.47Å |
| 308 | I | 91.1 | Very high | 90.1 | Very high | 66 Ų | 66 | 39.9 Ų | 39.9 | 34% | 0.338 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -65.6 | -45.4 | 175.4 | -64.8 | 176.7 | 0 | 0 | 0 | 110.9 | W304 I305 M306 V310 A311 F312 | W304-I308 HydrophobicContact CE3-CD1 3.47Å; W304-I308 VanDerWaalsContact CE3-CD1 3.47Å; W304-I308 HydrophobicContact CZ3-CD1 3.44Å; W304-I308 VanDerWaalsContact CZ3-CD1 3.44Å; I305-I308 PolarHBondContact O-N 2.99Å; M306-I308 PolarHBondContact O-N 3.49Å; I308-V310 PolarHBondContact O-N 2.8Å; I308-A311 PolarHBondContact O-N 3.3Å; I308-F312 HydrophobicContact CG2-CD2 3.93Å; I308-F312 HydrophobicContact CG2-CE2 3.56Å; I308-F312 HydrophobicContact CG2-CZ 4.01Å; I308-F312 PolarHBondContact O-N 3.32Å |
| 309 | F | 91.1 | Very high | 89.8 | Confident | 43 Ų | 43 | 37.1 Ų | 37.1 | 19% | 0.189 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -63.2 | -41.9 | 178.8 | -73 | -3.9 | 0 | 0 | 0 | 112.5 | T184 I187 A188 M191 I305 M306 F312 S313 | T184-F309 HydrophobicContact CG2-CB 3.74Å; T184-F309 HydrophobicContact CG2-CD1 3.34Å; T184-F309 HydrophobicContact CG2-CE1 4.02Å; T184-F309 HydrophobicContact CG2-CG 3.63Å; I187-F309 HydrophobicContact CG2-CE2 3.94Å; I187-F309 HydrophobicContact CG2-CZ 4.45Å; A188-F309 HydrophobicContact CB-CB 3.89Å; A188-F309 HydrophobicContact CB-CD2 3.96Å; A188-F309 HydrophobicContact CB-CG 4.39Å; M191-F309 HydrophobicContact SD-CD2 4.4Å; M191-F309 HydrophobicContact SD-CE2 3.82Å; I305-F309 HydrophobicContact CG2-CD1 4.04Å; I305-F309 HydrophobicContact CG2-CD2 3.88Å; I305-F309 HydrophobicContact CG2-CE1 3.64Å; I305-F309 HydrophobicContact CG2-CE2 3.45Å; I305-F309 VanDerWaalsContact CG2-CE2 3.45Å; I305-F309 HydrophobicContact CG2-CG 4.18Å; I305-F309 HydrophobicContact CG2-CZ 3.33Å; I305-F309 PolarHBondContact O-N 2.94Å; M306-F309 PolarHBondContact O-N 3.4Å; M306-F309 VanDerWaalsContact O-N 3.15Å; F309-F312 PolarHBondContact O-N 3.43Å; F309-S313 PolarHBondContact O-N 3.15Å |
| 310 | V | 91.2 | Very high | 89.3 | Confident | 0 Ų | 0 | 35.7 Ų | 35.7 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -69.6 | -37.6 | 176.4 | -179.1 | 0 | 0 | 0 | 0 | 111.4 | F50 Y136 A291 M306 I308 F312 S313 T314 | F50-V310 HydrophobicContact CB-CG1 4.01Å; F50-V310 HydrophobicContact CD1-CG1 4.26Å; F50-V310 HydrophobicContact CD1-CG2 3.78Å; F50-V310 HydrophobicContact CD2-CB 4.47Å; F50-V310 HydrophobicContact CD2-CG1 3.66Å; F50-V310 HydrophobicContact CD2-CG2 4.21Å; F50-V310 HydrophobicContact CE1-CG2 3.64Å; F50-V310 HydrophobicContact CE2-CG1 4.2Å; F50-V310 HydrophobicContact CE2-CG2 4.09Å; F50-V310 HydrophobicContact CG-CG1 3.7Å; F50-V310 HydrophobicContact CG-CG2 4.07Å; F50-V310 HydrophobicContact CZ-CG2 3.81Å; Y136-V310 HydrophobicContact CD1-CB 3.5Å; Y136-V310 HydrophobicContact CD1-CG1 3.35Å; Y136-V310 HydrophobicContact CD1-CG2 3.89Å; Y136-V310 HydrophobicContact CD2-CG1 4.01Å; Y136-V310 HydrophobicContact CE1-CB 3.86Å; Y136-V310 HydrophobicContact CE1-CG1 3.55Å; Y136-V310 HydrophobicContact CE1-CG2 3.77Å; Y136-V310 HydrophobicContact CE2-CG1 4.17Å; Y136-V310 HydrophobicContact CG-CB 4.11Å; Y136-V310 HydrophobicContact CG-CG1 3.59Å; A291-V310 HydrophobicContact CB-CG2 4.32Å; M306-V310 HydrophobicContact CG-CG2 4.48Å; M306-V310 WeakPolarHBondContact O-CG2 3.34Å; M306-V310 PolarHBondContact O-N 2.81Å; M306-V310 HydrophobicContact SD-CG2 4.32Å; I308-V310 PolarHBondContact O-N 2.8Å; V310-F312 PolarHBondContact O-N 3.43Å; V310-S313 WeakPolarHBondContact O-CB 3.36Å; V310-S313 PolarHBondContact O-N 2.86Å; V310-T314 HydrophobicContact CG1-CG2 4.29Å; V310-T314 WeakPolarHBondContact O-CG2 3.45Å; V310-T314 PolarHBondContact O-N 3.3Å; V310-T314 PolarHBondContact O-OG1 3.08Å |
| 311 | A | 90.8 | Very high | 89 | Confident | 7 Ų | 7 | 34.1 Ų | 34.1 | 6% | 0.058 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -60.1 | -44.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | F133 I137 P307 I308 S313 T314 F315 | F133-A311 HydrophobicContact CD2-CB 4.01Å; F133-A311 HydrophobicContact CE2-CB 4.07Å; I137-A311 HydrophobicContact CD1-CB 4.01Å; I137-A311 HydrophobicContact CG1-CB 3.83Å; P307-A311 WeakPolarHBondContact O-CB 3.29Å; P307-A311 PolarHBondContact O-N 3.47Å; I308-A311 PolarHBondContact O-N 3.3Å; A311-S313 PolarHBondContact O-N 2.68Å; A311-T314 WeakPolarHBondContact CA-OG1 3.47Å; A311-T314 PolarHBondContact O-N 3.45Å; A311-T314 PolarHBondContact O-OG1 3.05Å; A311-F315 VanDerWaalsContact O-CB 3.23Å; A311-F315 WeakPolarHBondContact O-CB 3.3Å; A311-F315 PolarHBondContact O-N 2.84Å |
| 312 | F | 88.9 | Confident | 88.9 | Confident | 87 Ų | 87 | 28.4 Ų | 28.4 | 38% | 0.382 | 14% | 0.144 | S | C | . | . | H | α-helix | trans | -64.2 | -39.6 | 174.1 | -72.5 | -23.3 | 0 | 0 | 0 | 112.7 | F181 T184 I308 F309 V310 F315 G316 | F181-F312 WeakPolarHBondContact CB-O 3.46Å; F181-F312 HydrophobicContact CD1-CB 3.59Å; F181-F312 HydrophobicContact CD1-CD1 4.05Å; F181-F312 AromaticContact CD1-CG 3.83Å; F181-F312 HydrophobicContact CD1-CG 3.83Å; F181-F312 HydrophobicContact CE1-CB 3.98Å; F181-F312 AromaticContact CE1-CD1 3.48Å; F181-F312 HydrophobicContact CE1-CD1 3.48Å; F181-F312 VanDerWaalsContact CE1-CD1 3.48Å; F181-F312 HydrophobicContact CE1-CE1 4.08Å; F181-F312 AromaticContact CE1-CG 3.75Å; F181-F312 HydrophobicContact CE1-CG 3.75Å; F181-F312 HydrophobicContact CG-CB 4.33Å; F181-F312 WeakPolarHBondContact CG-O 3.39Å; F181-F312 HydrophobicContact CZ-CD1 4.2Å; T184-F312 HydrophobicContact CG2-CB 4.15Å; T184-F312 HydrophobicContact CG2-CD2 4.15Å; I308-F312 HydrophobicContact CG2-CD2 3.93Å; I308-F312 HydrophobicContact CG2-CE2 3.56Å; I308-F312 HydrophobicContact CG2-CZ 4.01Å; I308-F312 PolarHBondContact O-N 3.32Å; F309-F312 PolarHBondContact O-N 3.43Å; V310-F312 PolarHBondContact O-N 3.43Å; F312-F315 PolarHBondContact O-N 3.33Å; F312-G316 PolarHBondContact O-N 3.15Å |
| 313 | S | 90 | Very high | 88.4 | Confident | 2 Ų | 2 | 27.5 Ų | 27.5 | 1% | 0.014 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -58.9 | -49.6 | 174.7 | -174.8 | 0 | 0 | 0 | 0 | 112.2 | K185 F309 V310 A311 G316 G317 | K185-S313 WeakPolarHBondContact CB-OG 3.4Å; F309-S313 PolarHBondContact O-N 3.15Å; V310-S313 WeakPolarHBondContact O-CB 3.36Å; V310-S313 PolarHBondContact O-N 2.86Å; A311-S313 PolarHBondContact O-N 2.68Å; S313-G316 PolarHBondContact O-N 2.68Å; S313-G317 PolarHBondContact O-N 2.64Å |
| 314 | T | 90.6 | Very high | 87.8 | Confident | 0 Ų | 0 | 26 Ų | 26 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -66.7 | -41.1 | -179.7 | 48.4 | 0 | 0 | 0 | 0 | 111.7 | S47 I129 T132 F133 V310 A311 G316 G317 V318 | S47-T314 VanDerWaalsContact CB-CG2 3.43Å; I129-T314 HydrophobicContact CG2-CG2 4.31Å; I129-T314 WeakPolarHBondContact CG2-O 3.46Å; T132-T314 HydrophobicContact CG2-CG2 3.65Å; F133-T314 WeakPolarHBondContact CA-OG1 3.17Å; F133-T314 VanDerWaalsContact CB-OG1 3.31Å; F133-T314 WeakPolarHBondContact CB-OG1 3.49Å; V310-T314 HydrophobicContact CG1-CG2 4.29Å; V310-T314 WeakPolarHBondContact O-CG2 3.45Å; V310-T314 PolarHBondContact O-N 3.3Å; V310-T314 PolarHBondContact O-OG1 3.08Å; A311-T314 WeakPolarHBondContact CA-OG1 3.47Å; A311-T314 PolarHBondContact O-N 3.45Å; A311-T314 PolarHBondContact O-OG1 3.05Å; T314-G316 PolarHBondContact O-N 2.76Å; T314-G317 WeakPolarHBondContact O-CA 3.42Å; T314-G317 PolarHBondContact O-N 3.4Å; T314-V318 PolarHBondContact O-N 3.32Å |
| 315 | F | 87.8 | Confident | 87.6 | Confident | 35 Ų | 35 | 19.1 Ų | 19.1 | 15% | 0.154 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -61.6 | -42.7 | 175.6 | -156.8 | -86.2 | 0 | 0 | 0 | 111.6 | F133 C159 I162 L163 F181 A311 F312 G317 V318 N319 | F133-F315 HydrophobicContact CD2-CD2 4.29Å; F133-F315 AromaticContact CE2-CD2 3.84Å; F133-F315 HydrophobicContact CE2-CD2 3.84Å; F133-F315 HydrophobicContact CZ-CD2 4.24Å; C159-F315 VanDerWaalsContact SG-CD2 3.51Å; I162-F315 HydrophobicContact CG2-CZ 3.97Å; L163-F315 HydrophobicContact CD1-CD1 3.83Å; L163-F315 HydrophobicContact CD1-CD2 4.19Å; L163-F315 HydrophobicContact CD1-CE1 3.89Å; L163-F315 HydrophobicContact CD1-CE2 4.19Å; L163-F315 HydrophobicContact CD1-CG 4.02Å; L163-F315 HydrophobicContact CD1-CZ 4.06Å; L163-F315 WeakPolarHBondContact CD1-O 3.39Å; L163-F315 HydrophobicContact CD2-CD1 3.63Å; L163-F315 HydrophobicContact CD2-CE1 3.12Å; L163-F315 HydrophobicContact CD2-CZ 3.69Å; L163-F315 HydrophobicContact CG-CD1 3.98Å; L163-F315 HydrophobicContact CG-CE1 3.51Å; L163-F315 HydrophobicContact CG-CE2 4.1Å; L163-F315 HydrophobicContact CG-CZ 3.56Å; F181-F315 HydrophobicContact CD2-CD1 4.46Å; F181-F315 HydrophobicContact CE2-CB 4.36Å; F181-F315 AromaticContact CE2-CD1 3.51Å; F181-F315 HydrophobicContact CE2-CD1 3.51Å; F181-F315 HydrophobicContact CE2-CE1 4.24Å; F181-F315 HydrophobicContact CE2-CG 4.36Å; F181-F315 AromaticContact CZ-CD1 3.91Å; F181-F315 HydrophobicContact CZ-CD1 3.91Å; F181-F315 HydrophobicContact CZ-CE1 4.48Å; A311-F315 VanDerWaalsContact O-CB 3.23Å; A311-F315 WeakPolarHBondContact O-CB 3.3Å; A311-F315 PolarHBondContact O-N 2.84Å; F312-F315 PolarHBondContact O-N 3.33Å; F315-G317 VanDerWaalsContact C-N 3.32Å; F315-G317 PolarHBondContact O-N 3.43Å; F315-V318 PolarHBondContact O-N 3.02Å; F315-N319 WeakPolarHBondContact O-CB 3.36Å; F315-N319 PolarHBondContact O-N 2.87Å |
| 316 | G | 84.5 | Confident | 87.2 | Confident | 2 Ų | 2 | 17.1 Ų | 17.1 | 2% | 0.021 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -63.5 | -34.6 | 170.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | Q178 F312 S313 T314 N319 G320 | Q178-G316 VanDerWaalsContact CD-O 3.29Å; Q178-G316 PolarHBondContact NE2-O 3.05Å; Q178-G316 PolarHBondContact OE1-O 2.99Å; F312-G316 PolarHBondContact O-N 3.15Å; S313-G316 PolarHBondContact O-N 2.68Å; T314-G316 PolarHBondContact O-N 2.76Å; G316-N319 PolarHBondContact O-N 3.38Å; G316-G320 PolarHBondContact O-N 3.43Å |
| 317 | G | 86 | Confident | 86.4 | Confident | 18 Ų | 18 | 22.9 Ų | 22.9 | 19% | 0.186 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -62 | -47.8 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | S313 T314 F315 N319 N321 | S313-G317 PolarHBondContact O-N 2.64Å; T314-G317 WeakPolarHBondContact O-CA 3.42Å; T314-G317 PolarHBondContact O-N 3.4Å; F315-G317 VanDerWaalsContact C-N 3.32Å; F315-G317 PolarHBondContact O-N 3.43Å; G317-N319 VanDerWaalsContact C-N 3.34Å; G317-N319 PolarHBondContact O-N 2.86Å; G317-N321 WeakPolarHBondContact O-CB 3.41Å; G317-N321 PolarHBondContact O-N 2.9Å |
| 318 | V | 89.6 | Confident | 85.9 | Confident | 0 Ų | 0 | 23.9 Ų | 23.9 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -61.6 | -44.5 | 175.8 | 173.2 | 0 | 0 | 0 | 0 | 110.7 | M126 I129 A130 I160 L163 T314 F315 N321 M322 | M126-V318 HydrophobicContact CG-CB 4.45Å; M126-V318 HydrophobicContact CG-CG1 3.76Å; M126-V318 HydrophobicContact CG-CG2 4.35Å; M126-V318 HydrophobicContact SD-CG1 3.96Å; I129-V318 HydrophobicContact CB-CG2 3.95Å; I129-V318 HydrophobicContact CG2-CG2 3.68Å; A130-V318 HydrophobicContact CB-CG2 4.13Å; I160-V318 HydrophobicContact CG1-CG1 4.41Å; L163-V318 HydrophobicContact CB-CG1 4.3Å; L163-V318 HydrophobicContact CD1-CB 3.48Å; L163-V318 VanDerWaalsContact CD1-CB 3.48Å; L163-V318 HydrophobicContact CD1-CG1 3.33Å; L163-V318 HydrophobicContact CG-CG1 4.44Å; T314-V318 PolarHBondContact O-N 3.32Å; F315-V318 PolarHBondContact O-N 3.02Å; V318-N321 PolarHBondContact O-N 2.89Å; V318-M322 PolarHBondContact O-N 3.2Å |
| 319 | N | 87.1 | Confident | 85.7 | Confident | 1 Ų | 1 | 20.8 Ų | 20.8 | 1% | 0.005 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -63 | -48 | -179.2 | -172 | 56.2 | 0 | 0 | 0 | 112.7 | L163 N167 S174 Q178 F315 G316 G317 N321 M322 L323 | L163-N319 HydrophobicContact CD1-CB 4.28Å; L163-N319 HydrophobicContact CD2-CB 3.74Å; N167-N319 PolarHBondContact ND2-OD1 3.07Å; N167-N319 PolarHBondContact OD1-OD1 3.27Å; S174-N319 PolarHBondContact O-ND2 3.18Å; S174-N319 VanDerWaalsContact O-ND2 3.17Å; S174-N319 VanDerWaalsContact OG-CG 3.28Å; S174-N319 PolarHBondContact OG-ND2 3.01Å; S174-N319 PolarHBondContact OG-OD1 3.43Å; Q178-N319 PolarHBondContact OE1-ND2 3.4Å; F315-N319 WeakPolarHBondContact O-CB 3.36Å; F315-N319 PolarHBondContact O-N 2.87Å; G316-N319 PolarHBondContact O-N 3.38Å; G317-N319 VanDerWaalsContact C-N 3.34Å; G317-N319 PolarHBondContact O-N 2.86Å; N319-N321 VanDerWaalsContact C-N 3.3Å; N319-N321 PolarHBondContact O-N 2.99Å; N319-M322 PolarHBondContact O-N 3.02Å; N319-L323 WeakPolarHBondContact O-CG 3.36Å; N319-L323 PolarHBondContact O-N 2.92Å |
| 320 | G | 81.2 | Confident | 85.2 | Confident | 17 Ų | 17 | 20 Ų | 20 | 18% | 0.175 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -61.5 | -37.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | G316 T324 | G316-G320 PolarHBondContact O-N 3.43Å; G320-T324 WeakPolarHBondContact O-CG2 3.28Å; G320-T324 PolarHBondContact O-N 3.49Å; G320-T324 VanDerWaalsContact O-N 3.08Å; G320-T324 PolarHBondContact O-OG1 3.49Å |
| 321 | N | 85 | Confident | 84.6 | Confident | 5 Ų | 5 | 21.6 Ų | 21.6 | 3% | 0.027 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -63.8 | -44.5 | 175.5 | -164.8 | -58.2 | 0 | 0 | 0 | 111.5 | T125 G317 V318 N319 T324 T325 | T125-N321 WeakPolarHBondContact CG2-ND2 3.38Å; G317-N321 WeakPolarHBondContact O-CB 3.41Å; G317-N321 PolarHBondContact O-N 2.9Å; V318-N321 PolarHBondContact O-N 2.89Å; N319-N321 VanDerWaalsContact C-N 3.3Å; N319-N321 PolarHBondContact O-N 2.99Å; N321-T324 PolarHBondContact O-N 3.27Å; N321-T324 PolarHBondContact O-OG1 2.82Å; N321-T324 VanDerWaalsContact O-OG1 3.07Å; N321-T325 WeakPolarHBondContact O-CB 3.41Å; N321-T325 PolarHBondContact O-N 2.85Å; N321-T325 PolarHBondContact O-OG1 2.88Å; N321-T325 PolarHBondContact OD1-OG1 3.13Å |
| 322 | M | 86.9 | Confident | 84.3 | Confident | 0 Ų | 0 | 21.3 Ų | 21.3 | 0% | 0 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -61.9 | -47.1 | 177.7 | -165.5 | 108.7 | 65.4 | 0 | 0 | 112.3 | M126 L163 G164 N167 V318 N319 T324 T325 S326 V356 T359 | M126-M322 HydrophobicContact SD-CE 4.32Å; M126-M322 HydrophobicContact SD-SD 4.24Å; L163-M322 HydrophobicContact CB-CE 3.89Å; G164-M322 VanDerWaalsContact N-CE 3.31Å; N167-M322 HydrophobicContact CB-CG 4.48Å; V318-M322 PolarHBondContact O-N 3.2Å; N319-M322 PolarHBondContact O-N 3.02Å; M322-T324 PolarHBondContact O-N 3.43Å; M322-T325 PolarHBondContact O-N 3.05Å; M322-S326 PolarHBondContact O-N 3.13Å; M322-S326 VanDerWaalsContact O-N 3.14Å; M322-V356 HydrophobicContact CG-CG1 4.21Å; M322-V356 HydrophobicContact CG-CG2 4.38Å; M322-V356 HydrophobicContact SD-CG1 3.91Å; M322-T359 HydrophobicContact SD-CG2 4.11Å |
| 323 | L | 80.1 | Confident | 84.2 | Confident | 21 Ų | 21 | 17.4 Ų | 17.4 | 11% | 0.11 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -60.1 | -47.5 | 178.9 | -76 | 176.1 | 0 | 0 | 0 | 112 | N167 V171 N319 S326 | N167-L323 WeakPolarHBondContact OD1-CD2 3.21Å; N167-L323 WeakPolarHBondContact OD1-CG 3.19Å; V171-L323 HydrophobicContact CG1-CD2 3.97Å; N319-L323 WeakPolarHBondContact O-CG 3.36Å; N319-L323 PolarHBondContact O-N 2.92Å; L323-S326 PolarHBondContact O-N 2.95Å; L323-S326 PolarHBondContact O-OG 3.02Å |
| 324 | T | 78.7 | Confident | 83.8 | Confident | 32 Ų | 32 | 25.1 Ų | 25.1 | 20% | 0.196 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -69.7 | -36.8 | -178.5 | 47.9 | 0 | 0 | 0 | 0 | 112.4 | R122 G320 N321 M322 S326 R327 I328 | R122-T324 PolarHBondContact NH1-OG1 2.77Å; G320-T324 WeakPolarHBondContact O-CG2 3.28Å; G320-T324 PolarHBondContact O-N 3.49Å; G320-T324 VanDerWaalsContact O-N 3.08Å; G320-T324 PolarHBondContact O-OG1 3.49Å; N321-T324 PolarHBondContact O-N 3.27Å; N321-T324 PolarHBondContact O-OG1 2.82Å; N321-T324 VanDerWaalsContact O-OG1 3.07Å; M322-T324 PolarHBondContact O-N 3.43Å; T324-S326 VanDerWaalsContact C-N 3.32Å; T324-S326 PolarHBondContact O-N 3.31Å; T324-R327 PolarHBondContact O-N 3.32Å; T324-I328 PolarHBondContact O-N 3.5Å |
| 325 | T | 84.3 | Confident | 83.5 | Confident | 2 Ų | 2 | 29.4 Ų | 29.4 | 1% | 0.012 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -62.4 | -39.7 | 176.2 | -57 | 0 | 0 | 0 | 0 | 111.7 | R122 N321 M322 R327 I328 F329 T359 | R122-T325 HydrophobicContact CB-CG2 4.23Å; R122-T325 WeakPolarHBondContact CB-OG1 3.37Å; R122-T325 WeakPolarHBondContact CD-OG1 3.39Å; R122-T325 HydrophobicContact CG-CG2 4.27Å; R122-T325 WeakPolarHBondContact CG-OG1 3.38Å; N321-T325 WeakPolarHBondContact O-CB 3.41Å; N321-T325 PolarHBondContact O-N 2.85Å; N321-T325 PolarHBondContact O-OG1 2.88Å; N321-T325 PolarHBondContact OD1-OG1 3.13Å; M322-T325 PolarHBondContact O-N 3.05Å; T325-R327 VanDerWaalsContact C-N 3.29Å; T325-R327 PolarHBondContact O-N 2.9Å; T325-I328 PolarHBondContact O-N 3.18Å; T325-I328 VanDerWaalsContact O-N 3.15Å; T325-F329 HydrophobicContact CG2-CD2 4.11Å; T325-F329 HydrophobicContact CG2-CE2 3.6Å; T325-F329 HydrophobicContact CG2-CZ 4.33Å; T325-F329 WeakPolarHBondContact O-CD2 3.26Å; T325-F329 PolarHBondContact O-N 3.21Å; T325-T359 HydrophobicContact CG2-CG2 4.1Å; T325-T359 WeakPolarHBondContact CG2-OG1 3.48Å |
| 326 | S | 81.6 | Confident | 83.4 | Confident | 11 Ų | 11 | 31.5 Ų | 31.5 | 8% | 0.077 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -58.2 | -40.7 | 178.3 | 74.9 | 0 | 0 | 0 | 0 | 112.6 | M322 L323 T324 I328 F329 F330 | M322-S326 PolarHBondContact O-N 3.13Å; M322-S326 VanDerWaalsContact O-N 3.14Å; L323-S326 PolarHBondContact O-N 2.95Å; L323-S326 PolarHBondContact O-OG 3.02Å; T324-S326 VanDerWaalsContact C-N 3.32Å; T324-S326 PolarHBondContact O-N 3.31Å; S326-I328 PolarHBondContact O-N 3.34Å; S326-F329 WeakPolarHBondContact O-CB 3.49Å; S326-F329 PolarHBondContact O-N 3.06Å; S326-F330 WeakPolarHBondContact O-CD2 3.45Å; S326-F330 PolarHBondContact O-N 3.38Å |
| 327 | R | 76.6 | Confident | 83.5 | Confident | 125 Ų | 125 | 32.1 Ų | 32.1 | 47% | 0.472 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -65.2 | -36.2 | 178 | -65.9 | 178.9 | -179.4 | 155.2 | -1.5 | 113 | T324 T325 F329 F330 V331 | T324-R327 PolarHBondContact O-N 3.32Å; T325-R327 VanDerWaalsContact C-N 3.29Å; T325-R327 PolarHBondContact O-N 2.9Å; R327-F329 VanDerWaalsContact C-N 3.28Å; R327-F329 PolarHBondContact O-N 3.4Å; R327-F330 WeakPolarHBondContact O-CB 3.25Å; R327-F330 PolarHBondContact O-N 2.8Å; R327-V331 PolarHBondContact O-N 2.98Å |
| 328 | I | 81.1 | Confident | 83.6 | Confident | 28 Ų | 28 | 32.2 Ų | 32.2 | 14% | 0.144 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -63.3 | -39.9 | 176.9 | -65.6 | 174.8 | 0 | 0 | 0 | 110 | L114 E117 V118 T324 T325 S326 F330 V331 A332 | L114-I328 HydrophobicContact CD1-CG2 3.44Å; L114-I328 VanDerWaalsContact CD1-CG2 3.44Å; E117-I328 HydrophobicContact CG-CD1 3.88Å; V118-I328 HydrophobicContact CG1-CG2 4.02Å; T324-I328 PolarHBondContact O-N 3.5Å; T325-I328 PolarHBondContact O-N 3.18Å; T325-I328 VanDerWaalsContact O-N 3.15Å; S326-I328 PolarHBondContact O-N 3.34Å; I328-F330 VanDerWaalsContact C-N 3.33Å; I328-F330 PolarHBondContact O-N 3.43Å; I328-V331 PolarHBondContact O-N 2.85Å; I328-A332 VanDerWaalsContact O-CB 3.31Å; I328-A332 WeakPolarHBondContact O-CB 3.38Å; I328-A332 PolarHBondContact O-N 3.39Å |
| 329 | F | 86.6 | Confident | 83.4 | Confident | 0 Ų | 0 | 35.2 Ų | 35.2 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -62.5 | -37 | 175.9 | -74.8 | -55.6 | 0 | 0 | 0 | 113.2 | V118 T325 S326 R327 S333 M338 I342 A355 F358 | V118-F329 HydrophobicContact CB-CE1 3.83Å; V118-F329 HydrophobicContact CB-CZ 3.79Å; V118-F329 HydrophobicContact CG1-CD1 4.38Å; V118-F329 HydrophobicContact CG1-CE1 3.75Å; V118-F329 HydrophobicContact CG1-CZ 3.91Å; V118-F329 HydrophobicContact CG2-CE1 4.23Å; T325-F329 HydrophobicContact CG2-CD2 4.11Å; T325-F329 HydrophobicContact CG2-CE2 3.6Å; T325-F329 HydrophobicContact CG2-CZ 4.33Å; T325-F329 WeakPolarHBondContact O-CD2 3.26Å; T325-F329 PolarHBondContact O-N 3.21Å; S326-F329 WeakPolarHBondContact O-CB 3.49Å; S326-F329 PolarHBondContact O-N 3.06Å; R327-F329 VanDerWaalsContact C-N 3.28Å; R327-F329 PolarHBondContact O-N 3.4Å; F329-S333 VanDerWaalsContact O-CB 3.31Å; F329-S333 WeakPolarHBondContact O-CB 3.32Å; F329-S333 PolarHBondContact O-N 3.33Å; F329-S333 PolarHBondContact O-OG 3.04Å; F329-M338 HydrophobicContact CD1-CG 4.3Å; F329-M338 HydrophobicContact CE1-CE 4.15Å; F329-M338 HydrophobicContact CE1-SD 4.41Å; F329-I342 HydrophobicContact CB-CG1 4.44Å; F329-I342 HydrophobicContact CB-CG2 4.07Å; F329-I342 HydrophobicContact CD1-CD1 3.65Å; F329-I342 HydrophobicContact CD1-CG1 4.14Å; F329-I342 HydrophobicContact CD1-CG2 4.22Å; F329-I342 HydrophobicContact CE1-CD1 3.67Å; F329-I342 HydrophobicContact CG-CD1 4.11Å; F329-I342 HydrophobicContact CG-CG1 4.16Å; F329-I342 HydrophobicContact CG-CG2 4.41Å; F329-I342 HydrophobicContact CZ-CD1 4.13Å; F329-A355 HydrophobicContact CB-CB 4.23Å; F329-A355 HydrophobicContact CD2-CB 3.71Å; F329-A355 HydrophobicContact CG-CB 4.31Å; F329-F358 HydrophobicContact CE1-CD1 4.19Å; F329-F358 HydrophobicContact CE1-CE1 4.38Å; F329-F358 AromaticContact CE2-CD1 3.91Å; F329-F358 HydrophobicContact CE2-CD1 3.91Å; F329-F358 AromaticContact CZ-CD1 3.34Å; F329-F358 HydrophobicContact CZ-CD1 3.34Å; F329-F358 AromaticContact CZ-CE1 3.72Å; F329-F358 HydrophobicContact CZ-CE1 3.72Å; F329-F358 HydrophobicContact CZ-CG 4.27Å |
| 330 | F | 80.4 | Confident | 83.2 | Confident | 28 Ų | 28 | 42.1 Ų | 42.1 | 12% | 0.123 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -59.1 | -54.5 | 173.6 | -80.2 | -83.5 | 0 | 0 | 0 | 111.7 | S326 R327 I328 A332 S333 R334 S343 L345 P352 | S326-F330 WeakPolarHBondContact O-CD2 3.45Å; S326-F330 PolarHBondContact O-N 3.38Å; R327-F330 WeakPolarHBondContact O-CB 3.25Å; R327-F330 PolarHBondContact O-N 2.8Å; I328-F330 VanDerWaalsContact C-N 3.33Å; I328-F330 PolarHBondContact O-N 3.43Å; F330-A332 VanDerWaalsContact C-N 3.34Å; F330-A332 PolarHBondContact O-N 3.46Å; F330-S333 PolarHBondContact O-N 3.08Å; F330-S333 PolarHBondContact O-OG 2.86Å; F330-R334 WeakPolarHBondContact O-CG 3.43Å; F330-R334 PolarHBondContact O-N 3.37Å; F330-S343 WeakPolarHBondContact CE1-O 3.33Å; F330-S343 WeakPolarHBondContact CZ-O 3.11Å; F330-L345 HydrophobicContact CE1-CD2 4.19Å; F330-L345 HydrophobicContact CE1-CG 4.16Å; F330-L345 HydrophobicContact CE2-CD2 4.44Å; F330-L345 HydrophobicContact CZ-CD2 3.51Å; F330-L345 HydrophobicContact CZ-CG 3.96Å; F330-P352 HydrophobicContact CE2-CB 3.6Å; F330-P352 HydrophobicContact CE2-CG 4.26Å; F330-P352 HydrophobicContact CZ-CB 3.82Å |
| 331 | V | 79 | Confident | 83.4 | Confident | 33 Ų | 33 | 43.4 Ų | 43.4 | 20% | 0.2 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -60.5 | -45.4 | -178.8 | 179 | 0 | 0 | 0 | 0 | 111 | S94 Y98 R327 I328 S333 R334 E335 | S94-V331 WeakPolarHBondContact O-CG1 3.33Å; Y98-V331 HydrophobicContact CD1-CG1 4.1Å; Y98-V331 HydrophobicContact CE1-CG1 4.08Å; R327-V331 PolarHBondContact O-N 2.98Å; I328-V331 PolarHBondContact O-N 2.85Å; V331-S333 VanDerWaalsContact C-N 3.3Å; V331-S333 PolarHBondContact O-N 3.1Å; V331-R334 PolarHBondContact O-N 3.39Å; V331-E335 PolarHBondContact O-N 3.04Å |
| 332 | A | 85.2 | Confident | 83.4 | Confident | 0 Ų | 0 | 43.5 Ų | 43.5 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -62.1 | -35.1 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | L114 I328 F330 S336 H337 M338 | L114-A332 HydrophobicContact CD1-CB 3.72Å; L114-A332 HydrophobicContact CD2-CB 3.38Å; L114-A332 HydrophobicContact CG-CB 4.19Å; I328-A332 VanDerWaalsContact O-CB 3.31Å; I328-A332 WeakPolarHBondContact O-CB 3.38Å; I328-A332 PolarHBondContact O-N 3.39Å; F330-A332 VanDerWaalsContact C-N 3.34Å; F330-A332 PolarHBondContact O-N 3.46Å; A332-S336 PolarHBondContact O-N 3.03Å; A332-H337 PolarHBondContact O-N 3.16Å; A332-M338 HydrophobicContact CB-CB 4.14Å; A332-M338 HydrophobicContact CB-CG 3.77Å; A332-M338 PolarHBondContact O-N 3.47Å |
| 333 | S | 85 | Confident | 83.3 | Confident | 5 Ų | 5 | 43.8 Ų | 43.8 | 4% | 0.035 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -69.6 | -34.5 | 178.8 | 77.4 | 0 | 0 | 0 | 0 | 112.4 | F329 F330 V331 E335 S336 S343 | F329-S333 VanDerWaalsContact O-CB 3.31Å; F329-S333 WeakPolarHBondContact O-CB 3.32Å; F329-S333 PolarHBondContact O-N 3.33Å; F329-S333 PolarHBondContact O-OG 3.04Å; F330-S333 PolarHBondContact O-N 3.08Å; F330-S333 PolarHBondContact O-OG 2.86Å; V331-S333 VanDerWaalsContact C-N 3.3Å; V331-S333 PolarHBondContact O-N 3.1Å; S333-E335 VanDerWaalsContact C-N 3.33Å; S333-S336 PolarHBondContact O-N 3.29Å; S333-S336 VanDerWaalsContact O-N 3.09Å; S333-S343 VanDerWaalsContact CB-OG 3.23Å; S333-S343 WeakPolarHBondContact CB-OG 3.26Å; S333-S343 WeakPolarHBondContact OG-CB 3.36Å; S333-S343 PolarHBondContact OG-OG 3.17Å |
| 334 | R | 82.6 | Confident | 83.7 | Confident | 165 Ų | 165 | 43.6 Ų | 43.6 | 62% | 0.623 | 21% | 0.21 | S | C | * | . | H | α-helix | trans | -66.4 | -37.3 | 177.7 | -67.3 | 177 | -177.6 | -172.1 | 1.3 | 111.3 | F330 V331 S336 E484 | F330-R334 WeakPolarHBondContact O-CG 3.43Å; F330-R334 PolarHBondContact O-N 3.37Å; V331-R334 PolarHBondContact O-N 3.39Å; R334-S336 PolarHBondContact O-N 3.08Å; R334-E484 IonicContact CZ-OE1 2.77Å; R334-E484 IonicContact CZ-OE2 3.37Å; R334-E484 IonicContact NE-OE1 3.16Å; R334-E484 IonicContact NE-OE2 2.9Å; R334-E484 PolarHBondContact NE-OE2 3.44Å; R334-E484 IonicContact NH2-OE1 2.62Å; R334-E484 PolarHBondContact NH2-OE1 3.21Å; R334-E484 IonicContact NH2-OE2 2.84Å; R334-E484 PolarHBondContact NH2-OE2 2.94Å |
| 335 | E | 85 | Confident | 84.2 | Confident | 90 Ų | 90 | 43.7 Ų | 43.7 | 42% | 0.421 | 21% | 0.209 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -79.3 | 6.6 | 174 | -64.4 | -64.4 | 159.7 | 0 | 0 | 113.5 | Y98 L102 V331 S333 H337 | Y98-E335 HydrophobicContact CE1-CG 4.1Å; Y98-E335 WeakPolarHBondContact OH-CB 3.32Å; Y98-E335 WeakPolarHBondContact OH-CG 3.4Å; L102-E335 HydrophobicContact CD2-CG 4.11Å; V331-E335 PolarHBondContact O-N 3.04Å; S333-E335 VanDerWaalsContact C-N 3.33Å; E335-H337 PolarHBondContact O-CD2 2.71Å; E335-H337 VanDerWaalsContact O-CD2 3.22Å; E335-H337 PolarHBondContact O-N 2.97Å; E335-H337 VanDerWaalsContact O-N 3.1Å |
| 336 | S | 84.2 | Confident | 84.4 | Confident | 79 Ų | 79 | 44.7 Ų | 44.7 | 55% | 0.552 | 21% | 0.214 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 57.6 | 20.7 | -178 | -55.6 | 0 | 0 | 0 | 0 | 114.8 | A332 S333 R334 | A332-S336 PolarHBondContact O-N 3.03Å; S333-S336 PolarHBondContact O-N 3.29Å; S333-S336 VanDerWaalsContact O-N 3.09Å; R334-S336 PolarHBondContact O-N 3.08Å |
| 337 | H | 87.9 | Confident | 84.5 | Confident | 14 Ų | 14 | 50.3 Ų | 50.3 | 7% | 0.065 | 24% | 0.237 | C | C | . | . | S | Bend | trans | -84.4 | -19.7 | 174.1 | -76.8 | -164.7 | 0 | 0 | 0 | 112.2 | Y98 S107 F111 L114 A332 E335 | Y98-H337 AromaticContact CE2-ND1 3.49Å; Y98-H337 WeakPolarHBondContact CE2-ND1 3.32Å; Y98-H337 AromaticContact CZ-ND1 3.68Å; Y98-H337 PolarHBondContact OH-CE1 2.83Å; Y98-H337 VanDerWaalsContact OH-CE1 3.28Å; Y98-H337 PolarHBondContact OH-ND1 3.24Å; S107-H337 PolarHBondContact O-CE1 3.49Å; S107-H337 PolarHBondContact OG-CE1 3.41Å; S107-H337 PolarHBondContact OG-NE2 2.67Å; F111-H337 HydrophobicContact CD2-CB 3.93Å; F111-H337 WeakPolarHBondContact CE2-O 3.38Å; L114-H337 HydrophobicContact CD2-CB 3.88Å; A332-H337 PolarHBondContact O-N 3.16Å; E335-H337 PolarHBondContact O-CD2 2.71Å; E335-H337 VanDerWaalsContact O-CD2 3.22Å; E335-H337 PolarHBondContact O-N 2.97Å; E335-H337 VanDerWaalsContact O-N 3.1Å |
| 338 | M | 87.3 | Confident | 84.9 | Confident | 20 Ų | 20 | 49.8 Ų | 49.8 | 10% | 0.099 | 24% | 0.243 | C | C | . | . | S | Bend | trans | -122.8 | 150.6 | 171.8 | -76.8 | -70.8 | 176.7 | 0 | 0 | 111.2 | L114 V118 F329 A332 K340 I342 | L114-M338 HydrophobicContact CD2-CE 4.02Å; L114-M338 HydrophobicContact CD2-CG 4.02Å; L114-M338 HydrophobicContact CG-CE 4.26Å; V118-M338 HydrophobicContact CG2-CE 3.6Å; F329-M338 HydrophobicContact CD1-CG 4.3Å; F329-M338 HydrophobicContact CE1-CE 4.15Å; F329-M338 HydrophobicContact CE1-SD 4.41Å; A332-M338 HydrophobicContact CB-CB 4.14Å; A332-M338 HydrophobicContact CB-CG 3.77Å; A332-M338 PolarHBondContact O-N 3.47Å; M338-K340 PolarHBondContact O-N 2.75Å; M338-I342 HydrophobicContact CB-CG2 3.96Å |
| 339 | P | 84.9 | Confident | 85.1 | Confident | 64 Ų | 64 | 53.2 Ų | 53.2 | 42% | 0.416 | 26% | 0.257 | S | S | . | . | trans | -57.4 | 132.8 | 173.2 | -23.3 | 33.9 | 0 | 0 | 0 | 111.3 | F341 I342 | P339-F341 HydrophobicContact CB-CD1 3.48Å; P339-F341 VanDerWaalsContact CB-CD1 3.48Å; P339-F341 HydrophobicContact CB-CE1 3.55Å; P339-F341 HydrophobicContact CG-CD1 4.45Å; P339-F341 HydrophobicContact CG-CE1 4.03Å; P339-F341 PolarHBondContact O-N 2.91Å; P339-I342 VanDerWaalsContact O-CG2 3.26Å; P339-I342 WeakPolarHBondContact O-CG2 3.12Å; P339-I342 PolarHBondContact O-N 2.91Å | ||
| 340 | K | 82.8 | Confident | 85 | Confident | 145 Ų | 145 | 58.4 Ų | 58.4 | 63% | 0.63 | 28% | 0.284 | S | S | * | . | G | 310 helix | trans | -55.1 | -29.2 | -176.3 | -65.8 | -173.7 | 178.4 | -173.6 | 0 | 114.2 | M338 I342 S343 F344 | M338-K340 PolarHBondContact O-N 2.75Å; K340-I342 PolarHBondContact O-N 3.49Å; K340-I342 VanDerWaalsContact O-N 3.14Å; K340-S343 PolarHBondContact O-N 2.96Å; K340-S343 PolarHBondContact O-OG 3.46Å; K340-F344 HydrophobicContact CB-CE1 4.12Å; K340-F344 WeakPolarHBondContact O-CD1 3.49Å; K340-F344 WeakPolarHBondContact O-CE1 3.29Å |
| 341 | F | 85.3 | Confident | 85.3 | Confident | 45 Ų | 45 | 57.1 Ų | 57.1 | 20% | 0.197 | 28% | 0.279 | C | S | . | . | G | 310 helix | trans | -59.3 | -27.9 | 179.8 | 87.1 | -94.1 | 0 | 0 | 0 | 112.9 | P339 S343 F344 P354 F471 T472 | P339-F341 HydrophobicContact CB-CD1 3.48Å; P339-F341 VanDerWaalsContact CB-CD1 3.48Å; P339-F341 HydrophobicContact CB-CE1 3.55Å; P339-F341 HydrophobicContact CG-CD1 4.45Å; P339-F341 HydrophobicContact CG-CE1 4.03Å; P339-F341 PolarHBondContact O-N 2.91Å; F341-S343 PolarHBondContact O-N 3.36Å; F341-F344 HydrophobicContact CB-CD2 4.36Å; F341-F344 HydrophobicContact CB-CE2 4.3Å; F341-F344 WeakPolarHBondContact O-CB 3.43Å; F341-F344 PolarHBondContact O-N 2.7Å; F341-F344 VanDerWaalsContact O-N 3.15Å; F341-P354 HydrophobicContact CD2-CB 4.14Å; F341-P354 HydrophobicContact CE2-CB 4.27Å; F341-F471 HydrophobicContact CD1-CE1 4.48Å; F341-F471 HydrophobicContact CD2-CE1 4.38Å; F341-F471 HydrophobicContact CE1-CE1 4.23Å; F341-F471 HydrophobicContact CE2-CE1 4.14Å; F341-F471 HydrophobicContact CZ-CE1 4.07Å; F341-T472 HydrophobicContact CB-CG2 3.95Å |
| 342 | I | 86.2 | Confident | 85.8 | Confident | 6 Ų | 6 | 56 Ų | 56 | 3% | 0.031 | 27% | 0.272 | C | S | . | . | G | 310 helix | trans | -68.8 | -24 | -175.8 | -152.7 | 158.3 | 0 | 0 | 0 | 112.3 | F329 M338 P339 K340 A355 F358 | F329-I342 HydrophobicContact CB-CG1 4.44Å; F329-I342 HydrophobicContact CB-CG2 4.07Å; F329-I342 HydrophobicContact CD1-CD1 3.65Å; F329-I342 HydrophobicContact CD1-CG1 4.14Å; F329-I342 HydrophobicContact CD1-CG2 4.22Å; F329-I342 HydrophobicContact CE1-CD1 3.67Å; F329-I342 HydrophobicContact CG-CD1 4.11Å; F329-I342 HydrophobicContact CG-CG1 4.16Å; F329-I342 HydrophobicContact CG-CG2 4.41Å; F329-I342 HydrophobicContact CZ-CD1 4.13Å; M338-I342 HydrophobicContact CB-CG2 3.96Å; P339-I342 VanDerWaalsContact O-CG2 3.26Å; P339-I342 WeakPolarHBondContact O-CG2 3.12Å; P339-I342 PolarHBondContact O-N 2.91Å; K340-I342 PolarHBondContact O-N 3.49Å; K340-I342 VanDerWaalsContact O-N 3.14Å; I342-A355 HydrophobicContact CG1-CB 4.49Å; I342-F358 HydrophobicContact CD1-CB 4.22Å; I342-F358 HydrophobicContact CD1-CD1 4.49Å; I342-F358 HydrophobicContact CD1-CD2 4.37Å; I342-F358 HydrophobicContact CD1-CG 4.07Å |
| 343 | S | 84.9 | Confident | 86 | Confident | 6 Ų | 6 | 56.8 Ų | 56.8 | 4% | 0.042 | 28% | 0.276 | C | S | . | . | G | 310 helix | trans | -97.6 | 11.2 | 176.7 | 57.5 | 0 | 0 | 0 | 0 | 113.1 | F330 S333 K340 F341 | F330-S343 WeakPolarHBondContact CE1-O 3.33Å; F330-S343 WeakPolarHBondContact CZ-O 3.11Å; S333-S343 VanDerWaalsContact CB-OG 3.23Å; S333-S343 WeakPolarHBondContact CB-OG 3.26Å; S333-S343 WeakPolarHBondContact OG-CB 3.36Å; S333-S343 PolarHBondContact OG-OG 3.17Å; K340-S343 PolarHBondContact O-N 2.96Å; K340-S343 PolarHBondContact O-OG 3.46Å; F341-S343 PolarHBondContact O-N 3.36Å |
| 344 | F | 88.1 | Confident | 86.4 | Confident | 17 Ų | 17 | 57.1 Ų | 57.1 | 8% | 0.075 | 28% | 0.278 | C | S | . | . | trans | -74.1 | 147.9 | 175.2 | -67.2 | -0.6 | 0 | 0 | 0 | 111.4 | K340 F341 T472 Q476 L481 I482 P483 | K340-F344 HydrophobicContact CB-CE1 4.12Å; K340-F344 WeakPolarHBondContact O-CD1 3.49Å; K340-F344 WeakPolarHBondContact O-CE1 3.29Å; F341-F344 HydrophobicContact CB-CD2 4.36Å; F341-F344 HydrophobicContact CB-CE2 4.3Å; F341-F344 WeakPolarHBondContact O-CB 3.43Å; F341-F344 PolarHBondContact O-N 2.7Å; F341-F344 VanDerWaalsContact O-N 3.15Å; F344-T472 HydrophobicContact CE2-CG2 3.61Å; F344-T472 HydrophobicContact CZ-CG2 4.03Å; F344-Q476 HydrophobicContact CD2-CG 3.64Å; F344-Q476 VanDerWaalsContact CE2-CD 3.44Å; F344-Q476 HydrophobicContact CE2-CG 3.56Å; F344-L481 HydrophobicContact CB-CB 3.84Å; F344-L481 HydrophobicContact CB-CD1 4.34Å; F344-L481 HydrophobicContact CD2-CB 4.21Å; F344-I482 WeakPolarHBondContact CA-O 3.35Å; F344-I482 WeakPolarHBondContact CB-O 3.22Å; F344-P483 HydrophobicContact CD1-CB 4.08Å; F344-P483 HydrophobicContact CE1-CB 3.7Å; F344-P483 HydrophobicContact CZ-CB 4.18Å | ||
| 345 | L | 87.9 | Confident | 86.7 | Confident | 35 Ų | 35 | 49.3 Ų | 49.3 | 18% | 0.183 | 25% | 0.249 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -109.1 | 144.9 | -179 | -68.7 | 172.6 | 0 | 0 | 0 | 110.7 | F330 K347 P352 L481 I482 | F330-L345 HydrophobicContact CE1-CD2 4.19Å; F330-L345 HydrophobicContact CE1-CG 4.16Å; F330-L345 HydrophobicContact CE2-CD2 4.44Å; F330-L345 HydrophobicContact CZ-CD2 3.51Å; F330-L345 HydrophobicContact CZ-CG 3.96Å; L345-K347 PolarHBondContact O-N 3.43Å; L345-P352 HydrophobicContact CD2-CB 4.08Å; L345-L481 CarbonylContact O-C 3.39Å; L345-L481 VanDerWaalsContact O-CA 3.27Å; L345-L481 WeakPolarHBondContact O-CA 3.36Å; L345-I482 PolarHBondContact N-O 3.36Å; L345-I482 WeakPolarHBondContact O-CG1 3.46Å; L345-I482 PolarHBondContact O-N 3.3Å |
| 346 | H | 88.6 | Confident | 87.1 | Confident | 22 Ų | 22 | 45.2 Ų | 45.2 | 10% | 0.102 | 23% | 0.23 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -64.2 | 133 | 169 | -176 | -67.5 | 0 | 0 | 0 | 110.6 | D348 K349 L350 T351 I353 L479 L481 | H346-D348 IonicContact CE1-OD2 3.61Å; H346-D348 PolarHBondContact ND1-N 2.96Å; H346-D348 VanDerWaalsContact ND1-N 3.12Å; H346-D348 PolarHBondContact O-N 3.23Å; H346-K349 HydrophobicContact CB-CB 4.32Å; H346-K349 PolarHBondContact ND1-N 3.36Å; H346-L350 VanDerWaalsContact O-CA 3.28Å; H346-L350 WeakPolarHBondContact O-CA 3.46Å; H346-L350 PolarHBondContact O-N 3.26Å; H346-T351 PolarHBondContact N-O 3.3Å; H346-I353 HydrophobicContact CB-CD1 3.83Å; H346-I353 HydrophobicContact CB-CG1 4.29Å; H346-L479 PolarHBondContact CD2-O 3.44Å; H346-L479 VanDerWaalsContact CD2-O 3.3Å; H346-L481 HydrophobicContact CB-CD2 4.49Å |
| 347 | K | 85.5 | Confident | 87.5 | Confident | 129 Ų | 129 | 45 Ų | 45 | 56% | 0.561 | 22% | 0.222 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -50.2 | -55.1 | -174.9 | -175.9 | -172.9 | 174.4 | -170.8 | 0 | 113.8 | L345 Q480 I482 | L345-K347 PolarHBondContact O-N 3.43Å; K347-Q480 WeakPolarHBondContact CB-O 3.33Å; K347-Q480 PolarHBondContact N-O 3.33Å; K347-I482 HydrophobicContact CB-CG2 4.47Å |
| 348 | D | 85 | Confident | 87.8 | Confident | 115 Ų | 115 | 47 Ų | 47 | 62% | 0.615 | 23% | 0.231 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -87.1 | -36.6 | -173.3 | -52 | -36.3 | 0 | 0 | 0 | 113.6 | H346 | H346-D348 IonicContact CE1-OD2 3.61Å; H346-D348 PolarHBondContact ND1-N 2.96Å; H346-D348 VanDerWaalsContact ND1-N 3.12Å; H346-D348 PolarHBondContact O-N 3.23Å |
| 349 | K | 84.6 | Confident | 88 | Confident | 100 Ų | 100 | 46.1 Ų | 46.1 | 44% | 0.435 | 23% | 0.227 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -89 | -18.6 | -173.6 | -66.7 | 171.5 | 173.3 | 176.9 | 0 | 113.6 | V169 H346 T351 | V169-K349 WeakPolarHBondContact O-CD 3.37Å; H346-K349 HydrophobicContact CB-CB 4.32Å; H346-K349 PolarHBondContact ND1-N 3.36Å; K349-T351 HydrophobicContact CB-CG2 4.03Å; K349-T351 PolarHBondContact O-N 2.96Å |
| 350 | L | 84.7 | Confident | 88.5 | Confident | 109 Ų | 109 | 43.7 Ų | 43.7 | 57% | 0.571 | 21% | 0.211 | S | C | * | . | trans | 53.1 | 38.7 | -173.8 | -56.3 | 172.8 | 0 | 0 | 0 | 112.3 | H346 | H346-L350 VanDerWaalsContact O-CA 3.28Å; H346-L350 WeakPolarHBondContact O-CA 3.46Å; H346-L350 PolarHBondContact O-N 3.26Å | ||
| 351 | T | 86.5 | Confident | 89.1 | Confident | 0 Ų | 0 | 42.3 Ų | 42.3 | 0% | 0 | 21% | 0.209 | C | C | . | . | trans | -106.3 | 142.9 | -179.5 | 49.2 | 0 | 0 | 0 | 0 | 111.3 | S168 V171 H346 K349 I353 | S168-T351 WeakPolarHBondContact O-CB 3.39Å; S168-T351 PolarHBondContact O-OG1 3.41Å; V171-T351 HydrophobicContact CG2-CG2 3.84Å; H346-T351 PolarHBondContact N-O 3.3Å; K349-T351 HydrophobicContact CB-CG2 4.03Å; K349-T351 PolarHBondContact O-N 2.96Å; T351-I353 VanDerWaalsContact C-N 3.33Å; T351-I353 PolarHBondContact O-N 2.76Å | ||
| 352 | P | 88.9 | Confident | 89.5 | Confident | 9 Ų | 9 | 41.2 Ų | 41.2 | 6% | 0.058 | 21% | 0.206 | C | C | . | . | trans | -86.7 | 68.1 | -176.4 | 35.6 | -36.6 | 0 | 0 | 0 | 112.2 | F330 L345 A355 V356 | F330-P352 HydrophobicContact CE2-CB 3.6Å; F330-P352 HydrophobicContact CE2-CG 4.26Å; F330-P352 HydrophobicContact CZ-CB 3.82Å; L345-P352 HydrophobicContact CD2-CB 4.08Å; P352-A355 HydrophobicContact CB-CB 4.26Å; P352-A355 PolarHBondContact O-N 2.77Å; P352-V356 HydrophobicContact CG-CG2 4.37Å; P352-V356 WeakPolarHBondContact O-CG2 3.39Å; P352-V356 PolarHBondContact O-N 3.38Å; P352-V356 VanDerWaalsContact O-N 3.09Å | ||
| 353 | I | 90.9 | Very high | 89.9 | Confident | 18 Ų | 18 | 40.9 Ų | 40.9 | 9% | 0.092 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -54.7 | -46.6 | -174.7 | -58.7 | -179.9 | 0 | 0 | 0 | 112.7 | H346 T351 A355 V356 L357 L479 L481 | H346-I353 HydrophobicContact CB-CD1 3.83Å; H346-I353 HydrophobicContact CB-CG1 4.29Å; T351-I353 VanDerWaalsContact C-N 3.33Å; T351-I353 PolarHBondContact O-N 2.76Å; I353-A355 PolarHBondContact O-N 2.69Å; I353-V356 PolarHBondContact O-N 2.87Å; I353-L357 HydrophobicContact CG2-CD1 3.75Å; I353-L357 HydrophobicContact CG2-CG 4.03Å; I353-L357 WeakPolarHBondContact O-CB 3.4Å; I353-L357 WeakPolarHBondContact O-CG 3.36Å; I353-L357 PolarHBondContact O-N 3.35Å; I353-L479 HydrophobicContact CG2-CD1 4.12Å; I353-L479 HydrophobicContact CG2-CD2 4.4Å; I353-L481 HydrophobicContact CB-CD2 4.33Å |
| 354 | P | 91.9 | Very high | 90.4 | Very high | 12 Ų | 12 | 43.4 Ų | 43.4 | 8% | 0.078 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -60.4 | -43.3 | -178.8 | -26.2 | 37.2 | 0 | 0 | 0 | 113.6 | F341 L357 F358 L481 | F341-P354 HydrophobicContact CD2-CB 4.14Å; F341-P354 HydrophobicContact CE2-CB 4.27Å; P354-L357 PolarHBondContact O-N 3.4Å; P354-F358 WeakPolarHBondContact O-CB 3.32Å; P354-F358 PolarHBondContact O-N 2.96Å; P354-L481 HydrophobicContact CG-CD1 3.46Å; P354-L481 VanDerWaalsContact CG-CD1 3.46Å; P354-L481 HydrophobicContact CG-CD2 4.21Å; P354-L481 HydrophobicContact CG-CG 4.48Å |
| 355 | A | 90.4 | Very high | 90.6 | Very high | 0 Ų | 0 | 45.1 Ų | 45.1 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -63.3 | -42.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112 | F329 I342 P352 I353 F358 T359 | F329-A355 HydrophobicContact CB-CB 4.23Å; F329-A355 HydrophobicContact CD2-CB 3.71Å; F329-A355 HydrophobicContact CG-CB 4.31Å; I342-A355 HydrophobicContact CG1-CB 4.49Å; P352-A355 HydrophobicContact CB-CB 4.26Å; P352-A355 PolarHBondContact O-N 2.77Å; I353-A355 PolarHBondContact O-N 2.69Å; A355-F358 PolarHBondContact O-N 3.24Å; A355-T359 WeakPolarHBondContact O-CB 3.45Å; A355-T359 PolarHBondContact O-N 2.9Å; A355-T359 PolarHBondContact O-OG1 3.43Å |
| 356 | V | 91.5 | Very high | 90.8 | Very high | 4 Ų | 4 | 45.4 Ų | 45.4 | 2% | 0.024 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -65 | -45.4 | 177.6 | 173.6 | 0 | 0 | 0 | 0 | 110.8 | G164 N167 M322 P352 I353 F358 T359 C360 | G164-V356 WeakPolarHBondContact O-CG1 3.47Å; N167-V356 HydrophobicContact CB-CG1 4.28Å; N167-V356 HydrophobicContact CB-CG2 4.18Å; M322-V356 HydrophobicContact CG-CG1 4.21Å; M322-V356 HydrophobicContact CG-CG2 4.38Å; M322-V356 HydrophobicContact SD-CG1 3.91Å; P352-V356 HydrophobicContact CG-CG2 4.37Å; P352-V356 WeakPolarHBondContact O-CG2 3.39Å; P352-V356 PolarHBondContact O-N 3.38Å; P352-V356 VanDerWaalsContact O-N 3.09Å; I353-V356 PolarHBondContact O-N 2.87Å; V356-F358 PolarHBondContact O-N 2.76Å; V356-T359 PolarHBondContact O-N 3.46Å; V356-C360 WeakPolarHBondContact O-CB 3.16Å; V356-C360 PolarHBondContact O-N 3.27Å; V356-C360 PolarHBondContact O-SG 3.24Å |
| 357 | L | 93.4 | Very high | 90.9 | Very high | 75 Ų | 75 | 44.6 Ų | 44.6 | 39% | 0.393 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -60.9 | -45.8 | 176.6 | -72.4 | 175.6 | 0 | 0 | 0 | 111.5 | I353 P354 T359 C360 I361 L479 | I353-L357 HydrophobicContact CG2-CD1 3.75Å; I353-L357 HydrophobicContact CG2-CG 4.03Å; I353-L357 WeakPolarHBondContact O-CB 3.4Å; I353-L357 WeakPolarHBondContact O-CG 3.36Å; I353-L357 PolarHBondContact O-N 3.35Å; P354-L357 PolarHBondContact O-N 3.4Å; L357-T359 VanDerWaalsContact C-N 3.3Å; L357-T359 PolarHBondContact O-N 3.47Å; L357-C360 PolarHBondContact O-N 3.49Å; L357-I361 WeakPolarHBondContact O-CB 3.42Å; L357-I361 VanDerWaalsContact O-CG1 3.24Å; L357-I361 WeakPolarHBondContact O-CG1 3.35Å; L357-I361 PolarHBondContact O-N 3.49Å; L357-L479 HydrophobicContact CD1-CD1 4.15Å |
| 358 | F | 93.7 | Very high | 91 | Very high | 57 Ų | 57 | 45 Ų | 45 | 25% | 0.25 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -57.9 | -45.4 | 176.8 | -176.5 | -87.9 | 0 | 0 | 0 | 111.7 | M119 F329 I342 P354 A355 V356 I361 T362 | M119-F358 HydrophobicContact CE-CE1 3.88Å; M119-F358 HydrophobicContact CE-CE2 4.14Å; M119-F358 HydrophobicContact CE-CZ 3.24Å; M119-F358 HydrophobicContact SD-CE1 4.27Å; M119-F358 HydrophobicContact SD-CZ 3.69Å; F329-F358 HydrophobicContact CE1-CD1 4.19Å; F329-F358 HydrophobicContact CE1-CE1 4.38Å; F329-F358 AromaticContact CE2-CD1 3.91Å; F329-F358 HydrophobicContact CE2-CD1 3.91Å; F329-F358 AromaticContact CZ-CD1 3.34Å; F329-F358 HydrophobicContact CZ-CD1 3.34Å; F329-F358 AromaticContact CZ-CE1 3.72Å; F329-F358 HydrophobicContact CZ-CE1 3.72Å; F329-F358 HydrophobicContact CZ-CG 4.27Å; I342-F358 HydrophobicContact CD1-CB 4.22Å; I342-F358 HydrophobicContact CD1-CD1 4.49Å; I342-F358 HydrophobicContact CD1-CD2 4.37Å; I342-F358 HydrophobicContact CD1-CG 4.07Å; P354-F358 WeakPolarHBondContact O-CB 3.32Å; P354-F358 PolarHBondContact O-N 2.96Å; A355-F358 PolarHBondContact O-N 3.24Å; V356-F358 PolarHBondContact O-N 2.76Å; F358-I361 PolarHBondContact O-N 3.12Å; F358-T362 HydrophobicContact CD1-CG2 4.25Å; F358-T362 HydrophobicContact CE1-CG2 3.62Å; F358-T362 HydrophobicContact CE2-CG2 4.2Å; F358-T362 HydrophobicContact CZ-CG2 3.55Å; F358-T362 WeakPolarHBondContact O-CG2 3.26Å; F358-T362 PolarHBondContact O-N 2.93Å; F358-T362 PolarHBondContact O-OG1 3.17Å |
| 359 | T | 92.8 | Very high | 90.9 | Very high | 1 Ų | 1 | 41.7 Ų | 41.7 | 1% | 0.006 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -64.3 | -42.4 | 178.2 | -51.2 | 0 | 0 | 0 | 0 | 111.2 | M126 M322 T325 A355 V356 L357 T362 G363 | M126-T359 HydrophobicContact CE-CG2 3.95Å; M126-T359 WeakPolarHBondContact CE-O 3.32Å; M126-T359 HydrophobicContact SD-CG2 4.13Å; M322-T359 HydrophobicContact SD-CG2 4.11Å; T325-T359 HydrophobicContact CG2-CG2 4.1Å; T325-T359 WeakPolarHBondContact CG2-OG1 3.48Å; A355-T359 WeakPolarHBondContact O-CB 3.45Å; A355-T359 PolarHBondContact O-N 2.9Å; A355-T359 PolarHBondContact O-OG1 3.43Å; V356-T359 PolarHBondContact O-N 3.46Å; L357-T359 VanDerWaalsContact C-N 3.3Å; L357-T359 PolarHBondContact O-N 3.47Å; T359-T362 WeakPolarHBondContact CA-OG1 3.5Å; T359-T362 PolarHBondContact O-OG1 2.68Å; T359-T362 VanDerWaalsContact O-OG1 3.05Å; T359-G363 PolarHBondContact O-N 3.04Å |
| 360 | C | 94.9 | Very high | 90.2 | Very high | 13 Ų | 13 | 42.2 Ų | 42.2 | 9% | 0.088 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -62.7 | -47.4 | 176.3 | -69 | 0 | 0 | 0 | 0 | 112.1 | I160 G164 V356 L357 G363 I364 | I160-C360 HydrophobicContact CG2-CB 4.15Å; G164-C360 VanDerWaalsContact CA-SG 3.58Å; V356-C360 WeakPolarHBondContact O-CB 3.16Å; V356-C360 PolarHBondContact O-N 3.27Å; V356-C360 PolarHBondContact O-SG 3.24Å; L357-C360 PolarHBondContact O-N 3.49Å; C360-G363 PolarHBondContact O-N 3.28Å; C360-I364 WeakPolarHBondContact O-CB 3.35Å; C360-I364 WeakPolarHBondContact O-CG1 3.17Å; C360-I364 PolarHBondContact O-N 3.38Å |
| 361 | I | 95.6 | Very high | 89.9 | Confident | 115 Ų | 115 | 40.1 Ų | 40.1 | 59% | 0.59 | 22% | 0.222 | S | C | * | . | H | α-helix | trans | -61.4 | -49.5 | -178.9 | -69.6 | 164.4 | 0 | 0 | 0 | 110.1 | L357 F358 I364 A365 | L357-I361 WeakPolarHBondContact O-CB 3.42Å; L357-I361 VanDerWaalsContact O-CG1 3.24Å; L357-I361 WeakPolarHBondContact O-CG1 3.35Å; L357-I361 PolarHBondContact O-N 3.49Å; F358-I361 PolarHBondContact O-N 3.12Å; I361-I364 PolarHBondContact O-N 3.21Å; I361-A365 WeakPolarHBondContact O-CB 3.23Å; I361-A365 PolarHBondContact O-N 2.93Å |
| 362 | T | 93.6 | Very high | 89.4 | Confident | 22 Ų | 22 | 40.4 Ų | 40.4 | 14% | 0.135 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -63.9 | -43.1 | 178.3 | 49.6 | 0 | 0 | 0 | 0 | 111.5 | P123 F358 T359 I364 A365 Y366 | P123-T362 WeakPolarHBondContact CG-OG1 3.38Å; F358-T362 HydrophobicContact CD1-CG2 4.25Å; F358-T362 HydrophobicContact CE1-CG2 3.62Å; F358-T362 HydrophobicContact CE2-CG2 4.2Å; F358-T362 HydrophobicContact CZ-CG2 3.55Å; F358-T362 WeakPolarHBondContact O-CG2 3.26Å; F358-T362 PolarHBondContact O-N 2.93Å; F358-T362 PolarHBondContact O-OG1 3.17Å; T359-T362 WeakPolarHBondContact CA-OG1 3.5Å; T359-T362 PolarHBondContact O-OG1 2.68Å; T359-T362 VanDerWaalsContact O-OG1 3.05Å; T362-I364 PolarHBondContact O-N 2.93Å; T362-A365 WeakPolarHBondContact O-CB 3.09Å; T362-A365 PolarHBondContact O-N 3.39Å; T362-Y366 WeakPolarHBondContact O-CD2 3.35Å; T362-Y366 PolarHBondContact O-N 3.1Å; T362-Y366 VanDerWaalsContact O-N 3.07Å |
| 363 | G | 94 | Very high | 88.9 | Confident | 0 Ų | 0 | 42.2 Ų | 42.2 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -62.8 | -40.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | T359 C360 A365 Y366 L367 | T359-G363 PolarHBondContact O-N 3.04Å; C360-G363 PolarHBondContact O-N 3.28Å; G363-A365 VanDerWaalsContact C-N 3.35Å; G363-Y366 PolarHBondContact O-N 3.41Å; G363-L367 PolarHBondContact O-N 2.99Å |
| 364 | I | 95.3 | Very high | 88.4 | Confident | 58 Ų | 58 | 42.7 Ų | 42.7 | 30% | 0.297 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -65.3 | -39.5 | 174.6 | -69.1 | 165.9 | 0 | 0 | 0 | 110.6 | I160 M161 C360 I361 T362 Y366 L367 | I160-I364 HydrophobicContact CG2-CG1 4.21Å; M161-I364 HydrophobicContact CG-CD1 3.93Å; C360-I364 WeakPolarHBondContact O-CB 3.35Å; C360-I364 WeakPolarHBondContact O-CG1 3.17Å; C360-I364 PolarHBondContact O-N 3.38Å; I361-I364 PolarHBondContact O-N 3.21Å; T362-I364 PolarHBondContact O-N 2.93Å; I364-Y366 VanDerWaalsContact C-N 3.26Å; I364-Y366 PolarHBondContact O-N 3.35Å; I364-L367 VanDerWaalsContact O-CB 3.3Å; I364-L367 WeakPolarHBondContact O-CB 3.31Å; I364-L367 PolarHBondContact O-N 3.37Å |
| 365 | A | 93.7 | Very high | 87.8 | Confident | 53 Ų | 53 | 42.2 Ų | 42.2 | 44% | 0.438 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -59.8 | -38.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | I361 T362 G363 L367 L368 | I361-A365 WeakPolarHBondContact O-CB 3.23Å; I361-A365 PolarHBondContact O-N 2.93Å; T362-A365 WeakPolarHBondContact O-CB 3.09Å; T362-A365 PolarHBondContact O-N 3.39Å; G363-A365 VanDerWaalsContact C-N 3.35Å; A365-L367 VanDerWaalsContact C-N 3.26Å; A365-L367 PolarHBondContact O-N 2.71Å; A365-L368 VanDerWaalsContact O-CB 3.27Å; A365-L368 WeakPolarHBondContact O-CB 3.28Å; A365-L368 WeakPolarHBondContact O-CG 3.27Å; A365-L368 PolarHBondContact O-N 3.41Å; A365-L368 VanDerWaalsContact O-N 3.11Å |
| 366 | Y | 91.3 | Very high | 87.3 | Confident | 41 Ų | 41 | 42.3 Ų | 42.3 | 16% | 0.161 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -68.3 | -20.2 | 175.1 | -90.1 | -81.8 | 0 | 0 | 0 | 114.3 | M119 P123 A124 T362 G363 I364 L368 V369 L375 | M119-Y366 WeakPolarHBondContact O-CE2 3.31Å; M119-Y366 PolarHBondContact O-OH 3.22Å; P123-Y366 HydrophobicContact CB-CD2 3.52Å; P123-Y366 HydrophobicContact CB-CE2 3.83Å; P123-Y366 HydrophobicContact CB-CG 4.45Å; A124-Y366 HydrophobicContact CB-CD1 3.95Å; A124-Y366 HydrophobicContact CB-CE1 3.98Å; A124-Y366 HydrophobicContact CB-CG 4.37Å; T362-Y366 WeakPolarHBondContact O-CD2 3.35Å; T362-Y366 PolarHBondContact O-N 3.1Å; T362-Y366 VanDerWaalsContact O-N 3.07Å; G363-Y366 PolarHBondContact O-N 3.41Å; I364-Y366 VanDerWaalsContact C-N 3.26Å; I364-Y366 PolarHBondContact O-N 3.35Å; Y366-L368 PolarHBondContact O-N 2.86Å; Y366-V369 HydrophobicContact CD1-CG2 4.23Å; Y366-V369 WeakPolarHBondContact O-CB 2.94Å; Y366-V369 PolarHBondContact O-N 2.94Å; Y366-L375 HydrophobicContact CD1-CD1 3.55Å; Y366-L375 HydrophobicContact CD1-CD2 4.5Å; Y366-L375 HydrophobicContact CE1-CD1 3.85Å |
| 367 | L | 91.7 | Very high | 86.9 | Confident | 6 Ų | 6 | 42.5 Ų | 42.5 | 3% | 0.031 | 23% | 0.233 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -67.2 | -15.9 | 171.1 | -63 | 176.4 | 0 | 0 | 0 | 112.8 | A127 M131 R153 A156 A157 I160 G363 I364 A365 V369 | A127-L367 HydrophobicContact CB-CD2 3.85Å; A127-L367 HydrophobicContact CB-CG 4.35Å; M131-L367 HydrophobicContact CE-CD2 4.25Å; M131-L367 HydrophobicContact CG-CD2 3.65Å; M131-L367 HydrophobicContact SD-CD2 4.26Å; R153-L367 WeakPolarHBondContact CD-O 3.27Å; R153-L367 WeakPolarHBondContact CG-O 3.35Å; R153-L367 PolarHBondContact NE-O 3.01Å; R153-L367 VanDerWaalsContact NE-O 3.1Å; A156-L367 HydrophobicContact CB-CD1 3.99Å; A156-L367 HydrophobicContact CB-CD2 3.77Å; A157-L367 HydrophobicContact CB-CD1 3.72Å; I160-L367 HydrophobicContact CD1-CD1 3.97Å; I160-L367 HydrophobicContact CD1-CG 4.33Å; G363-L367 PolarHBondContact O-N 2.99Å; I364-L367 VanDerWaalsContact O-CB 3.3Å; I364-L367 WeakPolarHBondContact O-CB 3.31Å; I364-L367 PolarHBondContact O-N 3.37Å; A365-L367 VanDerWaalsContact C-N 3.26Å; A365-L367 PolarHBondContact O-N 2.71Å; L367-V369 PolarHBondContact O-N 3.22Å |
| 368 | L | 87.3 | Confident | 86.4 | Confident | 136 Ų | 136 | 40.8 Ų | 40.8 | 71% | 0.712 | 22% | 0.221 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -73.1 | -19.2 | 175.5 | -58.2 | 176.4 | 0 | 0 | 0 | 112.4 | A365 Y366 T370 | A365-L368 VanDerWaalsContact O-CB 3.27Å; A365-L368 WeakPolarHBondContact O-CB 3.28Å; A365-L368 WeakPolarHBondContact O-CG 3.27Å; A365-L368 PolarHBondContact O-N 3.41Å; A365-L368 VanDerWaalsContact O-N 3.11Å; Y366-L368 PolarHBondContact O-N 2.86Å; L368-T370 PolarHBondContact O-N 2.61Å |
| 369 | V | 81.3 | Confident | 86 | Confident | 46 Ų | 46 | 38.2 Ų | 38.2 | 28% | 0.279 | 21% | 0.21 | S | C | . | . | S | Bend | trans | -65.2 | 132 | 175.8 | -179.4 | 0 | 0 | 0 | 0 | 109.3 | Y366 L367 L375 | Y366-V369 HydrophobicContact CD1-CG2 4.23Å; Y366-V369 WeakPolarHBondContact O-CB 2.94Å; Y366-V369 PolarHBondContact O-N 2.94Å; L367-V369 PolarHBondContact O-N 3.22Å; V369-L375 HydrophobicContact CG1-CB 4.33Å |
| 370 | T | 71.1 | Confident | 85.7 | Confident | 111 Ų | 111 | 38.3 Ų | 38.3 | 68% | 0.681 | 21% | 0.211 | S | C | * | . | S | Bend | trans | -72.6 | -44.1 | -166.5 | 23 | 0 | 0 | 0 | 0 | 114.2 | R153 L368 | R153-T370 VanDerWaalsContact NH2-CA 3.25Å; R153-T370 PolarHBondContact NH2-O 3.44Å; L368-T370 PolarHBondContact O-N 2.61Å |
| 371 | D | 78.5 | Confident | 85.4 | Confident | 65 Ų | 65 | 37.8 Ų | 37.8 | 35% | 0.348 | 21% | 0.208 | S | C | . | . | trans | -113 | 130.1 | -173.4 | 175.3 | 34.7 | 0 | 0 | 0 | 112.2 | Y373 S374 L375 | D371-Y373 PolarHBondContact OD1-N 2.99Å; D371-S374 WeakPolarHBondContact OD2-CB 3.47Å; D371-S374 PolarHBondContact OD2-N 2.97Å; D371-S374 PolarHBondContact OD2-OG 3.42Å; D371-L375 WeakPolarHBondContact O-CB 3.37Å; D371-L375 PolarHBondContact O-N 3.12Å | ||
| 372 | I | 76.5 | Confident | 85.1 | Confident | 7 Ų | 7 | 32.3 Ų | 32.3 | 4% | 0.036 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -71.4 | -35.3 | -177.4 | -133.9 | 170.8 | 0 | 0 | 0 | 111.6 | V128 M131 L375 M376 | V128-I372 HydrophobicContact CG1-CD1 4.4Å; V128-I372 HydrophobicContact CG1-CG1 4.35Å; V128-I372 HydrophobicContact CG2-CG1 4.21Å; M131-I372 HydrophobicContact CB-CD1 3.5Å; M131-I372 VanDerWaalsContact CB-CD1 3.5Å; M131-I372 HydrophobicContact CB-CG1 4.48Å; M131-I372 HydrophobicContact CE-CD1 3.93Å; M131-I372 HydrophobicContact CE-CG1 3.58Å; M131-I372 HydrophobicContact CG-CD1 4.37Å; M131-I372 HydrophobicContact SD-CD1 4.03Å; M131-I372 HydrophobicContact SD-CG1 4.09Å; I372-L375 WeakPolarHBondContact O-CB 3.46Å; I372-L375 PolarHBondContact O-N 3.4Å; I372-M376 WeakPolarHBondContact O-CG 3.44Å; I372-M376 PolarHBondContact O-N 3.38Å |
| 373 | Y | 77.8 | Confident | 85 | Confident | 47 Ų | 47 | 32 Ų | 32 | 18% | 0.184 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -80.2 | -36.9 | -175.3 | -65.7 | -69.8 | 0 | 0 | 0 | 111 | V51 T54 D371 L375 M376 T377 | V51-Y373 HydrophobicContact CG1-CE1 4.25Å; T54-Y373 WeakPolarHBondContact CB-OH 3.29Å; T54-Y373 WeakPolarHBondContact CG2-OH 3.42Å; D371-Y373 PolarHBondContact OD1-N 2.99Å; Y373-L375 VanDerWaalsContact C-N 3.32Å; Y373-M376 HydrophobicContact CD1-SD 4.19Å; Y373-M376 PolarHBondContact O-N 2.96Å; Y373-T377 PolarHBondContact O-N 3.35Å; Y373-T377 PolarHBondContact O-OG1 3.14Å |
| 374 | S | 79.9 | Confident | 84.8 | Confident | 27 Ų | 27 | 32.1 Ų | 32.1 | 19% | 0.189 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -54.9 | -52.1 | 162.9 | -60.6 | 0 | 0 | 0 | 0 | 109.2 | D371 M376 T377 Y378 | D371-S374 WeakPolarHBondContact OD2-CB 3.47Å; D371-S374 PolarHBondContact OD2-N 2.97Å; D371-S374 PolarHBondContact OD2-OG 3.42Å; S374-M376 VanDerWaalsContact C-N 3.3Å; S374-M376 PolarHBondContact O-N 2.88Å; S374-T377 WeakPolarHBondContact O-CA 3.43Å; S374-T377 WeakPolarHBondContact O-CB 3.43Å; S374-T377 PolarHBondContact O-N 3.48Å; S374-Y378 WeakPolarHBondContact O-CD2 3.38Å; S374-Y378 WeakPolarHBondContact O-CE2 3.14Å; S374-Y378 PolarHBondContact O-N 3Å |
| 375 | L | 79 | Confident | 84.6 | Confident | 3 Ų | 3 | 32.5 Ų | 32.5 | 2% | 0.016 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -52.2 | -46.2 | 177.8 | -173.5 | 56.5 | 0 | 0 | 0 | 112.7 | A124 A127 V128 M131 Y366 V369 D371 I372 Y373 T377 L379 | A124-L375 HydrophobicContact CB-CD1 3.8Å; A124-L375 HydrophobicContact CB-CD2 4.5Å; A124-L375 HydrophobicContact CB-CG 4.23Å; A127-L375 HydrophobicContact CB-CD2 4.22Å; V128-L375 HydrophobicContact CG2-CB 4.45Å; V128-L375 HydrophobicContact CG2-CD2 3.71Å; V128-L375 HydrophobicContact CG2-CG 3.98Å; M131-L375 HydrophobicContact CE-CD2 4Å; Y366-L375 HydrophobicContact CD1-CD1 3.55Å; Y366-L375 HydrophobicContact CD1-CD2 4.5Å; Y366-L375 HydrophobicContact CE1-CD1 3.85Å; V369-L375 HydrophobicContact CG1-CB 4.33Å; D371-L375 WeakPolarHBondContact O-CB 3.37Å; D371-L375 PolarHBondContact O-N 3.12Å; I372-L375 WeakPolarHBondContact O-CB 3.46Å; I372-L375 PolarHBondContact O-N 3.4Å; Y373-L375 VanDerWaalsContact C-N 3.32Å; L375-T377 VanDerWaalsContact C-N 3.32Å; L375-T377 PolarHBondContact O-N 3.1Å; L375-L379 WeakPolarHBondContact O-CB 3.38Å; L375-L379 PolarHBondContact O-N 2.86Å |
| 376 | M | 81.3 | Confident | 84.6 | Confident | 2 Ų | 2 | 30.3 Ų | 30.3 | 1% | 0.01 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -61.9 | -36.1 | 174.5 | -74.6 | -177.6 | 161.5 | 0 | 0 | 113.1 | V51 V128 F231 I372 Y373 S374 G380 | V51-M376 HydrophobicContact CB-CE 3.92Å; V51-M376 HydrophobicContact CG1-CE 3.42Å; V51-M376 VanDerWaalsContact CG1-CE 3.42Å; V51-M376 HydrophobicContact CG1-SD 4.27Å; V128-M376 HydrophobicContact CG1-CE 3.41Å; V128-M376 VanDerWaalsContact CG1-CE 3.41Å; V128-M376 HydrophobicContact CG1-CG 4.34Å; V128-M376 HydrophobicContact CG2-CG 4.26Å; F231-M376 HydrophobicContact CD1-CE 3.38Å; F231-M376 HydrophobicContact CD2-CE 4.44Å; F231-M376 HydrophobicContact CE1-CE 3.48Å; F231-M376 VanDerWaalsContact CE1-CE 3.48Å; F231-M376 HydrophobicContact CG-CE 3.9Å; F231-M376 HydrophobicContact CZ-CE 4.08Å; I372-M376 WeakPolarHBondContact O-CG 3.44Å; I372-M376 PolarHBondContact O-N 3.38Å; Y373-M376 HydrophobicContact CD1-SD 4.19Å; Y373-M376 PolarHBondContact O-N 2.96Å; S374-M376 VanDerWaalsContact C-N 3.3Å; S374-M376 PolarHBondContact O-N 2.88Å; M376-G380 WeakPolarHBondContact O-CA 3.24Å; M376-G380 PolarHBondContact O-N 2.97Å |
| 377 | T | 82.7 | Confident | 84.6 | Confident | 7 Ų | 7 | 28.4 Ų | 28.4 | 4% | 0.043 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -69 | -47.9 | 178.5 | -56.1 | 0 | 0 | 0 | 0 | 111.3 | K224 Y227 Y373 S374 L375 L379 G380 F381 T429 A433 E436 | K224-T377 HydrophobicContact CG-CG2 4.38Å; Y227-T377 HydrophobicContact CD2-CG2 4.41Å; Y373-T377 PolarHBondContact O-N 3.35Å; Y373-T377 PolarHBondContact O-OG1 3.14Å; S374-T377 WeakPolarHBondContact O-CA 3.43Å; S374-T377 WeakPolarHBondContact O-CB 3.43Å; S374-T377 PolarHBondContact O-N 3.48Å; L375-T377 VanDerWaalsContact C-N 3.32Å; L375-T377 PolarHBondContact O-N 3.1Å; T377-L379 VanDerWaalsContact C-N 3.32Å; T377-L379 PolarHBondContact O-N 3.33Å; T377-G380 PolarHBondContact O-N 3.47Å; T377-F381 WeakPolarHBondContact O-CB 3.44Å; T377-F381 PolarHBondContact O-N 3.22Å; T377-T429 HydrophobicContact CG2-CG2 4.28Å; T377-A433 HydrophobicContact CG2-CB 4.09Å; T377-E436 HydrophobicContact CG2-CB 4.26Å |
| 378 | Y | 82.3 | Confident | 84.8 | Confident | 39 Ų | 39 | 28.3 Ų | 28.3 | 15% | 0.153 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -61.1 | -44.3 | 175.1 | -47.5 | -91.2 | 0 | 0 | 0 | 110.9 | S374 F381 V382 E436 M439 | S374-Y378 WeakPolarHBondContact O-CD2 3.38Å; S374-Y378 WeakPolarHBondContact O-CE2 3.14Å; S374-Y378 PolarHBondContact O-N 3Å; Y378-F381 PolarHBondContact O-N 3.21Å; Y378-V382 WeakPolarHBondContact O-CG2 3.47Å; Y378-V382 PolarHBondContact O-N 3.01Å; Y378-V382 VanDerWaalsContact O-N 3.1Å; Y378-E436 VanDerWaalsContact CD1-CA 3.43Å; Y378-E436 HydrophobicContact CD1-CB 3.6Å; Y378-E436 HydrophobicContact CD1-CG 4.08Å; Y378-E436 VanDerWaalsContact CD1-O 3.26Å; Y378-E436 WeakPolarHBondContact CD1-O 3.42Å; Y378-E436 HydrophobicContact CE1-CB 3.5Å; Y378-E436 VanDerWaalsContact CE1-CB 3.5Å; Y378-E436 HydrophobicContact CE1-CG 3.5Å; Y378-E436 HydrophobicContact CE2-CG 4.21Å; Y378-E436 HydrophobicContact CG-CB 4.26Å; Y378-E436 VanDerWaalsContact CZ-CG 3.49Å; Y378-M439 HydrophobicContact CD1-CB 3.83Å; Y378-M439 HydrophobicContact CD1-SD 4.46Å; Y378-M439 HydrophobicContact CE1-CB 3.82Å; Y378-M439 HydrophobicContact CE1-CE 4.15Å; Y378-M439 HydrophobicContact CE1-CG 4.2Å; Y378-M439 HydrophobicContact CE1-SD 3.56Å; Y378-M439 VanDerWaalsContact CE1-SD 3.56Å |
| 379 | L | 85.4 | Confident | 85.1 | Confident | 3 Ų | 3 | 22.9 Ų | 22.9 | 2% | 0.016 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -59.2 | -51.9 | 177.9 | 170.4 | 62.8 | 0 | 0 | 0 | 110.9 | A121 A124 T125 F231 L375 T377 F381 V382 Q383 | A121-L379 VanDerWaalsContact CA-CD1 3.44Å; A121-L379 HydrophobicContact CB-CD1 4.03Å; A124-L379 HydrophobicContact CB-CB 4.44Å; A124-L379 HydrophobicContact CB-CD1 4.24Å; A124-L379 HydrophobicContact CB-CD2 4.45Å; T125-L379 WeakPolarHBondContact OG1-CD2 3.37Å; F231-L379 HydrophobicContact CD2-CD2 3.82Å; F231-L379 HydrophobicContact CE2-CD2 3.88Å; L375-L379 WeakPolarHBondContact O-CB 3.38Å; L375-L379 PolarHBondContact O-N 2.86Å; T377-L379 VanDerWaalsContact C-N 3.32Å; T377-L379 PolarHBondContact O-N 3.33Å; L379-F381 VanDerWaalsContact C-N 3.35Å; L379-F381 PolarHBondContact O-N 3.41Å; L379-V382 PolarHBondContact O-N 3.21Å; L379-Q383 HydrophobicContact CD1-CB 4.44Å; L379-Q383 WeakPolarHBondContact O-CB 3.37Å; L379-Q383 PolarHBondContact O-N 3.42Å |
| 380 | G | 86.2 | Confident | 85.8 | Confident | 3 Ų | 3 | 20.7 Ų | 20.7 | 3% | 0.031 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -58.2 | -48 | -179.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | Y227 M376 T377 V382 W384 | Y227-G380 WeakPolarHBondContact CE1-O 3.49Å; M376-G380 WeakPolarHBondContact O-CA 3.24Å; M376-G380 PolarHBondContact O-N 2.97Å; T377-G380 PolarHBondContact O-N 3.47Å; G380-V382 PolarHBondContact O-N 3.45Å; G380-W384 WeakPolarHBondContact O-CB 3.12Å; G380-W384 PolarHBondContact O-N 2.77Å |
| 381 | F | 89 | Confident | 86.9 | Confident | 2 Ų | 2 | 15.4 Ų | 15.4 | 1% | 0.009 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -54 | -56.7 | 176.5 | 175.4 | -94.4 | 0 | 0 | 0 | 112.1 | Y227 T377 Y378 L379 L385 V426 T429 F430 V441 | Y227-F381 HydrophobicContact CE2-CB 4.25Å; T377-F381 WeakPolarHBondContact O-CB 3.44Å; T377-F381 PolarHBondContact O-N 3.22Å; Y378-F381 PolarHBondContact O-N 3.21Å; L379-F381 VanDerWaalsContact C-N 3.35Å; L379-F381 PolarHBondContact O-N 3.41Å; F381-L385 HydrophobicContact CE1-CD2 4.33Å; F381-L385 HydrophobicContact CZ-CD2 4.35Å; F381-L385 WeakPolarHBondContact O-CB 3.39Å; F381-L385 PolarHBondContact O-N 2.91Å; F381-L385 VanDerWaalsContact O-N 3.08Å; F381-V426 HydrophobicContact CE2-CB 4.41Å; F381-V426 HydrophobicContact CE2-CG1 4.01Å; F381-V426 HydrophobicContact CE2-CG2 4.18Å; F381-T429 HydrophobicContact CD2-CG2 4.21Å; F381-F430 HydrophobicContact CE2-CD2 4.28Å; F381-F430 AromaticContact CE2-CE2 3.75Å; F381-F430 HydrophobicContact CE2-CE2 3.75Å; F381-F430 HydrophobicContact CE2-CZ 4.42Å; F381-F430 AromaticContact CZ-CE2 3.8Å; F381-F430 HydrophobicContact CZ-CE2 3.8Å; F381-F430 HydrophobicContact CZ-CZ 4.13Å; F381-V441 HydrophobicContact CE1-CG2 3.95Å; F381-V441 HydrophobicContact CZ-CG2 3.98Å |
| 382 | V | 90.2 | Very high | 87.8 | Confident | 1 Ų | 1 | 16.3 Ų | 16.3 | 1% | 0.006 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -67.1 | -44.2 | -174.5 | 175.7 | 0 | 0 | 0 | 0 | 111.1 | I116 V120 Y378 L379 G380 A386 I444 | I116-V382 HydrophobicContact CB-CG1 4.18Å; I116-V382 HydrophobicContact CD1-CG1 4.26Å; I116-V382 HydrophobicContact CG1-CG1 3.89Å; I116-V382 HydrophobicContact CG2-CG1 3.42Å; I116-V382 VanDerWaalsContact CG2-CG1 3.42Å; V120-V382 HydrophobicContact CB-CG1 4.48Å; V120-V382 HydrophobicContact CG1-CB 4.42Å; V120-V382 HydrophobicContact CG1-CG1 4.36Å; Y378-V382 WeakPolarHBondContact O-CG2 3.47Å; Y378-V382 PolarHBondContact O-N 3.01Å; Y378-V382 VanDerWaalsContact O-N 3.1Å; L379-V382 PolarHBondContact O-N 3.21Å; G380-V382 PolarHBondContact O-N 3.45Å; V382-A386 WeakPolarHBondContact O-CB 3.3Å; V382-A386 PolarHBondContact O-N 2.94Å; V382-A386 VanDerWaalsContact O-N 3.1Å; V382-I444 HydrophobicContact CG1-CD1 4.09Å; V382-I444 HydrophobicContact CG1-CG1 3.97Å; V382-I444 HydrophobicContact CG2-CD1 4.25Å; V382-I444 HydrophobicContact CG2-CG1 4.4Å |
| 383 | Q | 90.1 | Very high | 88.7 | Confident | 16 Ų | 16 | 16 Ų | 16 | 8% | 0.075 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -67.1 | -48.1 | -176.6 | -178 | 175.1 | -2 | 0 | 0 | 111.7 | L379 A386 I387 | L379-Q383 HydrophobicContact CD1-CB 4.44Å; L379-Q383 WeakPolarHBondContact O-CB 3.37Å; L379-Q383 PolarHBondContact O-N 3.42Å; Q383-A386 WeakPolarHBondContact O-CB 3.49Å; Q383-A386 PolarHBondContact O-N 3.29Å; Q383-I387 HydrophobicContact CG-CD1 3.95Å; Q383-I387 WeakPolarHBondContact O-CG1 3.48Å; Q383-I387 PolarHBondContact O-N 3.27Å |
| 384 | W | 90.1 | Very high | 89.6 | Confident | 2 Ų | 2 | 13.7 Ų | 13.7 | 1% | 0.008 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -75.6 | -28.9 | -176.5 | -64.8 | 110.7 | 0 | 0 | 0 | 112.4 | F76 Y227 L230 W236 G380 I387 G388 Y418 T422 | F76-W384 AromaticContact CE1-CE3 3.88Å; F76-W384 HydrophobicContact CE1-CE3 3.88Å; F76-W384 HydrophobicContact CE1-CZ3 4.16Å; Y227-W384 AromaticContact CD1-CD1 3.65Å; Y227-W384 HydrophobicContact CD1-CG 4.49Å; Y227-W384 HydrophobicContact CE1-CB 4.18Å; Y227-W384 AromaticContact CE1-CD1 3.87Å; Y227-W384 HydrophobicContact CE1-CG 4.35Å; L230-W384 HydrophobicContact CB-CD2 4.39Å; L230-W384 VanDerWaalsContact CB-CE2 3.5Å; L230-W384 HydrophobicContact CB-CH2 4.44Å; L230-W384 HydrophobicContact CB-CZ2 3.57Å; L230-W384 HydrophobicContact CD1-CD2 3.75Å; L230-W384 HydrophobicContact CD1-CE3 4.31Å; L230-W384 HydrophobicContact CD1-CG 3.89Å; L230-W384 HydrophobicContact CD1-CZ2 4.28Å; L230-W384 HydrophobicContact CD2-CH2 4.26Å; L230-W384 HydrophobicContact CD2-CZ2 4.19Å; L230-W384 HydrophobicContact CG-CZ2 4.23Å; L230-W384 WeakPolarHBondContact O-CZ2 3.23Å; W236-W384 HydrophobicContact CZ2-CZ3 4.06Å; W236-W384 AromaticContact NE1-CH2 3.74Å; G380-W384 WeakPolarHBondContact O-CB 3.12Å; G380-W384 PolarHBondContact O-N 2.77Å; W384-I387 HydrophobicContact CD2-CD1 4.3Å; W384-I387 HydrophobicContact CE3-CB 4.25Å; W384-I387 HydrophobicContact CE3-CD1 3.72Å; W384-I387 HydrophobicContact CE3-CG2 4.29Å; W384-I387 HydrophobicContact CH2-CD1 4.21Å; W384-I387 HydrophobicContact CZ3-CD1 3.69Å; W384-I387 HydrophobicContact CZ3-CG2 4.34Å; W384-I387 PolarHBondContact O-N 2.95Å; W384-G388 PolarHBondContact O-N 3.34Å; W384-Y418 WeakPolarHBondContact CZ3-OH 3.46Å; W384-T422 WeakPolarHBondContact O-CG2 3.39Å |
| 385 | L | 92 | Very high | 90.4 | Very high | 65 Ų | 65 | 14.1 Ų | 14.1 | 34% | 0.34 | 8% | 0.076 | S | C | . | . | H | α-helix | trans | -60.3 | -46.6 | 166.7 | 178.1 | 63 | 0 | 0 | 0 | 111.1 | F381 G388 A389 V426 I444 | F381-L385 HydrophobicContact CE1-CD2 4.33Å; F381-L385 HydrophobicContact CZ-CD2 4.35Å; F381-L385 WeakPolarHBondContact O-CB 3.39Å; F381-L385 PolarHBondContact O-N 2.91Å; F381-L385 VanDerWaalsContact O-N 3.08Å; L385-G388 PolarHBondContact O-N 3.4Å; L385-A389 PolarHBondContact O-N 3.23Å; L385-V426 HydrophobicContact CD1-CG2 4.06Å; L385-I444 HydrophobicContact CD2-CD1 4.04Å |
| 386 | A | 92.2 | Very high | 91.2 | Very high | 7 Ų | 7 | 16.3 Ų | 16.3 | 6% | 0.058 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -63.9 | -42.2 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | I116 V382 Q383 A389 C390 | I116-A386 HydrophobicContact CD1-CB 4.17Å; I116-A386 HydrophobicContact CG2-CB 4.13Å; V382-A386 WeakPolarHBondContact O-CB 3.3Å; V382-A386 PolarHBondContact O-N 2.94Å; V382-A386 VanDerWaalsContact O-N 3.1Å; Q383-A386 WeakPolarHBondContact O-CB 3.49Å; Q383-A386 PolarHBondContact O-N 3.29Å; A386-A389 PolarHBondContact O-N 3.22Å; A386-C390 PolarHBondContact O-N 3.24Å; A386-C390 VanDerWaalsContact O-N 3.09Å; A386-C390 PolarHBondContact O-SG 3.29Å |
| 387 | I | 92.3 | Very high | 91.9 | Very high | 1 Ų | 1 | 16.4 Ų | 16.4 | 1% | 0.005 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -66.3 | -41.5 | 176.2 | -67.5 | 170.4 | 0 | 0 | 0 | 110.8 | Y84 W236 Q383 W384 A389 C390 V391 Y418 | Y84-I387 HydrophobicContact CE2-CG2 3.92Å; W236-I387 HydrophobicContact CH2-CG2 3.95Å; W236-I387 HydrophobicContact CZ2-CG2 3.98Å; Q383-I387 HydrophobicContact CG-CD1 3.95Å; Q383-I387 WeakPolarHBondContact O-CG1 3.48Å; Q383-I387 PolarHBondContact O-N 3.27Å; W384-I387 HydrophobicContact CD2-CD1 4.3Å; W384-I387 HydrophobicContact CE3-CB 4.25Å; W384-I387 HydrophobicContact CE3-CD1 3.72Å; W384-I387 HydrophobicContact CE3-CG2 4.29Å; W384-I387 HydrophobicContact CH2-CD1 4.21Å; W384-I387 HydrophobicContact CZ3-CD1 3.69Å; W384-I387 HydrophobicContact CZ3-CG2 4.34Å; W384-I387 PolarHBondContact O-N 2.95Å; I387-A389 VanDerWaalsContact C-N 3.32Å; I387-A389 PolarHBondContact O-N 3.1Å; I387-C390 WeakPolarHBondContact O-CA 3.46Å; I387-C390 WeakPolarHBondContact O-CB 3.38Å; I387-C390 PolarHBondContact O-N 2.94Å; I387-C390 VanDerWaalsContact O-N 3.1Å; I387-V391 PolarHBondContact O-N 3.45Å; I387-Y418 HydrophobicContact CG2-CE1 4.16Å; I387-Y418 VanDerWaalsContact CG2-OH 3.3Å; I387-Y418 WeakPolarHBondContact CG2-OH 3.47Å |
| 388 | G | 95.2 | Very high | 92.5 | Very high | 4 Ų | 4 | 18 Ų | 18 | 4% | 0.041 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -59.6 | -41.2 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | W384 L385 C390 V391 M392 | W384-G388 PolarHBondContact O-N 3.34Å; L385-G388 PolarHBondContact O-N 3.4Å; G388-C390 VanDerWaalsContact C-N 3.31Å; G388-C390 PolarHBondContact O-N 3.03Å; G388-V391 PolarHBondContact O-N 3.09Å; G388-V391 VanDerWaalsContact O-N 3.17Å; G388-M392 WeakPolarHBondContact O-CG 3.14Å; G388-M392 PolarHBondContact O-N 3.5Å |
| 389 | A | 94.9 | Very high | 93.1 | Very high | 22 Ų | 22 | 24.5 Ų | 24.5 | 18% | 0.182 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -61.6 | -38.4 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | M101 L385 A386 I387 M392 | M101-A389 HydrophobicContact CE-CB 4.11Å; L385-A389 PolarHBondContact O-N 3.23Å; A386-A389 PolarHBondContact O-N 3.22Å; I387-A389 VanDerWaalsContact C-N 3.32Å; I387-A389 PolarHBondContact O-N 3.1Å; A389-M392 WeakPolarHBondContact O-CB 3.49Å; A389-M392 PolarHBondContact O-N 3.44Å |
| 390 | C | 94.5 | Very high | 93.5 | Very high | 0 Ų | 0 | 28.6 Ų | 28.6 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -65.5 | -42 | 171.7 | -68.7 | 0 | 0 | 0 | 0 | 112.3 | Y84 L87 M101 A386 I387 G388 M392 I393 | Y84-C390 HydrophobicContact CE2-CB 4.04Å; Y84-C390 WeakPolarHBondContact OH-CB 3.42Å; L87-C390 WeakPolarHBondContact CD1-O 3.5Å; M101-C390 WeakPolarHBondContact CG-SG 3.48Å; A386-C390 PolarHBondContact O-N 3.24Å; A386-C390 VanDerWaalsContact O-N 3.09Å; A386-C390 PolarHBondContact O-SG 3.29Å; I387-C390 WeakPolarHBondContact O-CA 3.46Å; I387-C390 WeakPolarHBondContact O-CB 3.38Å; I387-C390 PolarHBondContact O-N 2.94Å; I387-C390 VanDerWaalsContact O-N 3.1Å; G388-C390 VanDerWaalsContact C-N 3.31Å; G388-C390 PolarHBondContact O-N 3.03Å; C390-M392 VanDerWaalsContact C-N 3.27Å; C390-M392 PolarHBondContact O-N 3.36Å; C390-I393 WeakPolarHBondContact O-CB 3.38Å; C390-I393 VanDerWaalsContact O-CG1 3.3Å; C390-I393 WeakPolarHBondContact O-CG1 3.47Å; C390-I393 PolarHBondContact O-N 3.42Å |
| 391 | V | 95.8 | Very high | 93.9 | Very high | 0 Ų | 0 | 33 Ų | 33 | 0% | 0 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -65 | -32.5 | 177.1 | 177.1 | 0 | 0 | 0 | 0 | 111.5 | C83 Y84 I387 G388 I393 V394 A415 Y418 V419 | C83-V391 HydrophobicContact CB-CG1 3.9Å; C83-V391 HydrophobicContact CB-CG2 4.31Å; Y84-V391 HydrophobicContact CD2-CG2 4.03Å; Y84-V391 HydrophobicContact CE2-CG2 3.74Å; I387-V391 PolarHBondContact O-N 3.45Å; G388-V391 PolarHBondContact O-N 3.09Å; G388-V391 VanDerWaalsContact O-N 3.17Å; V391-I393 PolarHBondContact O-N 3.28Å; V391-I393 VanDerWaalsContact O-N 3.14Å; V391-V394 WeakPolarHBondContact O-CB 3.4Å; V391-V394 PolarHBondContact O-N 2.99Å; V391-A415 HydrophobicContact CG1-CB 4.08Å; V391-Y418 HydrophobicContact CB-CD1 3.77Å; V391-Y418 HydrophobicContact CB-CE1 4.17Å; V391-Y418 HydrophobicContact CG1-CD1 3.82Å; V391-Y418 HydrophobicContact CG1-CG 4.2Å; V391-Y418 HydrophobicContact CG2-CD1 3.61Å; V391-Y418 HydrophobicContact CG2-CE1 3.61Å; V391-Y418 HydrophobicContact CG2-CG 4.36Å; V391-V419 HydrophobicContact CB-CG2 4.36Å; V391-V419 HydrophobicContact CG1-CG2 4.09Å |
| 392 | M | 96.6 | Very high | 94 | Very high | 84 Ų | 84 | 36.4 Ų | 36.4 | 41% | 0.414 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -57.3 | -26.4 | 172.1 | -72.5 | -152.9 | -65.2 | 0 | 0 | 113 | G388 A389 C390 V394 I395 V396 V419 | G388-M392 WeakPolarHBondContact O-CG 3.14Å; G388-M392 PolarHBondContact O-N 3.5Å; A389-M392 WeakPolarHBondContact O-CB 3.49Å; A389-M392 PolarHBondContact O-N 3.44Å; C390-M392 VanDerWaalsContact C-N 3.27Å; C390-M392 PolarHBondContact O-N 3.36Å; M392-V394 PolarHBondContact O-N 2.9Å; M392-I395 WeakPolarHBondContact O-CB 3.39Å; M392-I395 PolarHBondContact O-N 2.79Å; M392-V396 WeakPolarHBondContact O-CG2 3.46Å; M392-V396 PolarHBondContact O-N 2.89Å; M392-V419 HydrophobicContact CB-CG2 4.39Å; M392-V419 HydrophobicContact CG-CB 4.2Å; M392-V419 HydrophobicContact CG-CG1 3.58Å; M392-V419 HydrophobicContact CG-CG2 3.47Å; M392-V419 VanDerWaalsContact CG-CG2 3.47Å; M392-V419 HydrophobicContact SD-CG1 3.76Å |
| 393 | I | 96.1 | Very high | 94.1 | Very high | 0 Ų | 0 | 43.8 Ų | 43.8 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -57.9 | -36.9 | 175.4 | -60 | 170.3 | 0 | 0 | 0 | 111 | L87 M101 A104 F105 C390 V391 I395 V396 F397 | L87-I393 HydrophobicContact CD1-CB 4.48Å; L87-I393 HydrophobicContact CD2-CB 4.12Å; L87-I393 HydrophobicContact CD2-CG2 3.76Å; M101-I393 HydrophobicContact CG-CD1 4.37Å; M101-I393 HydrophobicContact SD-CD1 3.82Å; M101-I393 HydrophobicContact SD-CG1 4.44Å; A104-I393 HydrophobicContact CB-CB 4.31Å; A104-I393 HydrophobicContact CB-CD1 3.75Å; A104-I393 HydrophobicContact CB-CG1 3.72Å; A104-I393 HydrophobicContact CB-CG2 3.65Å; F105-I393 HydrophobicContact CD2-CG1 4.43Å; F105-I393 HydrophobicContact CE2-CD1 4.33Å; F105-I393 HydrophobicContact CE2-CG1 3.66Å; F105-I393 HydrophobicContact CZ-CG1 4.17Å; C390-I393 WeakPolarHBondContact O-CB 3.38Å; C390-I393 VanDerWaalsContact O-CG1 3.3Å; C390-I393 WeakPolarHBondContact O-CG1 3.47Å; C390-I393 PolarHBondContact O-N 3.42Å; V391-I393 PolarHBondContact O-N 3.28Å; V391-I393 VanDerWaalsContact O-N 3.14Å; I393-I395 VanDerWaalsContact C-N 3.28Å; I393-I395 PolarHBondContact O-N 2.91Å; I393-V396 PolarHBondContact O-N 3.35Å; I393-F397 HydrophobicContact CG2-CD1 3.89Å; I393-F397 HydrophobicContact CG2-CD2 3.62Å; I393-F397 HydrophobicContact CG2-CE1 3.75Å; I393-F397 HydrophobicContact CG2-CE2 3.46Å; I393-F397 VanDerWaalsContact CG2-CE2 3.46Å; I393-F397 HydrophobicContact CG2-CG 3.84Å; I393-F397 HydrophobicContact CG2-CZ 3.54Å; I393-F397 VanDerWaalsContact O-CB 3.28Å; I393-F397 WeakPolarHBondContact O-CB 3.43Å; I393-F397 WeakPolarHBondContact O-CG 3.18Å; I393-F397 PolarHBondContact O-N 3.1Å |
| 394 | V | 96 | Very high | 94.1 | Very high | 0 Ų | 0 | 44.6 Ų | 44.6 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -60.4 | -42 | 177.5 | 178 | 0 | 0 | 0 | 0 | 110.6 | C83 L87 V391 M392 R398 A415 | C83-V394 HydrophobicContact CB-CG2 4.17Å; L87-V394 HydrophobicContact CD1-CG2 4.07Å; L87-V394 HydrophobicContact CD2-CG2 3.78Å; L87-V394 HydrophobicContact CG-CG2 3.71Å; V391-V394 WeakPolarHBondContact O-CB 3.4Å; V391-V394 PolarHBondContact O-N 2.99Å; M392-V394 PolarHBondContact O-N 2.9Å; V394-R398 WeakPolarHBondContact O-CG 3.1Å; V394-R398 PolarHBondContact O-N 3.09Å; V394-A415 HydrophobicContact CB-CB 4.28Å; V394-A415 HydrophobicContact CG1-CB 4.21Å |
| 395 | I | 96.8 | Very high | 94.2 | Very high | 36 Ų | 36 | 51.5 Ų | 51.5 | 19% | 0.185 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -66.8 | -50.6 | 176.7 | -55.2 | 176.4 | 0 | 0 | 0 | 109.4 | M392 I393 F397 R398 Y399 L412 A415 I416 V419 | M392-I395 WeakPolarHBondContact O-CB 3.39Å; M392-I395 PolarHBondContact O-N 2.79Å; I393-I395 VanDerWaalsContact C-N 3.28Å; I393-I395 PolarHBondContact O-N 2.91Å; I395-F397 PolarHBondContact O-N 3.4Å; I395-R398 WeakPolarHBondContact O-CB 3.36Å; I395-R398 PolarHBondContact O-N 3.45Å; I395-R398 VanDerWaalsContact O-N 3.11Å; I395-Y399 HydrophobicContact CG2-CD2 4.37Å; I395-Y399 HydrophobicContact CG2-CE2 3.94Å; I395-Y399 WeakPolarHBondContact O-CD2 3.5Å; I395-L412 HydrophobicContact CG1-CD1 4.19Å; I395-A415 HydrophobicContact CD1-CB 4.24Å; I395-A415 HydrophobicContact CG1-CB 3.78Å; I395-I416 HydrophobicContact CD1-CG1 4.09Å; I395-V419 HydrophobicContact CD1-CB 4.41Å; I395-V419 HydrophobicContact CD1-CG2 4.02Å |
| 396 | V | 96.4 | Very high | 94.3 | Very high | 49 Ų | 49 | 50.3 Ų | 50.3 | 30% | 0.297 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -57.5 | -47.3 | -179.7 | 172.8 | 0 | 0 | 0 | 0 | 111.3 | F105 M392 I393 R398 Y399 T400 | F105-V396 HydrophobicContact CE1-CG1 4.49Å; F105-V396 HydrophobicContact CE1-CG2 4.42Å; F105-V396 HydrophobicContact CZ-CG2 4.28Å; M392-V396 WeakPolarHBondContact O-CG2 3.46Å; M392-V396 PolarHBondContact O-N 2.89Å; I393-V396 PolarHBondContact O-N 3.35Å; V396-R398 PolarHBondContact O-N 3.25Å; V396-Y399 PolarHBondContact O-N 3.34Å; V396-T400 HydrophobicContact CG1-CG2 3.88Å; V396-T400 PolarHBondContact O-N 3.22Å; V396-T400 PolarHBondContact O-OG1 3.45Å; V396-T400 VanDerWaalsContact O-OG1 3.08Å |
| 397 | F | 95.7 | Very high | 94.3 | Very high | 3 Ų | 3 | 52 Ų | 52 | 1% | 0.013 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -67.5 | -20.6 | -179.8 | -77 | 1.8 | 0 | 0 | 0 | 113.9 | M90 I91 A104 I393 I395 Y399 R401 R406 | M90-F397 HydrophobicContact CE-CD2 4.23Å; M90-F397 HydrophobicContact SD-CD2 3.77Å; M90-F397 HydrophobicContact SD-CE2 4.35Å; I91-F397 HydrophobicContact CD1-CE2 3.87Å; I91-F397 HydrophobicContact CD1-CZ 4.36Å; A104-F397 HydrophobicContact CB-CE1 3.69Å; A104-F397 HydrophobicContact CB-CZ 3.69Å; I393-F397 HydrophobicContact CG2-CD1 3.89Å; I393-F397 HydrophobicContact CG2-CD2 3.62Å; I393-F397 HydrophobicContact CG2-CE1 3.75Å; I393-F397 HydrophobicContact CG2-CE2 3.46Å; I393-F397 VanDerWaalsContact CG2-CE2 3.46Å; I393-F397 HydrophobicContact CG2-CG 3.84Å; I393-F397 HydrophobicContact CG2-CZ 3.54Å; I393-F397 VanDerWaalsContact O-CB 3.28Å; I393-F397 WeakPolarHBondContact O-CB 3.43Å; I393-F397 WeakPolarHBondContact O-CG 3.18Å; I393-F397 PolarHBondContact O-N 3.1Å; I395-F397 PolarHBondContact O-N 3.4Å; F397-Y399 VanDerWaalsContact C-N 3.28Å; F397-R401 CarbonylContact O-C 3.53Å; F397-R401 VanDerWaalsContact O-C 3.25Å; F397-R401 WeakPolarHBondContact O-CA 3.34Å; F397-R401 PolarHBondContact O-N 3.06Å; F397-R401 VanDerWaalsContact O-N 3.09Å; F397-R406 PolarHBondContact O-NH2 3.37Å |
| 398 | R | 95 | Very high | 94.3 | Very high | 40 Ų | 40 | 52.4 Ų | 52.4 | 15% | 0.151 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -66.2 | -34.5 | 169.9 | -69.6 | -92 | -174.8 | -76 | -3.1 | 111.5 | E86 V394 I395 V396 A410 L412 | E86-R398 IonicContact OE1-CZ 3.67Å; E86-R398 IonicContact OE1-NH1 3.24Å; E86-R398 PolarHBondContact OE1-NH1 3.17Å; E86-R398 IonicContact OE1-NH2 3.63Å; E86-R398 PolarHBondContact OE1-NH2 2.79Å; E86-R398 IonicContact OE2-CZ 3.63Å; E86-R398 IonicContact OE2-NH1 2.68Å; E86-R398 IonicContact OE2-NH2 3.22Å; E86-R398 PolarHBondContact OE2-NH2 2.93Å; V394-R398 WeakPolarHBondContact O-CG 3.1Å; V394-R398 PolarHBondContact O-N 3.09Å; I395-R398 WeakPolarHBondContact O-CB 3.36Å; I395-R398 PolarHBondContact O-N 3.45Å; I395-R398 VanDerWaalsContact O-N 3.11Å; V396-R398 PolarHBondContact O-N 3.25Å; R398-A410 PolarHBondContact NH2-O 2.88Å; R398-L412 HydrophobicContact CG-CD1 4.11Å |
| 399 | Y | 94 | Very high | 94.3 | Very high | 176 Ų | 176 | 59 Ų | 59 | 69% | 0.69 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -88.8 | -42.5 | 178.4 | -65.3 | -77.8 | 0 | 0 | 0 | 112.9 | I395 V396 F397 | I395-Y399 HydrophobicContact CG2-CD2 4.37Å; I395-Y399 HydrophobicContact CG2-CE2 3.94Å; I395-Y399 WeakPolarHBondContact O-CD2 3.5Å; V396-Y399 PolarHBondContact O-N 3.34Å; F397-Y399 VanDerWaalsContact C-N 3.28Å |
| 400 | T | 95.1 | Very high | 94.2 | Very high | 89 Ų | 89 | 58 Ų | 58 | 55% | 0.546 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -87.1 | -26.3 | -172.9 | 60.3 | 0 | 0 | 0 | 0 | 114.1 | V396 | V396-T400 HydrophobicContact CG1-CG2 3.88Å; V396-T400 PolarHBondContact O-N 3.22Å; V396-T400 PolarHBondContact O-OG1 3.45Å; V396-T400 VanDerWaalsContact O-OG1 3.08Å |
| 401 | R | 93.2 | Very high | 94.2 | Very high | 97 Ų | 97 | 60.6 Ų | 60.6 | 37% | 0.366 | 31% | 0.308 | S | S | . | . | trans | -132.5 | 57.9 | -178.4 | -60.2 | -174.4 | -175.8 | -171.9 | 2.9 | 111 | E103 F397 D403 A404 R406 | E103-R401 IonicContact OE1-CZ 2.69Å; E103-R401 IonicContact OE1-NH1 2.96Å; E103-R401 PolarHBondContact OE1-NH1 3.32Å; E103-R401 IonicContact OE1-NH2 3.52Å; E103-R401 PolarHBondContact OE1-NH2 3.43Å; F397-R401 CarbonylContact O-C 3.53Å; F397-R401 VanDerWaalsContact O-C 3.25Å; F397-R401 WeakPolarHBondContact O-CA 3.34Å; F397-R401 PolarHBondContact O-N 3.06Å; F397-R401 VanDerWaalsContact O-N 3.09Å; R401-D403 VanDerWaalsContact C-N 3.3Å; R401-D403 PolarHBondContact O-N 3.39Å; R401-A404 HydrophobicContact CB-CB 4.12Å; R401-A404 PolarHBondContact O-N 2.98Å; R401-R406 PolarHBondContact O-NH2 3.47Å | ||
| 402 | P | 91.5 | Very high | 94.2 | Very high | 73 Ų | 73 | 63 Ų | 63 | 47% | 0.474 | 32% | 0.32 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.3 | -38.5 | -172.4 | 24.1 | -33.6 | 0 | 0 | 0 | 113 | A404 R406 | P402-A404 VanDerWaalsContact C-N 3.35Å; P402-A404 PolarHBondContact O-N 3.06Å; P402-R406 PolarHBondContact O-NH1 3.23Å |
| 403 | D | 91.9 | Very high | 94.2 | Very high | 155 Ų | 155 | 62.6 Ų | 62.6 | 83% | 0.829 | 32% | 0.324 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.3 | -0.4 | -173.4 | -53.7 | -47.7 | 0 | 0 | 0 | 114.6 | R401 | R401-D403 VanDerWaalsContact C-N 3.3Å; R401-D403 PolarHBondContact O-N 3.39Å |
| 404 | A | 91.7 | Very high | 94.2 | Very high | 34 Ų | 34 | 66.1 Ų | 66.1 | 28% | 0.281 | 34% | 0.34 | S | S | . | . | S | Bend | trans | -66.9 | 138.3 | -178.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | M90 R401 P402 R406 | M90-A404 HydrophobicContact CE-CB 3.17Å; R401-A404 HydrophobicContact CB-CB 4.12Å; R401-A404 PolarHBondContact O-N 2.98Å; P402-A404 VanDerWaalsContact C-N 3.35Å; P402-A404 PolarHBondContact O-N 3.06Å; A404-R406 PolarHBondContact O-N 3.3Å; A404-R406 PolarHBondContact O-NH1 3.22Å |
| 405 | I | 92 | Very high | 94.2 | Very high | 146 Ų | 146 | 66.1 Ų | 66.1 | 75% | 0.749 | 34% | 0.34 | S | S | * | . | trans | -64.4 | 123.8 | -179.7 | -59.7 | 173.1 | 0 | 0 | 0 | 109 | ||||
| 406 | R | 93.7 | Very high | 94.3 | Very high | 41 Ų | 41 | 68.2 Ų | 68.2 | 16% | 0.155 | 35% | 0.35 | C | S | . | . | trans | -121.3 | 95 | 179.3 | -70.1 | 170.3 | -172.3 | 103 | -15.7 | 109.6 | E86 M90 F397 R401 P402 A404 V408 | E86-R406 VanDerWaalsContact OE1-CD 3.31Å; E86-R406 WeakPolarHBondContact OE1-CD 3.35Å; E86-R406 IonicContact OE1-NE 3.8Å; M90-R406 HydrophobicContact CE-CG 4.29Å; M90-R406 HydrophobicContact SD-CG 4.28Å; F397-R406 PolarHBondContact O-NH2 3.37Å; R401-R406 PolarHBondContact O-NH2 3.47Å; P402-R406 PolarHBondContact O-NH1 3.23Å; A404-R406 PolarHBondContact O-N 3.3Å; A404-R406 PolarHBondContact O-NH1 3.22Å; R406-V408 VanDerWaalsContact C-N 3.28Å; R406-V408 PolarHBondContact O-N 3.21Å | ||
| 407 | P | 92.2 | Very high | 94.3 | Very high | 43 Ų | 43 | 69.7 Ų | 69.7 | 28% | 0.279 | 36% | 0.355 | S | S | . | . | S | Bend | trans | -61.5 | -38.7 | -179.7 | -25.1 | 35.8 | 0 | 0 | 0 | 113.5 | K250 | K250-P407 HydrophobicContact CB-CB 4.26Å; K250-P407 HydrophobicContact CD-CB 3.56Å; K250-P407 HydrophobicContact CD-CG 4.22Å; K250-P407 VanDerWaalsContact CE-CB 3.44Å; K250-P407 HydrophobicContact CG-CB 3.52Å; K250-P407 HydrophobicContact CG-CG 4.29Å |
| 408 | V | 92.7 | Very high | 94.4 | Very high | 8 Ų | 8 | 69.5 Ų | 69.5 | 5% | 0.048 | 36% | 0.355 | C | S | . | . | S | Bend | trans | -113.3 | 127.4 | 167.4 | 177.8 | 0 | 0 | 0 | 0 | 106.5 | Y82 A85 E86 T89 K250 P254 R406 | Y82-V408 HydrophobicContact CE1-CG1 4.47Å; A85-V408 HydrophobicContact CB-CG1 4.13Å; E86-V408 WeakPolarHBondContact CB-O 3.35Å; E86-V408 VanDerWaalsContact CG-O 3.31Å; E86-V408 WeakPolarHBondContact CG-O 3.34Å; T89-V408 HydrophobicContact CG2-CB 4.38Å; T89-V408 HydrophobicContact CG2-CG2 3.84Å; T89-V408 PolarHBondContact OG1-N 2.92Å; K250-V408 WeakPolarHBondContact O-CG2 3.47Å; P254-V408 HydrophobicContact CB-CG1 4.44Å; P254-V408 HydrophobicContact CG-CG2 4.01Å; R406-V408 VanDerWaalsContact C-N 3.28Å; R406-V408 PolarHBondContact O-N 3.21Å |
| 409 | K | 93.8 | Very high | 94.5 | Very high | 142 Ų | 142 | 68.9 Ų | 68.9 | 62% | 0.617 | 36% | 0.355 | S | S | * | . | trans | -117.2 | 105.5 | -179.7 | -169.8 | 179.3 | -179.3 | 178.3 | 0 | 108.6 | ||||
| 410 | A | 93.7 | Very high | 94.6 | Very high | 1 Ų | 1 | 64 Ų | 64 | 1% | 0.008 | 34% | 0.344 | C | S | . | . | trans | -67 | 135.4 | 172.3 | 0 | 0 | 0 | 0 | 0 | 109.9 | Y82 E86 R398 L412 | Y82-A410 HydrophobicContact CD1-CB 3.88Å; Y82-A410 HydrophobicContact CE1-CB 4.32Å; E86-A410 HydrophobicContact CB-CB 4.26Å; E86-A410 WeakPolarHBondContact OE2-CB 3.45Å; E86-A410 PolarHBondContact OE2-N 3.43Å; R398-A410 PolarHBondContact NH2-O 2.88Å; A410-L412 PolarHBondContact O-N 3.16Å | ||
| 411 | P | 95.2 | Very high | 94.7 | Very high | 55 Ų | 55 | 62.3 Ų | 62.3 | 36% | 0.357 | 33% | 0.331 | S | S | . | . | trans | -55.8 | 129.4 | 169.2 | -23.4 | 33.5 | 0 | 0 | 0 | 109.8 | P413 F414 | P411-P413 VanDerWaalsContact C-N 3.27Å; P411-F414 HydrophobicContact CB-CD1 4.14Å; P411-F414 HydrophobicContact CB-CD2 4.45Å; P411-F414 HydrophobicContact CB-CE1 4.36Å; P411-F414 HydrophobicContact CB-CG 4.18Å; P411-F414 HydrophobicContact CG-CD1 4.44Å; P411-F414 HydrophobicContact CG-CD2 4.08Å; P411-F414 HydrophobicContact CG-CE1 4.34Å; P411-F414 HydrophobicContact CG-CE2 3.98Å; P411-F414 HydrophobicContact CG-CG 4.31Å; P411-F414 HydrophobicContact CG-CZ 4.12Å; P411-F414 WeakPolarHBondContact O-CB 3.3Å; P411-F414 PolarHBondContact O-N 3.41Å | ||
| 412 | L | 94.6 | Very high | 94.8 | Very high | 51 Ų | 51 | 58.1 Ų | 58.1 | 27% | 0.267 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -54.9 | -37.2 | 179.9 | -173.2 | 62.2 | 0 | 0 | 0 | 113.5 | I395 R398 A410 F414 A415 I416 | I395-L412 HydrophobicContact CG1-CD1 4.19Å; R398-L412 HydrophobicContact CG-CD1 4.11Å; A410-L412 PolarHBondContact O-N 3.16Å; L412-F414 PolarHBondContact O-N 2.95Å; L412-A415 PolarHBondContact O-N 2.97Å; L412-I416 HydrophobicContact CD2-CD1 4.31Å; L412-I416 HydrophobicContact CG-CD1 3.86Å; L412-I416 HydrophobicContact CG-CG1 4.32Å; L412-I416 WeakPolarHBondContact O-CG1 3.37Å; L412-I416 PolarHBondContact O-N 3.22Å; L412-I416 VanDerWaalsContact O-N 3.09Å |
| 413 | P | 96.8 | Very high | 95 | Very high | 76 Ų | 76 | 61 Ų | 61 | 49% | 0.494 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -56.3 | -32.5 | 174.4 | -27.9 | 36.8 | 0 | 0 | 0 | 113.9 | P411 I416 I417 | P411-P413 VanDerWaalsContact C-N 3.27Å; P413-I416 PolarHBondContact O-N 3.4Å; P413-I417 WeakPolarHBondContact O-CB 3.16Å; P413-I417 WeakPolarHBondContact O-CD1 3.37Å; P413-I417 WeakPolarHBondContact O-CG1 3.37Å; P413-I417 PolarHBondContact O-N 3.41Å |
| 414 | F | 96.5 | Very high | 95.1 | Very high | 74 Ų | 74 | 57.2 Ų | 57.2 | 33% | 0.325 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -65 | -44.7 | 179.8 | -70.1 | 7.3 | 0 | 0 | 0 | 111 | L79 Y82 P411 L412 Y418 | L79-F414 HydrophobicContact CD2-CB 3.99Å; L79-F414 HydrophobicContact CD2-CD1 3.81Å; L79-F414 HydrophobicContact CD2-CD2 3.81Å; L79-F414 HydrophobicContact CD2-CE1 4.19Å; L79-F414 HydrophobicContact CD2-CE2 4.19Å; L79-F414 HydrophobicContact CD2-CG 3.61Å; L79-F414 HydrophobicContact CD2-CZ 4.37Å; Y82-F414 HydrophobicContact CD1-CD2 4.3Å; P411-F414 HydrophobicContact CB-CD1 4.14Å; P411-F414 HydrophobicContact CB-CD2 4.45Å; P411-F414 HydrophobicContact CB-CE1 4.36Å; P411-F414 HydrophobicContact CB-CG 4.18Å; P411-F414 HydrophobicContact CG-CD1 4.44Å; P411-F414 HydrophobicContact CG-CD2 4.08Å; P411-F414 HydrophobicContact CG-CE1 4.34Å; P411-F414 HydrophobicContact CG-CE2 3.98Å; P411-F414 HydrophobicContact CG-CG 4.31Å; P411-F414 HydrophobicContact CG-CZ 4.12Å; P411-F414 WeakPolarHBondContact O-CB 3.3Å; P411-F414 PolarHBondContact O-N 3.41Å; L412-F414 PolarHBondContact O-N 2.95Å; F414-Y418 VanDerWaalsContact O-CB 3.31Å; F414-Y418 WeakPolarHBondContact O-CB 3.41Å; F414-Y418 PolarHBondContact O-N 3.33Å |
| 415 | A | 96.7 | Very high | 95.2 | Very high | 0 Ų | 0 | 56 Ų | 56 | 0% | 0 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -65.5 | -42.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | V391 V394 I395 L412 Y418 V419 | V391-A415 HydrophobicContact CG1-CB 4.08Å; V394-A415 HydrophobicContact CB-CB 4.28Å; V394-A415 HydrophobicContact CG1-CB 4.21Å; I395-A415 HydrophobicContact CD1-CB 4.24Å; I395-A415 HydrophobicContact CG1-CB 3.78Å; L412-A415 PolarHBondContact O-N 2.97Å; A415-Y418 PolarHBondContact O-N 3.03Å; A415-V419 WeakPolarHBondContact O-CB 3.38Å; A415-V419 WeakPolarHBondContact O-CG2 3.37Å; A415-V419 PolarHBondContact O-N 3.42Å |
| 416 | I | 97.3 | Very high | 95.1 | Very high | 80 Ų | 80 | 50.1 Ų | 50.1 | 41% | 0.41 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -63.2 | -45.4 | 178.6 | -65.9 | 170.2 | 0 | 0 | 0 | 111.3 | I395 L412 P413 T420 | I395-I416 HydrophobicContact CD1-CG1 4.09Å; L412-I416 HydrophobicContact CD2-CD1 4.31Å; L412-I416 HydrophobicContact CG-CD1 3.86Å; L412-I416 HydrophobicContact CG-CG1 4.32Å; L412-I416 WeakPolarHBondContact O-CG1 3.37Å; L412-I416 PolarHBondContact O-N 3.22Å; L412-I416 VanDerWaalsContact O-N 3.09Å; P413-I416 PolarHBondContact O-N 3.4Å; I416-T420 VanDerWaalsContact O-CB 3.3Å; I416-T420 WeakPolarHBondContact O-CB 3.46Å; I416-T420 PolarHBondContact O-N 3.01Å; I416-T420 PolarHBondContact O-OG1 3.48Å |
| 417 | I | 97.6 | Very high | 95.1 | Very high | 79 Ų | 79 | 51.2 Ų | 51.2 | 41% | 0.405 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -62.3 | -46.9 | 177.9 | -70 | 164.9 | 0 | 0 | 0 | 109.8 | L79 P413 V419 T420 I421 | L79-I417 HydrophobicContact CD1-CG2 3.91Å; P413-I417 WeakPolarHBondContact O-CB 3.16Å; P413-I417 WeakPolarHBondContact O-CD1 3.37Å; P413-I417 WeakPolarHBondContact O-CG1 3.37Å; P413-I417 PolarHBondContact O-N 3.41Å; I417-V419 PolarHBondContact O-N 3.09Å; I417-T420 PolarHBondContact O-N 3.46Å; I417-I421 HydrophobicContact CG2-CD1 3.7Å; I417-I421 HydrophobicContact CG2-CG1 4.4Å; I417-I421 WeakPolarHBondContact O-CG1 3.45Å; I417-I421 PolarHBondContact O-N 3.47Å |
| 418 | Y | 97 | Very high | 95.1 | Very high | 0 Ų | 0 | 52 Ų | 52 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -61.3 | -45.6 | -179.1 | -169 | -84.9 | 0 | 0 | 0 | 112.4 | F76 L79 G80 W384 I387 V391 F414 A415 I421 T422 | F76-Y418 HydrophobicContact CD1-CD2 4.47Å; F76-Y418 AromaticContact CD1-CE2 3.69Å; F76-Y418 HydrophobicContact CD1-CE2 3.69Å; F76-Y418 AromaticContact CD2-CD2 3.77Å; F76-Y418 HydrophobicContact CD2-CD2 3.77Å; F76-Y418 AromaticContact CD2-CE2 3.8Å; F76-Y418 HydrophobicContact CD2-CE2 3.8Å; F76-Y418 HydrophobicContact CE1-CD2 4.33Å; F76-Y418 HydrophobicContact CE1-CE1 4.35Å; F76-Y418 AromaticContact CE1-CE2 3.43Å; F76-Y418 HydrophobicContact CE1-CE2 3.43Å; F76-Y418 VanDerWaalsContact CE1-CE2 3.43Å; F76-Y418 AromaticContact CE1-CZ 3.45Å; F76-Y418 VanDerWaalsContact CE1-CZ 3.45Å; F76-Y418 VanDerWaalsContact CE1-OH 3.27Å; F76-Y418 WeakPolarHBondContact CE1-OH 3.3Å; F76-Y418 HydrophobicContact CE2-CD1 4.27Å; F76-Y418 AromaticContact CE2-CD2 3.54Å; F76-Y418 HydrophobicContact CE2-CD2 3.54Å; F76-Y418 HydrophobicContact CE2-CE1 4.23Å; F76-Y418 AromaticContact CE2-CE2 3.5Å; F76-Y418 HydrophobicContact CE2-CE2 3.5Å; F76-Y418 VanDerWaalsContact CE2-CE2 3.5Å; F76-Y418 AromaticContact CE2-CG 3.95Å; F76-Y418 HydrophobicContact CE2-CG 3.95Å; F76-Y418 AromaticContact CE2-CZ 3.87Å; F76-Y418 HydrophobicContact CG-CD2 4.25Å; F76-Y418 AromaticContact CG-CE2 3.9Å; F76-Y418 HydrophobicContact CG-CE2 3.9Å; F76-Y418 HydrophobicContact CZ-CD1 4.24Å; F76-Y418 AromaticContact CZ-CD2 3.87Å; F76-Y418 HydrophobicContact CZ-CD2 3.87Å; F76-Y418 AromaticContact CZ-CE1 3.76Å; F76-Y418 HydrophobicContact CZ-CE1 3.76Å; F76-Y418 AromaticContact CZ-CE2 3.33Å; F76-Y418 HydrophobicContact CZ-CE2 3.33Å; F76-Y418 HydrophobicContact CZ-CG 4.3Å; F76-Y418 AromaticContact CZ-CZ 3.27Å; F76-Y418 WeakPolarHBondContact O-CD2 3.5Å; F76-Y418 WeakPolarHBondContact O-CE2 3.47Å; L79-Y418 HydrophobicContact CB-CD2 4.11Å; G80-Y418 VanDerWaalsContact CA-CD2 3.47Å; G80-Y418 VanDerWaalsContact N-CD2 3.32Å; W384-Y418 WeakPolarHBondContact CZ3-OH 3.46Å; I387-Y418 HydrophobicContact CG2-CE1 4.16Å; I387-Y418 VanDerWaalsContact CG2-OH 3.3Å; I387-Y418 WeakPolarHBondContact CG2-OH 3.47Å; V391-Y418 HydrophobicContact CB-CD1 3.77Å; V391-Y418 HydrophobicContact CB-CE1 4.17Å; V391-Y418 HydrophobicContact CG1-CD1 3.82Å; V391-Y418 HydrophobicContact CG1-CG 4.2Å; V391-Y418 HydrophobicContact CG2-CD1 3.61Å; V391-Y418 HydrophobicContact CG2-CE1 3.61Å; V391-Y418 HydrophobicContact CG2-CG 4.36Å; F414-Y418 VanDerWaalsContact O-CB 3.31Å; F414-Y418 WeakPolarHBondContact O-CB 3.41Å; F414-Y418 PolarHBondContact O-N 3.33Å; A415-Y418 PolarHBondContact O-N 3.03Å; Y418-I421 PolarHBondContact O-N 3.28Å; Y418-T422 WeakPolarHBondContact O-CB 3.46Å; Y418-T422 PolarHBondContact O-N 3.05Å; Y418-T422 PolarHBondContact O-OG1 3.45Å |
| 419 | V | 97.1 | Very high | 94.9 | Very high | 27 Ų | 27 | 51.7 Ų | 51.7 | 16% | 0.164 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -66.4 | -41.8 | 178.8 | 171.9 | 0 | 0 | 0 | 0 | 110.8 | V391 M392 I395 A415 I417 T422 F423 | V391-V419 HydrophobicContact CB-CG2 4.36Å; V391-V419 HydrophobicContact CG1-CG2 4.09Å; M392-V419 HydrophobicContact CB-CG2 4.39Å; M392-V419 HydrophobicContact CG-CB 4.2Å; M392-V419 HydrophobicContact CG-CG1 3.58Å; M392-V419 HydrophobicContact CG-CG2 3.47Å; M392-V419 VanDerWaalsContact CG-CG2 3.47Å; M392-V419 HydrophobicContact SD-CG1 3.76Å; I395-V419 HydrophobicContact CD1-CB 4.41Å; I395-V419 HydrophobicContact CD1-CG2 4.02Å; A415-V419 WeakPolarHBondContact O-CB 3.38Å; A415-V419 WeakPolarHBondContact O-CG2 3.37Å; A415-V419 PolarHBondContact O-N 3.42Å; I417-V419 PolarHBondContact O-N 3.09Å; V419-T422 PolarHBondContact O-N 3.35Å; V419-F423 WeakPolarHBondContact O-CB 3.31Å; V419-F423 PolarHBondContact O-N 2.73Å |
| 420 | T | 97.2 | Very high | 94.7 | Very high | 72 Ų | 72 | 48.8 Ų | 48.8 | 44% | 0.442 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -60.7 | -48 | 175.6 | -57.7 | 0 | 0 | 0 | 0 | 111.4 | I416 I417 T422 F423 L424 | I416-T420 VanDerWaalsContact O-CB 3.3Å; I416-T420 WeakPolarHBondContact O-CB 3.46Å; I416-T420 PolarHBondContact O-N 3.01Å; I416-T420 PolarHBondContact O-OG1 3.48Å; I417-T420 PolarHBondContact O-N 3.46Å; T420-T422 VanDerWaalsContact C-N 3.32Å; T420-T422 PolarHBondContact O-N 3.39Å; T420-F423 PolarHBondContact O-N 3.4Å; T420-L424 HydrophobicContact CG2-CD1 4.28Å; T420-L424 WeakPolarHBondContact O-CG 3.19Å; T420-L424 PolarHBondContact O-N 2.87Å |
| 421 | I | 96.2 | Very high | 94.5 | Very high | 55 Ų | 55 | 53.7 Ų | 53.7 | 28% | 0.282 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -62.8 | -41.5 | 177.4 | -67.9 | 169.7 | 0 | 0 | 0 | 110.4 | F76 I417 Y418 F423 L424 L425 | F76-I421 HydrophobicContact CD2-CB 4.02Å; F76-I421 HydrophobicContact CD2-CD1 4.18Å; F76-I421 HydrophobicContact CD2-CG2 3.58Å; F76-I421 HydrophobicContact CE2-CB 3.78Å; F76-I421 HydrophobicContact CE2-CG2 3.5Å; F76-I421 VanDerWaalsContact CE2-CG2 3.5Å; F76-I421 HydrophobicContact CZ-CG2 4.44Å; I417-I421 HydrophobicContact CG2-CD1 3.7Å; I417-I421 HydrophobicContact CG2-CG1 4.4Å; I417-I421 WeakPolarHBondContact O-CG1 3.45Å; I417-I421 PolarHBondContact O-N 3.47Å; Y418-I421 PolarHBondContact O-N 3.28Å; I421-F423 VanDerWaalsContact C-N 3.31Å; I421-F423 PolarHBondContact O-N 2.98Å; I421-L424 PolarHBondContact O-N 3.42Å; I421-L425 HydrophobicContact CG2-CD1 4.15Å; I421-L425 HydrophobicContact CG2-CG 4.28Å; I421-L425 WeakPolarHBondContact O-CG 3.49Å; I421-L425 PolarHBondContact O-N 2.94Å |
| 422 | T | 95.9 | Very high | 94.1 | Very high | 8 Ų | 8 | 52.3 Ų | 52.3 | 5% | 0.049 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -59.7 | -43.7 | 176.3 | -54.7 | 0 | 0 | 0 | 0 | 111.3 | W384 Y418 V419 T420 L425 V426 | W384-T422 WeakPolarHBondContact O-CG2 3.39Å; Y418-T422 WeakPolarHBondContact O-CB 3.46Å; Y418-T422 PolarHBondContact O-N 3.05Å; Y418-T422 PolarHBondContact O-OG1 3.45Å; V419-T422 PolarHBondContact O-N 3.35Å; T420-T422 VanDerWaalsContact C-N 3.32Å; T420-T422 PolarHBondContact O-N 3.39Å; T422-L425 PolarHBondContact O-N 2.94Å; T422-V426 WeakPolarHBondContact O-CG2 3.48Å; T422-V426 PolarHBondContact O-N 3.01Å |
| 423 | F | 94.4 | Very high | 93.6 | Very high | 133 Ų | 133 | 50 Ų | 50 | 58% | 0.583 | 26% | 0.262 | S | S | * | . | H | α-helix | trans | -64.2 | -41.2 | 177.1 | -176.2 | -106.9 | 0 | 0 | 0 | 112.4 | V419 T420 I421 V426 I427 | V419-F423 WeakPolarHBondContact O-CB 3.31Å; V419-F423 PolarHBondContact O-N 2.73Å; T420-F423 PolarHBondContact O-N 3.4Å; I421-F423 VanDerWaalsContact C-N 3.31Å; I421-F423 PolarHBondContact O-N 2.98Å; F423-V426 WeakPolarHBondContact O-CB 2.99Å; F423-V426 PolarHBondContact O-N 3.33Å; F423-I427 HydrophobicContact CD1-CD1 3.76Å; F423-I427 HydrophobicContact CE1-CD1 3.32Å; F423-I427 HydrophobicContact CE1-CG1 4.34Å; F423-I427 HydrophobicContact CZ-CD1 3.76Å; F423-I427 HydrophobicContact CZ-CG1 4.43Å; F423-I427 WeakPolarHBondContact O-CG1 3.49Å; F423-I427 PolarHBondContact O-N 3.49Å |
| 424 | L | 94.6 | Very high | 93.3 | Very high | 76 Ų | 76 | 49.3 Ų | 49.3 | 40% | 0.398 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -64 | -42.8 | 174.6 | -70.4 | 173.7 | 0 | 0 | 0 | 112.1 | T420 I421 V426 I427 F428 | T420-L424 HydrophobicContact CG2-CD1 4.28Å; T420-L424 WeakPolarHBondContact O-CG 3.19Å; T420-L424 PolarHBondContact O-N 2.87Å; I421-L424 PolarHBondContact O-N 3.42Å; L424-V426 VanDerWaalsContact C-N 3.29Å; L424-V426 PolarHBondContact O-N 2.99Å; L424-I427 PolarHBondContact O-N 2.87Å; L424-F428 WeakPolarHBondContact O-CB 3.13Å; L424-F428 WeakPolarHBondContact O-CD1 3.26Å; L424-F428 WeakPolarHBondContact O-CG 3.45Å; L424-F428 PolarHBondContact O-N 3.49Å |
| 425 | L | 93.4 | Very high | 92.9 | Very high | 9 Ų | 9 | 51.2 Ų | 51.2 | 5% | 0.047 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -58.8 | -43.1 | 175.3 | -73.4 | 174.7 | 0 | 0 | 0 | 110.9 | A223 F226 Y227 L230 I421 T422 F428 T429 | A223-L425 HydrophobicContact CB-CD2 4.38Å; F226-L425 HydrophobicContact CB-CD2 3.83Å; F226-L425 HydrophobicContact CD1-CD1 3.7Å; F226-L425 HydrophobicContact CD1-CD2 3.96Å; F226-L425 HydrophobicContact CD1-CG 4.45Å; F226-L425 HydrophobicContact CE1-CD1 4.12Å; F226-L425 HydrophobicContact CG-CD2 3.99Å; Y227-L425 HydrophobicContact CE1-CD1 4.49Å; L230-L425 HydrophobicContact CD1-CD1 4.34Å; I421-L425 HydrophobicContact CG2-CD1 4.15Å; I421-L425 HydrophobicContact CG2-CG 4.28Å; I421-L425 WeakPolarHBondContact O-CG 3.49Å; I421-L425 PolarHBondContact O-N 2.94Å; T422-L425 PolarHBondContact O-N 2.94Å; L425-F428 PolarHBondContact O-N 2.99Å; L425-T429 WeakPolarHBondContact O-CB 3.3Å; L425-T429 PolarHBondContact O-N 2.87Å; L425-T429 PolarHBondContact O-OG1 3.24Å |
| 426 | V | 91 | Very high | 92.2 | Very high | 22 Ų | 22 | 52.6 Ų | 52.6 | 13% | 0.133 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -57.8 | -51.9 | 174.9 | 166.7 | 0 | 0 | 0 | 0 | 110.7 | F381 L385 T422 F423 L424 F428 T429 F430 | F381-V426 HydrophobicContact CE2-CB 4.41Å; F381-V426 HydrophobicContact CE2-CG1 4.01Å; F381-V426 HydrophobicContact CE2-CG2 4.18Å; L385-V426 HydrophobicContact CD1-CG2 4.06Å; T422-V426 WeakPolarHBondContact O-CG2 3.48Å; T422-V426 PolarHBondContact O-N 3.01Å; F423-V426 WeakPolarHBondContact O-CB 2.99Å; F423-V426 PolarHBondContact O-N 3.33Å; L424-V426 VanDerWaalsContact C-N 3.29Å; L424-V426 PolarHBondContact O-N 2.99Å; V426-F428 PolarHBondContact O-N 3.45Å; V426-T429 PolarHBondContact O-N 3.5Å; V426-F430 HydrophobicContact CG1-CD2 4.02Å; V426-F430 HydrophobicContact CG1-CE2 3.96Å; V426-F430 VanDerWaalsContact O-CD2 3.29Å; V426-F430 WeakPolarHBondContact O-CD2 3.22Å; V426-F430 PolarHBondContact O-N 3.18Å |
| 427 | I | 92.9 | Very high | 91.7 | Very high | 64 Ų | 64 | 48.8 Ų | 48.8 | 33% | 0.328 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -58.6 | -48.4 | 179.1 | -67.9 | 169.6 | 0 | 0 | 0 | 111 | F423 L424 T429 F430 I431 | F423-I427 HydrophobicContact CD1-CD1 3.76Å; F423-I427 HydrophobicContact CE1-CD1 3.32Å; F423-I427 HydrophobicContact CE1-CG1 4.34Å; F423-I427 HydrophobicContact CZ-CD1 3.76Å; F423-I427 HydrophobicContact CZ-CG1 4.43Å; F423-I427 WeakPolarHBondContact O-CG1 3.49Å; F423-I427 PolarHBondContact O-N 3.49Å; L424-I427 PolarHBondContact O-N 2.87Å; I427-T429 VanDerWaalsContact C-N 3.26Å; I427-T429 PolarHBondContact O-N 2.96Å; I427-F430 PolarHBondContact O-N 2.88Å; I427-I431 HydrophobicContact CG2-CD1 4.02Å; I427-I431 WeakPolarHBondContact O-CG1 3.29Å; I427-I431 PolarHBondContact O-N 3.04Å; I427-I431 VanDerWaalsContact O-N 3.15Å |
| 428 | F | 93.3 | Very high | 91.3 | Very high | 61 Ų | 61 | 49.8 Ų | 49.8 | 27% | 0.268 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -65.2 | -33.7 | -176.9 | -77.5 | 15 | 0 | 0 | 0 | 111.8 | P219 G220 A223 L424 L425 V426 I431 G432 | P219-F428 HydrophobicContact CB-CB 4.29Å; P219-F428 HydrophobicContact CB-CD1 3.8Å; P219-F428 HydrophobicContact CB-CD2 3.62Å; P219-F428 HydrophobicContact CB-CE1 3.93Å; P219-F428 HydrophobicContact CB-CE2 3.75Å; P219-F428 HydrophobicContact CB-CG 3.64Å; P219-F428 HydrophobicContact CB-CZ 3.9Å; P219-F428 HydrophobicContact CG-CE1 4.49Å; P219-F428 HydrophobicContact CG-CE2 4.39Å; P219-F428 HydrophobicContact CG-CZ 4.29Å; P219-F428 WeakPolarHBondContact O-CB 3.44Å; P219-F428 WeakPolarHBondContact O-CD2 3.49Å; G220-F428 WeakPolarHBondContact CA-O 3.5Å; A223-F428 HydrophobicContact CB-CB 3.73Å; L424-F428 WeakPolarHBondContact O-CB 3.13Å; L424-F428 WeakPolarHBondContact O-CD1 3.26Å; L424-F428 WeakPolarHBondContact O-CG 3.45Å; L424-F428 PolarHBondContact O-N 3.49Å; L425-F428 PolarHBondContact O-N 2.99Å; V426-F428 PolarHBondContact O-N 3.45Å; F428-I431 PolarHBondContact O-N 3.34Å; F428-G432 PolarHBondContact O-N 3.33Å |
| 429 | T | 88.3 | Confident | 90.8 | Very high | 1 Ų | 1 | 53.9 Ų | 53.9 | 1% | 0.006 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -69 | -40 | 175.3 | -49.4 | 0 | 0 | 0 | 0 | 111.4 | Y227 T377 F381 L425 V426 I427 I431 G432 A433 S437 | Y227-T429 HydrophobicContact CE2-CG2 3.74Å; Y227-T429 WeakPolarHBondContact CE2-OG1 3.39Å; Y227-T429 PolarHBondContact OH-OG1 3.42Å; T377-T429 HydrophobicContact CG2-CG2 4.28Å; F381-T429 HydrophobicContact CD2-CG2 4.21Å; L425-T429 WeakPolarHBondContact O-CB 3.3Å; L425-T429 PolarHBondContact O-N 2.87Å; L425-T429 PolarHBondContact O-OG1 3.24Å; V426-T429 PolarHBondContact O-N 3.5Å; I427-T429 VanDerWaalsContact C-N 3.26Å; I427-T429 PolarHBondContact O-N 2.96Å; T429-I431 PolarHBondContact O-N 2.73Å; T429-G432 PolarHBondContact O-N 2.94Å; T429-A433 HydrophobicContact CG2-CB 4.11Å; T429-A433 CarbonylContact O-C 3.49Å; T429-A433 VanDerWaalsContact O-C 3.27Å; T429-A433 WeakPolarHBondContact O-CA 3.22Å; T429-A433 PolarHBondContact O-N 3.48Å; T429-S437 VanDerWaalsContact C-OG 3.31Å; T429-S437 WeakPolarHBondContact CG2-OG 3.42Å; T429-S437 PolarHBondContact O-OG 3.03Å |
| 430 | F | 90.1 | Very high | 90.2 | Very high | 80 Ų | 80 | 52.6 Ų | 52.6 | 35% | 0.351 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -61.3 | -31.1 | 172.9 | -87.9 | -76.1 | 0 | 0 | 0 | 112.7 | F381 V426 I427 P434 S437 V441 | F381-F430 HydrophobicContact CE2-CD2 4.28Å; F381-F430 AromaticContact CE2-CE2 3.75Å; F381-F430 HydrophobicContact CE2-CE2 3.75Å; F381-F430 HydrophobicContact CE2-CZ 4.42Å; F381-F430 AromaticContact CZ-CE2 3.8Å; F381-F430 HydrophobicContact CZ-CE2 3.8Å; F381-F430 HydrophobicContact CZ-CZ 4.13Å; V426-F430 HydrophobicContact CG1-CD2 4.02Å; V426-F430 HydrophobicContact CG1-CE2 3.96Å; V426-F430 VanDerWaalsContact O-CD2 3.29Å; V426-F430 WeakPolarHBondContact O-CD2 3.22Å; V426-F430 PolarHBondContact O-N 3.18Å; I427-F430 PolarHBondContact O-N 2.88Å; F430-P434 WeakPolarHBondContact O-CB 3.38Å; F430-S437 VanDerWaalsContact CE1-CB 3.47Å; F430-S437 PolarHBondContact N-OG 3.17Å; F430-V441 HydrophobicContact CZ-CG2 3.95Å |
| 431 | I | 89.1 | Confident | 89.9 | Confident | 105 Ų | 105 | 51.5 Ų | 51.5 | 54% | 0.538 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -74.9 | -44.7 | 175.7 | -63.5 | 166.9 | 0 | 0 | 0 | 111.2 | I427 F428 T429 | I427-I431 HydrophobicContact CG2-CD1 4.02Å; I427-I431 WeakPolarHBondContact O-CG1 3.29Å; I427-I431 PolarHBondContact O-N 3.04Å; I427-I431 VanDerWaalsContact O-N 3.15Å; F428-I431 PolarHBondContact O-N 3.34Å; T429-I431 PolarHBondContact O-N 2.73Å |
| 432 | G | 85.6 | Confident | 89.6 | Confident | 26 Ų | 26 | 54.1 Ų | 54.1 | 27% | 0.268 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -91.5 | -19.4 | -172.9 | 0 | 0 | 0 | 0 | 0 | 116.6 | K224 F428 T429 | K224-G432 VanDerWaalsContact CE-O 3.26Å; K224-G432 WeakPolarHBondContact CE-O 3.36Å; K224-G432 PolarHBondContact NZ-O 3.47Å; K224-G432 VanDerWaalsContact NZ-O 3.09Å; F428-G432 PolarHBondContact O-N 3.33Å; T429-G432 PolarHBondContact O-N 2.94Å |
| 433 | A | 85.5 | Confident | 89.1 | Confident | 1 Ų | 1 | 55.8 Ų | 55.8 | 1% | 0.008 | 29% | 0.29 | C | S | . | . | trans | -151.1 | 60.1 | -171.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | T377 T429 I435 E436 S437 | T377-A433 HydrophobicContact CG2-CB 4.09Å; T429-A433 HydrophobicContact CG2-CB 4.11Å; T429-A433 CarbonylContact O-C 3.49Å; T429-A433 VanDerWaalsContact O-C 3.27Å; T429-A433 WeakPolarHBondContact O-CA 3.22Å; T429-A433 PolarHBondContact O-N 3.48Å; A433-I435 PolarHBondContact O-N 3.12Å; A433-E436 WeakPolarHBondContact CA-OE2 3.3Å; A433-E436 HydrophobicContact CB-CB 4.06Å; A433-E436 HydrophobicContact CB-CG 4.33Å; A433-E436 WeakPolarHBondContact CB-OE2 3.3Å; A433-E436 PolarHBondContact O-N 2.91Å; A433-S437 WeakPolarHBondContact O-CB 3.23Å; A433-S437 PolarHBondContact O-N 2.93Å; A433-S437 PolarHBondContact O-OG 3.47Å | ||
| 434 | P | 89.2 | Confident | 88.9 | Confident | 62 Ų | 62 | 50.9 Ų | 50.9 | 40% | 0.403 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -64.8 | -39 | -172 | 24.2 | -33.3 | 0 | 0 | 0 | 112.5 | F430 E436 S437 L438 | F430-P434 WeakPolarHBondContact O-CB 3.38Å; P434-E436 VanDerWaalsContact C-N 3.29Å; P434-E436 PolarHBondContact O-N 2.95Å; P434-S437 PolarHBondContact O-N 3.36Å; P434-L438 WeakPolarHBondContact O-CB 3.45Å; P434-L438 WeakPolarHBondContact O-CD1 3.46Å; P434-L438 WeakPolarHBondContact O-CG 3.42Å; P434-L438 PolarHBondContact O-N 3.04Å |
| 435 | I | 87.5 | Confident | 88.8 | Confident | 114 Ų | 114 | 51.3 Ų | 51.3 | 59% | 0.585 | 27% | 0.272 | S | S | * | . | H | α-helix | trans | -63.4 | -43.7 | 178.9 | -62 | 175.1 | 0 | 0 | 0 | 109 | A433 L438 M439 | A433-I435 PolarHBondContact O-N 3.12Å; I435-L438 PolarHBondContact O-N 3.38Å; I435-M439 HydrophobicContact CG2-SD 4.26Å; I435-M439 WeakPolarHBondContact O-CG 3.15Å; I435-M439 PolarHBondContact O-N 3.4Å |
| 436 | E | 83.9 | Confident | 88.8 | Confident | 30 Ų | 30 | 53.9 Ų | 53.9 | 14% | 0.14 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -66.7 | -42.3 | -179.2 | -56.4 | 89.4 | 148.2 | 0 | 0 | 112.6 | T377 Y378 A433 P434 M439 G440 | T377-E436 HydrophobicContact CG2-CB 4.26Å; Y378-E436 VanDerWaalsContact CD1-CA 3.43Å; Y378-E436 HydrophobicContact CD1-CB 3.6Å; Y378-E436 HydrophobicContact CD1-CG 4.08Å; Y378-E436 VanDerWaalsContact CD1-O 3.26Å; Y378-E436 WeakPolarHBondContact CD1-O 3.42Å; Y378-E436 HydrophobicContact CE1-CB 3.5Å; Y378-E436 VanDerWaalsContact CE1-CB 3.5Å; Y378-E436 HydrophobicContact CE1-CG 3.5Å; Y378-E436 HydrophobicContact CE2-CG 4.21Å; Y378-E436 HydrophobicContact CG-CB 4.26Å; Y378-E436 VanDerWaalsContact CZ-CG 3.49Å; A433-E436 WeakPolarHBondContact CA-OE2 3.3Å; A433-E436 HydrophobicContact CB-CB 4.06Å; A433-E436 HydrophobicContact CB-CG 4.33Å; A433-E436 WeakPolarHBondContact CB-OE2 3.3Å; A433-E436 PolarHBondContact O-N 2.91Å; P434-E436 VanDerWaalsContact C-N 3.29Å; P434-E436 PolarHBondContact O-N 2.95Å; E436-M439 PolarHBondContact O-N 3.46Å; E436-G440 PolarHBondContact O-N 3.14Å |
| 437 | S | 85.9 | Confident | 88.9 | Confident | 0 Ų | 0 | 52.9 Ų | 52.9 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -62.7 | -45 | 174.6 | -54.6 | 0 | 0 | 0 | 0 | 111.5 | T429 F430 A433 P434 G440 V441 | T429-S437 VanDerWaalsContact C-OG 3.31Å; T429-S437 WeakPolarHBondContact CG2-OG 3.42Å; T429-S437 PolarHBondContact O-OG 3.03Å; F430-S437 VanDerWaalsContact CE1-CB 3.47Å; F430-S437 PolarHBondContact N-OG 3.17Å; A433-S437 WeakPolarHBondContact O-CB 3.23Å; A433-S437 PolarHBondContact O-N 2.93Å; A433-S437 PolarHBondContact O-OG 3.47Å; P434-S437 PolarHBondContact O-N 3.36Å; S437-G440 PolarHBondContact O-N 3.38Å; S437-V441 WeakPolarHBondContact O-CG2 3.3Å; S437-V441 PolarHBondContact O-N 2.99Å |
| 438 | L | 89.5 | Confident | 89 | Confident | 99 Ų | 99 | 52.5 Ų | 52.5 | 52% | 0.518 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -62.5 | -44 | 178.4 | -76.5 | 166.3 | 0 | 0 | 0 | 111.9 | P434 I435 G440 V441 L442 | P434-L438 WeakPolarHBondContact O-CB 3.45Å; P434-L438 WeakPolarHBondContact O-CD1 3.46Å; P434-L438 WeakPolarHBondContact O-CG 3.42Å; P434-L438 PolarHBondContact O-N 3.04Å; I435-L438 PolarHBondContact O-N 3.38Å; L438-G440 VanDerWaalsContact C-N 3.32Å; L438-G440 PolarHBondContact O-N 3.44Å; L438-V441 PolarHBondContact O-N 2.95Å; L438-L442 VanDerWaalsContact O-CG 3.32Å; L438-L442 WeakPolarHBondContact O-CG 3.42Å; L438-L442 PolarHBondContact O-N 3.43Å |
| 439 | M | 85.5 | Confident | 89 | Confident | 87 Ų | 87 | 52.6 Ų | 52.6 | 43% | 0.429 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -61.6 | -41.4 | 175.1 | -73.5 | -177.4 | 66.3 | 0 | 0 | 111.6 | Y378 I435 E436 V441 L442 I443 | Y378-M439 HydrophobicContact CD1-CB 3.83Å; Y378-M439 HydrophobicContact CD1-SD 4.46Å; Y378-M439 HydrophobicContact CE1-CB 3.82Å; Y378-M439 HydrophobicContact CE1-CE 4.15Å; Y378-M439 HydrophobicContact CE1-CG 4.2Å; Y378-M439 HydrophobicContact CE1-SD 3.56Å; Y378-M439 VanDerWaalsContact CE1-SD 3.56Å; I435-M439 HydrophobicContact CG2-SD 4.26Å; I435-M439 WeakPolarHBondContact O-CG 3.15Å; I435-M439 PolarHBondContact O-N 3.4Å; E436-M439 PolarHBondContact O-N 3.46Å; M439-V441 PolarHBondContact O-N 2.87Å; M439-L442 PolarHBondContact O-N 3.21Å; M439-I443 VanDerWaalsContact O-CG1 3.28Å; M439-I443 WeakPolarHBondContact O-CG1 3.34Å; M439-I443 PolarHBondContact O-N 2.95Å |
| 440 | G | 85.7 | Confident | 89.3 | Confident | 0 Ų | 0 | 55.3 Ų | 55.3 | 0% | 0 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -57.5 | -48 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | E436 S437 L438 I443 I444 | E436-G440 PolarHBondContact O-N 3.14Å; S437-G440 PolarHBondContact O-N 3.38Å; L438-G440 VanDerWaalsContact C-N 3.32Å; L438-G440 PolarHBondContact O-N 3.44Å; G440-I443 PolarHBondContact O-N 2.81Å; G440-I444 WeakPolarHBondContact O-CG1 3.21Å; G440-I444 PolarHBondContact O-N 3.33Å; G440-I444 VanDerWaalsContact O-N 3.11Å |
| 441 | V | 90 | Very high | 89.5 | Confident | 48 Ų | 48 | 52.9 Ų | 52.9 | 29% | 0.291 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -61.7 | -45.9 | 176.2 | 173.7 | 0 | 0 | 0 | 0 | 111.6 | F381 F430 S437 L438 M439 I443 I444 L445 | F381-V441 HydrophobicContact CE1-CG2 3.95Å; F381-V441 HydrophobicContact CZ-CG2 3.98Å; F430-V441 HydrophobicContact CZ-CG2 3.95Å; S437-V441 WeakPolarHBondContact O-CG2 3.3Å; S437-V441 PolarHBondContact O-N 2.99Å; L438-V441 PolarHBondContact O-N 2.95Å; M439-V441 PolarHBondContact O-N 2.87Å; V441-I443 VanDerWaalsContact C-N 3.29Å; V441-I443 PolarHBondContact O-N 3.31Å; V441-I444 WeakPolarHBondContact O-CB 3.17Å; V441-I444 PolarHBondContact O-N 3.42Å; V441-I444 VanDerWaalsContact O-N 3.16Å; V441-L445 HydrophobicContact CG1-CD1 3.87Å; V441-L445 HydrophobicContact CG1-CG 4.17Å; V441-L445 VanDerWaalsContact O-CG 3.32Å; V441-L445 WeakPolarHBondContact O-CG 3.42Å; V441-L445 PolarHBondContact O-N 3.49Å |
| 442 | L | 90.3 | Very high | 89.7 | Confident | 110 Ų | 110 | 52.2 Ų | 52.2 | 58% | 0.576 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -57.8 | -43.7 | 179.1 | -74.7 | 171.8 | 0 | 0 | 0 | 111.5 | L438 M439 I444 L445 T446 | L438-L442 VanDerWaalsContact O-CG 3.32Å; L438-L442 WeakPolarHBondContact O-CG 3.42Å; L438-L442 PolarHBondContact O-N 3.43Å; M439-L442 PolarHBondContact O-N 3.21Å; L442-I444 PolarHBondContact O-N 3.2Å; L442-L445 PolarHBondContact O-N 2.8Å; L442-T446 VanDerWaalsContact O-CG2 3.3Å; L442-T446 WeakPolarHBondContact O-CG2 3.31Å; L442-T446 PolarHBondContact O-N 3.02Å |
| 443 | I | 85.5 | Confident | 89.9 | Confident | 44 Ų | 44 | 55.3 Ų | 55.3 | 23% | 0.226 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -65.4 | -40.3 | 178.7 | -62.6 | 164 | 0 | 0 | 0 | 111.1 | W115 V120 M439 G440 V441 L445 T446 | W115-I443 PolarHBondContact NE1-O 3.36Å; V120-I443 HydrophobicContact CG2-CB 4.34Å; V120-I443 HydrophobicContact CG2-CG2 3.26Å; M439-I443 VanDerWaalsContact O-CG1 3.28Å; M439-I443 WeakPolarHBondContact O-CG1 3.34Å; M439-I443 PolarHBondContact O-N 2.95Å; G440-I443 PolarHBondContact O-N 2.81Å; V441-I443 VanDerWaalsContact C-N 3.29Å; V441-I443 PolarHBondContact O-N 3.31Å; I443-L445 VanDerWaalsContact C-N 3.3Å; I443-L445 PolarHBondContact O-N 2.85Å; I443-T446 PolarHBondContact O-N 3.41Å; I443-T446 PolarHBondContact O-OG1 3.44Å |
| 444 | I | 89.9 | Confident | 90.1 | Very high | 29 Ų | 29 | 56.9 Ų | 56.9 | 15% | 0.149 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -59.2 | -45.8 | 173 | -64.1 | 167.7 | 0 | 0 | 0 | 110.2 | I116 V382 L385 G440 V441 L442 T446 G447 | I116-I444 HydrophobicContact CD1-CD1 4.22Å; I116-I444 HydrophobicContact CD1-CG1 3.86Å; I116-I444 HydrophobicContact CD1-CG2 4.21Å; I116-I444 HydrophobicContact CG1-CG1 3.92Å; V382-I444 HydrophobicContact CG1-CD1 4.09Å; V382-I444 HydrophobicContact CG1-CG1 3.97Å; V382-I444 HydrophobicContact CG2-CD1 4.25Å; V382-I444 HydrophobicContact CG2-CG1 4.4Å; L385-I444 HydrophobicContact CD2-CD1 4.04Å; G440-I444 WeakPolarHBondContact O-CG1 3.21Å; G440-I444 PolarHBondContact O-N 3.33Å; G440-I444 VanDerWaalsContact O-N 3.11Å; V441-I444 WeakPolarHBondContact O-CB 3.17Å; V441-I444 PolarHBondContact O-N 3.42Å; V441-I444 VanDerWaalsContact O-N 3.16Å; L442-I444 PolarHBondContact O-N 3.2Å; I444-T446 VanDerWaalsContact C-N 3.27Å; I444-T446 PolarHBondContact O-N 3.24Å; I444-G447 PolarHBondContact O-N 3.22Å |
| 445 | L | 92.6 | Very high | 89.9 | Confident | 85 Ų | 85 | 55.7 Ų | 55.7 | 45% | 0.445 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -64.3 | -28.8 | -179.9 | -68.5 | 176.3 | 0 | 0 | 0 | 112.8 | V441 L442 I443 G447 I448 P449 | V441-L445 HydrophobicContact CG1-CD1 3.87Å; V441-L445 HydrophobicContact CG1-CG 4.17Å; V441-L445 VanDerWaalsContact O-CG 3.32Å; V441-L445 WeakPolarHBondContact O-CG 3.42Å; V441-L445 PolarHBondContact O-N 3.49Å; L442-L445 PolarHBondContact O-N 2.8Å; I443-L445 VanDerWaalsContact C-N 3.3Å; I443-L445 PolarHBondContact O-N 2.85Å; L445-G447 PolarHBondContact O-N 3.21Å; L445-I448 HydrophobicContact CD2-CD1 3.67Å; L445-I448 WeakPolarHBondContact O-CB 3.36Å; L445-I448 PolarHBondContact O-N 3.22Å; L445-P449 WeakPolarHBondContact O-CD 3.04Å |
| 446 | T | 93.4 | Very high | 90 | Very high | 64 Ų | 64 | 53.9 Ų | 53.9 | 39% | 0.393 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -61.9 | -21.8 | 172.8 | 68.5 | 0 | 0 | 0 | 0 | 113.3 | W115 L442 I443 I444 I448 P449 V450 | W115-T446 PolarHBondContact NE1-OG1 3.14Å; L442-T446 VanDerWaalsContact O-CG2 3.3Å; L442-T446 WeakPolarHBondContact O-CG2 3.31Å; L442-T446 PolarHBondContact O-N 3.02Å; I443-T446 PolarHBondContact O-N 3.41Å; I443-T446 PolarHBondContact O-OG1 3.44Å; I444-T446 VanDerWaalsContact C-N 3.27Å; I444-T446 PolarHBondContact O-N 3.24Å; T446-I448 PolarHBondContact O-N 2.9Å; T446-P449 VanDerWaalsContact O-CD 3.25Å; T446-P449 WeakPolarHBondContact O-CD 3.48Å; T446-P449 WeakPolarHBondContact O-CG 3.36Å; T446-V450 WeakPolarHBondContact O-CG2 3.36Å |
| 447 | G | 92.8 | Very high | 90.2 | Very high | 0 Ų | 0 | 58 Ų | 58 | 0% | 0 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -65.6 | -27.7 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | F111 W115 I444 L445 Y451 | F111-G447 VanDerWaalsContact CE1-O 3.26Å; F111-G447 WeakPolarHBondContact CE1-O 3.37Å; W115-G447 VanDerWaalsContact CD1-CA 3.43Å; I444-G447 PolarHBondContact O-N 3.22Å; L445-G447 PolarHBondContact O-N 3.21Å; G447-Y451 WeakPolarHBondContact O-CB 3.41Å; G447-Y451 PolarHBondContact O-N 2.81Å |
| 448 | I | 94.7 | Very high | 90 | Very high | 56 Ų | 56 | 66.7 Ų | 66.7 | 29% | 0.287 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -65.5 | -56.5 | -178.4 | -55.6 | 179.9 | 0 | 0 | 0 | 112.3 | F108 L112 L445 T446 V450 Y451 L452 | F108-I448 HydrophobicContact CE2-CG1 4.17Å; F108-I448 HydrophobicContact CE2-CG2 4.36Å; F108-I448 HydrophobicContact CZ-CD1 4.31Å; F108-I448 HydrophobicContact CZ-CG1 3.99Å; L112-I448 HydrophobicContact CD2-CG1 4.19Å; L445-I448 HydrophobicContact CD2-CD1 3.67Å; L445-I448 WeakPolarHBondContact O-CB 3.36Å; L445-I448 PolarHBondContact O-N 3.22Å; T446-I448 PolarHBondContact O-N 2.9Å; I448-V450 VanDerWaalsContact C-N 3.26Å; I448-V450 PolarHBondContact O-N 3.4Å; I448-Y451 WeakPolarHBondContact O-CB 3.32Å; I448-Y451 PolarHBondContact O-N 3.43Å; I448-L452 HydrophobicContact CG2-CD1 4.18Å; I448-L452 WeakPolarHBondContact O-CG 3.42Å; I448-L452 PolarHBondContact O-N 2.99Å |
| 449 | P | 94.8 | Very high | 89.8 | Confident | 64 Ų | 64 | 68.8 Ų | 68.8 | 42% | 0.416 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -62 | -36.2 | 178.6 | 23.9 | -33.3 | 0 | 0 | 0 | 111.6 | L445 T446 Y451 L452 I453 | L445-P449 WeakPolarHBondContact O-CD 3.04Å; T446-P449 VanDerWaalsContact O-CD 3.25Å; T446-P449 WeakPolarHBondContact O-CD 3.48Å; T446-P449 WeakPolarHBondContact O-CG 3.36Å; P449-Y451 PolarHBondContact O-N 3.4Å; P449-L452 PolarHBondContact O-N 3.13Å; P449-I453 WeakPolarHBondContact O-CB 3.48Å; P449-I453 VanDerWaalsContact O-CG1 3.26Å; P449-I453 WeakPolarHBondContact O-CG1 3.5Å; P449-I453 PolarHBondContact O-N 3.04Å |
| 450 | V | 93.4 | Very high | 89.8 | Confident | 58 Ų | 58 | 67 Ų | 67 | 35% | 0.352 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -65.5 | -39.3 | 176.9 | -178.2 | 0 | 0 | 0 | 0 | 111.3 | F111 W115 T446 I448 G454 | F111-V450 HydrophobicContact CZ-CB 4.39Å; F111-V450 HydrophobicContact CZ-CG1 3.99Å; W115-V450 HydrophobicContact CE3-CG1 4.32Å; W115-V450 HydrophobicContact CH2-CB 4.14Å; W115-V450 HydrophobicContact CH2-CG1 4.01Å; W115-V450 HydrophobicContact CH2-CG2 3.72Å; W115-V450 HydrophobicContact CZ2-CG2 4.08Å; W115-V450 HydrophobicContact CZ3-CB 4.12Å; W115-V450 HydrophobicContact CZ3-CG1 3.65Å; W115-V450 HydrophobicContact CZ3-CG2 4.22Å; T446-V450 WeakPolarHBondContact O-CG2 3.36Å; I448-V450 VanDerWaalsContact C-N 3.26Å; I448-V450 PolarHBondContact O-N 3.4Å; V450-G454 VanDerWaalsContact O-CA 3.32Å; V450-G454 WeakPolarHBondContact O-CA 3.07Å; V450-G454 PolarHBondContact O-N 3.35Å |
| 451 | Y | 93.8 | Very high | 90 | Very high | 28 Ų | 28 | 70 Ų | 70 | 11% | 0.11 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -63 | -44.6 | 173.6 | 179.6 | -105.8 | 0 | 0 | 0 | 112.4 | S107 F108 F111 G447 I448 P449 C455 V456 | S107-Y451 WeakPolarHBondContact CB-OH 3.45Å; S107-Y451 PolarHBondContact OG-OH 3.11Å; F108-Y451 HydrophobicContact CB-CE1 3.98Å; F108-Y451 AromaticContact CD2-CD1 3.5Å; F108-Y451 HydrophobicContact CD2-CD1 3.5Å; F108-Y451 AromaticContact CD2-CE1 3.68Å; F108-Y451 HydrophobicContact CD2-CE1 3.68Å; F108-Y451 HydrophobicContact CD2-CG 4.02Å; F108-Y451 HydrophobicContact CE2-CD1 4.15Å; F108-Y451 HydrophobicContact CG-CE1 4.3Å; F108-Y451 PolarHBondContact N-OH 3.47Å; F111-Y451 HydrophobicContact CB-CD2 3.47Å; F111-Y451 VanDerWaalsContact CB-CD2 3.47Å; F111-Y451 HydrophobicContact CB-CE2 3.78Å; F111-Y451 HydrophobicContact CB-CG 4.41Å; F111-Y451 AromaticContact CD1-CD2 3.74Å; F111-Y451 HydrophobicContact CD1-CD2 3.74Å; F111-Y451 HydrophobicContact CD1-CG 4.06Å; F111-Y451 AromaticContact CD2-CD2 3.81Å; F111-Y451 HydrophobicContact CD2-CD2 3.81Å; F111-Y451 HydrophobicContact CE1-CD2 4.46Å; F111-Y451 HydrophobicContact CE2-CD2 4.49Å; F111-Y451 AromaticContact CG-CD2 3.38Å; F111-Y451 HydrophobicContact CG-CD2 3.38Å; F111-Y451 HydrophobicContact CG-CE2 4.16Å; F111-Y451 HydrophobicContact CG-CG 4.17Å; G447-Y451 WeakPolarHBondContact O-CB 3.41Å; G447-Y451 PolarHBondContact O-N 2.81Å; I448-Y451 WeakPolarHBondContact O-CB 3.32Å; I448-Y451 PolarHBondContact O-N 3.43Å; P449-Y451 PolarHBondContact O-N 3.4Å; Y451-C455 HydrophobicContact CD2-CB 3.79Å; Y451-C455 HydrophobicContact CE2-CB 3.72Å; Y451-C455 WeakPolarHBondContact O-CA 3.49Å; Y451-C455 WeakPolarHBondContact O-CB 3.27Å; Y451-C455 PolarHBondContact O-N 2.85Å; Y451-V456 HydrophobicContact CD1-CG2 3.78Å; Y451-V456 HydrophobicContact CE1-CG2 3.39Å; Y451-V456 PolarHBondContact O-N 2.99Å |
| 452 | L | 93.5 | Very high | 89.9 | Confident | 91 Ų | 91 | 76.3 Ų | 76.3 | 48% | 0.476 | 40% | 0.398 | S | S | . | . | I | π-helix | trans | -63.5 | -46.3 | -179.6 | -67.2 | 174.4 | 0 | 0 | 0 | 111.4 | I448 P449 V456 W457 | I448-L452 HydrophobicContact CG2-CD1 4.18Å; I448-L452 WeakPolarHBondContact O-CG 3.42Å; I448-L452 PolarHBondContact O-N 2.99Å; P449-L452 PolarHBondContact O-N 3.13Å; L452-V456 HydrophobicContact CD2-CB 4.45Å; L452-V456 HydrophobicContact CD2-CG2 4.17Å; L452-V456 PolarHBondContact O-N 3.27Å; L452-W457 WeakPolarHBondContact O-CB 3.36Å; L452-W457 PolarHBondContact O-N 2.92Å |
| 453 | I | 91.4 | Very high | 89.9 | Confident | 92 Ų | 92 | 76.9 Ų | 76.9 | 47% | 0.472 | 41% | 0.406 | S | S | . | . | I | π-helix | trans | -72.3 | -41 | 179.4 | -64.5 | 167.4 | 0 | 0 | 0 | 111.2 | P449 W457 K460 | P449-I453 WeakPolarHBondContact O-CB 3.48Å; P449-I453 VanDerWaalsContact O-CG1 3.26Å; P449-I453 WeakPolarHBondContact O-CG1 3.5Å; P449-I453 PolarHBondContact O-N 3.04Å; I453-W457 HydrophobicContact CG2-CE3 4.2Å; I453-W457 HydrophobicContact CG2-CZ3 4.48Å; I453-K460 WeakPolarHBondContact O-CE 3.41Å; I453-K460 PolarHBondContact O-NZ 2.94Å |
| 454 | G | 88 | Confident | 90.1 | Very high | 33 Ų | 33 | 79.1 Ų | 79.1 | 34% | 0.34 | 41% | 0.414 | S | S | . | . | I | π-helix | trans | -76.8 | -52.5 | -173.3 | 0 | 0 | 0 | 0 | 0 | 113 | V450 K460 | V450-G454 VanDerWaalsContact O-CA 3.32Å; V450-G454 WeakPolarHBondContact O-CA 3.07Å; V450-G454 PolarHBondContact O-N 3.35Å; G454-K460 PolarHBondContact O-NZ 3.28Å |
| 455 | C | 86.5 | Confident | 89.9 | Confident | 37 Ų | 37 | 82.4 Ų | 82.4 | 25% | 0.25 | 43% | 0.429 | C | S | . | . | I | π-helix | trans | -106.4 | -42 | -166.3 | -57.1 | 0 | 0 | 0 | 0 | 113 | Y451 | Y451-C455 HydrophobicContact CD2-CB 3.79Å; Y451-C455 HydrophobicContact CE2-CB 3.72Å; Y451-C455 WeakPolarHBondContact O-CA 3.49Å; Y451-C455 WeakPolarHBondContact O-CB 3.27Å; Y451-C455 PolarHBondContact O-N 2.85Å |
| 456 | V | 88.9 | Confident | 89.8 | Confident | 76 Ų | 76 | 87 Ų | 87 | 46% | 0.461 | 44% | 0.441 | S | S | . | . | I | π-helix | trans | -80.8 | -37.7 | -174.8 | -178.3 | 0 | 0 | 0 | 0 | 111.8 | Y451 L452 K458 | Y451-V456 HydrophobicContact CD1-CG2 3.78Å; Y451-V456 HydrophobicContact CE1-CG2 3.39Å; Y451-V456 PolarHBondContact O-N 2.99Å; L452-V456 HydrophobicContact CD2-CB 4.45Å; L452-V456 HydrophobicContact CD2-CG2 4.17Å; L452-V456 PolarHBondContact O-N 3.27Å; V456-K458 PolarHBondContact O-N 3.38Å |
| 457 | W | 88 | Confident | 89.7 | Confident | 118 Ų | 118 | 86.6 Ų | 86.6 | 45% | 0.447 | 44% | 0.444 | S | S | . | . | trans | -73.4 | 96.1 | -178.2 | -171.7 | 25.2 | 0 | 0 | 0 | 112.3 | L452 I453 N459 K460 P461 | L452-W457 WeakPolarHBondContact O-CB 3.36Å; L452-W457 PolarHBondContact O-N 2.92Å; I453-W457 HydrophobicContact CG2-CE3 4.2Å; I453-W457 HydrophobicContact CG2-CZ3 4.48Å; W457-N459 PolarHBondContact NE1-O 3.06Å; W457-N459 VanDerWaalsContact NE1-O 3.12Å; W457-K460 HydrophobicContact CD2-CG 3.92Å; W457-K460 HydrophobicContact CE3-CG 3.93Å; W457-K460 HydrophobicContact CG-CG 4.25Å; W457-K460 HydrophobicContact CZ3-CG 4.49Å; W457-K460 VanDerWaalsContact O-CE 3.23Å; W457-K460 WeakPolarHBondContact O-CE 3.44Å; W457-K460 WeakPolarHBondContact O-CG 3.28Å; W457-P461 HydrophobicContact CH2-CG 3.93Å; W457-P461 VanDerWaalsContact CZ2-CD 3.42Å; W457-P461 HydrophobicContact CZ2-CG 4.06Å | ||
| 458 | K | 81.4 | Confident | 89.4 | Confident | 181 Ų | 181 | 89.5 Ų | 89.5 | 79% | 0.787 | 46% | 0.459 | S | S | * | . | trans | -75.5 | -39.7 | 178.9 | -64.2 | -174.3 | 179.1 | -178 | 0 | 113.2 | V456 K460 | V456-K458 PolarHBondContact O-N 3.38Å; K458-K460 VanDerWaalsContact C-N 3.32Å; K458-K460 PolarHBondContact O-N 2.78Å; K458-K460 VanDerWaalsContact O-N 3.1Å | ||
| 459 | N | 85.3 | Confident | 89.2 | Confident | 143 Ų | 143 | 94 Ų | 94 | 77% | 0.765 | 47% | 0.473 | S | S | * | . | S | Bend | trans | -91.3 | 58.2 | -173.1 | -66.2 | -12.1 | 0 | 0 | 0 | 112.4 | W457 | W457-N459 PolarHBondContact NE1-O 3.06Å; W457-N459 VanDerWaalsContact NE1-O 3.12Å |
| 460 | K | 86.4 | Confident | 89 | Confident | 49 Ų | 49 | 95.1 Ų | 95.1 | 21% | 0.213 | 48% | 0.475 | C | S | . | . | trans | -65.7 | 142.3 | 178.1 | -65.1 | 175.1 | -178.2 | 172.3 | 0 | 110.7 | I453 G454 W457 K458 K462 F464 Q465 | I453-K460 WeakPolarHBondContact O-CE 3.41Å; I453-K460 PolarHBondContact O-NZ 2.94Å; G454-K460 PolarHBondContact O-NZ 3.28Å; W457-K460 HydrophobicContact CD2-CG 3.92Å; W457-K460 HydrophobicContact CE3-CG 3.93Å; W457-K460 HydrophobicContact CG-CG 4.25Å; W457-K460 HydrophobicContact CZ3-CG 4.49Å; W457-K460 VanDerWaalsContact O-CE 3.23Å; W457-K460 WeakPolarHBondContact O-CE 3.44Å; W457-K460 WeakPolarHBondContact O-CG 3.28Å; K458-K460 VanDerWaalsContact C-N 3.32Å; K458-K460 PolarHBondContact O-N 2.78Å; K458-K460 VanDerWaalsContact O-N 3.1Å; K460-K462 PolarHBondContact O-N 3.09Å; K460-F464 HydrophobicContact CB-CD1 4.18Å; K460-F464 HydrophobicContact CD-CD1 4.03Å; K460-F464 HydrophobicContact CD-CE1 3.98Å; K460-F464 HydrophobicContact CG-CD1 4.44Å; K460-Q465 HydrophobicContact CB-CG 4.03Å; K460-Q465 PolarHBondContact O-NE2 3.12Å | ||
| 461 | P | 89.1 | Confident | 88.9 | Confident | 64 Ų | 64 | 97.8 Ų | 97.8 | 42% | 0.416 | 48% | 0.483 | S | S | . | . | trans | -55.6 | 140.1 | 178.7 | -24.7 | 32.8 | 0 | 0 | 0 | 111.2 | W457 V463 F464 Q465 | W457-P461 HydrophobicContact CH2-CG 3.93Å; W457-P461 VanDerWaalsContact CZ2-CD 3.42Å; W457-P461 HydrophobicContact CZ2-CG 4.06Å; P461-V463 PolarHBondContact O-N 3.24Å; P461-V463 VanDerWaalsContact O-N 3.13Å; P461-F464 HydrophobicContact CB-CB 4.46Å; P461-F464 WeakPolarHBondContact O-CB 3.44Å; P461-F464 PolarHBondContact O-N 3.31Å; P461-Q465 PolarHBondContact O-N 3.46Å | ||
| 462 | K | 87.8 | Confident | 88.7 | Confident | 181 Ų | 181 | 97.8 Ų | 97.8 | 79% | 0.787 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -54.9 | -34.9 | 179.9 | -69.8 | -174.9 | 178.8 | 179.1 | 0 | 112.6 | K460 Q465 R466 | K460-K462 PolarHBondContact O-N 3.09Å; K462-Q465 PolarHBondContact O-N 3.03Å; K462-R466 WeakPolarHBondContact O-CB 3.38Å; K462-R466 PolarHBondContact O-N 3.37Å |
| 463 | V | 91 | Very high | 88.5 | Confident | 122 Ų | 122 | 96 Ų | 96 | 74% | 0.739 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -60.7 | -44.7 | 175.8 | -178.4 | 0 | 0 | 0 | 0 | 111.2 | P461 R466 A467 | P461-V463 PolarHBondContact O-N 3.24Å; P461-V463 VanDerWaalsContact O-N 3.13Å; V463-R466 PolarHBondContact O-N 3.2Å; V463-A467 WeakPolarHBondContact O-CB 3.45Å; V463-A467 PolarHBondContact O-N 2.96Å |
| 464 | F | 88.5 | Confident | 88.5 | Confident | 91 Ų | 91 | 93.4 Ų | 93.4 | 40% | 0.399 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -68.6 | -42.1 | 179.1 | -175.6 | -103.7 | 0 | 0 | 0 | 111.9 | K460 P461 R466 A467 L468 | K460-F464 HydrophobicContact CB-CD1 4.18Å; K460-F464 HydrophobicContact CD-CD1 4.03Å; K460-F464 HydrophobicContact CD-CE1 3.98Å; K460-F464 HydrophobicContact CG-CD1 4.44Å; P461-F464 HydrophobicContact CB-CB 4.46Å; P461-F464 WeakPolarHBondContact O-CB 3.44Å; P461-F464 PolarHBondContact O-N 3.31Å; F464-R466 VanDerWaalsContact C-N 3.3Å; F464-R466 PolarHBondContact O-N 2.81Å; F464-A467 PolarHBondContact O-N 3.3Å; F464-L468 HydrophobicContact CD1-CD1 3.67Å; F464-L468 HydrophobicContact CE1-CD1 3.2Å; F464-L468 HydrophobicContact CE1-CG 4.24Å; F464-L468 HydrophobicContact CZ-CD1 3.71Å; F464-L468 HydrophobicContact CZ-CG 4.35Å; F464-L468 PolarHBondContact O-N 2.95Å |
| 465 | Q | 86.7 | Confident | 88.5 | Confident | 97 Ų | 97 | 92.9 Ų | 92.9 | 45% | 0.453 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -61.2 | -40 | 174.6 | -67.5 | -178.6 | -10.5 | 0 | 0 | 111.7 | K460 P461 K462 L468 Y469 | K460-Q465 HydrophobicContact CB-CG 4.03Å; K460-Q465 PolarHBondContact O-NE2 3.12Å; P461-Q465 PolarHBondContact O-N 3.46Å; K462-Q465 PolarHBondContact O-N 3.03Å; Q465-L468 PolarHBondContact O-N 2.68Å; Q465-Y469 WeakPolarHBondContact O-CB 3.29Å; Q465-Y469 PolarHBondContact O-N 3.43Å |
| 466 | R | 90 | Very high | 88.6 | Confident | 183 Ų | 183 | 93.6 Ų | 93.6 | 69% | 0.691 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -66.2 | -44.9 | 176.8 | -158.9 | 172.8 | -150.6 | 165.7 | 5.9 | 111.7 | K462 V463 F464 L468 Y469 D470 | K462-R466 WeakPolarHBondContact O-CB 3.38Å; K462-R466 PolarHBondContact O-N 3.37Å; V463-R466 PolarHBondContact O-N 3.2Å; F464-R466 VanDerWaalsContact C-N 3.3Å; F464-R466 PolarHBondContact O-N 2.81Å; R466-L468 VanDerWaalsContact C-N 3.34Å; R466-L468 PolarHBondContact O-N 2.88Å; R466-Y469 WeakPolarHBondContact O-CB 3.13Å; R466-Y469 PolarHBondContact O-N 3.42Å; R466-Y469 VanDerWaalsContact O-N 3.16Å; R466-D470 WeakPolarHBondContact O-CB 3.28Å; R466-D470 PolarHBondContact O-N 3.19Å |
| 467 | A | 90.7 | Very high | 88.7 | Confident | 55 Ų | 55 | 97.1 Ų | 97.1 | 46% | 0.455 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -59.6 | -43 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | V463 F464 D470 F471 | V463-A467 WeakPolarHBondContact O-CB 3.45Å; V463-A467 PolarHBondContact O-N 2.96Å; F464-A467 PolarHBondContact O-N 3.3Å; A467-D470 PolarHBondContact O-N 2.92Å; A467-F471 VanDerWaalsContact O-CB 3.27Å; A467-F471 WeakPolarHBondContact O-CB 3.28Å; A467-F471 PolarHBondContact O-N 2.74Å |
| 468 | L | 87.8 | Confident | 88.9 | Confident | 61 Ų | 61 | 98.3 Ų | 98.3 | 32% | 0.319 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -62.3 | -42.6 | 174 | -92.9 | 161.1 | 0 | 0 | 0 | 112.4 | F464 Q465 R466 T472 | F464-L468 HydrophobicContact CD1-CD1 3.67Å; F464-L468 HydrophobicContact CE1-CD1 3.2Å; F464-L468 HydrophobicContact CE1-CG 4.24Å; F464-L468 HydrophobicContact CZ-CD1 3.71Å; F464-L468 HydrophobicContact CZ-CG 4.35Å; F464-L468 PolarHBondContact O-N 2.95Å; Q465-L468 PolarHBondContact O-N 2.68Å; R466-L468 VanDerWaalsContact C-N 3.34Å; R466-L468 PolarHBondContact O-N 2.88Å; L468-T472 WeakPolarHBondContact O-CB 3.45Å; L468-T472 PolarHBondContact O-N 3.44Å; L468-T472 PolarHBondContact O-OG1 3.29Å |
| 469 | Y | 89 | Confident | 89.3 | Confident | 151 Ų | 151 | 92 Ų | 92 | 59% | 0.592 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -64.2 | -47.9 | 177 | 178.8 | -95.1 | 0 | 0 | 0 | 111.4 | Q465 R466 F471 T472 L473 | Q465-Y469 WeakPolarHBondContact O-CB 3.29Å; Q465-Y469 PolarHBondContact O-N 3.43Å; R466-Y469 WeakPolarHBondContact O-CB 3.13Å; R466-Y469 PolarHBondContact O-N 3.42Å; R466-Y469 VanDerWaalsContact O-N 3.16Å; Y469-F471 VanDerWaalsContact C-N 3.34Å; Y469-F471 PolarHBondContact O-N 2.71Å; Y469-T472 PolarHBondContact O-N 2.73Å; Y469-L473 HydrophobicContact CE1-CD2 4.14Å; Y469-L473 WeakPolarHBondContact O-CB 3.46Å; Y469-L473 PolarHBondContact O-N 3.08Å |
| 470 | D | 91.8 | Very high | 89.6 | Confident | 86 Ų | 86 | 90.2 Ų | 90.2 | 46% | 0.46 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -63.9 | -40.2 | 179.6 | -66.2 | -23 | 0 | 0 | 0 | 111.2 | R466 A467 G474 | R466-D470 WeakPolarHBondContact O-CB 3.28Å; R466-D470 PolarHBondContact O-N 3.19Å; A467-D470 PolarHBondContact O-N 2.92Å; D470-G474 PolarHBondContact O-N 3.38Å |
| 471 | F | 90.6 | Very high | 89.7 | Confident | 115 Ų | 115 | 88.3 Ų | 88.3 | 50% | 0.504 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -62.3 | -45 | 172.7 | 177.9 | -96.7 | 0 | 0 | 0 | 111.9 | F341 A467 Y469 G474 S475 | F341-F471 HydrophobicContact CD1-CE1 4.48Å; F341-F471 HydrophobicContact CD2-CE1 4.38Å; F341-F471 HydrophobicContact CE1-CE1 4.23Å; F341-F471 HydrophobicContact CE2-CE1 4.14Å; F341-F471 HydrophobicContact CZ-CE1 4.07Å; A467-F471 VanDerWaalsContact O-CB 3.27Å; A467-F471 WeakPolarHBondContact O-CB 3.28Å; A467-F471 PolarHBondContact O-N 2.74Å; Y469-F471 VanDerWaalsContact C-N 3.34Å; Y469-F471 PolarHBondContact O-N 2.71Å; F471-G474 PolarHBondContact O-N 2.85Å; F471-S475 WeakPolarHBondContact O-CB 3.41Å; F471-S475 PolarHBondContact O-N 3.21Å; F471-S475 PolarHBondContact O-OG 2.9Å |
| 472 | T | 89.6 | Confident | 89.6 | Confident | 28 Ų | 28 | 88.6 Ų | 88.6 | 17% | 0.172 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -63.7 | -47 | 178.9 | -57.6 | 0 | 0 | 0 | 0 | 110.4 | F341 F344 L468 Y469 S475 Q476 | F341-T472 HydrophobicContact CB-CG2 3.95Å; F344-T472 HydrophobicContact CE2-CG2 3.61Å; F344-T472 HydrophobicContact CZ-CG2 4.03Å; L468-T472 WeakPolarHBondContact O-CB 3.45Å; L468-T472 PolarHBondContact O-N 3.44Å; L468-T472 PolarHBondContact O-OG1 3.29Å; Y469-T472 PolarHBondContact O-N 2.73Å; T472-S475 PolarHBondContact O-N 3.27Å; T472-Q476 WeakPolarHBondContact O-CG 3.31Å; T472-Q476 PolarHBondContact O-N 2.84Å |
| 473 | L | 90.1 | Very high | 89.4 | Confident | 53 Ų | 53 | 83.6 Ų | 83.6 | 28% | 0.277 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -65.3 | -41.6 | 178.9 | -174.8 | 68.5 | 0 | 0 | 0 | 111.9 | Y469 Q476 K477 | Y469-L473 HydrophobicContact CE1-CD2 4.14Å; Y469-L473 WeakPolarHBondContact O-CB 3.46Å; Y469-L473 PolarHBondContact O-N 3.08Å; L473-Q476 PolarHBondContact O-N 3Å; L473-K477 HydrophobicContact CG-CD 4.48Å; L473-K477 WeakPolarHBondContact O-CG 3.31Å; L473-K477 PolarHBondContact O-N 2.62Å |
| 474 | G | 90.5 | Very high | 88.6 | Confident | 38 Ų | 38 | 80.9 Ų | 80.9 | 39% | 0.392 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -60.7 | -45.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | D470 F471 K477 L478 | D470-G474 PolarHBondContact O-N 3.38Å; F471-G474 PolarHBondContact O-N 2.85Å; G474-K477 PolarHBondContact O-N 2.74Å; G474-L478 VanDerWaalsContact O-CB 3.29Å; G474-L478 WeakPolarHBondContact O-CB 3.31Å; G474-L478 PolarHBondContact O-N 3.28Å |
| 475 | S | 88.2 | Confident | 87.3 | Confident | 21 Ų | 21 | 85.3 Ų | 85.3 | 15% | 0.147 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -62.9 | -42.4 | 175.7 | -58.7 | 0 | 0 | 0 | 0 | 111.9 | F471 T472 K477 L478 L479 | F471-S475 WeakPolarHBondContact O-CB 3.41Å; F471-S475 PolarHBondContact O-N 3.21Å; F471-S475 PolarHBondContact O-OG 2.9Å; T472-S475 PolarHBondContact O-N 3.27Å; S475-K477 VanDerWaalsContact C-N 3.35Å; S475-K477 PolarHBondContact O-N 3.09Å; S475-L478 PolarHBondContact O-N 2.78Å; S475-L479 WeakPolarHBondContact O-CB 3.13Å; S475-L479 PolarHBondContact O-N 3.11Å |
| 476 | Q | 89.4 | Confident | 87.3 | Confident | 52 Ų | 52 | 84.7 Ų | 84.7 | 24% | 0.243 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -60.6 | -42.4 | 175.6 | -75.9 | -178.5 | -70.3 | 0 | 0 | 112.5 | F344 T472 L473 Q480 L481 | F344-Q476 HydrophobicContact CD2-CG 3.64Å; F344-Q476 VanDerWaalsContact CE2-CD 3.44Å; F344-Q476 HydrophobicContact CE2-CG 3.56Å; T472-Q476 WeakPolarHBondContact O-CG 3.31Å; T472-Q476 PolarHBondContact O-N 2.84Å; L473-Q476 PolarHBondContact O-N 3Å; Q476-Q480 CarbonylContact O-C 3.56Å; Q476-Q480 WeakPolarHBondContact O-CA 3.37Å; Q476-Q480 PolarHBondContact O-N 2.89Å; Q476-L481 HydrophobicContact CG-CB 4.26Å; Q476-L481 PolarHBondContact O-N 2.72Å |
| 477 | K | 91 | Very high | 87.2 | Confident | 151 Ų | 151 | 79.5 Ų | 79.5 | 66% | 0.657 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -70 | -45 | 178.1 | -72.3 | 176.1 | 179.5 | -180 | 0 | 112 | L473 G474 S475 | L473-K477 HydrophobicContact CG-CD 4.48Å; L473-K477 WeakPolarHBondContact O-CG 3.31Å; L473-K477 PolarHBondContact O-N 2.62Å; G474-K477 PolarHBondContact O-N 2.74Å; S475-K477 VanDerWaalsContact C-N 3.35Å; S475-K477 PolarHBondContact O-N 3.09Å |
| 478 | L | 91.7 | Very high | 87 | Confident | 142 Ų | 142 | 80.9 Ų | 80.9 | 74% | 0.743 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -66.9 | -43.8 | -176.7 | -177.2 | 67.6 | 0 | 0 | 0 | 112.1 | G474 S475 | G474-L478 VanDerWaalsContact O-CB 3.29Å; G474-L478 WeakPolarHBondContact O-CB 3.31Å; G474-L478 PolarHBondContact O-N 3.28Å; S475-L478 PolarHBondContact O-N 2.78Å |
| 479 | L | 90 | Very high | 87 | Confident | 49 Ų | 49 | 82.1 Ų | 82.1 | 26% | 0.257 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -103.8 | 7 | -173.6 | -61.8 | 174.9 | 0 | 0 | 0 | 113.1 | H346 I353 L357 S475 L481 | H346-L479 PolarHBondContact CD2-O 3.44Å; H346-L479 VanDerWaalsContact CD2-O 3.3Å; I353-L479 HydrophobicContact CG2-CD1 4.12Å; I353-L479 HydrophobicContact CG2-CD2 4.4Å; L357-L479 HydrophobicContact CD1-CD1 4.15Å; S475-L479 WeakPolarHBondContact O-CB 3.13Å; S475-L479 PolarHBondContact O-N 3.11Å; L479-L481 HydrophobicContact CB-CD1 3.78Å; L479-L481 HydrophobicContact CB-CD2 3.94Å; L479-L481 HydrophobicContact CB-CG 3.6Å; L479-L481 HydrophobicContact CD1-CD1 4.08Å; L479-L481 PolarHBondContact O-N 2.99Å |
| 480 | Q | 90.9 | Very high | 86.8 | Confident | 106 Ų | 106 | 77.8 Ų | 77.8 | 50% | 0.495 | 43% | 0.427 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 51 | 51.5 | -178.1 | -60.8 | -175.7 | -15.7 | 0 | 0 | 113 | K347 Q476 | K347-Q480 WeakPolarHBondContact CB-O 3.33Å; K347-Q480 PolarHBondContact N-O 3.33Å; Q476-Q480 CarbonylContact O-C 3.56Å; Q476-Q480 WeakPolarHBondContact O-CA 3.37Å; Q476-Q480 PolarHBondContact O-N 2.89Å |
| 481 | L | 89.2 | Confident | 86.5 | Confident | 8 Ų | 8 | 77.2 Ų | 77.2 | 4% | 0.042 | 43% | 0.425 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.7 | 141.6 | -172.6 | -52.9 | 167.8 | 0 | 0 | 0 | 112.7 | F344 L345 H346 I353 P354 Q476 L479 | F344-L481 HydrophobicContact CB-CB 3.84Å; F344-L481 HydrophobicContact CB-CD1 4.34Å; F344-L481 HydrophobicContact CD2-CB 4.21Å; L345-L481 CarbonylContact O-C 3.39Å; L345-L481 VanDerWaalsContact O-CA 3.27Å; L345-L481 WeakPolarHBondContact O-CA 3.36Å; H346-L481 HydrophobicContact CB-CD2 4.49Å; I353-L481 HydrophobicContact CB-CD2 4.33Å; P354-L481 HydrophobicContact CG-CD1 3.46Å; P354-L481 VanDerWaalsContact CG-CD1 3.46Å; P354-L481 HydrophobicContact CG-CD2 4.21Å; P354-L481 HydrophobicContact CG-CG 4.48Å; Q476-L481 HydrophobicContact CG-CB 4.26Å; Q476-L481 PolarHBondContact O-N 2.72Å; L479-L481 HydrophobicContact CB-CD1 3.78Å; L479-L481 HydrophobicContact CB-CD2 3.94Å; L479-L481 HydrophobicContact CB-CG 3.6Å; L479-L481 HydrophobicContact CD1-CD1 4.08Å; L479-L481 PolarHBondContact O-N 2.99Å |
| 482 | I | 87.8 | Confident | 86.2 | Confident | 71 Ų | 71 | 74.5 Ų | 74.5 | 36% | 0.364 | 42% | 0.419 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.3 | 144.2 | 173.9 | 55 | 171.2 | 0 | 0 | 0 | 110.6 | F344 L345 K347 | F344-I482 WeakPolarHBondContact CA-O 3.35Å; F344-I482 WeakPolarHBondContact CB-O 3.22Å; L345-I482 PolarHBondContact N-O 3.36Å; L345-I482 WeakPolarHBondContact O-CG1 3.46Å; L345-I482 PolarHBondContact O-N 3.3Å; K347-I482 HydrophobicContact CB-CG2 4.47Å |
| 483 | P | 83.3 | Confident | 85.9 | Confident | 75 Ų | 75 | 78.1 Ų | 78.1 | 49% | 0.487 | 44% | 0.438 | S | S | . | . | trans | -66 | 151.4 | 173.3 | 28.4 | -33.7 | 0 | 0 | 0 | 111.2 | F344 | F344-P483 HydrophobicContact CD1-CB 4.08Å; F344-P483 HydrophobicContact CE1-CB 3.7Å; F344-P483 HydrophobicContact CZ-CB 4.18Å | ||
| 484 | E | 73.5 | Confident | 85.6 | Confident | 66 Ų | 66 | 80.2 Ų | 80.2 | 31% | 0.308 | 45% | 0.451 | S | S | . | . | trans | -64.5 | 135.2 | 170.4 | -167.8 | 178.9 | -148.2 | 0 | 0 | 109.9 | R334 | R334-E484 IonicContact CZ-OE1 2.77Å; R334-E484 IonicContact CZ-OE2 3.37Å; R334-E484 IonicContact NE-OE1 3.16Å; R334-E484 IonicContact NE-OE2 2.9Å; R334-E484 PolarHBondContact NE-OE2 3.44Å; R334-E484 IonicContact NH2-OE1 2.62Å; R334-E484 PolarHBondContact NH2-OE1 3.21Å; R334-E484 IonicContact NH2-OE2 2.84Å; R334-E484 PolarHBondContact NH2-OE2 2.94Å | ||
| 485 | S | 61.6 | Low | 85.2 | Confident | 183 Ų | 183 | 84 Ų | 84 | 100% | 1.28 | 46% | 0.457 | S | S | * | . | trans | -77.2 | 0 | -176.7 | 59 | 0 | 0 | 0 | 0 | 113.6 |
Retrieved 485 of 485 residues in 507 ms
(Link to these results)