| 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 | 68.9 | Low | 85.7 | Confident | 218 Ų | 218 | 117.4 Ų | 117.4 | 100% | 1.074 | 66% | 0.662 | S | S | * | * | 0 | 70.8 | 0 | -81.9 | 176.2 | -86.9 | 0 | 0 | 106.1 | |||||
| 2 | D | 84.2 | Confident | 85.5 | Confident | 147 Ų | 147 | 118.3 Ų | 118.3 | 79% | 0.786 | 65% | 0.654 | S | S | * | * | trans | -141.1 | -8.9 | -161.1 | -59.5 | -77.8 | 0 | 0 | 0 | 115.7 | ||||
| 3 | A | 85.4 | Confident | 85.2 | Confident | 82 Ų | 82 | 120.8 Ų | 120.8 | 68% | 0.678 | 66% | 0.661 | S | S | * | * | S | Bend | trans | -101.7 | -40.4 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | Q5 A6 A7 | A3-Q5 VanDerWaalsContact C-N 3.32Å; A3-Q5 PolarHBondContact O-N 3.49Å; A3-A6 PolarHBondContact O-N 3.47Å; A3-A7 PolarHBondContact O-N 3.11Å |
| 4 | Q | 88.5 | Confident | 84.1 | Confident | 176 Ų | 176 | 117.9 Ų | 117.9 | 82% | 0.822 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -67.7 | -30.7 | -177.9 | -78.9 | 167.4 | -94.8 | 0 | 0 | 113 | A7 D8 | Q4-A7 PolarHBondContact O-N 3.07Å; Q4-D8 PolarHBondContact O-N 3.49Å; Q4-D8 VanDerWaalsContact O-N 3.11Å |
| 5 | Q | 90.8 | Very high | 82.9 | Confident | 158 Ų | 158 | 120.5 Ų | 120.5 | 74% | 0.738 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -73.9 | -30.1 | -178.2 | -161.5 | 135.1 | -54 | 0 | 0 | 113.1 | A3 L9 | A3-Q5 VanDerWaalsContact C-N 3.32Å; A3-Q5 PolarHBondContact O-N 3.49Å; Q5-L9 WeakPolarHBondContact O-CB 3.43Å; Q5-L9 PolarHBondContact O-N 3.34Å; Q5-L9 VanDerWaalsContact O-N 3.13Å |
| 6 | A | 90.5 | Very high | 82 | Confident | 64 Ų | 64 | 123.3 Ų | 123.3 | 53% | 0.529 | 67% | 0.668 | S | S | . | * | H | α-helix | trans | -72.8 | -36.7 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112 | A3 L9 S10 | A3-A6 PolarHBondContact O-N 3.47Å; A6-L9 PolarHBondContact O-N 3.39Å; A6-S10 PolarHBondContact O-N 2.97Å |
| 7 | A | 90 | Very high | 81.1 | Confident | 54 Ų | 54 | 127.3 Ų | 127.3 | 45% | 0.446 | 68% | 0.678 | S | S | . | * | H | α-helix | trans | -65.1 | -46.6 | 174 | 0 | 0 | 0 | 0 | 0 | 111.4 | A3 Q4 L9 S10 D11 | A3-A7 PolarHBondContact O-N 3.11Å; Q4-A7 PolarHBondContact O-N 3.07Å; A7-L9 VanDerWaalsContact C-N 3.29Å; A7-L9 PolarHBondContact O-N 2.91Å; A7-S10 PolarHBondContact O-N 2.94Å; A7-S10 VanDerWaalsContact O-N 3.15Å; A7-D11 PolarHBondContact O-N 3.15Å |
| 8 | D | 88.2 | Confident | 80.1 | Confident | 92 Ų | 92 | 127.8 Ų | 127.8 | 49% | 0.492 | 68% | 0.681 | S | S | . | * | H | α-helix | trans | -61.3 | -36.4 | 177 | -167.6 | -99.9 | 0 | 0 | 0 | 112.3 | Q4 D11 K12 | Q4-D8 PolarHBondContact O-N 3.49Å; Q4-D8 VanDerWaalsContact O-N 3.11Å; D8-D11 PolarHBondContact O-N 3.48Å; D8-K12 WeakPolarHBondContact O-CB 3.46Å; D8-K12 WeakPolarHBondContact O-CG 3.39Å; D8-K12 PolarHBondContact O-N 3.13Å; D8-K12 WeakPolarHBondContact OD1-CE 3.12Å |
| 9 | L | 87.8 | Confident | 79.1 | Confident | 119 Ų | 119 | 127.3 Ų | 127.3 | 62% | 0.623 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -68.9 | -38.1 | 175.7 | -168.8 | 68.2 | 0 | 0 | 0 | 112.5 | Q5 A6 A7 K12 M13 | Q5-L9 WeakPolarHBondContact O-CB 3.43Å; Q5-L9 PolarHBondContact O-N 3.34Å; Q5-L9 VanDerWaalsContact O-N 3.13Å; A6-L9 PolarHBondContact O-N 3.39Å; A7-L9 VanDerWaalsContact C-N 3.29Å; A7-L9 PolarHBondContact O-N 2.91Å; L9-K12 PolarHBondContact O-N 3.49Å; L9-M13 WeakPolarHBondContact O-CB 3.46Å; L9-M13 PolarHBondContact O-N 3.15Å |
| 10 | S | 83.9 | Confident | 78.3 | Confident | 77 Ų | 77 | 127.7 Ų | 127.7 | 54% | 0.538 | 68% | 0.68 | S | S | . | * | H | α-helix | trans | -67.5 | -38.5 | 175.6 | -169.9 | 0 | 0 | 0 | 0 | 111.9 | A6 A7 S14 | A6-S10 PolarHBondContact O-N 2.97Å; A7-S10 PolarHBondContact O-N 2.94Å; A7-S10 VanDerWaalsContact O-N 3.15Å; S10-S14 PolarHBondContact O-N 3.27Å; S10-S14 VanDerWaalsContact O-N 3.15Å; S10-S14 PolarHBondContact O-OG 3.22Å |
| 11 | D | 84.7 | Confident | 77.5 | Confident | 104 Ų | 104 | 126.1 Ų | 126.1 | 56% | 0.556 | 68% | 0.677 | S | S | * | * | H | α-helix | trans | -67.1 | -42.5 | 173.7 | -88.2 | -54.5 | 0 | 0 | 0 | 111.4 | A7 D8 M13 S14 M15 | A7-D11 PolarHBondContact O-N 3.15Å; D8-D11 PolarHBondContact O-N 3.48Å; D11-M13 PolarHBondContact O-N 3.21Å; D11-S14 PolarHBondContact O-N 3.42Å; D11-M15 PolarHBondContact O-N 3.45Å |
| 12 | K | 82.6 | Confident | 77.2 | Confident | 129 Ų | 129 | 121 Ų | 121 | 56% | 0.561 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -61.8 | -40.7 | 174.6 | -79.3 | -178.5 | -175.9 | -75.8 | 0 | 112.7 | D8 L9 S14 M15 E16 | D8-K12 WeakPolarHBondContact O-CB 3.46Å; D8-K12 WeakPolarHBondContact O-CG 3.39Å; D8-K12 PolarHBondContact O-N 3.13Å; D8-K12 WeakPolarHBondContact OD1-CE 3.12Å; L9-K12 PolarHBondContact O-N 3.49Å; K12-S14 VanDerWaalsContact C-N 3.27Å; K12-S14 PolarHBondContact O-N 3.44Å; K12-M15 PolarHBondContact O-N 2.8Å; K12-E16 PolarHBondContact O-N 3.4Å |
| 13 | M | 81.4 | Confident | 75.9 | Confident | 151 Ų | 151 | 120.2 Ų | 120.2 | 74% | 0.744 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -67.6 | -29.2 | 177.9 | -157.2 | 75.2 | 123.2 | 0 | 0 | 112.3 | L9 D11 M15 | L9-M13 WeakPolarHBondContact O-CB 3.46Å; L9-M13 PolarHBondContact O-N 3.15Å; D11-M13 PolarHBondContact O-N 3.21Å; M13-M15 VanDerWaalsContact C-N 3.31Å |
| 14 | S | 70.3 | Confident | 74.7 | Confident | 80 Ų | 80 | 118.5 Ų | 118.5 | 56% | 0.559 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -73.3 | -23.1 | 176.3 | -55.3 | 0 | 0 | 0 | 0 | 113 | S10 D11 K12 | S10-S14 PolarHBondContact O-N 3.27Å; S10-S14 VanDerWaalsContact O-N 3.15Å; S10-S14 PolarHBondContact O-OG 3.22Å; D11-S14 PolarHBondContact O-N 3.42Å; K12-S14 VanDerWaalsContact C-N 3.27Å; K12-S14 PolarHBondContact O-N 3.44Å |
| 15 | M | 65.9 | Low | 73.4 | Confident | 157 Ų | 157 | 118.1 Ų | 118.1 | 77% | 0.773 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -84.6 | -21.4 | 176.6 | -66.1 | -153.2 | -128.8 | 0 | 0 | 113.8 | D11 K12 M13 K17 | D11-M15 PolarHBondContact O-N 3.45Å; K12-M15 PolarHBondContact O-N 2.8Å; M13-M15 VanDerWaalsContact C-N 3.31Å; M15-K17 PolarHBondContact O-N 2.83Å |
| 16 | E | 69.1 | Low | 72.4 | Confident | 165 Ų | 165 | 121.3 Ų | 121.3 | 77% | 0.771 | 65% | 0.648 | S | S | * | * | trans | -76.5 | 30 | 172.4 | -164.6 | 83 | 146.5 | 0 | 0 | 111.8 | K12 D18 | K12-E16 PolarHBondContact O-N 3.4Å; E16-D18 VanDerWaalsContact C-N 3.32Å; E16-D18 PolarHBondContact O-N 2.95Å | ||
| 17 | K | 66.1 | Low | 71.7 | Confident | 191 Ų | 191 | 125.1 Ų | 125.1 | 83% | 0.83 | 65% | 0.653 | S | S | * | * | trans | -67.8 | 94.1 | 174.8 | -169.1 | 176.5 | -173.8 | 171.2 | 0 | 108.7 | M15 | M15-K17 PolarHBondContact O-N 2.83Š| ||
| 18 | D | 63 | Low | 71.4 | Confident | 137 Ų | 137 | 123.7 Ų | 123.7 | 73% | 0.733 | 64% | 0.637 | S | S | * | * | trans | 15.2 | 115.7 | 169.7 | -138.9 | -74.3 | 0 | 0 | 0 | 116.7 | E16 K20 | E16-D18 VanDerWaalsContact C-N 3.32Å; E16-D18 PolarHBondContact O-N 2.95Å; D18-K20 PolarHBondContact O-N 2.96Å | ||
| 19 | P | 61.6 | Low | 71.3 | Confident | 117 Ų | 117 | 128 Ų | 128 | 76% | 0.76 | 65% | 0.648 | S | S | * | * | trans | -65.7 | 104.1 | -175.3 | 27 | -33.4 | 0 | 0 | 0 | 111.4 | ||||
| 20 | K | 63.6 | Low | 71.3 | Confident | 136 Ų | 136 | 126.5 Ų | 126.5 | 59% | 0.591 | 64% | 0.64 | S | S | * | * | trans | -53.1 | 123.2 | 172.6 | -98.9 | -176.5 | 158.9 | -162 | 0 | 110.3 | D18 S22 L24 D28 | D18-K20 PolarHBondContact O-N 2.96Å; K20-S22 PolarHBondContact O-N 2.71Å; K20-L24 HydrophobicContact CB-CD2 4.17Å; K20-L24 HydrophobicContact CD-CD2 3.28Å; K20-L24 HydrophobicContact CG-CD2 3.69Å; K20-L24 VanDerWaalsContact NZ-CD2 3.29Å; K20-D28 IonicContact NZ-OD1 2.83Å; K20-D28 PolarHBondContact NZ-OD1 2.83Å | ||
| 21 | P | 60.4 | Low | 71.6 | Confident | 94 Ų | 94 | 127.8 Ų | 127.8 | 61% | 0.61 | 64% | 0.638 | S | S | * | * | trans | -65.1 | 133.6 | -178.8 | 23.8 | -32.1 | 0 | 0 | 0 | 111.5 | C23 L24 | P21-C23 PolarHBondContact O-N 3.19Å; P21-L24 WeakPolarHBondContact O-CB 3.23Å; P21-L24 PolarHBondContact O-N 3.1Å | ||
| 22 | S | 63.7 | Low | 71.8 | Confident | 112 Ų | 112 | 129.6 Ų | 129.6 | 78% | 0.783 | 64% | 0.641 | S | S | * | * | G | 310 helix | trans | -58.7 | -19.2 | -168.8 | -28.6 | 0 | 0 | 0 | 0 | 115.8 | K20 L24 | K20-S22 PolarHBondContact O-N 2.71Å; S22-L24 PolarHBondContact O-N 3.3Å |
| 23 | C | 57.1 | Low | 72.2 | Confident | 130 Ų | 130 | 125 Ų | 125 | 88% | 0.878 | 63% | 0.627 | S | S | * | * | G | 310 helix | trans | -74.5 | -2 | 173.6 | -72.6 | 0 | 0 | 0 | 0 | 113.7 | P21 | P21-C23 PolarHBondContact O-N 3.19Š|
| 24 | L | 58.8 | Low | 72.7 | Confident | 45 Ų | 45 | 121.3 Ų | 121.3 | 24% | 0.236 | 61% | 0.61 | C | S | . | * | G | 310 helix | trans | -71.7 | -23 | 179.4 | -158.5 | 86 | 0 | 0 | 0 | 113.4 | K20 P21 S22 R26 F27 D28 | K20-L24 HydrophobicContact CB-CD2 4.17Å; K20-L24 HydrophobicContact CD-CD2 3.28Å; K20-L24 HydrophobicContact CG-CD2 3.69Å; K20-L24 VanDerWaalsContact NZ-CD2 3.29Å; P21-L24 WeakPolarHBondContact O-CB 3.23Å; P21-L24 PolarHBondContact O-N 3.1Å; S22-L24 PolarHBondContact O-N 3.3Å; L24-R26 VanDerWaalsContact C-N 3.32Å; L24-R26 PolarHBondContact O-N 3.04Å; L24-R26 VanDerWaalsContact O-N 3.08Å; L24-F27 CarbonylContact O-C 3.42Å; L24-F27 WeakPolarHBondContact O-CA 3.23Å; L24-F27 WeakPolarHBondContact O-CB 2.98Å; L24-F27 PolarHBondContact O-N 2.92Å; L24-D28 WeakPolarHBondContact CB-OD2 3.41Å; L24-D28 WeakPolarHBondContact CD2-OD1 3.41Å; L24-D28 VanDerWaalsContact CD2-OD2 3.23Å; L24-D28 WeakPolarHBondContact CD2-OD2 3.35Å; L24-D28 VanDerWaalsContact CG-OD2 3.3Å; L24-D28 WeakPolarHBondContact CG-OD2 3.48Å; L24-D28 PolarHBondContact O-N 3.45Å |
| 25 | F | 62.7 | Low | 73.7 | Confident | 169 Ų | 169 | 120.2 Ų | 120.2 | 74% | 0.741 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -53.1 | -39.4 | -169.9 | -109.8 | -80.4 | 0 | 0 | 0 | 115.6 | D28 Y29 | F25-D28 PolarHBondContact N-OD2 3.44Å; F25-Y29 PolarHBondContact O-N 2.95Å |
| 26 | R | 68.1 | Low | 75 | Confident | 224 Ų | 224 | 118.7 Ų | 118.7 | 85% | 0.845 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -71.2 | -38.2 | 175.8 | -71 | -174.8 | 80.8 | -177.1 | 5.2 | 111.7 | L24 L30 | L24-R26 VanDerWaalsContact C-N 3.32Å; L24-R26 PolarHBondContact O-N 3.04Å; L24-R26 VanDerWaalsContact O-N 3.08Å; R26-L30 PolarHBondContact O-N 3.36Å |
| 27 | F | 77.6 | Confident | 76.1 | Confident | 144 Ų | 144 | 116.1 Ų | 116.1 | 63% | 0.632 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -70.3 | -38.6 | 175.4 | -124.4 | -83.9 | 0 | 0 | 0 | 111.1 | L24 Y29 L30 E31 | L24-F27 CarbonylContact O-C 3.42Å; L24-F27 WeakPolarHBondContact O-CA 3.23Å; L24-F27 WeakPolarHBondContact O-CB 2.98Å; L24-F27 PolarHBondContact O-N 2.92Å; F27-Y29 PolarHBondContact O-N 3Å; F27-L30 CarbonylContact O-C 3.59Å; F27-L30 PolarHBondContact O-N 2.97Å; F27-E31 WeakPolarHBondContact O-CA 3.11Å; F27-E31 WeakPolarHBondContact O-CB 3.22Å; F27-E31 PolarHBondContact O-N 3.49Å |
| 28 | D | 82.9 | Confident | 77.3 | Confident | 24 Ų | 24 | 113.4 Ų | 113.4 | 13% | 0.128 | 57% | 0.573 | C | S | . | * | H | α-helix | trans | -61.7 | -41.7 | 177.7 | -74.4 | -58.9 | 0 | 0 | 0 | 111.5 | K20 L24 F25 K32 | K20-D28 IonicContact NZ-OD1 2.83Å; K20-D28 PolarHBondContact NZ-OD1 2.83Å; L24-D28 WeakPolarHBondContact CB-OD2 3.41Å; L24-D28 WeakPolarHBondContact CD2-OD1 3.41Å; L24-D28 VanDerWaalsContact CD2-OD2 3.23Å; L24-D28 WeakPolarHBondContact CD2-OD2 3.35Å; L24-D28 VanDerWaalsContact CG-OD2 3.3Å; L24-D28 WeakPolarHBondContact CG-OD2 3.48Å; L24-D28 PolarHBondContact O-N 3.45Å; F25-D28 PolarHBondContact N-OD2 3.44Å; D28-K32 WeakPolarHBondContact O-CB 3.35Å; D28-K32 VanDerWaalsContact O-CG 3.22Å; D28-K32 WeakPolarHBondContact O-CG 3.39Å; D28-K32 PolarHBondContact O-N 2.92Å |
| 29 | Y | 85.5 | Confident | 78.7 | Confident | 183 Ų | 183 | 115.9 Ų | 115.9 | 72% | 0.718 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -68.5 | -44.6 | 177.1 | -174.5 | -96 | 0 | 0 | 0 | 111.2 | F25 F27 E31 K32 A33 | F25-Y29 PolarHBondContact O-N 2.95Å; F27-Y29 PolarHBondContact O-N 3Å; Y29-E31 VanDerWaalsContact C-N 3.34Å; Y29-E31 PolarHBondContact O-N 3.33Å; Y29-K32 PolarHBondContact O-N 2.83Å; Y29-A33 WeakPolarHBondContact O-CB 3.3Å; Y29-A33 PolarHBondContact O-N 3.35Å |
| 30 | L | 88.5 | Confident | 80.2 | Confident | 87 Ų | 87 | 115 Ų | 115 | 46% | 0.455 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -62.6 | -41.8 | 175.9 | -176.1 | 64.4 | 0 | 0 | 0 | 111.3 | R26 F27 A33 L34 | R26-L30 PolarHBondContact O-N 3.36Å; F27-L30 CarbonylContact O-C 3.59Å; F27-L30 PolarHBondContact O-N 2.97Å; L30-A33 PolarHBondContact O-N 2.75Å; L30-L34 HydrophobicContact CD1-CD1 4.12Å; L30-L34 HydrophobicContact CD1-CG 4.11Å; L30-L34 HydrophobicContact CD2-CD1 4.39Å; L30-L34 HydrophobicContact CG-CD1 3.81Å; L30-L34 HydrophobicContact CG-CG 4.2Å; L30-L34 VanDerWaalsContact O-CB 3.28Å; L30-L34 WeakPolarHBondContact O-CB 3.11Å; L30-L34 WeakPolarHBondContact O-CG 3.41Å; L30-L34 PolarHBondContact O-N 2.8Å |
| 31 | E | 89.7 | Confident | 81.4 | Confident | 105 Ų | 105 | 114 Ų | 114 | 49% | 0.491 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -62.5 | -45 | 176.9 | -175.6 | -169.7 | 152.7 | 0 | 0 | 110.6 | F27 Y29 S35 | F27-E31 WeakPolarHBondContact O-CA 3.11Å; F27-E31 WeakPolarHBondContact O-CB 3.22Å; F27-E31 PolarHBondContact O-N 3.49Å; Y29-E31 VanDerWaalsContact C-N 3.34Å; Y29-E31 PolarHBondContact O-N 3.33Å; E31-S35 WeakPolarHBondContact O-CB 3.35Å; E31-S35 PolarHBondContact O-N 2.78Å; E31-S35 PolarHBondContact O-OG 3.01Å |
| 32 | K | 89.4 | Confident | 82.8 | Confident | 142 Ų | 142 | 112.4 Ų | 112.4 | 62% | 0.617 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -62.2 | -44 | 174.4 | -76.6 | 171 | -176.4 | 170.5 | 0 | 111.8 | D28 Y29 S35 Q36 | D28-K32 WeakPolarHBondContact O-CB 3.35Å; D28-K32 VanDerWaalsContact O-CG 3.22Å; D28-K32 WeakPolarHBondContact O-CG 3.39Å; D28-K32 PolarHBondContact O-N 2.92Å; Y29-K32 PolarHBondContact O-N 2.83Å; K32-S35 WeakPolarHBondContact CA-OG 3.3Å; K32-S35 PolarHBondContact O-OG 3.39Å; K32-Q36 WeakPolarHBondContact O-CB 3.04Å; K32-Q36 PolarHBondContact O-N 3.26Å |
| 33 | A | 90.7 | Very high | 84.1 | Confident | 33 Ų | 33 | 111.3 Ų | 111.3 | 27% | 0.273 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -65.1 | -48.6 | 178 | 0 | 0 | 0 | 0 | 0 | 111.7 | Y29 L30 Q36 L37 | Y29-A33 WeakPolarHBondContact O-CB 3.3Å; Y29-A33 PolarHBondContact O-N 3.35Å; L30-A33 PolarHBondContact O-N 2.75Å; A33-Q36 PolarHBondContact O-N 3.17Å; A33-L37 WeakPolarHBondContact O-CB 3.16Å; A33-L37 VanDerWaalsContact O-CG 3.27Å; A33-L37 WeakPolarHBondContact O-CG 3.34Å; A33-L37 PolarHBondContact O-N 2.7Å |
| 34 | L | 91.1 | Very high | 85.7 | Confident | 73 Ų | 73 | 109.1 Ų | 109.1 | 38% | 0.382 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.1 | -44 | 178.6 | -71.3 | 176.5 | 0 | 0 | 0 | 111.6 | L30 Q36 L37 F38 | L30-L34 HydrophobicContact CD1-CD1 4.12Å; L30-L34 HydrophobicContact CD1-CG 4.11Å; L30-L34 HydrophobicContact CD2-CD1 4.39Å; L30-L34 HydrophobicContact CG-CD1 3.81Å; L30-L34 HydrophobicContact CG-CG 4.2Å; L30-L34 VanDerWaalsContact O-CB 3.28Å; L30-L34 WeakPolarHBondContact O-CB 3.11Å; L30-L34 WeakPolarHBondContact O-CG 3.41Å; L30-L34 PolarHBondContact O-N 2.8Å; L34-Q36 VanDerWaalsContact C-N 3.33Å; L34-Q36 PolarHBondContact O-N 2.79Å; L34-L37 PolarHBondContact O-N 3.49Å; L34-F38 HydrophobicContact CB-CD2 4.31Å; L34-F38 HydrophobicContact CB-CE2 4.16Å; L34-F38 WeakPolarHBondContact O-CB 3.22Å; L34-F38 WeakPolarHBondContact O-CD2 3.34Å; L34-F38 WeakPolarHBondContact O-CG 3.07Å; L34-F38 PolarHBondContact O-N 3.36Å |
| 35 | S | 91.7 | Very high | 87.2 | Confident | 56 Ų | 56 | 108.9 Ų | 108.9 | 39% | 0.392 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.1 | -39.8 | 177 | 59.6 | 0 | 0 | 0 | 0 | 111.7 | E31 K32 F38 R39 | E31-S35 WeakPolarHBondContact O-CB 3.35Å; E31-S35 PolarHBondContact O-N 2.78Å; E31-S35 PolarHBondContact O-OG 3.01Å; K32-S35 WeakPolarHBondContact CA-OG 3.3Å; K32-S35 PolarHBondContact O-OG 3.39Å; S35-F38 PolarHBondContact O-N 2.97Å; S35-R39 WeakPolarHBondContact O-CB 3.4Å; S35-R39 VanDerWaalsContact O-CG 3.23Å; S35-R39 WeakPolarHBondContact O-CG 3.33Å; S35-R39 PolarHBondContact O-N 2.99Å |
| 36 | Q | 93 | Very high | 88.4 | Confident | 125 Ų | 125 | 105.1 Ų | 105.1 | 58% | 0.584 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -64.5 | -44.7 | 173.6 | -175 | 174.5 | -8 | 0 | 0 | 111.6 | K32 A33 L34 R39 I40 | K32-Q36 WeakPolarHBondContact O-CB 3.04Å; K32-Q36 PolarHBondContact O-N 3.26Å; A33-Q36 PolarHBondContact O-N 3.17Å; L34-Q36 VanDerWaalsContact C-N 3.33Å; L34-Q36 PolarHBondContact O-N 2.79Å; Q36-R39 PolarHBondContact O-N 3.29Å; Q36-I40 HydrophobicContact CG-CD1 3.99Å; Q36-I40 WeakPolarHBondContact O-CG1 3.31Å; Q36-I40 PolarHBondContact O-N 2.94Å |
| 37 | L | 92.9 | Very high | 89.5 | Confident | 112 Ų | 112 | 103.7 Ų | 103.7 | 59% | 0.586 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -60.6 | -46 | 176.2 | -73.1 | 171.7 | 0 | 0 | 0 | 111.5 | A33 L34 R39 I40 Y41 | A33-L37 WeakPolarHBondContact O-CB 3.16Å; A33-L37 VanDerWaalsContact O-CG 3.27Å; A33-L37 WeakPolarHBondContact O-CG 3.34Å; A33-L37 PolarHBondContact O-N 2.7Å; L34-L37 PolarHBondContact O-N 3.49Å; L37-R39 PolarHBondContact O-N 3.47Å; L37-I40 PolarHBondContact O-N 2.88Å; L37-Y41 WeakPolarHBondContact O-CB 3.34Å; L37-Y41 PolarHBondContact O-N 3.17Å |
| 38 | F | 91.8 | Very high | 90.2 | Very high | 134 Ų | 134 | 102.1 Ų | 102.1 | 59% | 0.588 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -65.4 | -37.6 | 177.5 | -74.6 | -54.3 | 0 | 0 | 0 | 112.6 | L34 S35 S42 | L34-F38 HydrophobicContact CB-CD2 4.31Å; L34-F38 HydrophobicContact CB-CE2 4.16Å; L34-F38 WeakPolarHBondContact O-CB 3.22Å; L34-F38 WeakPolarHBondContact O-CD2 3.34Å; L34-F38 WeakPolarHBondContact O-CG 3.07Å; L34-F38 PolarHBondContact O-N 3.36Å; S35-F38 PolarHBondContact O-N 2.97Å; F38-S42 VanDerWaalsContact O-CB 3.22Å; F38-S42 WeakPolarHBondContact O-CB 3.29Å; F38-S42 PolarHBondContact O-N 3.45Å; F38-S42 PolarHBondContact O-OG 3.02Å |
| 39 | R | 92.7 | Very high | 90.4 | Very high | 189 Ų | 189 | 104.2 Ų | 104.2 | 71% | 0.713 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -63.1 | -46 | 174.7 | -75.9 | 177 | 83.5 | -170.3 | 6.2 | 111.4 | S35 Q36 L37 S42 T43 | S35-R39 WeakPolarHBondContact O-CB 3.4Å; S35-R39 VanDerWaalsContact O-CG 3.23Å; S35-R39 WeakPolarHBondContact O-CG 3.33Å; S35-R39 PolarHBondContact O-N 2.99Å; Q36-R39 PolarHBondContact O-N 3.29Å; L37-R39 PolarHBondContact O-N 3.47Å; R39-S42 PolarHBondContact O-OG 2.7Å; R39-S42 VanDerWaalsContact O-OG 3.1Å; R39-T43 WeakPolarHBondContact O-CB 3.41Å; R39-T43 PolarHBondContact O-N 3.49Å; R39-T43 PolarHBondContact O-OG1 3.28Å |
| 40 | I | 91.9 | Very high | 90.7 | Very high | 98 Ų | 98 | 104.2 Ų | 104.2 | 50% | 0.503 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -67.4 | -47.5 | 177.9 | -63.7 | 167.4 | 0 | 0 | 0 | 110 | Q36 L37 T43 V44 | Q36-I40 HydrophobicContact CG-CD1 3.99Å; Q36-I40 WeakPolarHBondContact O-CG1 3.31Å; Q36-I40 PolarHBondContact O-N 2.94Å; L37-I40 PolarHBondContact O-N 2.88Å; I40-T43 PolarHBondContact O-N 2.79Å; I40-V44 HydrophobicContact CG2-CG2 4.46Å; I40-V44 WeakPolarHBondContact O-CG2 3.48Å; I40-V44 PolarHBondContact O-N 2.71Å |
| 41 | Y | 89.7 | Confident | 90.8 | Very high | 114 Ų | 114 | 103.4 Ų | 103.4 | 45% | 0.447 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -59.1 | -49.7 | -179.9 | 173.8 | -107.4 | 0 | 0 | 0 | 112.4 | L37 T43 V44 V45 F52 | L37-Y41 WeakPolarHBondContact O-CB 3.34Å; L37-Y41 PolarHBondContact O-N 3.17Å; Y41-T43 VanDerWaalsContact C-N 3.32Å; Y41-T43 PolarHBondContact O-N 3.3Å; Y41-V44 PolarHBondContact O-N 2.84Å; Y41-V44 VanDerWaalsContact O-N 3.17Å; Y41-V45 HydrophobicContact CD1-CG2 4.41Å; Y41-V45 HydrophobicContact CD2-CG2 4.01Å; Y41-V45 HydrophobicContact CE1-CG2 4.05Å; Y41-V45 HydrophobicContact CE2-CG2 3.6Å; Y41-V45 HydrophobicContact CG-CG2 4.39Å; Y41-V45 VanDerWaalsContact O-CG2 3.3Å; Y41-V45 WeakPolarHBondContact O-CG2 3.42Å; Y41-V45 PolarHBondContact O-N 3.23Å; Y41-F52 WeakPolarHBondContact OH-CE2 3.5Å; Y41-F52 WeakPolarHBondContact OH-CZ 3.46Å |
| 42 | S | 89.8 | Confident | 90.8 | Very high | 62 Ų | 62 | 103.9 Ų | 103.9 | 43% | 0.434 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.7 | -37 | 177.6 | 56.4 | 0 | 0 | 0 | 0 | 112.7 | F38 R39 S46 | F38-S42 VanDerWaalsContact O-CB 3.22Å; F38-S42 WeakPolarHBondContact O-CB 3.29Å; F38-S42 PolarHBondContact O-N 3.45Å; F38-S42 PolarHBondContact O-OG 3.02Å; R39-S42 PolarHBondContact O-OG 2.7Å; R39-S42 VanDerWaalsContact O-OG 3.1Å; S42-S46 VanDerWaalsContact O-CB 3.31Å; S42-S46 WeakPolarHBondContact O-CB 3.21Å; S42-S46 PolarHBondContact O-N 3.08Å; S42-S46 PolarHBondContact O-OG 3.22Å |
| 43 | T | 90.2 | Very high | 90.9 | Very high | 88 Ų | 88 | 101.8 Ų | 101.8 | 54% | 0.54 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.3 | -39.5 | 174.9 | -54.5 | 0 | 0 | 0 | 0 | 111.5 | R39 I40 Y41 S46 R47 | R39-T43 WeakPolarHBondContact O-CB 3.41Å; R39-T43 PolarHBondContact O-N 3.49Å; R39-T43 PolarHBondContact O-OG1 3.28Å; I40-T43 PolarHBondContact O-N 2.79Å; Y41-T43 VanDerWaalsContact C-N 3.32Å; Y41-T43 PolarHBondContact O-N 3.3Å; T43-S46 WeakPolarHBondContact CA-OG 3.28Å; T43-S46 PolarHBondContact O-OG 3.25Å; T43-R47 WeakPolarHBondContact O-CB 3.43Å; T43-R47 PolarHBondContact O-N 2.8Å |
| 44 | V | 90.3 | Very high | 91.1 | Very high | 85 Ų | 85 | 104.2 Ų | 104.2 | 52% | 0.515 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -69.4 | -45.6 | 177 | 172.8 | 0 | 0 | 0 | 0 | 111.4 | I40 Y41 R47 H48 | I40-V44 HydrophobicContact CG2-CG2 4.46Å; I40-V44 WeakPolarHBondContact O-CG2 3.48Å; I40-V44 PolarHBondContact O-N 2.71Å; Y41-V44 PolarHBondContact O-N 2.84Å; Y41-V44 VanDerWaalsContact O-N 3.17Å; V44-R47 PolarHBondContact O-N 2.9Å; V44-H48 PolarHBondContact O-N 3.43Å |
| 45 | V | 90.7 | Very high | 91.3 | Very high | 39 Ų | 39 | 105.2 Ų | 105.2 | 24% | 0.236 | 53% | 0.525 | C | S | . | . | H | α-helix | trans | -64.1 | -41.8 | -179.8 | 171.8 | 0 | 0 | 0 | 0 | 111.5 | Y41 H48 F52 | Y41-V45 HydrophobicContact CD1-CG2 4.41Å; Y41-V45 HydrophobicContact CD2-CG2 4.01Å; Y41-V45 HydrophobicContact CE1-CG2 4.05Å; Y41-V45 HydrophobicContact CE2-CG2 3.6Å; Y41-V45 HydrophobicContact CG-CG2 4.39Å; Y41-V45 VanDerWaalsContact O-CG2 3.3Å; Y41-V45 WeakPolarHBondContact O-CG2 3.42Å; Y41-V45 PolarHBondContact O-N 3.23Å; V45-H48 CarbonylContact O-C 3.25Å; V45-H48 VanDerWaalsContact O-C 3.25Å; V45-H48 PolarHBondContact O-N 2.91Å; V45-F52 HydrophobicContact CG1-CG 4.4Å |
| 46 | S | 88.3 | Confident | 91.5 | Very high | 90 Ų | 90 | 105.3 Ų | 105.3 | 63% | 0.629 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -67 | -35.3 | 177.1 | 55.2 | 0 | 0 | 0 | 0 | 112.9 | S42 T43 | S42-S46 VanDerWaalsContact O-CB 3.31Å; S42-S46 WeakPolarHBondContact O-CB 3.21Å; S42-S46 PolarHBondContact O-N 3.08Å; S42-S46 PolarHBondContact O-OG 3.22Å; T43-S46 WeakPolarHBondContact CA-OG 3.28Å; T43-S46 PolarHBondContact O-OG 3.25Å |
| 47 | R | 91.7 | Very high | 91.6 | Very high | 195 Ų | 195 | 103.3 Ų | 103.3 | 74% | 0.736 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -73.6 | -31.7 | 177.8 | -167.3 | 170.8 | -179.3 | 164.3 | -0.5 | 112.8 | T43 V44 | T43-R47 WeakPolarHBondContact O-CB 3.43Å; T43-R47 PolarHBondContact O-N 2.8Å; V44-R47 PolarHBondContact O-N 2.9Å |
| 48 | H | 90.6 | Very high | 91.8 | Very high | 110 Ų | 110 | 102.8 Ų | 102.8 | 51% | 0.509 | 52% | 0.517 | S | S | . | . | trans | -135.7 | 84.2 | -179.4 | -62.5 | -62.1 | 0 | 0 | 0 | 111.4 | V44 V45 P51 | V44-H48 PolarHBondContact O-N 3.43Å; V45-H48 CarbonylContact O-C 3.25Å; V45-H48 VanDerWaalsContact O-C 3.25Å; V45-H48 PolarHBondContact O-N 2.91Å; H48-P51 HydrophobicContact CB-CG 4.19Å; H48-P51 VanDerWaalsContact O-CD 3.29Å; H48-P51 WeakPolarHBondContact O-CD 3.46Å; H48-P51 WeakPolarHBondContact O-CG 3.27Å | ||
| 49 | P | 88 | Confident | 91.9 | Very high | 68 Ų | 68 | 101 Ų | 101 | 44% | 0.442 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -73.5 | -30.9 | -177.1 | 26.8 | -34.5 | 0 | 0 | 0 | 113.9 | F52 I53 | P49-F52 WeakPolarHBondContact O-CB 2.99Å; P49-F52 PolarHBondContact O-N 3.41Å; P49-F52 VanDerWaalsContact O-N 3.14Å; P49-I53 PolarHBondContact O-N 3.23Å |
| 50 | W | 92.1 | Very high | 92.1 | Very high | 183 Ų | 183 | 96 Ų | 96 | 69% | 0.693 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -54.1 | -50.6 | -176.4 | -78.8 | 106.2 | 0 | 0 | 0 | 116.1 | F52 I53 L54 | W50-F52 PolarHBondContact O-N 3.43Å; W50-I53 PolarHBondContact O-N 3.14Å; W50-I53 VanDerWaalsContact O-N 3.16Å; W50-L54 WeakPolarHBondContact O-CG 3.21Å; W50-L54 PolarHBondContact O-N 3.48Å |
| 51 | P | 90.4 | Very high | 92.2 | Very high | 70 Ų | 70 | 94.3 Ų | 94.3 | 46% | 0.455 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.2 | -31.5 | 178.7 | 23.4 | -35.3 | 0 | 0 | 0 | 112.3 | H48 I53 L54 V55 | H48-P51 HydrophobicContact CB-CG 4.19Å; H48-P51 VanDerWaalsContact O-CD 3.29Å; H48-P51 WeakPolarHBondContact O-CD 3.46Å; H48-P51 WeakPolarHBondContact O-CG 3.27Å; P51-I53 VanDerWaalsContact C-N 3.31Å; P51-I53 PolarHBondContact O-N 2.97Å; P51-L54 PolarHBondContact O-N 2.9Å; P51-V55 WeakPolarHBondContact O-CB 3.35Å; P51-V55 WeakPolarHBondContact O-CG2 3.49Å; P51-V55 PolarHBondContact O-N 3.16Å |
| 52 | F | 89.8 | Confident | 92.4 | Very high | 115 Ų | 115 | 94.1 Ų | 94.1 | 50% | 0.504 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -72.3 | -24.3 | -179.4 | -165.4 | -106 | 0 | 0 | 0 | 113.4 | Y41 V45 P49 W50 P56 | Y41-F52 WeakPolarHBondContact OH-CE2 3.5Å; Y41-F52 WeakPolarHBondContact OH-CZ 3.46Å; V45-F52 HydrophobicContact CG1-CG 4.4Å; P49-F52 WeakPolarHBondContact O-CB 2.99Å; P49-F52 PolarHBondContact O-N 3.41Å; P49-F52 VanDerWaalsContact O-N 3.14Å; W50-F52 PolarHBondContact O-N 3.43Å; F52-P56 WeakPolarHBondContact O-CD 3.09Å; F52-P56 WeakPolarHBondContact O-CG 2.95Å |
| 53 | I | 91.9 | Very high | 92.5 | Very high | 99 Ų | 99 | 98.5 Ų | 98.5 | 51% | 0.508 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -85.8 | -44.1 | 172.7 | -61.1 | 172.4 | 0 | 0 | 0 | 110 | P49 W50 P51 P56 V57 | P49-I53 PolarHBondContact O-N 3.23Å; W50-I53 PolarHBondContact O-N 3.14Å; W50-I53 VanDerWaalsContact O-N 3.16Å; P51-I53 VanDerWaalsContact C-N 3.31Å; P51-I53 PolarHBondContact O-N 2.97Å; I53-P56 WeakPolarHBondContact O-CD 3.23Å; I53-P56 WeakPolarHBondContact O-CG 3.21Å; I53-V57 WeakPolarHBondContact O-CG2 3.21Å; I53-V57 PolarHBondContact O-N 3.44Å |
| 54 | L | 95.1 | Very high | 92.7 | Very high | 84 Ų | 84 | 97.4 Ų | 97.4 | 44% | 0.44 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -68.7 | -41.6 | -176 | -72.1 | 174.8 | 0 | 0 | 0 | 112.8 | W50 P51 V57 L58 | W50-L54 WeakPolarHBondContact O-CG 3.21Å; W50-L54 PolarHBondContact O-N 3.48Å; P51-L54 PolarHBondContact O-N 2.9Å; L54-V57 PolarHBondContact O-N 2.85Å; L54-L58 WeakPolarHBondContact O-CB 3.08Å; L54-L58 VanDerWaalsContact O-CG 3.23Å; L54-L58 WeakPolarHBondContact O-CG 3.45Å; L54-L58 PolarHBondContact O-N 2.83Å |
| 55 | V | 94.8 | Very high | 92.8 | Very high | 93 Ų | 93 | 98.3 Ų | 98.3 | 56% | 0.564 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -57.5 | -54.4 | -178.7 | 168.2 | 0 | 0 | 0 | 0 | 112.8 | P51 V57 L58 L59 | P51-V55 WeakPolarHBondContact O-CB 3.35Å; P51-V55 WeakPolarHBondContact O-CG2 3.49Å; P51-V55 PolarHBondContact O-N 3.16Å; V55-V57 PolarHBondContact O-N 3.41Å; V55-L58 PolarHBondContact O-N 3.34Å; V55-L59 VanDerWaalsContact O-CB 3.22Å; V55-L59 WeakPolarHBondContact O-CB 3.37Å; V55-L59 PolarHBondContact O-N 3.39Å |
| 56 | P | 95.2 | Very high | 92.7 | Very high | 58 Ų | 58 | 98.9 Ų | 98.9 | 38% | 0.377 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -66.7 | -34.8 | 178.8 | 25.3 | -33.8 | 0 | 0 | 0 | 112.5 | F52 I53 L59 T60 | F52-P56 WeakPolarHBondContact O-CD 3.09Å; F52-P56 WeakPolarHBondContact O-CG 2.95Å; I53-P56 WeakPolarHBondContact O-CD 3.23Å; I53-P56 WeakPolarHBondContact O-CG 3.21Å; P56-L59 PolarHBondContact O-N 3.47Å; P56-T60 WeakPolarHBondContact O-CB 3.42Å; P56-T60 WeakPolarHBondContact O-CG2 3.22Å; P56-T60 PolarHBondContact O-N 2.78Å; P56-T60 PolarHBondContact O-OG1 2.87Å |
| 57 | V | 96 | Very high | 92.6 | Very high | 83 Ų | 83 | 100.8 Ų | 100.8 | 50% | 0.503 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -65.2 | -44.2 | 176.4 | 171.9 | 0 | 0 | 0 | 0 | 111.1 | I53 L54 V55 T60 S61 | I53-V57 WeakPolarHBondContact O-CG2 3.21Å; I53-V57 PolarHBondContact O-N 3.44Å; L54-V57 PolarHBondContact O-N 2.85Å; V55-V57 PolarHBondContact O-N 3.41Å; V57-T60 WeakPolarHBondContact CA-OG1 3.19Å; V57-T60 PolarHBondContact O-OG1 2.99Å; V57-S61 VanDerWaalsContact O-CB 3.28Å; V57-S61 WeakPolarHBondContact O-CB 3.45Å; V57-S61 PolarHBondContact O-N 3.3Å |
| 58 | L | 95.9 | Very high | 92.3 | Very high | 101 Ų | 101 | 98.7 Ų | 98.7 | 53% | 0.529 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -68 | -42 | 176.1 | -68.2 | 171.6 | 0 | 0 | 0 | 111.2 | L54 V55 T60 S61 I62 | L54-L58 WeakPolarHBondContact O-CB 3.08Å; L54-L58 VanDerWaalsContact O-CG 3.23Å; L54-L58 WeakPolarHBondContact O-CG 3.45Å; L54-L58 PolarHBondContact O-N 2.83Å; V55-L58 PolarHBondContact O-N 3.34Å; L58-T60 PolarHBondContact O-N 2.68Å; L58-S61 PolarHBondContact O-N 2.87Å; L58-I62 WeakPolarHBondContact O-CB 3.33Å; L58-I62 WeakPolarHBondContact O-CD1 3.3Å; L58-I62 WeakPolarHBondContact O-CG1 3.46Å; L58-I62 PolarHBondContact O-N 2.94Å |
| 59 | L | 95.4 | Very high | 92.1 | Very high | 96 Ų | 96 | 100.7 Ų | 100.7 | 50% | 0.503 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -62 | -45.6 | 178.5 | -174.8 | 65.2 | 0 | 0 | 0 | 111.8 | V55 P56 I62 F63 | V55-L59 VanDerWaalsContact O-CB 3.22Å; V55-L59 WeakPolarHBondContact O-CB 3.37Å; V55-L59 PolarHBondContact O-N 3.39Å; P56-L59 PolarHBondContact O-N 3.47Å; L59-I62 PolarHBondContact O-N 2.87Å; L59-F63 HydrophobicContact CD1-CD2 4.25Å; L59-F63 HydrophobicContact CD1-CE2 4.25Å; L59-F63 WeakPolarHBondContact O-CB 3.28Å; L59-F63 PolarHBondContact O-N 3.45Å |
| 60 | T | 95.2 | Very high | 91.7 | Very high | 84 Ų | 84 | 104.9 Ų | 104.9 | 52% | 0.515 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -65.1 | -40.1 | 176.5 | 51.7 | 0 | 0 | 0 | 0 | 111.6 | P56 V57 L58 F63 S64 | P56-T60 WeakPolarHBondContact O-CB 3.42Å; P56-T60 WeakPolarHBondContact O-CG2 3.22Å; P56-T60 PolarHBondContact O-N 2.78Å; P56-T60 PolarHBondContact O-OG1 2.87Å; V57-T60 WeakPolarHBondContact CA-OG1 3.19Å; V57-T60 PolarHBondContact O-OG1 2.99Å; L58-T60 PolarHBondContact O-N 2.68Å; T60-F63 PolarHBondContact O-N 3.5Å; T60-S64 VanDerWaalsContact O-CB 3.3Å; T60-S64 WeakPolarHBondContact O-CB 3.44Å; T60-S64 PolarHBondContact O-N 2.93Å; T60-S64 PolarHBondContact O-OG 3.41Å |
| 61 | S | 94.7 | Very high | 91 | Very high | 63 Ų | 63 | 102.1 Ų | 102.1 | 44% | 0.441 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -61.2 | -48.1 | 174.4 | -175.1 | 0 | 0 | 0 | 0 | 111.8 | V57 L58 F63 S64 I65 | V57-S61 VanDerWaalsContact O-CB 3.28Å; V57-S61 WeakPolarHBondContact O-CB 3.45Å; V57-S61 PolarHBondContact O-N 3.3Å; L58-S61 PolarHBondContact O-N 2.87Å; S61-F63 PolarHBondContact O-N 3.43Å; S61-S64 WeakPolarHBondContact O-CB 3.46Å; S61-S64 PolarHBondContact O-N 3.5Å; S61-S64 VanDerWaalsContact O-N 3.16Å; S61-I65 WeakPolarHBondContact O-CG1 3.42Å; S61-I65 PolarHBondContact O-N 3.07Å; S61-I65 VanDerWaalsContact O-N 3.07Å |
| 62 | I | 94.9 | Very high | 90.3 | Very high | 110 Ų | 110 | 103.2 Ų | 103.2 | 56% | 0.564 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -60.4 | -46.1 | 177.2 | -67.5 | 163.1 | 0 | 0 | 0 | 111.1 | L58 L59 S64 I65 | L58-I62 WeakPolarHBondContact O-CB 3.33Å; L58-I62 WeakPolarHBondContact O-CD1 3.3Å; L58-I62 WeakPolarHBondContact O-CG1 3.46Å; L58-I62 PolarHBondContact O-N 2.94Å; L59-I62 PolarHBondContact O-N 2.87Å; I62-S64 VanDerWaalsContact C-N 3.3Å; I62-S64 PolarHBondContact O-N 3.46Å; I62-I65 PolarHBondContact O-N 3.34Å |
| 63 | F | 91.9 | Very high | 89.6 | Confident | 155 Ų | 155 | 100.9 Ų | 100.9 | 68% | 0.68 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -63.7 | -36.2 | 176.5 | -98.9 | -123.9 | 0 | 0 | 0 | 112.4 | L59 T60 S61 I65 G66 | L59-F63 HydrophobicContact CD1-CD2 4.25Å; L59-F63 HydrophobicContact CD1-CE2 4.25Å; L59-F63 WeakPolarHBondContact O-CB 3.28Å; L59-F63 PolarHBondContact O-N 3.45Å; T60-F63 PolarHBondContact O-N 3.5Å; S61-F63 PolarHBondContact O-N 3.43Å; F63-I65 PolarHBondContact O-N 3.16Å; F63-G66 PolarHBondContact O-N 3.19Å |
| 64 | S | 94 | Very high | 88.6 | Confident | 64 Ų | 64 | 103.6 Ų | 103.6 | 45% | 0.448 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -66.2 | -36.1 | 178.5 | -60.4 | 0 | 0 | 0 | 0 | 112.2 | T60 S61 I62 G66 L67 | T60-S64 VanDerWaalsContact O-CB 3.3Å; T60-S64 WeakPolarHBondContact O-CB 3.44Å; T60-S64 PolarHBondContact O-N 2.93Å; T60-S64 PolarHBondContact O-OG 3.41Å; S61-S64 WeakPolarHBondContact O-CB 3.46Å; S61-S64 PolarHBondContact O-N 3.5Å; S61-S64 VanDerWaalsContact O-N 3.16Å; I62-S64 VanDerWaalsContact C-N 3.3Å; I62-S64 PolarHBondContact O-N 3.46Å; S64-G66 PolarHBondContact O-N 3.35Å; S64-L67 WeakPolarHBondContact O-CB 3.28Å; S64-L67 PolarHBondContact O-N 3.38Å |
| 65 | I | 92.4 | Very high | 87.6 | Confident | 105 Ų | 105 | 102 Ų | 102 | 54% | 0.538 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -59.8 | -37.4 | 174.1 | -64.8 | 163.3 | 0 | 0 | 0 | 110.8 | S61 I62 F63 L67 L68 | S61-I65 WeakPolarHBondContact O-CG1 3.42Å; S61-I65 PolarHBondContact O-N 3.07Å; S61-I65 VanDerWaalsContact O-N 3.07Å; I62-I65 PolarHBondContact O-N 3.34Å; F63-I65 PolarHBondContact O-N 3.16Å; I65-L67 PolarHBondContact O-N 3.26Å; I65-L68 WeakPolarHBondContact O-CB 3.42Å; I65-L68 PolarHBondContact O-N 3.07Å; I65-L68 VanDerWaalsContact O-N 3.07Å |
| 66 | G | 88.4 | Confident | 86.8 | Confident | 51 Ų | 51 | 100.2 Ų | 100.2 | 53% | 0.526 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -58.7 | -32.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | F63 S64 L68 H69 | F63-G66 PolarHBondContact O-N 3.19Å; S64-G66 PolarHBondContact O-N 3.35Å; G66-L68 VanDerWaalsContact C-N 3.34Å; G66-H69 PolarHBondContact O-N 3.14Å |
| 67 | L | 86.5 | Confident | 85.9 | Confident | 129 Ų | 129 | 100.8 Ų | 100.8 | 68% | 0.675 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -70.1 | -29.7 | 176.7 | -65.3 | 174.7 | 0 | 0 | 0 | 112.7 | S64 I65 H69 K70 | S64-L67 WeakPolarHBondContact O-CB 3.28Å; S64-L67 PolarHBondContact O-N 3.38Å; I65-L67 PolarHBondContact O-N 3.26Å; L67-H69 PolarHBondContact O-N 3.06Å; L67-K70 VanDerWaalsContact O-CB 3.28Å; L67-K70 WeakPolarHBondContact O-CB 3.38Å; L67-K70 PolarHBondContact O-N 3.34Å; L67-K70 VanDerWaalsContact O-N 3.14Å |
| 68 | L | 85.4 | Confident | 85.2 | Confident | 152 Ų | 152 | 104.3 Ų | 104.3 | 80% | 0.796 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -67.5 | -25.7 | 176.5 | -60.6 | 177.2 | 0 | 0 | 0 | 112.2 | I65 G66 K70 | I65-L68 WeakPolarHBondContact O-CB 3.42Å; I65-L68 PolarHBondContact O-N 3.07Å; I65-L68 VanDerWaalsContact O-N 3.07Å; G66-L68 VanDerWaalsContact C-N 3.34Å; L68-K70 PolarHBondContact O-N 3.45Å |
| 69 | H | 85.1 | Confident | 84.6 | Confident | 151 Ų | 151 | 104 Ų | 104 | 70% | 0.699 | 56% | 0.557 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.5 | 7.9 | 175.6 | -160.2 | 168.9 | 0 | 0 | 0 | 112.7 | G66 L67 N71 | G66-H69 PolarHBondContact O-N 3.14Å; L67-H69 PolarHBondContact O-N 3.06Å; H69-N71 PolarHBondContact O-N 3.21Å |
| 70 | K | 80.5 | Confident | 84.1 | Confident | 156 Ų | 156 | 108.7 Ų | 108.7 | 68% | 0.678 | 57% | 0.57 | S | S | * | * | trans | -70.8 | 101.8 | 174.2 | -172.5 | -172.4 | 175.8 | -171 | 0 | 109.6 | L67 L68 V72 | L67-K70 VanDerWaalsContact O-CB 3.28Å; L67-K70 WeakPolarHBondContact O-CB 3.38Å; L67-K70 PolarHBondContact O-N 3.34Å; L67-K70 VanDerWaalsContact O-N 3.14Å; L68-K70 PolarHBondContact O-N 3.45Å; K70-V72 PolarHBondContact O-N 2.96Å | ||
| 71 | N | 78.3 | Confident | 83.7 | Confident | 125 Ų | 125 | 105.9 Ų | 105.9 | 67% | 0.668 | 55% | 0.552 | S | S | * | * | trans | -64.7 | 117.7 | 167.3 | -72.9 | -70.2 | 0 | 0 | 0 | 109.1 | H69 V73 | H69-N71 PolarHBondContact O-N 3.21Å; N71-V73 PolarHBondContact O-N 3.01Å | ||
| 72 | V | 75.3 | Confident | 83.4 | Confident | 94 Ų | 94 | 107.3 Ų | 107.3 | 57% | 0.57 | 56% | 0.56 | S | S | * | * | trans | -72.7 | 94.6 | 172.9 | -73.6 | 0 | 0 | 0 | 0 | 108.8 | K70 I74 F154 | K70-V72 PolarHBondContact O-N 2.96Å; V72-I74 PolarHBondContact O-N 2.82Å; V72-F154 HydrophobicContact CG2-CE2 4.33Å; V72-F154 HydrophobicContact CG2-CZ 4.41Å | ||
| 73 | V | 74.9 | Confident | 82.9 | Confident | 66 Ų | 66 | 109.4 Ų | 109.4 | 40% | 0.4 | 57% | 0.572 | S | S | . | * | trans | -77.6 | 110.9 | 167.7 | -175.1 | 0 | 0 | 0 | 0 | 107.1 | N71 D75 Y78 L79 | N71-V73 PolarHBondContact O-N 3.01Å; V73-D75 VanDerWaalsContact C-N 3.34Å; V73-D75 HydrophobicContact CG1-CB 3.98Å; V73-Y78 HydrophobicContact CB-CD1 4.08Å; V73-Y78 HydrophobicContact CB-CE1 4.4Å; V73-Y78 HydrophobicContact CG1-CD1 3.56Å; V73-Y78 HydrophobicContact CG1-CE1 4.27Å; V73-Y78 HydrophobicContact CG1-CG 3.93Å; V73-Y78 HydrophobicContact CG2-CD1 4.42Å; V73-Y78 HydrophobicContact CG2-CE1 4.31Å; V73-L79 HydrophobicContact CB-CD1 4.16Å; V73-L79 HydrophobicContact CG1-CD1 4.04Å; V73-L79 WeakPolarHBondContact O-CD1 3.12Å | ||
| 74 | I | 71.3 | Confident | 82.4 | Confident | 156 Ų | 156 | 109.8 Ų | 109.8 | 80% | 0.8 | 58% | 0.581 | S | S | * | * | trans | -89.4 | -1.7 | 176.7 | 57.5 | 166.9 | 0 | 0 | 0 | 112.8 | V72 A76 | V72-I74 PolarHBondContact O-N 2.82Å; I74-A76 PolarHBondContact O-N 3.19Å | ||
| 75 | D | 73.9 | Confident | 81.9 | Confident | 49 Ų | 49 | 107.4 Ų | 107.4 | 26% | 0.262 | 57% | 0.566 | S | S | . | * | trans | -72.5 | 110.6 | -176.7 | -169.3 | -16.9 | 0 | 0 | 0 | 110.8 | V73 I77 Y78 L79 | V73-D75 VanDerWaalsContact C-N 3.34Å; V73-D75 HydrophobicContact CG1-CB 3.98Å; D75-I77 PolarHBondContact O-N 2.86Å; D75-I77 WeakPolarHBondContact OD1-CB 3.15Å; D75-I77 PolarHBondContact OD1-N 3.1Å; D75-Y78 PolarHBondContact O-N 2.89Å; D75-Y78 VanDerWaalsContact O-N 3.14Å; D75-L79 WeakPolarHBondContact O-CD1 3.27Å; D75-L79 PolarHBondContact O-N 3.19Å; D75-L79 VanDerWaalsContact O-N 3.07Å | ||
| 76 | A | 78 | Confident | 81.7 | Confident | 56 Ų | 56 | 107.6 Ų | 107.6 | 46% | 0.463 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -58.1 | -35.6 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | I74 Y78 L79 Y80 | I74-A76 PolarHBondContact O-N 3.19Å; A76-Y78 VanDerWaalsContact C-N 3.34Å; A76-Y78 PolarHBondContact O-N 2.75Å; A76-L79 PolarHBondContact O-N 3.02Å; A76-Y80 HydrophobicContact CB-CD2 4.24Å; A76-Y80 VanDerWaalsContact O-CD2 3.27Å; A76-Y80 WeakPolarHBondContact O-CD2 3.2Å; A76-Y80 PolarHBondContact O-N 3.07Å |
| 77 | I | 76.8 | Confident | 81.6 | Confident | 70 Ų | 70 | 107.3 Ų | 107.3 | 36% | 0.359 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -65.3 | -42.8 | 179.2 | -60.1 | -60.3 | 0 | 0 | 0 | 109.9 | D75 L79 T81 | D75-I77 PolarHBondContact O-N 2.86Å; D75-I77 WeakPolarHBondContact OD1-CB 3.15Å; D75-I77 PolarHBondContact OD1-N 3.1Å; I77-L79 VanDerWaalsContact C-N 3.34Å; I77-L79 PolarHBondContact O-N 3.29Å; I77-T81 WeakPolarHBondContact O-CB 3.03Å; I77-T81 PolarHBondContact O-N 3.47Å; I77-T81 VanDerWaalsContact O-N 3.1Å; I77-T81 PolarHBondContact O-OG1 3.49Å |
| 78 | Y | 80.2 | Confident | 81.5 | Confident | 157 Ų | 157 | 103 Ų | 103 | 62% | 0.616 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -64.2 | -38.5 | 176.7 | -176.8 | -95.5 | 0 | 0 | 0 | 112.3 | V73 D75 A76 | V73-Y78 HydrophobicContact CB-CD1 4.08Å; V73-Y78 HydrophobicContact CB-CE1 4.4Å; V73-Y78 HydrophobicContact CG1-CD1 3.56Å; V73-Y78 HydrophobicContact CG1-CE1 4.27Å; V73-Y78 HydrophobicContact CG1-CG 3.93Å; V73-Y78 HydrophobicContact CG2-CD1 4.42Å; V73-Y78 HydrophobicContact CG2-CE1 4.31Å; D75-Y78 PolarHBondContact O-N 2.89Å; D75-Y78 VanDerWaalsContact O-N 3.14Å; A76-Y78 VanDerWaalsContact C-N 3.34Å; A76-Y78 PolarHBondContact O-N 2.75Å |
| 79 | L | 84.5 | Confident | 81.7 | Confident | 96 Ų | 96 | 103.3 Ų | 103.3 | 50% | 0.503 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -76.4 | -37.5 | -174.3 | -92.3 | 73.5 | 0 | 0 | 0 | 113.7 | V73 D75 A76 I77 | V73-L79 HydrophobicContact CB-CD1 4.16Å; V73-L79 HydrophobicContact CG1-CD1 4.04Å; V73-L79 WeakPolarHBondContact O-CD1 3.12Å; D75-L79 WeakPolarHBondContact O-CD1 3.27Å; D75-L79 PolarHBondContact O-N 3.19Å; D75-L79 VanDerWaalsContact O-N 3.07Å; A76-L79 PolarHBondContact O-N 3.02Å; I77-L79 VanDerWaalsContact C-N 3.34Å; I77-L79 PolarHBondContact O-N 3.29Å |
| 80 | Y | 84.9 | Confident | 81.8 | Confident | 194 Ų | 194 | 101.3 Ų | 101.3 | 76% | 0.761 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -108.6 | -14.7 | -170 | -63.1 | -69 | 0 | 0 | 0 | 114.1 | A76 | A76-Y80 HydrophobicContact CB-CD2 4.24Å; A76-Y80 VanDerWaalsContact O-CD2 3.27Å; A76-Y80 WeakPolarHBondContact O-CD2 3.2Å; A76-Y80 PolarHBondContact O-N 3.07Å |
| 81 | T | 86 | Confident | 82 | Confident | 25 Ų | 25 | 95.9 Ų | 95.9 | 15% | 0.153 | 50% | 0.498 | C | S | . | . | S | Bend | trans | -95.6 | 129 | -178.7 | -48.7 | 0 | 0 | 0 | 0 | 110.5 | I77 S87 K88 | I77-T81 WeakPolarHBondContact O-CB 3.03Å; I77-T81 PolarHBondContact O-N 3.47Å; I77-T81 VanDerWaalsContact O-N 3.1Å; I77-T81 PolarHBondContact O-OG1 3.49Å; T81-S87 WeakPolarHBondContact CG2-OG 3.49Å; T81-K88 HydrophobicContact CG2-CG 4.42Å |
| 82 | P | 89 | Confident | 82.4 | Confident | 93 Ų | 93 | 96.4 Ų | 96.4 | 60% | 0.604 | 49% | 0.49 | S | S | * | . | trans | -56.9 | 160.2 | 176.5 | 24.4 | -34.1 | 0 | 0 | 0 | 112.2 | D84 G85 K88 | P82-D84 VanDerWaalsContact C-N 3.26Å; P82-D84 PolarHBondContact O-N 3.14Å; P82-G85 PolarHBondContact O-N 3.28Å; P82-K88 PolarHBondContact O-NZ 3.31Å | ||
| 83 | L | 83 | Confident | 83.1 | Confident | 154 Ų | 154 | 94.4 Ų | 94.4 | 81% | 0.806 | 48% | 0.478 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.9 | -44.1 | -177.1 | -78.6 | 116.1 | 0 | 0 | 0 | 112.2 | K88 | L83-K88 PolarHBondContact O-NZ 2.97Š|
| 84 | D | 83 | Confident | 83.6 | Confident | 162 Ų | 162 | 94.7 Ų | 94.7 | 87% | 0.866 | 47% | 0.474 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101.9 | 30.9 | -178.4 | -57.7 | -45 | 0 | 0 | 0 | 114 | P82 T86 | P82-D84 VanDerWaalsContact C-N 3.26Å; P82-D84 PolarHBondContact O-N 3.14Å; D84-T86 PolarHBondContact O-N 3.47Å |
| 85 | G | 83.8 | Confident | 84.2 | Confident | 14 Ų | 14 | 93 Ų | 93 | 14% | 0.144 | 46% | 0.463 | C | S | . | . | trans | -64.7 | 132.2 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | P82 S87 K88 | P82-G85 PolarHBondContact O-N 3.28Å; G85-S87 PolarHBondContact O-N 3.18Å; G85-K88 PolarHBondContact O-N 3.16Å | ||
| 86 | T | 88.2 | Confident | 84.8 | Confident | 110 Ų | 110 | 98 Ų | 98 | 68% | 0.675 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -56.5 | -30.8 | 175.6 | 50.8 | 0 | 0 | 0 | 0 | 112.7 | D84 K88 Y89 E90 | D84-T86 PolarHBondContact O-N 3.47Å; T86-K88 PolarHBondContact O-N 3.03Å; T86-Y89 WeakPolarHBondContact O-CB 3.03Å; T86-Y89 PolarHBondContact O-N 3.11Å; T86-E90 PolarHBondContact O-N 2.88Å |
| 87 | S | 84.5 | Confident | 85.2 | Confident | 44 Ų | 44 | 98.9 Ų | 98.9 | 31% | 0.308 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -59.7 | -30.1 | 176.1 | 58.1 | 0 | 0 | 0 | 0 | 113.7 | T81 G85 Q91 | T81-S87 WeakPolarHBondContact CG2-OG 3.49Å; G85-S87 PolarHBondContact O-N 3.18Å; S87-Q91 VanDerWaalsContact O-CB 3.27Å; S87-Q91 WeakPolarHBondContact O-CB 3.16Å; S87-Q91 PolarHBondContact O-N 2.94Å |
| 88 | K | 86 | Confident | 85.6 | Confident | 38 Ų | 38 | 100.5 Ų | 100.5 | 17% | 0.165 | 49% | 0.486 | C | S | . | . | H | α-helix | trans | -70.2 | -35.3 | 175.2 | -70.3 | -179.4 | -178.7 | 162 | 0 | 111.8 | T81 P82 L83 G85 T86 R92 | T81-K88 HydrophobicContact CG2-CG 4.42Å; P82-K88 PolarHBondContact O-NZ 3.31Å; L83-K88 PolarHBondContact O-NZ 2.97Å; G85-K88 PolarHBondContact O-N 3.16Å; T86-K88 PolarHBondContact O-N 3.03Å; K88-R92 WeakPolarHBondContact O-CG 3.42Å; K88-R92 PolarHBondContact O-N 3.23Å; K88-R92 VanDerWaalsContact O-N 3.13Å |
| 89 | Y | 88.5 | Confident | 85.4 | Confident | 160 Ų | 160 | 97 Ų | 97 | 63% | 0.627 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -67.1 | -48.6 | 174.4 | 173.4 | -100.2 | 0 | 0 | 0 | 110.3 | T86 Q91 R92 V93 | T86-Y89 WeakPolarHBondContact O-CB 3.03Å; T86-Y89 PolarHBondContact O-N 3.11Å; Y89-Q91 VanDerWaalsContact C-N 3.3Å; Y89-Q91 PolarHBondContact O-N 3.47Å; Y89-R92 PolarHBondContact O-N 3.33Å; Y89-R92 VanDerWaalsContact O-N 3.13Å; Y89-V93 HydrophobicContact CD1-CG2 4.39Å; Y89-V93 HydrophobicContact CE1-CG2 3.92Å; Y89-V93 HydrophobicContact CE2-CG2 4.16Å; Y89-V93 WeakPolarHBondContact O-CG2 3.27Å; Y89-V93 PolarHBondContact O-N 3.49Å |
| 90 | E | 88.3 | Confident | 84.9 | Confident | 108 Ų | 108 | 98.4 Ų | 98.4 | 51% | 0.505 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -57.1 | -44.6 | 176.3 | -66.6 | 174.5 | 167.7 | 0 | 0 | 111.4 | T86 R92 V93 F94 | T86-E90 PolarHBondContact O-N 2.88Å; E90-R92 PolarHBondContact O-N 2.96Å; E90-V93 PolarHBondContact O-N 3.42Å; E90-F94 HydrophobicContact CB-CE2 4.49Å; E90-F94 WeakPolarHBondContact O-CD2 3.36Å; E90-F94 PolarHBondContact O-N 3.18Å |
| 91 | Q | 84.7 | Confident | 84.2 | Confident | 42 Ų | 42 | 93.3 Ų | 93.3 | 20% | 0.196 | 48% | 0.479 | C | S | . | . | H | α-helix | trans | -56.9 | -46.1 | 175.2 | 168.5 | 167.1 | 1 | 0 | 0 | 112.8 | S87 Y89 V93 F94 E95 L112 | S87-Q91 VanDerWaalsContact O-CB 3.27Å; S87-Q91 WeakPolarHBondContact O-CB 3.16Å; S87-Q91 PolarHBondContact O-N 2.94Å; Y89-Q91 VanDerWaalsContact C-N 3.3Å; Y89-Q91 PolarHBondContact O-N 3.47Å; Q91-V93 VanDerWaalsContact C-N 3.33Å; Q91-V93 PolarHBondContact O-N 3.13Å; Q91-F94 PolarHBondContact O-N 3.05Å; Q91-E95 PolarHBondContact O-N 3.14Å; Q91-L112 HydrophobicContact CB-CD2 4.08Å; Q91-L112 HydrophobicContact CG-CD1 3.92Å; Q91-L112 HydrophobicContact CG-CD2 3.58Å; Q91-L112 HydrophobicContact CG-CG 4.4Å |
| 92 | R | 85.9 | Confident | 83.4 | Confident | 137 Ų | 137 | 100.2 Ų | 100.2 | 52% | 0.517 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.9 | -42.4 | 177.6 | -72 | 179.9 | -159.7 | 112.7 | -3.6 | 111.5 | K88 Y89 E90 F94 E95 E96 | K88-R92 WeakPolarHBondContact O-CG 3.42Å; K88-R92 PolarHBondContact O-N 3.23Å; K88-R92 VanDerWaalsContact O-N 3.13Å; Y89-R92 PolarHBondContact O-N 3.33Å; Y89-R92 VanDerWaalsContact O-N 3.13Å; E90-R92 PolarHBondContact O-N 2.96Å; R92-F94 VanDerWaalsContact C-N 3.31Å; R92-F94 PolarHBondContact O-N 3.15Å; R92-E95 PolarHBondContact O-N 2.91Å; R92-E96 WeakPolarHBondContact O-CG 3.27Å; R92-E96 PolarHBondContact O-N 2.88Å |
| 93 | V | 90 | Very high | 82.6 | Confident | 52 Ų | 52 | 99.6 Ų | 99.6 | 32% | 0.315 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -61.1 | -41.5 | 176.3 | 174.7 | 0 | 0 | 0 | 0 | 111 | Y89 E90 Q91 E96 T97 | Y89-V93 HydrophobicContact CD1-CG2 4.39Å; Y89-V93 HydrophobicContact CE1-CG2 3.92Å; Y89-V93 HydrophobicContact CE2-CG2 4.16Å; Y89-V93 WeakPolarHBondContact O-CG2 3.27Å; Y89-V93 PolarHBondContact O-N 3.49Å; E90-V93 PolarHBondContact O-N 3.42Å; Q91-V93 VanDerWaalsContact C-N 3.33Å; Q91-V93 PolarHBondContact O-N 3.13Å; V93-E96 PolarHBondContact O-N 3.18Å; V93-T97 WeakPolarHBondContact O-CB 3.49Å; V93-T97 PolarHBondContact O-N 2.77Å; V93-T97 PolarHBondContact O-OG1 2.79Å |
| 94 | F | 85.8 | Confident | 81.9 | Confident | 72 Ų | 72 | 95.7 Ų | 95.7 | 32% | 0.316 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.6 | -41.8 | 175.3 | -79.5 | -67.8 | 0 | 0 | 0 | 112.6 | E90 Q91 R92 T97 W98 I111 L112 | E90-F94 HydrophobicContact CB-CE2 4.49Å; E90-F94 WeakPolarHBondContact O-CD2 3.36Å; E90-F94 PolarHBondContact O-N 3.18Å; Q91-F94 PolarHBondContact O-N 3.05Å; R92-F94 VanDerWaalsContact C-N 3.31Å; R92-F94 PolarHBondContact O-N 3.15Å; F94-T97 PolarHBondContact O-N 3.03Å; F94-W98 AromaticContact CD1-CE3 3.66Å; F94-W98 HydrophobicContact CD1-CE3 3.66Å; F94-W98 HydrophobicContact CD1-CH2 4.49Å; F94-W98 AromaticContact CD1-CZ3 3.36Å; F94-W98 HydrophobicContact CD1-CZ3 3.36Å; F94-W98 HydrophobicContact CE1-CE3 4.32Å; F94-W98 HydrophobicContact CE1-CH2 4.39Å; F94-W98 AromaticContact CE1-CZ3 3.61Å; F94-W98 HydrophobicContact CE1-CZ3 3.61Å; F94-W98 HydrophobicContact CG-CZ3 4.49Å; F94-W98 PolarHBondContact O-N 2.65Å; F94-I111 HydrophobicContact CD1-CD1 3.9Å; F94-I111 HydrophobicContact CE1-CD1 3.58Å; F94-I111 HydrophobicContact CZ-CD1 4.03Å; F94-L112 HydrophobicContact CB-CD1 4.39Å |
| 95 | E | 82.7 | Confident | 81.2 | Confident | 120 Ų | 120 | 93.6 Ų | 93.6 | 56% | 0.561 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -66.4 | -38.8 | 178.5 | -170.7 | 167.2 | -171.3 | 0 | 0 | 112.2 | Q91 R92 L112 | Q91-E95 PolarHBondContact O-N 3.14Å; R92-E95 PolarHBondContact O-N 2.91Å; E95-L112 HydrophobicContact CB-CD1 4Å |
| 96 | E | 86.6 | Confident | 80.7 | Confident | 155 Ų | 155 | 97.7 Ų | 97.7 | 72% | 0.724 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -71.9 | -39.5 | 175.1 | -72.5 | 175.6 | -172.9 | 0 | 0 | 112.7 | R92 V93 | R92-E96 WeakPolarHBondContact O-CG 3.27Å; R92-E96 PolarHBondContact O-N 2.88Å; V93-E96 PolarHBondContact O-N 3.18Å |
| 97 | T | 87.5 | Confident | 79.8 | Confident | 73 Ų | 73 | 97.2 Ų | 97.2 | 45% | 0.448 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -76.2 | -34.1 | -175.9 | -54.5 | 0 | 0 | 0 | 0 | 112 | V93 F94 | V93-T97 WeakPolarHBondContact O-CB 3.49Å; V93-T97 PolarHBondContact O-N 2.77Å; V93-T97 PolarHBondContact O-OG1 2.79Å; F94-T97 PolarHBondContact O-N 3.03Å |
| 98 | W | 84.3 | Confident | 79.2 | Confident | 105 Ų | 105 | 98.5 Ų | 98.5 | 40% | 0.398 | 53% | 0.526 | S | S | . | . | S | Bend | trans | -130.2 | 76.4 | -179.2 | -66.3 | -74.3 | 0 | 0 | 0 | 111.3 | F94 L100 | F94-W98 AromaticContact CD1-CE3 3.66Å; F94-W98 HydrophobicContact CD1-CE3 3.66Å; F94-W98 HydrophobicContact CD1-CH2 4.49Å; F94-W98 AromaticContact CD1-CZ3 3.36Å; F94-W98 HydrophobicContact CD1-CZ3 3.36Å; F94-W98 HydrophobicContact CE1-CE3 4.32Å; F94-W98 HydrophobicContact CE1-CH2 4.39Å; F94-W98 AromaticContact CE1-CZ3 3.61Å; F94-W98 HydrophobicContact CE1-CZ3 3.61Å; F94-W98 HydrophobicContact CG-CZ3 4.49Å; F94-W98 PolarHBondContact O-N 2.65Å; W98-L100 PolarHBondContact O-N 3.34Å |
| 99 | P | 77.4 | Confident | 78.5 | Confident | 83 Ų | 83 | 103.7 Ų | 103.7 | 54% | 0.539 | 55% | 0.545 | S | S | . | . | trans | -64.4 | 129.1 | 176.8 | 26.4 | -33.8 | 0 | 0 | 0 | 110.6 | T101 | P99-T101 PolarHBondContact O-N 2.77Š| ||
| 100 | L | 72.6 | Confident | 77.5 | Confident | 125 Ų | 125 | 97.1 Ų | 97.1 | 65% | 0.654 | 52% | 0.521 | S | S | * | . | trans | -72.5 | 95.1 | 171.1 | -70.7 | 153.3 | 0 | 0 | 0 | 108.1 | W98 F105 | W98-L100 PolarHBondContact O-N 3.34Å; L100-F105 HydrophobicContact CD2-CD2 4.47Å | ||
| 101 | T | 71.1 | Confident | 76.5 | Confident | 88 Ų | 88 | 96.6 Ų | 96.6 | 54% | 0.54 | 52% | 0.521 | S | S | . | . | trans | -94.9 | 142 | 171 | -55.3 | 0 | 0 | 0 | 0 | 109.4 | P99 G103 T104 | P99-T101 PolarHBondContact O-N 2.77Å; T101-G103 PolarHBondContact O-N 2.9Å; T101-G103 VanDerWaalsContact O-N 3.08Å; T101-T104 PolarHBondContact O-N 3.3Å; T101-T104 PolarHBondContact O-OG1 3.48Å | ||
| 102 | D | 69.6 | Low | 75.5 | Confident | 170 Ų | 170 | 96.8 Ų | 96.8 | 91% | 0.909 | 52% | 0.523 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57 | 114.6 | 175.8 | -63.4 | -31.5 | 0 | 0 | 0 | 110 | ||
| 103 | G | 70.5 | Confident | 74.4 | Confident | 80 Ų | 80 | 96.7 Ų | 96.7 | 83% | 0.825 | 53% | 0.532 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 111.4 | -17.8 | 178.8 | 0 | 0 | 0 | 0 | 0 | 116.1 | T101 | T101-G103 PolarHBondContact O-N 2.9Å; T101-G103 VanDerWaalsContact O-N 3.08Å |
| 104 | T | 69.4 | Low | 73.2 | Confident | 72 Ų | 72 | 101.6 Ų | 101.6 | 44% | 0.442 | 55% | 0.549 | S | S | . | . | trans | -113.2 | 53 | 178.3 | 54.3 | 0 | 0 | 0 | 0 | 111.6 | T101 Q106 | T101-T104 PolarHBondContact O-N 3.3Å; T101-T104 PolarHBondContact O-OG1 3.48Å; T104-Q106 VanDerWaalsContact C-OE1 3.3Å; T104-Q106 PolarHBondContact O-N 3.27Å; T104-Q106 PolarHBondContact O-NE2 3.5Å; T104-Q106 PolarHBondContact O-OE1 2.85Å | ||
| 105 | F | 68.5 | Low | 72.2 | Confident | 117 Ų | 117 | 107.6 Ų | 107.6 | 51% | 0.513 | 57% | 0.57 | S | S | . | * | trans | -79.1 | 111.7 | 176.2 | -177.7 | -101.5 | 0 | 0 | 0 | 110.8 | L100 P107 T110 | L100-F105 HydrophobicContact CD2-CD2 4.47Å; F105-P107 HydrophobicContact CE1-CB 4.33Å; F105-T110 HydrophobicContact CE2-CG2 4.35Å; F105-T110 WeakPolarHBondContact CE2-OG1 3.2Å | ||
| 106 | Q | 72.1 | Confident | 71.5 | Confident | 100 Ų | 100 | 106 Ų | 106 | 47% | 0.467 | 56% | 0.562 | S | S | . | * | trans | -110.6 | 116.3 | 171.7 | -67.5 | 72.8 | -136.6 | 0 | 0 | 109.9 | T104 G108 R109 T110 | T104-Q106 VanDerWaalsContact C-OE1 3.3Å; T104-Q106 PolarHBondContact O-N 3.27Å; T104-Q106 PolarHBondContact O-NE2 3.5Å; T104-Q106 PolarHBondContact O-OE1 2.85Å; Q106-G108 PolarHBondContact O-N 3.01Å; Q106-R109 HydrophobicContact CB-CB 4.17Å; Q106-R109 HydrophobicContact CB-CG 3.94Å; Q106-R109 PolarHBondContact O-N 2.93Å; Q106-T110 PolarHBondContact O-N 2.93Å; Q106-T110 PolarHBondContact O-OG1 2.91Å | ||
| 107 | P | 69.6 | Low | 70.9 | Confident | 101 Ų | 101 | 103.3 Ų | 103.3 | 66% | 0.656 | 56% | 0.561 | S | S | * | * | G | 310 helix | trans | -61.1 | -32.8 | -175.5 | 23.3 | -33.5 | 0 | 0 | 0 | 113 | F105 R109 | F105-P107 HydrophobicContact CE1-CB 4.33Å; P107-R109 PolarHBondContact O-N 3.33Å |
| 108 | G | 73 | Confident | 70.4 | Confident | 71 Ų | 71 | 106.9 Ų | 106.9 | 73% | 0.732 | 57% | 0.572 | S | S | * | * | G | 310 helix | trans | -74.6 | -6.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | Q106 | Q106-G108 PolarHBondContact O-N 3.01Š|
| 109 | R | 70.4 | Confident | 70.3 | Confident | 146 Ų | 146 | 106.1 Ų | 106.1 | 55% | 0.551 | 58% | 0.579 | S | S | * | * | G | 310 helix | trans | -108 | -9.7 | 179.1 | -61.2 | -64.7 | -175.2 | -172.8 | -1.1 | 112.8 | Q106 P107 I111 | Q106-R109 HydrophobicContact CB-CB 4.17Å; Q106-R109 HydrophobicContact CB-CG 3.94Å; Q106-R109 PolarHBondContact O-N 2.93Å; P107-R109 PolarHBondContact O-N 3.33Å; R109-I111 PolarHBondContact O-N 3.01Å |
| 110 | T | 68.3 | Low | 70.7 | Confident | 23 Ų | 23 | 109.6 Ų | 109.6 | 14% | 0.141 | 59% | 0.591 | C | S | . | * | trans | -83.5 | 80 | 179.1 | -49.7 | 0 | 0 | 0 | 0 | 110.3 | F105 Q106 | F105-T110 HydrophobicContact CE2-CG2 4.35Å; F105-T110 WeakPolarHBondContact CE2-OG1 3.2Å; Q106-T110 PolarHBondContact O-N 2.93Å; Q106-T110 PolarHBondContact O-OG1 2.91Å | ||
| 111 | I | 65.7 | Low | 71.3 | Confident | 97 Ų | 97 | 106.7 Ų | 106.7 | 50% | 0.497 | 58% | 0.579 | S | S | . | * | trans | -84.7 | -29.4 | 173.9 | -57 | 172.5 | 0 | 0 | 0 | 110.4 | F94 R109 L113 | F94-I111 HydrophobicContact CD1-CD1 3.9Å; F94-I111 HydrophobicContact CE1-CD1 3.58Å; F94-I111 HydrophobicContact CZ-CD1 4.03Å; R109-I111 PolarHBondContact O-N 3.01Å; I111-L113 WeakPolarHBondContact O-CD1 3.4Å; I111-L113 PolarHBondContact O-N 3.43Å; I111-L113 VanDerWaalsContact O-N 3.15Å | ||
| 112 | L | 65.5 | Low | 72 | Confident | 46 Ų | 46 | 107.3 Ų | 107.3 | 24% | 0.241 | 59% | 0.587 | C | S | . | * | S | Bend | trans | -85.8 | 88.9 | 178 | -55.6 | 179.4 | 0 | 0 | 0 | 108.6 | Q91 F94 E95 K114 | Q91-L112 HydrophobicContact CB-CD2 4.08Å; Q91-L112 HydrophobicContact CG-CD1 3.92Å; Q91-L112 HydrophobicContact CG-CD2 3.58Å; Q91-L112 HydrophobicContact CG-CG 4.4Å; F94-L112 HydrophobicContact CB-CD1 4.39Å; E95-L112 HydrophobicContact CB-CD1 4Å; L112-K114 PolarHBondContact O-N 3.17Å |
| 113 | L | 62.7 | Low | 72.7 | Confident | 134 Ų | 134 | 99.7 Ų | 99.7 | 70% | 0.702 | 55% | 0.547 | S | S | * | . | trans | -68.2 | 52.5 | -178.5 | -84.9 | 73.7 | 0 | 0 | 0 | 112.8 | I111 | I111-L113 WeakPolarHBondContact O-CD1 3.4Å; I111-L113 PolarHBondContact O-N 3.43Å; I111-L113 VanDerWaalsContact O-N 3.15Å | ||
| 114 | K | 63.6 | Low | 73.4 | Confident | 155 Ų | 155 | 106.2 Ų | 106.2 | 67% | 0.674 | 55% | 0.553 | S | S | * | * | S | Bend | trans | -73.1 | -40.5 | -173.4 | -140.5 | 171.7 | -173.4 | -179 | 0 | 112.1 | L112 | L112-K114 PolarHBondContact O-N 3.17Š|
| 115 | R | 65.6 | Low | 74.2 | Confident | 198 Ų | 198 | 107.4 Ų | 107.4 | 75% | 0.747 | 56% | 0.557 | S | S | * | * | S | Bend | trans | -158.4 | 76.3 | 179.7 | -61.3 | -173.7 | -179.5 | -167.5 | -4.2 | 111.8 | D153 | R115-D153 IonicContact CZ-OD1 3.83Å; R115-D153 IonicContact NH1-OD1 3.03Å; R115-D153 PolarHBondContact NH1-OD1 3.34Å; R115-D153 IonicContact NH2-OD1 3.67Å |
| 116 | Q | 67.9 | Low | 74.9 | Confident | 86 Ų | 86 | 111.1 Ų | 111.1 | 40% | 0.402 | 57% | 0.573 | S | S | . | * | trans | -103 | 130.7 | 173.6 | -174.3 | -178.4 | 6.3 | 0 | 0 | 110.7 | Q118 | Q116-Q118 HydrophobicContact CG-CG 4.34Š| ||
| 117 | S | 73.7 | Confident | 75.5 | Confident | 100 Ų | 100 | 107.8 Ų | 107.8 | 70% | 0.699 | 57% | 0.565 | S | S | * | * | trans | -104.9 | 136.7 | 164.6 | 60.6 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 118 | Q | 76.3 | Confident | 76.3 | Confident | 148 Ų | 148 | 107.6 Ų | 107.6 | 69% | 0.692 | 56% | 0.558 | S | S | * | * | trans | -114.3 | 123.2 | 175.8 | -66 | -174.1 | 2.2 | 0 | 0 | 108.8 | Q116 | Q116-Q118 HydrophobicContact CG-CG 4.34Š| ||
| 119 | V | 82.4 | Confident | 76.8 | Confident | 89 Ų | 89 | 107.5 Ų | 107.5 | 54% | 0.539 | 54% | 0.543 | S | S | . | . | trans | -112.2 | 115.9 | 177.4 | -178.4 | 0 | 0 | 0 | 0 | 108.2 | V121 L141 I145 | V119-V121 HydrophobicContact CG1-CG2 4.36Å; V119-L141 HydrophobicContact CG1-CD2 4.26Å; V119-I145 HydrophobicContact CG1-CD1 4.48Å; V119-I145 HydrophobicContact CG2-CD1 4.1Å | ||
| 120 | I | 85.7 | Confident | 77.4 | Confident | 155 Ų | 155 | 107.4 Ų | 107.4 | 80% | 0.795 | 55% | 0.553 | S | S | * | * | trans | -102.5 | 116.4 | 178.7 | -58.4 | 173.8 | 0 | 0 | 0 | 108 | ||||
| 121 | V | 84.8 | Confident | 78.4 | Confident | 65 Ų | 65 | 110.3 Ų | 110.3 | 39% | 0.394 | 56% | 0.561 | S | S | . | * | trans | -98.3 | 125.4 | 177 | -175.7 | 0 | 0 | 0 | 0 | 109.4 | V119 V138 L141 | V119-V121 HydrophobicContact CG1-CG2 4.36Å; V121-V138 HydrophobicContact CB-CG2 4.31Å; V121-V138 HydrophobicContact CG1-CG2 4Å; V121-V138 HydrophobicContact CG2-CG2 4.36Å; V121-L141 HydrophobicContact CG2-CD2 3.79Å | ||
| 122 | S | 85.7 | Confident | 79.4 | Confident | 100 Ų | 100 | 110.1 Ų | 110.1 | 70% | 0.699 | 57% | 0.567 | S | S | * | * | trans | -117.1 | 138.9 | 174.5 | -167.3 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 123 | A | 86.4 | Confident | 80.4 | Confident | 10 Ų | 10 | 113.4 Ų | 113.4 | 8% | 0.083 | 59% | 0.589 | C | S | . | * | trans | -73.9 | 134.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | D125 K126 V129 I134 | A123-D125 WeakPolarHBondContact CB-OD1 3.48Å; A123-D125 PolarHBondContact O-N 3.05Å; A123-K126 WeakPolarHBondContact O-CA 3.45Å; A123-K126 PolarHBondContact O-N 3.21Å; A123-V129 HydrophobicContact CB-CG1 4.14Å; A123-I134 HydrophobicContact CB-CD1 3.74Å | ||
| 124 | K | 84.6 | Confident | 81.5 | Confident | 218 Ų | 218 | 108.6 Ų | 108.6 | 95% | 0.948 | 56% | 0.563 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.4 | -33.4 | 179.7 | -175.8 | 178.1 | 179.3 | -179.1 | 0 | 113 | K126 | K124-K126 VanDerWaalsContact C-N 3.27Å; K124-K126 PolarHBondContact O-N 3.06Å |
| 125 | D | 85.9 | Confident | 82.7 | Confident | 97 Ų | 97 | 103.4 Ų | 103.4 | 52% | 0.519 | 55% | 0.547 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.5 | 4.6 | 178.6 | 68.6 | -24.2 | 0 | 0 | 0 | 113.3 | A123 G127 R131 | A123-D125 WeakPolarHBondContact CB-OD1 3.48Å; A123-D125 PolarHBondContact O-N 3.05Å; D125-G127 PolarHBondContact O-N 3.42Å; D125-G127 PolarHBondContact OD1-N 3.04Å; D125-G127 VanDerWaalsContact OD1-N 3.14Å; D125-R131 IonicContact OD1-CZ 3.82Å; D125-R131 IonicContact OD1-NH2 2.77Å; D125-R131 PolarHBondContact OD1-NH2 3.25Å; D125-R131 IonicContact OD2-CZ 3.09Å; D125-R131 IonicContact OD2-NH1 2.65Å; D125-R131 PolarHBondContact OD2-NH1 3.36Å; D125-R131 IonicContact OD2-NH2 2.79Å; D125-R131 PolarHBondContact OD2-NH2 2.95Å |
| 126 | K | 82.3 | Confident | 83.8 | Confident | 195 Ų | 195 | 101.4 Ų | 101.4 | 85% | 0.848 | 54% | 0.543 | S | S | * | . | S | Bend | trans | 53.9 | 19.6 | -173.2 | -58.3 | -178.9 | 178.6 | -178.2 | 0 | 113.7 | A123 K124 | A123-K126 WeakPolarHBondContact O-CA 3.45Å; A123-K126 PolarHBondContact O-N 3.21Å; K124-K126 VanDerWaalsContact C-N 3.27Å; K124-K126 PolarHBondContact O-N 3.06Å |
| 127 | G | 85.6 | Confident | 84.8 | Confident | 30 Ų | 30 | 100.1 Ų | 100.1 | 31% | 0.309 | 55% | 0.547 | S | S | . | . | trans | -87.5 | -169.9 | -178.5 | 0 | 0 | 0 | 0 | 0 | 113 | D125 V129 | D125-G127 PolarHBondContact O-N 3.42Å; D125-G127 PolarHBondContact OD1-N 3.04Å; D125-G127 VanDerWaalsContact OD1-N 3.14Å; G127-V129 PolarHBondContact O-N 3.13Å | ||
| 128 | N | 86.4 | Confident | 85.6 | Confident | 96 Ų | 96 | 98 Ų | 98 | 51% | 0.513 | 53% | 0.53 | S | S | . | . | trans | -64.9 | 120.3 | 179.9 | -170.1 | -16.4 | 0 | 0 | 0 | 111.5 | L130 R131 | N128-L130 VanDerWaalsContact C-N 3.28Å; N128-L130 PolarHBondContact O-N 3.25Å; N128-L130 VanDerWaalsContact OD1-CB 3.31Å; N128-L130 WeakPolarHBondContact OD1-CB 3.27Å; N128-L130 VanDerWaalsContact OD1-CD1 3.3Å; N128-L130 WeakPolarHBondContact OD1-CD1 3.49Å; N128-L130 PolarHBondContact OD1-N 3.31Å; N128-R131 WeakPolarHBondContact O-CG 3.5Å; N128-R131 VanDerWaalsContact O-CZ 3.28Å; N128-R131 PolarHBondContact O-NE 3.35Å; N128-R131 PolarHBondContact O-NH2 3.49Å | ||
| 129 | V | 83.7 | Confident | 86.2 | Confident | 69 Ų | 69 | 96.6 Ų | 96.6 | 42% | 0.418 | 53% | 0.527 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.8 | -19 | 178.3 | -66.3 | 0 | 0 | 0 | 0 | 113.5 | A123 G127 R131 I134 | A123-V129 HydrophobicContact CB-CG1 4.14Å; G127-V129 PolarHBondContact O-N 3.13Å; V129-R131 PolarHBondContact O-N 3.06Å; V129-I134 HydrophobicContact CB-CG2 4.44Å; V129-I134 WeakPolarHBondContact O-CB 3.43Å; V129-I134 WeakPolarHBondContact O-CG2 3.3Å |
| 130 | L | 83.6 | Confident | 86.6 | Confident | 145 Ų | 145 | 102.1 Ų | 102.1 | 76% | 0.759 | 54% | 0.538 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.2 | 1.3 | 178.8 | -69 | 124.4 | 0 | 0 | 0 | 113.6 | N128 | N128-L130 VanDerWaalsContact C-N 3.28Å; N128-L130 PolarHBondContact O-N 3.25Å; N128-L130 VanDerWaalsContact OD1-CB 3.31Å; N128-L130 WeakPolarHBondContact OD1-CB 3.27Å; N128-L130 VanDerWaalsContact OD1-CD1 3.3Å; N128-L130 WeakPolarHBondContact OD1-CD1 3.49Å; N128-L130 PolarHBondContact OD1-N 3.31Å |
| 131 | R | 88.3 | Confident | 86.8 | Confident | 83 Ų | 83 | 98 Ų | 98 | 31% | 0.313 | 52% | 0.517 | S | S | . | . | S | Bend | trans | -61.2 | 141 | 175.8 | -75.3 | 175.4 | -67.2 | -154.4 | 1.8 | 110.5 | D125 N128 V129 V133 I134 S135 | D125-R131 IonicContact OD1-CZ 3.82Å; D125-R131 IonicContact OD1-NH2 2.77Å; D125-R131 PolarHBondContact OD1-NH2 3.25Å; D125-R131 IonicContact OD2-CZ 3.09Å; D125-R131 IonicContact OD2-NH1 2.65Å; D125-R131 PolarHBondContact OD2-NH1 3.36Å; D125-R131 IonicContact OD2-NH2 2.79Å; D125-R131 PolarHBondContact OD2-NH2 2.95Å; N128-R131 WeakPolarHBondContact O-CG 3.5Å; N128-R131 VanDerWaalsContact O-CZ 3.28Å; N128-R131 PolarHBondContact O-NE 3.35Å; N128-R131 PolarHBondContact O-NH2 3.49Å; V129-R131 PolarHBondContact O-N 3.06Å; R131-V133 PolarHBondContact O-N 3.21Å; R131-I134 HydrophobicContact CB-CD1 4.41Å; R131-I134 PolarHBondContact O-N 2.97Å; R131-S135 PolarHBondContact O-N 2.91Å; R131-S135 PolarHBondContact O-OG 3.42Å |
| 132 | P | 86.4 | Confident | 86.9 | Confident | 93 Ų | 93 | 98.8 Ų | 98.8 | 60% | 0.604 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -60.1 | -24.9 | -175.3 | 23.8 | -34.7 | 0 | 0 | 0 | 113.7 | S135 K136 | P132-S135 WeakPolarHBondContact CA-OG 3.36Å; P132-S135 PolarHBondContact O-OG 3.23Å; P132-K136 VanDerWaalsContact O-CG 3.31Å; P132-K136 WeakPolarHBondContact O-CG 3.49Å; P132-K136 PolarHBondContact O-N 3.24Å |
| 133 | V | 86.6 | Confident | 87.1 | Confident | 116 Ų | 116 | 98.6 Ų | 98.6 | 70% | 0.703 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -71.5 | -41.8 | 175.6 | -178.4 | 0 | 0 | 0 | 0 | 111.3 | R131 A137 | R131-V133 PolarHBondContact O-N 3.21Å; V133-A137 PolarHBondContact O-N 3.43Å |
| 134 | I | 87 | Confident | 87.1 | Confident | 32 Ų | 32 | 101.9 Ų | 101.9 | 16% | 0.164 | 52% | 0.523 | C | S | . | . | H | α-helix | trans | -77.4 | -40 | -178.2 | -61.7 | 172.1 | 0 | 0 | 0 | 110.1 | A123 V129 R131 K136 A137 V138 | A123-I134 HydrophobicContact CB-CD1 3.74Å; V129-I134 HydrophobicContact CB-CG2 4.44Å; V129-I134 WeakPolarHBondContact O-CB 3.43Å; V129-I134 WeakPolarHBondContact O-CG2 3.3Å; R131-I134 HydrophobicContact CB-CD1 4.41Å; R131-I134 PolarHBondContact O-N 2.97Å; I134-K136 VanDerWaalsContact C-N 3.31Å; I134-K136 PolarHBondContact O-N 2.79Å; I134-A137 WeakPolarHBondContact O-CA 3.41Å; I134-A137 WeakPolarHBondContact O-CB 3.07Å; I134-A137 PolarHBondContact O-N 3.2Å; I134-V138 HydrophobicContact CG2-CG2 4.26Å; I134-V138 WeakPolarHBondContact O-CG2 3.33Å; I134-V138 PolarHBondContact O-N 3.47Å |
| 135 | S | 87.5 | Confident | 87.2 | Confident | 47 Ų | 47 | 94.1 Ų | 94.1 | 33% | 0.329 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -60.2 | -40 | 176.8 | 62.3 | 0 | 0 | 0 | 0 | 112.2 | R131 P132 A137 V138 L139 | R131-S135 PolarHBondContact O-N 2.91Å; R131-S135 PolarHBondContact O-OG 3.42Å; P132-S135 WeakPolarHBondContact CA-OG 3.36Å; P132-S135 PolarHBondContact O-OG 3.23Å; S135-A137 VanDerWaalsContact C-N 3.33Å; S135-A137 PolarHBondContact O-N 3.04Å; S135-V138 PolarHBondContact O-N 3.45Å; S135-L139 WeakPolarHBondContact O-CG 3.46Å; S135-L139 PolarHBondContact O-N 2.97Å |
| 136 | K | 90.1 | Very high | 87.1 | Confident | 155 Ų | 155 | 96 Ų | 96 | 67% | 0.674 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -60.8 | -40.3 | 171.8 | -76.5 | 178.6 | -178 | -177 | 0 | 112.5 | P132 I134 L139 R140 | P132-K136 VanDerWaalsContact O-CG 3.31Å; P132-K136 WeakPolarHBondContact O-CG 3.49Å; P132-K136 PolarHBondContact O-N 3.24Å; I134-K136 VanDerWaalsContact C-N 3.31Å; I134-K136 PolarHBondContact O-N 2.79Å; K136-L139 PolarHBondContact O-N 2.87Å; K136-R140 WeakPolarHBondContact O-CB 3.41Å; K136-R140 PolarHBondContact O-N 2.94Å |
| 137 | A | 88.3 | Confident | 87.1 | Confident | 59 Ų | 59 | 91.6 Ų | 91.6 | 49% | 0.488 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -66.9 | -40.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112 | V133 I134 S135 R140 L141 | V133-A137 PolarHBondContact O-N 3.43Å; I134-A137 WeakPolarHBondContact O-CA 3.41Å; I134-A137 WeakPolarHBondContact O-CB 3.07Å; I134-A137 PolarHBondContact O-N 3.2Å; S135-A137 VanDerWaalsContact C-N 3.33Å; S135-A137 PolarHBondContact O-N 3.04Å; A137-R140 PolarHBondContact O-N 3.03Å; A137-L141 WeakPolarHBondContact O-CB 3.48Å; A137-L141 PolarHBondContact O-N 3.36Å |
| 138 | V | 90 | Very high | 87 | Confident | 57 Ų | 57 | 94.7 Ų | 94.7 | 35% | 0.345 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -63.7 | -42.9 | 175.3 | 173.3 | 0 | 0 | 0 | 0 | 111.1 | V121 I134 S135 R140 L141 N142 | V121-V138 HydrophobicContact CB-CG2 4.31Å; V121-V138 HydrophobicContact CG1-CG2 4Å; V121-V138 HydrophobicContact CG2-CG2 4.36Å; I134-V138 HydrophobicContact CG2-CG2 4.26Å; I134-V138 WeakPolarHBondContact O-CG2 3.33Å; I134-V138 PolarHBondContact O-N 3.47Å; S135-V138 PolarHBondContact O-N 3.45Å; V138-R140 VanDerWaalsContact C-N 3.35Å; V138-R140 PolarHBondContact O-N 3.37Å; V138-L141 WeakPolarHBondContact O-CB 3.43Å; V138-L141 PolarHBondContact O-N 3.37Å; V138-N142 WeakPolarHBondContact O-CB 3.45Å; V138-N142 PolarHBondContact O-N 3.48Å |
| 139 | L | 90.1 | Very high | 86.5 | Confident | 118 Ų | 118 | 93.2 Ų | 93.2 | 62% | 0.618 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -62.7 | -42 | 175.8 | -72.2 | 172.6 | 0 | 0 | 0 | 111.7 | S135 K136 L141 N142 D143 | S135-L139 WeakPolarHBondContact O-CG 3.46Å; S135-L139 PolarHBondContact O-N 2.97Å; K136-L139 PolarHBondContact O-N 2.87Å; L139-L141 VanDerWaalsContact C-N 3.33Å; L139-L141 PolarHBondContact O-N 2.91Å; L139-N142 PolarHBondContact O-N 3.49Å; L139-D143 WeakPolarHBondContact O-CB 3.47Å; L139-D143 PolarHBondContact O-N 3.29Å |
| 140 | R | 89.6 | Confident | 85.9 | Confident | 204 Ų | 204 | 98.5 Ų | 98.5 | 77% | 0.77 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -63.3 | -38.8 | 174.7 | -171.3 | 178.8 | -176 | 180 | 0.7 | 112.2 | K136 A137 V138 F144 | K136-R140 WeakPolarHBondContact O-CB 3.41Å; K136-R140 PolarHBondContact O-N 2.94Å; A137-R140 PolarHBondContact O-N 3.03Å; V138-R140 VanDerWaalsContact C-N 3.35Å; V138-R140 PolarHBondContact O-N 3.37Å; R140-F144 WeakPolarHBondContact O-CB 3.45Å; R140-F144 PolarHBondContact O-N 2.88Å |
| 141 | L | 89.4 | Confident | 85.2 | Confident | 68 Ų | 68 | 96.7 Ų | 96.7 | 36% | 0.356 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -66 | -43 | 175 | 177.7 | 63.5 | 0 | 0 | 0 | 111.4 | V119 V121 A137 V138 L139 D143 F144 I145 | V119-L141 HydrophobicContact CG1-CD2 4.26Å; V121-L141 HydrophobicContact CG2-CD2 3.79Å; A137-L141 WeakPolarHBondContact O-CB 3.48Å; A137-L141 PolarHBondContact O-N 3.36Å; V138-L141 WeakPolarHBondContact O-CB 3.43Å; V138-L141 PolarHBondContact O-N 3.37Å; L139-L141 VanDerWaalsContact C-N 3.33Å; L139-L141 PolarHBondContact O-N 2.91Å; L141-D143 VanDerWaalsContact C-N 3.34Å; L141-F144 WeakPolarHBondContact O-CB 3.3Å; L141-F144 PolarHBondContact O-N 3.18Å; L141-I145 HydrophobicContact CD1-CD1 4.03Å; L141-I145 HydrophobicContact CD1-CG1 4.33Å; L141-I145 HydrophobicContact CG-CD1 3.86Å; L141-I145 VanDerWaalsContact O-CG1 3.27Å; L141-I145 WeakPolarHBondContact O-CG1 3.34Å; L141-I145 PolarHBondContact O-N 3.49Å |
| 142 | N | 88.3 | Confident | 83.7 | Confident | 83 Ų | 83 | 96.4 Ų | 96.4 | 44% | 0.444 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.5 | -43.9 | 176.2 | -179.2 | 83.3 | 0 | 0 | 0 | 111.5 | V138 L139 F144 I145 M146 | V138-N142 WeakPolarHBondContact O-CB 3.45Å; V138-N142 PolarHBondContact O-N 3.48Å; L139-N142 PolarHBondContact O-N 3.49Å; N142-F144 VanDerWaalsContact C-N 3.34Å; N142-F144 PolarHBondContact O-N 2.98Å; N142-I145 PolarHBondContact O-N 2.68Å; N142-M146 WeakPolarHBondContact O-CB 3.46Å; N142-M146 VanDerWaalsContact O-CG 3.3Å; N142-M146 WeakPolarHBondContact O-CG 3.39Å; N142-M146 PolarHBondContact O-N 3.24Å |
| 143 | D | 88.7 | Confident | 82.4 | Confident | 95 Ų | 95 | 98 Ų | 98 | 51% | 0.508 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.3 | -41.7 | 176.8 | -167.5 | 60.3 | 0 | 0 | 0 | 111.9 | L139 L141 M146 N147 | L139-D143 WeakPolarHBondContact O-CB 3.47Å; L139-D143 PolarHBondContact O-N 3.29Å; L141-D143 VanDerWaalsContact C-N 3.34Å; D143-M146 PolarHBondContact O-N 2.89Å; D143-N147 VanDerWaalsContact CG-ND2 3.31Å; D143-N147 WeakPolarHBondContact O-CB 3.35Å; D143-N147 PolarHBondContact O-N 3.48Å; D143-N147 PolarHBondContact O-ND2 3.02Å; D143-N147 VanDerWaalsContact O-ND2 3.17Å; D143-N147 PolarHBondContact OD1-ND2 2.81Å |
| 144 | F | 87.8 | Confident | 80.7 | Confident | 80 Ų | 80 | 101.5 Ų | 101.5 | 35% | 0.351 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -61.1 | -45.2 | 173.4 | 179.8 | -99.1 | 0 | 0 | 0 | 112.2 | R140 L141 N142 D148 V149 L162 | R140-F144 WeakPolarHBondContact O-CB 3.45Å; R140-F144 PolarHBondContact O-N 2.88Å; L141-F144 WeakPolarHBondContact O-CB 3.3Å; L141-F144 PolarHBondContact O-N 3.18Å; N142-F144 VanDerWaalsContact C-N 3.34Å; N142-F144 PolarHBondContact O-N 2.98Å; F144-D148 HydrophobicContact CD2-CB 4.01Å; F144-D148 HydrophobicContact CE2-CB 3.95Å; F144-D148 WeakPolarHBondContact CE2-OD2 3.22Å; F144-D148 HydrophobicContact CZ-CB 4.44Å; F144-D148 VanDerWaalsContact O-CB 3.27Å; F144-D148 WeakPolarHBondContact O-CB 3.31Å; F144-D148 PolarHBondContact O-N 2.99Å; F144-V149 HydrophobicContact CE1-CG2 4.38Å; F144-L162 HydrophobicContact CZ-CD2 4.16Å |
| 145 | I | 86.5 | Confident | 78.6 | Confident | 54 Ų | 54 | 102.8 Ų | 102.8 | 28% | 0.277 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -65.1 | -42.4 | 179.2 | -68 | 163.7 | 0 | 0 | 0 | 111.3 | V119 L141 N142 V149 | V119-I145 HydrophobicContact CG1-CD1 4.48Å; V119-I145 HydrophobicContact CG2-CD1 4.1Å; L141-I145 HydrophobicContact CD1-CD1 4.03Å; L141-I145 HydrophobicContact CD1-CG1 4.33Å; L141-I145 HydrophobicContact CG-CD1 3.86Å; L141-I145 VanDerWaalsContact O-CG1 3.27Å; L141-I145 WeakPolarHBondContact O-CG1 3.34Å; L141-I145 PolarHBondContact O-N 3.49Å; N142-I145 PolarHBondContact O-N 2.68Å; I145-V149 WeakPolarHBondContact O-CB 3.31Å |
| 146 | M | 82.6 | Confident | 76.6 | Confident | 137 Ų | 137 | 110.2 Ų | 110.2 | 68% | 0.675 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -72.3 | -35.3 | -177 | -71 | -63.9 | -164.3 | 0 | 0 | 113.2 | N142 D143 | N142-M146 WeakPolarHBondContact O-CB 3.46Å; N142-M146 VanDerWaalsContact O-CG 3.3Å; N142-M146 WeakPolarHBondContact O-CG 3.39Å; N142-M146 PolarHBondContact O-N 3.24Å; D143-M146 PolarHBondContact O-N 2.89Å |
| 147 | N | 83.3 | Confident | 74.7 | Confident | 103 Ų | 103 | 107.1 Ų | 107.1 | 55% | 0.551 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -100.5 | -28.1 | -172.1 | -62.7 | -39.3 | 0 | 0 | 0 | 114.2 | D143 | D143-N147 VanDerWaalsContact CG-ND2 3.31Å; D143-N147 WeakPolarHBondContact O-CB 3.35Å; D143-N147 PolarHBondContact O-N 3.48Å; D143-N147 PolarHBondContact O-ND2 3.02Å; D143-N147 VanDerWaalsContact O-ND2 3.17Å; D143-N147 PolarHBondContact OD1-ND2 2.81Å |
| 148 | D | 82.1 | Confident | 72.4 | Confident | 95 Ų | 95 | 109.4 Ų | 109.4 | 51% | 0.508 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -113.2 | -16.8 | -169.1 | -155.9 | 39.8 | 0 | 0 | 0 | 113.6 | F144 Y150 | F144-D148 HydrophobicContact CD2-CB 4.01Å; F144-D148 HydrophobicContact CE2-CB 3.95Å; F144-D148 WeakPolarHBondContact CE2-OD2 3.22Å; F144-D148 HydrophobicContact CZ-CB 4.44Å; F144-D148 VanDerWaalsContact O-CB 3.27Å; F144-D148 WeakPolarHBondContact O-CB 3.31Å; F144-D148 PolarHBondContact O-N 2.99Å; D148-Y150 PolarHBondContact O-N 3.35Å |
| 149 | V | 76.2 | Confident | 70.8 | Confident | 64 Ų | 64 | 112.5 Ų | 112.5 | 39% | 0.388 | 58% | 0.575 | S | S | . | * | trans | -91.6 | 105 | -178.9 | -177.5 | 0 | 0 | 0 | 0 | 110.6 | F144 I145 I157 | F144-V149 HydrophobicContact CE1-CG2 4.38Å; I145-V149 WeakPolarHBondContact O-CB 3.31Å; V149-I157 HydrophobicContact CG1-CD1 4.36Å | ||
| 150 | Y | 72.4 | Confident | 68.8 | Low | 180 Ų | 180 | 112 Ų | 112 | 71% | 0.706 | 58% | 0.582 | S | S | * | * | trans | -91 | 121.8 | 168.8 | -58 | -83.1 | 0 | 0 | 0 | 110.3 | D148 S152 | D148-Y150 PolarHBondContact O-N 3.35Å; Y150-S152 PolarHBondContact O-N 2.71Å; Y150-S152 VanDerWaalsContact O-N 3.11Å | ||
| 151 | V | 67.9 | Low | 66.7 | Low | 108 Ų | 108 | 106.8 Ų | 106.8 | 66% | 0.655 | 58% | 0.577 | S | S | * | * | trans | -75.7 | 100.2 | 171.8 | -177.4 | 0 | 0 | 0 | 0 | 108.2 | D153 | V151-D153 PolarHBondContact O-N 3.16Š| ||
| 152 | S | 56.7 | Low | 64.6 | Low | 77 Ų | 77 | 110.1 Ų | 110.1 | 54% | 0.538 | 59% | 0.594 | S | S | . | * | trans | -73.1 | 121.5 | 166.7 | -63.2 | 0 | 0 | 0 | 0 | 108.2 | Y150 F154 A155 | Y150-S152 PolarHBondContact O-N 2.71Å; Y150-S152 VanDerWaalsContact O-N 3.11Å; S152-F154 PolarHBondContact O-N 3.04Å; S152-A155 PolarHBondContact O-N 3.15Å | ||
| 153 | D | 59.3 | Low | 62.5 | Low | 126 Ų | 126 | 114.3 Ų | 114.3 | 67% | 0.674 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.7 | -5.6 | -170.5 | -81.2 | -56 | 0 | 0 | 0 | 116.1 | R115 V151 | R115-D153 IonicContact CZ-OD1 3.83Å; R115-D153 IonicContact NH1-OD1 3.03Å; R115-D153 PolarHBondContact NH1-OD1 3.34Å; R115-D153 IonicContact NH2-OD1 3.67Å; V151-D153 PolarHBondContact O-N 3.16Å |
| 154 | F | 50.6 | Low | 59.7 | Low | 189 Ų | 189 | 120.6 Ų | 120.6 | 83% | 0.829 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -134.6 | 10.1 | -178.2 | -127.6 | -95.9 | 0 | 0 | 0 | 116.6 | V72 S152 | V72-F154 HydrophobicContact CG2-CE2 4.33Å; V72-F154 HydrophobicContact CG2-CZ 4.41Å; S152-F154 PolarHBondContact O-N 3.04Å |
| 155 | A | 42.9 | Very low | 57.3 | Low | 60 Ų | 60 | 126.6 Ų | 126.6 | 50% | 0.496 | 68% | 0.681 | S | S | . | * | trans | -110 | 118.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | S152 I157 | S152-A155 PolarHBondContact O-N 3.15Å; A155-I157 VanDerWaalsContact C-N 3.3Å; A155-I157 PolarHBondContact O-N 3.47Å | ||
| 156 | F | 46.5 | Very low | 55.9 | Low | 203 Ų | 203 | 130.2 Ų | 130.2 | 89% | 0.89 | 70% | 0.701 | S | S | * | * | trans | -61.8 | 94.7 | 162 | -123.6 | -97.1 | 0 | 0 | 0 | 107.3 | T158 | F156-T158 VanDerWaalsContact C-N 3.3Å; F156-T158 PolarHBondContact O-N 3.19Å | ||
| 157 | I | 50.1 | Low | 54.5 | Low | 89 Ų | 89 | 129.8 Ų | 129.8 | 46% | 0.456 | 70% | 0.703 | S | S | . | * | trans | -70.4 | 93.7 | 176.6 | -54.6 | 178.6 | 0 | 0 | 0 | 107.1 | V149 A155 V159 | V149-I157 HydrophobicContact CG1-CD1 4.36Å; A155-I157 VanDerWaalsContact C-N 3.3Å; A155-I157 PolarHBondContact O-N 3.47Å; I157-V159 HydrophobicContact CG2-CG2 3.75Å; I157-V159 PolarHBondContact O-N 3.39Å; I157-V159 VanDerWaalsContact O-N 3.16Å | ||
| 158 | T | 40.6 | Very low | 52.9 | Low | 108 Ų | 108 | 131.3 Ų | 131.3 | 66% | 0.663 | 71% | 0.711 | S | S | * | * | trans | -78.5 | 93.7 | 168.9 | -58.8 | 0 | 0 | 0 | 0 | 107.2 | F156 S160 | F156-T158 VanDerWaalsContact C-N 3.3Å; F156-T158 PolarHBondContact O-N 3.19Å; T158-S160 PolarHBondContact O-N 3.08Å | ||
| 159 | V | 54.9 | Low | 51.2 | Low | 121 Ų | 121 | 133.5 Ų | 133.5 | 73% | 0.733 | 72% | 0.723 | S | S | * | * | trans | -73.7 | 72.2 | 173.7 | -167.8 | 0 | 0 | 0 | 0 | 108.7 | I157 | I157-V159 HydrophobicContact CG2-CG2 3.75Å; I157-V159 PolarHBondContact O-N 3.39Å; I157-V159 VanDerWaalsContact O-N 3.16Å | ||
| 160 | S | 49.3 | Very low | 49.6 | Very low | 107 Ų | 107 | 137.8 Ų | 137.8 | 75% | 0.748 | 74% | 0.744 | S | S | * | * | trans | -111.5 | 1.5 | 173.2 | -168.2 | 0 | 0 | 0 | 0 | 113.3 | T158 | T158-S160 PolarHBondContact O-N 3.08Š| ||
| 161 | S | 44.2 | Very low | 48.1 | Very low | 96 Ų | 96 | 135 Ų | 135 | 67% | 0.671 | 75% | 0.746 | S | S | * | * | S | Bend | trans | -129.9 | 5.5 | -172.2 | -166 | 0 | 0 | 0 | 0 | 117.1 | ||
| 162 | L | 45.1 | Very low | 46.7 | Very low | 137 Ų | 137 | 136.9 Ų | 136.9 | 72% | 0.717 | 75% | 0.753 | S | S | * | * | S | Bend | trans | -103.5 | 44.1 | 176.7 | -99.2 | 131.8 | 0 | 0 | 0 | 112.9 | F144 | F144-L162 HydrophobicContact CZ-CD2 4.16Š|
| 163 | I | 44.4 | Very low | 45.9 | Very low | 172 Ų | 172 | 141.5 Ų | 141.5 | 88% | 0.882 | 77% | 0.769 | S | S | * | * | trans | -138.5 | 74 | 152 | -55.5 | 176.7 | 0 | 0 | 0 | 106.1 | ||||
| 164 | R | 30.5 | Very low | 44.8 | Very low | 227 Ų | 227 | 142.8 Ų | 142.8 | 86% | 0.857 | 78% | 0.777 | S | S | * | * | trans | -124 | 105.7 | 162.8 | -128.2 | 179.9 | -162.1 | -125 | 3.7 | 107.3 | ||||
| 165 | C | 38.3 | Very low | 44.2 | Very low | 205 Ų | 205 | 138.6 Ų | 138.6 | 100% | 1.385 | 77% | 0.773 | S | S | * | * | trans | 69 | 0 | 170.1 | -67.6 | 0 | 0 | 0 | 0 | 117 |
Retrieved 165 of 165 residues in 62.2 ms
(Link to these results)