| 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 | 38.9 | Very low | 50.1 | Low | 243 Ų | 243 | 147 Ų | 147 | 100% | 1.197 | 80% | 0.798 | S | S | * | * | 0 | 105.2 | 0 | -71.8 | -63.4 | -169 | 0 | 0 | 109 | |||||
| 2 | R | 52.6 | Low | 52.4 | Low | 211 Ų | 211 | 140 Ų | 140 | 80% | 0.796 | 77% | 0.766 | S | S | * | * | trans | -77.3 | 155.3 | 152.4 | -78.9 | -172.7 | -173 | -174 | 2.4 | 106.8 | ||||
| 3 | P | 56 | Low | 54.7 | Low | 115 Ų | 115 | 142.6 Ų | 142.6 | 75% | 0.747 | 77% | 0.765 | S | S | * | * | -146.7 | -169.1 | 56.4 | 27.1 | 1.7 | 0 | 0 | 0 | 111.2 | |||||
| 4 | L | 39.8 | Very low | 56.6 | Low | 158 Ų | 158 | 142.6 Ų | 142.6 | 83% | 0.827 | 76% | 0.758 | S | S | * | * | cis | -138 | 144.7 | 14.8 | -90.9 | 84.6 | 0 | 0 | 0 | 108.5 | ||||
| 5 | R | 50.4 | Low | 58.6 | Low | 206 Ų | 206 | 139.1 Ų | 139.1 | 78% | 0.777 | 74% | 0.74 | S | S | * | * | trans | -72.2 | 122.9 | 158.5 | -88.1 | 176.9 | -115.6 | -144.2 | -1.9 | 107.6 | T7 | R5-T7 VanDerWaalsContact C-N 3.35Å; R5-T7 PolarHBondContact O-N 3.19Å; R5-T7 VanDerWaalsContact O-N 3.1Å | ||
| 6 | D | 43.8 | Very low | 60.5 | Low | 168 Ų | 168 | 137.1 Ų | 137.1 | 90% | 0.898 | 73% | 0.727 | S | S | * | * | trans | -71.6 | 94.7 | 160.7 | -119.7 | -16.2 | 0 | 0 | 0 | 107.5 | G8 | D6-G8 VanDerWaalsContact C-N 3.32Å; D6-G8 PolarHBondContact O-N 3.1Å | ||
| 7 | T | 46.6 | Very low | 62.4 | Low | 122 Ų | 122 | 134.4 Ų | 134.4 | 75% | 0.748 | 71% | 0.711 | S | S | * | * | trans | -77.5 | 90.9 | 162.5 | 49.4 | 0 | 0 | 0 | 0 | 106.7 | R5 | R5-T7 VanDerWaalsContact C-N 3.35Å; R5-T7 PolarHBondContact O-N 3.19Å; R5-T7 VanDerWaalsContact O-N 3.1Å | ||
| 8 | G | 53.2 | Low | 64.1 | Low | 58 Ų | 58 | 131.6 Ų | 131.6 | 60% | 0.598 | 70% | 0.696 | S | S | * | * | trans | -53.8 | 146.4 | 166 | 0 | 0 | 0 | 0 | 0 | 110.1 | D6 S10 | D6-G8 VanDerWaalsContact C-N 3.32Å; D6-G8 PolarHBondContact O-N 3.1Å; G8-S10 PolarHBondContact O-N 3.11Å | ||
| 9 | P | 50.3 | Low | 65.6 | Low | 124 Ų | 124 | 127.1 Ų | 127.1 | 81% | 0.805 | 68% | 0.679 | S | S | * | * | trans | -68.4 | 110.4 | -170.7 | 27.4 | -31.8 | 0 | 0 | 0 | 109.9 | V11 | P9-V11 PolarHBondContact O-N 3.03Å; P9-V11 VanDerWaalsContact O-N 3.11Å | ||
| 10 | S | 57 | Low | 67 | Low | 111 Ų | 111 | 126.1 Ų | 126.1 | 78% | 0.776 | 67% | 0.67 | S | S | * | * | trans | -70.6 | 99.7 | 163.4 | 169.4 | 0 | 0 | 0 | 0 | 107.6 | G8 P12 | G8-S10 PolarHBondContact O-N 3.11Å; S10-P12 WeakPolarHBondContact O-CD 3.46Å | ||
| 11 | V | 62.3 | Low | 68.4 | Low | 101 Ų | 101 | 124.9 Ų | 124.9 | 61% | 0.612 | 66% | 0.663 | S | S | * | * | trans | -55.8 | 124.2 | 168.2 | -174.2 | 0 | 0 | 0 | 0 | 107.8 | P9 K13 N15 | P9-V11 PolarHBondContact O-N 3.03Å; P9-V11 VanDerWaalsContact O-N 3.11Å; V11-K13 PolarHBondContact O-N 3.1Å; V11-N15 HydrophobicContact CG1-CB 4.05Å | ||
| 12 | P | 77.9 | Confident | 71.2 | Confident | 63 Ų | 63 | 118.9 Ų | 118.9 | 41% | 0.409 | 63% | 0.632 | S | S | . | * | trans | -59.4 | 135.6 | 179.2 | -20.5 | 30.4 | 0 | 0 | 0 | 110.2 | S10 E14 N15 M16 | S10-P12 WeakPolarHBondContact O-CD 3.46Å; P12-E14 PolarHBondContact O-N 3.48Å; P12-N15 WeakPolarHBondContact O-CB 3.27Å; P12-N15 PolarHBondContact O-N 3.43Å; P12-M16 PolarHBondContact O-N 3.06Å | ||
| 13 | K | 81.8 | Confident | 73.2 | Confident | 174 Ų | 174 | 113.4 Ų | 113.4 | 76% | 0.757 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -52.3 | -32.3 | 178.9 | -68.7 | -179.1 | 178.2 | -178.5 | 0 | 112.9 | V11 N15 M16 I17 | V11-K13 PolarHBondContact O-N 3.1Å; K13-N15 VanDerWaalsContact C-N 3.35Å; K13-N15 PolarHBondContact O-N 2.94Å; K13-M16 WeakPolarHBondContact O-CB 3.46Å; K13-M16 PolarHBondContact O-N 3.45Å; K13-I17 WeakPolarHBondContact O-CG1 3.44Å; K13-I17 PolarHBondContact O-N 2.94Å |
| 14 | E | 81.7 | Confident | 75.2 | Confident | 143 Ų | 143 | 111.2 Ų | 111.2 | 67% | 0.668 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -59.4 | -41.3 | 174.9 | -72.6 | 162.8 | 168.4 | 0 | 0 | 112.5 | P12 M16 I17 I18 | P12-E14 PolarHBondContact O-N 3.48Å; E14-M16 VanDerWaalsContact C-N 3.3Å; E14-M16 PolarHBondContact O-N 3.44Å; E14-I17 PolarHBondContact O-N 3.47Å; E14-I18 WeakPolarHBondContact O-CD1 3.5Å; E14-I18 WeakPolarHBondContact O-CG1 3.47Å; E14-I18 PolarHBondContact O-N 2.89Å |
| 15 | N | 86.8 | Confident | 77.9 | Confident | 89 Ų | 89 | 108 Ų | 108 | 48% | 0.476 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -68.3 | -31.9 | 177.8 | -71 | -7 | 0 | 0 | 0 | 112.1 | V11 P12 K13 A19 | V11-N15 HydrophobicContact CG1-CB 4.05Å; P12-N15 WeakPolarHBondContact O-CB 3.27Å; P12-N15 PolarHBondContact O-N 3.43Å; K13-N15 VanDerWaalsContact C-N 3.35Å; K13-N15 PolarHBondContact O-N 2.94Å; N15-A19 PolarHBondContact O-N 3.36Å; N15-A19 VanDerWaalsContact O-N 3.1Å |
| 16 | M | 88.3 | Confident | 80.2 | Confident | 108 Ų | 108 | 101.8 Ų | 101.8 | 53% | 0.532 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -69.1 | -44.8 | 175.6 | -159.6 | 179.2 | 79.5 | 0 | 0 | 111 | P12 K13 E14 I18 A19 E20 | P12-M16 PolarHBondContact O-N 3.06Å; K13-M16 WeakPolarHBondContact O-CB 3.46Å; K13-M16 PolarHBondContact O-N 3.45Å; E14-M16 VanDerWaalsContact C-N 3.3Å; E14-M16 PolarHBondContact O-N 3.44Å; M16-I18 VanDerWaalsContact C-N 3.34Å; M16-I18 PolarHBondContact O-N 3.03Å; M16-A19 PolarHBondContact O-N 3.37Å; M16-E20 WeakPolarHBondContact O-CG 3.21Å; M16-E20 PolarHBondContact O-N 3.25Å |
| 17 | I | 92.6 | Very high | 82.7 | Confident | 90 Ų | 90 | 96.7 Ų | 96.7 | 46% | 0.462 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -61.9 | -42 | 175.3 | -66.1 | 165.3 | 0 | 0 | 0 | 110.8 | K13 E14 A19 E20 L21 | K13-I17 WeakPolarHBondContact O-CG1 3.44Å; K13-I17 PolarHBondContact O-N 2.94Å; E14-I17 PolarHBondContact O-N 3.47Å; I17-A19 VanDerWaalsContact C-N 3.34Å; I17-A19 PolarHBondContact O-N 2.78Å; I17-E20 PolarHBondContact O-N 3Å; I17-L21 HydrophobicContact CG2-CD1 4Å; I17-L21 HydrophobicContact CG2-CG 4.42Å; I17-L21 WeakPolarHBondContact O-CB 3.41Å; I17-L21 VanDerWaalsContact O-CG 3.31Å; I17-L21 WeakPolarHBondContact O-CG 3.46Å; I17-L21 PolarHBondContact O-N 3.27Å |
| 18 | I | 93.2 | Very high | 85.1 | Confident | 85 Ų | 85 | 96.2 Ų | 96.2 | 44% | 0.436 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -61.1 | -43.1 | 176.6 | -70.7 | 164.4 | 0 | 0 | 0 | 111.1 | E14 M16 L21 Q22 | E14-I18 WeakPolarHBondContact O-CD1 3.5Å; E14-I18 WeakPolarHBondContact O-CG1 3.47Å; E14-I18 PolarHBondContact O-N 2.89Å; M16-I18 VanDerWaalsContact C-N 3.34Å; M16-I18 PolarHBondContact O-N 3.03Å; I18-L21 PolarHBondContact O-N 2.9Å; I18-Q22 HydrophobicContact CG2-CG 4.48Å; I18-Q22 WeakPolarHBondContact O-CB 3.49Å; I18-Q22 VanDerWaalsContact O-CG 3.27Å; I18-Q22 WeakPolarHBondContact O-CG 3.44Å; I18-Q22 PolarHBondContact O-N 3.46Å |
| 19 | A | 93 | Very high | 87.2 | Confident | 45 Ų | 45 | 100.7 Ų | 100.7 | 37% | 0.372 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -66.4 | -39.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | N15 M16 I17 Q22 T23 | N15-A19 PolarHBondContact O-N 3.36Å; N15-A19 VanDerWaalsContact O-N 3.1Å; M16-A19 PolarHBondContact O-N 3.37Å; I17-A19 VanDerWaalsContact C-N 3.34Å; I17-A19 PolarHBondContact O-N 2.78Å; A19-Q22 PolarHBondContact O-N 2.82Å; A19-T23 WeakPolarHBondContact O-CB 3.31Å; A19-T23 PolarHBondContact O-N 3.3Å; A19-T23 PolarHBondContact O-OG1 2.93Å |
| 20 | E | 94.3 | Very high | 89.5 | Confident | 108 Ų | 108 | 99.8 Ų | 99.8 | 51% | 0.505 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -64.2 | -43.4 | 174.8 | -74.4 | 175.1 | -174.2 | 0 | 0 | 111.7 | M16 I17 T23 T24 | M16-E20 WeakPolarHBondContact O-CG 3.21Å; M16-E20 PolarHBondContact O-N 3.25Å; I17-E20 PolarHBondContact O-N 3Å; E20-T23 PolarHBondContact O-N 2.97Å; E20-T24 WeakPolarHBondContact O-CB 3.47Å; E20-T24 PolarHBondContact O-N 3.42Å; E20-T24 PolarHBondContact O-OG1 3.47Å |
| 21 | L | 96.1 | Very high | 91.4 | Very high | 100 Ų | 100 | 98.6 Ų | 98.6 | 52% | 0.524 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.4 | -42.3 | 175.2 | -72.3 | 172.7 | 0 | 0 | 0 | 111.7 | I17 I18 T23 T24 I25 | I17-L21 HydrophobicContact CG2-CD1 4Å; I17-L21 HydrophobicContact CG2-CG 4.42Å; I17-L21 WeakPolarHBondContact O-CB 3.41Å; I17-L21 VanDerWaalsContact O-CG 3.31Å; I17-L21 WeakPolarHBondContact O-CG 3.46Å; I17-L21 PolarHBondContact O-N 3.27Å; I18-L21 PolarHBondContact O-N 2.9Å; L21-T23 VanDerWaalsContact C-N 3.32Å; L21-T23 PolarHBondContact O-N 3.45Å; L21-T24 PolarHBondContact O-N 2.96Å; L21-I25 WeakPolarHBondContact O-CB 3.39Å; L21-I25 VanDerWaalsContact O-CG1 3.24Å; L21-I25 WeakPolarHBondContact O-CG1 3.39Å; L21-I25 PolarHBondContact O-N 3.37Å |
| 22 | Q | 96.6 | Very high | 93.1 | Very high | 118 Ų | 118 | 97 Ų | 97 | 55% | 0.551 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -61.8 | -39.9 | 175.5 | -76.5 | 173.8 | -10.5 | 0 | 0 | 112.2 | I18 A19 S26 | I18-Q22 HydrophobicContact CG2-CG 4.48Å; I18-Q22 WeakPolarHBondContact O-CB 3.49Å; I18-Q22 VanDerWaalsContact O-CG 3.27Å; I18-Q22 WeakPolarHBondContact O-CG 3.44Å; I18-Q22 PolarHBondContact O-N 3.46Å; A19-Q22 PolarHBondContact O-N 2.82Å; Q22-S26 WeakPolarHBondContact O-CB 3.42Å; Q22-S26 PolarHBondContact O-N 3.02Å; Q22-S26 PolarHBondContact O-OG 3.22Å |
| 23 | T | 96.3 | Very high | 94 | Very high | 96 Ų | 96 | 97 Ų | 97 | 59% | 0.589 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -64.7 | -44.4 | 175.7 | -55.3 | 0 | 0 | 0 | 0 | 110.8 | A19 E20 L21 S26 S27 | A19-T23 WeakPolarHBondContact O-CB 3.31Å; A19-T23 PolarHBondContact O-N 3.3Å; A19-T23 PolarHBondContact O-OG1 2.93Å; E20-T23 PolarHBondContact O-N 2.97Å; L21-T23 VanDerWaalsContact C-N 3.32Å; L21-T23 PolarHBondContact O-N 3.45Å; T23-S26 PolarHBondContact O-N 3.46Å; T23-S27 PolarHBondContact O-N 2.71Å; T23-S27 PolarHBondContact O-OG 3.4Å |
| 24 | T | 96.6 | Very high | 94.8 | Very high | 69 Ų | 69 | 95.7 Ų | 95.7 | 42% | 0.423 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -65.8 | -40.7 | 178.5 | -51.3 | 0 | 0 | 0 | 0 | 112 | E20 L21 S26 S27 L28 | E20-T24 WeakPolarHBondContact O-CB 3.47Å; E20-T24 PolarHBondContact O-N 3.42Å; E20-T24 PolarHBondContact O-OG1 3.47Å; L21-T24 PolarHBondContact O-N 2.96Å; T24-S26 VanDerWaalsContact C-N 3.3Å; T24-S26 PolarHBondContact O-N 3.24Å; T24-S27 PolarHBondContact O-N 3.35Å; T24-S27 PolarHBondContact O-OG 2.78Å; T24-L28 HydrophobicContact CG2-CD1 4.1Å; T24-L28 HydrophobicContact CG2-CG 4.49Å; T24-L28 WeakPolarHBondContact O-CB 3.48Å; T24-L28 VanDerWaalsContact O-CG 3.25Å; T24-L28 WeakPolarHBondContact O-CG 3.36Å; T24-L28 PolarHBondContact O-N 2.99Å |
| 25 | I | 97.5 | Very high | 95.6 | Very high | 89 Ų | 89 | 94.4 Ų | 94.4 | 46% | 0.456 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.2 | -41 | 174.8 | -71.9 | 165.8 | 0 | 0 | 0 | 110.5 | L21 K29 | L21-I25 WeakPolarHBondContact O-CB 3.39Å; L21-I25 VanDerWaalsContact O-CG1 3.24Å; L21-I25 WeakPolarHBondContact O-CG1 3.39Å; L21-I25 PolarHBondContact O-N 3.37Å; I25-K29 HydrophobicContact CG2-CD 4.36Å; I25-K29 WeakPolarHBondContact O-CB 3.46Å; I25-K29 WeakPolarHBondContact O-CG 3.23Å; I25-K29 PolarHBondContact O-N 3.47Å |
| 26 | S | 97.3 | Very high | 96.1 | Very high | 76 Ų | 76 | 95.6 Ų | 95.6 | 53% | 0.531 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -66 | -43.5 | 179.4 | -58.1 | 0 | 0 | 0 | 0 | 111.5 | Q22 T23 T24 K29 E30 | Q22-S26 WeakPolarHBondContact O-CB 3.42Å; Q22-S26 PolarHBondContact O-N 3.02Å; Q22-S26 PolarHBondContact O-OG 3.22Å; T23-S26 PolarHBondContact O-N 3.46Å; T24-S26 VanDerWaalsContact C-N 3.3Å; T24-S26 PolarHBondContact O-N 3.24Å; S26-K29 PolarHBondContact O-N 3.46Å; S26-E30 PolarHBondContact O-N 3.04Å |
| 27 | S | 97.3 | Very high | 96.6 | Very high | 62 Ų | 62 | 94.3 Ų | 94.3 | 43% | 0.434 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -65.8 | -41.9 | 176.5 | 65.9 | 0 | 0 | 0 | 0 | 112.2 | T23 T24 K29 E30 E31 | T23-S27 PolarHBondContact O-N 2.71Å; T23-S27 PolarHBondContact O-OG 3.4Å; T24-S27 PolarHBondContact O-N 3.35Å; T24-S27 PolarHBondContact O-OG 2.78Å; S27-K29 VanDerWaalsContact C-N 3.34Å; S27-K29 PolarHBondContact O-N 3.31Å; S27-E30 PolarHBondContact O-N 3.46Å; S27-E31 WeakPolarHBondContact O-CB 3.36Å; S27-E31 PolarHBondContact O-N 2.99Å |
| 28 | L | 97.3 | Very high | 96.8 | Very high | 112 Ų | 112 | 91.9 Ų | 91.9 | 59% | 0.586 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -63 | -39 | 175.7 | -74.6 | 171.7 | 0 | 0 | 0 | 112.3 | T24 S32 | T24-L28 HydrophobicContact CG2-CD1 4.1Å; T24-L28 HydrophobicContact CG2-CG 4.49Å; T24-L28 WeakPolarHBondContact O-CB 3.48Å; T24-L28 VanDerWaalsContact O-CG 3.25Å; T24-L28 WeakPolarHBondContact O-CG 3.36Å; T24-L28 PolarHBondContact O-N 2.99Å; L28-S32 VanDerWaalsContact O-CB 3.23Å; L28-S32 WeakPolarHBondContact O-CB 3.42Å; L28-S32 PolarHBondContact O-N 3.41Å |
| 29 | K | 97.8 | Very high | 97 | Very high | 151 Ų | 151 | 90.6 Ų | 90.6 | 66% | 0.657 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -65.1 | -42.8 | 174.6 | -80.2 | -177.6 | 177.1 | -176 | 0 | 112.2 | I25 S26 S27 S33 | I25-K29 HydrophobicContact CG2-CD 4.36Å; I25-K29 WeakPolarHBondContact O-CB 3.46Å; I25-K29 WeakPolarHBondContact O-CG 3.23Å; I25-K29 PolarHBondContact O-N 3.47Å; S26-K29 PolarHBondContact O-N 3.46Å; S27-K29 VanDerWaalsContact C-N 3.34Å; S27-K29 PolarHBondContact O-N 3.31Å; K29-S33 WeakPolarHBondContact O-CB 3.32Å; K29-S33 PolarHBondContact O-N 3.41Å |
| 30 | E | 97.4 | Very high | 97.3 | Very high | 105 Ų | 105 | 93.1 Ų | 93.1 | 49% | 0.491 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -65.5 | -44.6 | 177.9 | -167.8 | -177.2 | 167.5 | 0 | 0 | 111.4 | S26 S27 S33 R34 | S26-E30 PolarHBondContact O-N 3.04Å; S27-E30 PolarHBondContact O-N 3.46Å; E30-S33 WeakPolarHBondContact O-CB 3.45Å; E30-S33 PolarHBondContact O-N 2.9Å; E30-R34 WeakPolarHBondContact O-CG 3.46Å; E30-R34 PolarHBondContact O-N 2.95Å; E30-R34 IonicContact OE1-CZ 3.36Å; E30-R34 IonicContact OE1-NE 3.35Å; E30-R34 PolarHBondContact OE1-NE 2.92Å; E30-R34 IonicContact OE1-NH2 2.71Å; E30-R34 PolarHBondContact OE1-NH2 3.29Å |
| 31 | E | 97.5 | Very high | 97.5 | Very high | 87 Ų | 87 | 95.8 Ų | 95.8 | 41% | 0.407 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.4 | -43.5 | 177 | -176.9 | 56.2 | -153.7 | 0 | 0 | 111.5 | S27 S33 R34 Q35 | S27-E31 WeakPolarHBondContact O-CB 3.36Å; S27-E31 PolarHBondContact O-N 2.99Å; E31-S33 VanDerWaalsContact C-N 3.33Å; E31-S33 PolarHBondContact O-N 3.29Å; E31-R34 PolarHBondContact O-N 2.83Å; E31-Q35 WeakPolarHBondContact O-CB 3.24Å; E31-Q35 VanDerWaalsContact O-CG 3.31Å; E31-Q35 WeakPolarHBondContact O-CG 3.43Å; E31-Q35 PolarHBondContact O-N 2.99Å; E31-Q35 WeakPolarHBondContact OE1-CG 3.4Å; E31-Q35 PolarHBondContact OE1-NE2 3.06Å |
| 32 | S | 97.5 | Very high | 97.6 | Very high | 67 Ų | 67 | 99.6 Ų | 99.6 | 47% | 0.469 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -59.3 | -42.8 | 174.5 | 176.9 | 0 | 0 | 0 | 0 | 112.1 | L28 Q35 Q36 | L28-S32 VanDerWaalsContact O-CB 3.23Å; L28-S32 WeakPolarHBondContact O-CB 3.42Å; L28-S32 PolarHBondContact O-N 3.41Å; S32-Q35 PolarHBondContact O-N 3.27Å; S32-Q36 WeakPolarHBondContact O-CB 3.25Å; S32-Q36 PolarHBondContact O-N 2.94Å |
| 33 | S | 97.9 | Very high | 97.6 | Very high | 62 Ų | 62 | 99.1 Ų | 99.1 | 43% | 0.434 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.1 | -45 | 176 | 179.7 | 0 | 0 | 0 | 0 | 111.9 | K29 E30 E31 Q35 Q36 L37 | K29-S33 WeakPolarHBondContact O-CB 3.32Å; K29-S33 PolarHBondContact O-N 3.41Å; E30-S33 WeakPolarHBondContact O-CB 3.45Å; E30-S33 PolarHBondContact O-N 2.9Å; E31-S33 VanDerWaalsContact C-N 3.33Å; E31-S33 PolarHBondContact O-N 3.29Å; S33-Q35 PolarHBondContact O-N 2.97Å; S33-Q36 PolarHBondContact O-N 3.46Å; S33-L37 PolarHBondContact O-N 2.92Å |
| 34 | R | 98.1 | Very high | 97.7 | Very high | 148 Ų | 148 | 101 Ų | 101 | 56% | 0.558 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -60.7 | -43.7 | 176 | -73.9 | 177.5 | -177.6 | -162.1 | 2.5 | 112 | E30 E31 L37 A38 | E30-R34 WeakPolarHBondContact O-CG 3.46Å; E30-R34 PolarHBondContact O-N 2.95Å; E30-R34 IonicContact OE1-CZ 3.36Å; E30-R34 IonicContact OE1-NE 3.35Å; E30-R34 PolarHBondContact OE1-NE 2.92Å; E30-R34 IonicContact OE1-NH2 2.71Å; E30-R34 PolarHBondContact OE1-NH2 3.29Å; E31-R34 PolarHBondContact O-N 2.83Å; R34-L37 PolarHBondContact O-N 2.9Å; R34-A38 WeakPolarHBondContact O-CB 3.31Å; R34-A38 PolarHBondContact O-N 2.92Å |
| 35 | Q | 97.9 | Very high | 97.8 | Very high | 116 Ų | 116 | 102.4 Ų | 102.4 | 54% | 0.542 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -64.9 | -41.4 | 177.7 | -73 | 177.9 | 2.1 | 0 | 0 | 111.9 | E31 S32 S33 A38 A39 | E31-Q35 WeakPolarHBondContact O-CB 3.24Å; E31-Q35 VanDerWaalsContact O-CG 3.31Å; E31-Q35 WeakPolarHBondContact O-CG 3.43Å; E31-Q35 PolarHBondContact O-N 2.99Å; E31-Q35 WeakPolarHBondContact OE1-CG 3.4Å; E31-Q35 PolarHBondContact OE1-NE2 3.06Å; S32-Q35 PolarHBondContact O-N 3.27Å; S33-Q35 PolarHBondContact O-N 2.97Å; Q35-A38 PolarHBondContact O-N 3.28Å; Q35-A39 WeakPolarHBondContact O-CB 3.48Å; Q35-A39 PolarHBondContact O-N 2.87Å |
| 36 | Q | 98 | Very high | 97.9 | Very high | 113 Ų | 113 | 102.6 Ų | 102.6 | 53% | 0.528 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -62 | -47.5 | 176.5 | -177.3 | 167.6 | -7.6 | 0 | 0 | 111.6 | S32 S33 A38 A39 E40 | S32-Q36 WeakPolarHBondContact O-CB 3.25Å; S32-Q36 PolarHBondContact O-N 2.94Å; S33-Q36 PolarHBondContact O-N 3.46Å; Q36-A38 VanDerWaalsContact C-N 3.31Å; Q36-A38 PolarHBondContact O-N 2.88Å; Q36-A39 PolarHBondContact O-N 3.25Å; Q36-A39 VanDerWaalsContact O-N 3.16Å; Q36-E40 WeakPolarHBondContact CG-OE1 3.46Å; Q36-E40 PolarHBondContact NE2-OE1 2.92Å; Q36-E40 WeakPolarHBondContact O-CG 3.44Å; Q36-E40 PolarHBondContact O-N 3.16Å |
| 37 | L | 98.2 | Very high | 97.9 | Very high | 81 Ų | 81 | 103.8 Ų | 103.8 | 42% | 0.424 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -58.4 | -40.9 | 174.3 | -91.4 | 150.8 | 0 | 0 | 0 | 112.6 | S33 R34 R41 | S33-L37 PolarHBondContact O-N 2.92Å; R34-L37 PolarHBondContact O-N 2.9Å; L37-R41 VanDerWaalsContact O-CG 3.32Å; L37-R41 WeakPolarHBondContact O-CG 3.34Å; L37-R41 PolarHBondContact O-N 3.17Å |
| 38 | A | 98 | Very high | 98 | Very high | 39 Ų | 39 | 106 Ų | 106 | 32% | 0.322 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -66.9 | -38.5 | 177 | 0 | 0 | 0 | 0 | 0 | 112 | R34 Q35 Q36 R42 | R34-A38 WeakPolarHBondContact O-CB 3.31Å; R34-A38 PolarHBondContact O-N 2.92Å; Q35-A38 PolarHBondContact O-N 3.28Å; Q36-A38 VanDerWaalsContact C-N 3.31Å; Q36-A38 PolarHBondContact O-N 2.88Å; A38-R42 VanDerWaalsContact O-CG 3.32Å; A38-R42 WeakPolarHBondContact O-CG 3.48Å; A38-R42 PolarHBondContact O-N 3.08Å; A38-R42 VanDerWaalsContact O-N 3.14Å |
| 39 | A | 97.5 | Very high | 98 | Very high | 58 Ų | 58 | 107.1 Ų | 107.1 | 48% | 0.479 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -67.2 | -44 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q35 Q36 R41 R42 L43 | Q35-A39 WeakPolarHBondContact O-CB 3.48Å; Q35-A39 PolarHBondContact O-N 2.87Å; Q36-A39 PolarHBondContact O-N 3.25Å; Q36-A39 VanDerWaalsContact O-N 3.16Å; A39-R41 PolarHBondContact O-N 3.48Å; A39-R42 PolarHBondContact O-N 3.45Å; A39-L43 WeakPolarHBondContact O-CB 3.44Å; A39-L43 PolarHBondContact O-N 3.45Å |
| 40 | E | 98 | Very high | 98.1 | Very high | 98 Ų | 98 | 106.3 Ų | 106.3 | 46% | 0.458 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -60.1 | -44 | 176.4 | -76.3 | 172.3 | -170.5 | 0 | 0 | 111.7 | Q36 L43 Q44 | Q36-E40 WeakPolarHBondContact CG-OE1 3.46Å; Q36-E40 PolarHBondContact NE2-OE1 2.92Å; Q36-E40 WeakPolarHBondContact O-CG 3.44Å; Q36-E40 PolarHBondContact O-N 3.16Å; E40-L43 PolarHBondContact O-N 3.37Å; E40-Q44 WeakPolarHBondContact O-CB 3.32Å; E40-Q44 PolarHBondContact O-N 2.88Å |
| 41 | R | 98.1 | Very high | 98.1 | Very high | 164 Ų | 164 | 104.5 Ų | 104.5 | 62% | 0.619 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -60.6 | -47.2 | 175.2 | -73.9 | 174.5 | -175 | 178.4 | 2 | 112.2 | L37 A39 L43 Q44 D45 | L37-R41 VanDerWaalsContact O-CG 3.32Å; L37-R41 WeakPolarHBondContact O-CG 3.34Å; L37-R41 PolarHBondContact O-N 3.17Å; A39-R41 PolarHBondContact O-N 3.48Å; R41-L43 VanDerWaalsContact C-N 3.29Å; R41-L43 PolarHBondContact O-N 2.96Å; R41-Q44 PolarHBondContact O-N 3.37Å; R41-D45 PolarHBondContact O-N 3.39Å |
| 42 | R | 98.1 | Very high | 98.2 | Very high | 181 Ų | 181 | 104.3 Ų | 104.3 | 68% | 0.683 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -61.2 | -39.6 | 177.6 | -72.6 | 173.6 | -174.4 | 169.5 | 3.1 | 111.8 | A38 A39 D45 V46 | A38-R42 VanDerWaalsContact O-CG 3.32Å; A38-R42 WeakPolarHBondContact O-CG 3.48Å; A38-R42 PolarHBondContact O-N 3.08Å; A38-R42 VanDerWaalsContact O-N 3.14Å; A39-R42 PolarHBondContact O-N 3.45Å; R42-D45 PolarHBondContact O-N 2.91Å; R42-V46 WeakPolarHBondContact O-CG2 3.31Å; R42-V46 PolarHBondContact O-N 3.47Å; R42-V46 VanDerWaalsContact O-N 3.14Å |
| 43 | L | 98.3 | Very high | 98.2 | Very high | 107 Ų | 107 | 107 Ų | 107 | 56% | 0.56 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -63.6 | -44.7 | 176.2 | 179.5 | 62.3 | 0 | 0 | 0 | 110.9 | A39 E40 R41 D45 V46 I47 | A39-L43 WeakPolarHBondContact O-CB 3.44Å; A39-L43 PolarHBondContact O-N 3.45Å; E40-L43 PolarHBondContact O-N 3.37Å; R41-L43 VanDerWaalsContact C-N 3.29Å; R41-L43 PolarHBondContact O-N 2.96Å; L43-D45 VanDerWaalsContact C-N 3.33Å; L43-D45 PolarHBondContact O-N 3.28Å; L43-V46 PolarHBondContact O-N 2.9Å; L43-I47 HydrophobicContact CD1-CD1 4.1Å; L43-I47 HydrophobicContact CD1-CG1 4.35Å; L43-I47 HydrophobicContact CG-CD1 3.86Å; L43-I47 HydrophobicContact CG-CG1 4.5Å; L43-I47 VanDerWaalsContact O-CG1 3.31Å; L43-I47 WeakPolarHBondContact O-CG1 3.47Å; L43-I47 PolarHBondContact O-N 2.87Å |
| 44 | Q | 98.4 | Very high | 98.2 | Very high | 137 Ų | 137 | 108.3 Ų | 108.3 | 64% | 0.64 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -61.7 | -40.9 | 177.9 | -167.8 | 170.2 | 7.8 | 0 | 0 | 112 | E40 R41 V46 I47 Q48 | E40-Q44 WeakPolarHBondContact O-CB 3.32Å; E40-Q44 PolarHBondContact O-N 2.88Å; R41-Q44 PolarHBondContact O-N 3.37Å; Q44-V46 PolarHBondContact O-N 3.47Å; Q44-I47 PolarHBondContact O-N 3.2Å; Q44-Q48 WeakPolarHBondContact O-CB 3.42Å; Q44-Q48 PolarHBondContact O-N 3.03Å |
| 45 | D | 98.4 | Very high | 98.3 | Very high | 98 Ų | 98 | 104.8 Ų | 104.8 | 52% | 0.524 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.9 | -41.5 | 175.7 | -68.6 | -22.6 | 0 | 0 | 0 | 112.2 | R41 R42 L43 K49 | R41-D45 PolarHBondContact O-N 3.39Å; R42-D45 PolarHBondContact O-N 2.91Å; L43-D45 VanDerWaalsContact C-N 3.33Å; L43-D45 PolarHBondContact O-N 3.28Å; D45-K49 WeakPolarHBondContact O-CG 3.49Å; D45-K49 PolarHBondContact O-N 3.14Å; D45-K49 VanDerWaalsContact O-N 3.08Å |
| 46 | V | 98.3 | Very high | 98.3 | Very high | 93 Ų | 93 | 103.1 Ų | 103.1 | 56% | 0.564 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -68.8 | -42.1 | 178.2 | 173.1 | 0 | 0 | 0 | 0 | 111.1 | R42 L43 Q44 Q48 K49 F50 | R42-V46 WeakPolarHBondContact O-CG2 3.31Å; R42-V46 PolarHBondContact O-N 3.47Å; R42-V46 VanDerWaalsContact O-N 3.14Å; L43-V46 PolarHBondContact O-N 2.9Å; Q44-V46 PolarHBondContact O-N 3.47Å; V46-Q48 VanDerWaalsContact C-N 3.32Å; V46-Q48 PolarHBondContact O-N 2.87Å; V46-K49 PolarHBondContact O-N 3.18Å; V46-F50 WeakPolarHBondContact O-CB 3.23Å; V46-F50 PolarHBondContact O-N 3.48Å |
| 47 | I | 98.3 | Very high | 98.3 | Very high | 101 Ų | 101 | 102.9 Ų | 102.9 | 52% | 0.518 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.6 | -44.7 | 176 | -70.4 | 168.7 | 0 | 0 | 0 | 110.4 | L43 Q44 F50 E51 | L43-I47 HydrophobicContact CD1-CD1 4.1Å; L43-I47 HydrophobicContact CD1-CG1 4.35Å; L43-I47 HydrophobicContact CG-CD1 3.86Å; L43-I47 HydrophobicContact CG-CG1 4.5Å; L43-I47 VanDerWaalsContact O-CG1 3.31Å; L43-I47 WeakPolarHBondContact O-CG1 3.47Å; L43-I47 PolarHBondContact O-N 2.87Å; Q44-I47 PolarHBondContact O-N 3.2Å; I47-F50 PolarHBondContact O-N 3.22Å; I47-E51 PolarHBondContact O-N 3.14Å |
| 48 | Q | 98.4 | Very high | 98.3 | Very high | 107 Ų | 107 | 102.4 Ų | 102.4 | 50% | 0.5 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.2 | -47 | 179.5 | -173.7 | 59.9 | 52.5 | 0 | 0 | 111.4 | Q44 V46 F50 E51 D52 | Q44-Q48 WeakPolarHBondContact O-CB 3.42Å; Q44-Q48 PolarHBondContact O-N 3.03Å; V46-Q48 VanDerWaalsContact C-N 3.32Å; V46-Q48 PolarHBondContact O-N 2.87Å; Q48-F50 VanDerWaalsContact C-N 3.3Å; Q48-F50 PolarHBondContact O-N 2.91Å; Q48-E51 PolarHBondContact O-N 3.37Å; Q48-D52 PolarHBondContact NE2-OD1 3.33Å; Q48-D52 PolarHBondContact O-N 3.49Å |
| 49 | K | 98.5 | Very high | 98.4 | Very high | 136 Ų | 136 | 106.6 Ų | 106.6 | 59% | 0.591 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -58.7 | -42.6 | 176.5 | -73.9 | 175.8 | -178 | -178.9 | 0 | 112.3 | D45 V46 D52 E53 | D45-K49 WeakPolarHBondContact O-CG 3.49Å; D45-K49 PolarHBondContact O-N 3.14Å; D45-K49 VanDerWaalsContact O-N 3.08Å; V46-K49 PolarHBondContact O-N 3.18Å; K49-D52 PolarHBondContact O-N 2.93Å; K49-E53 WeakPolarHBondContact O-CB 3.5Å; K49-E53 WeakPolarHBondContact O-CG 3.47Å; K49-E53 PolarHBondContact O-N 2.89Å |
| 50 | F | 98.4 | Very high | 98.4 | Very high | 135 Ų | 135 | 107.4 Ų | 107.4 | 59% | 0.592 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -64.1 | -42.1 | 178.2 | -176.8 | -96.7 | 0 | 0 | 0 | 112 | V46 I47 Q48 E53 K54 | V46-F50 WeakPolarHBondContact O-CB 3.23Å; V46-F50 PolarHBondContact O-N 3.48Å; I47-F50 PolarHBondContact O-N 3.22Å; Q48-F50 VanDerWaalsContact C-N 3.3Å; Q48-F50 PolarHBondContact O-N 2.91Å; F50-E53 PolarHBondContact O-N 3.34Å; F50-K54 VanDerWaalsContact O-CB 3.27Å; F50-K54 WeakPolarHBondContact O-CB 3.43Å; F50-K54 PolarHBondContact O-N 3.47Å |
| 51 | E | 98.5 | Very high | 98.4 | Very high | 66 Ų | 66 | 107.2 Ų | 107.2 | 31% | 0.308 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -66.1 | -40.3 | 176 | -166.1 | 62.6 | -139.4 | 0 | 0 | 111 | I47 Q48 E53 K54 Q55 | I47-E51 PolarHBondContact O-N 3.14Å; Q48-E51 PolarHBondContact O-N 3.37Å; E51-E53 PolarHBondContact O-N 3.22Å; E51-K54 PolarHBondContact O-N 2.88Å; E51-K54 IonicContact OE1-NZ 3.23Å; E51-K54 PolarHBondContact OE1-NZ 3.47Å; E51-K54 IonicContact OE2-NZ 3.84Å; E51-K54 PolarHBondContact OE2-NZ 3.5Å; E51-Q55 WeakPolarHBondContact O-CB 3.5Å; E51-Q55 VanDerWaalsContact O-CG 3.23Å; E51-Q55 WeakPolarHBondContact O-CG 3.46Å; E51-Q55 PolarHBondContact O-N 2.96Å; E51-Q55 PolarHBondContact OE1-NE2 3.4Å |
| 52 | D | 98.5 | Very high | 98.5 | Very high | 84 Ų | 84 | 104 Ų | 104 | 45% | 0.449 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.5 | -45.4 | 176.5 | -66.4 | -20.9 | 0 | 0 | 0 | 111.9 | Q48 K49 Q55 Q56 | Q48-D52 PolarHBondContact NE2-OD1 3.33Å; Q48-D52 PolarHBondContact O-N 3.49Å; K49-D52 PolarHBondContact O-N 2.93Å; D52-Q55 PolarHBondContact O-N 2.94Å; D52-Q56 WeakPolarHBondContact O-CB 3.46Å; D52-Q56 PolarHBondContact O-N 2.94Å |
| 53 | E | 98.5 | Very high | 98.5 | Very high | 124 Ų | 124 | 102 Ų | 102 | 58% | 0.579 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -62.4 | -44.7 | 175.7 | -77.5 | 177.2 | -165.2 | 0 | 0 | 111.8 | K49 F50 E51 Q55 Q56 L57 | K49-E53 WeakPolarHBondContact O-CB 3.5Å; K49-E53 WeakPolarHBondContact O-CG 3.47Å; K49-E53 PolarHBondContact O-N 2.89Å; F50-E53 PolarHBondContact O-N 3.34Å; E51-E53 PolarHBondContact O-N 3.22Å; E53-Q55 PolarHBondContact O-N 3.38Å; E53-Q56 PolarHBondContact O-N 3.24Å; E53-L57 WeakPolarHBondContact O-CG 3.3Å; E53-L57 PolarHBondContact O-N 3.39Å |
| 54 | K | 98.5 | Very high | 98.5 | Very high | 88 Ų | 88 | 99.1 Ų | 99.1 | 38% | 0.383 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -60 | -45.3 | 175.9 | 174.7 | -174.4 | 157.6 | -144.5 | 0 | 111.4 | F50 E51 Q56 L57 I58 | F50-K54 VanDerWaalsContact O-CB 3.27Å; F50-K54 WeakPolarHBondContact O-CB 3.43Å; F50-K54 PolarHBondContact O-N 3.47Å; E51-K54 PolarHBondContact O-N 2.88Å; E51-K54 IonicContact OE1-NZ 3.23Å; E51-K54 PolarHBondContact OE1-NZ 3.47Å; E51-K54 IonicContact OE2-NZ 3.84Å; E51-K54 PolarHBondContact OE2-NZ 3.5Å; K54-Q56 VanDerWaalsContact C-N 3.32Å; K54-Q56 PolarHBondContact O-N 3.14Å; K54-L57 PolarHBondContact O-N 3.45Å; K54-I58 HydrophobicContact CG-CD1 4.18Å; K54-I58 VanDerWaalsContact O-CG1 3.3Å; K54-I58 WeakPolarHBondContact O-CG1 3.27Å; K54-I58 PolarHBondContact O-N 2.98Å |
| 55 | Q | 98.6 | Very high | 98.5 | Very high | 75 Ų | 75 | 96.5 Ų | 96.5 | 35% | 0.35 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -65.1 | -37.1 | 177.1 | -68.9 | -60.2 | -33.4 | 0 | 0 | 111.8 | E51 D52 E53 I58 R59 | E51-Q55 WeakPolarHBondContact O-CB 3.5Å; E51-Q55 VanDerWaalsContact O-CG 3.23Å; E51-Q55 WeakPolarHBondContact O-CG 3.46Å; E51-Q55 PolarHBondContact O-N 2.96Å; E51-Q55 PolarHBondContact OE1-NE2 3.4Å; D52-Q55 PolarHBondContact O-N 2.94Å; E53-Q55 PolarHBondContact O-N 3.38Å; Q55-I58 PolarHBondContact O-N 3.3Å; Q55-R59 WeakPolarHBondContact O-CG 3.39Å; Q55-R59 PolarHBondContact O-N 2.98Å; Q55-R59 VanDerWaalsContact O-N 3.14Å |
| 56 | Q | 98.6 | Very high | 98.5 | Very high | 81 Ų | 81 | 98 Ų | 98 | 38% | 0.379 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -63.9 | -47.4 | 174.5 | -173.2 | 57.3 | 39.9 | 0 | 0 | 111.6 | D52 E53 K54 I58 R59 D60 | D52-Q56 WeakPolarHBondContact O-CB 3.46Å; D52-Q56 PolarHBondContact O-N 2.94Å; E53-Q56 PolarHBondContact O-N 3.24Å; K54-Q56 VanDerWaalsContact C-N 3.32Å; K54-Q56 PolarHBondContact O-N 3.14Å; Q56-I58 VanDerWaalsContact C-N 3.29Å; Q56-I58 PolarHBondContact O-N 3.49Å; Q56-R59 WeakPolarHBondContact O-CB 3.42Å; Q56-R59 PolarHBondContact O-N 3.36Å; Q56-R59 VanDerWaalsContact O-N 3.14Å; Q56-D60 PolarHBondContact NE2-OD1 3.34Å; Q56-D60 PolarHBondContact NE2-OD2 2.79Å; Q56-D60 VanDerWaalsContact O-CG 3.29Å; Q56-D60 PolarHBondContact O-N 2.89Å |
| 57 | L | 98.6 | Very high | 98.5 | Very high | 107 Ų | 107 | 96.2 Ų | 96.2 | 56% | 0.56 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -60.8 | -37.1 | 177.6 | -74.9 | 172.1 | 0 | 0 | 0 | 112.7 | E53 K54 N61 | E53-L57 WeakPolarHBondContact O-CG 3.3Å; E53-L57 PolarHBondContact O-N 3.39Å; K54-L57 PolarHBondContact O-N 3.45Å; L57-N61 WeakPolarHBondContact O-CB 3.38Å; L57-N61 PolarHBondContact O-N 3Å; L57-N61 PolarHBondContact O-ND2 2.97Å |
| 58 | I | 98.5 | Very high | 98.6 | Very high | 72 Ų | 72 | 97 Ų | 97 | 37% | 0.369 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -62.1 | -49.4 | 174.5 | -70.2 | 165.3 | 0 | 0 | 0 | 109.9 | K54 Q55 Q56 D60 N61 D62 | K54-I58 HydrophobicContact CG-CD1 4.18Å; K54-I58 VanDerWaalsContact O-CG1 3.3Å; K54-I58 WeakPolarHBondContact O-CG1 3.27Å; K54-I58 PolarHBondContact O-N 2.98Å; Q55-I58 PolarHBondContact O-N 3.3Å; Q56-I58 VanDerWaalsContact C-N 3.29Å; Q56-I58 PolarHBondContact O-N 3.49Å; I58-D60 VanDerWaalsContact C-N 3.35Å; I58-D60 PolarHBondContact O-N 3.28Å; I58-N61 PolarHBondContact O-N 3.41Å; I58-D62 PolarHBondContact O-N 2.92Å |
| 59 | R | 98.6 | Very high | 98.6 | Very high | 127 Ų | 127 | 97.4 Ų | 97.4 | 48% | 0.479 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -59.6 | -44.3 | 178.6 | -71.4 | -174 | -68.5 | -99.8 | 4.4 | 112.6 | Q55 Q56 D62 Q63 | Q55-R59 WeakPolarHBondContact O-CG 3.39Å; Q55-R59 PolarHBondContact O-N 2.98Å; Q55-R59 VanDerWaalsContact O-N 3.14Å; Q56-R59 WeakPolarHBondContact O-CB 3.42Å; Q56-R59 PolarHBondContact O-N 3.36Å; Q56-R59 VanDerWaalsContact O-N 3.14Å; R59-D62 PolarHBondContact O-N 3.14Å; R59-Q63 WeakPolarHBondContact O-CB 3.46Å; R59-Q63 PolarHBondContact O-N 2.84Å |
| 60 | D | 98.6 | Very high | 98.6 | Very high | 74 Ų | 74 | 94.8 Ų | 94.8 | 40% | 0.396 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -65.5 | -40.9 | -179.6 | -66.2 | -19.4 | 0 | 0 | 0 | 111.1 | Q56 I58 Q63 A64 | Q56-D60 PolarHBondContact NE2-OD1 3.34Å; Q56-D60 PolarHBondContact NE2-OD2 2.79Å; Q56-D60 VanDerWaalsContact O-CG 3.29Å; Q56-D60 PolarHBondContact O-N 2.89Å; I58-D60 VanDerWaalsContact C-N 3.35Å; I58-D60 PolarHBondContact O-N 3.28Å; D60-Q63 PolarHBondContact O-N 3.36Å; D60-A64 WeakPolarHBondContact O-CB 3.4Å; D60-A64 PolarHBondContact O-N 3.11Å |
| 61 | N | 98.6 | Very high | 98.6 | Very high | 94 Ų | 94 | 93.4 Ų | 93.4 | 50% | 0.503 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -64.7 | -44.8 | 174.2 | -84.9 | -70.4 | 0 | 0 | 0 | 112.1 | L57 I58 Q63 A64 I65 | L57-N61 WeakPolarHBondContact O-CB 3.38Å; L57-N61 PolarHBondContact O-N 3Å; L57-N61 PolarHBondContact O-ND2 2.97Å; I58-N61 PolarHBondContact O-N 3.41Å; N61-Q63 VanDerWaalsContact C-N 3.28Å; N61-Q63 PolarHBondContact O-N 2.88Å; N61-A64 PolarHBondContact O-N 3Å; N61-I65 WeakPolarHBondContact O-CB 3.3Å; N61-I65 VanDerWaalsContact O-CG1 3.26Å; N61-I65 WeakPolarHBondContact O-CG1 3.49Å; N61-I65 PolarHBondContact O-N 2.8Å |
| 62 | D | 98.7 | Very high | 98.6 | Very high | 97 Ų | 97 | 96.2 Ų | 96.2 | 52% | 0.519 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.4 | -40.9 | 177.9 | -73.8 | -22.9 | 0 | 0 | 0 | 111.3 | I58 R59 I65 K66 | I58-D62 PolarHBondContact O-N 2.92Å; R59-D62 PolarHBondContact O-N 3.14Å; D62-I65 PolarHBondContact O-N 3.34Å; D62-K66 WeakPolarHBondContact O-CB 3.38Å; D62-K66 PolarHBondContact O-N 3.01Å |
| 63 | Q | 98.6 | Very high | 98.6 | Very high | 139 Ų | 139 | 97.7 Ų | 97.7 | 65% | 0.65 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -64.9 | -42.9 | 175.3 | -175.7 | 172.9 | -5.3 | 0 | 0 | 111.9 | R59 D60 N61 K66 A67 | R59-Q63 WeakPolarHBondContact O-CB 3.46Å; R59-Q63 PolarHBondContact O-N 2.84Å; D60-Q63 PolarHBondContact O-N 3.36Å; N61-Q63 VanDerWaalsContact C-N 3.28Å; N61-Q63 PolarHBondContact O-N 2.88Å; Q63-K66 PolarHBondContact O-N 3.45Å; Q63-A67 PolarHBondContact O-N 2.91Å |
| 64 | A | 98.6 | Very high | 98.6 | Very high | 47 Ų | 47 | 95.4 Ų | 95.4 | 39% | 0.388 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -64.5 | -43.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | D60 N61 K66 A67 L68 | D60-A64 WeakPolarHBondContact O-CB 3.4Å; D60-A64 PolarHBondContact O-N 3.11Å; N61-A64 PolarHBondContact O-N 3Å; A64-K66 VanDerWaalsContact C-N 3.33Å; A64-K66 PolarHBondContact O-N 2.92Å; A64-A67 PolarHBondContact O-N 3.26Å; A64-L68 VanDerWaalsContact O-CG 3.32Å; A64-L68 WeakPolarHBondContact O-CG 3.43Å; A64-L68 PolarHBondContact O-N 3.18Å |
| 65 | I | 98.6 | Very high | 98.5 | Very high | 82 Ų | 82 | 97.7 Ų | 97.7 | 42% | 0.421 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -58.8 | -46.7 | 176 | -72 | 166.5 | 0 | 0 | 0 | 110.1 | N61 D62 A67 L68 Q69 | N61-I65 WeakPolarHBondContact O-CB 3.3Å; N61-I65 VanDerWaalsContact O-CG1 3.26Å; N61-I65 WeakPolarHBondContact O-CG1 3.49Å; N61-I65 PolarHBondContact O-N 2.8Å; D62-I65 PolarHBondContact O-N 3.34Å; I65-A67 PolarHBondContact O-N 3.45Å; I65-L68 PolarHBondContact O-N 2.9Å; I65-Q69 HydrophobicContact CG2-CG 4.38Å; I65-Q69 VanDerWaalsContact O-CG 3.3Å; I65-Q69 WeakPolarHBondContact O-CG 3.45Å; I65-Q69 PolarHBondContact O-N 3.28Å |
| 66 | K | 98.6 | Very high | 98.5 | Very high | 129 Ų | 129 | 96.5 Ų | 96.5 | 56% | 0.561 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -61.5 | -45.4 | 178.7 | -172.2 | 175.5 | -178.8 | -178.9 | 0 | 112 | D62 Q63 A64 L68 Q69 D70 | D62-K66 WeakPolarHBondContact O-CB 3.38Å; D62-K66 PolarHBondContact O-N 3.01Å; Q63-K66 PolarHBondContact O-N 3.45Å; A64-K66 VanDerWaalsContact C-N 3.33Å; A64-K66 PolarHBondContact O-N 2.92Å; K66-L68 VanDerWaalsContact C-N 3.31Å; K66-L68 PolarHBondContact O-N 3.39Å; K66-Q69 WeakPolarHBondContact O-CB 3.26Å; K66-Q69 PolarHBondContact O-N 2.98Å; K66-D70 VanDerWaalsContact O-CG 3.3Å; K66-D70 PolarHBondContact O-N 3.45Å |
| 67 | A | 98.6 | Very high | 98.5 | Very high | 56 Ų | 56 | 97.1 Ų | 97.1 | 46% | 0.463 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.1 | -41.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q63 A64 I65 D70 E71 | Q63-A67 PolarHBondContact O-N 2.91Å; A64-A67 PolarHBondContact O-N 3.26Å; I65-A67 PolarHBondContact O-N 3.45Å; A67-D70 PolarHBondContact O-N 3.42Å; A67-E71 WeakPolarHBondContact O-CB 3.49Å; A67-E71 PolarHBondContact O-N 3.18Å |
| 68 | L | 98.6 | Very high | 98.5 | Very high | 116 Ų | 116 | 96.5 Ų | 96.5 | 61% | 0.607 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -66.4 | -37.6 | 176.2 | -70.5 | 172.3 | 0 | 0 | 0 | 112.3 | A64 I65 K66 L72 | A64-L68 VanDerWaalsContact O-CG 3.32Å; A64-L68 WeakPolarHBondContact O-CG 3.43Å; A64-L68 PolarHBondContact O-N 3.18Å; I65-L68 PolarHBondContact O-N 2.9Å; K66-L68 VanDerWaalsContact C-N 3.31Å; K66-L68 PolarHBondContact O-N 3.39Å; L68-L72 VanDerWaalsContact O-CB 3.28Å; L68-L72 WeakPolarHBondContact O-CB 3.47Å; L68-L72 PolarHBondContact O-N 2.99Å |
| 69 | Q | 98.6 | Very high | 98.5 | Very high | 116 Ų | 116 | 96.8 Ų | 96.8 | 54% | 0.542 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64.4 | -46.7 | 175 | -74.4 | 172.6 | -13.6 | 0 | 0 | 111.4 | I65 K66 E71 L72 E73 | I65-Q69 HydrophobicContact CG2-CG 4.38Å; I65-Q69 VanDerWaalsContact O-CG 3.3Å; I65-Q69 WeakPolarHBondContact O-CG 3.45Å; I65-Q69 PolarHBondContact O-N 3.28Å; K66-Q69 WeakPolarHBondContact O-CB 3.26Å; K66-Q69 PolarHBondContact O-N 2.98Å; Q69-E71 VanDerWaalsContact C-N 3.33Å; Q69-E71 PolarHBondContact O-N 3.49Å; Q69-L72 PolarHBondContact O-N 3.01Å; Q69-E73 WeakPolarHBondContact O-CB 3.32Å; Q69-E73 PolarHBondContact O-N 3.31Å |
| 70 | D | 98.6 | Very high | 98.5 | Very high | 82 Ų | 82 | 96.3 Ų | 96.3 | 44% | 0.439 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -62.4 | -40.5 | 178.3 | -67.4 | -17.5 | 0 | 0 | 0 | 111.2 | K66 A67 T74 | K66-D70 VanDerWaalsContact O-CG 3.3Å; K66-D70 PolarHBondContact O-N 3.45Å; A67-D70 PolarHBondContact O-N 3.42Å; D70-T74 WeakPolarHBondContact O-CB 3.32Å; D70-T74 PolarHBondContact O-N 2.82Å; D70-T74 PolarHBondContact O-OG1 2.96Å |
| 71 | E | 98.5 | Very high | 98.5 | Very high | 105 Ų | 105 | 95.5 Ų | 95.5 | 49% | 0.491 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -66.4 | -43.8 | 175.4 | -172.4 | 174.7 | -175.8 | 0 | 0 | 111.6 | A67 Q69 E73 T74 R75 | A67-E71 WeakPolarHBondContact O-CB 3.49Å; A67-E71 PolarHBondContact O-N 3.18Å; Q69-E71 VanDerWaalsContact C-N 3.33Å; Q69-E71 PolarHBondContact O-N 3.49Å; E71-E73 VanDerWaalsContact C-N 3.35Å; E71-E73 PolarHBondContact O-N 3.46Å; E71-T74 WeakPolarHBondContact O-CB 3.28Å; E71-T74 PolarHBondContact O-N 3.21Å; E71-R75 HydrophobicContact CG-CG 4.36Å; E71-R75 WeakPolarHBondContact O-CB 3.5Å; E71-R75 VanDerWaalsContact O-CG 3.3Å; E71-R75 WeakPolarHBondContact O-CG 3.38Å; E71-R75 PolarHBondContact O-N 3.19Å |
| 72 | L | 98.5 | Very high | 98.5 | Very high | 125 Ų | 125 | 93.8 Ų | 93.8 | 65% | 0.654 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -60.7 | -44.4 | 177.4 | -179.5 | 65.6 | 0 | 0 | 0 | 111.5 | L68 Q69 R75 S76 | L68-L72 VanDerWaalsContact O-CB 3.28Å; L68-L72 WeakPolarHBondContact O-CB 3.47Å; L68-L72 PolarHBondContact O-N 2.99Å; Q69-L72 PolarHBondContact O-N 3.01Å; L72-R75 PolarHBondContact O-N 3.31Å; L72-S76 WeakPolarHBondContact O-CB 3.5Å; L72-S76 PolarHBondContact O-N 3.47Å |
| 73 | E | 98.5 | Very high | 98.5 | Very high | 116 Ų | 116 | 94.6 Ų | 94.6 | 54% | 0.542 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -62.1 | -45.9 | 176.7 | -176.2 | 168.8 | -158.7 | 0 | 0 | 110.8 | Q69 E71 R75 S76 H77 | Q69-E73 WeakPolarHBondContact O-CB 3.32Å; Q69-E73 PolarHBondContact O-N 3.31Å; E71-E73 VanDerWaalsContact C-N 3.35Å; E71-E73 PolarHBondContact O-N 3.46Å; E73-R75 PolarHBondContact O-N 3.25Å; E73-S76 WeakPolarHBondContact O-CB 3.3Å; E73-S76 PolarHBondContact O-N 2.92Å; E73-H77 PolarHBondContact O-CD2 3.43Å; E73-H77 PolarHBondContact O-N 3.39Å; E73-H77 IonicContact OE1-NE2 3.75Å |
| 74 | T | 98.5 | Very high | 98.5 | Very high | 75 Ų | 75 | 95.5 Ų | 95.5 | 46% | 0.46 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -58.4 | -47.3 | 176.2 | -60.4 | 0 | 0 | 0 | 0 | 111.6 | D70 E71 H77 Q78 | D70-T74 WeakPolarHBondContact O-CB 3.32Å; D70-T74 PolarHBondContact O-N 2.82Å; D70-T74 PolarHBondContact O-OG1 2.96Å; E71-T74 WeakPolarHBondContact O-CB 3.28Å; E71-T74 PolarHBondContact O-N 3.21Å; T74-H77 PolarHBondContact O-N 3.3Å; T74-Q78 WeakPolarHBondContact O-CG 3.45Å; T74-Q78 PolarHBondContact O-N 3.47Å |
| 75 | R | 98.1 | Very high | 98.5 | Very high | 136 Ų | 136 | 99.8 Ų | 99.8 | 51% | 0.513 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.3 | -43.3 | 177.4 | -71.8 | -65.9 | -174.2 | -159 | 3.7 | 111.8 | E71 L72 E73 H77 Q78 V79 | E71-R75 HydrophobicContact CG-CG 4.36Å; E71-R75 WeakPolarHBondContact O-CB 3.5Å; E71-R75 VanDerWaalsContact O-CG 3.3Å; E71-R75 WeakPolarHBondContact O-CG 3.38Å; E71-R75 PolarHBondContact O-N 3.19Å; L72-R75 PolarHBondContact O-N 3.31Å; E73-R75 PolarHBondContact O-N 3.25Å; R75-H77 VanDerWaalsContact C-N 3.3Å; R75-H77 PolarHBondContact O-N 3.26Å; R75-Q78 WeakPolarHBondContact O-CB 3.36Å; R75-Q78 PolarHBondContact O-N 2.97Å; R75-Q78 VanDerWaalsContact O-N 3.17Å; R75-V79 WeakPolarHBondContact O-CG2 3.34Å; R75-V79 PolarHBondContact O-N 3.38Å |
| 76 | S | 98.4 | Very high | 98.5 | Very high | 51 Ų | 51 | 101.6 Ų | 101.6 | 36% | 0.357 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -58.8 | -41.6 | 175.5 | 175.7 | 0 | 0 | 0 | 0 | 112 | L72 E73 R80 | L72-S76 WeakPolarHBondContact O-CB 3.5Å; L72-S76 PolarHBondContact O-N 3.47Å; E73-S76 WeakPolarHBondContact O-CB 3.3Å; E73-S76 PolarHBondContact O-N 2.92Å; S76-R80 WeakPolarHBondContact O-CG 3.36Å; S76-R80 PolarHBondContact O-N 2.86Å; S76-R80 VanDerWaalsContact O-N 3.09Å; S76-R80 PolarHBondContact O-NE 3.05Å; S76-R80 PolarHBondContact OG-NE 3.43Å; S76-R80 PolarHBondContact OG-NH2 3.23Å |
| 77 | H | 98.4 | Very high | 98.5 | Very high | 93 Ų | 93 | 100.5 Ų | 100.5 | 43% | 0.431 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.8 | -41 | 174.6 | -77.9 | -61.8 | 0 | 0 | 0 | 112.9 | E73 T74 R75 R80 S81 | E73-H77 PolarHBondContact O-CD2 3.43Å; E73-H77 PolarHBondContact O-N 3.39Å; E73-H77 IonicContact OE1-NE2 3.75Å; T74-H77 PolarHBondContact O-N 3.3Å; R75-H77 VanDerWaalsContact C-N 3.3Å; R75-H77 PolarHBondContact O-N 3.26Å; H77-R80 PolarHBondContact CE1-NH2 3.16Å; H77-R80 PolarHBondContact ND1-NH2 3.1Å; H77-R80 PolarHBondContact O-N 2.87Å; H77-S81 WeakPolarHBondContact O-CB 3.46Å; H77-S81 PolarHBondContact O-N 3.28Å |
| 78 | Q | 98.5 | Very high | 98.5 | Very high | 95 Ų | 95 | 103.1 Ų | 103.1 | 44% | 0.444 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.3 | -46.3 | 176.4 | -72.9 | 173.2 | 3.4 | 0 | 0 | 111.7 | T74 R75 S81 A82 | T74-Q78 WeakPolarHBondContact O-CG 3.45Å; T74-Q78 PolarHBondContact O-N 3.47Å; R75-Q78 WeakPolarHBondContact O-CB 3.36Å; R75-Q78 PolarHBondContact O-N 2.97Å; R75-Q78 VanDerWaalsContact O-N 3.17Å; Q78-S81 PolarHBondContact O-N 3.47Å; Q78-A82 WeakPolarHBondContact O-CB 3.41Å; Q78-A82 PolarHBondContact O-N 3.24Å |
| 79 | V | 98.6 | Very high | 98.5 | Very high | 78 Ų | 78 | 104.3 Ų | 104.3 | 47% | 0.473 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -59.3 | -51.9 | 177.2 | 171 | 0 | 0 | 0 | 0 | 110.4 | R75 S81 A82 E83 | R75-V79 WeakPolarHBondContact O-CG2 3.34Å; R75-V79 PolarHBondContact O-N 3.38Å; V79-S81 VanDerWaalsContact C-N 3.26Å; V79-S81 PolarHBondContact O-N 3.48Å; V79-A82 PolarHBondContact O-N 2.93Å; V79-A82 VanDerWaalsContact O-N 3.07Å; V79-E83 HydrophobicContact CG1-CG 4.26Å; V79-E83 WeakPolarHBondContact O-CG 3.5Å; V79-E83 PolarHBondContact O-N 2.99Å |
| 80 | R | 98.6 | Very high | 98.5 | Very high | 116 Ų | 116 | 103.6 Ų | 103.6 | 44% | 0.438 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -58 | -37.7 | 178 | -76.4 | -177.4 | -80.2 | 166.7 | -6.8 | 113 | S76 H77 K84 | S76-R80 WeakPolarHBondContact O-CG 3.36Å; S76-R80 PolarHBondContact O-N 2.86Å; S76-R80 VanDerWaalsContact O-N 3.09Å; S76-R80 PolarHBondContact O-NE 3.05Å; S76-R80 PolarHBondContact OG-NE 3.43Å; S76-R80 PolarHBondContact OG-NH2 3.23Å; H77-R80 PolarHBondContact CE1-NH2 3.16Å; H77-R80 PolarHBondContact ND1-NH2 3.1Å; H77-R80 PolarHBondContact O-N 2.87Å; R80-K84 WeakPolarHBondContact O-CG 3.38Å; R80-K84 PolarHBondContact O-N 3.09Å; R80-K84 VanDerWaalsContact O-N 3.16Å |
| 81 | S | 98.4 | Very high | 98.5 | Very high | 58 Ų | 58 | 103 Ų | 103 | 41% | 0.406 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -68.4 | -42.4 | 176.4 | -174.8 | 0 | 0 | 0 | 0 | 111.9 | H77 Q78 V79 K84 K85 | H77-S81 WeakPolarHBondContact O-CB 3.46Å; H77-S81 PolarHBondContact O-N 3.28Å; Q78-S81 PolarHBondContact O-N 3.47Å; V79-S81 VanDerWaalsContact C-N 3.26Å; V79-S81 PolarHBondContact O-N 3.48Å; S81-K84 PolarHBondContact O-N 3.07Å; S81-K85 WeakPolarHBondContact O-CG 3.43Å; S81-K85 PolarHBondContact O-N 3.17Å; S81-K85 VanDerWaalsContact O-N 3.1Å |
| 82 | A | 98.4 | Very high | 98.5 | Very high | 57 Ų | 57 | 101.8 Ų | 101.8 | 47% | 0.471 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64.9 | -44 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q78 V79 K84 K85 L86 | Q78-A82 WeakPolarHBondContact O-CB 3.41Å; Q78-A82 PolarHBondContact O-N 3.24Å; V79-A82 PolarHBondContact O-N 2.93Å; V79-A82 VanDerWaalsContact O-N 3.07Å; A82-K84 PolarHBondContact O-N 2.85Å; A82-K85 PolarHBondContact O-N 3.23Å; A82-L86 WeakPolarHBondContact O-CB 3.48Å; A82-L86 PolarHBondContact O-N 2.98Å |
| 83 | E | 98.4 | Very high | 98.4 | Very high | 114 Ų | 114 | 98 Ų | 98 | 53% | 0.533 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -58.2 | -46.6 | 175.6 | -73.3 | 172.4 | 162.1 | 0 | 0 | 111.6 | V79 K85 L86 H87 | V79-E83 HydrophobicContact CG1-CG 4.26Å; V79-E83 WeakPolarHBondContact O-CG 3.5Å; V79-E83 PolarHBondContact O-N 2.99Å; E83-K85 VanDerWaalsContact C-N 3.35Å; E83-K85 PolarHBondContact O-N 2.9Å; E83-L86 PolarHBondContact O-N 3.27Å; E83-H87 WeakPolarHBondContact O-CB 3.44Å; E83-H87 PolarHBondContact O-N 3.39Å |
| 84 | K | 98.6 | Very high | 98.4 | Very high | 159 Ų | 159 | 97.4 Ų | 97.4 | 69% | 0.691 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -59.8 | -43.8 | 176.1 | -75.9 | 179.1 | -179.9 | -174 | 0 | 112.4 | R80 S81 A82 H88 | R80-K84 WeakPolarHBondContact O-CG 3.38Å; R80-K84 PolarHBondContact O-N 3.09Å; R80-K84 VanDerWaalsContact O-N 3.16Å; S81-K84 PolarHBondContact O-N 3.07Å; A82-K84 PolarHBondContact O-N 2.85Å; K84-H88 WeakPolarHBondContact O-CB 3.48Å; K84-H88 PolarHBondContact O-N 2.94Å |
| 85 | K | 98.6 | Very high | 98.4 | Very high | 137 Ų | 137 | 99.7 Ų | 99.7 | 60% | 0.596 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -65.1 | -40.4 | 177.4 | -72.9 | 175.4 | -178.1 | 179.3 | 0 | 111.8 | S81 A82 E83 K89 | S81-K85 WeakPolarHBondContact O-CG 3.43Å; S81-K85 PolarHBondContact O-N 3.17Å; S81-K85 VanDerWaalsContact O-N 3.1Å; A82-K85 PolarHBondContact O-N 3.23Å; E83-K85 VanDerWaalsContact C-N 3.35Å; E83-K85 PolarHBondContact O-N 2.9Å; K85-K89 WeakPolarHBondContact O-CG 3.44Å; K85-K89 PolarHBondContact O-N 2.91Å; K85-K89 VanDerWaalsContact O-N 3.12Å |
| 86 | L | 98.6 | Very high | 98.4 | Very high | 119 Ų | 119 | 99.3 Ų | 99.3 | 62% | 0.623 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -64.5 | -47.8 | 177.8 | -179.7 | 62.9 | 0 | 0 | 0 | 110.8 | A82 E83 H88 K89 E90 | A82-L86 WeakPolarHBondContact O-CB 3.48Å; A82-L86 PolarHBondContact O-N 2.98Å; E83-L86 PolarHBondContact O-N 3.27Å; L86-H88 VanDerWaalsContact C-N 3.3Å; L86-H88 PolarHBondContact O-N 3.03Å; L86-K89 PolarHBondContact O-N 2.86Å; L86-E90 PolarHBondContact O-N 3.23Å |
| 87 | H | 98.4 | Very high | 98.4 | Very high | 107 Ų | 107 | 101.3 Ų | 101.3 | 50% | 0.495 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -60.3 | -40.7 | 178.5 | -174.6 | 56.7 | 0 | 0 | 0 | 112.2 | E83 E90 L91 | E83-H87 WeakPolarHBondContact O-CB 3.44Å; E83-H87 PolarHBondContact O-N 3.39Å; H87-E90 WeakPolarHBondContact O-CB 3.48Å; H87-E90 PolarHBondContact O-N 3.38Å; H87-L91 WeakPolarHBondContact O-CG 3.49Å; H87-L91 PolarHBondContact O-N 3.3Å |
| 88 | H | 98.6 | Very high | 98.3 | Very high | 110 Ų | 110 | 102.5 Ų | 102.5 | 51% | 0.509 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.8 | -46.3 | 175.1 | -176.2 | 51.3 | 0 | 0 | 0 | 112.2 | K84 L86 E90 L91 E92 | K84-H88 WeakPolarHBondContact O-CB 3.48Å; K84-H88 PolarHBondContact O-N 2.94Å; L86-H88 VanDerWaalsContact C-N 3.3Å; L86-H88 PolarHBondContact O-N 3.03Å; H88-E90 VanDerWaalsContact C-N 3.28Å; H88-E90 PolarHBondContact O-N 2.88Å; H88-L91 PolarHBondContact O-N 3.25Å; H88-E92 IonicContact CD2-OE1 3.78Å; H88-E92 IonicContact CE1-OE1 2.87Å; H88-E92 IonicContact NE2-OE1 3.18Å; H88-E92 PolarHBondContact NE2-OE1 3.12Å; H88-E92 WeakPolarHBondContact O-CG 3.41Å; H88-E92 PolarHBondContact O-N 3.19Å |
| 89 | K | 98.5 | Very high | 98.3 | Very high | 141 Ų | 141 | 104.2 Ų | 104.2 | 61% | 0.613 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -62.6 | -35.3 | 176 | -74.1 | -176.5 | 174.9 | -169.8 | 0 | 112.9 | K85 L86 A93 | K85-K89 WeakPolarHBondContact O-CG 3.44Å; K85-K89 PolarHBondContact O-N 2.91Å; K85-K89 VanDerWaalsContact O-N 3.12Å; L86-K89 PolarHBondContact O-N 2.86Å; K89-A93 WeakPolarHBondContact O-CB 3.32Å; K89-A93 PolarHBondContact O-N 3.14Å |
| 90 | E | 98.4 | Very high | 98.2 | Very high | 102 Ų | 102 | 104.6 Ų | 104.6 | 48% | 0.477 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.4 | -45.9 | 175.4 | -175.1 | -178.2 | -175.3 | 0 | 0 | 111 | L86 H87 H88 A93 Q94 | L86-E90 PolarHBondContact O-N 3.23Å; H87-E90 WeakPolarHBondContact O-CB 3.48Å; H87-E90 PolarHBondContact O-N 3.38Å; H88-E90 VanDerWaalsContact C-N 3.28Å; H88-E90 PolarHBondContact O-N 2.88Å; E90-A93 PolarHBondContact O-N 3.42Å; E90-Q94 VanDerWaalsContact O-CG 3.32Å; E90-Q94 WeakPolarHBondContact O-CG 3.42Å; E90-Q94 PolarHBondContact O-N 2.92Å |
| 91 | L | 98.4 | Very high | 98.1 | Very high | 69 Ų | 69 | 107.6 Ų | 107.6 | 36% | 0.361 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -60.9 | -48 | 175.4 | -72.2 | 168 | 0 | 0 | 0 | 111.7 | H87 H88 A93 Q94 E95 | H87-L91 WeakPolarHBondContact O-CG 3.49Å; H87-L91 PolarHBondContact O-N 3.3Å; H88-L91 PolarHBondContact O-N 3.25Å; L91-A93 VanDerWaalsContact C-N 3.3Å; L91-A93 PolarHBondContact O-N 2.92Å; L91-Q94 WeakPolarHBondContact O-CB 3.44Å; L91-Q94 PolarHBondContact O-N 3.34Å; L91-Q94 VanDerWaalsContact O-N 3.14Å; L91-E95 WeakPolarHBondContact O-CG 3.35Å; L91-E95 PolarHBondContact O-N 3Å |
| 92 | E | 98.4 | Very high | 97.9 | Very high | 80 Ų | 80 | 110.4 Ų | 110.4 | 37% | 0.374 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -57.5 | -42.9 | 176.8 | -71.2 | 179.1 | 151 | 0 | 0 | 111.8 | H88 E95 Q96 | H88-E92 IonicContact CD2-OE1 3.78Å; H88-E92 IonicContact CE1-OE1 2.87Å; H88-E92 IonicContact NE2-OE1 3.18Å; H88-E92 PolarHBondContact NE2-OE1 3.12Å; H88-E92 WeakPolarHBondContact O-CG 3.41Å; H88-E92 PolarHBondContact O-N 3.19Å; E92-E95 PolarHBondContact O-N 3.38Å; E92-Q96 VanDerWaalsContact O-CG 3.31Å; E92-Q96 WeakPolarHBondContact O-CG 3.43Å; E92-Q96 PolarHBondContact O-N 3.33Å |
| 93 | A | 98 | Very high | 97.7 | Very high | 45 Ų | 45 | 111 Ų | 111 | 37% | 0.372 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -66.3 | -40 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112 | K89 E90 L91 Q96 I97 | K89-A93 WeakPolarHBondContact O-CB 3.32Å; K89-A93 PolarHBondContact O-N 3.14Å; E90-A93 PolarHBondContact O-N 3.42Å; L91-A93 VanDerWaalsContact C-N 3.3Å; L91-A93 PolarHBondContact O-N 2.92Å; A93-Q96 PolarHBondContact O-N 2.86Å; A93-I97 VanDerWaalsContact O-CG1 3.31Å; A93-I97 WeakPolarHBondContact O-CG1 3.45Å; A93-I97 PolarHBondContact O-N 2.95Å |
| 94 | Q | 98.4 | Very high | 97.3 | Very high | 104 Ų | 104 | 111.9 Ų | 111.9 | 49% | 0.486 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.3 | -43.5 | 175.3 | -74.7 | 177.5 | 5.8 | 0 | 0 | 111.5 | E90 L91 I97 M98 | E90-Q94 VanDerWaalsContact O-CG 3.32Å; E90-Q94 WeakPolarHBondContact O-CG 3.42Å; E90-Q94 PolarHBondContact O-N 2.92Å; L91-Q94 WeakPolarHBondContact O-CB 3.44Å; L91-Q94 PolarHBondContact O-N 3.34Å; L91-Q94 VanDerWaalsContact O-N 3.14Å; Q94-I97 PolarHBondContact O-N 3.33Å; Q94-M98 WeakPolarHBondContact O-CB 3.31Å; Q94-M98 PolarHBondContact O-N 3.47Å |
| 95 | E | 97.9 | Very high | 96.9 | Very high | 123 Ų | 123 | 109.1 Ų | 109.1 | 58% | 0.575 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -61.6 | -44 | 175.7 | -72.4 | 177 | 172.7 | 0 | 0 | 111.9 | L91 E92 I97 M98 Y99 | L91-E95 WeakPolarHBondContact O-CG 3.35Å; L91-E95 PolarHBondContact O-N 3Å; E92-E95 PolarHBondContact O-N 3.38Å; E95-I97 PolarHBondContact O-N 2.98Å; E95-M98 PolarHBondContact O-N 3.26Å; E95-Y99 WeakPolarHBondContact O-CB 3.31Å; E95-Y99 PolarHBondContact O-N 2.72Å |
| 96 | Q | 98.1 | Very high | 96.3 | Very high | 127 Ų | 127 | 107 Ų | 107 | 59% | 0.593 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -62 | -43.9 | 175.9 | -72.6 | 174.7 | 21.1 | 0 | 0 | 112.2 | E92 A93 M98 Y99 I100 | E92-Q96 VanDerWaalsContact O-CG 3.31Å; E92-Q96 WeakPolarHBondContact O-CG 3.43Å; E92-Q96 PolarHBondContact O-N 3.33Å; A93-Q96 PolarHBondContact O-N 2.86Å; Q96-M98 VanDerWaalsContact C-N 3.31Å; Q96-M98 PolarHBondContact O-N 2.93Å; Q96-Y99 PolarHBondContact O-N 3.44Å; Q96-I100 VanDerWaalsContact O-CG1 3.31Å; Q96-I100 WeakPolarHBondContact O-CG1 3.31Å; Q96-I100 PolarHBondContact O-N 2.95Å |
| 97 | I | 97.9 | Very high | 95.7 | Very high | 93 Ų | 93 | 106.6 Ų | 106.6 | 48% | 0.477 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61 | -43.8 | 176.1 | -72.3 | 168.1 | 0 | 0 | 0 | 110.4 | A93 Q94 E95 I100 R101 | A93-I97 VanDerWaalsContact O-CG1 3.31Å; A93-I97 WeakPolarHBondContact O-CG1 3.45Å; A93-I97 PolarHBondContact O-N 2.95Å; Q94-I97 PolarHBondContact O-N 3.33Å; E95-I97 PolarHBondContact O-N 2.98Å; I97-I100 PolarHBondContact O-N 2.97Å; I97-R101 HydrophobicContact CG2-CG 4.48Å; I97-R101 WeakPolarHBondContact O-CB 3.4Å; I97-R101 VanDerWaalsContact O-CG 3.31Å; I97-R101 WeakPolarHBondContact O-CG 3.39Å; I97-R101 PolarHBondContact O-N 3.27Å |
| 98 | M | 97.3 | Very high | 94.6 | Very high | 119 Ų | 119 | 108.3 Ų | 108.3 | 59% | 0.586 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -62.1 | -46.1 | 177.9 | -176.6 | 176.8 | 64.3 | 0 | 0 | 111.2 | Q94 E95 Q96 I100 R101 Q102 | Q94-M98 WeakPolarHBondContact O-CB 3.31Å; Q94-M98 PolarHBondContact O-N 3.47Å; E95-M98 PolarHBondContact O-N 3.26Å; Q96-M98 VanDerWaalsContact C-N 3.31Å; Q96-M98 PolarHBondContact O-N 2.93Å; M98-I100 PolarHBondContact O-N 3.46Å; M98-R101 PolarHBondContact O-N 3.5Å; M98-Q102 PolarHBondContact O-N 3.35Å |
| 99 | Y | 97.8 | Very high | 93.6 | Very high | 131 Ų | 131 | 109.9 Ų | 109.9 | 51% | 0.514 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -56.7 | -50.3 | 176.4 | 178.7 | -91.8 | 0 | 0 | 0 | 111.5 | E95 Q96 R101 Q102 E103 | E95-Y99 WeakPolarHBondContact O-CB 3.31Å; E95-Y99 PolarHBondContact O-N 2.72Å; Q96-Y99 PolarHBondContact O-N 3.44Å; Y99-R101 PolarHBondContact O-N 2.95Å; Y99-Q102 PolarHBondContact O-N 3.38Å; Y99-E103 HydrophobicContact CD1-CG 4.24Å; Y99-E103 VanDerWaalsContact CE1-CD 3.41Å; Y99-E103 HydrophobicContact CE1-CG 3.66Å; Y99-E103 WeakPolarHBondContact CE1-OE1 3.46Å; Y99-E103 PolarHBondContact O-N 3.42Å; Y99-E103 PolarHBondContact OH-OE1 2.93Å |
| 100 | I | 96.8 | Very high | 92.4 | Very high | 85 Ų | 85 | 106.2 Ų | 106.2 | 44% | 0.436 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -59.7 | -46.7 | 178.6 | -69.7 | 168.9 | 0 | 0 | 0 | 110.6 | Q96 I97 M98 Q102 E103 Y104 | Q96-I100 VanDerWaalsContact O-CG1 3.31Å; Q96-I100 WeakPolarHBondContact O-CG1 3.31Å; Q96-I100 PolarHBondContact O-N 2.95Å; I97-I100 PolarHBondContact O-N 2.97Å; M98-I100 PolarHBondContact O-N 3.46Å; I100-Q102 VanDerWaalsContact C-N 3.31Å; I100-Q102 PolarHBondContact O-N 3.4Å; I100-E103 PolarHBondContact O-N 3.39Å; I100-Y104 HydrophobicContact CG2-CD2 3.62Å; I100-Y104 HydrophobicContact CG2-CE2 3.6Å; I100-Y104 VanDerWaalsContact O-CD2 3.25Å; I100-Y104 WeakPolarHBondContact O-CD2 3.31Å; I100-Y104 PolarHBondContact O-N 3.23Å |
| 101 | R | 95.5 | Very high | 91 | Very high | 179 Ų | 179 | 107.9 Ų | 107.9 | 68% | 0.675 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -57.3 | -45.4 | 177.8 | -77.4 | 177.8 | -179.7 | -82.6 | 0.1 | 111.7 | I97 M98 Y99 Y104 E105 | I97-R101 HydrophobicContact CG2-CG 4.48Å; I97-R101 WeakPolarHBondContact O-CB 3.4Å; I97-R101 VanDerWaalsContact O-CG 3.31Å; I97-R101 WeakPolarHBondContact O-CG 3.39Å; I97-R101 PolarHBondContact O-N 3.27Å; M98-R101 PolarHBondContact O-N 3.5Å; Y99-R101 PolarHBondContact O-N 2.95Å; R101-Y104 PolarHBondContact O-N 2.8Å; R101-E105 WeakPolarHBondContact O-CB 3.32Å; R101-E105 PolarHBondContact O-N 2.91Å |
| 102 | Q | 94.9 | Very high | 89.8 | Confident | 117 Ų | 117 | 109.1 Ų | 109.1 | 55% | 0.547 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -64.1 | -42.2 | 178.6 | -175.8 | 179.3 | 0.5 | 0 | 0 | 112 | M98 Y99 I100 Y104 E105 T106 | M98-Q102 PolarHBondContact O-N 3.35Å; Y99-Q102 PolarHBondContact O-N 3.38Å; I100-Q102 VanDerWaalsContact C-N 3.31Å; I100-Q102 PolarHBondContact O-N 3.4Å; Q102-Y104 PolarHBondContact O-N 3.38Å; Q102-E105 PolarHBondContact O-N 3.5Å; Q102-T106 WeakPolarHBondContact O-CB 3.47Å; Q102-T106 PolarHBondContact O-N 3.36Å; Q102-T106 PolarHBondContact O-OG1 2.99Å |
| 103 | E | 93.6 | Very high | 89 | Confident | 71 Ų | 71 | 108.6 Ų | 108.6 | 33% | 0.332 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -59.4 | -46.9 | 175.1 | -78.9 | -153.2 | 146.8 | 0 | 0 | 111.6 | Y99 I100 T106 K107 | Y99-E103 HydrophobicContact CD1-CG 4.24Å; Y99-E103 VanDerWaalsContact CE1-CD 3.41Å; Y99-E103 HydrophobicContact CE1-CG 3.66Å; Y99-E103 WeakPolarHBondContact CE1-OE1 3.46Å; Y99-E103 PolarHBondContact O-N 3.42Å; Y99-E103 PolarHBondContact OH-OE1 2.93Å; I100-E103 PolarHBondContact O-N 3.39Å; E103-T106 PolarHBondContact O-N 3.23Å; E103-K107 WeakPolarHBondContact O-CB 3.46Å; E103-K107 WeakPolarHBondContact O-CG 3.25Å; E103-K107 PolarHBondContact O-N 3.24Å; E103-K107 IonicContact OE2-NZ 2.65Å |
| 104 | Y | 91.6 | Very high | 88.2 | Confident | 131 Ų | 131 | 110.4 Ų | 110.4 | 51% | 0.514 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -64.9 | -43.9 | 177.9 | -83.9 | -74.8 | 0 | 0 | 0 | 111.6 | I100 R101 Q102 T106 K107 F108 | I100-Y104 HydrophobicContact CG2-CD2 3.62Å; I100-Y104 HydrophobicContact CG2-CE2 3.6Å; I100-Y104 VanDerWaalsContact O-CD2 3.25Å; I100-Y104 WeakPolarHBondContact O-CD2 3.31Å; I100-Y104 PolarHBondContact O-N 3.23Å; R101-Y104 PolarHBondContact O-N 2.8Å; Q102-Y104 PolarHBondContact O-N 3.38Å; Y104-T106 VanDerWaalsContact C-N 3.29Å; Y104-T106 PolarHBondContact O-N 2.92Å; Y104-K107 PolarHBondContact O-N 2.65Å; Y104-F108 HydrophobicContact CD1-CE2 4.21Å; Y104-F108 WeakPolarHBondContact O-CB 3.2Å; Y104-F108 WeakPolarHBondContact O-CD2 3.34Å; Y104-F108 PolarHBondContact O-N 3.45Å |
| 105 | E | 88.7 | Confident | 87.6 | Confident | 102 Ų | 102 | 109 Ų | 109 | 48% | 0.477 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -59.3 | -42.4 | 177.2 | -173.9 | 175.5 | -176.4 | 0 | 0 | 111.6 | R101 Q102 F108 K109 | R101-E105 WeakPolarHBondContact O-CB 3.32Å; R101-E105 PolarHBondContact O-N 2.91Å; Q102-E105 PolarHBondContact O-N 3.5Å; E105-F108 PolarHBondContact O-N 2.87Å; E105-K109 HydrophobicContact CG-CD 4.2Å; E105-K109 WeakPolarHBondContact O-CB 3.43Å; E105-K109 WeakPolarHBondContact O-CG 3.2Å; E105-K109 PolarHBondContact O-N 2.92Å; E105-K109 WeakPolarHBondContact OE1-CE 3.17Å; E105-K109 IonicContact OE1-NZ 3.69Å; E105-K109 PolarHBondContact OE1-NZ 2.94Å |
| 106 | T | 86.9 | Confident | 87 | Confident | 91 Ų | 91 | 107.1 Ų | 107.1 | 56% | 0.558 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -64.2 | -46 | 176.4 | -54.8 | 0 | 0 | 0 | 0 | 111.1 | Q102 E103 Y104 K109 G110 | Q102-T106 WeakPolarHBondContact O-CB 3.47Å; Q102-T106 PolarHBondContact O-N 3.36Å; Q102-T106 PolarHBondContact O-OG1 2.99Å; E103-T106 PolarHBondContact O-N 3.23Å; Y104-T106 VanDerWaalsContact C-N 3.29Å; Y104-T106 PolarHBondContact O-N 2.92Å; T106-K109 PolarHBondContact O-N 3.44Å; T106-G110 PolarHBondContact O-N 3.29Å |
| 107 | K | 85.6 | Confident | 86.4 | Confident | 112 Ų | 112 | 108.1 Ų | 108.1 | 49% | 0.487 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -59.9 | -47.5 | 175.8 | -74.2 | 171.5 | -174.1 | 165.4 | 0 | 111.1 | E103 Y104 G110 L111 | E103-K107 WeakPolarHBondContact O-CB 3.46Å; E103-K107 WeakPolarHBondContact O-CG 3.25Å; E103-K107 PolarHBondContact O-N 3.24Å; E103-K107 IonicContact OE2-NZ 2.65Å; Y104-K107 PolarHBondContact O-N 2.65Å; K107-G110 CarbonylContact O-C 3.59Å; K107-G110 PolarHBondContact O-N 3.16Å; K107-G110 VanDerWaalsContact O-N 3.16Å; K107-L111 WeakPolarHBondContact O-CG 3.45Å; K107-L111 PolarHBondContact O-N 3.43Å |
| 108 | F | 76.4 | Confident | 86.1 | Confident | 143 Ų | 143 | 108.1 Ų | 108.1 | 63% | 0.627 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -62.8 | -44.1 | 179.1 | -86.4 | -70 | 0 | 0 | 0 | 112.9 | Y104 E105 G110 L111 | Y104-F108 HydrophobicContact CD1-CE2 4.21Å; Y104-F108 WeakPolarHBondContact O-CB 3.2Å; Y104-F108 WeakPolarHBondContact O-CD2 3.34Å; Y104-F108 PolarHBondContact O-N 3.45Å; E105-F108 PolarHBondContact O-N 2.87Å; F108-G110 VanDerWaalsContact C-N 3.27Å; F108-G110 PolarHBondContact O-N 2.91Å; F108-L111 PolarHBondContact O-N 2.81Å |
| 109 | K | 77.2 | Confident | 86 | Confident | 143 Ų | 143 | 108 Ų | 108 | 62% | 0.622 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -63.2 | -35.1 | 174 | -72.5 | 176.5 | -175.2 | 170.6 | 0 | 111.8 | E105 T106 | E105-K109 HydrophobicContact CG-CD 4.2Å; E105-K109 WeakPolarHBondContact O-CB 3.43Å; E105-K109 WeakPolarHBondContact O-CG 3.2Å; E105-K109 PolarHBondContact O-N 2.92Å; E105-K109 WeakPolarHBondContact OE1-CE 3.17Å; E105-K109 IonicContact OE1-NZ 3.69Å; E105-K109 PolarHBondContact OE1-NZ 2.94Å; T106-K109 PolarHBondContact O-N 3.44Å |
| 110 | G | 72.1 | Confident | 85.8 | Confident | 63 Ų | 63 | 106 Ų | 106 | 65% | 0.649 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -73.6 | -24.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | T106 K107 F108 | T106-G110 PolarHBondContact O-N 3.29Å; K107-G110 CarbonylContact O-C 3.59Å; K107-G110 PolarHBondContact O-N 3.16Å; K107-G110 VanDerWaalsContact O-N 3.16Å; F108-G110 VanDerWaalsContact C-N 3.27Å; F108-G110 PolarHBondContact O-N 2.91Å |
| 111 | L | 69.6 | Low | 85.7 | Confident | 138 Ų | 138 | 106.3 Ų | 106.3 | 72% | 0.723 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -78.6 | -16.3 | -178.2 | -75.4 | 168.7 | 0 | 0 | 0 | 113.9 | K107 F108 | K107-L111 WeakPolarHBondContact O-CG 3.45Å; K107-L111 PolarHBondContact O-N 3.43Å; F108-L111 PolarHBondContact O-N 2.81Å |
| 112 | M | 72.3 | Confident | 85.8 | Confident | 95 Ų | 95 | 102.1 Ų | 102.1 | 47% | 0.468 | 52% | 0.524 | S | S | . | . | S | Bend | trans | -124.4 | 99.8 | 177.9 | -171.7 | 177.1 | -73.2 | 0 | 0 | 110.2 | A114 R117 | M112-A114 PolarHBondContact O-N 2.99Å; M112-R117 HydrophobicContact CG-CB 4.16Å; M112-R117 HydrophobicContact SD-CB 4.01Å; M112-R117 HydrophobicContact SD-CG 3.88Å |
| 113 | P | 82.4 | Confident | 86 | Confident | 68 Ų | 68 | 100.3 Ų | 100.3 | 44% | 0.442 | 52% | 0.521 | S | S | . | . | trans | -55.7 | 138.5 | 173.7 | -24.6 | 34 | 0 | 0 | 0 | 111.1 | S115 L116 R117 | P113-S115 PolarHBondContact O-N 3Å; P113-L116 HydrophobicContact CB-CB 4.26Å; P113-L116 PolarHBondContact O-N 3.19Å; P113-L116 VanDerWaalsContact O-N 3.08Å; P113-R117 PolarHBondContact O-N 3.47Å | ||
| 114 | A | 81.9 | Confident | 86.1 | Confident | 84 Ų | 84 | 101 Ų | 101 | 69% | 0.694 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -57 | -34.3 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | M112 R117 Q118 | M112-A114 PolarHBondContact O-N 2.99Å; A114-R117 PolarHBondContact O-N 3.08Å; A114-Q118 WeakPolarHBondContact O-CB 3.29Å; A114-Q118 PolarHBondContact O-N 3.33Å |
| 115 | S | 85.3 | Confident | 86.4 | Confident | 75 Ų | 75 | 98.2 Ų | 98.2 | 52% | 0.524 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -61.1 | -51.2 | 173.8 | 50.6 | 0 | 0 | 0 | 0 | 112.2 | P113 R117 Q118 E119 | P113-S115 PolarHBondContact O-N 3Å; S115-R117 VanDerWaalsContact C-N 3.29Å; S115-R117 PolarHBondContact O-N 3.17Å; S115-Q118 PolarHBondContact O-N 3.1Å; S115-Q118 VanDerWaalsContact O-N 3.17Å; S115-E119 WeakPolarHBondContact O-CG 3.49Å; S115-E119 PolarHBondContact O-N 3.44Å |
| 116 | L | 85.5 | Confident | 86.9 | Confident | 82 Ų | 82 | 96.2 Ų | 96.2 | 43% | 0.429 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -63.1 | -37.4 | 179.1 | -178.2 | 61.5 | 0 | 0 | 0 | 111.5 | P113 L120 | P113-L116 HydrophobicContact CB-CB 4.26Å; P113-L116 PolarHBondContact O-N 3.19Å; P113-L116 VanDerWaalsContact O-N 3.08Å; L116-L120 HydrophobicContact CG-CD1 4.43Å; L116-L120 VanDerWaalsContact O-CG 3.29Å; L116-L120 WeakPolarHBondContact O-CG 3.41Å; L116-L120 PolarHBondContact O-N 2.92Å; L116-L120 VanDerWaalsContact O-N 3.1Å |
| 117 | R | 84.9 | Confident | 87.4 | Confident | 148 Ų | 148 | 96.3 Ų | 96.3 | 56% | 0.558 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -61.2 | -46.8 | 174.2 | -166.5 | -177.9 | -147 | -176.2 | 5.5 | 111.5 | M112 P113 A114 S115 L120 E121 | M112-R117 HydrophobicContact CG-CB 4.16Å; M112-R117 HydrophobicContact SD-CB 4.01Å; M112-R117 HydrophobicContact SD-CG 3.88Å; P113-R117 PolarHBondContact O-N 3.47Å; A114-R117 PolarHBondContact O-N 3.08Å; S115-R117 VanDerWaalsContact C-N 3.29Å; S115-R117 PolarHBondContact O-N 3.17Å; R117-L120 PolarHBondContact O-N 3.37Å; R117-E121 WeakPolarHBondContact O-CG 3.46Å; R117-E121 PolarHBondContact O-N 3.03Å |
| 118 | Q | 92.1 | Very high | 88 | Confident | 93 Ų | 93 | 97.9 Ų | 97.9 | 44% | 0.435 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -63.8 | -44.1 | 179.1 | -170.6 | 62.3 | 56.2 | 0 | 0 | 111.6 | A114 S115 L120 E121 D122 | A114-Q118 WeakPolarHBondContact O-CB 3.29Å; A114-Q118 PolarHBondContact O-N 3.33Å; S115-Q118 PolarHBondContact O-N 3.1Å; S115-Q118 VanDerWaalsContact O-N 3.17Å; Q118-L120 VanDerWaalsContact C-N 3.28Å; Q118-L120 PolarHBondContact O-N 2.91Å; Q118-E121 PolarHBondContact O-N 3.33Å; Q118-E121 VanDerWaalsContact O-N 3.14Å; Q118-D122 PolarHBondContact NE2-OD1 2.82Å; Q118-D122 WeakPolarHBondContact O-CB 3.21Å; Q118-D122 VanDerWaalsContact O-CG 3.24Å; Q118-D122 PolarHBondContact O-N 2.92Å |
| 119 | E | 94.6 | Very high | 89 | Confident | 117 Ų | 117 | 95 Ų | 95 | 55% | 0.547 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -58.6 | -40.1 | 176.9 | -74.1 | 172.9 | -158.2 | 0 | 0 | 112.2 | S115 T123 | S115-E119 WeakPolarHBondContact O-CG 3.49Å; S115-E119 PolarHBondContact O-N 3.44Å; E119-T123 WeakPolarHBondContact O-CB 3.47Å; E119-T123 PolarHBondContact O-N 2.94Å; E119-T123 PolarHBondContact O-OG1 2.86Å |
| 120 | L | 93.8 | Very high | 90 | Very high | 90 Ų | 90 | 93.1 Ų | 93.1 | 47% | 0.471 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -66.9 | -42.8 | 175.4 | -70.8 | 172 | 0 | 0 | 0 | 111.8 | L116 R117 Q118 T123 I124 | L116-L120 HydrophobicContact CG-CD1 4.43Å; L116-L120 VanDerWaalsContact O-CG 3.29Å; L116-L120 WeakPolarHBondContact O-CG 3.41Å; L116-L120 PolarHBondContact O-N 2.92Å; L116-L120 VanDerWaalsContact O-N 3.1Å; R117-L120 PolarHBondContact O-N 3.37Å; Q118-L120 VanDerWaalsContact C-N 3.28Å; Q118-L120 PolarHBondContact O-N 2.91Å; L120-T123 PolarHBondContact O-N 3.42Å; L120-I124 WeakPolarHBondContact O-CB 3.35Å; L120-I124 WeakPolarHBondContact O-CD1 3.33Å; L120-I124 WeakPolarHBondContact O-CG1 3.44Å; L120-I124 PolarHBondContact O-N 3.14Å |
| 121 | E | 95.4 | Very high | 91.3 | Very high | 91 Ų | 91 | 93.8 Ų | 93.8 | 43% | 0.425 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.6 | -41.5 | 177 | -74.1 | 176.3 | -171.4 | 0 | 0 | 112.2 | R117 Q118 I124 S125 | R117-E121 WeakPolarHBondContact O-CG 3.46Å; R117-E121 PolarHBondContact O-N 3.03Å; Q118-E121 PolarHBondContact O-N 3.33Å; Q118-E121 VanDerWaalsContact O-N 3.14Å; E121-I124 PolarHBondContact O-N 2.74Å; E121-S125 WeakPolarHBondContact O-CB 3.35Å; E121-S125 PolarHBondContact O-N 3.39Å; E121-S125 PolarHBondContact O-OG 3.45Å |
| 122 | D | 97.6 | Very high | 92.6 | Very high | 90 Ų | 90 | 90.5 Ų | 90.5 | 48% | 0.481 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -65.1 | -43.4 | 176.3 | -68.3 | -12.9 | 0 | 0 | 0 | 110.8 | Q118 S125 S126 | Q118-D122 PolarHBondContact NE2-OD1 2.82Å; Q118-D122 WeakPolarHBondContact O-CB 3.21Å; Q118-D122 VanDerWaalsContact O-CG 3.24Å; Q118-D122 PolarHBondContact O-N 2.92Å; D122-S125 PolarHBondContact O-N 2.87Å; D122-S126 WeakPolarHBondContact O-CB 3.47Å; D122-S126 PolarHBondContact O-N 3.25Å |
| 123 | T | 97.6 | Very high | 93.8 | Very high | 79 Ų | 79 | 92.1 Ų | 92.1 | 49% | 0.485 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.3 | -45.9 | 176.8 | -59.6 | 0 | 0 | 0 | 0 | 111.4 | E119 L120 S125 S126 L127 | E119-T123 WeakPolarHBondContact O-CB 3.47Å; E119-T123 PolarHBondContact O-N 2.94Å; E119-T123 PolarHBondContact O-OG1 2.86Å; L120-T123 PolarHBondContact O-N 3.42Å; T123-S125 VanDerWaalsContact C-N 3.3Å; T123-S125 PolarHBondContact O-N 2.97Å; T123-S126 PolarHBondContact O-N 3.12Å; T123-L127 HydrophobicContact CG2-CD1 4.11Å; T123-L127 WeakPolarHBondContact O-CB 3.37Å; T123-L127 WeakPolarHBondContact O-CG 3.45Å; T123-L127 PolarHBondContact O-N 3.08Å |
| 124 | I | 97.3 | Very high | 94.6 | Very high | 86 Ų | 86 | 93.2 Ų | 93.2 | 44% | 0.441 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.1 | -43.1 | 176 | -71.4 | 165 | 0 | 0 | 0 | 110.4 | L120 E121 L127 K128 | L120-I124 WeakPolarHBondContact O-CB 3.35Å; L120-I124 WeakPolarHBondContact O-CD1 3.33Å; L120-I124 WeakPolarHBondContact O-CG1 3.44Å; L120-I124 PolarHBondContact O-N 3.14Å; E121-I124 PolarHBondContact O-N 2.74Å; I124-L127 PolarHBondContact O-N 3.42Å; I124-K128 HydrophobicContact CG2-CD 4.15Å; I124-K128 WeakPolarHBondContact O-CB 3.49Å; I124-K128 WeakPolarHBondContact O-CG 3.44Å; I124-K128 PolarHBondContact O-N 3.44Å |
| 125 | S | 97.8 | Very high | 95.3 | Very high | 72 Ų | 72 | 95.1 Ų | 95.1 | 50% | 0.503 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -65 | -43.1 | 179.9 | -61.5 | 0 | 0 | 0 | 0 | 111.8 | E121 D122 T123 K128 S129 | E121-S125 WeakPolarHBondContact O-CB 3.35Å; E121-S125 PolarHBondContact O-N 3.39Å; E121-S125 PolarHBondContact O-OG 3.45Å; D122-S125 PolarHBondContact O-N 2.87Å; T123-S125 VanDerWaalsContact C-N 3.3Å; T123-S125 PolarHBondContact O-N 2.97Å; S125-K128 PolarHBondContact O-N 3.42Å; S125-S129 PolarHBondContact O-N 3.42Å; S125-S129 VanDerWaalsContact O-N 3.08Å |
| 126 | S | 98.3 | Very high | 95.8 | Very high | 61 Ų | 61 | 97.7 Ų | 97.7 | 43% | 0.427 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.6 | -48.2 | 174.4 | -176.8 | 0 | 0 | 0 | 0 | 111.7 | D122 T123 K128 S129 Q130 | D122-S126 WeakPolarHBondContact O-CB 3.47Å; D122-S126 PolarHBondContact O-N 3.25Å; T123-S126 PolarHBondContact O-N 3.12Å; S126-K128 PolarHBondContact O-N 2.95Å; S126-S129 WeakPolarHBondContact O-CB 3.43Å; S126-S129 PolarHBondContact O-N 2.95Å; S126-Q130 WeakPolarHBondContact O-CG 3.34Å; S126-Q130 PolarHBondContact O-N 3.19Å; S126-Q130 PolarHBondContact OG-NE2 2.98Å; S126-Q130 VanDerWaalsContact OG-NE2 3.12Å |
| 127 | L | 98.3 | Very high | 96.3 | Very high | 93 Ų | 93 | 100.3 Ų | 100.3 | 49% | 0.487 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -61.9 | -42.2 | 178.4 | -72.8 | 172.1 | 0 | 0 | 0 | 112.2 | T123 I124 S129 Q130 V131 | T123-L127 HydrophobicContact CG2-CD1 4.11Å; T123-L127 WeakPolarHBondContact O-CB 3.37Å; T123-L127 WeakPolarHBondContact O-CG 3.45Å; T123-L127 PolarHBondContact O-N 3.08Å; I124-L127 PolarHBondContact O-N 3.42Å; L127-S129 VanDerWaalsContact C-N 3.32Å; L127-S129 PolarHBondContact O-N 2.95Å; L127-Q130 PolarHBondContact O-N 3.48Å; L127-V131 WeakPolarHBondContact O-CG2 3.49Å; L127-V131 PolarHBondContact O-N 3.47Å |
| 128 | K | 97.8 | Very high | 96.8 | Very high | 145 Ų | 145 | 96 Ų | 96 | 63% | 0.63 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -58.9 | -43.1 | 174.7 | -77.8 | 176 | 178.2 | 177.1 | 0 | 111.9 | I124 S125 S126 V131 N132 | I124-K128 HydrophobicContact CG2-CD 4.15Å; I124-K128 WeakPolarHBondContact O-CB 3.49Å; I124-K128 WeakPolarHBondContact O-CG 3.44Å; I124-K128 PolarHBondContact O-N 3.44Å; S125-K128 PolarHBondContact O-N 3.42Å; S126-K128 PolarHBondContact O-N 2.95Å; K128-V131 PolarHBondContact O-N 2.9Å; K128-N132 WeakPolarHBondContact O-CB 3.35Å; K128-N132 PolarHBondContact O-N 2.99Å |
| 129 | S | 97.9 | Very high | 97 | Very high | 81 Ų | 81 | 95.2 Ų | 95.2 | 57% | 0.566 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -63.2 | -45.3 | 176.5 | -175.9 | 0 | 0 | 0 | 0 | 111.7 | S125 S126 L127 V131 N132 F133 | S125-S129 PolarHBondContact O-N 3.42Å; S125-S129 VanDerWaalsContact O-N 3.08Å; S126-S129 WeakPolarHBondContact O-CB 3.43Å; S126-S129 PolarHBondContact O-N 2.95Å; L127-S129 VanDerWaalsContact C-N 3.32Å; L127-S129 PolarHBondContact O-N 2.95Å; S129-V131 PolarHBondContact O-N 3.35Å; S129-N132 PolarHBondContact O-N 2.93Å; S129-F133 PolarHBondContact O-N 3.26Å |
| 130 | Q | 98.2 | Very high | 97 | Very high | 104 Ų | 104 | 94 Ų | 94 | 49% | 0.486 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -60.5 | -45.6 | 176.7 | -69.1 | 174.2 | 43.1 | 0 | 0 | 112 | S126 L127 N132 F133 L134 | S126-Q130 WeakPolarHBondContact O-CG 3.34Å; S126-Q130 PolarHBondContact O-N 3.19Å; S126-Q130 PolarHBondContact OG-NE2 2.98Å; S126-Q130 VanDerWaalsContact OG-NE2 3.12Å; L127-Q130 PolarHBondContact O-N 3.48Å; Q130-N132 VanDerWaalsContact C-N 3.35Å; Q130-N132 PolarHBondContact O-N 3.27Å; Q130-F133 PolarHBondContact O-N 3.47Å; Q130-L134 WeakPolarHBondContact O-CG 3.41Å; Q130-L134 PolarHBondContact O-N 3.48Å |
| 131 | V | 98.2 | Very high | 97 | Very high | 77 Ų | 77 | 94 Ų | 94 | 47% | 0.467 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -60.7 | -44.8 | 176.2 | 170.3 | 0 | 0 | 0 | 0 | 110.9 | L127 K128 S129 F133 L134 Q135 | L127-V131 WeakPolarHBondContact O-CG2 3.49Å; L127-V131 PolarHBondContact O-N 3.47Å; K128-V131 PolarHBondContact O-N 2.9Å; S129-V131 PolarHBondContact O-N 3.35Å; V131-F133 VanDerWaalsContact C-N 3.33Å; V131-F133 PolarHBondContact O-N 3.31Å; V131-L134 PolarHBondContact O-N 2.98Å; V131-Q135 HydrophobicContact CG1-CG 4.32Å; V131-Q135 WeakPolarHBondContact O-CB 3.44Å; V131-Q135 VanDerWaalsContact O-CG 3.28Å; V131-Q135 WeakPolarHBondContact O-CG 3.28Å; V131-Q135 PolarHBondContact O-N 3.29Å |
| 132 | N | 97.8 | Very high | 96.8 | Very high | 70 Ų | 70 | 95.3 Ų | 95.3 | 37% | 0.374 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -60.7 | -42.7 | 177.8 | -170.5 | -85.6 | 0 | 0 | 0 | 112 | K128 S129 Q130 Q135 K136 | K128-N132 WeakPolarHBondContact O-CB 3.35Å; K128-N132 PolarHBondContact O-N 2.99Å; S129-N132 PolarHBondContact O-N 2.93Å; Q130-N132 VanDerWaalsContact C-N 3.35Å; Q130-N132 PolarHBondContact O-N 3.27Å; N132-Q135 PolarHBondContact O-N 2.88Å; N132-K136 WeakPolarHBondContact O-CG 3.46Å; N132-K136 PolarHBondContact O-N 2.97Å; N132-K136 WeakPolarHBondContact OD1-CD 3.44Å; N132-K136 WeakPolarHBondContact OD1-CE 3.42Å; N132-K136 PolarHBondContact OD1-NZ 3.37Å |
| 133 | F | 97.9 | Very high | 96.5 | Very high | 129 Ų | 129 | 97 Ų | 97 | 57% | 0.566 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -61.7 | -47.2 | 177 | -179.3 | -94 | 0 | 0 | 0 | 111.7 | S129 Q130 V131 Q135 K136 R137 | S129-F133 PolarHBondContact O-N 3.26Å; Q130-F133 PolarHBondContact O-N 3.47Å; V131-F133 VanDerWaalsContact C-N 3.33Å; V131-F133 PolarHBondContact O-N 3.31Å; F133-Q135 VanDerWaalsContact C-N 3.35Å; F133-Q135 PolarHBondContact O-N 3.29Å; F133-K136 PolarHBondContact O-N 3.42Å; F133-R137 PolarHBondContact O-N 3.4Å |
| 134 | L | 97.8 | Very high | 96.3 | Very high | 91 Ų | 91 | 97.9 Ų | 97.9 | 48% | 0.476 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.6 | -41.4 | 177.9 | -70.8 | 174.6 | 0 | 0 | 0 | 111.9 | Q130 V131 R137 A138 | Q130-L134 WeakPolarHBondContact O-CG 3.41Å; Q130-L134 PolarHBondContact O-N 3.48Å; V131-L134 PolarHBondContact O-N 2.98Å; L134-R137 PolarHBondContact O-N 3.49Å; L134-A138 WeakPolarHBondContact O-CB 3.08Å; L134-A138 PolarHBondContact O-N 3.39Å |
| 135 | Q | 96.8 | Very high | 95.8 | Very high | 123 Ų | 123 | 98.3 Ų | 98.3 | 58% | 0.575 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -60.8 | -45.5 | 175.3 | -74.7 | 172.1 | -26 | 0 | 0 | 112 | V131 N132 F133 A138 S139 | V131-Q135 HydrophobicContact CG1-CG 4.32Å; V131-Q135 WeakPolarHBondContact O-CB 3.44Å; V131-Q135 VanDerWaalsContact O-CG 3.28Å; V131-Q135 WeakPolarHBondContact O-CG 3.28Å; V131-Q135 PolarHBondContact O-N 3.29Å; N132-Q135 PolarHBondContact O-N 2.88Å; F133-Q135 VanDerWaalsContact C-N 3.35Å; F133-Q135 PolarHBondContact O-N 3.29Å; Q135-A138 PolarHBondContact O-N 2.91Å; Q135-S139 PolarHBondContact O-N 2.89Å |
| 136 | K | 96.9 | Very high | 95.3 | Very high | 129 Ų | 129 | 97.7 Ų | 97.7 | 56% | 0.561 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -60.9 | -46.1 | 175.7 | -76.8 | 172.7 | 174.2 | 161.1 | 0 | 111.9 | N132 F133 A138 S139 I140 | N132-K136 WeakPolarHBondContact O-CG 3.46Å; N132-K136 PolarHBondContact O-N 2.97Å; N132-K136 WeakPolarHBondContact OD1-CD 3.44Å; N132-K136 WeakPolarHBondContact OD1-CE 3.42Å; N132-K136 PolarHBondContact OD1-NZ 3.37Å; F133-K136 PolarHBondContact O-N 3.42Å; K136-A138 PolarHBondContact O-N 3.08Å; K136-S139 WeakPolarHBondContact O-CB 3.45Å; K136-S139 PolarHBondContact O-N 3.36Å; K136-I140 WeakPolarHBondContact O-CG1 3.46Å; K136-I140 PolarHBondContact O-N 3.49Å; K136-I140 VanDerWaalsContact O-N 3.1Å |
| 137 | R | 96.4 | Very high | 94.6 | Very high | 138 Ų | 138 | 97.5 Ų | 97.5 | 52% | 0.521 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.9 | -42.9 | 178.4 | -167.5 | 178.4 | 74.6 | -174 | 3 | 111.8 | F133 L134 S139 I140 L141 | F133-R137 PolarHBondContact O-N 3.4Å; L134-R137 PolarHBondContact O-N 3.49Å; R137-S139 VanDerWaalsContact C-N 3.32Å; R137-S139 PolarHBondContact O-N 3.1Å; R137-I140 PolarHBondContact O-N 3.25Å; R137-L141 HydrophobicContact CG-CD1 4.4Å; R137-L141 WeakPolarHBondContact O-CG 3.42Å; R137-L141 PolarHBondContact O-N 2.96Å; R137-L141 VanDerWaalsContact O-N 3.08Å |
| 138 | A | 94.9 | Very high | 93.6 | Very high | 58 Ų | 58 | 101.2 Ų | 101.2 | 48% | 0.479 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.1 | -40.2 | 176 | 0 | 0 | 0 | 0 | 0 | 111.9 | L134 Q135 K136 L141 Q142 | L134-A138 WeakPolarHBondContact O-CB 3.08Å; L134-A138 PolarHBondContact O-N 3.39Å; Q135-A138 PolarHBondContact O-N 2.91Å; K136-A138 PolarHBondContact O-N 3.08Å; A138-L141 PolarHBondContact O-N 3.32Å; A138-Q142 WeakPolarHBondContact O-CB 3.49Å; A138-Q142 PolarHBondContact O-N 3.01Å |
| 139 | S | 95.7 | Very high | 92.4 | Very high | 76 Ų | 76 | 100.9 Ų | 100.9 | 53% | 0.531 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -60.4 | -45 | 175.7 | -169 | 0 | 0 | 0 | 0 | 112.4 | Q135 K136 R137 Q142 E143 | Q135-S139 PolarHBondContact O-N 2.89Å; K136-S139 WeakPolarHBondContact O-CB 3.45Å; K136-S139 PolarHBondContact O-N 3.36Å; R137-S139 VanDerWaalsContact C-N 3.32Å; R137-S139 PolarHBondContact O-N 3.1Å; S139-Q142 WeakPolarHBondContact O-CB 3.4Å; S139-Q142 PolarHBondContact O-N 3.32Å; S139-E143 PolarHBondContact O-N 2.71Å |
| 140 | I | 94.9 | Very high | 91.1 | Very high | 92 Ų | 92 | 101.9 Ų | 101.9 | 47% | 0.472 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.9 | -47.8 | 178.4 | -66.3 | 166.2 | 0 | 0 | 0 | 110.6 | K136 R137 Q142 E143 E144 | K136-I140 WeakPolarHBondContact O-CG1 3.46Å; K136-I140 PolarHBondContact O-N 3.49Å; K136-I140 VanDerWaalsContact O-N 3.1Å; R137-I140 PolarHBondContact O-N 3.25Å; I140-Q142 VanDerWaalsContact C-N 3.25Å; I140-Q142 PolarHBondContact O-N 3.43Å; I140-E143 WeakPolarHBondContact O-CB 3.36Å; I140-E143 PolarHBondContact O-N 2.91Å; I140-E143 VanDerWaalsContact O-N 3.11Å; I140-E144 WeakPolarHBondContact O-CG 3.35Å; I140-E144 PolarHBondContact O-N 3.11Å |
| 141 | L | 94.2 | Very high | 89.7 | Confident | 88 Ų | 88 | 106.7 Ų | 106.7 | 46% | 0.461 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -61.4 | -36.1 | 178.4 | -70.5 | 171.6 | 0 | 0 | 0 | 112.1 | R137 A138 L145 | R137-L141 HydrophobicContact CG-CD1 4.4Å; R137-L141 WeakPolarHBondContact O-CG 3.42Å; R137-L141 PolarHBondContact O-N 2.96Å; R137-L141 VanDerWaalsContact O-N 3.08Å; A138-L141 PolarHBondContact O-N 3.32Å; L141-L145 WeakPolarHBondContact O-CG 3.49Å; L141-L145 PolarHBondContact O-N 2.94Å |
| 142 | Q | 91.7 | Very high | 87.5 | Confident | 119 Ų | 119 | 116.6 Ų | 116.6 | 56% | 0.556 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -65.3 | -42.2 | 174.7 | -166.8 | 68.2 | 32.9 | 0 | 0 | 111.5 | A138 S139 I140 L145 T146 | A138-Q142 WeakPolarHBondContact O-CB 3.49Å; A138-Q142 PolarHBondContact O-N 3.01Å; S139-Q142 WeakPolarHBondContact O-CB 3.4Å; S139-Q142 PolarHBondContact O-N 3.32Å; I140-Q142 VanDerWaalsContact C-N 3.25Å; I140-Q142 PolarHBondContact O-N 3.43Å; Q142-L145 PolarHBondContact O-N 3.24Å; Q142-T146 WeakPolarHBondContact O-CG2 3.1Å; Q142-T146 PolarHBondContact O-N 3Å; Q142-T146 PolarHBondContact O-OG1 2.96Å |
| 143 | E | 91.3 | Very high | 87 | Confident | 126 Ų | 126 | 119 Ų | 119 | 59% | 0.589 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -65.2 | -39.4 | 176.6 | -174.3 | 177.4 | -173.4 | 0 | 0 | 112.5 | S139 I140 T146 T147 | S139-E143 PolarHBondContact O-N 2.71Å; I140-E143 WeakPolarHBondContact O-CB 3.36Å; I140-E143 PolarHBondContact O-N 2.91Å; I140-E143 VanDerWaalsContact O-N 3.11Å; E143-T146 WeakPolarHBondContact CA-OG1 3.43Å; E143-T146 PolarHBondContact O-OG1 3.47Å; E143-T147 WeakPolarHBondContact O-CB 3.47Å; E143-T147 PolarHBondContact O-N 3Å; E143-T147 PolarHBondContact O-OG1 3.33Å |
| 144 | E | 92.1 | Very high | 86.5 | Confident | 98 Ų | 98 | 118.4 Ų | 118.4 | 46% | 0.458 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -61.9 | -48 | 173.4 | -72.1 | 177.2 | -178.6 | 0 | 0 | 110.9 | I140 T146 T147 Y148 | I140-E144 WeakPolarHBondContact O-CG 3.35Å; I140-E144 PolarHBondContact O-N 3.11Å; E144-T146 PolarHBondContact O-N 2.91Å; E144-T147 WeakPolarHBondContact O-CB 3.33Å; E144-T147 PolarHBondContact O-N 3.39Å; E144-Y148 WeakPolarHBondContact O-CD2 3.38Å; E144-Y148 PolarHBondContact O-N 3.06Å |
| 145 | L | 88 | Confident | 85.8 | Confident | 95 Ų | 95 | 119.9 Ų | 119.9 | 50% | 0.497 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -60.1 | -44.4 | 178.1 | -77.5 | 171 | 0 | 0 | 0 | 112.7 | L141 Q142 T147 Y148 Q149 | L141-L145 WeakPolarHBondContact O-CG 3.49Å; L141-L145 PolarHBondContact O-N 2.94Å; Q142-L145 PolarHBondContact O-N 3.24Å; L145-T147 VanDerWaalsContact C-N 3.32Å; L145-T147 PolarHBondContact O-N 3.49Å; L145-Y148 PolarHBondContact O-N 3.49Å; L145-Q149 VanDerWaalsContact O-CG 3.32Å; L145-Q149 WeakPolarHBondContact O-CG 3.33Å; L145-Q149 PolarHBondContact O-N 2.8Å |
| 146 | T | 87.1 | Confident | 85.2 | Confident | 59 Ų | 59 | 119.8 Ų | 119.8 | 36% | 0.362 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -66.3 | -36.1 | 177.8 | 55 | 0 | 0 | 0 | 0 | 111.7 | Q142 E143 E144 Q149 S150 | Q142-T146 WeakPolarHBondContact O-CG2 3.1Å; Q142-T146 PolarHBondContact O-N 3Å; Q142-T146 PolarHBondContact O-OG1 2.96Å; E143-T146 WeakPolarHBondContact CA-OG1 3.43Å; E143-T146 PolarHBondContact O-OG1 3.47Å; E144-T146 PolarHBondContact O-N 2.91Å; T146-Q149 PolarHBondContact O-N 2.98Å; T146-S150 WeakPolarHBondContact O-CB 3.32Å; T146-S150 PolarHBondContact O-N 3.26Å; T146-S150 PolarHBondContact O-OG 3.42Å |
| 147 | T | 82.6 | Confident | 84.5 | Confident | 57 Ų | 57 | 119.2 Ų | 119.2 | 35% | 0.35 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -64.6 | -42.2 | 174.6 | -57.6 | 0 | 0 | 0 | 0 | 111.4 | E143 E144 L145 S150 R151 | E143-T147 WeakPolarHBondContact O-CB 3.47Å; E143-T147 PolarHBondContact O-N 3Å; E143-T147 PolarHBondContact O-OG1 3.33Å; E144-T147 WeakPolarHBondContact O-CB 3.33Å; E144-T147 PolarHBondContact O-N 3.39Å; L145-T147 VanDerWaalsContact C-N 3.32Å; L145-T147 PolarHBondContact O-N 3.49Å; T147-S150 PolarHBondContact O-N 3.37Å; T147-R151 WeakPolarHBondContact O-CG 3.39Å; T147-R151 PolarHBondContact O-N 2.95Å |
| 148 | Y | 76.9 | Confident | 83.7 | Confident | 170 Ų | 170 | 117.9 Ų | 117.9 | 67% | 0.667 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -65.2 | -41.2 | 174 | -80.4 | -68.7 | 0 | 0 | 0 | 112.5 | E144 L145 S150 R151 | E144-Y148 WeakPolarHBondContact O-CD2 3.38Å; E144-Y148 PolarHBondContact O-N 3.06Å; L145-Y148 PolarHBondContact O-N 3.49Å; Y148-S150 VanDerWaalsContact C-N 3.31Å; Y148-S150 PolarHBondContact O-N 3.46Å; Y148-R151 PolarHBondContact O-N 3.32Å |
| 149 | Q | 73.5 | Confident | 82.9 | Confident | 139 Ų | 139 | 122.2 Ų | 122.2 | 65% | 0.65 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -66.5 | -32.4 | 178.7 | -74.8 | 173.8 | -12.3 | 0 | 0 | 113 | L145 T146 R151 | L145-Q149 VanDerWaalsContact O-CG 3.32Å; L145-Q149 WeakPolarHBondContact O-CG 3.33Å; L145-Q149 PolarHBondContact O-N 2.8Å; T146-Q149 PolarHBondContact O-N 2.98Å; Q149-R151 VanDerWaalsContact C-N 3.29Å; Q149-R151 PolarHBondContact O-N 3.48Å |
| 150 | S | 69.5 | Low | 81.9 | Confident | 102 Ų | 102 | 125.8 Ų | 125.8 | 71% | 0.713 | 59% | 0.586 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.2 | -11.4 | 179.4 | -57.1 | 0 | 0 | 0 | 0 | 113.5 | T146 T147 Y148 | T146-S150 WeakPolarHBondContact O-CB 3.32Å; T146-S150 PolarHBondContact O-N 3.26Å; T146-S150 PolarHBondContact O-OG 3.42Å; T147-S150 PolarHBondContact O-N 3.37Å; Y148-S150 VanDerWaalsContact C-N 3.31Å; Y148-S150 PolarHBondContact O-N 3.46Å |
| 151 | R | 69.5 | Low | 80.8 | Confident | 204 Ų | 204 | 128.6 Ų | 128.6 | 77% | 0.77 | 60% | 0.596 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.5 | 0.6 | 178.7 | -73.1 | 178.4 | -177.3 | -170 | 3.5 | 113.6 | T147 Y148 Q149 | T147-R151 WeakPolarHBondContact O-CG 3.39Å; T147-R151 PolarHBondContact O-N 2.95Å; Y148-R151 PolarHBondContact O-N 3.32Å; Q149-R151 VanDerWaalsContact C-N 3.29Å; Q149-R151 PolarHBondContact O-N 3.48Å |
| 152 | R | 53 | Low | 79.6 | Confident | 286 Ų | 286 | 132.3 Ų | 132.3 | 100% | 1.079 | 61% | 0.608 | S | S | * | * | trans | -109.2 | 0 | 178.4 | -163.1 | -178.8 | -171.4 | -176.6 | 2.8 | 110 |
Retrieved 152 of 152 residues in 51.5 ms
(Link to these results)