| 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 | 47.9 | Very low | 47.6 | Very low | 242 Ų | 242 | 140.5 Ų | 140.5 | 100% | 1.192 | 83% | 0.831 | S | S | * | * | 0 | 98 | 0 | -78.6 | 163.5 | 170.8 | 0 | 0 | 106 | |||||
| 2 | T | 44.3 | Very low | 48.7 | Very low | 145 Ų | 145 | 143.3 Ų | 143.3 | 89% | 0.89 | 83% | 0.829 | S | S | * | * | -142.4 | 121.2 | 95.4 | 35.3 | 0 | 0 | 0 | 0 | 111.5 | |||||
| 3 | K | 48.1 | Very low | 49.8 | Very low | 187 Ų | 187 | 139.2 Ų | 139.2 | 81% | 0.813 | 81% | 0.81 | S | S | * | * | trans | -97 | 115.5 | 171 | 172.5 | 178.2 | 178.4 | 166.2 | 0 | 106.1 | ||||
| 4 | L | 48.3 | Very low | 51.7 | Low | 169 Ų | 169 | 131.9 Ų | 131.9 | 89% | 0.885 | 77% | 0.77 | S | S | * | * | trans | -136.5 | 75 | 155.8 | -68.9 | 177.9 | 0 | 0 | 0 | 105 | ||||
| 5 | A | 45.6 | Very low | 53.6 | Low | 75 Ų | 75 | 128.7 Ų | 128.7 | 62% | 0.62 | 76% | 0.758 | S | S | * | * | 59.7 | 83.6 | 92.9 | 0 | 0 | 0 | 0 | 0 | 109.8 | S7 | A5-S7 PolarHBondContact O-N 3.42Å; A5-S7 VanDerWaalsContact O-N 3.14Å | |||
| 6 | A | 49.9 | Very low | 55.5 | Low | 101 Ų | 101 | 129.8 Ų | 129.8 | 84% | 0.835 | 75% | 0.746 | S | S | * | * | trans | -47.3 | 113 | 154.9 | 0 | 0 | 0 | 0 | 0 | 108.5 | E8 | A6-E8 VanDerWaalsContact C-N 3.33Å; A6-E8 PolarHBondContact O-N 3.14Å | ||
| 7 | S | 43.6 | Very low | 57.5 | Low | 111 Ų | 111 | 126.4 Ų | 126.4 | 78% | 0.776 | 72% | 0.724 | S | S | * | * | trans | -93.1 | 77.2 | 165.3 | -174.4 | 0 | 0 | 0 | 0 | 107.1 | A5 A9 | A5-S7 PolarHBondContact O-N 3.42Å; A5-S7 VanDerWaalsContact O-N 3.14Å; S7-A9 PolarHBondContact O-N 3.15Å | ||
| 8 | E | 49.9 | Very low | 59.2 | Low | 196 Ų | 196 | 125.1 Ų | 125.1 | 92% | 0.916 | 71% | 0.713 | S | S | * | * | trans | -67.5 | 104.2 | 152.7 | -114.9 | -172.2 | 130.4 | 0 | 0 | 106.5 | A6 | A6-E8 VanDerWaalsContact C-N 3.33Å; A6-E8 PolarHBondContact O-N 3.14Å | ||
| 9 | A | 43.5 | Very low | 60.8 | Low | 68 Ų | 68 | 126.6 Ų | 126.6 | 56% | 0.562 | 71% | 0.711 | S | S | * | * | trans | -120.9 | 94 | 164.2 | 0 | 0 | 0 | 0 | 0 | 106.3 | S7 E11 | S7-A9 PolarHBondContact O-N 3.15Å; A9-E11 PolarHBondContact O-N 3.23Å; A9-E11 VanDerWaalsContact O-N 3.15Å | ||
| 10 | G | 55.6 | Low | 62.4 | Low | 85 Ų | 85 | 125 Ų | 125 | 88% | 0.876 | 70% | 0.7 | S | S | * | * | trans | -69.3 | 100.6 | 166.2 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 11 | E | 47.3 | Very low | 63.8 | Low | 167 Ų | 167 | 123.2 Ų | 123.2 | 78% | 0.78 | 69% | 0.692 | S | S | * | * | trans | -135.5 | 134.6 | 166.7 | -99.9 | 167.1 | 125.7 | 0 | 0 | 107.6 | A9 | A9-E11 PolarHBondContact O-N 3.23Å; A9-E11 VanDerWaalsContact O-N 3.15Å | ||
| 12 | H | 60.4 | Low | 66 | Low | 174 Ų | 174 | 114.7 Ų | 114.7 | 81% | 0.806 | 65% | 0.653 | S | S | * | * | trans | -20.5 | 130.4 | 178 | -125.6 | -97.2 | 0 | 0 | 0 | 113.2 | P14 | H12-P14 WeakPolarHBondContact O-CA 2.95Å; H12-P14 WeakPolarHBondContact O-CD 3.48Å; H12-P14 WeakPolarHBondContact O-CG 3.42Å | ||
| 13 | P | 62.5 | Low | 68.4 | Low | 89 Ų | 89 | 113.2 Ų | 113.2 | 58% | 0.578 | 64% | 0.635 | S | S | * | * | trans | -49.5 | 108.7 | -178.2 | 21.5 | -32.3 | 0 | 0 | 0 | 107.4 | S15 | P13-S15 PolarHBondContact O-N 3.34Š| ||
| 14 | P | 76.4 | Confident | 70.6 | Confident | 38 Ų | 38 | 108.9 Ų | 108.9 | 25% | 0.247 | 62% | 0.62 | C | S | . | * | trans | -62.6 | 140.3 | -169.6 | -31.4 | 40 | 0 | 0 | 0 | 108.1 | H12 Y16 I17 | H12-P14 WeakPolarHBondContact O-CA 2.95Å; H12-P14 WeakPolarHBondContact O-CD 3.48Å; H12-P14 WeakPolarHBondContact O-CG 3.42Å; P14-Y16 HydrophobicContact CB-CD1 3.11Å; P14-Y16 HydrophobicContact CB-CD2 4.36Å; P14-Y16 HydrophobicContact CB-CE1 2.91Å; P14-Y16 HydrophobicContact CB-CE2 4.18Å; P14-Y16 HydrophobicContact CB-CG 3.84Å; P14-Y16 VanDerWaalsContact CB-CZ 3.47Å; P14-Y16 HydrophobicContact CG-CD1 4.09Å; P14-Y16 HydrophobicContact CG-CE1 3.37Å; P14-Y16 HydrophobicContact CG-CE2 4.47Å; P14-Y16 PolarHBondContact O-N 3.32Å; P14-I17 HydrophobicContact CB-CG1 4.47Å; P14-I17 HydrophobicContact CG-CD1 4.46Å; P14-I17 WeakPolarHBondContact O-CB 3.45Å; P14-I17 PolarHBondContact O-N 2.93Å | ||
| 15 | S | 79.9 | Confident | 72.9 | Confident | 84 Ų | 84 | 107.8 Ų | 107.8 | 59% | 0.587 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -51.4 | -27.4 | -177.7 | -50 | 0 | 0 | 0 | 0 | 112.1 | P13 I17 I18 F19 | P13-S15 PolarHBondContact O-N 3.34Å; S15-I17 VanDerWaalsContact C-N 3.34Å; S15-I17 PolarHBondContact O-N 3.4Å; S15-I18 PolarHBondContact O-N 3.26Å; S15-F19 WeakPolarHBondContact O-CD2 3.32Å; S15-F19 PolarHBondContact O-N 2.87Å |
| 16 | Y | 85 | Confident | 75.3 | Confident | 146 Ų | 146 | 110 Ų | 110 | 57% | 0.573 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -59.3 | -34.7 | 172.6 | 74.4 | -111.9 | 0 | 0 | 0 | 114.1 | P14 I18 F19 L20 | P14-Y16 HydrophobicContact CB-CD1 3.11Å; P14-Y16 HydrophobicContact CB-CD2 4.36Å; P14-Y16 HydrophobicContact CB-CE1 2.91Å; P14-Y16 HydrophobicContact CB-CE2 4.18Å; P14-Y16 HydrophobicContact CB-CG 3.84Å; P14-Y16 VanDerWaalsContact CB-CZ 3.47Å; P14-Y16 HydrophobicContact CG-CD1 4.09Å; P14-Y16 HydrophobicContact CG-CE1 3.37Å; P14-Y16 HydrophobicContact CG-CE2 4.47Å; P14-Y16 PolarHBondContact O-N 3.32Å; Y16-I18 VanDerWaalsContact C-N 3.31Å; Y16-I18 PolarHBondContact O-N 3.2Å; Y16-F19 PolarHBondContact O-N 2.87Å; Y16-L20 HydrophobicContact CD2-CD1 4.04Å; Y16-L20 VanDerWaalsContact O-CG 3.26Å; Y16-L20 WeakPolarHBondContact O-CG 3.26Å; Y16-L20 PolarHBondContact O-N 3.22Å |
| 17 | I | 88.5 | Confident | 77.5 | Confident | 72 Ų | 72 | 109.2 Ų | 109.2 | 37% | 0.369 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -63.8 | -40.9 | 177.6 | -61.4 | -170.9 | 0 | 0 | 0 | 110 | P14 S15 L20 V21 | P14-I17 HydrophobicContact CB-CG1 4.47Å; P14-I17 HydrophobicContact CG-CD1 4.46Å; P14-I17 WeakPolarHBondContact O-CB 3.45Å; P14-I17 PolarHBondContact O-N 2.93Å; S15-I17 VanDerWaalsContact C-N 3.34Å; S15-I17 PolarHBondContact O-N 3.4Å; I17-L20 PolarHBondContact O-N 3.46Å; I17-V21 HydrophobicContact CG2-CG2 4.26Å; I17-V21 VanDerWaalsContact O-CG2 3.32Å; I17-V21 WeakPolarHBondContact O-CG2 3.45Å; I17-V21 PolarHBondContact O-N 3.33Å |
| 18 | I | 89 | Confident | 79.9 | Confident | 103 Ų | 103 | 108.1 Ų | 108.1 | 53% | 0.528 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -64.6 | -45.2 | 178.5 | -55.4 | 170.3 | 0 | 0 | 0 | 109.6 | S15 Y16 L20 V21 V22 | S15-I18 PolarHBondContact O-N 3.26Å; Y16-I18 VanDerWaalsContact C-N 3.31Å; Y16-I18 PolarHBondContact O-N 3.2Å; I18-L20 VanDerWaalsContact C-N 3.3Å; I18-L20 PolarHBondContact O-N 3.41Å; I18-V21 PolarHBondContact O-N 3.5Å; I18-V22 HydrophobicContact CG2-CG2 4.41Å; I18-V22 WeakPolarHBondContact O-CB 3.26Å; I18-V22 VanDerWaalsContact O-CG2 3.26Å; I18-V22 WeakPolarHBondContact O-CG2 3.38Å; I18-V22 PolarHBondContact O-N 2.75Å |
| 19 | F | 90.1 | Very high | 82 | Confident | 153 Ų | 153 | 100.8 Ų | 100.8 | 67% | 0.671 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -59.1 | -40.6 | 173.5 | -72.3 | -67.2 | 0 | 0 | 0 | 112.3 | S15 Y16 F23 | S15-F19 WeakPolarHBondContact O-CD2 3.32Å; S15-F19 PolarHBondContact O-N 2.87Å; Y16-F19 PolarHBondContact O-N 2.87Å; F19-F23 WeakPolarHBondContact O-CB 3.05Å; F19-F23 PolarHBondContact O-N 2.85Å |
| 20 | L | 91.2 | Very high | 84.5 | Confident | 94 Ų | 94 | 103.1 Ų | 103.1 | 49% | 0.492 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -66.4 | -44.6 | 176.4 | -71 | 174.5 | 0 | 0 | 0 | 112.1 | Y16 I17 I18 V22 F23 L24 | Y16-L20 HydrophobicContact CD2-CD1 4.04Å; Y16-L20 VanDerWaalsContact O-CG 3.26Å; Y16-L20 WeakPolarHBondContact O-CG 3.26Å; Y16-L20 PolarHBondContact O-N 3.22Å; I17-L20 PolarHBondContact O-N 3.46Å; I18-L20 VanDerWaalsContact C-N 3.3Å; I18-L20 PolarHBondContact O-N 3.41Å; L20-V22 PolarHBondContact O-N 3.31Å; L20-F23 PolarHBondContact O-N 2.83Å; L20-L24 VanDerWaalsContact O-CB 3.32Å; L20-L24 WeakPolarHBondContact O-CB 3.17Å; L20-L24 WeakPolarHBondContact O-CG 3.32Å; L20-L24 PolarHBondContact O-N 2.8Å |
| 21 | V | 92.4 | Very high | 86.4 | Confident | 88 Ų | 88 | 103.5 Ų | 103.5 | 53% | 0.533 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -63 | -44.5 | 178.1 | 171.1 | 0 | 0 | 0 | 0 | 110.7 | I17 I18 L24 F25 | I17-V21 HydrophobicContact CG2-CG2 4.26Å; I17-V21 VanDerWaalsContact O-CG2 3.32Å; I17-V21 WeakPolarHBondContact O-CG2 3.45Å; I17-V21 PolarHBondContact O-N 3.33Å; I18-V21 PolarHBondContact O-N 3.5Å; V21-L24 PolarHBondContact O-N 2.91Å; V21-F25 VanDerWaalsContact O-CB 3.31Å; V21-F25 WeakPolarHBondContact O-CB 3.03Å; V21-F25 PolarHBondContact O-N 3.43Å |
| 22 | V | 94.3 | Very high | 88.5 | Confident | 63 Ų | 63 | 97 Ų | 97 | 38% | 0.382 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.7 | -43.4 | 176.8 | 169.9 | 0 | 0 | 0 | 0 | 110.8 | I18 L20 F25 F26 | I18-V22 HydrophobicContact CG2-CG2 4.41Å; I18-V22 WeakPolarHBondContact O-CB 3.26Å; I18-V22 VanDerWaalsContact O-CG2 3.26Å; I18-V22 WeakPolarHBondContact O-CG2 3.38Å; I18-V22 PolarHBondContact O-N 2.75Å; L20-V22 PolarHBondContact O-N 3.31Å; V22-F25 WeakPolarHBondContact O-CB 3.14Å; V22-F25 PolarHBondContact O-N 2.88Å; V22-F26 HydrophobicContact CG1-CD2 3.62Å; V22-F26 HydrophobicContact CG1-CE2 3.17Å; V22-F26 HydrophobicContact CG1-CZ 4.08Å; V22-F26 WeakPolarHBondContact O-CD2 3.46Å; V22-F26 WeakPolarHBondContact O-CG 3.31Å; V22-F26 PolarHBondContact O-N 2.87Å |
| 23 | F | 95.1 | Very high | 90.1 | Very high | 114 Ų | 114 | 95.3 Ų | 95.3 | 50% | 0.5 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61.7 | -45.4 | 175.4 | 178.5 | -106.4 | 0 | 0 | 0 | 112 | F19 L20 F25 F26 L27 | F19-F23 WeakPolarHBondContact O-CB 3.05Å; F19-F23 PolarHBondContact O-N 2.85Å; L20-F23 PolarHBondContact O-N 2.83Å; F23-F25 VanDerWaalsContact C-N 3.32Å; F23-F25 PolarHBondContact O-N 3.4Å; F23-F26 PolarHBondContact O-N 2.81Å; F23-L27 HydrophobicContact CD1-CD1 3.81Å; F23-L27 HydrophobicContact CD1-CG 4.26Å; F23-L27 HydrophobicContact CE1-CD1 3.25Å; F23-L27 HydrophobicContact CE1-CG 3.93Å; F23-L27 HydrophobicContact CE2-CD1 4.42Å; F23-L27 HydrophobicContact CE2-CD2 4.32Å; F23-L27 HydrophobicContact CE2-CG 4.28Å; F23-L27 HydrophobicContact CZ-CD1 3.61Å; F23-L27 HydrophobicContact CZ-CD2 4.05Å; F23-L27 HydrophobicContact CZ-CG 3.93Å; F23-L27 WeakPolarHBondContact O-CG 3.38Å; F23-L27 PolarHBondContact O-N 2.71Å |
| 24 | L | 94.4 | Very high | 91.5 | Very high | 97 Ų | 97 | 95.5 Ų | 95.5 | 51% | 0.508 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.7 | -38.1 | 174.9 | -70.2 | 172.2 | 0 | 0 | 0 | 111.4 | L20 V21 F26 L27 T28 | L20-L24 VanDerWaalsContact O-CB 3.32Å; L20-L24 WeakPolarHBondContact O-CB 3.17Å; L20-L24 WeakPolarHBondContact O-CG 3.32Å; L20-L24 PolarHBondContact O-N 2.8Å; V21-L24 PolarHBondContact O-N 2.91Å; L24-F26 VanDerWaalsContact C-N 3.34Å; L24-L27 PolarHBondContact O-N 2.96Å; L24-T28 WeakPolarHBondContact O-CB 3.25Å; L24-T28 VanDerWaalsContact O-CG2 3.25Å; L24-T28 WeakPolarHBondContact O-CG2 3.32Å; L24-T28 PolarHBondContact O-N 3.14Å; L24-T28 PolarHBondContact O-OG1 2.81Å |
| 25 | F | 95.9 | Very high | 92.2 | Very high | 145 Ų | 145 | 97.5 Ų | 97.5 | 64% | 0.636 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -62.8 | -41.1 | 173.7 | -174.6 | -99.4 | 0 | 0 | 0 | 111.6 | V21 V22 F23 T28 G29 | V21-F25 VanDerWaalsContact O-CB 3.31Å; V21-F25 WeakPolarHBondContact O-CB 3.03Å; V21-F25 PolarHBondContact O-N 3.43Å; V22-F25 WeakPolarHBondContact O-CB 3.14Å; V22-F25 PolarHBondContact O-N 2.88Å; F23-F25 VanDerWaalsContact C-N 3.32Å; F23-F25 PolarHBondContact O-N 3.4Å; F25-T28 WeakPolarHBondContact CA-OG1 3.48Å; F25-T28 PolarHBondContact O-OG1 3.25Å; F25-T28 VanDerWaalsContact O-OG1 3.14Å; F25-G29 WeakPolarHBondContact O-CA 3.36Å; F25-G29 PolarHBondContact O-N 2.81Å |
| 26 | F | 96.2 | Very high | 92.5 | Very high | 123 Ų | 123 | 96.2 Ų | 96.2 | 54% | 0.539 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -66 | -45 | 173.5 | -72.4 | -56.5 | 0 | 0 | 0 | 112.4 | V22 F23 L24 G29 L30 | V22-F26 HydrophobicContact CG1-CD2 3.62Å; V22-F26 HydrophobicContact CG1-CE2 3.17Å; V22-F26 HydrophobicContact CG1-CZ 4.08Å; V22-F26 WeakPolarHBondContact O-CD2 3.46Å; V22-F26 WeakPolarHBondContact O-CG 3.31Å; V22-F26 PolarHBondContact O-N 2.87Å; F23-F26 PolarHBondContact O-N 2.81Å; L24-F26 VanDerWaalsContact C-N 3.34Å; F26-G29 PolarHBondContact O-N 3.47Å; F26-L30 VanDerWaalsContact O-CB 3.31Å; F26-L30 WeakPolarHBondContact O-CB 3.45Å; F26-L30 VanDerWaalsContact O-CG 3.23Å; F26-L30 WeakPolarHBondContact O-CG 3.41Å; F26-L30 PolarHBondContact O-N 3.35Å |
| 27 | L | 95.7 | Very high | 92.7 | Very high | 84 Ų | 84 | 94.1 Ų | 94.1 | 44% | 0.44 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.8 | -47.1 | 177.3 | -71.4 | -176.6 | 0 | 0 | 0 | 111.7 | F23 L24 L31 | F23-L27 HydrophobicContact CD1-CD1 3.81Å; F23-L27 HydrophobicContact CD1-CG 4.26Å; F23-L27 HydrophobicContact CE1-CD1 3.25Å; F23-L27 HydrophobicContact CE1-CG 3.93Å; F23-L27 HydrophobicContact CE2-CD1 4.42Å; F23-L27 HydrophobicContact CE2-CD2 4.32Å; F23-L27 HydrophobicContact CE2-CG 4.28Å; F23-L27 HydrophobicContact CZ-CD1 3.61Å; F23-L27 HydrophobicContact CZ-CD2 4.05Å; F23-L27 HydrophobicContact CZ-CG 3.93Å; F23-L27 WeakPolarHBondContact O-CG 3.38Å; F23-L27 PolarHBondContact O-N 2.71Å; L24-L27 PolarHBondContact O-N 2.96Å; L27-L31 WeakPolarHBondContact O-CB 3.13Å; L27-L31 PolarHBondContact O-N 3.4Å |
| 28 | T | 93.9 | Very high | 92.7 | Very high | 88 Ų | 88 | 95.1 Ų | 95.1 | 54% | 0.54 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -67.7 | -36.9 | 178 | 53.3 | 0 | 0 | 0 | 0 | 112 | L24 F25 G32 | L24-T28 WeakPolarHBondContact O-CB 3.25Å; L24-T28 VanDerWaalsContact O-CG2 3.25Å; L24-T28 WeakPolarHBondContact O-CG2 3.32Å; L24-T28 PolarHBondContact O-N 3.14Å; L24-T28 PolarHBondContact O-OG1 2.81Å; F25-T28 WeakPolarHBondContact CA-OG1 3.48Å; F25-T28 PolarHBondContact O-OG1 3.25Å; F25-T28 VanDerWaalsContact O-OG1 3.14Å; T28-G32 PolarHBondContact O-N 3.05Å |
| 29 | G | 95.1 | Very high | 92.6 | Very high | 41 Ų | 41 | 93.2 Ų | 93.2 | 42% | 0.423 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -67.5 | -44.4 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | F25 F26 G32 F33 | F25-G29 WeakPolarHBondContact O-CA 3.36Å; F25-G29 PolarHBondContact O-N 2.81Å; F26-G29 PolarHBondContact O-N 3.47Å; G29-G32 PolarHBondContact O-N 2.95Å; G29-F33 PolarHBondContact O-N 2.82Å |
| 30 | L | 95.6 | Very high | 92.3 | Very high | 117 Ų | 117 | 93.7 Ų | 93.7 | 61% | 0.613 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -68.6 | -36.9 | 175.1 | -69.3 | 176.6 | 0 | 0 | 0 | 111.7 | F26 G32 F33 L34 | F26-L30 VanDerWaalsContact O-CB 3.31Å; F26-L30 WeakPolarHBondContact O-CB 3.45Å; F26-L30 VanDerWaalsContact O-CG 3.23Å; F26-L30 WeakPolarHBondContact O-CG 3.41Å; F26-L30 PolarHBondContact O-N 3.35Å; L30-G32 VanDerWaalsContact C-N 3.34Å; L30-F33 PolarHBondContact O-N 3.27Å; L30-L34 VanDerWaalsContact O-CB 3.25Å; L30-L34 WeakPolarHBondContact O-CB 3.43Å; L30-L34 PolarHBondContact O-N 3.2Å |
| 31 | L | 94.7 | Very high | 91.9 | Very high | 94 Ų | 94 | 97.5 Ų | 97.5 | 49% | 0.492 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.5 | -43.6 | 172.2 | -178.7 | 62.7 | 0 | 0 | 0 | 110.7 | L27 L34 I35 | L27-L31 WeakPolarHBondContact O-CB 3.13Å; L27-L31 PolarHBondContact O-N 3.4Å; L31-L34 PolarHBondContact O-N 2.84Å; L31-I35 HydrophobicContact CD1-CD1 4.06Å; L31-I35 HydrophobicContact CD1-CG1 4.3Å; L31-I35 HydrophobicContact CG-CD1 3.82Å; L31-I35 HydrophobicContact CG-CG1 4.48Å; L31-I35 WeakPolarHBondContact O-CB 3.27Å; L31-I35 WeakPolarHBondContact O-CD1 3.34Å; L31-I35 WeakPolarHBondContact O-CG1 3.35Å; L31-I35 PolarHBondContact O-N 3.21Å |
| 32 | G | 93.1 | Very high | 91.3 | Very high | 31 Ų | 31 | 101.2 Ų | 101.2 | 32% | 0.32 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -58 | -49 | 173 | 0 | 0 | 0 | 0 | 0 | 111.8 | T28 G29 L30 L34 I35 C36 | T28-G32 PolarHBondContact O-N 3.05Å; G29-G32 PolarHBondContact O-N 2.95Å; L30-G32 VanDerWaalsContact C-N 3.34Å; G32-L34 PolarHBondContact O-N 2.81Å; G32-I35 PolarHBondContact O-N 2.97Å; G32-C36 WeakPolarHBondContact O-CB 3.38Å; G32-C36 PolarHBondContact O-N 3Å; G32-C36 PolarHBondContact O-SG 3.43Å |
| 33 | F | 92.6 | Very high | 90.3 | Very high | 137 Ų | 137 | 101.2 Ų | 101.2 | 60% | 0.601 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -60.9 | -42.1 | 175.7 | 179.2 | -98.1 | 0 | 0 | 0 | 112.8 | G29 L30 C36 H37 | G29-F33 PolarHBondContact O-N 2.82Å; L30-F33 PolarHBondContact O-N 3.27Å; F33-C36 PolarHBondContact O-N 2.85Å; F33-H37 WeakPolarHBondContact O-CB 3.21Å; F33-H37 PolarHBondContact O-N 2.85Å |
| 34 | L | 91.6 | Very high | 89.3 | Confident | 93 Ų | 93 | 102.9 Ų | 102.9 | 49% | 0.487 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -63.6 | -45.1 | 178.4 | -179.2 | 62.1 | 0 | 0 | 0 | 111 | L30 L31 G32 H37 L38 | L30-L34 VanDerWaalsContact O-CB 3.25Å; L30-L34 WeakPolarHBondContact O-CB 3.43Å; L30-L34 PolarHBondContact O-N 3.2Å; L31-L34 PolarHBondContact O-N 2.84Å; G32-L34 PolarHBondContact O-N 2.81Å; L34-H37 PolarHBondContact O-N 3.32Å; L34-L38 HydrophobicContact CD1-CD1 4.31Å; L34-L38 HydrophobicContact CD1-CG 4.42Å; L34-L38 HydrophobicContact CG-CD1 4.08Å; L34-L38 WeakPolarHBondContact O-CB 3.23Å; L34-L38 VanDerWaalsContact O-CG 3.23Å; L34-L38 WeakPolarHBondContact O-CG 3.31Å; L34-L38 PolarHBondContact O-N 3.14Å |
| 35 | I | 91.1 | Very high | 88.1 | Confident | 81 Ų | 81 | 105.9 Ų | 105.9 | 42% | 0.415 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -60.8 | -48.8 | 174.3 | -67.1 | 164.1 | 0 | 0 | 0 | 109.4 | L31 G32 H37 L38 L39 | L31-I35 HydrophobicContact CD1-CD1 4.06Å; L31-I35 HydrophobicContact CD1-CG1 4.3Å; L31-I35 HydrophobicContact CG-CD1 3.82Å; L31-I35 HydrophobicContact CG-CG1 4.48Å; L31-I35 WeakPolarHBondContact O-CB 3.27Å; L31-I35 WeakPolarHBondContact O-CD1 3.34Å; L31-I35 WeakPolarHBondContact O-CG1 3.35Å; L31-I35 PolarHBondContact O-N 3.21Å; G32-I35 PolarHBondContact O-N 2.97Å; I35-H37 VanDerWaalsContact C-N 3.29Å; I35-H37 PolarHBondContact O-N 2.85Å; I35-L38 PolarHBondContact O-N 3.36Å; I35-L39 HydrophobicContact CG2-CD1 3.71Å; I35-L39 HydrophobicContact CG2-CG 4.14Å; I35-L39 VanDerWaalsContact O-CB 3.31Å; I35-L39 WeakPolarHBondContact O-CB 3.47Å; I35-L39 WeakPolarHBondContact O-CG 3.19Å; I35-L39 PolarHBondContact O-N 2.91Å |
| 36 | C | 87.4 | Confident | 86.5 | Confident | 56 Ų | 56 | 102.2 Ų | 102.2 | 38% | 0.378 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -57.1 | -40.2 | 176.4 | -69 | 0 | 0 | 0 | 0 | 112.6 | G32 F33 K40 | G32-C36 WeakPolarHBondContact O-CB 3.38Å; G32-C36 PolarHBondContact O-N 3Å; G32-C36 PolarHBondContact O-SG 3.43Å; F33-C36 PolarHBondContact O-N 2.85Å; C36-K40 WeakPolarHBondContact O-CB 3.31Å; C36-K40 PolarHBondContact O-N 3.34Å |
| 37 | H | 88.9 | Confident | 84.8 | Confident | 102 Ų | 102 | 105.8 Ų | 105.8 | 47% | 0.472 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -72.6 | -36.9 | 179.6 | -170.7 | -86.1 | 0 | 0 | 0 | 112.4 | F33 L34 I35 K41 | F33-H37 WeakPolarHBondContact O-CB 3.21Å; F33-H37 PolarHBondContact O-N 2.85Å; L34-H37 PolarHBondContact O-N 3.32Å; I35-H37 VanDerWaalsContact C-N 3.29Å; I35-H37 PolarHBondContact O-N 2.85Å; H37-K41 WeakPolarHBondContact O-CB 3.43Å; H37-K41 PolarHBondContact O-N 2.84Å |
| 38 | L | 89.1 | Confident | 82.5 | Confident | 94 Ų | 94 | 108.5 Ų | 108.5 | 49% | 0.492 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -67.9 | -41.1 | 174.5 | -71.5 | 169.3 | 0 | 0 | 0 | 111.5 | L34 I35 K41 K42 | L34-L38 HydrophobicContact CD1-CD1 4.31Å; L34-L38 HydrophobicContact CD1-CG 4.42Å; L34-L38 HydrophobicContact CG-CD1 4.08Å; L34-L38 WeakPolarHBondContact O-CB 3.23Å; L34-L38 VanDerWaalsContact O-CG 3.23Å; L34-L38 WeakPolarHBondContact O-CG 3.31Å; L34-L38 PolarHBondContact O-N 3.14Å; I35-L38 PolarHBondContact O-N 3.36Å; L38-K41 PolarHBondContact O-N 2.94Å; L38-K42 WeakPolarHBondContact O-CB 3.2Å; L38-K42 PolarHBondContact O-N 3.28Å |
| 39 | L | 86.9 | Confident | 80.3 | Confident | 63 Ų | 63 | 107.4 Ų | 107.4 | 33% | 0.33 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -61.9 | -48.9 | 173.3 | -72.6 | 177.9 | 0 | 0 | 0 | 110.1 | I35 K41 K42 G43 Y44 | I35-L39 HydrophobicContact CG2-CD1 3.71Å; I35-L39 HydrophobicContact CG2-CG 4.14Å; I35-L39 VanDerWaalsContact O-CB 3.31Å; I35-L39 WeakPolarHBondContact O-CB 3.47Å; I35-L39 WeakPolarHBondContact O-CG 3.19Å; I35-L39 PolarHBondContact O-N 2.91Å; L39-K41 VanDerWaalsContact C-N 3.33Å; L39-K41 PolarHBondContact O-N 3.13Å; L39-K42 CarbonylContact O-C 3.58Å; L39-K42 PolarHBondContact O-N 2.85Å; L39-G43 PolarHBondContact O-N 2.96Å; L39-G43 VanDerWaalsContact O-N 3.13Å; L39-Y44 CarbonylContact C-O 3.31Å; L39-Y44 VanDerWaalsContact C-O 3.31Å; L39-Y44 HydrophobicContact CD2-CD2 3.95Å; L39-Y44 HydrophobicContact CD2-CG 3.89Å; L39-Y44 WeakPolarHBondContact O-CA 3.43Å; L39-Y44 WeakPolarHBondContact O-CB 3.23Å; L39-Y44 PolarHBondContact O-N 3.1Å |
| 40 | K | 83.7 | Confident | 78 | Confident | 162 Ų | 162 | 108.8 Ų | 108.8 | 70% | 0.704 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -57.6 | -42.1 | 174.9 | -178.5 | 175.7 | 172.7 | 171.4 | 0 | 112.8 | C36 K42 G43 Y44 | C36-K40 WeakPolarHBondContact O-CB 3.31Å; C36-K40 PolarHBondContact O-N 3.34Å; K40-K42 VanDerWaalsContact C-N 3.27Å; K40-K42 PolarHBondContact O-N 2.95Å; K40-G43 PolarHBondContact O-N 3.32Å; K40-Y44 PolarHBondContact N-O 3.32Å |
| 41 | K | 81.3 | Confident | 75.8 | Confident | 175 Ų | 175 | 111 Ų | 111 | 76% | 0.761 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -70.4 | -23.9 | 178.5 | -170.5 | 175 | 178 | 179.8 | 0 | 112.9 | H37 L38 L39 | H37-K41 WeakPolarHBondContact O-CB 3.43Å; H37-K41 PolarHBondContact O-N 2.84Å; L38-K41 PolarHBondContact O-N 2.94Å; L39-K41 VanDerWaalsContact C-N 3.33Å; L39-K41 PolarHBondContact O-N 3.13Å |
| 42 | K | 80.4 | Confident | 73.2 | Confident | 166 Ų | 166 | 114.8 Ų | 114.8 | 72% | 0.722 | 59% | 0.592 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.9 | 3.6 | 175.8 | -83.5 | 179.9 | 165.5 | 178.8 | 0 | 113.6 | L38 L39 K40 Y44 | L38-K42 WeakPolarHBondContact O-CB 3.2Å; L38-K42 PolarHBondContact O-N 3.28Å; L39-K42 CarbonylContact O-C 3.58Å; L39-K42 PolarHBondContact O-N 2.85Å; K40-K42 VanDerWaalsContact C-N 3.27Å; K40-K42 PolarHBondContact O-N 2.95Å; K42-Y44 HydrophobicContact CB-CD2 3.58Å; K42-Y44 HydrophobicContact CB-CE2 3.71Å; K42-Y44 HydrophobicContact CD-CE2 4.35Å |
| 43 | G | 74.4 | Confident | 70.8 | Confident | 62 Ų | 62 | 119.7 Ų | 119.7 | 64% | 0.639 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 87.7 | 1.1 | -179.3 | 0 | 0 | 0 | 0 | 0 | 114.9 | L39 K40 H45 | L39-G43 PolarHBondContact O-N 2.96Å; L39-G43 VanDerWaalsContact O-N 3.13Å; K40-G43 PolarHBondContact O-N 3.32Å; G43-H45 PolarHBondContact O-N 3.3Å |
| 44 | Y | 73.8 | Confident | 68.4 | Low | 150 Ų | 150 | 121.5 Ų | 121.5 | 59% | 0.588 | 62% | 0.621 | S | S | * | * | trans | -79.1 | 108.2 | 175.2 | -61.7 | -89.2 | 0 | 0 | 0 | 109.8 | L39 K40 K42 | L39-Y44 CarbonylContact C-O 3.31Å; L39-Y44 VanDerWaalsContact C-O 3.31Å; L39-Y44 HydrophobicContact CD2-CD2 3.95Å; L39-Y44 HydrophobicContact CD2-CG 3.89Å; L39-Y44 WeakPolarHBondContact O-CA 3.43Å; L39-Y44 WeakPolarHBondContact O-CB 3.23Å; L39-Y44 PolarHBondContact O-N 3.1Å; K40-Y44 PolarHBondContact N-O 3.32Å; K42-Y44 HydrophobicContact CB-CD2 3.58Å; K42-Y44 HydrophobicContact CB-CE2 3.71Å; K42-Y44 HydrophobicContact CD-CE2 4.35Å | ||
| 45 | H | 69.1 | Low | 65.9 | Low | 160 Ų | 160 | 126.4 Ų | 126.4 | 74% | 0.741 | 64% | 0.639 | S | S | * | * | trans | -73.5 | 127.5 | 170.9 | -107.1 | -97.9 | 0 | 0 | 0 | 109.9 | G43 R47 | G43-H45 PolarHBondContact O-N 3.3Å; H45-R47 VanDerWaalsContact C-N 3.28Å; H45-R47 PolarHBondContact O-N 3.23Å | ||
| 46 | C | 63 | Low | 63.2 | Low | 68 Ų | 68 | 132 Ų | 132 | 46% | 0.459 | 66% | 0.663 | S | S | . | * | trans | -69.6 | 85.1 | 174.1 | -62.5 | 0 | 0 | 0 | 0 | 109.5 | T48 | C46-T48 PolarHBondContact O-N 3.41Š| ||
| 47 | R | 59.8 | Low | 61.2 | Low | 197 Ų | 197 | 138.3 Ų | 138.3 | 74% | 0.743 | 68% | 0.684 | S | S | * | * | trans | -78.5 | 72.4 | 172.1 | -164.6 | 176.8 | 174.7 | 97.4 | -1.5 | 108.5 | H45 G49 D50 | H45-R47 VanDerWaalsContact C-N 3.28Å; H45-R47 PolarHBondContact O-N 3.23Å; R47-G49 PolarHBondContact O-N 3.01Å; R47-D50 HydrophobicContact CG-CB 4.25Å; R47-D50 IonicContact CZ-OD2 3.81Å; R47-D50 IonicContact NE-OD2 2.97Å; R47-D50 PolarHBondContact NE-OD2 3.37Å; R47-D50 IonicContact NH2-OD2 3.82Å | ||
| 48 | T | 48 | Very low | 58.8 | Low | 142 Ų | 142 | 141.1 Ų | 141.1 | 87% | 0.871 | 70% | 0.702 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.5 | 83.8 | 172.5 | -60 | 0 | 0 | 0 | 0 | 108.3 | C46 | C46-T48 PolarHBondContact O-N 3.41Š|
| 49 | G | 47.9 | Very low | 56.1 | Low | 65 Ų | 65 | 139.9 Ų | 139.9 | 67% | 0.67 | 71% | 0.712 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 169.5 | 1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 116.2 | R47 | R47-G49 PolarHBondContact O-N 3.01Š|
| 50 | D | 45.8 | Very low | 54 | Low | 69 Ų | 69 | 145.7 Ų | 145.7 | 37% | 0.369 | 74% | 0.737 | S | S | . | * | trans | -115.3 | 48.8 | -173.4 | -146.9 | -8.5 | 0 | 0 | 0 | 112.7 | R47 E52 | R47-D50 HydrophobicContact CG-CB 4.25Å; R47-D50 IonicContact CZ-OD2 3.81Å; R47-D50 IonicContact NE-OD2 2.97Å; R47-D50 PolarHBondContact NE-OD2 3.37Å; R47-D50 IonicContact NH2-OD2 3.82Å; D50-E52 VanDerWaalsContact C-N 3.28Å | ||
| 51 | L | 48.7 | Very low | 51.8 | Low | 165 Ų | 165 | 145.5 Ų | 145.5 | 86% | 0.864 | 74% | 0.744 | S | S | * | * | S | Bend | trans | -95.8 | 17.2 | 165.7 | -67.9 | 177.3 | 0 | 0 | 0 | 111.1 | ||
| 52 | E | 41.6 | Very low | 50.2 | Low | 173 Ų | 173 | 146.1 Ų | 146.1 | 81% | 0.808 | 75% | 0.749 | S | S | * | * | S | Bend | trans | -102.8 | -21.9 | -179.5 | -57.3 | -164.9 | -177.3 | 0 | 0 | 113.1 | D50 E54 | D50-E52 VanDerWaalsContact C-N 3.28Å; E52-E54 PolarHBondContact O-N 2.97Å |
| 53 | D | 41.5 | Very low | 48.4 | Very low | 134 Ų | 134 | 146 Ų | 146 | 72% | 0.717 | 76% | 0.757 | S | S | * | * | trans | -102.9 | 43.9 | -176.1 | -70.6 | -28.4 | 0 | 0 | 0 | 113.9 | K55 | D53-K55 PolarHBondContact O-N 2.96Š| ||
| 54 | E | 42.4 | Very low | 46.8 | Very low | 174 Ų | 174 | 149.8 Ų | 149.8 | 81% | 0.813 | 76% | 0.762 | S | S | * | * | trans | -75.5 | 54.7 | 159.8 | -72.1 | -80.4 | 148.8 | 0 | 0 | 110 | E52 | E52-E54 PolarHBondContact O-N 2.97Š| ||
| 55 | K | 39.5 | Very low | 45.7 | Very low | 196 Ų | 196 | 151.8 Ų | 151.8 | 85% | 0.852 | 78% | 0.777 | S | S | * | * | trans | -168.5 | 45.2 | 172.7 | -121.2 | 178.3 | -164.7 | -169.2 | 0 | 119.1 | D53 | D53-K55 PolarHBondContact O-N 2.96Š| ||
| 56 | E | 34.1 | Very low | 44.6 | Very low | 200 Ų | 200 | 150 Ų | 150 | 94% | 0.935 | 77% | 0.773 | S | S | * | * | trans | -146.2 | 118.2 | 152 | -142.6 | 159.8 | -173.3 | 0 | 0 | 114.2 | ||||
| 57 | K | 45 | Very low | 44 | Very low | 187 Ų | 187 | 151.2 Ų | 151.2 | 81% | 0.813 | 78% | 0.775 | S | S | * | * | trans | -104.2 | 113.4 | -178.1 | 167.6 | -174.9 | -177.2 | -72.3 | 0 | 107.1 | ||||
| 58 | L | 39.3 | Very low | 43.8 | Very low | 162 Ų | 162 | 151.6 Ų | 151.6 | 85% | 0.848 | 79% | 0.785 | S | S | * | * | trans | 179.6 | 110.6 | 147.6 | -129.5 | 64.6 | 0 | 0 | 0 | 107.9 | ||||
| 59 | G | 32.9 | Very low | 44.3 | Very low | 68 Ų | 68 | 150.1 Ų | 150.1 | 70% | 0.701 | 77% | 0.772 | S | S | * | * | 109.1 | 94.8 | 89.8 | 0 | 0 | 0 | 0 | 0 | 107.5 | |||||
| 60 | E | 42.9 | Very low | 44.8 | Very low | 185 Ų | 185 | 149 Ų | 149 | 86% | 0.864 | 75% | 0.749 | S | S | * | * | 62 | 97.9 | 101.5 | -161.9 | 173.3 | -172.5 | 0 | 0 | 112.5 | |||||
| 61 | D | 36.5 | Very low | 46.1 | Very low | 157 Ų | 157 | 150.3 Ų | 150.3 | 84% | 0.84 | 76% | 0.756 | S | S | * | * | -165.4 | 132.7 | 114.8 | -99.8 | -32.7 | 0 | 0 | 0 | 110.2 | |||||
| 62 | E | 48.4 | Very low | 47.7 | Very low | 188 Ų | 188 | 147.2 Ų | 147.2 | 88% | 0.879 | 74% | 0.744 | S | S | * | * | trans | -77 | 120.7 | 176.3 | -58.3 | -179.7 | 147.2 | 0 | 0 | 109.4 | ||||
| 63 | D | 42 | Very low | 49.7 | Very low | 165 Ų | 165 | 143 Ų | 143 | 88% | 0.882 | 73% | 0.73 | S | S | * | * | -171.7 | 138 | 127.8 | -123.8 | -20.8 | 0 | 0 | 0 | 112.3 | |||||
| 64 | D | 41.4 | Very low | 51.6 | Low | 141 Ų | 141 | 141.3 Ų | 141.3 | 75% | 0.754 | 72% | 0.718 | S | S | * | * | trans | 72 | 103.2 | 161.8 | -132.8 | 2.8 | 0 | 0 | 0 | 120.2 | N66 | D64-N66 PolarHBondContact O-N 3.03Š| ||
| 65 | E | 49.5 | Very low | 53.5 | Low | 191 Ų | 191 | 138.6 Ų | 138.6 | 89% | 0.893 | 71% | 0.706 | S | S | * | * | trans | -44.9 | 91.8 | 158.6 | -61 | 177.4 | 157.4 | 0 | 0 | 112.4 | ||||
| 66 | N | 46.9 | Very low | 55.7 | Low | 123 Ų | 123 | 133.8 Ų | 133.8 | 66% | 0.658 | 69% | 0.688 | S | S | * | * | trans | -149.2 | 84 | 156.9 | -161.6 | 41.5 | 0 | 0 | 0 | 112.6 | D64 | D64-N66 PolarHBondContact O-N 3.03Š| ||
| 67 | D | 49.5 | Very low | 58.4 | Low | 94 Ų | 94 | 128.6 Ų | 128.6 | 50% | 0.503 | 67% | 0.666 | S | S | . | * | trans | 58 | 67.7 | 137.2 | -144 | 6.7 | 0 | 0 | 0 | 115.1 | N69 Q70 | D67-N69 PolarHBondContact O-N 3.26Å; D67-Q70 PolarHBondContact O-N 3.32Å | ||
| 68 | E | 55.2 | Low | 60.4 | Low | 204 Ų | 204 | 123.7 Ų | 123.7 | 95% | 0.953 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.5 | 3.1 | 166 | -70.5 | 178.6 | 147.3 | 0 | 0 | 113.6 | ||
| 69 | N | 58.4 | Low | 62.4 | Low | 112 Ų | 112 | 120 Ų | 120 | 60% | 0.599 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.3 | 27.7 | 179.2 | -116.6 | 95.6 | 0 | 0 | 0 | 112.8 | D67 D71 | D67-N69 PolarHBondContact O-N 3.26Å; N69-D71 VanDerWaalsContact C-N 3.32Å; N69-D71 PolarHBondContact O-N 3.1Å |
| 70 | Q | 58.9 | Low | 65 | Low | 40 Ų | 40 | 120.2 Ų | 120.2 | 19% | 0.187 | 62% | 0.616 | C | S | . | * | trans | -51.6 | 104.9 | 155.7 | -74 | -111.2 | -30.8 | 0 | 0 | 107.3 | D67 T72 Q75 | D67-Q70 PolarHBondContact O-N 3.32Å; Q70-T72 PolarHBondContact O-N 3.44Å; Q70-Q75 HydrophobicContact CB-CB 4.35Å | ||
| 71 | D | 72.3 | Confident | 67.1 | Low | 98 Ų | 98 | 117 Ų | 117 | 52% | 0.524 | 60% | 0.602 | S | S | . | * | trans | -48.3 | 133.8 | 177.5 | -165.4 | -10.7 | 0 | 0 | 0 | 106.9 | N69 V73 E74 Q75 | N69-D71 VanDerWaalsContact C-N 3.32Å; N69-D71 PolarHBondContact O-N 3.1Å; D71-V73 CarbonylContact O-C 3.6Å; D71-V73 PolarHBondContact O-N 3.2Å; D71-E74 HydrophobicContact CB-CB 3.98Å; D71-E74 CarbonylContact O-C 3.49Å; D71-E74 WeakPolarHBondContact O-CA 3.25Å; D71-E74 WeakPolarHBondContact O-CB 3.48Å; D71-E74 PolarHBondContact O-N 3.26Å; D71-Q75 PolarHBondContact O-N 3.08Å | ||
| 72 | T | 82.1 | Confident | 69.5 | Low | 99 Ų | 99 | 115.4 Ų | 115.4 | 61% | 0.607 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -53.4 | -29.7 | -177.3 | -53.5 | 0 | 0 | 0 | 0 | 110.4 | Q70 I76 | Q70-T72 PolarHBondContact O-N 3.44Å; T72-I76 HydrophobicContact CG2-CD1 4Å; T72-I76 WeakPolarHBondContact O-CB 3.09Å; T72-I76 VanDerWaalsContact O-CD1 3.25Å; T72-I76 WeakPolarHBondContact O-CD1 3.46Å; T72-I76 WeakPolarHBondContact O-CG1 3.37Å; T72-I76 PolarHBondContact O-N 3.18Å |
| 73 | V | 85.2 | Confident | 71.3 | Confident | 85 Ų | 85 | 110 Ų | 110 | 52% | 0.515 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -65.9 | -47.3 | 170.9 | -178.2 | 0 | 0 | 0 | 0 | 112.7 | D71 I76 L77 | D71-V73 CarbonylContact O-C 3.6Å; D71-V73 PolarHBondContact O-N 3.2Å; V73-I76 PolarHBondContact O-N 2.85Å; V73-L77 HydrophobicContact CG1-CD1 3.94Å; V73-L77 HydrophobicContact CG1-CG 4.38Å; V73-L77 WeakPolarHBondContact O-CB 3.43Å; V73-L77 VanDerWaalsContact O-CG 3.22Å; V73-L77 WeakPolarHBondContact O-CG 3.29Å; V73-L77 PolarHBondContact O-N 3.32Å |
| 74 | E | 80.3 | Confident | 73.4 | Confident | 99 Ų | 99 | 109.8 Ų | 109.8 | 46% | 0.463 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -63.6 | -41.5 | 178.2 | -175.5 | 170.7 | -176.7 | 0 | 0 | 111.6 | D71 I76 L77 K78 | D71-E74 HydrophobicContact CB-CB 3.98Å; D71-E74 CarbonylContact O-C 3.49Å; D71-E74 WeakPolarHBondContact O-CA 3.25Å; D71-E74 WeakPolarHBondContact O-CB 3.48Å; D71-E74 PolarHBondContact O-N 3.26Å; E74-I76 PolarHBondContact O-N 3.29Å; E74-L77 PolarHBondContact O-N 2.84Å; E74-K78 VanDerWaalsContact O-CB 3.28Å; E74-K78 WeakPolarHBondContact O-CB 3.35Å; E74-K78 PolarHBondContact O-N 3.43Å |
| 75 | Q | 82 | Confident | 75.5 | Confident | 117 Ų | 117 | 106.5 Ų | 106.5 | 55% | 0.547 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -66.6 | -38.8 | 176.3 | -160.7 | 170.8 | 55.2 | 0 | 0 | 111.8 | Q70 D71 C79 | Q70-Q75 HydrophobicContact CB-CB 4.35Å; D71-Q75 PolarHBondContact O-N 3.08Å; Q75-C79 WeakPolarHBondContact O-CB 3.39Å; Q75-C79 PolarHBondContact O-N 3.49Å |
| 76 | I | 87.6 | Confident | 77.3 | Confident | 94 Ų | 94 | 100.4 Ų | 100.4 | 48% | 0.482 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64.3 | -45.4 | 172 | -72.2 | 165.2 | 0 | 0 | 0 | 110.6 | T72 V73 E74 C79 I80 | T72-I76 HydrophobicContact CG2-CD1 4Å; T72-I76 WeakPolarHBondContact O-CB 3.09Å; T72-I76 VanDerWaalsContact O-CD1 3.25Å; T72-I76 WeakPolarHBondContact O-CD1 3.46Å; T72-I76 WeakPolarHBondContact O-CG1 3.37Å; T72-I76 PolarHBondContact O-N 3.18Å; V73-I76 PolarHBondContact O-N 2.85Å; E74-I76 PolarHBondContact O-N 3.29Å; I76-C79 PolarHBondContact O-N 3.29Å; I76-I80 HydrophobicContact CG2-CD1 3.58Å; I76-I80 HydrophobicContact CG2-CG1 4.31Å; I76-I80 WeakPolarHBondContact O-CB 3.28Å; I76-I80 WeakPolarHBondContact O-CD1 3.46Å; I76-I80 WeakPolarHBondContact O-CG1 3.45Å; I76-I80 PolarHBondContact O-N 2.83Å |
| 77 | L | 90.6 | Very high | 79.2 | Confident | 91 Ų | 91 | 99.3 Ų | 99.3 | 48% | 0.476 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -61.5 | -45.3 | 178.7 | -75.5 | 169 | 0 | 0 | 0 | 111.4 | V73 E74 I80 M81 | V73-L77 HydrophobicContact CG1-CD1 3.94Å; V73-L77 HydrophobicContact CG1-CG 4.38Å; V73-L77 WeakPolarHBondContact O-CB 3.43Å; V73-L77 VanDerWaalsContact O-CG 3.22Å; V73-L77 WeakPolarHBondContact O-CG 3.29Å; V73-L77 PolarHBondContact O-N 3.32Å; E74-L77 PolarHBondContact O-N 2.84Å; L77-I80 PolarHBondContact O-N 2.81Å; L77-M81 HydrophobicContact CB-CE 4.44Å; L77-M81 WeakPolarHBondContact O-CG 3.49Å; L77-M81 PolarHBondContact O-N 3.45Å |
| 78 | K | 85.7 | Confident | 80.9 | Confident | 84 Ų | 84 | 100.7 Ų | 100.7 | 37% | 0.365 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -59.8 | -47.6 | 175.2 | -174.3 | 175.5 | 179.5 | -178.2 | 0 | 111.1 | E74 I80 M81 E82 | E74-K78 VanDerWaalsContact O-CB 3.28Å; E74-K78 WeakPolarHBondContact O-CB 3.35Å; E74-K78 PolarHBondContact O-N 3.43Å; K78-I80 VanDerWaalsContact C-N 3.31Å; K78-I80 PolarHBondContact O-N 3.42Å; K78-M81 PolarHBondContact O-N 3.17Å; K78-E82 WeakPolarHBondContact CE-OE1 3.07Å; K78-E82 HydrophobicContact CG-CG 4.31Å; K78-E82 WeakPolarHBondContact CG-OE1 3.25Å; K78-E82 WeakPolarHBondContact O-CB 3.2Å; K78-E82 WeakPolarHBondContact O-CG 3.43Å; K78-E82 PolarHBondContact O-N 3.2Å |
| 79 | C | 82.6 | Confident | 82.3 | Confident | 86 Ų | 86 | 93.1 Ų | 93.1 | 58% | 0.581 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -60.8 | -37.6 | 176.3 | -174.8 | 0 | 0 | 0 | 0 | 112.8 | Q75 I76 N83 | Q75-C79 WeakPolarHBondContact O-CB 3.39Å; Q75-C79 PolarHBondContact O-N 3.49Å; I76-C79 PolarHBondContact O-N 3.29Å; C79-N83 PolarHBondContact O-N 2.91Å |
| 80 | I | 87.6 | Confident | 83.7 | Confident | 72 Ų | 72 | 91.8 Ų | 91.8 | 37% | 0.369 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -68.8 | -42.6 | 177.3 | -70 | 164.6 | 0 | 0 | 0 | 111.2 | I76 L77 K78 N86 F90 | I76-I80 HydrophobicContact CG2-CD1 3.58Å; I76-I80 HydrophobicContact CG2-CG1 4.31Å; I76-I80 WeakPolarHBondContact O-CB 3.28Å; I76-I80 WeakPolarHBondContact O-CD1 3.46Å; I76-I80 WeakPolarHBondContact O-CG1 3.45Å; I76-I80 PolarHBondContact O-N 2.83Å; L77-I80 PolarHBondContact O-N 2.81Å; K78-I80 VanDerWaalsContact C-N 3.31Å; K78-I80 PolarHBondContact O-N 3.42Å; I80-N86 VanDerWaalsContact O-CB 3.28Å; I80-N86 WeakPolarHBondContact O-CB 3.33Å; I80-N86 PolarHBondContact O-ND2 3.42Å; I80-F90 HydrophobicContact CG2-CE2 4.37Å; I80-F90 HydrophobicContact CG2-CZ 4.41Å |
| 81 | M | 86.6 | Confident | 84.7 | Confident | 116 Ų | 116 | 94.8 Ų | 94.8 | 57% | 0.571 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -74.6 | -37.5 | -177.8 | -70.9 | -175.1 | -65.7 | 0 | 0 | 113.1 | L77 K78 N83 | L77-M81 HydrophobicContact CB-CE 4.44Å; L77-M81 WeakPolarHBondContact O-CG 3.49Å; L77-M81 PolarHBondContact O-N 3.45Å; K78-M81 PolarHBondContact O-N 3.17Å; M81-N83 VanDerWaalsContact C-N 3.27Å; M81-N83 PolarHBondContact O-N 3.41Å |
| 82 | E | 85.6 | Confident | 85.1 | Confident | 125 Ų | 125 | 96.4 Ų | 96.4 | 58% | 0.584 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -78.2 | -12.2 | -179.5 | -70.7 | 176.5 | 175.7 | 0 | 0 | 113.1 | K78 E84 | K78-E82 WeakPolarHBondContact CE-OE1 3.07Å; K78-E82 HydrophobicContact CG-CG 4.31Å; K78-E82 WeakPolarHBondContact CG-OE1 3.25Å; K78-E82 WeakPolarHBondContact O-CB 3.2Å; K78-E82 WeakPolarHBondContact O-CG 3.43Å; K78-E82 PolarHBondContact O-N 3.2Å; E82-E84 PolarHBondContact O-N 3.46Å; E82-E84 VanDerWaalsContact O-N 3.14Å |
| 83 | N | 87.3 | Confident | 84.7 | Confident | 73 Ų | 73 | 97.3 Ų | 97.3 | 39% | 0.39 | 50% | 0.504 | S | S | . | . | trans | -65.5 | 115 | 175.4 | -175.7 | -64.8 | 0 | 0 | 0 | 110.2 | C79 M81 A85 N86 M87 | C79-N83 PolarHBondContact O-N 2.91Å; M81-N83 VanDerWaalsContact C-N 3.27Å; M81-N83 PolarHBondContact O-N 3.41Å; N83-A85 VanDerWaalsContact C-N 3.26Å; N83-A85 PolarHBondContact O-N 2.83Å; N83-A85 WeakPolarHBondContact OD1-CB 3.49Å; N83-A85 PolarHBondContact OD1-N 3.09Å; N83-A85 VanDerWaalsContact OD1-N 3.07Å; N83-N86 HydrophobicContact CB-CB 4Å; N83-N86 WeakPolarHBondContact CB-ND2 3.33Å; N83-N86 CarbonylContact O-C 3.48Å; N83-N86 WeakPolarHBondContact O-CA 3.37Å; N83-N86 WeakPolarHBondContact O-CB 3.19Å; N83-N86 PolarHBondContact O-N 3.1Å; N83-N86 PolarHBondContact OD1-N 3.47Å; N83-M87 PolarHBondContact O-N 3.45Å | ||
| 84 | E | 85.9 | Confident | 84.1 | Confident | 162 Ų | 162 | 98.8 Ų | 98.8 | 76% | 0.757 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -54.2 | -38.6 | -175.9 | -172.7 | 169.1 | -173.6 | 0 | 0 | 113.3 | E82 M87 E88 | E82-E84 PolarHBondContact O-N 3.46Å; E82-E84 VanDerWaalsContact O-N 3.14Å; E84-M87 PolarHBondContact O-N 3.3Å; E84-E88 WeakPolarHBondContact O-CB 3.48Å; E84-E88 PolarHBondContact O-N 3.4Å |
| 85 | A | 86.5 | Confident | 83.2 | Confident | 72 Ų | 72 | 96 Ų | 96 | 60% | 0.595 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -70.4 | -35.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | N83 A89 | N83-A85 VanDerWaalsContact C-N 3.26Å; N83-A85 PolarHBondContact O-N 2.83Å; N83-A85 WeakPolarHBondContact OD1-CB 3.49Å; N83-A85 PolarHBondContact OD1-N 3.09Å; N83-A85 VanDerWaalsContact OD1-N 3.07Å; A85-A89 PolarHBondContact O-N 3.31Å |
| 86 | N | 86.9 | Confident | 82 | Confident | 62 Ų | 62 | 96.3 Ų | 96.3 | 33% | 0.332 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -72 | -40.2 | 174.4 | -66.2 | -17.9 | 0 | 0 | 0 | 111.3 | I80 N83 E88 A89 F90 | I80-N86 VanDerWaalsContact O-CB 3.28Å; I80-N86 WeakPolarHBondContact O-CB 3.33Å; I80-N86 PolarHBondContact O-ND2 3.42Å; N83-N86 HydrophobicContact CB-CB 4Å; N83-N86 WeakPolarHBondContact CB-ND2 3.33Å; N83-N86 CarbonylContact O-C 3.48Å; N83-N86 WeakPolarHBondContact O-CA 3.37Å; N83-N86 WeakPolarHBondContact O-CB 3.19Å; N83-N86 PolarHBondContact O-N 3.1Å; N83-N86 PolarHBondContact OD1-N 3.47Å; N86-E88 VanDerWaalsContact C-N 3.35Å; N86-A89 PolarHBondContact O-N 3.09Å; N86-F90 HydrophobicContact CB-CD2 4.26Å; N86-F90 HydrophobicContact CB-CE2 3.95Å; N86-F90 WeakPolarHBondContact O-CB 3.39Å; N86-F90 WeakPolarHBondContact O-CD2 2.88Å; N86-F90 WeakPolarHBondContact O-CG 3.22Å; N86-F90 PolarHBondContact O-N 3.29Å |
| 87 | M | 87 | Confident | 80.5 | Confident | 100 Ų | 100 | 99.4 Ų | 99.4 | 49% | 0.493 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -63.2 | -41.1 | 178.8 | 179 | 162 | 34.5 | 0 | 0 | 111.5 | N83 E84 F90 N91 | N83-M87 PolarHBondContact O-N 3.45Å; E84-M87 PolarHBondContact O-N 3.3Å; M87-F90 PolarHBondContact O-N 3.3Å; M87-N91 WeakPolarHBondContact O-CB 3.28Å; M87-N91 PolarHBondContact O-N 3.26Å |
| 88 | E | 85.5 | Confident | 78.7 | Confident | 124 Ų | 124 | 101.3 Ų | 101.3 | 58% | 0.579 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -62.7 | -44.6 | 172.9 | -172.9 | 60 | -155.3 | 0 | 0 | 111.6 | E84 N86 F90 N91 E92 | E84-E88 WeakPolarHBondContact O-CB 3.48Å; E84-E88 PolarHBondContact O-N 3.4Å; N86-E88 VanDerWaalsContact C-N 3.35Å; E88-F90 PolarHBondContact O-N 3.13Å; E88-N91 PolarHBondContact O-N 2.92Å; E88-E92 PolarHBondContact O-N 2.78Å |
| 89 | A | 84.3 | Confident | 77.1 | Confident | 44 Ų | 44 | 103.7 Ų | 103.7 | 36% | 0.364 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -65.2 | -38.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | A85 N86 E92 M93 | A85-A89 PolarHBondContact O-N 3.31Å; N86-A89 PolarHBondContact O-N 3.09Å; A89-E92 PolarHBondContact O-N 3.1Å; A89-M93 WeakPolarHBondContact O-CG 3.28Å; A89-M93 PolarHBondContact O-N 2.83Å |
| 90 | F | 87.7 | Confident | 75.2 | Confident | 84 Ų | 84 | 105.5 Ų | 105.5 | 37% | 0.368 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -64.9 | -41 | 173.5 | -72.5 | -52.6 | 0 | 0 | 0 | 111.3 | I80 N86 M87 E88 M93 L94 | I80-F90 HydrophobicContact CG2-CE2 4.37Å; I80-F90 HydrophobicContact CG2-CZ 4.41Å; N86-F90 HydrophobicContact CB-CD2 4.26Å; N86-F90 HydrophobicContact CB-CE2 3.95Å; N86-F90 WeakPolarHBondContact O-CB 3.39Å; N86-F90 WeakPolarHBondContact O-CD2 2.88Å; N86-F90 WeakPolarHBondContact O-CG 3.22Å; N86-F90 PolarHBondContact O-N 3.29Å; M87-F90 PolarHBondContact O-N 3.3Å; E88-F90 PolarHBondContact O-N 3.13Å; F90-M93 HydrophobicContact CD1-CE 3.58Å; F90-M93 HydrophobicContact CE1-CE 4.06Å; F90-M93 PolarHBondContact O-N 2.9Å; F90-L94 WeakPolarHBondContact O-CB 3.39Å; F90-L94 VanDerWaalsContact O-CG 3.3Å; F90-L94 WeakPolarHBondContact O-CG 3.4Å; F90-L94 PolarHBondContact O-N 3.43Å |
| 91 | N | 79.8 | Confident | 73.1 | Confident | 103 Ų | 103 | 109 Ų | 109 | 55% | 0.551 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -64.2 | -39.9 | 177.4 | -167.9 | 39.9 | 0 | 0 | 0 | 111.7 | M87 E88 G95 | M87-N91 WeakPolarHBondContact O-CB 3.28Å; M87-N91 PolarHBondContact O-N 3.26Å; E88-N91 PolarHBondContact O-N 2.92Å; N91-G95 WeakPolarHBondContact O-CA 3.47Å; N91-G95 PolarHBondContact O-N 3.34Å |
| 92 | E | 81.1 | Confident | 71.2 | Confident | 132 Ų | 132 | 113.4 Ų | 113.4 | 62% | 0.617 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -65.4 | -38.1 | 174.1 | -169 | -176.4 | 167 | 0 | 0 | 112.1 | E88 A89 N96 | E88-E92 PolarHBondContact O-N 2.78Å; A89-E92 PolarHBondContact O-N 3.1Å; E92-N96 PolarHBondContact O-ND2 3.06Å; E92-N96 PolarHBondContact O-OD1 3.39Å |
| 93 | M | 74.1 | Confident | 68.9 | Low | 118 Ų | 118 | 115.1 Ų | 115.1 | 58% | 0.581 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -74.3 | -38.6 | 177.8 | -70.4 | -171.7 | -57.5 | 0 | 0 | 113.2 | A89 F90 | A89-M93 WeakPolarHBondContact O-CG 3.28Å; A89-M93 PolarHBondContact O-N 2.83Å; F90-M93 HydrophobicContact CD1-CE 3.58Å; F90-M93 HydrophobicContact CE1-CE 4.06Å; F90-M93 PolarHBondContact O-N 2.9Å |
| 94 | L | 72.3 | Confident | 66.8 | Low | 116 Ų | 116 | 118.3 Ų | 118.3 | 61% | 0.607 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -82.2 | -31.3 | -178.4 | -67.8 | 175.6 | 0 | 0 | 0 | 112.7 | F90 N96 H97 | F90-L94 WeakPolarHBondContact O-CB 3.39Å; F90-L94 VanDerWaalsContact O-CG 3.3Å; F90-L94 WeakPolarHBondContact O-CG 3.4Å; F90-L94 PolarHBondContact O-N 3.43Å; L94-N96 PolarHBondContact O-N 3.05Å; L94-N96 VanDerWaalsContact O-N 3.12Å; L94-H97 PolarHBondContact O-N 2.61Å |
| 95 | G | 60.3 | Low | 65.1 | Low | 41 Ų | 41 | 115.4 Ų | 115.4 | 42% | 0.423 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -58.4 | -23.8 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | N91 N98 | N91-G95 WeakPolarHBondContact O-CA 3.47Å; N91-G95 PolarHBondContact O-N 3.34Å; G95-N98 PolarHBondContact O-ND2 3.02Å |
| 96 | N | 57.5 | Low | 63.5 | Low | 124 Ų | 124 | 122.9 Ų | 122.9 | 66% | 0.663 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.4 | -7.9 | -178.1 | -54.1 | -1.7 | 0 | 0 | 0 | 112.2 | E92 L94 N98 | E92-N96 PolarHBondContact O-ND2 3.06Å; E92-N96 PolarHBondContact O-OD1 3.39Å; L94-N96 PolarHBondContact O-N 3.05Å; L94-N96 VanDerWaalsContact O-N 3.12Å; N96-N98 VanDerWaalsContact C-N 3.27Å; N96-N98 PolarHBondContact O-N 3.02Å |
| 97 | H | 55.5 | Low | 61.3 | Low | 159 Ų | 159 | 126.2 Ų | 126.2 | 74% | 0.736 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.7 | 26 | -176.6 | -160.2 | 69.9 | 0 | 0 | 0 | 113.5 | L94 | L94-H97 PolarHBondContact O-N 2.61Š|
| 98 | N | 52.3 | Low | 59.2 | Low | 130 Ų | 130 | 127.7 Ų | 127.7 | 70% | 0.695 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107.5 | 2.2 | 179.2 | -53.3 | -57.5 | 0 | 0 | 0 | 114.3 | G95 N96 | G95-N98 PolarHBondContact O-ND2 3.02Å; N96-N98 VanDerWaalsContact C-N 3.27Å; N96-N98 PolarHBondContact O-N 3.02Å |
| 99 | V | 52.8 | Low | 57.4 | Low | 135 Ų | 135 | 124.8 Ų | 124.8 | 82% | 0.818 | 66% | 0.661 | S | S | * | * | S | Bend | trans | -151.3 | 82.4 | 173.1 | -170.4 | 0 | 0 | 0 | 0 | 111 | ||
| 100 | C | 41.8 | Very low | 55.8 | Low | 123 Ų | 123 | 133.3 Ų | 133.3 | 83% | 0.831 | 68% | 0.684 | S | S | * | * | trans | -158.6 | 44.5 | 147.5 | -137.4 | 0 | 0 | 0 | 0 | 113.2 | R102 | C100-R102 PolarHBondContact O-N 2.95Š| ||
| 101 | V | 45.1 | Very low | 53.7 | Low | 147 Ų | 147 | 136.8 Ų | 136.8 | 89% | 0.891 | 71% | 0.705 | S | S | * | * | trans | -94.5 | 74.1 | 158.7 | -176.6 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 102 | R | 45.8 | Very low | 51.8 | Low | 207 Ų | 207 | 142 Ų | 142 | 78% | 0.781 | 72% | 0.717 | S | S | * | * | S | Bend | trans | 174 | 132.6 | 142.3 | -106.4 | -173.3 | 174.3 | 161.8 | 1.3 | 112.8 | C100 | C100-R102 PolarHBondContact O-N 2.95Š|
| 103 | H | 36.8 | Very low | 49.8 | Very low | 161 Ų | 161 | 144 Ų | 144 | 75% | 0.745 | 72% | 0.724 | S | S | * | * | trans | 82.2 | 89.5 | 162.9 | -60 | -63.8 | 0 | 0 | 0 | 117.9 | ||||
| 104 | D | 43.5 | Very low | 48 | Very low | 140 Ų | 140 | 145.6 Ų | 145.6 | 75% | 0.749 | 73% | 0.73 | S | S | * | * | -72.3 | 142 | 128.8 | -159.2 | 19.6 | 0 | 0 | 0 | 106.7 | R106 | D104-R106 PolarHBondContact OD1-N 2.94Š| |||
| 105 | P | 51.3 | Low | 46.5 | Very low | 101 Ų | 101 | 144.8 Ų | 144.8 | 66% | 0.656 | 73% | 0.734 | S | S | * | * | S | Bend | -143.7 | 125.1 | 69.2 | 26.9 | -2.1 | 0 | 0 | 0 | 114.8 | L107 | P105-L107 PolarHBondContact O-N 2.81Š| |
| 106 | R | 51.5 | Low | 46 | Very low | 229 Ų | 229 | 150.9 Ų | 150.9 | 86% | 0.864 | 76% | 0.755 | S | S | * | * | S | Bend | trans | 74 | 3.1 | 144.9 | -66.4 | -176.9 | 154.5 | 162.4 | -3.2 | 122 | D104 | D104-R106 PolarHBondContact OD1-N 2.94Š|
| 107 | L | 41.8 | Very low | 45.8 | Very low | 132 Ų | 132 | 147.9 Ų | 147.9 | 69% | 0.691 | 75% | 0.754 | S | S | * | * | trans | -145.6 | 134 | 173.2 | -64.1 | 169.8 | 0 | 0 | 0 | 106.8 | P105 | P105-L107 PolarHBondContact O-N 2.81Š| ||
| 108 | T | 43.2 | Very low | 45.6 | Very low | 131 Ų | 131 | 144.5 Ų | 144.5 | 80% | 0.804 | 76% | 0.762 | S | S | * | * | -161.4 | 65.5 | 65.9 | 41.3 | 0 | 0 | 0 | 0 | 106 | |||||
| 109 | S | 47.1 | Very low | 45.6 | Very low | 63 Ų | 63 | 142.4 Ų | 142.4 | 44% | 0.441 | 75% | 0.749 | S | S | . | * | 56.6 | 141 | 92.2 | -149.6 | 0 | 0 | 0 | 0 | 112.4 | L111 | S109-L111 VanDerWaalsContact C-N 3.28Å; S109-L111 PolarHBondContact O-N 3.18Å | |||
| 110 | R | 50.3 | Low | 45.8 | Very low | 224 Ų | 224 | 140.7 Ų | 140.7 | 85% | 0.845 | 74% | 0.741 | S | S | * | * | trans | 63.9 | 22.3 | 143.5 | -68.8 | 157.1 | -175.7 | -104.2 | 0.7 | 116.8 | ||||
| 111 | L | 44.5 | Very low | 46.6 | Very low | 156 Ų | 156 | 141.4 Ų | 141.4 | 82% | 0.817 | 74% | 0.744 | S | S | * | * | trans | -135.8 | 102.5 | 170.9 | -114.3 | 95.3 | 0 | 0 | 0 | 108.6 | S109 | S109-L111 VanDerWaalsContact C-N 3.28Å; S109-L111 PolarHBondContact O-N 3.18Å | ||
| 112 | R | 39.6 | Very low | 47.5 | Very low | 213 Ų | 213 | 138 Ų | 138 | 80% | 0.804 | 72% | 0.718 | S | S | * | * | cis | -162 | 134.1 | 10.8 | -100 | -142.6 | 171.9 | 125.3 | -5.8 | 105.7 | ||||
| 113 | K | 37.7 | Very low | 48.2 | Very low | 173 Ų | 173 | 136.3 Ų | 136.3 | 75% | 0.752 | 72% | 0.724 | S | S | * | * | trans | 51.4 | 119.8 | 137.1 | -109.9 | -168.9 | 159.5 | -141.4 | 0 | 116.6 | ||||
| 114 | E | 36.9 | Very low | 49.2 | Very low | 152 Ų | 152 | 133.2 Ų | 133.2 | 71% | 0.71 | 71% | 0.71 | S | S | * | * | cis | -166.9 | 147.2 | 37.9 | -73.7 | 166.1 | 166.2 | 0 | 0 | 103.9 | ||||
| 115 | S | 42.1 | Very low | 50 | Low | 100 Ų | 100 | 133 Ų | 133 | 70% | 0.699 | 71% | 0.714 | S | S | * | * | 179 | 123.4 | 53.9 | -176.2 | 0 | 0 | 0 | 0 | 108.4 | |||||
| 116 | I | 49.7 | Very low | 50.1 | Low | 169 Ų | 169 | 132.5 Ų | 132.5 | 87% | 0.867 | 71% | 0.709 | S | S | * | * | trans | 44.6 | 99.4 | 139.9 | -52.3 | 166.1 | 0 | 0 | 0 | 116.7 | ||||
| 117 | G | 52.6 | Low | 50.1 | Low | 61 Ų | 61 | 130 Ų | 130 | 63% | 0.629 | 71% | 0.706 | S | S | * | * | trans | 136.9 | 79.7 | 162.1 | 0 | 0 | 0 | 0 | 0 | 112 | I119 | G117-I119 PolarHBondContact O-N 2.88Š| ||
| 118 | G | 51.5 | Low | 50.4 | Low | 88 Ų | 88 | 127.4 Ų | 127.4 | 91% | 0.907 | 70% | 0.7 | S | S | * | * | trans | -54.7 | 90.3 | -171.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 119 | I | 51.6 | Low | 50.8 | Low | 85 Ų | 85 | 125.2 Ų | 125.2 | 44% | 0.436 | 70% | 0.703 | S | S | . | * | trans | -140.1 | 126.4 | 171.9 | -51.6 | 167 | 0 | 0 | 0 | 107 | G117 V141 | G117-I119 PolarHBondContact O-N 2.88Å; I119-V141 HydrophobicContact CD1-CG2 3.69Å | ||
| 120 | P | 57.7 | Low | 51.1 | Low | 100 Ų | 100 | 127 Ų | 127 | 65% | 0.649 | 71% | 0.711 | S | S | * | * | trans | -60 | 146.2 | 173.2 | -19.6 | 31.2 | 0 | 0 | 0 | 111.3 | H122 | P120-H122 PolarHBondContact O-N 2.92Š| ||
| 121 | P | 59.3 | Low | 51.3 | Low | 138 Ų | 138 | 124.3 Ų | 124.3 | 90% | 0.896 | 71% | 0.714 | S | S | * | * | trans | -63 | 110.1 | 172.1 | 26.6 | -31.6 | 0 | 0 | 0 | 108.7 | ||||
| 122 | H | 64 | Low | 52 | Low | 74 Ų | 74 | 124.6 Ų | 124.6 | 34% | 0.343 | 72% | 0.715 | S | S | . | * | trans | -108 | 128.2 | 170.7 | 96.9 | -70.5 | 0 | 0 | 0 | 108.5 | P120 H124 C135 L137 C138 | P120-H122 PolarHBondContact O-N 2.92Å; H122-H124 AromaticContact CE1-ND1 3.8Å; H122-H124 AromaticContact NE2-ND1 3.3Å; H122-H124 PolarHBondContact NE2-ND1 2.73Å; H122-C135 PolarHBondContact NE2-SG 2.89Å; H122-C135 VanDerWaalsContact NE2-SG 3.4Å; H122-L137 HydrophobicContact CB-CD2 4.2Å; H122-C138 PolarHBondContact CE1-SG 2.83Å | ||
| 123 | L | 58.9 | Low | 52.9 | Low | 172 Ų | 172 | 118.4 Ų | 118.4 | 90% | 0.901 | 70% | 0.698 | S | S | * | * | trans | -97.3 | 132.9 | 174.9 | -156.5 | 77.6 | 0 | 0 | 0 | 107.7 | ||||
| 124 | H | 59.1 | Low | 54.2 | Low | 96 Ų | 96 | 114.2 Ų | 114.2 | 44% | 0.444 | 69% | 0.69 | S | S | . | * | trans | -133 | 137.8 | 173.5 | 69.2 | -94.9 | 0 | 0 | 0 | 110.2 | H122 V126 C138 | H122-H124 AromaticContact CE1-ND1 3.8Å; H122-H124 AromaticContact NE2-ND1 3.3Å; H122-H124 PolarHBondContact NE2-ND1 2.73Å; H124-V126 WeakPolarHBondContact CD2-CG2 3.37Å; H124-C138 PolarHBondContact CE1-SG 3.34Å | ||
| 125 | T | 60.3 | Low | 55.8 | Low | 136 Ų | 136 | 109 Ų | 109 | 83% | 0.834 | 67% | 0.67 | S | S | * | * | trans | -107.4 | 96.3 | 174.6 | -45.7 | 0 | 0 | 0 | 0 | 106.9 | H127 | T125-H127 PolarHBondContact O-N 2.92Š| ||
| 126 | V | 53.7 | Low | 57 | Low | 91 Ų | 91 | 111.1 Ų | 111.1 | 55% | 0.552 | 67% | 0.673 | S | S | * | * | trans | -84.9 | 101.5 | 174.4 | -170.1 | 0 | 0 | 0 | 0 | 108.5 | H124 | H124-V126 WeakPolarHBondContact CD2-CG2 3.37Š| ||
| 127 | H | 49.7 | Very low | 57.8 | Low | 175 Ų | 175 | 106.6 Ų | 106.6 | 81% | 0.81 | 65% | 0.65 | S | S | * | * | trans | -138.3 | 90.1 | 157 | -155.9 | 88.1 | 0 | 0 | 0 | 108.6 | T125 | T125-H127 PolarHBondContact O-N 2.92Š| ||
| 128 | S | 49.2 | Very low | 58.5 | Low | 79 Ų | 79 | 105.2 Ų | 105.2 | 55% | 0.552 | 63% | 0.63 | S | S | * | * | trans | -152.3 | 109.3 | 167.2 | -71.1 | 0 | 0 | 0 | 0 | 107.3 | T130 N133 | S128-T130 PolarHBondContact O-N 2.83Å; S128-N133 WeakPolarHBondContact CB-ND2 3.41Å; S128-N133 PolarHBondContact O-ND2 3.31Å | ||
| 129 | G | 52.3 | Low | 59.1 | Low | 85 Ų | 85 | 103.6 Ų | 103.6 | 88% | 0.876 | 60% | 0.603 | S | S | * | * | trans | -73.7 | 64.1 | -177.4 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 130 | T | 52.4 | Low | 59.7 | Low | 99 Ų | 99 | 104.6 Ų | 104.6 | 61% | 0.607 | 61% | 0.606 | S | S | * | * | S | Bend | trans | -147.8 | 141.6 | 168.8 | 14.6 | 0 | 0 | 0 | 0 | 109.2 | S128 L132 N133 | S128-T130 PolarHBondContact O-N 2.83Å; T130-L132 PolarHBondContact O-N 2.87Å; T130-N133 PolarHBondContact O-ND2 3.25Å |
| 131 | D | 53.9 | Low | 59.9 | Low | 169 Ų | 169 | 101.3 Ų | 101.3 | 90% | 0.904 | 58% | 0.584 | S | S | * | * | S | Bend | trans | -76.8 | 25.7 | -154.8 | -33.4 | -38.4 | 0 | 0 | 0 | 114.6 | ||
| 132 | L | 59.4 | Low | 59.9 | Low | 162 Ų | 162 | 102.6 Ų | 102.6 | 85% | 0.848 | 58% | 0.575 | S | S | * | * | trans | -138.8 | 41.8 | -176 | -144.9 | 81.5 | 0 | 0 | 0 | 114 | T130 | T130-L132 PolarHBondContact O-N 2.87Š| ||
| 133 | N | 57.8 | Low | 59.7 | Low | 82 Ų | 82 | 103 Ų | 103 | 44% | 0.439 | 59% | 0.592 | S | S | . | * | trans | -117.3 | 64.3 | -175.7 | -65 | -36 | 0 | 0 | 0 | 113.2 | S128 T130 | S128-N133 WeakPolarHBondContact CB-ND2 3.41Å; S128-N133 PolarHBondContact O-ND2 3.31Å; T130-N133 PolarHBondContact O-ND2 3.25Å | ||
| 134 | S | 65.6 | Low | 59.6 | Low | 85 Ų | 85 | 102.5 Ų | 102.5 | 59% | 0.594 | 58% | 0.582 | S | S | * | * | trans | -104.6 | 115.8 | 170.5 | 73.2 | 0 | 0 | 0 | 0 | 111.5 | L136 T139 | S134-L136 PolarHBondContact O-N 3.33Å; S134-T139 WeakPolarHBondContact OG-CG2 3.45Å | ||
| 135 | C | 70.3 | Confident | 59.5 | Low | 43 Ų | 43 | 106.7 Ų | 106.7 | 29% | 0.291 | 59% | 0.594 | S | S | . | * | trans | -56.6 | 126.9 | 171.7 | 170.1 | 0 | 0 | 0 | 0 | 110.7 | H122 L137 C138 T139 | H122-C135 PolarHBondContact NE2-SG 2.89Å; H122-C135 VanDerWaalsContact NE2-SG 3.4Å; C135-L137 PolarHBondContact O-N 2.81Å; C135-L137 PolarHBondContact SG-N 2.81Å; C135-L137 VanDerWaalsContact SG-N 3.42Å; C135-C138 HydrophobicContact CB-CB 3.95Å; C135-C138 WeakPolarHBondContact O-CB 2.98Å; C135-C138 PolarHBondContact O-N 3.5Å; C135-T139 PolarHBondContact O-N 3.02Å; C135-T139 PolarHBondContact O-OG1 2.96Å | ||
| 136 | L | 68.9 | Low | 59.1 | Low | 145 Ų | 145 | 103.8 Ų | 103.8 | 76% | 0.759 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -59.6 | -31.1 | 179.7 | -74.5 | 166 | 0 | 0 | 0 | 113 | S134 T139 Q140 | S134-L136 PolarHBondContact O-N 3.33Å; L136-T139 WeakPolarHBondContact CA-OG1 3.33Å; L136-T139 PolarHBondContact O-OG1 3.35Å; L136-Q140 WeakPolarHBondContact O-CB 3.47Å; L136-Q140 PolarHBondContact O-N 3.25Å; L136-Q140 VanDerWaalsContact O-N 3.1Å |
| 137 | L | 64.7 | Low | 59.1 | Low | 74 Ų | 74 | 107.9 Ų | 107.9 | 39% | 0.387 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -71.4 | -39.3 | 174.1 | -114.3 | 65.5 | 0 | 0 | 0 | 111.6 | H122 C135 V141 | H122-L137 HydrophobicContact CB-CD2 4.2Å; C135-L137 PolarHBondContact O-N 2.81Å; C135-L137 PolarHBondContact SG-N 2.81Å; C135-L137 VanDerWaalsContact SG-N 3.42Å; L137-V141 VanDerWaalsContact O-CG2 3.28Å; L137-V141 WeakPolarHBondContact O-CG2 3.48Å; L137-V141 PolarHBondContact O-N 3.37Å; L137-V141 VanDerWaalsContact O-N 3.09Å |
| 138 | C | 67.4 | Low | 58.9 | Low | 31 Ų | 31 | 111.1 Ų | 111.1 | 21% | 0.209 | 61% | 0.609 | C | S | . | * | H | α-helix | trans | -68.4 | -37.9 | 176.3 | -69.7 | 0 | 0 | 0 | 0 | 112.7 | H122 H124 C135 V141 K142 | H122-C138 PolarHBondContact CE1-SG 2.83Å; H124-C138 PolarHBondContact CE1-SG 3.34Å; C135-C138 HydrophobicContact CB-CB 3.95Å; C135-C138 WeakPolarHBondContact O-CB 2.98Å; C135-C138 PolarHBondContact O-N 3.5Å; C138-V141 PolarHBondContact O-N 2.9Å; C138-K142 PolarHBondContact O-N 3.18Å; C138-K142 VanDerWaalsContact O-N 3.1Å |
| 139 | T | 65.6 | Low | 59 | Low | 54 Ų | 54 | 116.7 Ų | 116.7 | 33% | 0.331 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -69.6 | -40.3 | 176.7 | 54.2 | 0 | 0 | 0 | 0 | 111.4 | S134 C135 L136 V141 K142 A143 | S134-T139 WeakPolarHBondContact OG-CG2 3.45Å; C135-T139 PolarHBondContact O-N 3.02Å; C135-T139 PolarHBondContact O-OG1 2.96Å; L136-T139 WeakPolarHBondContact CA-OG1 3.33Å; L136-T139 PolarHBondContact O-OG1 3.35Å; T139-V141 VanDerWaalsContact C-N 3.31Å; T139-V141 PolarHBondContact O-N 2.96Å; T139-K142 PolarHBondContact O-N 2.96Å; T139-A143 PolarHBondContact O-N 3.24Å |
| 140 | Q | 63.6 | Low | 58.9 | Low | 106 Ų | 106 | 117.7 Ų | 117.7 | 50% | 0.495 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -63.1 | -36.1 | 174.8 | -164.5 | -169.9 | 81.1 | 0 | 0 | 112.3 | L136 K144 | L136-Q140 WeakPolarHBondContact O-CB 3.47Å; L136-Q140 PolarHBondContact O-N 3.25Å; L136-Q140 VanDerWaalsContact O-N 3.1Å; Q140-K144 WeakPolarHBondContact O-CG 3.33Å; Q140-K144 PolarHBondContact O-N 2.82Å |
| 141 | V | 62.4 | Low | 58.6 | Low | 32 Ų | 32 | 124.7 Ų | 124.7 | 19% | 0.194 | 64% | 0.635 | C | S | . | * | H | α-helix | trans | -66.8 | -42.1 | 174 | 168.2 | 0 | 0 | 0 | 0 | 112.1 | I119 L137 C138 T139 K144 R145 | I119-V141 HydrophobicContact CD1-CG2 3.69Å; L137-V141 VanDerWaalsContact O-CG2 3.28Å; L137-V141 WeakPolarHBondContact O-CG2 3.48Å; L137-V141 PolarHBondContact O-N 3.37Å; L137-V141 VanDerWaalsContact O-N 3.09Å; C138-V141 PolarHBondContact O-N 2.9Å; T139-V141 VanDerWaalsContact C-N 3.31Å; T139-V141 PolarHBondContact O-N 2.96Å; V141-K144 PolarHBondContact O-N 2.96Å; V141-R145 HydrophobicContact CG1-CG 4.34Å; V141-R145 WeakPolarHBondContact O-CB 3.41Å; V141-R145 VanDerWaalsContact O-CG 3.29Å; V141-R145 WeakPolarHBondContact O-CG 3.49Å; V141-R145 PolarHBondContact O-N 3.14Å; V141-R145 VanDerWaalsContact O-N 3.09Å |
| 142 | K | 59 | Low | 58.2 | Low | 164 Ų | 164 | 123 Ų | 123 | 71% | 0.713 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -64.4 | -41.7 | 177.1 | -76.2 | 177.9 | 177.1 | 176 | 0 | 111.8 | C138 T139 K144 R145 G146 | C138-K142 PolarHBondContact O-N 3.18Å; C138-K142 VanDerWaalsContact O-N 3.1Å; T139-K142 PolarHBondContact O-N 2.96Å; K142-K144 VanDerWaalsContact C-N 3.26Å; K142-K144 PolarHBondContact O-N 2.94Å; K142-R145 PolarHBondContact O-N 3.07Å; K142-R145 VanDerWaalsContact O-N 3.1Å; K142-G146 PolarHBondContact O-N 3.18Å |
| 143 | A | 59.8 | Low | 57.7 | Low | 83 Ų | 83 | 120.3 Ų | 120.3 | 69% | 0.686 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -60.3 | -35 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | T139 | T139-A143 PolarHBondContact O-N 3.24Å |
| 144 | K | 57 | Low | 57.6 | Low | 161 Ų | 161 | 128.1 Ų | 128.1 | 70% | 0.7 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -83 | -13.6 | 176.6 | -67.3 | 179.9 | -179.3 | 177.2 | 0 | 114.2 | Q140 V141 K142 | Q140-K144 WeakPolarHBondContact O-CG 3.33Å; Q140-K144 PolarHBondContact O-N 2.82Å; V141-K144 PolarHBondContact O-N 2.96Å; K142-K144 VanDerWaalsContact C-N 3.26Å; K142-K144 PolarHBondContact O-N 2.94Å |
| 145 | R | 55.7 | Low | 57 | Low | 185 Ų | 185 | 133.3 Ų | 133.3 | 70% | 0.698 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -105.2 | 4.5 | -177.4 | -71.3 | -176.3 | -175.6 | -170.3 | 4.5 | 114.5 | V141 K142 H147 | V141-R145 HydrophobicContact CG1-CG 4.34Å; V141-R145 WeakPolarHBondContact O-CB 3.41Å; V141-R145 VanDerWaalsContact O-CG 3.29Å; V141-R145 WeakPolarHBondContact O-CG 3.49Å; V141-R145 PolarHBondContact O-N 3.14Å; V141-R145 VanDerWaalsContact O-N 3.09Å; K142-R145 PolarHBondContact O-N 3.07Å; K142-R145 VanDerWaalsContact O-N 3.1Å; R145-H147 PolarHBondContact O-N 3.46Å |
| 146 | G | 52.5 | Low | 56.2 | Low | 74 Ų | 74 | 140.8 Ų | 140.8 | 76% | 0.763 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.7 | 15.3 | -178.8 | 0 | 0 | 0 | 0 | 0 | 117.4 | K142 | K142-G146 PolarHBondContact O-N 3.18Š|
| 147 | H | 54.1 | Low | 55.5 | Low | 178 Ų | 178 | 141.4 Ų | 141.4 | 82% | 0.824 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -123.1 | 23.5 | -177.6 | -160.1 | 71.2 | 0 | 0 | 0 | 114.7 | R145 | R145-H147 PolarHBondContact O-N 3.46Š|
| 148 | R | 46.3 | Very low | 55.2 | Low | 242 Ų | 242 | 147.3 Ų | 147.3 | 91% | 0.913 | 70% | 0.703 | S | S | * | * | trans | -131 | 94.6 | 169.2 | -68.8 | -168.9 | -179 | -127.1 | 0.8 | 110.7 | ||||
| 149 | Q | 49.4 | Very low | 54.5 | Low | 197 Ų | 197 | 152.4 Ų | 152.4 | 92% | 0.921 | 74% | 0.735 | S | S | * | * | trans | -65.7 | 154.3 | 176.9 | -74.1 | -169.1 | -16.9 | 0 | 0 | 112.9 | ||||
| 150 | S | 50.6 | Low | 54.3 | Low | 106 Ų | 106 | 152.7 Ų | 152.7 | 74% | 0.741 | 75% | 0.748 | S | S | * | * | trans | -51.6 | 142 | -178.6 | 59.6 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 151 | R | 45.7 | Very low | 54.4 | Low | 246 Ų | 246 | 150.9 Ų | 150.9 | 93% | 0.928 | 74% | 0.74 | S | S | * | * | trans | -144.7 | 108.7 | 144.2 | -82 | -170.5 | 159.3 | 170.7 | -7.1 | 110.2 | ||||
| 152 | T | 47.5 | Very low | 54.9 | Low | 133 Ų | 133 | 155.6 Ų | 155.6 | 82% | 0.816 | 76% | 0.76 | S | S | * | * | trans | -84.7 | 130.4 | 164.9 | 39.7 | 0 | 0 | 0 | 0 | 109.1 | R154 | T152-R154 PolarHBondContact O-N 3.24Š| ||
| 153 | P | 47.4 | Very low | 55.4 | Low | 105 Ų | 105 | 150.1 Ų | 150.1 | 68% | 0.682 | 74% | 0.74 | S | S | * | * | trans | -84 | 111.6 | 168.8 | 30.1 | -26.2 | 0 | 0 | 0 | 108.9 | F155 | P153-F155 HydrophobicContact CB-CD2 4.49Å; P153-F155 HydrophobicContact CB-CE2 4.4Å; P153-F155 HydrophobicContact CG-CE2 4.4Å; P153-F155 PolarHBondContact O-N 2.8Å | ||
| 154 | R | 55.4 | Low | 55.9 | Low | 247 Ų | 247 | 150.7 Ų | 150.7 | 93% | 0.932 | 74% | 0.735 | S | S | * | * | trans | -65.6 | 109 | 163.4 | -84 | -160.4 | -171.9 | -141.4 | 7.2 | 108.1 | T152 | T152-R154 PolarHBondContact O-N 3.24Š| ||
| 155 | F | 54.1 | Low | 56 | Low | 194 Ų | 194 | 149.3 Ų | 149.3 | 85% | 0.851 | 73% | 0.729 | S | S | * | * | P | Polyproline II helix | trans | -76.5 | 127.7 | 168.8 | -94.4 | -92.8 | 0 | 0 | 0 | 110.2 | P153 Q157 | P153-F155 HydrophobicContact CB-CD2 4.49Å; P153-F155 HydrophobicContact CB-CE2 4.4Å; P153-F155 HydrophobicContact CG-CE2 4.4Å; P153-F155 PolarHBondContact O-N 2.8Å; F155-Q157 PolarHBondContact O-N 3.48Å |
| 156 | K | 52.9 | Low | 56.9 | Low | 200 Ų | 200 | 143.8 Ų | 143.8 | 87% | 0.87 | 72% | 0.719 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 125.7 | 176.9 | -81.6 | 175 | 170.6 | -177.2 | 0 | 110.3 | R158 | K156-R158 PolarHBondContact O-N 3.4Š|
| 157 | Q | 54.4 | Low | 57.5 | Low | 158 Ų | 158 | 144.5 Ų | 144.5 | 74% | 0.738 | 71% | 0.709 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 123.5 | 173 | -148.4 | 176.6 | -5 | 0 | 0 | 109.3 | F155 | F155-Q157 PolarHBondContact O-N 3.48Š|
| 158 | R | 59.6 | Low | 58.7 | Low | 198 Ų | 198 | 140 Ų | 140 | 75% | 0.747 | 71% | 0.71 | S | S | * | * | P | Polyproline II helix | trans | -75.9 | 131.2 | 171.7 | -74.5 | -179.7 | 178.3 | 166.2 | -0.6 | 108.5 | K156 G160 E161 | K156-R158 PolarHBondContact O-N 3.4Å; R158-G160 PolarHBondContact O-N 3.24Å; R158-E161 PolarHBondContact O-N 3.05Å |
| 159 | P | 52.4 | Low | 60.2 | Low | 138 Ų | 138 | 140.6 Ų | 140.6 | 90% | 0.896 | 71% | 0.712 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.6 | 118.9 | 175.8 | -19.3 | 30.9 | 0 | 0 | 0 | 110.1 | ||
| 160 | G | 61.4 | Low | 60.7 | Low | 59 Ų | 59 | 138.1 Ų | 138.1 | 61% | 0.608 | 70% | 0.698 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 117.4 | -0.8 | 179.4 | 0 | 0 | 0 | 0 | 0 | 115.6 | R158 | R158-G160 PolarHBondContact O-N 3.24Š|
| 161 | E | 64.3 | Low | 62.1 | Low | 68 Ų | 68 | 140.1 Ų | 140.1 | 32% | 0.318 | 69% | 0.69 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -102.3 | 102.8 | 179.3 | -166.8 | 170.5 | -166.2 | 0 | 0 | 110.4 | R158 T173 | R158-E161 PolarHBondContact O-N 3.05Å; E161-T173 VanDerWaalsContact CG-CB 3.42Å; E161-T173 HydrophobicContact CG-CG2 3.66Å; E161-T173 WeakPolarHBondContact OE1-CB 3.47Å; E161-T173 WeakPolarHBondContact OE1-CG2 3.3Å; E161-T173 PolarHBondContact OE1-OG1 2.91Å |
| 162 | Q | 73.4 | Confident | 63.5 | Low | 132 Ų | 132 | 131.3 Ų | 131.3 | 62% | 0.617 | 66% | 0.663 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -89.7 | 118.3 | 177.6 | -168.4 | 170.6 | 15.5 | 0 | 0 | 109.7 | V164 H174 | Q162-V164 PolarHBondContact O-N 3.47Å; Q162-H174 PolarHBondContact N-O 2.83Å; Q162-H174 PolarHBondContact O-N 3.27Å; Q162-H174 VanDerWaalsContact O-N 3.08Å |
| 163 | T | 70.1 | Confident | 65.2 | Low | 49 Ų | 49 | 127.3 Ų | 127.3 | 30% | 0.301 | 64% | 0.639 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -75.5 | 105.4 | 171.5 | 53.5 | 0 | 0 | 0 | 0 | 108.3 | R171 T173 | T163-R171 VanDerWaalsContact CG2-NH1 3.31Å; T163-T173 HydrophobicContact CG2-CG2 3.46Å; T163-T173 VanDerWaalsContact CG2-CG2 3.46Å |
| 164 | V | 69.9 | Low | 66 | Low | 95 Ų | 95 | 127.6 Ų | 127.6 | 58% | 0.576 | 63% | 0.631 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -83.5 | -18.6 | 178.1 | -84.8 | 0 | 0 | 0 | 0 | 111.9 | Q162 V172 H174 | Q162-V164 PolarHBondContact O-N 3.47Å; V164-V172 PolarHBondContact N-O 3Å; V164-H174 HydrophobicContact CG2-CB 4.4Å |
| 165 | F | 57.9 | Low | 66.6 | Low | 132 Ų | 132 | 119.7 Ų | 119.7 | 58% | 0.579 | 61% | 0.613 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -157.8 | 141.2 | 175.1 | -164.2 | -110.3 | 0 | 0 | 0 | 113.1 | V167 V172 | F165-V167 HydrophobicContact CD1-CG2 4.18Å; F165-V167 HydrophobicContact CE1-CB 4.43Å; F165-V167 HydrophobicContact CE1-CG2 3.33Å; F165-V167 HydrophobicContact CZ-CG2 3.54Å; F165-V172 PolarHBondContact O-N 3.01Å |
| 166 | S | 75.9 | Confident | 66.5 | Low | 69 Ų | 69 | 115.5 Ų | 115.5 | 48% | 0.483 | 60% | 0.599 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -144.8 | 128.5 | 173.3 | 61.4 | 0 | 0 | 0 | 0 | 112.9 | F170 | S166-F170 WeakPolarHBondContact CA-O 3.34Å |
| 167 | V | 65.6 | Low | 66.5 | Low | 89 Ų | 89 | 115.6 Ų | 115.6 | 54% | 0.539 | 60% | 0.6 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -132.7 | 115 | 173.5 | 178.2 | 0 | 0 | 0 | 0 | 109.2 | F165 R169 F170 | F165-V167 HydrophobicContact CD1-CG2 4.18Å; F165-V167 HydrophobicContact CE1-CB 4.43Å; F165-V167 HydrophobicContact CE1-CG2 3.33Å; F165-V167 HydrophobicContact CZ-CG2 3.54Å; V167-R169 PolarHBondContact O-N 2.94Å; V167-R169 VanDerWaalsContact O-N 3.13Å; V167-F170 PolarHBondContact N-O 3.45Å; V167-F170 PolarHBondContact O-N 3.24Å |
| 168 | G | 77.8 | Confident | 66 | Low | 82 Ų | 82 | 117.4 Ų | 117.4 | 85% | 0.845 | 61% | 0.605 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 58.7 | -114.4 | 180 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||
| 169 | R | 78.7 | Confident | 65.2 | Low | 256 Ų | 256 | 116 Ų | 116 | 97% | 0.966 | 61% | 0.612 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.2 | -8.5 | 177.6 | -63.9 | -177.6 | -179.8 | 171.3 | 1.3 | 113.3 | V167 | V167-R169 PolarHBondContact O-N 2.94Å; V167-R169 VanDerWaalsContact O-N 3.13Å |
| 170 | F | 60.3 | Low | 64.6 | Low | 144 Ų | 144 | 117 Ų | 117 | 63% | 0.632 | 60% | 0.604 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -91.8 | 127.8 | -179.1 | -164.7 | -105.6 | 0 | 0 | 0 | 110 | S166 V167 V172 | S166-F170 WeakPolarHBondContact CA-O 3.34Å; V167-F170 PolarHBondContact N-O 3.45Å; V167-F170 PolarHBondContact O-N 3.24Å; F170-V172 HydrophobicContact CD1-CG2 4.03Å; F170-V172 HydrophobicContact CE1-CG2 3.37Å; F170-V172 HydrophobicContact CZ-CG2 4.11Å |
| 171 | R | 78.9 | Confident | 63.2 | Low | 148 Ų | 148 | 123.4 Ų | 123.4 | 56% | 0.558 | 62% | 0.616 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -134.6 | 124.3 | 179.9 | -51.7 | -173.7 | 90.7 | -123.3 | 1.1 | 107.9 | T163 | T163-R171 VanDerWaalsContact CG2-NH1 3.31Å |
| 172 | V | 75.5 | Confident | 62 | Low | 62 Ų | 62 | 128 Ų | 128 | 38% | 0.376 | 64% | 0.635 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -100.8 | 120.3 | 173.4 | -176.2 | 0 | 0 | 0 | 0 | 107.5 | V164 F165 F170 | V164-V172 PolarHBondContact N-O 3Å; F165-V172 PolarHBondContact O-N 3.01Å; F170-V172 HydrophobicContact CD1-CG2 4.03Å; F170-V172 HydrophobicContact CE1-CG2 3.37Å; F170-V172 HydrophobicContact CZ-CG2 4.11Å |
| 173 | T | 82.7 | Confident | 60 | Low | 49 Ų | 49 | 127.1 Ų | 127.1 | 30% | 0.301 | 64% | 0.644 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -114.7 | 133.6 | 177.6 | 47.4 | 0 | 0 | 0 | 0 | 109.8 | E161 T163 | E161-T173 VanDerWaalsContact CG-CB 3.42Å; E161-T173 HydrophobicContact CG-CG2 3.66Å; E161-T173 WeakPolarHBondContact OE1-CB 3.47Å; E161-T173 WeakPolarHBondContact OE1-CG2 3.3Å; E161-T173 PolarHBondContact OE1-OG1 2.91Å; T163-T173 HydrophobicContact CG2-CG2 3.46Å; T163-T173 VanDerWaalsContact CG2-CG2 3.46Å |
| 174 | H | 64.9 | Low | 58.1 | Low | 111 Ų | 111 | 131.8 Ų | 131.8 | 51% | 0.514 | 67% | 0.667 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -90.7 | 128.3 | 166.9 | -164.6 | -103.9 | 0 | 0 | 0 | 107.9 | Q162 V164 D176 | Q162-H174 PolarHBondContact N-O 2.83Å; Q162-H174 PolarHBondContact O-N 3.27Å; Q162-H174 VanDerWaalsContact O-N 3.08Å; V164-H174 HydrophobicContact CG2-CB 4.4Å; H174-D176 IonicContact CE1-OD1 3.58Å; H174-D176 IonicContact ND1-OD1 3.2Å; H174-D176 PolarHBondContact ND1-OD1 2.85Å |
| 175 | S | 67.2 | Low | 56.5 | Low | 80 Ų | 80 | 132.8 Ų | 132.8 | 56% | 0.559 | 68% | 0.678 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -95.6 | 108.4 | 170.5 | -35.4 | 0 | 0 | 0 | 0 | 107.4 | K177 | S175-K177 PolarHBondContact O-N 3.04Å; S175-K177 VanDerWaalsContact O-N 3.1Å |
| 176 | D | 52.3 | Low | 55.2 | Low | 106 Ų | 106 | 134.1 Ų | 134.1 | 57% | 0.567 | 69% | 0.691 | S | S | * | * | trans | -65.4 | 116.8 | 169.9 | -72.5 | -35.9 | 0 | 0 | 0 | 108.3 | H174 K178 | H174-D176 IonicContact CE1-OD1 3.58Å; H174-D176 IonicContact ND1-OD1 3.2Å; H174-D176 PolarHBondContact ND1-OD1 2.85Å; D176-K178 PolarHBondContact O-N 3.03Å | ||
| 177 | K | 52.1 | Low | 53 | Low | 202 Ų | 202 | 136.4 Ų | 136.4 | 88% | 0.878 | 71% | 0.707 | S | S | * | * | trans | -68.6 | 84.4 | 172.8 | -55.7 | 178.5 | -170.1 | 177.3 | 0 | 107.1 | S175 L179 | S175-K177 PolarHBondContact O-N 3.04Å; S175-K177 VanDerWaalsContact O-N 3.1Å; K177-L179 PolarHBondContact O-N 3.02Å | ||
| 178 | K | 45.5 | Very low | 51.3 | Low | 196 Ų | 196 | 135.7 Ų | 135.7 | 85% | 0.852 | 72% | 0.718 | S | S | * | * | trans | -61.7 | 104.4 | 167.5 | -157.7 | -177 | -171.3 | -169.8 | 0 | 106.1 | D176 Q180 | D176-K178 PolarHBondContact O-N 3.03Å; K178-Q180 VanDerWaalsContact C-N 3.34Å; K178-Q180 PolarHBondContact O-N 3.12Å | ||
| 179 | L | 42.4 | Very low | 49.2 | Very low | 169 Ų | 169 | 136.8 Ų | 136.8 | 89% | 0.885 | 71% | 0.712 | S | S | * | * | trans | -52.1 | 101.2 | 172 | -108.8 | 144.6 | 0 | 0 | 0 | 107.7 | K177 K181 | K177-L179 PolarHBondContact O-N 3.02Å; L179-K181 PolarHBondContact O-N 3.48Å | ||
| 180 | Q | 40 | Very low | 47.1 | Very low | 158 Ų | 158 | 132.7 Ų | 132.7 | 74% | 0.738 | 70% | 0.704 | S | S | * | * | trans | -78.9 | 80.5 | 178.9 | -159.7 | 176.8 | 37.7 | 0 | 0 | 106.5 | K178 F182 | K178-Q180 VanDerWaalsContact C-N 3.34Å; K178-Q180 PolarHBondContact O-N 3.12Å; Q180-F182 PolarHBondContact O-N 3.24Å | ||
| 181 | K | 32.6 | Very low | 45.6 | Very low | 195 Ų | 195 | 133.9 Ų | 133.9 | 85% | 0.848 | 71% | 0.712 | S | S | * | * | trans | -62.2 | 104.3 | 162.3 | -160.6 | 173.4 | -171.3 | 177.5 | 0 | 105.5 | L179 S183 | L179-K181 PolarHBondContact O-N 3.48Å; K181-S183 PolarHBondContact O-N 2.98Å | ||
| 182 | F | 37.4 | Very low | 43.4 | Very low | 163 Ų | 163 | 131.4 Ų | 131.4 | 72% | 0.715 | 72% | 0.717 | S | S | * | * | trans | -56.3 | 105.6 | 172.5 | -86.5 | -89.2 | 0 | 0 | 0 | 108.4 | Q180 N184 | Q180-F182 PolarHBondContact O-N 3.24Å; F182-N184 PolarHBondContact O-N 2.73Å | ||
| 183 | S | 31.3 | Very low | 41.4 | Very low | 115 Ų | 115 | 133.1 Ų | 133.1 | 80% | 0.804 | 73% | 0.732 | S | S | * | * | trans | -83.2 | 90.1 | 159.2 | 57.4 | 0 | 0 | 0 | 0 | 107.1 | K181 | K181-S183 PolarHBondContact O-N 2.98Š| ||
| 184 | N | 31.9 | Very low | 39.3 | Very low | 147 Ų | 147 | 142.1 Ų | 142.1 | 79% | 0.786 | 76% | 0.76 | S | S | * | * | trans | -74.5 | 127.6 | 158 | -87.1 | -9.2 | 0 | 0 | 0 | 107.5 | F182 | F182-N184 PolarHBondContact O-N 2.73Š| ||
| 185 | S | 35.4 | Very low | 37.7 | Very low | 116 Ų | 116 | 145.3 Ų | 145.3 | 81% | 0.811 | 78% | 0.78 | S | S | * | * | trans | -65.1 | 132.4 | 177.2 | 42.2 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 186 | N | 31.7 | Very low | 36 | Very low | 160 Ų | 160 | 144.7 Ų | 144.7 | 86% | 0.856 | 79% | 0.786 | S | S | * | * | trans | 82.8 | 100.4 | 146.1 | -143.6 | 33.7 | 0 | 0 | 0 | 118.9 | ||||
| 187 | S | 29.8 | Very low | 35 | Very low | 117 Ų | 117 | 148.3 Ų | 148.3 | 82% | 0.818 | 81% | 0.805 | S | S | * | * | 177.5 | 135.3 | 121.9 | 43.1 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 188 | G | 29.3 | Very low | 34.2 | Very low | 74 Ų | 74 | 146.9 Ų | 146.9 | 76% | 0.763 | 80% | 0.801 | S | S | * | * | trans | 85.4 | 102.7 | 144.9 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 189 | S | 32.5 | Very low | 33.5 | Very low | 104 Ų | 104 | 143.9 Ų | 143.9 | 73% | 0.727 | 80% | 0.799 | S | S | * | * | trans | 41.7 | 132.4 | 135.1 | -71.1 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 190 | Q | 34.7 | Very low | 33.1 | Very low | 171 Ų | 171 | 140 Ų | 140 | 80% | 0.799 | 79% | 0.792 | S | S | * | * | trans | 49.3 | 130.2 | 132.5 | -55.8 | 178.6 | 7.2 | 0 | 0 | 116.6 | ||||
| 191 | E | 30 | Very low | 33.4 | Very low | 169 Ų | 169 | 137.8 Ų | 137.8 | 79% | 0.79 | 80% | 0.8 | S | S | * | * | cis | -177.4 | 159.6 | 43.4 | -166.3 | 172.1 | 102.6 | 0 | 0 | 107.3 | ||||
| 192 | S | 32.5 | Very low | 33.5 | Very low | 95 Ų | 95 | 132.1 Ų | 132.1 | 66% | 0.664 | 80% | 0.797 | S | S | * | * | trans | -46.7 | 141.7 | 164.8 | 177.5 | 0 | 0 | 0 | 0 | 114 | ||||
| 193 | S | 33.5 | Very low | 33.6 | Very low | 99 Ų | 99 | 131.2 Ų | 131.2 | 69% | 0.692 | 80% | 0.799 | S | S | * | * | 154.5 | 132.9 | 115.1 | -69.3 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 194 | R | 37.6 | Very low | 34.2 | Very low | 238 Ų | 238 | 132 Ų | 132 | 90% | 0.898 | 80% | 0.802 | S | S | * | * | trans | 23.5 | 122.1 | 143.2 | -74.6 | 178.1 | 161.3 | 177.4 | -5.2 | 117.6 | ||||
| 195 | L | 32.8 | Very low | 35 | Very low | 177 Ų | 177 | 129.1 Ų | 129.1 | 93% | 0.927 | 80% | 0.799 | S | S | * | * | -158 | 112.6 | 120 | -99 | 164.7 | 0 | 0 | 0 | 108 | |||||
| 196 | G | 31.5 | Very low | 35.5 | Very low | 67 Ų | 67 | 128.1 Ų | 128.1 | 69% | 0.691 | 79% | 0.791 | S | S | * | * | trans | -80.2 | 145 | 159.9 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 197 | L | 30.3 | Very low | 36.3 | Very low | 182 Ų | 182 | 126.8 Ų | 126.8 | 95% | 0.953 | 78% | 0.784 | S | S | * | * | trans | -147.4 | 133.6 | 138.1 | -154.1 | 62.8 | 0 | 0 | 0 | 108.8 | ||||
| 198 | Q | 34.8 | Very low | 37.5 | Very low | 172 Ų | 172 | 125.6 Ų | 125.6 | 80% | 0.804 | 78% | 0.775 | S | S | * | * | trans | -110.9 | 161.5 | -168.4 | -163 | 170 | 35.1 | 0 | 0 | 108.7 | ||||
| 199 | V | 32 | Very low | 38.5 | Very low | 133 Ų | 133 | 127.9 Ų | 127.9 | 81% | 0.806 | 77% | 0.766 | S | S | * | * | trans | 79.6 | 133.2 | 162.7 | -159 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 200 | A | 34.3 | Very low | 39.3 | Very low | 89 Ų | 89 | 129.5 Ų | 129.5 | 74% | 0.736 | 76% | 0.762 | S | S | * | * | cis | -151.6 | 148.6 | 46.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 201 | A | 46.2 | Very low | 40.3 | Very low | 110 Ų | 110 | 125.2 Ų | 125.2 | 91% | 0.909 | 75% | 0.748 | S | S | * | * | trans | -62.3 | 140.2 | 158.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 202 | G | 35.1 | Very low | 41.3 | Very low | 76 Ų | 76 | 123.6 Ų | 123.6 | 78% | 0.784 | 74% | 0.743 | S | S | * | * | trans | -148.4 | 132.2 | 172.3 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 203 | D | 38.5 | Very low | 42.3 | Very low | 144 Ų | 144 | 125 Ų | 125 | 77% | 0.77 | 74% | 0.738 | S | S | * | * | trans | -58.3 | 154.9 | -170.7 | -69.2 | -58.3 | 0 | 0 | 0 | 115.9 | A205 | D203-A205 VanDerWaalsContact C-N 3.27Å; D203-A205 PolarHBondContact O-N 3.22Å | ||
| 204 | P | 43.6 | Very low | 43.2 | Very low | 133 Ų | 133 | 125.8 Ų | 125.8 | 86% | 0.864 | 73% | 0.734 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.6 | 55.4 | -172.9 | 37.5 | -37.2 | 0 | 0 | 0 | 112.6 | ||
| 205 | A | 48.5 | Very low | 44 | Very low | 86 Ų | 86 | 124 Ų | 124 | 71% | 0.711 | 73% | 0.727 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.5 | 3.2 | -179 | 0 | 0 | 0 | 0 | 0 | 115 | D203 | D203-A205 VanDerWaalsContact C-N 3.27Å; D203-A205 PolarHBondContact O-N 3.22Å |
| 206 | S | 47.2 | Very low | 44.9 | Very low | 94 Ų | 94 | 122.1 Ų | 122.1 | 66% | 0.657 | 72% | 0.718 | S | S | * | * | S | Bend | trans | -109.8 | 5.9 | -179 | 68.1 | 0 | 0 | 0 | 0 | 115.1 | S208 | S206-S208 VanDerWaalsContact C-N 3.32Š|
| 207 | L | 47.6 | Very low | 46.1 | Very low | 133 Ų | 133 | 123.8 Ų | 123.8 | 70% | 0.696 | 71% | 0.714 | S | S | * | * | H | α-helix | trans | -78.3 | -14.8 | -179 | -124 | 165.1 | 0 | 0 | 0 | 113.1 | V211 | L207-V211 HydrophobicContact CD2-CG2 4.46Å; L207-V211 WeakPolarHBondContact O-CG2 3.43Å |
| 208 | S | 54.5 | Low | 47.1 | Very low | 91 Ų | 91 | 122.9 Ų | 122.9 | 64% | 0.636 | 71% | 0.705 | S | S | * | * | H | α-helix | trans | -83.8 | -26.1 | -178.6 | 51.3 | 0 | 0 | 0 | 0 | 114 | S206 | S206-S208 VanDerWaalsContact C-N 3.32Å |
| 209 | E | 51.4 | Low | 47.9 | Very low | 123 Ų | 123 | 119.5 Ų | 119.5 | 58% | 0.575 | 70% | 0.7 | S | S | * | * | H | α-helix | trans | -85.5 | -20.3 | -177 | -126.7 | -157.7 | 100.1 | 0 | 0 | 113.8 | K213 | E209-K213 WeakPolarHBondContact O-CG 3.32Å; E209-K213 WeakPolarHBondContact OE1-CE 3.36Å; E209-K213 IonicContact OE1-NZ 2.73Å; E209-K213 PolarHBondContact OE1-NZ 3.24Å |
| 210 | Q | 49.1 | Very low | 48.8 | Very low | 138 Ų | 138 | 121.4 Ų | 121.4 | 65% | 0.645 | 70% | 0.7 | S | S | * | * | H | α-helix | trans | -78.2 | -40.9 | 173.1 | -106.6 | -179.7 | -8.5 | 0 | 0 | 111.8 | L212 K213 D214 | Q210-L212 VanDerWaalsContact C-N 3.31Å; Q210-L212 PolarHBondContact O-N 3.37Å; Q210-K213 PolarHBondContact O-N 3.33Å; Q210-D214 PolarHBondContact O-N 3.03Å |
| 211 | V | 54.6 | Low | 49.5 | Very low | 81 Ų | 81 | 124.1 Ų | 124.1 | 49% | 0.491 | 70% | 0.702 | S | S | . | * | H | α-helix | trans | -68.4 | -29.8 | -178.5 | 178.2 | 0 | 0 | 0 | 0 | 112.3 | L207 R215 | L207-V211 HydrophobicContact CD2-CG2 4.46Å; L207-V211 WeakPolarHBondContact O-CG2 3.43Å; V211-R215 PolarHBondContact O-N 3.3Å |
| 212 | L | 52.3 | Low | 49.6 | Very low | 134 Ų | 134 | 128.1 Ų | 128.1 | 70% | 0.702 | 70% | 0.702 | S | S | * | * | H | α-helix | trans | -74 | -30.1 | 176.8 | -155.4 | 86.1 | 0 | 0 | 0 | 112.7 | Q210 | Q210-L212 VanDerWaalsContact C-N 3.31Å; Q210-L212 PolarHBondContact O-N 3.37Å |
| 213 | K | 53.9 | Low | 50.5 | Low | 125 Ų | 125 | 133.6 Ų | 133.6 | 54% | 0.543 | 71% | 0.707 | S | S | . | * | H | α-helix | trans | -75.2 | -35.9 | 177.5 | -69.3 | 173.6 | -171.1 | 168.4 | 0 | 111.2 | E209 Q210 R215 L216 | E209-K213 WeakPolarHBondContact O-CG 3.32Å; E209-K213 WeakPolarHBondContact OE1-CE 3.36Å; E209-K213 IonicContact OE1-NZ 2.73Å; E209-K213 PolarHBondContact OE1-NZ 3.24Å; Q210-K213 PolarHBondContact O-N 3.33Å; K213-R215 VanDerWaalsContact C-N 3.33Å; K213-R215 PolarHBondContact O-N 3.31Å; K213-L216 PolarHBondContact O-N 3.45Å |
| 214 | D | 51.9 | Low | 51.1 | Low | 115 Ų | 115 | 131.5 Ų | 131.5 | 62% | 0.615 | 71% | 0.71 | S | S | * | * | H | α-helix | trans | -68.8 | -29.5 | 176 | -70.9 | -17.8 | 0 | 0 | 0 | 112.8 | Q210 | Q210-D214 PolarHBondContact O-N 3.03Å |
| 215 | R | 54.2 | Low | 51.4 | Low | 201 Ų | 201 | 132.3 Ų | 132.3 | 76% | 0.758 | 71% | 0.707 | S | S | * | * | H | α-helix | trans | -75.7 | -18.5 | 174.8 | -98.5 | -170.3 | 175.2 | -137.4 | 0.8 | 115 | V211 K213 | V211-R215 PolarHBondContact O-N 3.3Å; K213-R215 VanDerWaalsContact C-N 3.33Å; K213-R215 PolarHBondContact O-N 3.31Å |
| 216 | L | 52.6 | Low | 51.5 | Low | 138 Ų | 138 | 135.2 Ų | 135.2 | 72% | 0.723 | 72% | 0.716 | S | S | * | * | H | α-helix | trans | -89.6 | -23.7 | -179.8 | -157.7 | 118.4 | 0 | 0 | 0 | 112.8 | K213 | K213-L216 PolarHBondContact O-N 3.45Å |
| 217 | V | 55.4 | Low | 51.7 | Low | 101 Ų | 101 | 136.4 Ų | 136.4 | 61% | 0.612 | 72% | 0.719 | S | S | * | * | H | α-helix | trans | -74 | -30.6 | 176.5 | 176.3 | 0 | 0 | 0 | 0 | 111.5 | S219 | V217-S219 VanDerWaalsContact C-N 3.25Å; V217-S219 PolarHBondContact O-N 3.27Å |
| 218 | Q | 50.9 | Low | 52.4 | Low | 164 Ų | 164 | 135.8 Ų | 135.8 | 77% | 0.766 | 72% | 0.723 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79 | -4.7 | -174.7 | -148.6 | 154.6 | 14 | 0 | 0 | 114.5 | ||
| 219 | S | 52 | Low | 52.2 | Low | 100 Ų | 100 | 140.5 Ų | 140.5 | 70% | 0.699 | 74% | 0.735 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95 | -0.6 | -179.2 | -55.5 | 0 | 0 | 0 | 0 | 114.1 | V217 | V217-S219 VanDerWaalsContact C-N 3.25Å; V217-S219 PolarHBondContact O-N 3.27Å |
| 220 | Q | 51.7 | Low | 51.9 | Low | 173 Ų | 173 | 144.2 Ų | 144.2 | 81% | 0.808 | 77% | 0.773 | S | S | * | * | S | Bend | trans | -104.1 | -5.8 | -178.8 | -84.4 | -171.3 | -18.6 | 0 | 0 | 115.4 | ||
| 221 | D | 48.5 | Very low | 52 | Low | 146 Ų | 146 | 144.6 Ų | 144.6 | 78% | 0.781 | 78% | 0.779 | S | S | * | * | S | Bend | trans | -95.7 | 11.4 | -173.6 | -72.4 | -37.5 | 0 | 0 | 0 | 115.1 | ||
| 222 | Q | 49 | Very low | 51.9 | Low | 194 Ų | 194 | 147.9 Ų | 147.9 | 91% | 0.907 | 79% | 0.794 | S | S | * | * | S | Bend | trans | -123.6 | 45.9 | -176.4 | -153.7 | 141.1 | 47 | 0 | 0 | 113.7 | ||
| 223 | E | 52.7 | Low | 51.9 | Low | 192 Ų | 192 | 148.7 Ų | 148.7 | 90% | 0.897 | 80% | 0.799 | S | S | * | * | S | Bend | trans | -148.5 | 70.1 | 162.8 | -158.8 | 179.4 | 116.8 | 0 | 0 | 111 | ||
| 224 | A | 51.8 | Low | 51.7 | Low | 100 Ų | 100 | 150.1 Ų | 150.1 | 83% | 0.826 | 81% | 0.814 | S | S | * | * | trans | -166.9 | 69.5 | 164.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 225 | D | 48.7 | Very low | 51.7 | Low | 149 Ų | 149 | 152.3 Ų | 152.3 | 80% | 0.797 | 83% | 0.827 | S | S | * | * | trans | -161.3 | 78 | 150.9 | -161.6 | 36.3 | 0 | 0 | 0 | 112.1 | ||||
| 226 | V | 50.5 | Low | 51.6 | Low | 147 Ų | 147 | 149 Ų | 149 | 89% | 0.891 | 83% | 0.831 | S | S | * | * | trans | -146.7 | 95.2 | 150.6 | -176.8 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 227 | T | 52.1 | Low | 51.5 | Low | 120 Ų | 120 | 149.8 Ų | 149.8 | 74% | 0.736 | 84% | 0.839 | S | S | * | * | trans | -94.9 | 145.3 | 160.2 | 41.4 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 228 | P | 62.4 | Low | 51.2 | Low | 120 Ų | 120 | 153.5 Ų | 153.5 | 78% | 0.779 | 86% | 0.857 | S | S | * | * | trans | -89 | 139.3 | -176.5 | 35.7 | -30.7 | 0 | 0 | 0 | 111 | ||||
| 229 | E | 51 | Low | 51.2 | Low | 189 Ų | 189 | 152.7 Ų | 152.7 | 88% | 0.883 | 86% | 0.864 | S | S | * | * | trans | -114 | 143.4 | 164.8 | -77.1 | -109.1 | 108.9 | 0 | 0 | 109.5 | ||||
| 230 | C | 44 | Very low | 51.1 | Low | 202 Ų | 202 | 157.5 Ų | 157.5 | 100% | 1.365 | 88% | 0.879 | S | S | * | * | trans | -62.2 | 0 | -159.3 | -60.4 | 0 | 0 | 0 | 0 | 118 |
Retrieved 230 of 230 residues in 216.9 ms
(Link to these results)