| 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 | 42.8 | Very low | 51.7 | Low | 206 Ų | 206 | 108.9 Ų | 108.9 | 100% | 1.015 | 56% | 0.562 | S | S | * | * | 0 | 118.2 | 0 | -158.8 | 144.7 | 140.6 | 0 | 0 | 107 | |||||
| 2 | S | 42.8 | Very low | 52.6 | Low | 63 Ų | 63 | 106.3 Ų | 106.3 | 44% | 0.441 | 57% | 0.568 | S | S | . | * | trans | -70.1 | 138.5 | -159.6 | 172.2 | 0 | 0 | 0 | 0 | 114 | S4 Q5 | S2-S4 PolarHBondContact O-N 3.05Å; S2-S4 PolarHBondContact OG-N 3.38Å; S2-S4 PolarHBondContact OG-OG 3.48Å; S2-Q5 PolarHBondContact O-N 3.28Å; S2-Q5 VanDerWaalsContact O-N 3.13Å | ||
| 3 | L | 49.8 | Very low | 53.6 | Low | 156 Ų | 156 | 102.7 Ų | 102.7 | 82% | 0.817 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -50.9 | -23.9 | 171.6 | -146.5 | 87.6 | 0 | 0 | 0 | 113 | H6 F7 | L3-H6 PolarHBondContact O-N 3Å; L3-F7 PolarHBondContact O-N 3.34Å |
| 4 | S | 44.1 | Very low | 54.3 | Low | 61 Ų | 61 | 103.4 Ų | 103.4 | 43% | 0.427 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -69.8 | -31.6 | 179.7 | 62.7 | 0 | 0 | 0 | 0 | 114.3 | S2 W8 | S2-S4 PolarHBondContact O-N 3.05Å; S2-S4 PolarHBondContact OG-N 3.38Å; S2-S4 PolarHBondContact OG-OG 3.48Å; S4-W8 WeakPolarHBondContact O-CB 3.47Å; S4-W8 PolarHBondContact O-N 3.14Å |
| 5 | Q | 48.7 | Very low | 55.2 | Low | 132 Ų | 132 | 99.3 Ų | 99.3 | 62% | 0.617 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -74.3 | -27.8 | 177.1 | -72 | -175.7 | -63.7 | 0 | 0 | 112.4 | S2 | S2-Q5 PolarHBondContact O-N 3.28Å; S2-Q5 VanDerWaalsContact O-N 3.13Å |
| 6 | H | 53.8 | Low | 56 | Low | 129 Ų | 129 | 97.6 Ų | 97.6 | 60% | 0.597 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -82.8 | -24.2 | -177.8 | -72 | -98.2 | 0 | 0 | 0 | 113.5 | L3 P10 | L3-H6 PolarHBondContact O-N 3Å; H6-P10 WeakPolarHBondContact O-CD 3.33Å; H6-P10 WeakPolarHBondContact O-CG 3.34Å |
| 7 | F | 53 | Low | 56.6 | Low | 142 Ų | 142 | 91.9 Ų | 91.9 | 62% | 0.623 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -100.6 | -45 | -177.4 | -160.5 | -100.1 | 0 | 0 | 0 | 113.1 | L3 P10 V11 | L3-F7 PolarHBondContact O-N 3.34Å; F7-P10 WeakPolarHBondContact O-CD 3.4Å; F7-V11 HydrophobicContact CD1-CG2 4.33Å; F7-V11 HydrophobicContact CE1-CG2 4.22Å; F7-V11 VanDerWaalsContact O-CG2 3.23Å; F7-V11 WeakPolarHBondContact O-CG2 3.5Å; F7-V11 PolarHBondContact O-N 3.44Å |
| 8 | W | 52.7 | Low | 57.4 | Low | 173 Ų | 173 | 92.3 Ų | 92.3 | 66% | 0.655 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -78.2 | -29.4 | -174.8 | -69.5 | 99 | 0 | 0 | 0 | 113.6 | S4 V11 A12 | S4-W8 WeakPolarHBondContact O-CB 3.47Å; S4-W8 PolarHBondContact O-N 3.14Å; W8-V11 PolarHBondContact O-N 3.32Å; W8-A12 WeakPolarHBondContact O-CB 3.3Å; W8-A12 PolarHBondContact O-N 3.21Å |
| 9 | G | 61.2 | Low | 58.1 | Low | 35 Ų | 35 | 90.1 Ų | 90.1 | 36% | 0.361 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -60.5 | -47.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | N13 | G9-N13 PolarHBondContact O-N 3.49Å; G9-N13 PolarHBondContact O-ND2 3.02Å |
| 10 | P | 57.7 | Low | 58.6 | Low | 30 Ų | 30 | 85.9 Ų | 85.9 | 20% | 0.195 | 47% | 0.467 | C | S | . | . | H | α-helix | trans | -67.1 | -39.7 | 172.6 | -25.2 | 35.3 | 0 | 0 | 0 | 114.1 | H6 F7 A12 N13 W14 L59 | H6-P10 WeakPolarHBondContact O-CD 3.33Å; H6-P10 WeakPolarHBondContact O-CG 3.34Å; F7-P10 WeakPolarHBondContact O-CD 3.4Å; P10-A12 VanDerWaalsContact C-N 3.33Å; P10-A12 PolarHBondContact O-N 2.95Å; P10-N13 WeakPolarHBondContact O-CB 3.41Å; P10-N13 PolarHBondContact O-N 3.45Å; P10-N13 VanDerWaalsContact O-N 3.1Å; P10-W14 PolarHBondContact O-N 2.97Å; P10-L59 HydrophobicContact CB-CB 4.25Å; P10-L59 HydrophobicContact CB-CD1 3.63Å; P10-L59 HydrophobicContact CB-CD2 4.4Å; P10-L59 HydrophobicContact CB-CG 4.29Å; P10-L59 HydrophobicContact CG-CD1 3.62Å |
| 11 | V | 62.3 | Low | 59.1 | Low | 71 Ų | 71 | 85.5 Ų | 85.5 | 43% | 0.43 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -64.2 | -37.3 | 178.3 | 171.1 | 0 | 0 | 0 | 0 | 111.6 | F7 W8 N13 W14 | F7-V11 HydrophobicContact CD1-CG2 4.33Å; F7-V11 HydrophobicContact CE1-CG2 4.22Å; F7-V11 VanDerWaalsContact O-CG2 3.23Å; F7-V11 WeakPolarHBondContact O-CG2 3.5Å; F7-V11 PolarHBondContact O-N 3.44Å; W8-V11 PolarHBondContact O-N 3.32Å; V11-N13 VanDerWaalsContact C-N 3.25Å; V11-N13 PolarHBondContact O-N 2.92Å; V11-W14 WeakPolarHBondContact O-CB 3.48Å; V11-W14 PolarHBondContact O-N 3.47Å; V11-W14 VanDerWaalsContact O-N 3.13Å |
| 12 | A | 62.2 | Low | 60.3 | Low | 77 Ų | 77 | 79.5 Ų | 79.5 | 64% | 0.636 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -62.3 | -31.6 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | W8 P10 W14 G15 | W8-A12 WeakPolarHBondContact O-CB 3.3Å; W8-A12 PolarHBondContact O-N 3.21Å; P10-A12 VanDerWaalsContact C-N 3.33Å; P10-A12 PolarHBondContact O-N 2.95Å; A12-W14 VanDerWaalsContact C-N 3.29Å; A12-W14 PolarHBondContact O-N 3.14Å; A12-G15 PolarHBondContact O-N 3.41Å |
| 13 | N | 65.3 | Low | 61.5 | Low | 60 Ų | 60 | 79.4 Ų | 79.4 | 32% | 0.321 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -70.3 | -23.8 | 176.1 | -80.2 | -70.7 | 0 | 0 | 0 | 112.9 | G9 P10 V11 G15 L16 P17 C63 | G9-N13 PolarHBondContact O-N 3.49Å; G9-N13 PolarHBondContact O-ND2 3.02Å; P10-N13 WeakPolarHBondContact O-CB 3.41Å; P10-N13 PolarHBondContact O-N 3.45Å; P10-N13 VanDerWaalsContact O-N 3.1Å; V11-N13 VanDerWaalsContact C-N 3.25Å; V11-N13 PolarHBondContact O-N 2.92Å; N13-G15 PolarHBondContact O-N 2.76Å; N13-L16 PolarHBondContact O-N 3.35Å; N13-P17 WeakPolarHBondContact O-CD 3.41Å; N13-C63 PolarHBondContact O-SG 3.4Å |
| 14 | W | 64.5 | Low | 62.2 | Low | 113 Ų | 113 | 74.6 Ų | 74.6 | 43% | 0.428 | 41% | 0.407 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.6 | -9.2 | 175.3 | -83.8 | 79.6 | 0 | 0 | 0 | 114 | P10 V11 A12 L16 P17 I18 | P10-W14 PolarHBondContact O-N 2.97Å; V11-W14 WeakPolarHBondContact O-CB 3.48Å; V11-W14 PolarHBondContact O-N 3.47Å; V11-W14 VanDerWaalsContact O-N 3.13Å; A12-W14 VanDerWaalsContact C-N 3.29Å; A12-W14 PolarHBondContact O-N 3.14Å; W14-L16 PolarHBondContact O-N 2.96Å; W14-P17 HydrophobicContact CE3-CB 4.2Å; W14-P17 HydrophobicContact CE3-CG 4.43Å; W14-P17 WeakPolarHBondContact O-CD 3.43Å; W14-I18 WeakPolarHBondContact O-CB 3.46Å; W14-I18 VanDerWaalsContact O-CG1 3.25Å; W14-I18 WeakPolarHBondContact O-CG1 3.37Å; W14-I18 PolarHBondContact O-N 3.48Å |
| 15 | G | 67.6 | Low | 63.1 | Low | 41 Ų | 41 | 80.6 Ų | 80.6 | 42% | 0.423 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -57.9 | -35.9 | 171.5 | 0 | 0 | 0 | 0 | 0 | 113 | A12 N13 A19 | A12-G15 PolarHBondContact O-N 3.41Å; N13-G15 PolarHBondContact O-N 2.76Å; G15-A19 VanDerWaalsContact O-CB 3.24Å; G15-A19 WeakPolarHBondContact O-CB 3.41Å; G15-A19 PolarHBondContact O-N 3.43Å |
| 16 | L | 68.5 | Low | 63.8 | Low | 72 Ų | 72 | 79.6 Ų | 79.6 | 38% | 0.377 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -68.3 | -50.7 | 178.2 | -72.3 | 171.3 | 0 | 0 | 0 | 112.5 | N13 W14 I18 A19 A20 | N13-L16 PolarHBondContact O-N 3.35Å; W14-L16 PolarHBondContact O-N 2.96Å; L16-I18 VanDerWaalsContact C-N 3.33Å; L16-I18 PolarHBondContact O-N 3.17Å; L16-A19 PolarHBondContact O-N 2.92Å; L16-A20 WeakPolarHBondContact O-CB 3.33Å; L16-A20 PolarHBondContact O-N 3.27Å |
| 17 | P | 65.1 | Low | 63.9 | Low | 1 Ų | 1 | 76.1 Ų | 76.1 | 1% | 0.006 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -56.5 | -42.8 | 171.8 | -28.3 | 30.4 | 0 | 0 | 0 | 113.5 | N13 W14 A20 I21 C63 T66 | N13-P17 WeakPolarHBondContact O-CD 3.41Å; W14-P17 HydrophobicContact CE3-CB 4.2Å; W14-P17 HydrophobicContact CE3-CG 4.43Å; W14-P17 WeakPolarHBondContact O-CD 3.43Å; P17-A20 PolarHBondContact O-N 3.42Å; P17-I21 WeakPolarHBondContact O-CB 3.48Å; P17-I21 WeakPolarHBondContact O-CD1 3.46Å; P17-I21 WeakPolarHBondContact O-CG1 3.22Å; P17-I21 PolarHBondContact O-N 2.91Å; P17-C63 WeakPolarHBondContact CD-SG 3.33Å; P17-C63 HydrophobicContact CG-CB 4.16Å; P17-C63 WeakPolarHBondContact CG-SG 3.34Å; P17-T66 HydrophobicContact CB-CG2 4.09Å |
| 18 | I | 71 | Confident | 64.1 | Low | 99 Ų | 99 | 70.7 Ų | 70.7 | 51% | 0.508 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -66.3 | -42.4 | 179.5 | -67.7 | 169.5 | 0 | 0 | 0 | 110.5 | W14 L16 I21 T22 | W14-I18 WeakPolarHBondContact O-CB 3.46Å; W14-I18 VanDerWaalsContact O-CG1 3.25Å; W14-I18 WeakPolarHBondContact O-CG1 3.37Å; W14-I18 PolarHBondContact O-N 3.48Å; L16-I18 VanDerWaalsContact C-N 3.33Å; L16-I18 PolarHBondContact O-N 3.17Å; I18-I21 PolarHBondContact O-N 2.91Å; I18-T22 WeakPolarHBondContact O-CB 3.44Å; I18-T22 PolarHBondContact O-N 3.48Å; I18-T22 PolarHBondContact O-OG1 2.78Å |
| 19 | A | 71.3 | Confident | 64.3 | Low | 50 Ų | 50 | 68.9 Ų | 68.9 | 41% | 0.413 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -61.7 | -43.5 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | G15 L16 T22 D23 | G15-A19 VanDerWaalsContact O-CB 3.24Å; G15-A19 WeakPolarHBondContact O-CB 3.41Å; G15-A19 PolarHBondContact O-N 3.43Å; L16-A19 PolarHBondContact O-N 2.92Å; A19-T22 PolarHBondContact O-N 3.16Å; A19-D23 WeakPolarHBondContact O-CB 3.23Å; A19-D23 PolarHBondContact O-N 3.08Å |
| 20 | A | 68.1 | Low | 64.1 | Low | 7 Ų | 7 | 73.3 Ų | 73.3 | 6% | 0.058 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -62.2 | -44.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | L16 P17 T22 D23 M24 N67 A70 | L16-A20 WeakPolarHBondContact O-CB 3.33Å; L16-A20 PolarHBondContact O-N 3.27Å; P17-A20 PolarHBondContact O-N 3.42Å; A20-T22 VanDerWaalsContact C-N 3.32Å; A20-T22 PolarHBondContact O-N 3.02Å; A20-D23 PolarHBondContact O-N 3.39Å; A20-M24 WeakPolarHBondContact O-CG 3.27Å; A20-M24 PolarHBondContact O-N 3.27Å; A20-M24 VanDerWaalsContact O-N 3.11Å; A20-N67 WeakPolarHBondContact CB-OD1 3.34Å; A20-A70 HydrophobicContact CB-CB 4.07Å |
| 21 | I | 69.6 | Low | 64.4 | Low | 78 Ų | 78 | 73 Ų | 73 | 40% | 0.4 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -63.5 | -39.6 | 175.4 | -68.2 | 161.9 | 0 | 0 | 0 | 111.1 | P17 I18 M24 | P17-I21 WeakPolarHBondContact O-CB 3.48Å; P17-I21 WeakPolarHBondContact O-CD1 3.46Å; P17-I21 WeakPolarHBondContact O-CG1 3.22Å; P17-I21 PolarHBondContact O-N 2.91Å; I18-I21 PolarHBondContact O-N 2.91Å; I21-M24 HydrophobicContact CB-CE 4.02Å; I21-M24 HydrophobicContact CG1-CE 3.83Å; I21-M24 HydrophobicContact CG2-CE 4.01Å; I21-M24 WeakPolarHBondContact O-CB 3.17Å; I21-M24 PolarHBondContact O-N 2.67Å |
| 22 | T | 68.3 | Low | 64.6 | Low | 80 Ų | 80 | 72.6 Ų | 72.6 | 49% | 0.491 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -67.4 | -38.9 | 177.5 | -56.1 | 0 | 0 | 0 | 0 | 111.2 | I18 A19 A20 M24 K25 | I18-T22 WeakPolarHBondContact O-CB 3.44Å; I18-T22 PolarHBondContact O-N 3.48Å; I18-T22 PolarHBondContact O-OG1 2.78Å; A19-T22 PolarHBondContact O-N 3.16Å; A20-T22 VanDerWaalsContact C-N 3.32Å; A20-T22 PolarHBondContact O-N 3.02Å; T22-M24 PolarHBondContact O-N 3.4Å; T22-K25 PolarHBondContact O-N 2.98Å |
| 23 | D | 67.8 | Low | 64.8 | Low | 60 Ų | 60 | 70.5 Ų | 70.5 | 32% | 0.321 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -65.7 | -24.6 | 174.3 | -90.1 | -2.7 | 0 | 0 | 0 | 112.2 | A19 A20 K25 K26 Q74 | A19-D23 WeakPolarHBondContact O-CB 3.23Å; A19-D23 PolarHBondContact O-N 3.08Å; A20-D23 PolarHBondContact O-N 3.39Å; D23-K25 PolarHBondContact O-N 3.47Å; D23-K25 VanDerWaalsContact O-N 3.13Å; D23-K26 PolarHBondContact O-N 3.39Å; D23-K26 WeakPolarHBondContact OD1-CD 3.13Å; D23-K26 WeakPolarHBondContact OD1-CE 3.38Å; D23-K26 IonicContact OD1-NZ 2.75Å; D23-K26 PolarHBondContact OD1-NZ 3.19Å; D23-Q74 PolarHBondContact O-NE2 3.08Å |
| 24 | M | 62.9 | Low | 65.2 | Low | 55 Ų | 55 | 78 Ų | 78 | 27% | 0.271 | 41% | 0.408 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.7 | -19 | 175.4 | -64.6 | -161.7 | -76.2 | 0 | 0 | 113.5 | A20 I21 T22 A70 Q74 R77 | A20-M24 WeakPolarHBondContact O-CG 3.27Å; A20-M24 PolarHBondContact O-N 3.27Å; A20-M24 VanDerWaalsContact O-N 3.11Å; I21-M24 HydrophobicContact CB-CE 4.02Å; I21-M24 HydrophobicContact CG1-CE 3.83Å; I21-M24 HydrophobicContact CG2-CE 4.01Å; I21-M24 WeakPolarHBondContact O-CB 3.17Å; I21-M24 PolarHBondContact O-N 2.67Å; T22-M24 PolarHBondContact O-N 3.4Å; M24-A70 HydrophobicContact CE-CB 4.35Å; M24-A70 HydrophobicContact CG-CB 4.29Å; M24-A70 HydrophobicContact SD-CB 3.91Å; M24-Q74 VanDerWaalsContact CA-NE2 3.3Å; M24-Q74 HydrophobicContact CG-CG 3.95Å; M24-R77 PolarHBondContact O-NH1 3.44Å |
| 25 | K | 62.8 | Low | 65.7 | Low | 188 Ų | 188 | 78.1 Ų | 78.1 | 82% | 0.817 | 42% | 0.415 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.5 | -12.1 | 176.7 | -64.5 | -173.1 | 174.4 | -175.6 | 0 | 113.5 | T22 D23 | T22-K25 PolarHBondContact O-N 2.98Å; D23-K25 PolarHBondContact O-N 3.47Å; D23-K25 VanDerWaalsContact O-N 3.13Å |
| 26 | K | 64.2 | Low | 66.1 | Low | 111 Ų | 111 | 76.8 Ų | 76.8 | 48% | 0.483 | 40% | 0.399 | S | S | . | . | S | Bend | trans | -74.8 | 149 | 178.2 | -70.2 | -176.4 | 179.7 | 155.9 | 0 | 111 | D23 | D23-K26 PolarHBondContact O-N 3.39Å; D23-K26 WeakPolarHBondContact OD1-CD 3.13Å; D23-K26 WeakPolarHBondContact OD1-CE 3.38Å; D23-K26 IonicContact OD1-NZ 2.75Å; D23-K26 PolarHBondContact OD1-NZ 3.19Å |
| 27 | S | 56.3 | Low | 66.6 | Low | 56 Ų | 56 | 80.4 Ų | 80.4 | 39% | 0.392 | 41% | 0.412 | S | S | . | . | trans | -58.5 | 135.4 | 179.4 | 179.1 | 0 | 0 | 0 | 0 | 110.3 | E29 I30 | S27-E29 PolarHBondContact O-N 2.76Å; S27-E29 VanDerWaalsContact O-N 3.09Å; S27-I30 WeakPolarHBondContact O-CG1 3.37Å; S27-I30 PolarHBondContact O-N 3.46Å | ||
| 28 | P | 57.7 | Low | 67.4 | Low | 28 Ų | 28 | 83 Ų | 83 | 18% | 0.182 | 43% | 0.433 | C | S | . | . | G | 310 helix | trans | -59.6 | -19.7 | -179.3 | 22.9 | -32.7 | 0 | 0 | 0 | 113.8 | I30 I31 L78 | P28-I30 PolarHBondContact O-N 2.87Å; P28-I31 PolarHBondContact O-N 3.32Å; P28-L78 WeakPolarHBondContact O-CD1 3.25Å |
| 29 | E | 55 | Low | 67.8 | Low | 135 Ų | 135 | 81.1 Ų | 81.1 | 63% | 0.631 | 42% | 0.424 | S | S | * | . | G | 310 helix | trans | -65.4 | -25.7 | 174.5 | -70.1 | -175.2 | 166 | 0 | 0 | 113.8 | S27 Y81 | S27-E29 PolarHBondContact O-N 2.76Å; S27-E29 VanDerWaalsContact O-N 3.09Å; E29-Y81 HydrophobicContact CG-CE1 4.07Å; E29-Y81 HydrophobicContact CG-CE2 4.21Å; E29-Y81 WeakPolarHBondContact CG-OH 3.41Å; E29-Y81 PolarHBondContact OE1-OH 3.32Å |
| 30 | I | 59.1 | Low | 68.4 | Low | 127 Ų | 127 | 79.5 Ų | 79.5 | 65% | 0.651 | 41% | 0.409 | S | S | * | . | G | 310 helix | trans | -93 | -9.6 | -178.8 | -24.5 | 169.8 | 0 | 0 | 0 | 110.9 | S27 P28 S32 | S27-I30 WeakPolarHBondContact O-CG1 3.37Å; S27-I30 PolarHBondContact O-N 3.46Å; P28-I30 PolarHBondContact O-N 2.87Å; I30-S32 PolarHBondContact O-N 3.24Å |
| 31 | I | 62.2 | Low | 69.1 | Low | 24 Ų | 24 | 82 Ų | 82 | 12% | 0.123 | 43% | 0.425 | C | S | . | . | trans | -80.6 | 106.9 | -176.8 | -58.7 | -176.9 | 0 | 0 | 0 | 108.7 | P28 G33 Q74 L78 | P28-I31 PolarHBondContact O-N 3.32Å; I31-G33 PolarHBondContact O-N 3.46Å; I31-Q74 HydrophobicContact CD1-CB 4.26Å; I31-Q74 HydrophobicContact CD1-CG 4.23Å; I31-L78 HydrophobicContact CG2-CD2 4.38Å; I31-L78 WeakPolarHBondContact O-CD1 3.47Å; I31-L78 WeakPolarHBondContact O-CD2 3.46Å | ||
| 32 | S | 67.1 | Low | 69.8 | Low | 63 Ų | 63 | 83 Ų | 83 | 44% | 0.441 | 43% | 0.425 | S | S | . | . | trans | -73.6 | 109.3 | 174 | 177 | 0 | 0 | 0 | 0 | 110.5 | I30 R34 M35 T36 | I30-S32 PolarHBondContact O-N 3.24Å; S32-R34 PolarHBondContact O-N 3.01Å; S32-R34 VanDerWaalsContact O-N 3.16Å; S32-M35 WeakPolarHBondContact O-CA 3.4Å; S32-M35 WeakPolarHBondContact O-CB 3.41Å; S32-M35 PolarHBondContact O-N 3.44Å; S32-T36 PolarHBondContact O-N 3.09Å; S32-T36 PolarHBondContact O-OG1 3.44Å | ||
| 33 | G | 67.6 | Low | 70.5 | Confident | 33 Ų | 33 | 79.1 Ų | 79.1 | 34% | 0.34 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -57.6 | -30.7 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | I31 M35 F37 | I31-G33 PolarHBondContact O-N 3.46Å; G33-M35 VanDerWaalsContact C-N 3.34Å; G33-F37 WeakPolarHBondContact O-CB 3.39Å; G33-F37 PolarHBondContact O-N 3.01Å |
| 34 | R | 73.2 | Confident | 71.4 | Confident | 217 Ų | 217 | 80.6 Ų | 80.6 | 82% | 0.819 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -65.3 | -37.8 | 173.6 | -68 | 177.3 | 69.9 | 178.9 | 1.7 | 111.8 | S32 A38 | S32-R34 PolarHBondContact O-N 3.01Å; S32-R34 VanDerWaalsContact O-N 3.16Å; R34-A38 WeakPolarHBondContact O-CB 3.36Å; R34-A38 PolarHBondContact O-N 3.05Å |
| 35 | M | 74.8 | Confident | 72.5 | Confident | 115 Ų | 115 | 83.6 Ų | 83.6 | 57% | 0.567 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -72.4 | -42.9 | 178.3 | -171 | 174.3 | 176 | 0 | 0 | 111.3 | S32 G33 F37 A38 L39 | S32-M35 WeakPolarHBondContact O-CA 3.4Å; S32-M35 WeakPolarHBondContact O-CB 3.41Å; S32-M35 PolarHBondContact O-N 3.44Å; G33-M35 VanDerWaalsContact C-N 3.34Å; M35-F37 VanDerWaalsContact C-N 3.32Å; M35-F37 PolarHBondContact O-N 2.95Å; M35-A38 PolarHBondContact O-N 3.3Å; M35-L39 HydrophobicContact CE-CD1 4.26Å; M35-L39 HydrophobicContact CG-CD1 4.04Å; M35-L39 WeakPolarHBondContact O-CB 3.36Å; M35-L39 WeakPolarHBondContact O-CG 3.47Å; M35-L39 PolarHBondContact O-N 3.2Å |
| 36 | T | 76.4 | Confident | 73.5 | Confident | 14 Ų | 14 | 77.6 Ų | 77.6 | 9% | 0.086 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -58.5 | -43.8 | 174.1 | -52.7 | 0 | 0 | 0 | 0 | 111.5 | S32 L39 C40 Q71 | S32-T36 PolarHBondContact O-N 3.09Å; S32-T36 PolarHBondContact O-OG1 3.44Å; T36-L39 PolarHBondContact O-N 3.04Å; T36-C40 PolarHBondContact O-N 3.01Å; T36-C40 PolarHBondContact O-SG 3.24Å; T36-Q71 HydrophobicContact CG2-CB 3.92Å; T36-Q71 HydrophobicContact CG2-CG 4.46Å; T36-Q71 WeakPolarHBondContact CG2-O 3.46Å; T36-Q71 PolarHBondContact O-OE1 2.9Å |
| 37 | F | 77.9 | Confident | 74.4 | Confident | 148 Ų | 148 | 73.4 Ų | 73.4 | 65% | 0.649 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -65.3 | -45.5 | 176.4 | -177.3 | -102.3 | 0 | 0 | 0 | 112.3 | G33 M35 L39 C40 C41 | G33-F37 WeakPolarHBondContact O-CB 3.39Å; G33-F37 PolarHBondContact O-N 3.01Å; M35-F37 VanDerWaalsContact C-N 3.32Å; M35-F37 PolarHBondContact O-N 2.95Å; F37-L39 VanDerWaalsContact C-N 3.29Å; F37-L39 PolarHBondContact O-N 3.46Å; F37-C40 PolarHBondContact O-N 3.25Å; F37-C41 PolarHBondContact O-N 3.24Å; F37-C41 PolarHBondContact O-SG 3.36Å |
| 38 | A | 81.7 | Confident | 75.9 | Confident | 55 Ų | 55 | 79 Ų | 79 | 46% | 0.455 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -58.9 | -41.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112 | R34 M35 C41 Y42 | R34-A38 WeakPolarHBondContact O-CB 3.36Å; R34-A38 PolarHBondContact O-N 3.05Å; M35-A38 PolarHBondContact O-N 3.3Å; A38-C41 PolarHBondContact O-N 3.26Å; A38-Y42 WeakPolarHBondContact O-CB 3.33Å; A38-Y42 PolarHBondContact O-N 3.34Å |
| 39 | L | 80.4 | Confident | 77.2 | Confident | 59 Ų | 59 | 83.5 Ų | 83.5 | 31% | 0.309 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -74 | -29 | 179.6 | -74.9 | 166.9 | 0 | 0 | 0 | 113.4 | M35 T36 F37 S43 | M35-L39 HydrophobicContact CE-CD1 4.26Å; M35-L39 HydrophobicContact CG-CD1 4.04Å; M35-L39 WeakPolarHBondContact O-CB 3.36Å; M35-L39 WeakPolarHBondContact O-CG 3.47Å; M35-L39 PolarHBondContact O-N 3.2Å; T36-L39 PolarHBondContact O-N 3.04Å; F37-L39 VanDerWaalsContact C-N 3.29Å; F37-L39 PolarHBondContact O-N 3.46Å; L39-S43 WeakPolarHBondContact O-CB 3.34Å; L39-S43 PolarHBondContact O-N 3.17Å; L39-S43 PolarHBondContact O-OG 3.47Å |
| 40 | C | 82.4 | Confident | 78.5 | Confident | 16 Ų | 16 | 77.1 Ų | 77.1 | 11% | 0.108 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -64.4 | -50.9 | 168.8 | -79.2 | 0 | 0 | 0 | 0 | 110.4 | T36 F37 Y42 S43 L44 | T36-C40 PolarHBondContact O-N 3.01Å; T36-C40 PolarHBondContact O-SG 3.24Å; F37-C40 PolarHBondContact O-N 3.25Å; C40-Y42 VanDerWaalsContact C-N 3.27Å; C40-Y42 PolarHBondContact O-N 3.46Å; C40-S43 PolarHBondContact O-N 3.34Å; C40-L44 PolarHBondContact O-N 3.03Å |
| 41 | C | 84.4 | Confident | 79.5 | Confident | 59 Ų | 59 | 76.9 Ų | 76.9 | 40% | 0.399 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -57.4 | -41 | 176.4 | -70.1 | 0 | 0 | 0 | 0 | 112.4 | F37 A38 L45 | F37-C41 PolarHBondContact O-N 3.24Å; F37-C41 PolarHBondContact O-SG 3.36Å; A38-C41 PolarHBondContact O-N 3.26Å; C41-L45 PolarHBondContact O-N 3.28Å; C41-L45 VanDerWaalsContact O-N 3.17Å |
| 42 | Y | 83.3 | Confident | 80.6 | Confident | 99 Ų | 99 | 82.8 Ų | 82.8 | 39% | 0.388 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -60.9 | -46.1 | 174 | 177 | -98.6 | 0 | 0 | 0 | 111.8 | A38 C40 L45 F46 H64 | A38-Y42 WeakPolarHBondContact O-CB 3.33Å; A38-Y42 PolarHBondContact O-N 3.34Å; C40-Y42 VanDerWaalsContact C-N 3.27Å; C40-Y42 PolarHBondContact O-N 3.46Å; Y42-L45 PolarHBondContact O-N 3.02Å; Y42-F46 HydrophobicContact CD1-CD2 4.41Å; Y42-F46 HydrophobicContact CD2-CD2 4Å; Y42-F46 AromaticContact CD2-CE2 3.82Å; Y42-F46 HydrophobicContact CD2-CE2 3.82Å; Y42-F46 HydrophobicContact CE1-CD2 4.09Å; Y42-F46 HydrophobicContact CE1-CE2 4.21Å; Y42-F46 AromaticContact CE2-CD2 3.66Å; Y42-F46 HydrophobicContact CE2-CD2 3.66Å; Y42-F46 AromaticContact CE2-CE2 3.12Å; Y42-F46 HydrophobicContact CE2-CE2 3.12Å; Y42-F46 AromaticContact CE2-CZ 3.88Å; Y42-F46 HydrophobicContact CE2-CZ 3.88Å; Y42-F46 HydrophobicContact CG-CD2 4.36Å; Y42-F46 AromaticContact CZ-CD2 3.68Å; Y42-F46 AromaticContact CZ-CE2 3.35Å; Y42-F46 AromaticContact CZ-CZ 3.81Å; Y42-F46 WeakPolarHBondContact O-CD2 3.48Å; Y42-F46 PolarHBondContact O-N 3.43Å; Y42-F46 VanDerWaalsContact O-N 3.12Å; Y42-F46 WeakPolarHBondContact OH-CE2 3.43Å; Y42-F46 WeakPolarHBondContact OH-CZ 3.32Å; Y42-H64 AromaticContact CE1-CE1 3.79Å |
| 43 | S | 83.2 | Confident | 81.3 | Confident | 0 Ų | 0 | 82.4 Ų | 82.4 | 0% | 0 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -64 | -43.5 | -179.9 | -59.2 | 0 | 0 | 0 | 0 | 112.1 | L39 C40 L45 F46 M47 N67 | L39-S43 WeakPolarHBondContact O-CB 3.34Å; L39-S43 PolarHBondContact O-N 3.17Å; L39-S43 PolarHBondContact O-OG 3.47Å; C40-S43 PolarHBondContact O-N 3.34Å; S43-L45 VanDerWaalsContact C-N 3.34Å; S43-L45 PolarHBondContact O-N 3.49Å; S43-F46 PolarHBondContact O-N 2.95Å; S43-M47 WeakPolarHBondContact O-CB 3.46Å; S43-M47 VanDerWaalsContact O-CG 3.3Å; S43-M47 WeakPolarHBondContact O-CG 3.4Å; S43-M47 PolarHBondContact O-N 3.04Å; S43-N67 PolarHBondContact OG-ND2 3.21Å |
| 44 | L | 86.8 | Confident | 81.9 | Confident | 91 Ų | 91 | 88.5 Ų | 88.5 | 48% | 0.476 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -58.6 | -43.7 | 175.1 | -73 | 172.2 | 0 | 0 | 0 | 112.8 | C40 F46 M47 R48 E68 | C40-L44 PolarHBondContact O-N 3.03Å; L44-F46 VanDerWaalsContact C-N 3.34Å; L44-F46 PolarHBondContact O-N 2.93Å; L44-M47 PolarHBondContact O-N 2.92Å; L44-R48 PolarHBondContact O-N 3.13Å; L44-E68 WeakPolarHBondContact CD2-OE1 3.47Å; L44-E68 VanDerWaalsContact CD2-OE2 3.23Å; L44-E68 WeakPolarHBondContact CD2-OE2 3.3Å; L44-E68 WeakPolarHBondContact CG-OE1 3.5Å; L44-E68 VanDerWaalsContact CG-OE2 3.27Å; L44-E68 WeakPolarHBondContact CG-OE2 3.36Å; L44-E68 PolarHBondContact N-OE2 3.37Å |
| 45 | L | 87.2 | Confident | 82.3 | Confident | 117 Ų | 117 | 84.1 Ų | 84.1 | 61% | 0.613 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -62.5 | -44.7 | 179.4 | -175.2 | 66 | 0 | 0 | 0 | 110.8 | C41 Y42 S43 R48 F49 | C41-L45 PolarHBondContact O-N 3.28Å; C41-L45 VanDerWaalsContact O-N 3.17Å; Y42-L45 PolarHBondContact O-N 3.02Å; S43-L45 VanDerWaalsContact C-N 3.34Å; S43-L45 PolarHBondContact O-N 3.49Å; L45-R48 PolarHBondContact O-N 2.91Å; L45-F49 PolarHBondContact O-N 3.46Å |
| 46 | F | 82.3 | Confident | 82.5 | Confident | 62 Ų | 62 | 84.3 Ų | 84.3 | 27% | 0.272 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -69.9 | -35.6 | 178.2 | -89.4 | -100.4 | 0 | 0 | 0 | 112.9 | Y42 S43 L44 F49 A50 L60 H64 | Y42-F46 HydrophobicContact CD1-CD2 4.41Å; Y42-F46 HydrophobicContact CD2-CD2 4Å; Y42-F46 AromaticContact CD2-CE2 3.82Å; Y42-F46 HydrophobicContact CD2-CE2 3.82Å; Y42-F46 HydrophobicContact CE1-CD2 4.09Å; Y42-F46 HydrophobicContact CE1-CE2 4.21Å; Y42-F46 AromaticContact CE2-CD2 3.66Å; Y42-F46 HydrophobicContact CE2-CD2 3.66Å; Y42-F46 AromaticContact CE2-CE2 3.12Å; Y42-F46 HydrophobicContact CE2-CE2 3.12Å; Y42-F46 AromaticContact CE2-CZ 3.88Å; Y42-F46 HydrophobicContact CE2-CZ 3.88Å; Y42-F46 HydrophobicContact CG-CD2 4.36Å; Y42-F46 AromaticContact CZ-CD2 3.68Å; Y42-F46 AromaticContact CZ-CE2 3.35Å; Y42-F46 AromaticContact CZ-CZ 3.81Å; Y42-F46 WeakPolarHBondContact O-CD2 3.48Å; Y42-F46 PolarHBondContact O-N 3.43Å; Y42-F46 VanDerWaalsContact O-N 3.12Å; Y42-F46 WeakPolarHBondContact OH-CE2 3.43Å; Y42-F46 WeakPolarHBondContact OH-CZ 3.32Å; S43-F46 PolarHBondContact O-N 2.95Å; L44-F46 VanDerWaalsContact C-N 3.34Å; L44-F46 PolarHBondContact O-N 2.93Å; F46-F49 PolarHBondContact O-N 3.4Å; F46-A50 VanDerWaalsContact O-CB 3.28Å; F46-A50 WeakPolarHBondContact O-CB 3.44Å; F46-A50 PolarHBondContact O-N 2.87Å; F46-L60 HydrophobicContact CD1-CD2 4.49Å; F46-H64 VanDerWaalsContact CB-CD2 3.46Å; F46-H64 WeakPolarHBondContact CB-CD2 3.5Å; F46-H64 WeakPolarHBondContact CB-NE2 3.39Å; F46-H64 AromaticContact CD1-CE1 3.99Å; F46-H64 AromaticContact CD1-NE2 3.49Å; F46-H64 WeakPolarHBondContact CD1-NE2 3.18Å; F46-H64 AromaticContact CG-CE1 3.75Å; F46-H64 AromaticContact CG-NE2 3.59Å |
| 47 | M | 84.2 | Confident | 82.7 | Confident | 23 Ų | 23 | 86.9 Ų | 86.9 | 11% | 0.113 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -60.9 | -44.1 | 172 | -75.8 | 172.8 | 62 | 0 | 0 | 111.4 | S43 L44 A50 Y51 F61 H64 L65 | S43-M47 WeakPolarHBondContact O-CB 3.46Å; S43-M47 VanDerWaalsContact O-CG 3.3Å; S43-M47 WeakPolarHBondContact O-CG 3.4Å; S43-M47 PolarHBondContact O-N 3.04Å; L44-M47 PolarHBondContact O-N 2.92Å; M47-A50 PolarHBondContact O-N 3.21Å; M47-Y51 WeakPolarHBondContact O-CB 3.22Å; M47-Y51 PolarHBondContact O-N 3.34Å; M47-F61 HydrophobicContact CB-CD2 3.86Å; M47-F61 HydrophobicContact CB-CE2 3.86Å; M47-F61 HydrophobicContact CE-CD2 4.32Å; M47-F61 HydrophobicContact CE-CE1 4.36Å; M47-F61 HydrophobicContact CE-CE2 3.56Å; M47-F61 HydrophobicContact CE-CZ 3.58Å; M47-F61 HydrophobicContact CG-CD2 4.06Å; M47-F61 HydrophobicContact CG-CE2 4.16Å; M47-H64 HydrophobicContact CG-CB 3.57Å; M47-H64 HydrophobicContact SD-CB 4.33Å; M47-L65 HydrophobicContact CE-CB 4.1Å; M47-L65 HydrophobicContact CE-CD1 3.58Å; M47-L65 HydrophobicContact CE-CG 4.43Å; M47-L65 HydrophobicContact SD-CB 4.19Å; M47-L65 HydrophobicContact SD-CD1 4.35Å |
| 48 | R | 86.8 | Confident | 82.7 | Confident | 175 Ų | 175 | 86.9 Ų | 86.9 | 66% | 0.66 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -62.8 | -42.6 | 175.5 | -179.3 | 175 | 174.3 | 83.8 | -3.4 | 111.8 | L44 L45 Y51 K52 | L44-R48 PolarHBondContact O-N 3.13Å; L45-R48 PolarHBondContact O-N 2.91Å; R48-Y51 PolarHBondContact O-N 3.02Å; R48-K52 WeakPolarHBondContact O-CB 3.46Å; R48-K52 WeakPolarHBondContact O-CG 3.39Å; R48-K52 PolarHBondContact O-N 3.44Å; R48-K52 VanDerWaalsContact O-N 3.09Å |
| 49 | F | 85.6 | Confident | 82.7 | Confident | 121 Ų | 121 | 88.5 Ų | 88.5 | 53% | 0.531 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -61.9 | -49.4 | 175.8 | 175.3 | -101.5 | 0 | 0 | 0 | 111.7 | L45 F46 Y51 K52 V53 L60 | L45-F49 PolarHBondContact O-N 3.46Å; F46-F49 PolarHBondContact O-N 3.4Å; F49-Y51 PolarHBondContact O-N 3.02Å; F49-K52 PolarHBondContact O-N 3.23Å; F49-K52 VanDerWaalsContact O-N 3.08Å; F49-V53 HydrophobicContact CZ-CG2 4.28Å; F49-V53 PolarHBondContact O-N 3.33Å; F49-L60 HydrophobicContact CD1-CD2 4.3Å |
| 50 | A | 82.5 | Confident | 82.6 | Confident | 1 Ų | 1 | 86.5 Ų | 86.5 | 1% | 0.008 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -58.3 | -34.7 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113 | F46 M47 N57 L60 F61 | F46-A50 VanDerWaalsContact O-CB 3.28Å; F46-A50 WeakPolarHBondContact O-CB 3.44Å; F46-A50 PolarHBondContact O-N 2.87Å; M47-A50 PolarHBondContact O-N 3.21Å; A50-N57 PolarHBondContact O-N 3.36Å; A50-N57 VanDerWaalsContact O-N 3.16Å; A50-L60 HydrophobicContact CB-CB 4.05Å; A50-L60 HydrophobicContact CB-CD2 3.97Å; A50-L60 HydrophobicContact CB-CG 4.08Å; A50-F61 HydrophobicContact CB-CB 4.03Å |
| 51 | Y | 79.3 | Confident | 82.6 | Confident | 122 Ų | 122 | 88.3 Ų | 88.3 | 48% | 0.478 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -75.6 | -36 | 176.2 | -175.2 | -93.6 | 0 | 0 | 0 | 113.4 | M47 R48 F49 W58 | M47-Y51 WeakPolarHBondContact O-CB 3.22Å; M47-Y51 PolarHBondContact O-N 3.34Å; R48-Y51 PolarHBondContact O-N 3.02Å; F49-Y51 PolarHBondContact O-N 3.02Å; Y51-W58 HydrophobicContact CE2-CH2 4.43Å |
| 52 | K | 85.7 | Confident | 82.5 | Confident | 149 Ų | 149 | 87.3 Ų | 87.3 | 65% | 0.648 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -82.3 | -28.9 | -176.4 | -73 | -71.3 | -72.6 | 177.7 | 0 | 113.6 | R48 F49 | R48-K52 WeakPolarHBondContact O-CB 3.46Å; R48-K52 WeakPolarHBondContact O-CG 3.39Å; R48-K52 PolarHBondContact O-N 3.44Å; R48-K52 VanDerWaalsContact O-N 3.09Å; F49-K52 PolarHBondContact O-N 3.23Å; F49-K52 VanDerWaalsContact O-N 3.08Å |
| 53 | V | 82 | Confident | 82.5 | Confident | 54 Ų | 54 | 82.7 Ų | 82.7 | 33% | 0.327 | 39% | 0.39 | S | S | . | . | S | Bend | trans | -67.4 | 139.6 | 178.2 | 91.6 | 0 | 0 | 0 | 0 | 110.2 | F49 P55 R56 N57 | F49-V53 HydrophobicContact CZ-CG2 4.28Å; F49-V53 PolarHBondContact O-N 3.33Å; V53-P55 CarbonylContact O-C 3.43Å; V53-R56 VanDerWaalsContact O-CA 3.25Å; V53-R56 WeakPolarHBondContact O-CA 3.31Å; V53-R56 PolarHBondContact O-N 3.02Å; V53-N57 HydrophobicContact CG1-CB 4.23Å |
| 54 | Q | 80.2 | Confident | 82.5 | Confident | 162 Ų | 162 | 82.8 Ų | 82.8 | 76% | 0.757 | 39% | 0.39 | S | S | * | . | S | Bend | trans | -117.7 | 133.1 | 173.7 | -83.3 | -152.8 | -13.2 | 0 | 0 | 111.5 | ||
| 55 | P | 80.6 | Confident | 82.4 | Confident | 125 Ų | 125 | 82.1 Ų | 82.1 | 81% | 0.812 | 39% | 0.387 | S | S | * | . | S | Bend | cis | -65.4 | 147 | -4.8 | 27.9 | -34.2 | 0 | 0 | 0 | 112.7 | V53 N57 | V53-P55 CarbonylContact O-C 3.43Å; P55-N57 PolarHBondContact O-N 2.96Å |
| 56 | R | 80.1 | Confident | 82.2 | Confident | 119 Ų | 119 | 79 Ų | 79 | 45% | 0.449 | 37% | 0.372 | S | S | . | . | trans | -61.9 | 132.3 | -172.7 | -67.4 | 178.1 | -177.1 | 137.2 | -0.5 | 111.7 | V53 W58 | V53-R56 VanDerWaalsContact O-CA 3.25Å; V53-R56 WeakPolarHBondContact O-CA 3.31Å; V53-R56 PolarHBondContact O-N 3.02Å; R56-W58 HydrophobicContact CB-CZ2 4.5Å; R56-W58 PolarHBondContact O-N 3.33Å | ||
| 57 | N | 80.6 | Confident | 82.2 | Confident | 67 Ų | 67 | 76.3 Ų | 76.3 | 36% | 0.358 | 36% | 0.361 | S | S | . | . | trans | -95.2 | 79 | -178.9 | -167.2 | -21 | 0 | 0 | 0 | 111.4 | A50 V53 P55 L59 L60 F61 | A50-N57 PolarHBondContact O-N 3.36Å; A50-N57 VanDerWaalsContact O-N 3.16Å; V53-N57 HydrophobicContact CG1-CB 4.23Å; P55-N57 PolarHBondContact O-N 2.96Å; N57-L59 PolarHBondContact O-N 3.09Å; N57-L59 PolarHBondContact OD1-N 3.07Å; N57-L60 HydrophobicContact CB-CB 4.17Å; N57-L60 PolarHBondContact O-N 3.11Å; N57-L60 WeakPolarHBondContact OD1-CB 3.46Å; N57-L60 PolarHBondContact OD1-N 3.47Å; N57-L60 VanDerWaalsContact OD1-N 3.08Å; N57-F61 PolarHBondContact O-N 3.38Å; N57-F61 VanDerWaalsContact O-N 3.12Å | ||
| 58 | W | 78.4 | Confident | 82.2 | Confident | 148 Ų | 148 | 76.3 Ų | 76.3 | 56% | 0.561 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -63 | -27.4 | -178.7 | -64.5 | 108.3 | 0 | 0 | 0 | 114.1 | Y51 R56 F61 A62 | Y51-W58 HydrophobicContact CE2-CH2 4.43Å; R56-W58 HydrophobicContact CB-CZ2 4.5Å; R56-W58 PolarHBondContact O-N 3.33Å; W58-F61 PolarHBondContact O-N 3.06Å; W58-A62 WeakPolarHBondContact O-CB 3.47Å; W58-A62 PolarHBondContact O-N 3.08Å |
| 59 | L | 80.1 | Confident | 82.1 | Confident | 90 Ų | 90 | 71 Ų | 71 | 47% | 0.471 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -71.1 | -44.4 | 178.5 | -73.5 | 158.9 | 0 | 0 | 0 | 111.4 | P10 N57 F61 A62 C63 | P10-L59 HydrophobicContact CB-CB 4.25Å; P10-L59 HydrophobicContact CB-CD1 3.63Å; P10-L59 HydrophobicContact CB-CD2 4.4Å; P10-L59 HydrophobicContact CB-CG 4.29Å; P10-L59 HydrophobicContact CG-CD1 3.62Å; N57-L59 PolarHBondContact O-N 3.09Å; N57-L59 PolarHBondContact OD1-N 3.07Å; L59-F61 VanDerWaalsContact C-N 3.31Å; L59-F61 PolarHBondContact O-N 3.24Å; L59-A62 PolarHBondContact O-N 2.84Å; L59-C63 VanDerWaalsContact O-CB 3.31Å; L59-C63 WeakPolarHBondContact O-CB 3.32Å; L59-C63 PolarHBondContact O-N 3.38Å |
| 60 | L | 78.1 | Confident | 82 | Confident | 16 Ų | 16 | 65.5 Ų | 65.5 | 8% | 0.084 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -62.1 | -42.1 | 173 | -173 | 65.5 | 0 | 0 | 0 | 110.6 | F46 F49 A50 N57 C63 H64 | F46-L60 HydrophobicContact CD1-CD2 4.49Å; F49-L60 HydrophobicContact CD1-CD2 4.3Å; A50-L60 HydrophobicContact CB-CB 4.05Å; A50-L60 HydrophobicContact CB-CD2 3.97Å; A50-L60 HydrophobicContact CB-CG 4.08Å; N57-L60 HydrophobicContact CB-CB 4.17Å; N57-L60 PolarHBondContact O-N 3.11Å; N57-L60 WeakPolarHBondContact OD1-CB 3.46Å; N57-L60 PolarHBondContact OD1-N 3.47Å; N57-L60 VanDerWaalsContact OD1-N 3.08Å; L60-C63 WeakPolarHBondContact O-CB 3.35Å; L60-C63 PolarHBondContact O-N 3.25Å; L60-H64 WeakPolarHBondContact CD1-NE2 3.49Å; L60-H64 PolarHBondContact O-CD2 3.25Å; L60-H64 PolarHBondContact O-N 2.9Å; L60-H64 VanDerWaalsContact O-N 3.09Å |
| 61 | F | 82.9 | Confident | 81.8 | Confident | 54 Ų | 54 | 65.7 Ų | 65.7 | 24% | 0.237 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -59.9 | -50.6 | 176 | -177 | -91.9 | 0 | 0 | 0 | 112.4 | M47 A50 N57 W58 L59 C63 H64 L65 | M47-F61 HydrophobicContact CB-CD2 3.86Å; M47-F61 HydrophobicContact CB-CE2 3.86Å; M47-F61 HydrophobicContact CE-CD2 4.32Å; M47-F61 HydrophobicContact CE-CE1 4.36Å; M47-F61 HydrophobicContact CE-CE2 3.56Å; M47-F61 HydrophobicContact CE-CZ 3.58Å; M47-F61 HydrophobicContact CG-CD2 4.06Å; M47-F61 HydrophobicContact CG-CE2 4.16Å; A50-F61 HydrophobicContact CB-CB 4.03Å; N57-F61 PolarHBondContact O-N 3.38Å; N57-F61 VanDerWaalsContact O-N 3.12Å; W58-F61 PolarHBondContact O-N 3.06Å; L59-F61 VanDerWaalsContact C-N 3.31Å; L59-F61 PolarHBondContact O-N 3.24Å; F61-C63 VanDerWaalsContact C-N 3.31Å; F61-C63 PolarHBondContact O-N 2.99Å; F61-H64 PolarHBondContact O-N 3.42Å; F61-L65 HydrophobicContact CE1-CD2 4.21Å; F61-L65 WeakPolarHBondContact O-CB 3.36Å; F61-L65 PolarHBondContact O-N 2.82Å |
| 62 | A | 82.9 | Confident | 81.9 | Confident | 39 Ų | 39 | 64.6 Ų | 64.6 | 32% | 0.322 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -63 | -37.3 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | W58 L59 T66 | W58-A62 WeakPolarHBondContact O-CB 3.47Å; W58-A62 PolarHBondContact O-N 3.08Å; L59-A62 PolarHBondContact O-N 2.84Å; A62-T66 WeakPolarHBondContact O-CB 3.33Å; A62-T66 PolarHBondContact O-N 2.83Å; A62-T66 PolarHBondContact O-OG1 3.12Å |
| 63 | C | 82.3 | Confident | 81.8 | Confident | 1 Ų | 1 | 61.3 Ų | 61.3 | 1% | 0.007 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -58.5 | -54.7 | 174 | 168.8 | 0 | 0 | 0 | 0 | 111.5 | N13 P17 L59 L60 F61 L65 T66 N67 | N13-C63 PolarHBondContact O-SG 3.4Å; P17-C63 WeakPolarHBondContact CD-SG 3.33Å; P17-C63 HydrophobicContact CG-CB 4.16Å; P17-C63 WeakPolarHBondContact CG-SG 3.34Å; L59-C63 VanDerWaalsContact O-CB 3.31Å; L59-C63 WeakPolarHBondContact O-CB 3.32Å; L59-C63 PolarHBondContact O-N 3.38Å; L60-C63 WeakPolarHBondContact O-CB 3.35Å; L60-C63 PolarHBondContact O-N 3.25Å; F61-C63 VanDerWaalsContact C-N 3.31Å; F61-C63 PolarHBondContact O-N 2.99Å; C63-L65 PolarHBondContact O-N 2.93Å; C63-T66 PolarHBondContact O-N 2.98Å; C63-N67 PolarHBondContact O-N 2.95Å |
| 64 | H | 83 | Confident | 81.6 | Confident | 3 Ų | 3 | 59.2 Ų | 59.2 | 1% | 0.014 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -68.7 | -33.7 | -179 | -74 | -72.6 | 0 | 0 | 0 | 112.9 | Y42 F46 M47 L60 F61 T66 N67 E68 | Y42-H64 AromaticContact CE1-CE1 3.79Å; F46-H64 VanDerWaalsContact CB-CD2 3.46Å; F46-H64 WeakPolarHBondContact CB-CD2 3.5Å; F46-H64 WeakPolarHBondContact CB-NE2 3.39Å; F46-H64 AromaticContact CD1-CE1 3.99Å; F46-H64 AromaticContact CD1-NE2 3.49Å; F46-H64 WeakPolarHBondContact CD1-NE2 3.18Å; F46-H64 AromaticContact CG-CE1 3.75Å; F46-H64 AromaticContact CG-NE2 3.59Å; M47-H64 HydrophobicContact CG-CB 3.57Å; M47-H64 HydrophobicContact SD-CB 4.33Å; L60-H64 WeakPolarHBondContact CD1-NE2 3.49Å; L60-H64 PolarHBondContact O-CD2 3.25Å; L60-H64 PolarHBondContact O-N 2.9Å; L60-H64 VanDerWaalsContact O-N 3.09Å; F61-H64 PolarHBondContact O-N 3.42Å; H64-T66 VanDerWaalsContact C-N 3.31Å; H64-T66 PolarHBondContact O-N 3.3Å; H64-N67 PolarHBondContact O-N 2.8Å; H64-E68 WeakPolarHBondContact O-CB 3.47Å; H64-E68 PolarHBondContact O-N 2.91Å |
| 65 | L | 85.6 | Confident | 81.4 | Confident | 77 Ų | 77 | 52.2 Ų | 52.2 | 40% | 0.403 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -60.8 | -41.3 | 172.8 | -177.9 | 70.1 | 0 | 0 | 0 | 111.8 | M47 F61 C63 S69 | M47-L65 HydrophobicContact CE-CB 4.1Å; M47-L65 HydrophobicContact CE-CD1 3.58Å; M47-L65 HydrophobicContact CE-CG 4.43Å; M47-L65 HydrophobicContact SD-CB 4.19Å; M47-L65 HydrophobicContact SD-CD1 4.35Å; F61-L65 HydrophobicContact CE1-CD2 4.21Å; F61-L65 WeakPolarHBondContact O-CB 3.36Å; F61-L65 PolarHBondContact O-N 2.82Å; C63-L65 PolarHBondContact O-N 2.93Å; L65-S69 WeakPolarHBondContact O-CB 3.49Å; L65-S69 PolarHBondContact O-N 3.01Å; L65-S69 PolarHBondContact O-OG 3.43Å |
| 66 | T | 83.3 | Confident | 81.3 | Confident | 50 Ų | 50 | 49.4 Ų | 49.4 | 31% | 0.307 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -68 | -43.6 | 177.7 | -55.7 | 0 | 0 | 0 | 0 | 111.1 | P17 A62 C63 H64 S69 A70 | P17-T66 HydrophobicContact CB-CG2 4.09Å; A62-T66 WeakPolarHBondContact O-CB 3.33Å; A62-T66 PolarHBondContact O-N 2.83Å; A62-T66 PolarHBondContact O-OG1 3.12Å; C63-T66 PolarHBondContact O-N 2.98Å; H64-T66 VanDerWaalsContact C-N 3.31Å; H64-T66 PolarHBondContact O-N 3.3Å; T66-S69 PolarHBondContact O-N 3.42Å; T66-A70 PolarHBondContact O-N 2.99Å |
| 67 | N | 82.1 | Confident | 81.2 | Confident | 7 Ų | 7 | 49.6 Ų | 49.6 | 4% | 0.037 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -60.6 | -45.9 | 175.9 | -175.5 | 42.7 | 0 | 0 | 0 | 112 | A20 S43 C63 H64 A70 Q71 | A20-N67 WeakPolarHBondContact CB-OD1 3.34Å; S43-N67 PolarHBondContact OG-ND2 3.21Å; C63-N67 PolarHBondContact O-N 2.95Å; H64-N67 PolarHBondContact O-N 2.8Å; N67-A70 PolarHBondContact O-N 3.5Å; N67-Q71 PolarHBondContact ND2-NE2 3.47Å; N67-Q71 WeakPolarHBondContact O-CB 3.25Å; N67-Q71 WeakPolarHBondContact O-CG 3.28Å; N67-Q71 PolarHBondContact O-N 2.88Å; N67-Q71 PolarHBondContact OD1-NE2 3.22Å |
| 68 | E | 83.8 | Confident | 81 | Confident | 23 Ų | 23 | 47.1 Ų | 47.1 | 11% | 0.107 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -64.2 | -42.5 | 177.8 | -176.1 | 153.5 | -175.2 | 0 | 0 | 112.1 | L44 H64 A70 Q71 L72 | L44-E68 WeakPolarHBondContact CD2-OE1 3.47Å; L44-E68 VanDerWaalsContact CD2-OE2 3.23Å; L44-E68 WeakPolarHBondContact CD2-OE2 3.3Å; L44-E68 WeakPolarHBondContact CG-OE1 3.5Å; L44-E68 VanDerWaalsContact CG-OE2 3.27Å; L44-E68 WeakPolarHBondContact CG-OE2 3.36Å; L44-E68 PolarHBondContact N-OE2 3.37Å; H64-E68 WeakPolarHBondContact O-CB 3.47Å; H64-E68 PolarHBondContact O-N 2.91Å; E68-A70 PolarHBondContact O-N 3.3Å; E68-Q71 PolarHBondContact O-N 2.87Å; E68-L72 HydrophobicContact CG-CD1 4.12Å; E68-L72 HydrophobicContact CG-CG 4.41Å; E68-L72 WeakPolarHBondContact O-CB 3.46Å; E68-L72 WeakPolarHBondContact O-CG 3.24Å; E68-L72 PolarHBondContact O-N 3.42Å |
| 69 | S | 85.4 | Confident | 80.9 | Confident | 62 Ų | 62 | 45.1 Ų | 45.1 | 43% | 0.434 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -59.8 | -45.2 | 175.4 | -59.5 | 0 | 0 | 0 | 0 | 111.9 | L65 T66 Q71 L72 V73 | L65-S69 WeakPolarHBondContact O-CB 3.49Å; L65-S69 PolarHBondContact O-N 3.01Å; L65-S69 PolarHBondContact O-OG 3.43Å; T66-S69 PolarHBondContact O-N 3.42Å; S69-Q71 VanDerWaalsContact C-N 3.34Å; S69-Q71 PolarHBondContact O-N 3.3Å; S69-L72 PolarHBondContact O-N 3.16Å; S69-V73 WeakPolarHBondContact O-CG2 3.34Å; S69-V73 PolarHBondContact O-N 3.37Å |
| 70 | A | 82.4 | Confident | 80.9 | Confident | 7 Ų | 7 | 47.4 Ų | 47.4 | 6% | 0.058 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -62.2 | -41.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112 | A20 M24 T66 N67 E68 V73 Q74 | A20-A70 HydrophobicContact CB-CB 4.07Å; M24-A70 HydrophobicContact CE-CB 4.35Å; M24-A70 HydrophobicContact CG-CB 4.29Å; M24-A70 HydrophobicContact SD-CB 3.91Å; T66-A70 PolarHBondContact O-N 2.99Å; N67-A70 PolarHBondContact O-N 3.5Å; E68-A70 PolarHBondContact O-N 3.3Å; A70-V73 PolarHBondContact O-N 3.12Å; A70-Q74 WeakPolarHBondContact O-CG 3.37Å; A70-Q74 PolarHBondContact O-N 3.31Å |
| 71 | Q | 79.2 | Confident | 80.8 | Confident | 5 Ų | 5 | 49.5 Ų | 49.5 | 2% | 0.023 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -71.7 | -36.1 | 179.6 | -75 | 178.4 | 23 | 0 | 0 | 113.7 | T36 N67 E68 S69 V73 Q74 G75 | T36-Q71 HydrophobicContact CG2-CB 3.92Å; T36-Q71 HydrophobicContact CG2-CG 4.46Å; T36-Q71 WeakPolarHBondContact CG2-O 3.46Å; T36-Q71 PolarHBondContact O-OE1 2.9Å; N67-Q71 PolarHBondContact ND2-NE2 3.47Å; N67-Q71 WeakPolarHBondContact O-CB 3.25Å; N67-Q71 WeakPolarHBondContact O-CG 3.28Å; N67-Q71 PolarHBondContact O-N 2.88Å; N67-Q71 PolarHBondContact OD1-NE2 3.22Å; E68-Q71 PolarHBondContact O-N 2.87Å; S69-Q71 VanDerWaalsContact C-N 3.34Å; S69-Q71 PolarHBondContact O-N 3.3Å; Q71-V73 VanDerWaalsContact C-N 3.29Å; Q71-V73 PolarHBondContact O-N 3.36Å; Q71-Q74 PolarHBondContact O-N 2.84Å; Q71-G75 PolarHBondContact O-N 3.47Å |
| 72 | L | 81.7 | Confident | 80.4 | Confident | 99 Ų | 99 | 51 Ų | 51 | 52% | 0.518 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -62.2 | -39.7 | 172.9 | -74.8 | 171.3 | 0 | 0 | 0 | 111.2 | E68 S69 S76 | E68-L72 HydrophobicContact CG-CD1 4.12Å; E68-L72 HydrophobicContact CG-CG 4.41Å; E68-L72 WeakPolarHBondContact O-CB 3.46Å; E68-L72 WeakPolarHBondContact O-CG 3.24Å; E68-L72 PolarHBondContact O-N 3.42Å; S69-L72 PolarHBondContact O-N 3.16Å; L72-S76 WeakPolarHBondContact O-CB 3.48Å; L72-S76 PolarHBondContact O-N 3.47Å; L72-S76 PolarHBondContact O-OG 3.3Å |
| 73 | V | 83.1 | Confident | 80.1 | Confident | 79 Ų | 79 | 54.6 Ų | 54.6 | 48% | 0.479 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -64.6 | -46.8 | 174.6 | 172.8 | 0 | 0 | 0 | 0 | 110.9 | S69 A70 Q71 S76 R77 | S69-V73 WeakPolarHBondContact O-CG2 3.34Å; S69-V73 PolarHBondContact O-N 3.37Å; A70-V73 PolarHBondContact O-N 3.12Å; Q71-V73 VanDerWaalsContact C-N 3.29Å; Q71-V73 PolarHBondContact O-N 3.36Å; V73-S76 PolarHBondContact O-N 3.18Å; V73-R77 WeakPolarHBondContact O-CG 3.47Å; V73-R77 PolarHBondContact O-N 3.09Å; V73-R77 VanDerWaalsContact O-N 3.08Å |
| 74 | Q | 76.7 | Confident | 79.6 | Confident | 11 Ų | 11 | 61 Ų | 61 | 5% | 0.051 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -61.7 | -45.3 | 175.4 | -74.3 | 176.9 | -36.1 | 0 | 0 | 112.7 | D23 M24 I31 A70 Q71 S76 R77 L78 | D23-Q74 PolarHBondContact O-NE2 3.08Å; M24-Q74 VanDerWaalsContact CA-NE2 3.3Å; M24-Q74 HydrophobicContact CG-CG 3.95Å; I31-Q74 HydrophobicContact CD1-CB 4.26Å; I31-Q74 HydrophobicContact CD1-CG 4.23Å; A70-Q74 WeakPolarHBondContact O-CG 3.37Å; A70-Q74 PolarHBondContact O-N 3.31Å; Q71-Q74 PolarHBondContact O-N 2.84Å; Q74-S76 VanDerWaalsContact C-N 3.31Å; Q74-S76 PolarHBondContact O-N 3.5Å; Q74-R77 WeakPolarHBondContact O-CB 3.4Å; Q74-R77 PolarHBondContact O-N 3.13Å; Q74-L78 PolarHBondContact O-N 2.91Å |
| 75 | G | 76.7 | Confident | 78.8 | Confident | 14 Ų | 14 | 67.3 Ų | 67.3 | 14% | 0.144 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -60.9 | -40.8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q71 R77 L78 I79 | Q71-G75 PolarHBondContact O-N 3.47Å; G75-R77 PolarHBondContact O-N 3.44Å; G75-L78 PolarHBondContact O-N 3.05Å; G75-I79 VanDerWaalsContact O-CG1 3.3Å; G75-I79 WeakPolarHBondContact O-CG1 3.38Å; G75-I79 PolarHBondContact O-N 2.75Å |
| 76 | S | 79.4 | Confident | 77.7 | Confident | 66 Ų | 66 | 72.6 Ų | 72.6 | 46% | 0.462 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -62.7 | -41.2 | 174.7 | -60.3 | 0 | 0 | 0 | 0 | 112.2 | L72 V73 Q74 K80 | L72-S76 WeakPolarHBondContact O-CB 3.48Å; L72-S76 PolarHBondContact O-N 3.47Å; L72-S76 PolarHBondContact O-OG 3.3Å; V73-S76 PolarHBondContact O-N 3.18Å; Q74-S76 VanDerWaalsContact C-N 3.31Å; Q74-S76 PolarHBondContact O-N 3.5Å; S76-K80 WeakPolarHBondContact O-CG 3.23Å; S76-K80 PolarHBondContact O-N 3.05Å; S76-K80 VanDerWaalsContact O-N 3.14Å |
| 77 | R | 77.4 | Confident | 76.6 | Confident | 124 Ų | 124 | 75.3 Ų | 75.3 | 47% | 0.468 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -64.9 | -41 | 174.9 | -69.4 | 175.4 | 72.3 | -166.8 | 0.8 | 111.8 | M24 V73 Q74 G75 K80 Y81 | M24-R77 PolarHBondContact O-NH1 3.44Å; V73-R77 WeakPolarHBondContact O-CG 3.47Å; V73-R77 PolarHBondContact O-N 3.09Å; V73-R77 VanDerWaalsContact O-N 3.08Å; Q74-R77 WeakPolarHBondContact O-CB 3.4Å; Q74-R77 PolarHBondContact O-N 3.13Å; G75-R77 PolarHBondContact O-N 3.44Å; R77-K80 PolarHBondContact O-N 3.42Å; R77-Y81 PolarHBondContact O-N 2.75Å |
| 78 | L | 77 | Confident | 75.1 | Confident | 15 Ų | 15 | 83 Ų | 83 | 8% | 0.079 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -64.6 | -43.4 | 177.2 | -178.6 | 69.7 | 0 | 0 | 0 | 112.2 | P28 I31 Q74 G75 Y81 N82 | P28-L78 WeakPolarHBondContact O-CD1 3.25Å; I31-L78 HydrophobicContact CG2-CD2 4.38Å; I31-L78 WeakPolarHBondContact O-CD1 3.47Å; I31-L78 WeakPolarHBondContact O-CD2 3.46Å; Q74-L78 PolarHBondContact O-N 2.91Å; G75-L78 PolarHBondContact O-N 3.05Å; L78-Y81 PolarHBondContact O-N 2.9Å; L78-N82 WeakPolarHBondContact O-CB 3.47Å; L78-N82 PolarHBondContact O-N 3.4Å; L78-N82 PolarHBondContact O-ND2 3.31Å |
| 79 | I | 76.4 | Confident | 74.7 | Confident | 106 Ų | 106 | 86 Ų | 86 | 54% | 0.544 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -61.1 | -46.4 | 177.4 | -69.3 | 165.4 | 0 | 0 | 0 | 110.2 | G75 Y81 N82 M83 | G75-I79 VanDerWaalsContact O-CG1 3.3Å; G75-I79 WeakPolarHBondContact O-CG1 3.38Å; G75-I79 PolarHBondContact O-N 2.75Å; I79-Y81 PolarHBondContact O-N 3.22Å; I79-N82 PolarHBondContact O-N 3.46Å; I79-M83 HydrophobicContact CG2-CG 4.44Å; I79-M83 HydrophobicContact CG2-SD 4.03Å; I79-M83 WeakPolarHBondContact O-CG 3.34Å; I79-M83 PolarHBondContact O-N 3.37Å |
| 80 | K | 79.8 | Confident | 74.1 | Confident | 138 Ų | 138 | 87.2 Ų | 87.2 | 60% | 0.6 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -58.1 | -48 | 175.9 | -74.6 | -176.1 | 177.3 | -171.5 | 0 | 112 | S76 R77 N82 M83 E84 | S76-K80 WeakPolarHBondContact O-CG 3.23Å; S76-K80 PolarHBondContact O-N 3.05Å; S76-K80 VanDerWaalsContact O-N 3.14Å; R77-K80 PolarHBondContact O-N 3.42Å; K80-N82 PolarHBondContact O-N 3.35Å; K80-M83 PolarHBondContact O-N 3.46Å; K80-E84 PolarHBondContact O-N 3.33Å |
| 81 | Y | 75.8 | Confident | 73.6 | Confident | 60 Ų | 60 | 91.7 Ų | 91.7 | 24% | 0.235 | 48% | 0.477 | C | S | . | . | H | α-helix | trans | -59.6 | -44.4 | 177.3 | 176.2 | -91.6 | 0 | 0 | 0 | 112.5 | E29 R77 L78 I79 M83 E84 K85 | E29-Y81 HydrophobicContact CG-CE1 4.07Å; E29-Y81 HydrophobicContact CG-CE2 4.21Å; E29-Y81 WeakPolarHBondContact CG-OH 3.41Å; E29-Y81 PolarHBondContact OE1-OH 3.32Å; R77-Y81 PolarHBondContact O-N 2.75Å; L78-Y81 PolarHBondContact O-N 2.9Å; I79-Y81 PolarHBondContact O-N 3.22Å; Y81-M83 VanDerWaalsContact C-N 3.34Å; Y81-M83 PolarHBondContact O-N 3.1Å; Y81-E84 PolarHBondContact O-N 3.34Å; Y81-K85 HydrophobicContact CE1-CD 4.31Å; Y81-K85 WeakPolarHBondContact O-CB 3.46Å; Y81-K85 PolarHBondContact O-N 2.87Å |
| 82 | N | 75.3 | Confident | 73.3 | Confident | 84 Ų | 84 | 96.8 Ų | 96.8 | 45% | 0.449 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -66.4 | -33.6 | 177.6 | -75.8 | -28.4 | 0 | 0 | 0 | 112.8 | L78 I79 K80 K86 | L78-N82 WeakPolarHBondContact O-CB 3.47Å; L78-N82 PolarHBondContact O-N 3.4Å; L78-N82 PolarHBondContact O-ND2 3.31Å; I79-N82 PolarHBondContact O-N 3.46Å; K80-N82 PolarHBondContact O-N 3.35Å; N82-K86 WeakPolarHBondContact O-CB 3.45Å; N82-K86 PolarHBondContact O-N 3.39Å; N82-K86 VanDerWaalsContact O-N 3.14Å |
| 83 | M | 74.8 | Confident | 72.8 | Confident | 116 Ų | 116 | 96.6 Ų | 96.6 | 57% | 0.571 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -70 | -42.4 | 175.2 | -74 | -179.5 | 6.4 | 0 | 0 | 112.3 | I79 K80 Y81 K86 S87 | I79-M83 HydrophobicContact CG2-CG 4.44Å; I79-M83 HydrophobicContact CG2-SD 4.03Å; I79-M83 WeakPolarHBondContact O-CG 3.34Å; I79-M83 PolarHBondContact O-N 3.37Å; K80-M83 PolarHBondContact O-N 3.46Å; Y81-M83 VanDerWaalsContact C-N 3.34Å; Y81-M83 PolarHBondContact O-N 3.1Å; M83-K86 PolarHBondContact O-N 3.13Å; M83-S87 PolarHBondContact O-N 3.46Å; M83-S87 PolarHBondContact O-OG 3Å |
| 84 | E | 72.3 | Confident | 72.1 | Confident | 136 Ų | 136 | 97.8 Ų | 97.8 | 64% | 0.636 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -62.9 | -46.7 | 175.4 | -75.3 | 172.2 | -176.2 | 0 | 0 | 110.8 | K80 Y81 K86 S87 | K80-E84 PolarHBondContact O-N 3.33Å; Y81-E84 PolarHBondContact O-N 3.34Å; E84-K86 VanDerWaalsContact C-N 3.27Å; E84-K86 PolarHBondContact O-N 3.25Å; E84-S87 PolarHBondContact O-N 2.73Å |
| 85 | K | 67.1 | Low | 71.8 | Confident | 134 Ų | 134 | 104 Ų | 104 | 58% | 0.583 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -61.6 | -31.2 | 176.4 | -176.7 | 171 | -179.8 | 162.6 | 0 | 113.6 | Y81 S87 | Y81-K85 HydrophobicContact CE1-CD 4.31Å; Y81-K85 WeakPolarHBondContact O-CB 3.46Å; Y81-K85 PolarHBondContact O-N 2.87Å; K85-S87 VanDerWaalsContact C-N 3.25Å; K85-S87 PolarHBondContact O-N 3.18Å |
| 86 | K | 63.1 | Low | 71.4 | Confident | 188 Ų | 188 | 110.9 Ų | 110.9 | 82% | 0.817 | 57% | 0.567 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.5 | -13.4 | 177.7 | -158.6 | -178.4 | -178.9 | -165.8 | 0 | 112.9 | N82 M83 E84 | N82-K86 WeakPolarHBondContact O-CB 3.45Å; N82-K86 PolarHBondContact O-N 3.39Å; N82-K86 VanDerWaalsContact O-N 3.14Å; M83-K86 PolarHBondContact O-N 3.13Å; E84-K86 VanDerWaalsContact C-N 3.27Å; E84-K86 PolarHBondContact O-N 3.25Å |
| 87 | S | 58.8 | Low | 70.7 | Confident | 107 Ų | 107 | 114.7 Ų | 114.7 | 75% | 0.748 | 58% | 0.575 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.3 | -0.3 | -177.6 | -55.4 | 0 | 0 | 0 | 0 | 113.8 | M83 E84 K85 | M83-S87 PolarHBondContact O-N 3.46Å; M83-S87 PolarHBondContact O-OG 3Å; E84-S87 PolarHBondContact O-N 2.73Å; K85-S87 VanDerWaalsContact C-N 3.25Å; K85-S87 PolarHBondContact O-N 3.18Å |
| 88 | S | 51.3 | Low | 70.1 | Confident | 168 Ų | 168 | 113.8 Ų | 113.8 | 100% | 1.175 | 59% | 0.585 | S | S | * | * | trans | -110 | 0 | 171.6 | -98.5 | 0 | 0 | 0 | 0 | 110.5 |
Retrieved 88 of 88 residues in 71.2 ms
(Link to these results)