| 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 | 53.5 | Low | 68 | Low | 207 Ų | 207 | 111.8 Ų | 111.8 | 100% | 1.02 | 59% | 0.588 | S | S | * | * | 0 | -39.7 | 0 | -101.9 | 169.6 | -171.2 | 0 | 0 | 113.4 | K3 I4 T5 | M1-K3 PolarHBondContact O-N 3.43Å; M1-I4 PolarHBondContact O-N 3.29Å; M1-T5 PolarHBondContact O-OG1 3.44Å | |||
| 2 | T | 57.9 | Low | 69.5 | Low | 128 Ų | 128 | 109.7 Ų | 109.7 | 79% | 0.785 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -58.8 | -36.8 | -173.5 | -7.5 | 0 | 0 | 0 | 0 | 115.2 | F6 | T2-F6 PolarHBondContact O-N 3.28Å |
| 3 | K | 56.2 | Low | 70.7 | Confident | 181 Ų | 181 | 104.6 Ų | 104.6 | 79% | 0.787 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -67 | -37.7 | 179.5 | -69.8 | -170.7 | 176.2 | -175.4 | 0 | 113.7 | M1 F6 T7 | M1-K3 PolarHBondContact O-N 3.43Å; K3-F6 PolarHBondContact O-N 3.07Å; K3-T7 PolarHBondContact O-N 3.23Å; K3-T7 VanDerWaalsContact O-N 3.16Å; K3-T7 PolarHBondContact O-OG1 3.37Å; K3-T7 VanDerWaalsContact O-OG1 3.1Å |
| 4 | I | 59.5 | Low | 72 | Confident | 128 Ų | 128 | 100.4 Ų | 100.4 | 66% | 0.656 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -71.3 | -40.4 | -176.7 | -60.7 | 175.1 | 0 | 0 | 0 | 111 | M1 F6 S8 | M1-I4 PolarHBondContact O-N 3.29Å; I4-F6 VanDerWaalsContact C-N 3.33Å; I4-F6 PolarHBondContact O-N 3.26Å; I4-S8 PolarHBondContact O-N 3.39Å; I4-S8 PolarHBondContact O-OG 3.16Å |
| 5 | T | 63.6 | Low | 73.1 | Confident | 99 Ų | 99 | 104 Ų | 104 | 61% | 0.607 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -63.1 | -40.9 | 175.2 | -45.1 | 0 | 0 | 0 | 0 | 111.3 | M1 S8 C9 | M1-T5 PolarHBondContact O-OG1 3.44Å; T5-S8 PolarHBondContact O-N 3.5Å; T5-C9 WeakPolarHBondContact O-CB 3.32Å; T5-C9 PolarHBondContact O-N 2.96Å; T5-C9 VanDerWaalsContact O-N 3.07Å |
| 6 | F | 69.4 | Low | 74.1 | Confident | 127 Ų | 127 | 101.4 Ų | 101.4 | 56% | 0.557 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -63.6 | -46.4 | 179.5 | -170.5 | -100.6 | 0 | 0 | 0 | 112.2 | T2 K3 I4 S8 C9 F10 A222 | T2-F6 PolarHBondContact O-N 3.28Å; K3-F6 PolarHBondContact O-N 3.07Å; I4-F6 VanDerWaalsContact C-N 3.33Å; I4-F6 PolarHBondContact O-N 3.26Å; F6-S8 VanDerWaalsContact C-N 3.32Å; F6-S8 PolarHBondContact O-N 3.1Å; F6-C9 PolarHBondContact O-N 3.42Å; F6-F10 WeakPolarHBondContact O-CB 3.49Å; F6-F10 PolarHBondContact O-N 3.03Å; F6-A222 HydrophobicContact CZ-CB 4.37Å |
| 7 | T | 71.4 | Confident | 75 | Confident | 69 Ų | 69 | 95.9 Ų | 95.9 | 42% | 0.423 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.8 | -37.4 | 178.2 | -51.7 | 0 | 0 | 0 | 0 | 112.6 | K3 K11 | K3-T7 PolarHBondContact O-N 3.23Å; K3-T7 VanDerWaalsContact O-N 3.16Å; K3-T7 PolarHBondContact O-OG1 3.37Å; K3-T7 VanDerWaalsContact O-OG1 3.1Å; T7-K11 HydrophobicContact CG2-CD 4.48Å; T7-K11 WeakPolarHBondContact O-CG 3.39Å; T7-K11 PolarHBondContact O-N 3.45Å; T7-K11 VanDerWaalsContact O-N 3.09Å |
| 8 | S | 75.2 | Confident | 76 | Confident | 74 Ų | 74 | 93.6 Ų | 93.6 | 52% | 0.517 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -70.7 | -44 | -179.6 | -55.9 | 0 | 0 | 0 | 0 | 112 | I4 T5 F6 K11 C12 | I4-S8 PolarHBondContact O-N 3.39Å; I4-S8 PolarHBondContact O-OG 3.16Å; T5-S8 PolarHBondContact O-N 3.5Å; F6-S8 VanDerWaalsContact C-N 3.32Å; F6-S8 PolarHBondContact O-N 3.1Å; S8-K11 PolarHBondContact O-N 3.32Å; S8-C12 PolarHBondContact O-N 3.09Å |
| 9 | C | 78.4 | Confident | 76.9 | Confident | 70 Ų | 70 | 92.8 Ų | 92.8 | 47% | 0.473 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61.8 | -45 | 174.9 | -176.2 | 0 | 0 | 0 | 0 | 111.4 | T5 F6 K11 C12 L13 | T5-C9 WeakPolarHBondContact O-CB 3.32Å; T5-C9 PolarHBondContact O-N 2.96Å; T5-C9 VanDerWaalsContact O-N 3.07Å; F6-C9 PolarHBondContact O-N 3.42Å; C9-K11 PolarHBondContact O-N 3.16Å; C9-C12 WeakPolarHBondContact O-CB 3.41Å; C9-C12 PolarHBondContact O-N 2.92Å; C9-C12 VanDerWaalsContact O-N 3.16Å; C9-L13 WeakPolarHBondContact O-CG 3.34Å; C9-L13 PolarHBondContact O-N 3.47Å |
| 10 | F | 80.4 | Confident | 77.6 | Confident | 27 Ų | 27 | 93.5 Ų | 93.5 | 12% | 0.118 | 49% | 0.487 | C | S | . | . | H | α-helix | trans | -60.6 | -44.8 | 178.5 | -179.7 | -101.1 | 0 | 0 | 0 | 112.6 | F6 C12 L13 K14 L219 A222 I223 L226 | F6-F10 WeakPolarHBondContact O-CB 3.49Å; F6-F10 PolarHBondContact O-N 3.03Å; F10-C12 VanDerWaalsContact C-N 3.34Å; F10-C12 PolarHBondContact O-N 3.34Å; F10-L13 PolarHBondContact O-N 3.07Å; F10-K14 WeakPolarHBondContact O-CB 3.41Å; F10-K14 PolarHBondContact O-N 2.89Å; F10-L219 HydrophobicContact CD2-CD1 4.23Å; F10-L219 HydrophobicContact CE2-CD1 3.4Å; F10-L219 HydrophobicContact CE2-CG 4.36Å; F10-L219 HydrophobicContact CZ-CD1 3.61Å; F10-A222 HydrophobicContact CD2-CB 3.52Å; F10-A222 HydrophobicContact CE2-CB 3.29Å; F10-A222 HydrophobicContact CZ-CB 4.3Å; F10-I223 HydrophobicContact CZ-CG1 4.41Å; F10-L226 HydrophobicContact CE1-CD1 4.45Å; F10-L226 HydrophobicContact CZ-CD1 4.42Å |
| 11 | K | 82.9 | Confident | 78.4 | Confident | 120 Ų | 120 | 89.2 Ų | 89.2 | 52% | 0.522 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -58.9 | -46.6 | 173.7 | -74.3 | 176 | -179 | 179.7 | 0 | 111.1 | T7 S8 C9 L13 K14 Y15 | T7-K11 HydrophobicContact CG2-CD 4.48Å; T7-K11 WeakPolarHBondContact O-CG 3.39Å; T7-K11 PolarHBondContact O-N 3.45Å; T7-K11 VanDerWaalsContact O-N 3.09Å; S8-K11 PolarHBondContact O-N 3.32Å; C9-K11 PolarHBondContact O-N 3.16Å; K11-L13 PolarHBondContact O-N 2.96Å; K11-K14 PolarHBondContact O-N 3.46Å; K11-Y15 HydrophobicContact CB-CD2 4.42Å; K11-Y15 HydrophobicContact CB-CE2 4.39Å; K11-Y15 WeakPolarHBondContact O-CD2 3.29Å; K11-Y15 PolarHBondContact O-N 3.45Å |
| 12 | C | 85.8 | Confident | 80.4 | Confident | 86 Ų | 86 | 82.8 Ų | 82.8 | 58% | 0.581 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -58.2 | -47.5 | 177.8 | -171.8 | 0 | 0 | 0 | 0 | 111.9 | S8 C9 F10 Y15 S16 | S8-C12 PolarHBondContact O-N 3.09Å; C9-C12 WeakPolarHBondContact O-CB 3.41Å; C9-C12 PolarHBondContact O-N 2.92Å; C9-C12 VanDerWaalsContact O-N 3.16Å; F10-C12 VanDerWaalsContact C-N 3.34Å; F10-C12 PolarHBondContact O-N 3.34Å; C12-Y15 PolarHBondContact O-N 3.36Å; C12-S16 WeakPolarHBondContact O-CB 3.07Å; C12-S16 PolarHBondContact O-N 2.84Å |
| 13 | L | 85.4 | Confident | 82.2 | Confident | 44 Ų | 44 | 80.9 Ų | 80.9 | 23% | 0.23 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -61 | -45.9 | 177.3 | -71.2 | 171.9 | 0 | 0 | 0 | 112.1 | C9 F10 K11 S16 M17 F215 M218 | C9-L13 WeakPolarHBondContact O-CG 3.34Å; C9-L13 PolarHBondContact O-N 3.47Å; F10-L13 PolarHBondContact O-N 3.07Å; K11-L13 PolarHBondContact O-N 2.96Å; L13-S16 PolarHBondContact O-N 3.43Å; L13-M17 VanDerWaalsContact O-CB 3.32Å; L13-M17 WeakPolarHBondContact O-CB 3.35Å; L13-M17 PolarHBondContact O-N 3.14Å; L13-F215 HydrophobicContact CD2-CD1 3.72Å; L13-F215 HydrophobicContact CD2-CE1 3.64Å; L13-M218 HydrophobicContact CD1-CE 4.04Å; L13-M218 HydrophobicContact CD2-CE 4.09Å |
| 14 | K | 88.4 | Confident | 84 | Confident | 45 Ų | 45 | 73.4 Ų | 73.4 | 20% | 0.196 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -59.1 | -50 | 177.5 | -179.8 | -179.7 | 176.2 | 168.9 | 0 | 111.6 | F10 K11 F18 A79 E82 L219 | F10-K14 WeakPolarHBondContact O-CB 3.41Å; F10-K14 PolarHBondContact O-N 2.89Å; K11-K14 PolarHBondContact O-N 3.46Å; K14-F18 WeakPolarHBondContact O-CB 3.21Å; K14-F18 PolarHBondContact O-N 3.24Å; K14-A79 WeakPolarHBondContact CE-O 3.36Å; K14-E82 IonicContact NZ-OE1 2.66Å; K14-E82 PolarHBondContact NZ-OE1 2.93Å; K14-L219 HydrophobicContact CB-CD1 4.06Å; K14-L219 HydrophobicContact CG-CD1 4.46Å |
| 15 | Y | 89.3 | Confident | 85.8 | Confident | 155 Ų | 155 | 71.6 Ų | 71.6 | 61% | 0.608 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -67.6 | -39.8 | 179.5 | -74.6 | -66.3 | 0 | 0 | 0 | 112.1 | K11 C12 F18 V19 | K11-Y15 HydrophobicContact CB-CD2 4.42Å; K11-Y15 HydrophobicContact CB-CE2 4.39Å; K11-Y15 WeakPolarHBondContact O-CD2 3.29Å; K11-Y15 PolarHBondContact O-N 3.45Å; C12-Y15 PolarHBondContact O-N 3.36Å; Y15-F18 PolarHBondContact O-N 2.66Å; Y15-V19 VanDerWaalsContact O-CG2 3.29Å; Y15-V19 WeakPolarHBondContact O-CG2 3.43Å; Y15-V19 PolarHBondContact O-N 3.41Å |
| 16 | S | 88.2 | Confident | 87.4 | Confident | 62 Ų | 62 | 69.6 Ų | 69.6 | 43% | 0.434 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -62.1 | -46.7 | 176.3 | -175.1 | 0 | 0 | 0 | 0 | 111.7 | C12 L13 V19 F20 | C12-S16 WeakPolarHBondContact O-CB 3.07Å; C12-S16 PolarHBondContact O-N 2.84Å; L13-S16 PolarHBondContact O-N 3.43Å; S16-V19 PolarHBondContact O-N 3.38Å; S16-F20 WeakPolarHBondContact O-CB 3.37Å; S16-F20 PolarHBondContact O-N 3.18Å |
| 17 | M | 90 | Very high | 88.6 | Confident | 8 Ų | 8 | 68.2 Ų | 68.2 | 4% | 0.039 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -62.9 | -44 | 176.9 | -178.1 | 175.5 | 174 | 0 | 0 | 110.9 | L13 V19 F20 C21 L87 F90 F215 L219 | L13-M17 VanDerWaalsContact O-CB 3.32Å; L13-M17 WeakPolarHBondContact O-CB 3.35Å; L13-M17 PolarHBondContact O-N 3.14Å; M17-V19 PolarHBondContact O-N 3.47Å; M17-F20 PolarHBondContact O-N 3.43Å; M17-C21 WeakPolarHBondContact O-CB 3.14Å; M17-C21 PolarHBondContact O-N 2.88Å; M17-C21 PolarHBondContact O-SG 2.95Å; M17-L87 HydrophobicContact CE-CD1 3.47Å; M17-L87 VanDerWaalsContact CE-CD1 3.47Å; M17-L87 HydrophobicContact SD-CD1 4.12Å; M17-F90 HydrophobicContact CE-CD1 3.76Å; M17-F90 HydrophobicContact CE-CE1 3.7Å; M17-F90 HydrophobicContact CE-CZ 4.49Å; M17-F215 HydrophobicContact SD-CB 4.36Å; M17-L219 HydrophobicContact SD-CD2 4.06Å |
| 18 | F | 92.7 | Very high | 89.8 | Confident | 54 Ų | 54 | 65 Ų | 65 | 24% | 0.237 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -59.4 | -48.7 | 177.4 | 177 | -107.2 | 0 | 0 | 0 | 112.2 | K14 Y15 F20 C21 L22 C76 A79 I80 | K14-F18 WeakPolarHBondContact O-CB 3.21Å; K14-F18 PolarHBondContact O-N 3.24Å; Y15-F18 PolarHBondContact O-N 2.66Å; F18-F20 PolarHBondContact O-N 2.94Å; F18-C21 PolarHBondContact O-N 3.45Å; F18-L22 HydrophobicContact CE1-CD1 3.89Å; F18-L22 HydrophobicContact CE2-CD1 4.28Å; F18-L22 HydrophobicContact CZ-CD1 3.56Å; F18-L22 VanDerWaalsContact O-CB 3.23Å; F18-L22 WeakPolarHBondContact O-CB 3.32Å; F18-L22 PolarHBondContact O-N 2.97Å; F18-C76 HydrophobicContact CD2-CB 4.18Å; F18-C76 HydrophobicContact CE2-CB 4.02Å; F18-A79 HydrophobicContact CB-CB 4.41Å; F18-I80 HydrophobicContact CD2-CD1 3.83Å; F18-I80 HydrophobicContact CD2-CG1 3.73Å; F18-I80 HydrophobicContact CE2-CD1 3.19Å; F18-I80 HydrophobicContact CE2-CG1 3.65Å; F18-I80 HydrophobicContact CZ-CD1 3.74Å; F18-I80 HydrophobicContact CZ-CG1 4.39Å |
| 19 | V | 93.1 | Very high | 90.9 | Very high | 80 Ų | 80 | 64 Ų | 64 | 49% | 0.485 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -61.6 | -45.7 | 178.9 | 171.2 | 0 | 0 | 0 | 0 | 111 | Y15 S16 M17 L22 I23 | Y15-V19 VanDerWaalsContact O-CG2 3.29Å; Y15-V19 WeakPolarHBondContact O-CG2 3.43Å; Y15-V19 PolarHBondContact O-N 3.41Å; S16-V19 PolarHBondContact O-N 3.38Å; M17-V19 PolarHBondContact O-N 3.47Å; V19-L22 PolarHBondContact O-N 3.43Å; V19-I23 HydrophobicContact CG1-CD1 3.9Å; V19-I23 VanDerWaalsContact O-CG1 3.31Å; V19-I23 WeakPolarHBondContact O-CG1 3.19Å; V19-I23 PolarHBondContact O-N 3.02Å |
| 20 | F | 91.7 | Very high | 91.7 | Very high | 105 Ų | 105 | 65 Ų | 65 | 46% | 0.461 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -63 | -46.6 | 179.1 | -177.5 | -96.7 | 0 | 0 | 0 | 112.2 | S16 M17 F18 L22 I23 A24 I208 | S16-F20 WeakPolarHBondContact O-CB 3.37Å; S16-F20 PolarHBondContact O-N 3.18Å; M17-F20 PolarHBondContact O-N 3.43Å; F18-F20 PolarHBondContact O-N 2.94Å; F20-L22 VanDerWaalsContact C-N 3.29Å; F20-L22 PolarHBondContact O-N 3.08Å; F20-I23 PolarHBondContact O-N 2.92Å; F20-A24 WeakPolarHBondContact O-CB 3.37Å; F20-A24 PolarHBondContact O-N 2.99Å; F20-I208 HydrophobicContact CE1-CG2 4.27Å; F20-I208 HydrophobicContact CZ-CG2 3.65Å |
| 21 | C | 93.7 | Very high | 92.3 | Very high | 4 Ų | 4 | 65.8 Ų | 65.8 | 3% | 0.027 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -64.9 | -33.2 | 177.1 | -69.8 | 0 | 0 | 0 | 0 | 112.2 | M17 F18 A24 W25 C76 | M17-C21 WeakPolarHBondContact O-CB 3.14Å; M17-C21 PolarHBondContact O-N 2.88Å; M17-C21 PolarHBondContact O-SG 2.95Å; F18-C21 PolarHBondContact O-N 3.45Å; C21-A24 PolarHBondContact O-N 3.32Å; C21-W25 VanDerWaalsContact O-CB 3.32Å; C21-W25 WeakPolarHBondContact O-CB 3.33Å; C21-W25 PolarHBondContact O-N 3.43Å; C21-C76 WeakPolarHBondContact CB-SG 3.26Å |
| 22 | L | 95.1 | Very high | 92.9 | Very high | 72 Ų | 72 | 62.1 Ų | 62.1 | 38% | 0.377 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -69.7 | -42.8 | 177.4 | -174.7 | 145.8 | 0 | 0 | 0 | 111 | F18 V19 F20 A24 W25 V26 C76 | F18-L22 HydrophobicContact CE1-CD1 3.89Å; F18-L22 HydrophobicContact CE2-CD1 4.28Å; F18-L22 HydrophobicContact CZ-CD1 3.56Å; F18-L22 VanDerWaalsContact O-CB 3.23Å; F18-L22 WeakPolarHBondContact O-CB 3.32Å; F18-L22 PolarHBondContact O-N 2.97Å; V19-L22 PolarHBondContact O-N 3.43Å; F20-L22 VanDerWaalsContact C-N 3.29Å; F20-L22 PolarHBondContact O-N 3.08Å; L22-A24 VanDerWaalsContact C-N 3.35Å; L22-W25 PolarHBondContact O-N 3.38Å; L22-V26 HydrophobicContact CD2-CG2 4.34Å; L22-V26 WeakPolarHBondContact O-CG2 3.43Å; L22-V26 PolarHBondContact O-N 3.05Å; L22-C76 VanDerWaalsContact CA-SG 3.55Å; L22-C76 PolarHBondContact N-SG 2.93Å |
| 23 | I | 95.4 | Very high | 93.3 | Very high | 88 Ų | 88 | 62.3 Ų | 62.3 | 45% | 0.451 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -60.2 | -47.7 | 173 | -67.1 | 165.1 | 0 | 0 | 0 | 109.9 | V19 F20 W25 V26 L27 | V19-I23 HydrophobicContact CG1-CD1 3.9Å; V19-I23 VanDerWaalsContact O-CG1 3.31Å; V19-I23 WeakPolarHBondContact O-CG1 3.19Å; V19-I23 PolarHBondContact O-N 3.02Å; F20-I23 PolarHBondContact O-N 2.92Å; I23-W25 VanDerWaalsContact C-N 3.31Å; I23-W25 PolarHBondContact O-N 3.1Å; I23-V26 PolarHBondContact O-N 3.29Å; I23-L27 HydrophobicContact CG2-CD1 3.88Å; I23-L27 HydrophobicContact CG2-CG 4.31Å; I23-L27 WeakPolarHBondContact O-CB 3.44Å; I23-L27 WeakPolarHBondContact O-CG 3.31Å; I23-L27 PolarHBondContact O-N 3.43Å |
| 24 | A | 94.5 | Very high | 93.5 | Very high | 25 Ų | 25 | 62.8 Ų | 62.8 | 21% | 0.207 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -59.9 | -40.7 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | F20 C21 L22 L27 G28 I68 | F20-A24 WeakPolarHBondContact O-CB 3.37Å; F20-A24 PolarHBondContact O-N 2.99Å; C21-A24 PolarHBondContact O-N 3.32Å; L22-A24 VanDerWaalsContact C-N 3.35Å; A24-L27 PolarHBondContact O-N 3.48Å; A24-G28 PolarHBondContact O-N 3.35Å; A24-I68 WeakPolarHBondContact O-CG2 3.43Å |
| 25 | W | 96.6 | Very high | 93.7 | Very high | 89 Ų | 89 | 60.7 Ų | 60.7 | 34% | 0.337 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -61.8 | -47.2 | 176 | -179.9 | 80.9 | 0 | 0 | 0 | 112.1 | C21 L22 I23 G28 L29 M69 | C21-W25 VanDerWaalsContact O-CB 3.32Å; C21-W25 WeakPolarHBondContact O-CB 3.33Å; C21-W25 PolarHBondContact O-N 3.43Å; L22-W25 PolarHBondContact O-N 3.38Å; I23-W25 VanDerWaalsContact C-N 3.31Å; I23-W25 PolarHBondContact O-N 3.1Å; W25-G28 PolarHBondContact O-N 2.88Å; W25-L29 HydrophobicContact CH2-CD2 4.08Å; W25-L29 HydrophobicContact CZ2-CD2 4.4Å; W25-L29 HydrophobicContact CZ3-CD2 4.42Å; W25-L29 WeakPolarHBondContact O-CB 3.49Å; W25-L29 PolarHBondContact O-N 2.97Å; W25-M69 VanDerWaalsContact CD1-O 3.26Å |
| 26 | V | 97.1 | Very high | 93.8 | Very high | 57 Ų | 57 | 56.5 Ų | 56.5 | 35% | 0.345 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -62.1 | -46 | 177 | 172.8 | 0 | 0 | 0 | 0 | 111 | L22 I23 G28 L29 I30 | L22-V26 HydrophobicContact CD2-CG2 4.34Å; L22-V26 WeakPolarHBondContact O-CG2 3.43Å; L22-V26 PolarHBondContact O-N 3.05Å; I23-V26 PolarHBondContact O-N 3.29Å; V26-G28 VanDerWaalsContact C-N 3.34Å; V26-G28 PolarHBondContact O-N 3.5Å; V26-L29 PolarHBondContact O-N 3.45Å; V26-I30 HydrophobicContact CG1-CD1 3.86Å; V26-I30 HydrophobicContact CG1-CG1 4.48Å; V26-I30 VanDerWaalsContact O-CG1 3.31Å; V26-I30 WeakPolarHBondContact O-CG1 3.33Å; V26-I30 PolarHBondContact O-N 2.88Å |
| 27 | L | 96.3 | Very high | 93.9 | Very high | 99 Ų | 99 | 56.8 Ų | 56.8 | 52% | 0.518 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -63.4 | -40.1 | 177.5 | -69.5 | 176.1 | 0 | 0 | 0 | 112 | I23 A24 I30 T31 | I23-L27 HydrophobicContact CG2-CD1 3.88Å; I23-L27 HydrophobicContact CG2-CG 4.31Å; I23-L27 WeakPolarHBondContact O-CB 3.44Å; I23-L27 WeakPolarHBondContact O-CG 3.31Å; I23-L27 PolarHBondContact O-N 3.43Å; A24-L27 PolarHBondContact O-N 3.48Å; L27-I30 PolarHBondContact O-N 2.92Å; L27-T31 VanDerWaalsContact O-CB 3.31Å; L27-T31 WeakPolarHBondContact O-CB 3.43Å; L27-T31 PolarHBondContact O-N 2.98Å; L27-T31 PolarHBondContact O-OG1 3.17Å |
| 28 | G | 96.7 | Very high | 93.7 | Very high | 0 Ų | 0 | 56.4 Ų | 56.4 | 0% | 0 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -61.6 | -44.8 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | A24 W25 V26 T31 F32 | A24-G28 PolarHBondContact O-N 3.35Å; W25-G28 PolarHBondContact O-N 2.88Å; V26-G28 VanDerWaalsContact C-N 3.34Å; V26-G28 PolarHBondContact O-N 3.5Å; G28-T31 PolarHBondContact O-N 3.34Å; G28-F32 VanDerWaalsContact O-CB 3.25Å; G28-F32 WeakPolarHBondContact O-CB 3.23Å; G28-F32 PolarHBondContact O-N 2.92Å |
| 29 | L | 97.1 | Very high | 93.4 | Very high | 55 Ų | 55 | 59.1 Ų | 59.1 | 29% | 0.288 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -62.6 | -46.2 | 176.8 | -176.5 | 67.4 | 0 | 0 | 0 | 111.9 | W25 V26 T31 F32 I33 M69 | W25-L29 HydrophobicContact CH2-CD2 4.08Å; W25-L29 HydrophobicContact CZ2-CD2 4.4Å; W25-L29 HydrophobicContact CZ3-CD2 4.42Å; W25-L29 WeakPolarHBondContact O-CB 3.49Å; W25-L29 PolarHBondContact O-N 2.97Å; V26-L29 PolarHBondContact O-N 3.45Å; L29-T31 VanDerWaalsContact C-N 3.35Å; L29-T31 PolarHBondContact O-N 3.1Å; L29-F32 PolarHBondContact O-N 3.39Å; L29-I33 HydrophobicContact CD1-CD1 4.22Å; L29-I33 HydrophobicContact CG-CD1 3.97Å; L29-I33 VanDerWaalsContact O-CG1 3.27Å; L29-I33 WeakPolarHBondContact O-CG1 3.45Å; L29-I33 PolarHBondContact O-N 3.01Å; L29-M69 HydrophobicContact CD1-SD 3.77Å |
| 30 | I | 95.5 | Very high | 93.1 | Very high | 90 Ų | 90 | 60.7 Ų | 60.7 | 46% | 0.462 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -59.3 | -48.5 | 175.9 | -67.9 | 166.3 | 0 | 0 | 0 | 110 | V26 L27 F32 I33 V34 | V26-I30 HydrophobicContact CG1-CD1 3.86Å; V26-I30 HydrophobicContact CG1-CG1 4.48Å; V26-I30 VanDerWaalsContact O-CG1 3.31Å; V26-I30 WeakPolarHBondContact O-CG1 3.33Å; V26-I30 PolarHBondContact O-N 2.88Å; L27-I30 PolarHBondContact O-N 2.92Å; I30-F32 VanDerWaalsContact C-N 3.32Å; I30-F32 PolarHBondContact O-N 3.3Å; I30-I33 PolarHBondContact O-N 2.9Å; I30-V34 HydrophobicContact CG2-CG2 4.35Å; I30-V34 WeakPolarHBondContact O-CB 3.48Å; I30-V34 VanDerWaalsContact O-CG2 3.27Å; I30-V34 WeakPolarHBondContact O-CG2 3.12Å; I30-V34 PolarHBondContact O-N 2.93Å |
| 31 | T | 93.4 | Very high | 92.7 | Very high | 43 Ų | 43 | 61.1 Ų | 61.1 | 26% | 0.264 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -61.8 | -40.9 | -179.5 | -56.5 | 0 | 0 | 0 | 0 | 111.6 | L27 G28 L29 V34 G35 L61 | L27-T31 VanDerWaalsContact O-CB 3.31Å; L27-T31 WeakPolarHBondContact O-CB 3.43Å; L27-T31 PolarHBondContact O-N 2.98Å; L27-T31 PolarHBondContact O-OG1 3.17Å; G28-T31 PolarHBondContact O-N 3.34Å; L29-T31 VanDerWaalsContact C-N 3.35Å; L29-T31 PolarHBondContact O-N 3.1Å; T31-V34 PolarHBondContact O-N 3.48Å; T31-G35 PolarHBondContact O-N 2.69Å; T31-L61 HydrophobicContact CG2-CD1 4.16Å; T31-L61 HydrophobicContact CG2-CD2 4.36Å; T31-L61 HydrophobicContact CG2-CG 3.72Å |
| 32 | F | 95.1 | Very high | 91.7 | Very high | 44 Ų | 44 | 62.3 Ų | 62.3 | 19% | 0.193 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -63.7 | -47 | 176 | 179.9 | -112.2 | 0 | 0 | 0 | 112 | G28 L29 I30 G35 I36 I62 F66 | G28-F32 VanDerWaalsContact O-CB 3.25Å; G28-F32 WeakPolarHBondContact O-CB 3.23Å; G28-F32 PolarHBondContact O-N 2.92Å; L29-F32 PolarHBondContact O-N 3.39Å; I30-F32 VanDerWaalsContact C-N 3.32Å; I30-F32 PolarHBondContact O-N 3.3Å; F32-G35 PolarHBondContact O-N 2.88Å; F32-I36 HydrophobicContact CD1-CD1 3.86Å; F32-I36 HydrophobicContact CE1-CD1 3.42Å; F32-I36 VanDerWaalsContact CE1-CD1 3.42Å; F32-I36 HydrophobicContact CE2-CD1 4.17Å; F32-I36 HydrophobicContact CG-CD1 4.4Å; F32-I36 HydrophobicContact CZ-CD1 3.6Å; F32-I36 HydrophobicContact CZ-CG1 4.45Å; F32-I36 WeakPolarHBondContact O-CG1 3.33Å; F32-I36 PolarHBondContact O-N 3.49Å; F32-I62 HydrophobicContact CD2-CG2 4.1Å; F32-I62 HydrophobicContact CE2-CG2 3.76Å; F32-F66 HydrophobicContact CD2-CB 3.75Å; F32-F66 HydrophobicContact CD2-CD2 4.46Å; F32-F66 HydrophobicContact CE2-CB 3.81Å; F32-F66 AromaticContact CE2-CD2 3.96Å; F32-F66 HydrophobicContact CE2-CD2 3.96Å; F32-F66 HydrophobicContact CE2-CG 4.27Å; F32-F66 HydrophobicContact CZ-CD2 4.19Å |
| 33 | I | 93.5 | Very high | 90.6 | Very high | 89 Ų | 89 | 60.6 Ų | 60.6 | 46% | 0.456 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -61.8 | -46 | 176.9 | -68.1 | 166.7 | 0 | 0 | 0 | 110.6 | L29 I30 G35 I36 V37 | L29-I33 HydrophobicContact CD1-CD1 4.22Å; L29-I33 HydrophobicContact CG-CD1 3.97Å; L29-I33 VanDerWaalsContact O-CG1 3.27Å; L29-I33 WeakPolarHBondContact O-CG1 3.45Å; L29-I33 PolarHBondContact O-N 3.01Å; I30-I33 PolarHBondContact O-N 2.9Å; I33-G35 VanDerWaalsContact C-N 3.27Å; I33-G35 PolarHBondContact O-N 3.49Å; I33-I36 PolarHBondContact O-N 3.44Å; I33-I36 VanDerWaalsContact O-N 3.17Å; I33-V37 HydrophobicContact CG2-CG2 4.28Å; I33-V37 WeakPolarHBondContact O-CG2 3.34Å; I33-V37 PolarHBondContact O-N 3.23Å |
| 34 | V | 91 | Very high | 89.4 | Confident | 55 Ų | 55 | 57.3 Ų | 57.3 | 33% | 0.333 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -59.2 | -41.4 | 176.7 | 171.3 | 0 | 0 | 0 | 0 | 110.8 | I30 T31 V37 A38 F44 L61 | I30-V34 HydrophobicContact CG2-CG2 4.35Å; I30-V34 WeakPolarHBondContact O-CB 3.48Å; I30-V34 VanDerWaalsContact O-CG2 3.27Å; I30-V34 WeakPolarHBondContact O-CG2 3.12Å; I30-V34 PolarHBondContact O-N 2.93Å; T31-V34 PolarHBondContact O-N 3.48Å; V34-V37 PolarHBondContact O-N 3.34Å; V34-A38 VanDerWaalsContact O-CB 3.26Å; V34-A38 WeakPolarHBondContact O-CB 3.27Å; V34-A38 PolarHBondContact O-N 3.25Å; V34-F44 HydrophobicContact CG1-CD1 4.42Å; V34-L61 HydrophobicContact CB-CD2 4.33Å; V34-L61 HydrophobicContact CG1-CD2 3.82Å |
| 35 | G | 91 | Very high | 88.2 | Confident | 0 Ų | 0 | 58.2 Ų | 58.2 | 0% | 0 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -60.7 | -45 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113 | T31 F32 I33 A38 R39 I62 | T31-G35 PolarHBondContact O-N 2.69Å; F32-G35 PolarHBondContact O-N 2.88Å; I33-G35 VanDerWaalsContact C-N 3.27Å; I33-G35 PolarHBondContact O-N 3.49Å; G35-A38 PolarHBondContact O-N 3.02Å; G35-R39 WeakPolarHBondContact O-CB 3.25Å; G35-R39 PolarHBondContact O-N 3.47Å; G35-I62 VanDerWaalsContact C-CG1 3.41Å |
| 36 | I | 91.9 | Very high | 86.8 | Confident | 68 Ų | 68 | 61.7 Ų | 61.7 | 35% | 0.349 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -63.5 | -49.2 | 177.2 | -67.8 | 168.8 | 0 | 0 | 0 | 110.8 | F32 I33 A38 R39 V40 I62 | F32-I36 HydrophobicContact CD1-CD1 3.86Å; F32-I36 HydrophobicContact CE1-CD1 3.42Å; F32-I36 VanDerWaalsContact CE1-CD1 3.42Å; F32-I36 HydrophobicContact CE2-CD1 4.17Å; F32-I36 HydrophobicContact CG-CD1 4.4Å; F32-I36 HydrophobicContact CZ-CD1 3.6Å; F32-I36 HydrophobicContact CZ-CG1 4.45Å; F32-I36 WeakPolarHBondContact O-CG1 3.33Å; F32-I36 PolarHBondContact O-N 3.49Å; I33-I36 PolarHBondContact O-N 3.44Å; I33-I36 VanDerWaalsContact O-N 3.17Å; I36-A38 VanDerWaalsContact C-N 3.29Å; I36-A38 PolarHBondContact O-N 3.29Å; I36-R39 WeakPolarHBondContact O-CB 3.45Å; I36-R39 PolarHBondContact O-N 3.43Å; I36-R39 VanDerWaalsContact O-N 3.12Å; I36-V40 HydrophobicContact CG2-CG2 4.3Å; I36-V40 WeakPolarHBondContact O-CG2 3.29Å; I36-V40 PolarHBondContact O-N 2.91Å; I36-I62 HydrophobicContact CG1-CD1 4.4Å; I36-I62 HydrophobicContact CG1-CG1 4.27Å |
| 37 | V | 90.6 | Very high | 85.4 | Confident | 67 Ų | 67 | 62.2 Ų | 62.2 | 41% | 0.406 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -59.5 | -43.4 | 179.8 | 171.9 | 0 | 0 | 0 | 0 | 110.4 | I33 V34 R39 V40 N41 | I33-V37 HydrophobicContact CG2-CG2 4.28Å; I33-V37 WeakPolarHBondContact O-CG2 3.34Å; I33-V37 PolarHBondContact O-N 3.23Å; V34-V37 PolarHBondContact O-N 3.34Å; V37-R39 VanDerWaalsContact C-N 3.32Å; V37-R39 PolarHBondContact O-N 2.9Å; V37-V40 PolarHBondContact O-N 2.95Å; V37-N41 WeakPolarHBondContact CG1-ND2 3.31Å; V37-N41 WeakPolarHBondContact O-CB 3.31Å; V37-N41 PolarHBondContact O-N 3.4Å |
| 38 | A | 86.7 | Confident | 83.9 | Confident | 1 Ų | 1 | 60.8 Ų | 60.8 | 1% | 0.008 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -63.6 | -38 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | V34 G35 I36 G42 S43 F44 V54 A58 | V34-A38 VanDerWaalsContact O-CB 3.26Å; V34-A38 WeakPolarHBondContact O-CB 3.27Å; V34-A38 PolarHBondContact O-N 3.25Å; G35-A38 PolarHBondContact O-N 3.02Å; I36-A38 VanDerWaalsContact C-N 3.29Å; I36-A38 PolarHBondContact O-N 3.29Å; A38-G42 PolarHBondContact O-N 3.19Å; A38-G42 VanDerWaalsContact O-N 3.12Å; A38-S43 WeakPolarHBondContact CA-O 3.39Å; A38-F44 HydrophobicContact CB-CD1 3.2Å; A38-F44 HydrophobicContact CB-CD2 4.34Å; A38-F44 HydrophobicContact CB-CE1 3.21Å; A38-F44 HydrophobicContact CB-CE2 4.38Å; A38-F44 HydrophobicContact CB-CG 3.8Å; A38-F44 HydrophobicContact CB-CZ 3.85Å; A38-V54 WeakPolarHBondContact O-CG1 3.24Å; A38-A58 HydrophobicContact CB-CB 3.95Å |
| 39 | R | 86 | Confident | 82 | Confident | 111 Ų | 111 | 64.3 Ų | 64.3 | 42% | 0.419 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -67 | -39.7 | 176.7 | -176.4 | 59.4 | 174.5 | 155.2 | 1.6 | 112.3 | G35 I36 V37 H55 A58 I62 | G35-R39 WeakPolarHBondContact O-CB 3.25Å; G35-R39 PolarHBondContact O-N 3.47Å; I36-R39 WeakPolarHBondContact O-CB 3.45Å; I36-R39 PolarHBondContact O-N 3.43Å; I36-R39 VanDerWaalsContact O-N 3.12Å; V37-R39 VanDerWaalsContact C-N 3.32Å; V37-R39 PolarHBondContact O-N 2.9Å; R39-H55 PolarHBondContact NH1-ND1 2.93Å; R39-A58 HydrophobicContact CB-CB 4.03Å; R39-I62 HydrophobicContact CB-CD1 3.99Å; R39-I62 HydrophobicContact CG-CD1 4.38Å |
| 40 | V | 86.5 | Confident | 80.4 | Confident | 112 Ų | 112 | 67.3 Ų | 67.3 | 68% | 0.679 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -77.7 | -46.7 | -177.7 | 174 | 0 | 0 | 0 | 0 | 111.7 | I36 V37 G42 | I36-V40 HydrophobicContact CG2-CG2 4.3Å; I36-V40 WeakPolarHBondContact O-CG2 3.29Å; I36-V40 PolarHBondContact O-N 2.91Å; V37-V40 PolarHBondContact O-N 2.95Å; V40-G42 VanDerWaalsContact C-N 3.31Å; V40-G42 PolarHBondContact O-N 3.31Å |
| 41 | N | 83.4 | Confident | 78.8 | Confident | 114 Ų | 114 | 65.2 Ų | 65.2 | 61% | 0.61 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -80.2 | -14.1 | -175.8 | -67.2 | -6.6 | 0 | 0 | 0 | 113 | V37 S43 | V37-N41 WeakPolarHBondContact CG1-ND2 3.31Å; V37-N41 WeakPolarHBondContact O-CB 3.31Å; V37-N41 PolarHBondContact O-N 3.4Å; N41-S43 PolarHBondContact O-N 3.48Å |
| 42 | G | 73.3 | Confident | 77.2 | Confident | 30 Ų | 30 | 64 Ų | 64 | 31% | 0.309 | 36% | 0.362 | S | S | . | . | S | Bend | trans | 67.2 | 16.2 | -173.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | A38 V40 | A38-G42 PolarHBondContact O-N 3.19Å; A38-G42 VanDerWaalsContact O-N 3.12Å; V40-G42 VanDerWaalsContact C-N 3.31Å; V40-G42 PolarHBondContact O-N 3.31Å |
| 43 | S | 70.9 | Confident | 75.8 | Confident | 36 Ų | 36 | 62.6 Ų | 62.6 | 25% | 0.252 | 36% | 0.359 | S | S | . | . | S | Bend | trans | -151.8 | 139 | 179.9 | 158 | 0 | 0 | 0 | 0 | 109.5 | A38 N41 G45 D48 | A38-S43 WeakPolarHBondContact CA-O 3.39Å; N41-S43 PolarHBondContact O-N 3.48Å; S43-G45 PolarHBondContact O-N 3.38Å; S43-G45 WeakPolarHBondContact OG-CA 3.18Å; S43-G45 PolarHBondContact OG-N 2.95Å; S43-D48 WeakPolarHBondContact CA-OD1 3.35Å; S43-D48 WeakPolarHBondContact CB-OD2 3.48Å; S43-D48 PolarHBondContact OG-OD1 2.94Å; S43-D48 VanDerWaalsContact OG-OD1 3.12Å; S43-D48 PolarHBondContact OG-OD2 2.85Å |
| 44 | F | 70.3 | Confident | 74.6 | Confident | 18 Ų | 18 | 58.6 Ų | 58.6 | 8% | 0.079 | 34% | 0.339 | C | S | . | . | trans | -78.3 | 8.5 | 168.7 | -74.1 | -77.1 | 0 | 0 | 0 | 112.9 | V34 A38 I46 L47 D48 I51 V54 A58 L61 | V34-F44 HydrophobicContact CG1-CD1 4.42Å; A38-F44 HydrophobicContact CB-CD1 3.2Å; A38-F44 HydrophobicContact CB-CD2 4.34Å; A38-F44 HydrophobicContact CB-CE1 3.21Å; A38-F44 HydrophobicContact CB-CE2 4.38Å; A38-F44 HydrophobicContact CB-CG 3.8Å; A38-F44 HydrophobicContact CB-CZ 3.85Å; F44-I46 PolarHBondContact O-N 2.96Å; F44-L47 HydrophobicContact CB-CB 3.66Å; F44-L47 HydrophobicContact CG-CB 4.5Å; F44-L47 PolarHBondContact O-N 3.46Å; F44-D48 WeakPolarHBondContact CA-OD1 3.4Å; F44-D48 PolarHBondContact N-OD1 3.41Å; F44-I51 HydrophobicContact CD1-CD1 4.47Å; F44-I51 HydrophobicContact CD2-CB 3.73Å; F44-I51 HydrophobicContact CD2-CG2 4.07Å; F44-I51 HydrophobicContact CE1-CD1 4.24Å; F44-I51 HydrophobicContact CE2-CB 3.54Å; F44-I51 HydrophobicContact CE2-CD1 4.21Å; F44-I51 HydrophobicContact CE2-CG1 4.47Å; F44-I51 HydrophobicContact CE2-CG2 3.34Å; F44-I51 HydrophobicContact CZ-CB 4.24Å; F44-I51 HydrophobicContact CZ-CD1 4.09Å; F44-I51 HydrophobicContact CZ-CG2 3.88Å; F44-V54 HydrophobicContact CD2-CB 4.45Å; F44-V54 HydrophobicContact CD2-CG1 4.02Å; F44-V54 HydrophobicContact CD2-CG2 4.28Å; F44-V54 HydrophobicContact CE2-CB 4.31Å; F44-V54 HydrophobicContact CE2-CG1 4.01Å; F44-A58 HydrophobicContact CE1-CB 4.47Å; F44-A58 HydrophobicContact CZ-CB 4.07Å; F44-L61 HydrophobicContact CE1-CD2 3.98Å | ||
| 45 | G | 70.3 | Confident | 73.8 | Confident | 44 Ų | 44 | 59.4 Ų | 59.4 | 45% | 0.454 | 34% | 0.339 | S | S | . | . | G | 310 helix | trans | 62.4 | -121.4 | -176.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | S43 L47 D48 | S43-G45 PolarHBondContact O-N 3.38Å; S43-G45 WeakPolarHBondContact OG-CA 3.18Å; S43-G45 PolarHBondContact OG-N 2.95Å; G45-L47 PolarHBondContact O-N 3.45Å; G45-D48 WeakPolarHBondContact O-CB 3.31Å; G45-D48 VanDerWaalsContact O-CG 3.31Å; G45-D48 PolarHBondContact O-N 3.36Å |
| 46 | I | 66.5 | Low | 73.1 | Confident | 162 Ų | 162 | 62.4 Ų | 62.4 | 83% | 0.831 | 36% | 0.364 | S | S | * | . | G | 310 helix | trans | -60 | -18.6 | 177.6 | 55.2 | 159 | 0 | 0 | 0 | 113.8 | F44 | F44-I46 PolarHBondContact O-N 2.96Š|
| 47 | L | 66.9 | Low | 72.6 | Confident | 69 Ų | 69 | 59.9 Ų | 59.9 | 36% | 0.361 | 35% | 0.354 | S | S | . | . | G | 310 helix | trans | -90.3 | -0.4 | 178.6 | -95.4 | 71.6 | 0 | 0 | 0 | 113.7 | F44 G45 A49 H50 I51 | F44-L47 HydrophobicContact CB-CB 3.66Å; F44-L47 HydrophobicContact CG-CB 4.5Å; F44-L47 PolarHBondContact O-N 3.46Å; G45-L47 PolarHBondContact O-N 3.45Å; L47-A49 PolarHBondContact O-N 2.87Å; L47-A49 VanDerWaalsContact O-N 3.1Å; L47-H50 WeakPolarHBondContact O-CB 3.27Å; L47-H50 PolarHBondContact O-N 3.28Å; L47-I51 PolarHBondContact O-N 3.27Å |
| 48 | D | 64.9 | Low | 72.4 | Confident | 68 Ų | 68 | 56.7 Ų | 56.7 | 36% | 0.364 | 34% | 0.335 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.2 | -31.9 | 178.5 | -81.4 | -17.3 | 0 | 0 | 0 | 112.8 | S43 F44 G45 H50 | S43-D48 WeakPolarHBondContact CA-OD1 3.35Å; S43-D48 WeakPolarHBondContact CB-OD2 3.48Å; S43-D48 PolarHBondContact OG-OD1 2.94Å; S43-D48 VanDerWaalsContact OG-OD1 3.12Å; S43-D48 PolarHBondContact OG-OD2 2.85Å; F44-D48 WeakPolarHBondContact CA-OD1 3.4Å; F44-D48 PolarHBondContact N-OD1 3.41Å; G45-D48 WeakPolarHBondContact O-CB 3.31Å; G45-D48 VanDerWaalsContact O-CG 3.31Å; G45-D48 PolarHBondContact O-N 3.36Å; D48-H50 PolarHBondContact O-N 3.14Å |
| 49 | A | 58.5 | Low | 72.5 | Confident | 74 Ų | 74 | 60.4 Ų | 60.4 | 61% | 0.612 | 36% | 0.355 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.8 | -17.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | L47 F145 | L47-A49 PolarHBondContact O-N 2.87Å; L47-A49 VanDerWaalsContact O-N 3.1Å; A49-F145 WeakPolarHBondContact O-CD2 3.37Å; A49-F145 WeakPolarHBondContact O-CE2 3.49Å |
| 50 | H | 61.5 | Low | 72.7 | Confident | 119 Ų | 119 | 60.7 Ų | 60.7 | 55% | 0.551 | 36% | 0.364 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -108.5 | -27.5 | -173.1 | -64 | 85.7 | 0 | 0 | 0 | 113.7 | L47 D48 F145 | L47-H50 WeakPolarHBondContact O-CB 3.27Å; L47-H50 PolarHBondContact O-N 3.28Å; D48-H50 PolarHBondContact O-N 3.14Å; H50-F145 WeakPolarHBondContact O-CE2 3.48Å; H50-F145 WeakPolarHBondContact O-CZ 3.32Å |
| 51 | I | 62.7 | Low | 72.9 | Confident | 46 Ų | 46 | 57.4 Ų | 57.4 | 24% | 0.236 | 34% | 0.342 | C | S | . | . | trans | -132.2 | 87.7 | -174.2 | -48.4 | 176.1 | 0 | 0 | 0 | 109.5 | F44 L47 | F44-I51 HydrophobicContact CD1-CD1 4.47Å; F44-I51 HydrophobicContact CD2-CB 3.73Å; F44-I51 HydrophobicContact CD2-CG2 4.07Å; F44-I51 HydrophobicContact CE1-CD1 4.24Å; F44-I51 HydrophobicContact CE2-CB 3.54Å; F44-I51 HydrophobicContact CE2-CD1 4.21Å; F44-I51 HydrophobicContact CE2-CG1 4.47Å; F44-I51 HydrophobicContact CE2-CG2 3.34Å; F44-I51 HydrophobicContact CZ-CB 4.24Å; F44-I51 HydrophobicContact CZ-CD1 4.09Å; F44-I51 HydrophobicContact CZ-CG2 3.88Å; L47-I51 PolarHBondContact O-N 3.27Å | ||
| 52 | P | 59.1 | Low | 73.4 | Confident | 16 Ų | 16 | 53.9 Ų | 53.9 | 10% | 0.104 | 32% | 0.323 | C | S | . | . | trans | -73.9 | -25.9 | -175.2 | 33.1 | -43.4 | 0 | 0 | 0 | 114.1 | V54 K141 L142 F145 | P52-V54 VanDerWaalsContact C-N 3.3Å; P52-V54 PolarHBondContact O-N 3.34Å; P52-V54 VanDerWaalsContact O-N 3.15Å; P52-K141 VanDerWaalsContact CB-C 3.46Å; P52-K141 HydrophobicContact CB-CB 3.95Å; P52-K141 WeakPolarHBondContact CB-O 3.42Å; P52-K141 WeakPolarHBondContact O-CB 3.5Å; P52-K141 WeakPolarHBondContact O-CD 3.42Å; P52-L142 HydrophobicContact CG-CB 4.43Å; P52-L142 HydrophobicContact CG-CD1 3.88Å; P52-F145 HydrophobicContact CB-CB 3.57Å; P52-F145 HydrophobicContact CB-CG 4.18Å; P52-F145 HydrophobicContact CG-CB 3.35Å; P52-F145 HydrophobicContact CG-CD1 3.79Å; P52-F145 HydrophobicContact CG-CD2 4.34Å; P52-F145 HydrophobicContact CG-CG 3.57Å | ||
| 53 | A | 65.9 | Low | 74.4 | Confident | 15 Ų | 15 | 55.3 Ų | 55.3 | 12% | 0.124 | 33% | 0.332 | C | S | . | . | trans | -88.4 | 75.6 | 178.2 | 0 | 0 | 0 | 0 | 0 | 107.7 | H55 A56 G57 E138 L142 | A53-H55 VanDerWaalsContact C-N 3.28Å; A53-H55 PolarHBondContact O-N 3.28Å; A53-A56 HydrophobicContact CB-CB 4.28Å; A53-G57 WeakPolarHBondContact O-CA 3.4Å; A53-G57 PolarHBondContact O-N 3.43Å; A53-E138 VanDerWaalsContact CA-OE2 3.26Å; A53-E138 WeakPolarHBondContact CA-OE2 3.48Å; A53-L142 HydrophobicContact CB-CD1 4.43Å | ||
| 54 | V | 68.7 | Low | 75.5 | Confident | 5 Ų | 5 | 56.7 Ų | 56.7 | 3% | 0.03 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -59.4 | -41.9 | -169.9 | -173.3 | 0 | 0 | 0 | 0 | 111.2 | A38 F44 P52 A58 E138 | A38-V54 WeakPolarHBondContact O-CG1 3.24Å; F44-V54 HydrophobicContact CD2-CB 4.45Å; F44-V54 HydrophobicContact CD2-CG1 4.02Å; F44-V54 HydrophobicContact CD2-CG2 4.28Å; F44-V54 HydrophobicContact CE2-CB 4.31Å; F44-V54 HydrophobicContact CE2-CG1 4.01Å; P52-V54 VanDerWaalsContact C-N 3.3Å; P52-V54 PolarHBondContact O-N 3.34Å; P52-V54 VanDerWaalsContact O-N 3.15Å; V54-A58 WeakPolarHBondContact O-CA 3.48Å; V54-A58 WeakPolarHBondContact O-CB 3.49Å; V54-A58 PolarHBondContact O-N 2.96Å; V54-E138 PolarHBondContact N-OE2 3.31Å |
| 55 | H | 74 | Confident | 76.7 | Confident | 72 Ų | 72 | 55.8 Ų | 55.8 | 33% | 0.333 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -75.8 | -47.7 | -177.4 | -66.1 | -30 | 0 | 0 | 0 | 112.9 | R39 A53 N59 E138 | R39-H55 PolarHBondContact NH1-ND1 2.93Å; A53-H55 VanDerWaalsContact C-N 3.28Å; A53-H55 PolarHBondContact O-N 3.28Å; H55-N59 WeakPolarHBondContact O-CB 3.47Å; H55-N59 PolarHBondContact O-N 3.4Å; H55-N59 PolarHBondContact O-ND2 2.93Å; H55-E138 HydrophobicContact CB-CG 4.23Å; H55-E138 IonicContact CD2-OE1 3.74Å; H55-E138 PolarHBondContact CD2-OE1 3.35Å; H55-E138 IonicContact CG-OE1 3.93Å; H55-E138 PolarHBondContact N-OE2 2.86Å |
| 56 | A | 76.9 | Confident | 78 | Confident | 64 Ų | 64 | 58.3 Ų | 58.3 | 53% | 0.529 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -66.9 | -43.6 | 179 | 0 | 0 | 0 | 0 | 0 | 111.2 | A53 L60 | A53-A56 HydrophobicContact CB-CB 4.28Å; A56-L60 WeakPolarHBondContact O-CB 3.42Å; A56-L60 PolarHBondContact O-N 2.87Å |
| 57 | G | 81.6 | Confident | 79.3 | Confident | 15 Ų | 15 | 53.7 Ų | 53.7 | 16% | 0.155 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -62.3 | -46.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112 | A53 L60 L61 | A53-G57 WeakPolarHBondContact O-CA 3.4Å; A53-G57 PolarHBondContact O-N 3.43Å; G57-L60 PolarHBondContact O-N 3.46Å; G57-L61 WeakPolarHBondContact O-CB 3.32Å; G57-L61 PolarHBondContact O-N 3.44Å |
| 58 | A | 86.2 | Confident | 80.7 | Confident | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -64.5 | -43 | 179.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | A38 R39 F44 V54 L60 L61 I62 | A38-A58 HydrophobicContact CB-CB 3.95Å; R39-A58 HydrophobicContact CB-CB 4.03Å; F44-A58 HydrophobicContact CE1-CB 4.47Å; F44-A58 HydrophobicContact CZ-CB 4.07Å; V54-A58 WeakPolarHBondContact O-CA 3.48Å; V54-A58 WeakPolarHBondContact O-CB 3.49Å; V54-A58 PolarHBondContact O-N 2.96Å; A58-L60 VanDerWaalsContact C-N 3.32Å; A58-L60 PolarHBondContact O-N 2.84Å; A58-L61 PolarHBondContact O-N 3.09Å; A58-I62 WeakPolarHBondContact O-CB 3.31Å; A58-I62 WeakPolarHBondContact O-CG1 3.48Å; A58-I62 PolarHBondContact O-N 2.98Å |
| 59 | N | 88.5 | Confident | 82.1 | Confident | 79 Ų | 79 | 51.3 Ų | 51.3 | 42% | 0.422 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -60.3 | -42.6 | 176.1 | -71.9 | -13.4 | 0 | 0 | 0 | 111.7 | H55 A63 | H55-N59 WeakPolarHBondContact O-CB 3.47Å; H55-N59 PolarHBondContact O-N 3.4Å; H55-N59 PolarHBondContact O-ND2 2.93Å; N59-A63 WeakPolarHBondContact O-CB 3.28Å; N59-A63 PolarHBondContact O-N 3.36Å |
| 60 | L | 89.9 | Confident | 83.9 | Confident | 116 Ų | 116 | 50.5 Ų | 50.5 | 61% | 0.607 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -63.6 | -43.9 | 174.9 | -177.1 | 66 | 0 | 0 | 0 | 111.4 | A56 G57 A58 A63 V64 | A56-L60 WeakPolarHBondContact O-CB 3.42Å; A56-L60 PolarHBondContact O-N 2.87Å; G57-L60 PolarHBondContact O-N 3.46Å; A58-L60 VanDerWaalsContact C-N 3.32Å; A58-L60 PolarHBondContact O-N 2.84Å; L60-A63 PolarHBondContact O-N 2.93Å; L60-V64 HydrophobicContact CD1-CG2 4.06Å; L60-V64 HydrophobicContact CG-CG2 4.32Å; L60-V64 WeakPolarHBondContact O-CB 3.43Å; L60-V64 VanDerWaalsContact O-CG2 3.29Å; L60-V64 WeakPolarHBondContact O-CG2 3.27Å; L60-V64 PolarHBondContact O-N 3.36Å |
| 61 | L | 90.6 | Very high | 85.4 | Confident | 44 Ų | 44 | 46.1 Ų | 46.1 | 23% | 0.23 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -64.2 | -40.4 | 179.6 | -140.2 | 74 | 0 | 0 | 0 | 112 | T31 V34 F44 G57 A58 G65 | T31-L61 HydrophobicContact CG2-CD1 4.16Å; T31-L61 HydrophobicContact CG2-CD2 4.36Å; T31-L61 HydrophobicContact CG2-CG 3.72Å; V34-L61 HydrophobicContact CB-CD2 4.33Å; V34-L61 HydrophobicContact CG1-CD2 3.82Å; F44-L61 HydrophobicContact CE1-CD2 3.98Å; G57-L61 WeakPolarHBondContact O-CB 3.32Å; G57-L61 PolarHBondContact O-N 3.44Å; A58-L61 PolarHBondContact O-N 3.09Å; L61-G65 WeakPolarHBondContact O-CA 3.46Å; L61-G65 PolarHBondContact O-N 3.44Å |
| 62 | I | 93.4 | Very high | 87 | Confident | 40 Ų | 40 | 44.1 Ų | 44.1 | 21% | 0.205 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -60.8 | -51.4 | 172.9 | -69.2 | 167.3 | 0 | 0 | 0 | 109.7 | F32 G35 I36 R39 A58 F66 | F32-I62 HydrophobicContact CD2-CG2 4.1Å; F32-I62 HydrophobicContact CE2-CG2 3.76Å; G35-I62 VanDerWaalsContact C-CG1 3.41Å; I36-I62 HydrophobicContact CG1-CD1 4.4Å; I36-I62 HydrophobicContact CG1-CG1 4.27Å; R39-I62 HydrophobicContact CB-CD1 3.99Å; R39-I62 HydrophobicContact CG-CD1 4.38Å; A58-I62 WeakPolarHBondContact O-CB 3.31Å; A58-I62 WeakPolarHBondContact O-CG1 3.48Å; A58-I62 PolarHBondContact O-N 2.98Å; I62-F66 WeakPolarHBondContact O-CB 3.44Å; I62-F66 PolarHBondContact O-N 3.19Å |
| 63 | A | 94.3 | Very high | 88.6 | Confident | 59 Ų | 59 | 48.7 Ų | 48.7 | 49% | 0.488 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -61.8 | -48.7 | -177.8 | 0 | 0 | 0 | 0 | 0 | 112 | N59 L60 F67 | N59-A63 WeakPolarHBondContact O-CB 3.28Å; N59-A63 PolarHBondContact O-N 3.36Å; L60-A63 PolarHBondContact O-N 2.93Å; A63-F67 WeakPolarHBondContact O-CB 3.48Å; A63-F67 PolarHBondContact O-N 3.5Å |
| 64 | V | 94.4 | Very high | 90 | Very high | 65 Ų | 65 | 49 Ų | 49 | 39% | 0.394 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -67.2 | -45.4 | 179.8 | 173.6 | 0 | 0 | 0 | 0 | 111 | L60 F66 F67 I68 | L60-V64 HydrophobicContact CD1-CG2 4.06Å; L60-V64 HydrophobicContact CG-CG2 4.32Å; L60-V64 WeakPolarHBondContact O-CB 3.43Å; L60-V64 VanDerWaalsContact O-CG2 3.29Å; L60-V64 WeakPolarHBondContact O-CG2 3.27Å; L60-V64 PolarHBondContact O-N 3.36Å; V64-F66 PolarHBondContact O-N 3.21Å; V64-F67 PolarHBondContact O-N 3.24Å; V64-I68 HydrophobicContact CG1-CD1 3.65Å; V64-I68 HydrophobicContact CG1-CG1 4.33Å; V64-I68 VanDerWaalsContact O-CG1 3.28Å; V64-I68 WeakPolarHBondContact O-CG1 3.48Å; V64-I68 PolarHBondContact O-N 3.29Å |
| 65 | G | 96.2 | Very high | 91.2 | Very high | 0 Ų | 0 | 48.8 Ų | 48.8 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -61.3 | -44.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | L61 F67 I68 M69 | L61-G65 WeakPolarHBondContact O-CA 3.46Å; L61-G65 PolarHBondContact O-N 3.44Å; G65-F67 PolarHBondContact O-N 2.74Å; G65-I68 PolarHBondContact O-N 3.06Å; G65-M69 VanDerWaalsContact O-CB 3.29Å; G65-M69 WeakPolarHBondContact O-CB 3.47Å; G65-M69 PolarHBondContact O-N 2.99Å |
| 66 | F | 96.3 | Very high | 92.1 | Very high | 96 Ų | 96 | 46 Ų | 46 | 42% | 0.421 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -60.9 | -44.3 | 175.6 | -177.9 | -109.8 | 0 | 0 | 0 | 112 | F32 I62 V64 M69 I70 | F32-F66 HydrophobicContact CD2-CB 3.75Å; F32-F66 HydrophobicContact CD2-CD2 4.46Å; F32-F66 HydrophobicContact CE2-CB 3.81Å; F32-F66 AromaticContact CE2-CD2 3.96Å; F32-F66 HydrophobicContact CE2-CD2 3.96Å; F32-F66 HydrophobicContact CE2-CG 4.27Å; F32-F66 HydrophobicContact CZ-CD2 4.19Å; I62-F66 WeakPolarHBondContact O-CB 3.44Å; I62-F66 PolarHBondContact O-N 3.19Å; V64-F66 PolarHBondContact O-N 3.21Å; F66-M69 HydrophobicContact CD2-CE 3.55Å; F66-M69 HydrophobicContact CE2-CE 3.88Å; F66-M69 WeakPolarHBondContact O-CB 3.4Å; F66-M69 PolarHBondContact O-N 3.47Å; F66-I70 HydrophobicContact CD1-CD1 3.92Å; F66-I70 HydrophobicContact CE1-CD1 3.32Å; F66-I70 HydrophobicContact CE1-CG1 4.38Å; F66-I70 HydrophobicContact CE2-CD1 4.07Å; F66-I70 HydrophobicContact CE2-CG1 4.48Å; F66-I70 HydrophobicContact CZ-CD1 3.41Å; F66-I70 VanDerWaalsContact CZ-CD1 3.41Å; F66-I70 HydrophobicContact CZ-CG1 4.27Å; F66-I70 PolarHBondContact O-N 2.92Å |
| 67 | F | 95.1 | Very high | 92.9 | Very high | 66 Ų | 66 | 44 Ų | 44 | 29% | 0.289 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -65.2 | -45.1 | 179.8 | -174.8 | -97.7 | 0 | 0 | 0 | 112.2 | A63 V64 G65 M69 I70 M71 F93 C97 | A63-F67 WeakPolarHBondContact O-CB 3.48Å; A63-F67 PolarHBondContact O-N 3.5Å; V64-F67 PolarHBondContact O-N 3.24Å; G65-F67 PolarHBondContact O-N 2.74Å; F67-M69 VanDerWaalsContact C-N 3.32Å; F67-M69 PolarHBondContact O-N 3.38Å; F67-I70 PolarHBondContact O-N 3.49Å; F67-M71 HydrophobicContact CD1-CE 3.48Å; F67-M71 VanDerWaalsContact CD1-CE 3.48Å; F67-M71 HydrophobicContact CD1-CG 4.37Å; F67-M71 HydrophobicContact CD1-SD 4.04Å; F67-M71 HydrophobicContact CE1-CE 3.22Å; F67-M71 HydrophobicContact CE1-CG 3.89Å; F67-M71 HydrophobicContact CE1-SD 3.23Å; F67-M71 WeakPolarHBondContact CE1-SD 3.3Å; F67-M71 HydrophobicContact CZ-CE 4.22Å; F67-M71 HydrophobicContact CZ-CG 4.01Å; F67-M71 HydrophobicContact CZ-SD 3.64Å; F67-M71 WeakPolarHBondContact O-CG 3.24Å; F67-M71 PolarHBondContact O-N 2.96Å; F67-F93 AromaticContact CE2-CD1 3.98Å; F67-F93 HydrophobicContact CE2-CD1 3.98Å; F67-F93 HydrophobicContact CE2-CE1 4.45Å; F67-F93 HydrophobicContact CZ-CD1 4.22Å; F67-C97 WeakPolarHBondContact CE1-SG 3.38Å; F67-C97 WeakPolarHBondContact CZ-SG 3.32Å |
| 68 | I | 95.3 | Very high | 93.4 | Very high | 54 Ų | 54 | 43.3 Ų | 43.3 | 28% | 0.277 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -61.1 | -42 | 174.5 | -66.8 | 169.4 | 0 | 0 | 0 | 110.7 | A24 V64 G65 M71 G72 | A24-I68 WeakPolarHBondContact O-CG2 3.43Å; V64-I68 HydrophobicContact CG1-CD1 3.65Å; V64-I68 HydrophobicContact CG1-CG1 4.33Å; V64-I68 VanDerWaalsContact O-CG1 3.28Å; V64-I68 WeakPolarHBondContact O-CG1 3.48Å; V64-I68 PolarHBondContact O-N 3.29Å; G65-I68 PolarHBondContact O-N 3.06Å; I68-M71 HydrophobicContact CG1-CE 4.41Å; I68-M71 PolarHBondContact O-N 3.49Å; I68-G72 PolarHBondContact O-N 3Å |
| 69 | M | 95.8 | Very high | 93.6 | Very high | 33 Ų | 33 | 43.3 Ų | 43.3 | 16% | 0.163 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -60.3 | -47.2 | 176.9 | -178.9 | -174.6 | 68.3 | 0 | 0 | 111.5 | W25 L29 G65 F66 F67 G72 F73 | W25-M69 VanDerWaalsContact CD1-O 3.26Å; L29-M69 HydrophobicContact CD1-SD 3.77Å; G65-M69 VanDerWaalsContact O-CB 3.29Å; G65-M69 WeakPolarHBondContact O-CB 3.47Å; G65-M69 PolarHBondContact O-N 2.99Å; F66-M69 HydrophobicContact CD2-CE 3.55Å; F66-M69 HydrophobicContact CE2-CE 3.88Å; F66-M69 WeakPolarHBondContact O-CB 3.4Å; F66-M69 PolarHBondContact O-N 3.47Å; F67-M69 VanDerWaalsContact C-N 3.32Å; F67-M69 PolarHBondContact O-N 3.38Å; M69-G72 PolarHBondContact O-N 3.37Å; M69-F73 WeakPolarHBondContact O-CB 3.35Å; M69-F73 PolarHBondContact O-N 2.99Å |
| 70 | I | 95 | Very high | 93.7 | Very high | 57 Ų | 57 | 44.4 Ų | 44.4 | 29% | 0.292 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -61.6 | -48.4 | 176.8 | -71.3 | 177.2 | 0 | 0 | 0 | 111 | F66 F67 G72 F73 L74 | F66-I70 HydrophobicContact CD1-CD1 3.92Å; F66-I70 HydrophobicContact CE1-CD1 3.32Å; F66-I70 HydrophobicContact CE1-CG1 4.38Å; F66-I70 HydrophobicContact CE2-CD1 4.07Å; F66-I70 HydrophobicContact CE2-CG1 4.48Å; F66-I70 HydrophobicContact CZ-CD1 3.41Å; F66-I70 VanDerWaalsContact CZ-CD1 3.41Å; F66-I70 HydrophobicContact CZ-CG1 4.27Å; F66-I70 PolarHBondContact O-N 2.92Å; F67-I70 PolarHBondContact O-N 3.49Å; I70-G72 VanDerWaalsContact C-N 3.34Å; I70-G72 PolarHBondContact O-N 3.48Å; I70-F73 PolarHBondContact O-N 3.49Å; I70-L74 HydrophobicContact CG2-CD1 3.81Å; I70-L74 HydrophobicContact CG2-CG 4.21Å; I70-L74 WeakPolarHBondContact O-CG 3.5Å; I70-L74 PolarHBondContact O-N 2.97Å |
| 71 | M | 93.9 | Very high | 93.7 | Very high | 27 Ų | 27 | 47.9 Ų | 47.9 | 13% | 0.133 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -59.8 | -44.4 | 179.3 | -73.6 | -165.3 | -60.6 | 0 | 0 | 112 | F67 I68 F73 L74 G75 F90 F93 V94 | F67-M71 HydrophobicContact CD1-CE 3.48Å; F67-M71 VanDerWaalsContact CD1-CE 3.48Å; F67-M71 HydrophobicContact CD1-CG 4.37Å; F67-M71 HydrophobicContact CD1-SD 4.04Å; F67-M71 HydrophobicContact CE1-CE 3.22Å; F67-M71 HydrophobicContact CE1-CG 3.89Å; F67-M71 HydrophobicContact CE1-SD 3.23Å; F67-M71 WeakPolarHBondContact CE1-SD 3.3Å; F67-M71 HydrophobicContact CZ-CE 4.22Å; F67-M71 HydrophobicContact CZ-CG 4.01Å; F67-M71 HydrophobicContact CZ-SD 3.64Å; F67-M71 WeakPolarHBondContact O-CG 3.24Å; F67-M71 PolarHBondContact O-N 2.96Å; I68-M71 HydrophobicContact CG1-CE 4.41Å; I68-M71 PolarHBondContact O-N 3.49Å; M71-F73 VanDerWaalsContact C-N 3.34Å; M71-F73 PolarHBondContact O-N 2.94Å; M71-L74 PolarHBondContact O-N 3.19Å; M71-G75 PolarHBondContact O-N 3.45Å; M71-F90 HydrophobicContact CB-CE2 4.49Å; M71-F90 VanDerWaalsContact O-CD2 3.3Å; M71-F90 WeakPolarHBondContact O-CD2 3.35Å; M71-F93 HydrophobicContact CG-CB 4.24Å; M71-F93 HydrophobicContact SD-CB 4.4Å; M71-V94 HydrophobicContact SD-CG2 4.29Å |
| 72 | G | 94.9 | Very high | 93.5 | Very high | 3 Ų | 3 | 49.7 Ų | 49.7 | 3% | 0.031 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -61.3 | -42 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | I68 M69 I70 G75 C76 | I68-G72 PolarHBondContact O-N 3Å; M69-G72 PolarHBondContact O-N 3.37Å; I70-G72 VanDerWaalsContact C-N 3.34Å; I70-G72 PolarHBondContact O-N 3.48Å; G72-G75 PolarHBondContact O-N 3.3Å; G72-C76 WeakPolarHBondContact O-CB 3.35Å; G72-C76 PolarHBondContact O-N 2.87Å; G72-C76 PolarHBondContact O-SG 3.28Å |
| 73 | F | 94.4 | Very high | 93.4 | Very high | 113 Ų | 113 | 49.6 Ų | 49.6 | 50% | 0.496 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -64.4 | -48.1 | 177 | -179.2 | -102.1 | 0 | 0 | 0 | 112.1 | M69 I70 M71 G75 C76 C77 | M69-F73 WeakPolarHBondContact O-CB 3.35Å; M69-F73 PolarHBondContact O-N 2.99Å; I70-F73 PolarHBondContact O-N 3.49Å; M71-F73 VanDerWaalsContact C-N 3.34Å; M71-F73 PolarHBondContact O-N 2.94Å; F73-G75 VanDerWaalsContact C-N 3.33Å; F73-G75 PolarHBondContact O-N 2.95Å; F73-C76 PolarHBondContact O-N 2.91Å; F73-C77 VanDerWaalsContact CE2-SG 3.51Å; F73-C77 WeakPolarHBondContact CZ-SG 3.23Å; F73-C77 WeakPolarHBondContact O-CB 3.3Å; F73-C77 PolarHBondContact O-N 3.47Å; F73-C77 PolarHBondContact O-SG 3.27Å |
| 74 | L | 94.7 | Very high | 93.2 | Very high | 22 Ų | 22 | 50.2 Ų | 50.2 | 12% | 0.115 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -59.7 | -43.4 | 177.1 | -69.6 | 175.1 | 0 | 0 | 0 | 111.4 | I70 M71 G78 L86 F90 F93 | I70-L74 HydrophobicContact CG2-CD1 3.81Å; I70-L74 HydrophobicContact CG2-CG 4.21Å; I70-L74 WeakPolarHBondContact O-CG 3.5Å; I70-L74 PolarHBondContact O-N 2.97Å; M71-L74 PolarHBondContact O-N 3.19Å; L74-G78 WeakPolarHBondContact O-CA 3.37Å; L74-G78 PolarHBondContact O-N 3.34Å; L74-L86 HydrophobicContact CD2-CD2 3.97Å; L74-F90 HydrophobicContact CB-CB 4.37Å; L74-F93 HydrophobicContact CD1-CD2 3.7Å; L74-F93 HydrophobicContact CD1-CE2 3.72Å |
| 75 | G | 93.7 | Very high | 93.2 | Very high | 0 Ų | 0 | 51.1 Ų | 51.1 | 0% | 0 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -62.5 | -46.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | M71 G72 F73 A79 | M71-G75 PolarHBondContact O-N 3.45Å; G72-G75 PolarHBondContact O-N 3.3Å; F73-G75 VanDerWaalsContact C-N 3.33Å; F73-G75 PolarHBondContact O-N 2.95Å; G75-A79 WeakPolarHBondContact O-CB 3.44Å; G75-A79 PolarHBondContact O-N 2.89Å |
| 76 | C | 93.6 | Very high | 93 | Very high | 13 Ų | 13 | 52.9 Ų | 52.9 | 9% | 0.088 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -62.5 | -50.2 | 177.3 | -70.6 | 0 | 0 | 0 | 0 | 112.4 | F18 C21 L22 G72 F73 A79 I80 | F18-C76 HydrophobicContact CD2-CB 4.18Å; F18-C76 HydrophobicContact CE2-CB 4.02Å; C21-C76 WeakPolarHBondContact CB-SG 3.26Å; L22-C76 VanDerWaalsContact CA-SG 3.55Å; L22-C76 PolarHBondContact N-SG 2.93Å; G72-C76 WeakPolarHBondContact O-CB 3.35Å; G72-C76 PolarHBondContact O-N 2.87Å; G72-C76 PolarHBondContact O-SG 3.28Å; F73-C76 PolarHBondContact O-N 2.91Å; C76-A79 PolarHBondContact O-N 3.45Å; C76-I80 PolarHBondContact O-N 3.33Å |
| 77 | C | 93.4 | Very high | 92.8 | Very high | 23 Ų | 23 | 48.3 Ų | 48.3 | 16% | 0.155 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -68.1 | -37.9 | -179 | -70.3 | 0 | 0 | 0 | 0 | 112 | F73 A79 R81 L86 | F73-C77 VanDerWaalsContact CE2-SG 3.51Å; F73-C77 WeakPolarHBondContact CZ-SG 3.23Å; F73-C77 WeakPolarHBondContact O-CB 3.3Å; F73-C77 PolarHBondContact O-N 3.47Å; F73-C77 PolarHBondContact O-SG 3.27Å; C77-A79 VanDerWaalsContact C-N 3.34Å; C77-R81 VanDerWaalsContact O-CB 3.24Å; C77-R81 WeakPolarHBondContact O-CB 3.33Å; C77-R81 WeakPolarHBondContact O-CG 3.41Å; C77-R81 PolarHBondContact O-N 3.48Å; C77-L86 HydrophobicContact CB-CD1 3.81Å |
| 78 | G | 91.6 | Very high | 92.7 | Very high | 0 Ų | 0 | 51.3 Ų | 51.3 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -60.6 | -43.3 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | L74 E82 S83 | L74-G78 WeakPolarHBondContact O-CA 3.37Å; L74-G78 PolarHBondContact O-N 3.34Å; G78-E82 WeakPolarHBondContact O-CA 3.23Å; G78-E82 PolarHBondContact O-N 3.48Å; G78-S83 PolarHBondContact O-N 3.23Å |
| 79 | A | 90.4 | Very high | 92.7 | Very high | 0 Ų | 0 | 52 Ų | 52 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -67.4 | -48.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | K14 F18 G75 C76 C77 L219 | K14-A79 WeakPolarHBondContact CE-O 3.36Å; F18-A79 HydrophobicContact CB-CB 4.41Å; G75-A79 WeakPolarHBondContact O-CB 3.44Å; G75-A79 PolarHBondContact O-N 2.89Å; C76-A79 PolarHBondContact O-N 3.45Å; C77-A79 VanDerWaalsContact C-N 3.34Å; A79-L219 HydrophobicContact CB-CD2 4.29Å |
| 80 | I | 89.8 | Confident | 92.6 | Very high | 101 Ų | 101 | 51.1 Ų | 51.1 | 52% | 0.518 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -66.4 | -51.1 | -178.6 | -71.3 | 172.1 | 0 | 0 | 0 | 111.6 | F18 C76 E82 | F18-I80 HydrophobicContact CD2-CD1 3.83Å; F18-I80 HydrophobicContact CD2-CG1 3.73Å; F18-I80 HydrophobicContact CE2-CD1 3.19Å; F18-I80 HydrophobicContact CE2-CG1 3.65Å; F18-I80 HydrophobicContact CZ-CD1 3.74Å; F18-I80 HydrophobicContact CZ-CG1 4.39Å; C76-I80 PolarHBondContact O-N 3.33Å; I80-E82 PolarHBondContact O-N 3.39Å |
| 81 | R | 90.3 | Very high | 92.6 | Very high | 190 Ų | 190 | 50.5 Ų | 50.5 | 72% | 0.717 | 25% | 0.247 | S | C | * | . | H | α-helix | trans | -79.4 | -4.3 | -173.3 | -63.9 | -173.9 | 173.4 | -169.8 | -1.5 | 113.1 | C77 S83 | C77-R81 VanDerWaalsContact O-CB 3.24Å; C77-R81 WeakPolarHBondContact O-CB 3.33Å; C77-R81 WeakPolarHBondContact O-CG 3.41Å; C77-R81 PolarHBondContact O-N 3.48Å; R81-S83 PolarHBondContact O-N 2.86Å; R81-S83 VanDerWaalsContact O-N 3.1Å |
| 82 | E | 88 | Confident | 92.7 | Very high | 81 Ų | 81 | 51 Ų | 51 | 38% | 0.379 | 26% | 0.256 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 50.4 | 37.1 | -174.6 | -62.6 | -179 | 169.4 | 0 | 0 | 111.3 | K14 G78 I80 Q84 I223 | K14-E82 IonicContact NZ-OE1 2.66Å; K14-E82 PolarHBondContact NZ-OE1 2.93Å; G78-E82 WeakPolarHBondContact O-CA 3.23Å; G78-E82 PolarHBondContact O-N 3.48Å; I80-E82 PolarHBondContact O-N 3.39Å; E82-Q84 PolarHBondContact O-N 2.95Å; E82-I223 HydrophobicContact CB-CD1 3.87Å; E82-I223 HydrophobicContact CB-CG1 4.12Å; E82-I223 HydrophobicContact CG-CD1 4.38Å; E82-I223 WeakPolarHBondContact O-CG2 3.49Å |
| 83 | S | 90.7 | Very high | 92.6 | Very high | 38 Ų | 38 | 54.5 Ų | 54.5 | 27% | 0.266 | 27% | 0.27 | S | S | . | . | trans | -91.3 | 110.4 | -176 | -178.8 | 0 | 0 | 0 | 0 | 110 | G78 R81 C85 L86 L87 | G78-S83 PolarHBondContact O-N 3.23Å; R81-S83 PolarHBondContact O-N 2.86Å; R81-S83 VanDerWaalsContact O-N 3.1Å; S83-C85 PolarHBondContact O-N 3.42Å; S83-L86 PolarHBondContact O-N 3.42Å; S83-L87 WeakPolarHBondContact O-CB 3.38Å; S83-L87 PolarHBondContact O-N 2.91Å; S83-L87 VanDerWaalsContact O-N 3.09Å | ||
| 84 | Q | 90.4 | Very high | 92.7 | Very high | 72 Ų | 72 | 49.3 Ų | 49.3 | 34% | 0.336 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -54.6 | -38.6 | 176.6 | -67.5 | 176.2 | -30.9 | 0 | 0 | 112.3 | E82 L87 F88 I223 R224 | E82-Q84 PolarHBondContact O-N 2.95Å; Q84-L87 PolarHBondContact O-N 2.95Å; Q84-F88 VanDerWaalsContact O-CB 3.28Å; Q84-F88 WeakPolarHBondContact O-CB 3.4Å; Q84-F88 PolarHBondContact O-N 3.47Å; Q84-I223 HydrophobicContact CG-CB 4.32Å; Q84-I223 HydrophobicContact CG-CG2 3.74Å; Q84-R224 VanDerWaalsContact NE2-CB 3.27Å |
| 85 | C | 92.9 | Very high | 92.7 | Very high | 85 Ų | 85 | 53.3 Ų | 53.3 | 57% | 0.574 | 26% | 0.264 | S | S | * | . | H | α-helix | trans | -63 | -48.5 | 179.2 | -178.3 | 0 | 0 | 0 | 0 | 112 | S83 L87 F88 L89 | S83-C85 PolarHBondContact O-N 3.42Å; C85-L87 VanDerWaalsContact C-N 3.32Å; C85-L87 PolarHBondContact O-N 2.89Å; C85-F88 PolarHBondContact O-N 3.19Å; C85-L89 WeakPolarHBondContact O-CG 3.31Å; C85-L89 PolarHBondContact O-N 3.24Å |
| 86 | L | 93.5 | Very high | 92.8 | Very high | 36 Ų | 36 | 58.9 Ų | 58.9 | 19% | 0.188 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -64.8 | -38.6 | 178.8 | -69.1 | 177.1 | 0 | 0 | 0 | 112.1 | L74 C77 S83 L89 F90 | L74-L86 HydrophobicContact CD2-CD2 3.97Å; C77-L86 HydrophobicContact CB-CD1 3.81Å; S83-L86 PolarHBondContact O-N 3.42Å; L86-L89 PolarHBondContact O-N 3.43Å; L86-F90 PolarHBondContact O-N 3.39Å |
| 87 | L | 92.3 | Very high | 92.9 | Very high | 0 Ų | 0 | 59.2 Ų | 59.2 | 0% | 0 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -69 | -38.8 | 179.2 | -163.9 | 62.1 | 0 | 0 | 0 | 111.7 | M17 S83 Q84 C85 F90 F91 S216 L219 C220 I223 | M17-L87 HydrophobicContact CE-CD1 3.47Å; M17-L87 VanDerWaalsContact CE-CD1 3.47Å; M17-L87 HydrophobicContact SD-CD1 4.12Å; S83-L87 WeakPolarHBondContact O-CB 3.38Å; S83-L87 PolarHBondContact O-N 2.91Å; S83-L87 VanDerWaalsContact O-N 3.09Å; Q84-L87 PolarHBondContact O-N 2.95Å; C85-L87 VanDerWaalsContact C-N 3.32Å; C85-L87 PolarHBondContact O-N 2.89Å; L87-F90 PolarHBondContact O-N 3.38Å; L87-F91 PolarHBondContact O-N 3.47Å; L87-S216 VanDerWaalsContact CD1-OG 3.31Å; L87-S216 WeakPolarHBondContact CD1-OG 3.42Å; L87-S216 VanDerWaalsContact CD2-O 3.27Å; L87-S216 WeakPolarHBondContact CD2-O 3.34Å; L87-S216 VanDerWaalsContact CG-OG 3.31Å; L87-S216 WeakPolarHBondContact CG-OG 3.29Å; L87-S216 PolarHBondContact O-OG 2.79Å; L87-L219 HydrophobicContact CD1-CD2 4Å; L87-L219 HydrophobicContact CD2-CB 3.82Å; L87-L219 HydrophobicContact CD2-CD2 3.82Å; L87-L219 HydrophobicContact CD2-CG 3.94Å; L87-C220 HydrophobicContact CD2-CB 3.69Å; L87-C220 VanDerWaalsContact CD2-N 3.27Å; L87-C220 HydrophobicContact CG-CB 4.39Å; L87-I223 HydrophobicContact CD2-CD1 4.23Å |
| 88 | F | 92.8 | Very high | 93 | Very high | 129 Ų | 129 | 60.3 Ų | 60.3 | 57% | 0.566 | 29% | 0.293 | S | S | * | . | H | α-helix | trans | -65.5 | -40.6 | 172.2 | -177 | -98.7 | 0 | 0 | 0 | 112 | Q84 C85 F91 A92 | Q84-F88 VanDerWaalsContact O-CB 3.28Å; Q84-F88 WeakPolarHBondContact O-CB 3.4Å; Q84-F88 PolarHBondContact O-N 3.47Å; C85-F88 PolarHBondContact O-N 3.19Å; F88-F91 WeakPolarHBondContact O-CB 3.31Å; F88-F91 PolarHBondContact O-N 2.96Å; F88-A92 WeakPolarHBondContact O-CB 3.47Å; F88-A92 PolarHBondContact O-N 3.49Å |
| 89 | L | 94.4 | Very high | 93.2 | Very high | 69 Ų | 69 | 62.9 Ų | 62.9 | 36% | 0.361 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -61.1 | -46.1 | 173.5 | -72.5 | 174.5 | 0 | 0 | 0 | 111.4 | C85 L86 F91 A92 F93 | C85-L89 WeakPolarHBondContact O-CG 3.31Å; C85-L89 PolarHBondContact O-N 3.24Å; L86-L89 PolarHBondContact O-N 3.43Å; L89-F91 VanDerWaalsContact C-N 3.34Å; L89-F91 PolarHBondContact O-N 3.43Å; L89-A92 PolarHBondContact O-N 2.82Å; L89-F93 WeakPolarHBondContact O-CD2 3.28Å; L89-F93 PolarHBondContact O-N 3.35Å |
| 90 | F | 94.2 | Very high | 93.5 | Very high | 14 Ų | 14 | 67.2 Ų | 67.2 | 6% | 0.061 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -56.5 | -48.3 | 174.3 | 174.9 | -104.3 | 0 | 0 | 0 | 111.5 | M17 M71 L74 L86 L87 A92 F93 V94 | M17-F90 HydrophobicContact CE-CD1 3.76Å; M17-F90 HydrophobicContact CE-CE1 3.7Å; M17-F90 HydrophobicContact CE-CZ 4.49Å; M71-F90 HydrophobicContact CB-CE2 4.49Å; M71-F90 VanDerWaalsContact O-CD2 3.3Å; M71-F90 WeakPolarHBondContact O-CD2 3.35Å; L74-F90 HydrophobicContact CB-CB 4.37Å; L86-F90 PolarHBondContact O-N 3.39Å; L87-F90 PolarHBondContact O-N 3.38Å; F90-A92 PolarHBondContact O-N 3.3Å; F90-F93 PolarHBondContact O-N 2.99Å; F90-V94 HydrophobicContact CD1-CG2 4.48Å; F90-V94 HydrophobicContact CD2-CG2 4.17Å; F90-V94 HydrophobicContact CE1-CG2 4.11Å; F90-V94 HydrophobicContact CE2-CG2 3.77Å; F90-V94 HydrophobicContact CZ-CG2 3.74Å; F90-V94 VanDerWaalsContact O-CG2 3.3Å; F90-V94 WeakPolarHBondContact O-CG2 3.21Å; F90-V94 PolarHBondContact O-N 3.37Å |
| 91 | F | 95 | Very high | 93.6 | Very high | 44 Ų | 44 | 67.2 Ų | 67.2 | 19% | 0.193 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -56.7 | -47.2 | 174.8 | 176.1 | -89.9 | 0 | 0 | 0 | 112.2 | L87 F88 L89 F93 V94 F95 M213 M217 | L87-F91 PolarHBondContact O-N 3.47Å; F88-F91 WeakPolarHBondContact O-CB 3.31Å; F88-F91 PolarHBondContact O-N 2.96Å; L89-F91 VanDerWaalsContact C-N 3.34Å; L89-F91 PolarHBondContact O-N 3.43Å; F91-F93 PolarHBondContact O-N 3.4Å; F91-V94 PolarHBondContact O-N 2.96Å; F91-F95 HydrophobicContact CE1-CB 4.41Å; F91-F95 VanDerWaalsContact O-CB 3.23Å; F91-F95 WeakPolarHBondContact O-CB 3.25Å; F91-F95 PolarHBondContact O-N 3.21Å; F91-M213 HydrophobicContact CD2-CB 3.92Å; F91-M213 HydrophobicContact CD2-CG 4Å; F91-M213 HydrophobicContact CE2-CB 3.78Å; F91-M213 HydrophobicContact CE2-CG 3.98Å; F91-M213 HydrophobicContact CE2-SD 4.29Å; F91-M217 HydrophobicContact CD2-CG 3.61Å; F91-M217 HydrophobicContact CD2-SD 3.93Å; F91-M217 HydrophobicContact CE2-CG 3.47Å; F91-M217 VanDerWaalsContact CE2-CG 3.47Å; F91-M217 HydrophobicContact CE2-SD 3.89Å; F91-M217 HydrophobicContact CG-SD 4.28Å; F91-M217 HydrophobicContact CZ-CG 4.29Å; F91-M217 HydrophobicContact CZ-SD 4.24Å |
| 92 | A | 95 | Very high | 93.8 | Very high | 39 Ų | 39 | 62.4 Ų | 62.4 | 32% | 0.322 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -62.5 | -42.9 | -178.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | F88 L89 F90 F96 | F88-A92 WeakPolarHBondContact O-CB 3.47Å; F88-A92 PolarHBondContact O-N 3.49Å; L89-A92 PolarHBondContact O-N 2.82Å; F90-A92 PolarHBondContact O-N 3.3Å; A92-F96 WeakPolarHBondContact O-CB 3.29Å; A92-F96 PolarHBondContact O-N 2.89Å |
| 93 | F | 94.4 | Very high | 94.2 | Very high | 75 Ų | 75 | 61.1 Ų | 61.1 | 33% | 0.329 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -64.1 | -46.4 | 175.4 | -81.2 | -67.4 | 0 | 0 | 0 | 112.1 | F67 M71 L74 L89 F90 F91 F95 F96 C97 | F67-F93 AromaticContact CE2-CD1 3.98Å; F67-F93 HydrophobicContact CE2-CD1 3.98Å; F67-F93 HydrophobicContact CE2-CE1 4.45Å; F67-F93 HydrophobicContact CZ-CD1 4.22Å; M71-F93 HydrophobicContact CG-CB 4.24Å; M71-F93 HydrophobicContact SD-CB 4.4Å; L74-F93 HydrophobicContact CD1-CD2 3.7Å; L74-F93 HydrophobicContact CD1-CE2 3.72Å; L89-F93 WeakPolarHBondContact O-CD2 3.28Å; L89-F93 PolarHBondContact O-N 3.35Å; F90-F93 PolarHBondContact O-N 2.99Å; F91-F93 PolarHBondContact O-N 3.4Å; F93-F95 VanDerWaalsContact C-N 3.35Å; F93-F95 PolarHBondContact O-N 2.85Å; F93-F96 PolarHBondContact O-N 2.96Å; F93-C97 PolarHBondContact O-N 3.32Å; F93-C97 PolarHBondContact O-SG 3.48Å; F93-C97 VanDerWaalsContact O-SG 3.4Å |
| 94 | V | 94.7 | Very high | 94.3 | Very high | 5 Ų | 5 | 62 Ų | 62 | 3% | 0.03 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -64 | -41.7 | 178.6 | 174.7 | 0 | 0 | 0 | 0 | 110.9 | M71 F90 F91 C97 F98 L209 M213 | M71-V94 HydrophobicContact SD-CG2 4.29Å; F90-V94 HydrophobicContact CD1-CG2 4.48Å; F90-V94 HydrophobicContact CD2-CG2 4.17Å; F90-V94 HydrophobicContact CE1-CG2 4.11Å; F90-V94 HydrophobicContact CE2-CG2 3.77Å; F90-V94 HydrophobicContact CZ-CG2 3.74Å; F90-V94 VanDerWaalsContact O-CG2 3.3Å; F90-V94 WeakPolarHBondContact O-CG2 3.21Å; F90-V94 PolarHBondContact O-N 3.37Å; F91-V94 PolarHBondContact O-N 2.96Å; V94-C97 PolarHBondContact O-N 2.93Å; V94-F98 WeakPolarHBondContact O-CB 3.46Å; V94-F98 PolarHBondContact O-N 3.43Å; V94-L209 HydrophobicContact CG1-CB 4.01Å; V94-L209 HydrophobicContact CG1-CD2 3.88Å; V94-L209 WeakPolarHBondContact CG1-O 3.25Å; V94-M213 HydrophobicContact CB-CG 4.17Å; V94-M213 HydrophobicContact CG1-CG 3.56Å; V94-M213 HydrophobicContact CG1-SD 4.3Å |
| 95 | F | 96.1 | Very high | 94.3 | Very high | 106 Ų | 106 | 60.4 Ų | 60.4 | 47% | 0.465 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -61.7 | -45.3 | 175.9 | 179 | -101.7 | 0 | 0 | 0 | 111.6 | F91 F93 C97 F98 T99 M213 | F91-F95 HydrophobicContact CE1-CB 4.41Å; F91-F95 VanDerWaalsContact O-CB 3.23Å; F91-F95 WeakPolarHBondContact O-CB 3.25Å; F91-F95 PolarHBondContact O-N 3.21Å; F93-F95 VanDerWaalsContact C-N 3.35Å; F93-F95 PolarHBondContact O-N 2.85Å; F95-C97 VanDerWaalsContact C-N 3.34Å; F95-C97 PolarHBondContact O-N 3.39Å; F95-F98 PolarHBondContact O-N 3.21Å; F95-T99 HydrophobicContact CD1-CG2 4.35Å; F95-T99 HydrophobicContact CE1-CG2 3.92Å; F95-T99 HydrophobicContact CE2-CG2 4.15Å; F95-T99 HydrophobicContact CZ-CG2 3.81Å; F95-T99 WeakPolarHBondContact O-CG2 3.14Å; F95-T99 PolarHBondContact O-N 2.96Å; F95-T99 PolarHBondContact O-OG1 2.97Å; F95-M213 HydrophobicContact CB-SD 3.95Å; F95-M213 HydrophobicContact CD2-SD 4Å |
| 96 | F | 95.7 | Very high | 94.3 | Very high | 116 Ų | 116 | 61.7 Ų | 61.7 | 51% | 0.509 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -60.7 | -41.5 | 175.5 | -179 | -105.3 | 0 | 0 | 0 | 112.2 | A92 F93 T99 L100 | A92-F96 WeakPolarHBondContact O-CB 3.29Å; A92-F96 PolarHBondContact O-N 2.89Å; F93-F96 PolarHBondContact O-N 2.96Å; F96-T99 PolarHBondContact O-N 2.85Å; F96-T99 PolarHBondContact O-OG1 3.32Å; F96-L100 HydrophobicContact CD1-CD1 3.83Å; F96-L100 HydrophobicContact CD1-CG 4.42Å; F96-L100 HydrophobicContact CE1-CD1 3.28Å; F96-L100 HydrophobicContact CE1-CG 4.09Å; F96-L100 HydrophobicContact CE2-CD1 4.34Å; F96-L100 HydrophobicContact CE2-CG 4.34Å; F96-L100 HydrophobicContact CZ-CD1 3.58Å; F96-L100 HydrophobicContact CZ-CD2 4.31Å; F96-L100 HydrophobicContact CZ-CG 4.04Å; F96-L100 WeakPolarHBondContact O-CB 3.15Å; F96-L100 WeakPolarHBondContact O-CG 3.43Å; F96-L100 PolarHBondContact O-N 3.5Å |
| 97 | C | 95 | Very high | 94.2 | Very high | 21 Ų | 21 | 67.5 Ų | 67.5 | 14% | 0.142 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -64.5 | -41.9 | 173.9 | -72.4 | 0 | 0 | 0 | 0 | 113 | F67 F93 V94 F95 T99 L100 L101 | F67-C97 WeakPolarHBondContact CE1-SG 3.38Å; F67-C97 WeakPolarHBondContact CZ-SG 3.32Å; F93-C97 PolarHBondContact O-N 3.32Å; F93-C97 PolarHBondContact O-SG 3.48Å; F93-C97 VanDerWaalsContact O-SG 3.4Å; V94-C97 PolarHBondContact O-N 2.93Å; F95-C97 VanDerWaalsContact C-N 3.34Å; F95-C97 PolarHBondContact O-N 3.39Å; C97-T99 VanDerWaalsContact C-N 3.35Å; C97-T99 PolarHBondContact O-N 3.28Å; C97-L100 PolarHBondContact O-N 3.45Å; C97-L101 WeakPolarHBondContact O-CB 3.37Å; C97-L101 VanDerWaalsContact O-CG 3.26Å; C97-L101 WeakPolarHBondContact O-CG 3.29Å; C97-L101 PolarHBondContact O-N 3.44Å |
| 98 | F | 95.6 | Very high | 93.9 | Very high | 45 Ų | 45 | 70.1 Ų | 70.1 | 20% | 0.197 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -60.9 | -45 | 177.5 | 177.8 | -99.5 | 0 | 0 | 0 | 111.3 | V94 F95 L101 M102 A206 L209 I210 M213 | V94-F98 WeakPolarHBondContact O-CB 3.46Å; V94-F98 PolarHBondContact O-N 3.43Å; F95-F98 PolarHBondContact O-N 3.21Å; F98-L101 PolarHBondContact O-N 3.07Å; F98-M102 HydrophobicContact CE1-CE 4.23Å; F98-M102 HydrophobicContact CE2-CE 3.99Å; F98-M102 HydrophobicContact CZ-CE 3.56Å; F98-M102 VanDerWaalsContact O-CB 3.29Å; F98-M102 WeakPolarHBondContact O-CB 3.33Å; F98-M102 PolarHBondContact O-N 3.38Å; F98-A206 HydrophobicContact CE2-CB 4.19Å; F98-L209 HydrophobicContact CB-CD1 4.33Å; F98-L209 HydrophobicContact CD2-CB 4.42Å; F98-L209 HydrophobicContact CD2-CD1 4.43Å; F98-I210 HydrophobicContact CD2-CG1 4.43Å; F98-I210 HydrophobicContact CE2-CD1 3.97Å; F98-I210 HydrophobicContact CE2-CG1 4Å; F98-I210 HydrophobicContact CZ-CD1 4.25Å; F98-I210 HydrophobicContact CZ-CG1 4.43Å; F98-M213 HydrophobicContact CB-CE 4.23Å; F98-M213 HydrophobicContact CD1-CE 4.37Å; F98-M213 HydrophobicContact CD2-CE 4.43Å; F98-M213 HydrophobicContact CG-CE 4.09Å |
| 99 | T | 96 | Very high | 93.6 | Very high | 55 Ų | 55 | 69 Ų | 69 | 34% | 0.337 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -67.3 | -39.7 | 178.1 | 58.4 | 0 | 0 | 0 | 0 | 112.2 | F95 F96 C97 M102 A103 | F95-T99 HydrophobicContact CD1-CG2 4.35Å; F95-T99 HydrophobicContact CE1-CG2 3.92Å; F95-T99 HydrophobicContact CE2-CG2 4.15Å; F95-T99 HydrophobicContact CZ-CG2 3.81Å; F95-T99 WeakPolarHBondContact O-CG2 3.14Å; F95-T99 PolarHBondContact O-N 2.96Å; F95-T99 PolarHBondContact O-OG1 2.97Å; F96-T99 PolarHBondContact O-N 2.85Å; F96-T99 PolarHBondContact O-OG1 3.32Å; C97-T99 VanDerWaalsContact C-N 3.35Å; C97-T99 PolarHBondContact O-N 3.28Å; T99-M102 PolarHBondContact O-N 2.71Å; T99-A103 VanDerWaalsContact O-CB 3.27Å; T99-A103 WeakPolarHBondContact O-CB 3.26Å; T99-A103 PolarHBondContact O-N 2.94Å |
| 100 | L | 95.6 | Very high | 93.4 | Very high | 91 Ų | 91 | 69.6 Ų | 69.6 | 48% | 0.476 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -63.1 | -44.8 | 174.2 | -75.6 | -178.1 | 0 | 0 | 0 | 112.5 | F96 C97 A103 A104 | F96-L100 HydrophobicContact CD1-CD1 3.83Å; F96-L100 HydrophobicContact CD1-CG 4.42Å; F96-L100 HydrophobicContact CE1-CD1 3.28Å; F96-L100 HydrophobicContact CE1-CG 4.09Å; F96-L100 HydrophobicContact CE2-CD1 4.34Å; F96-L100 HydrophobicContact CE2-CG 4.34Å; F96-L100 HydrophobicContact CZ-CD1 3.58Å; F96-L100 HydrophobicContact CZ-CD2 4.31Å; F96-L100 HydrophobicContact CZ-CG 4.04Å; F96-L100 WeakPolarHBondContact O-CB 3.15Å; F96-L100 WeakPolarHBondContact O-CG 3.43Å; F96-L100 PolarHBondContact O-N 3.5Å; C97-L100 PolarHBondContact O-N 3.45Å; L100-A103 PolarHBondContact O-N 2.95Å; L100-A104 WeakPolarHBondContact O-CB 3.46Å; L100-A104 PolarHBondContact O-N 2.9Å |
| 101 | L | 93.9 | Very high | 93 | Very high | 100 Ų | 100 | 72.6 Ų | 72.6 | 52% | 0.524 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -65.8 | -40.4 | 177.7 | -72.7 | 170.3 | 0 | 0 | 0 | 111.4 | C97 F98 A104 G105 L209 | C97-L101 WeakPolarHBondContact O-CB 3.37Å; C97-L101 VanDerWaalsContact O-CG 3.26Å; C97-L101 WeakPolarHBondContact O-CG 3.29Å; C97-L101 PolarHBondContact O-N 3.44Å; F98-L101 PolarHBondContact O-N 3.07Å; L101-A104 PolarHBondContact O-N 3.23Å; L101-G105 PolarHBondContact O-N 3.33Å; L101-L209 HydrophobicContact CD1-CD1 3.63Å |
| 102 | M | 94 | Very high | 92.3 | Very high | 89 Ų | 89 | 73.5 Ų | 73.5 | 44% | 0.438 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -63.7 | -46 | 175.1 | -169.3 | 63.9 | 66.8 | 0 | 0 | 111.1 | F98 T99 A104 G105 L106 | F98-M102 HydrophobicContact CE1-CE 4.23Å; F98-M102 HydrophobicContact CE2-CE 3.99Å; F98-M102 HydrophobicContact CZ-CE 3.56Å; F98-M102 VanDerWaalsContact O-CB 3.29Å; F98-M102 WeakPolarHBondContact O-CB 3.33Å; F98-M102 PolarHBondContact O-N 3.38Å; T99-M102 PolarHBondContact O-N 2.71Å; M102-A104 PolarHBondContact O-N 3.35Å; M102-G105 PolarHBondContact O-N 3.35Å; M102-L106 HydrophobicContact CG-CD1 4.24Å; M102-L106 WeakPolarHBondContact O-CB 3.47Å; M102-L106 VanDerWaalsContact O-CG 3.29Å; M102-L106 WeakPolarHBondContact O-CG 3.32Å; M102-L106 PolarHBondContact O-N 2.92Å |
| 103 | A | 95.3 | Very high | 91.5 | Very high | 54 Ų | 54 | 76.7 Ų | 76.7 | 45% | 0.446 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -61.5 | -43.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | T99 L100 L106 W107 | T99-A103 VanDerWaalsContact O-CB 3.27Å; T99-A103 WeakPolarHBondContact O-CB 3.26Å; T99-A103 PolarHBondContact O-N 2.94Å; L100-A103 PolarHBondContact O-N 2.95Å; A103-L106 PolarHBondContact O-N 3.48Å; A103-W107 WeakPolarHBondContact O-CB 3.37Å; A103-W107 PolarHBondContact O-N 3.48Å |
| 104 | A | 92.4 | Very high | 91 | Very high | 58 Ų | 58 | 78.6 Ų | 78.6 | 48% | 0.479 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -63.1 | -41.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | L100 L101 M102 W107 A108 | L100-A104 WeakPolarHBondContact O-CB 3.46Å; L100-A104 PolarHBondContact O-N 2.9Å; L101-A104 PolarHBondContact O-N 3.23Å; M102-A104 PolarHBondContact O-N 3.35Å; A104-W107 PolarHBondContact O-N 3.48Å; A104-A108 WeakPolarHBondContact O-CB 3.35Å; A104-A108 PolarHBondContact O-N 2.93Å |
| 105 | G | 91.5 | Very high | 90.2 | Very high | 38 Ų | 38 | 81.3 Ų | 81.3 | 39% | 0.392 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -64.2 | -47.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | L101 M102 W107 A108 V109 | L101-G105 PolarHBondContact O-N 3.33Å; M102-G105 PolarHBondContact O-N 3.35Å; G105-W107 VanDerWaalsContact C-N 3.32Å; G105-W107 PolarHBondContact O-N 2.84Å; G105-A108 PolarHBondContact O-N 2.84Å; G105-V109 WeakPolarHBondContact O-CG2 3.34Å; G105-V109 PolarHBondContact O-N 3.45Å |
| 106 | L | 92.2 | Very high | 89.6 | Confident | 112 Ų | 112 | 78.8 Ų | 78.8 | 59% | 0.586 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -61.1 | -41.8 | 175.2 | -70.4 | 175 | 0 | 0 | 0 | 111.4 | M102 A103 V109 A110 | M102-L106 HydrophobicContact CG-CD1 4.24Å; M102-L106 WeakPolarHBondContact O-CB 3.47Å; M102-L106 VanDerWaalsContact O-CG 3.29Å; M102-L106 WeakPolarHBondContact O-CG 3.32Å; M102-L106 PolarHBondContact O-N 2.92Å; A103-L106 PolarHBondContact O-N 3.48Å; L106-V109 PolarHBondContact O-N 2.91Å; L106-A110 VanDerWaalsContact O-CB 3.29Å; L106-A110 WeakPolarHBondContact O-CB 3.43Å; L106-A110 PolarHBondContact O-N 2.96Å |
| 107 | W | 91.4 | Very high | 89.2 | Confident | 158 Ų | 158 | 78.3 Ų | 78.3 | 60% | 0.598 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -61 | -46.2 | 175.2 | -172.6 | -83.3 | 0 | 0 | 0 | 111.5 | A103 A104 G105 V109 A110 W111 | A103-W107 WeakPolarHBondContact O-CB 3.37Å; A103-W107 PolarHBondContact O-N 3.48Å; A104-W107 PolarHBondContact O-N 3.48Å; G105-W107 VanDerWaalsContact C-N 3.32Å; G105-W107 PolarHBondContact O-N 2.84Å; W107-V109 VanDerWaalsContact C-N 3.31Å; W107-V109 PolarHBondContact O-N 3.5Å; W107-A110 PolarHBondContact O-N 3.45Å; W107-W111 AromaticContact CE2-CE2 3.94Å; W107-W111 AromaticContact CE2-NE1 3.91Å; W107-W111 HydrophobicContact CH2-CZ2 4.06Å; W107-W111 HydrophobicContact CZ2-CD2 4.12Å; W107-W111 AromaticContact CZ2-CE2 3.54Å; W107-W111 HydrophobicContact CZ2-CH2 4.13Å; W107-W111 AromaticContact CZ2-CZ2 3.59Å; W107-W111 HydrophobicContact CZ2-CZ2 3.59Å; W107-W111 AromaticContact CZ2-NE1 3.74Å; W107-W111 AromaticContact NE1-CD2 3.97Å; W107-W111 WeakPolarHBondContact O-CB 3.2Å; W107-W111 PolarHBondContact O-N 3.32Å |
| 108 | A | 87.2 | Confident | 88.7 | Confident | 55 Ų | 55 | 83.7 Ų | 83.7 | 46% | 0.455 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -60.1 | -39.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | A104 G105 S112 | A104-A108 WeakPolarHBondContact O-CB 3.35Å; A104-A108 PolarHBondContact O-N 2.93Å; G105-A108 PolarHBondContact O-N 2.84Å; A108-S112 PolarHBondContact O-N 2.84Å; A108-S112 VanDerWaalsContact O-N 3.13Å |
| 109 | V | 86.6 | Confident | 88.3 | Confident | 106 Ų | 106 | 83.9 Ų | 83.9 | 64% | 0.642 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -70.6 | -47.6 | 176 | 174.8 | 0 | 0 | 0 | 0 | 111.3 | G105 L106 W107 W111 S112 | G105-V109 WeakPolarHBondContact O-CG2 3.34Å; G105-V109 PolarHBondContact O-N 3.45Å; L106-V109 PolarHBondContact O-N 2.91Å; W107-V109 VanDerWaalsContact C-N 3.31Å; W107-V109 PolarHBondContact O-N 3.5Å; V109-W111 VanDerWaalsContact C-N 3.26Å; V109-W111 PolarHBondContact O-N 3.29Å; V109-S112 WeakPolarHBondContact O-CB 3.35Å; V109-S112 PolarHBondContact O-N 3.01Å; V109-S112 VanDerWaalsContact O-N 3.14Å; V109-S112 PolarHBondContact O-OG 3.33Å |
| 110 | A | 89.4 | Confident | 88.1 | Confident | 80 Ų | 80 | 84.5 Ų | 84.5 | 66% | 0.661 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -62 | -34.1 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | L106 W107 | L106-A110 VanDerWaalsContact O-CB 3.29Å; L106-A110 WeakPolarHBondContact O-CB 3.43Å; L106-A110 PolarHBondContact O-N 2.96Å; W107-A110 PolarHBondContact O-N 3.45Å |
| 111 | W | 86.3 | Confident | 87.8 | Confident | 77 Ų | 77 | 86.5 Ų | 86.5 | 29% | 0.292 | 47% | 0.471 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -95.8 | 4.9 | 179 | -80.4 | 50.9 | 0 | 0 | 0 | 113.8 | W107 V109 S113 K114 V115 Y118 | W107-W111 AromaticContact CE2-CE2 3.94Å; W107-W111 AromaticContact CE2-NE1 3.91Å; W107-W111 HydrophobicContact CH2-CZ2 4.06Å; W107-W111 HydrophobicContact CZ2-CD2 4.12Å; W107-W111 AromaticContact CZ2-CE2 3.54Å; W107-W111 HydrophobicContact CZ2-CH2 4.13Å; W107-W111 AromaticContact CZ2-CZ2 3.59Å; W107-W111 HydrophobicContact CZ2-CZ2 3.59Å; W107-W111 AromaticContact CZ2-NE1 3.74Å; W107-W111 AromaticContact NE1-CD2 3.97Å; W107-W111 WeakPolarHBondContact O-CB 3.2Å; W107-W111 PolarHBondContact O-N 3.32Å; V109-W111 VanDerWaalsContact C-N 3.26Å; V109-W111 PolarHBondContact O-N 3.29Å; W111-S113 PolarHBondContact O-N 3.49Å; W111-S113 VanDerWaalsContact O-N 3.1Å; W111-K114 HydrophobicContact CD2-CD 4.26Å; W111-K114 HydrophobicContact CE3-CB 4.36Å; W111-K114 HydrophobicContact CE3-CD 4.09Å; W111-K114 HydrophobicContact CZ3-CD 4.37Å; W111-K114 CarbonylContact O-C 3.5Å; W111-K114 WeakPolarHBondContact O-CA 3.29Å; W111-K114 WeakPolarHBondContact O-CB 3.45Å; W111-K114 PolarHBondContact O-N 2.84Å; W111-V115 WeakPolarHBondContact O-CG2 3.27Å; W111-V115 PolarHBondContact O-N 3.45Å; W111-Y118 HydrophobicContact CE3-CD2 4.29Å; W111-Y118 AromaticContact CE3-CE2 3.73Å; W111-Y118 HydrophobicContact CE3-CE2 3.73Å; W111-Y118 HydrophobicContact CH2-CE2 4.49Å; W111-Y118 HydrophobicContact CZ3-CD2 4.31Å; W111-Y118 AromaticContact CZ3-CE2 3.37Å; W111-Y118 HydrophobicContact CZ3-CE2 3.37Å; W111-Y118 AromaticContact CZ3-CZ 3.57Å; W111-Y118 WeakPolarHBondContact CZ3-OH 3.27Å |
| 112 | S | 80.1 | Confident | 87.5 | Confident | 63 Ų | 63 | 87 Ų | 87 | 44% | 0.441 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -49.8 | -40.6 | -176.9 | 57.3 | 0 | 0 | 0 | 0 | 113.6 | A108 V109 K114 V115 | A108-S112 PolarHBondContact O-N 2.84Å; A108-S112 VanDerWaalsContact O-N 3.13Å; V109-S112 WeakPolarHBondContact O-CB 3.35Å; V109-S112 PolarHBondContact O-N 3.01Å; V109-S112 VanDerWaalsContact O-N 3.14Å; V109-S112 PolarHBondContact O-OG 3.33Å; S112-K114 VanDerWaalsContact C-N 3.29Å; S112-K114 PolarHBondContact O-N 3.08Å; S112-V115 WeakPolarHBondContact O-CB 3.29Å; S112-V115 PolarHBondContact O-N 2.85Å |
| 113 | S | 78.5 | Confident | 87.2 | Confident | 106 Ų | 106 | 82.7 Ų | 82.7 | 74% | 0.741 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -63.3 | -32.3 | 175.4 | -56.4 | 0 | 0 | 0 | 0 | 113.5 | W111 | W111-S113 PolarHBondContact O-N 3.49Å; W111-S113 VanDerWaalsContact O-N 3.1Å |
| 114 | K | 82.5 | Confident | 86.9 | Confident | 116 Ų | 116 | 82.7 Ų | 82.7 | 50% | 0.504 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -87.3 | -22.7 | 177.2 | -63.6 | -176 | -178.3 | 178.2 | 0 | 112.7 | W111 S112 N116 H117 Y118 | W111-K114 HydrophobicContact CD2-CD 4.26Å; W111-K114 HydrophobicContact CE3-CB 4.36Å; W111-K114 HydrophobicContact CE3-CD 4.09Å; W111-K114 HydrophobicContact CZ3-CD 4.37Å; W111-K114 CarbonylContact O-C 3.5Å; W111-K114 WeakPolarHBondContact O-CA 3.29Å; W111-K114 WeakPolarHBondContact O-CB 3.45Å; W111-K114 PolarHBondContact O-N 2.84Å; S112-K114 VanDerWaalsContact C-N 3.29Å; S112-K114 PolarHBondContact O-N 3.08Å; K114-N116 PolarHBondContact O-N 2.89Å; K114-N116 VanDerWaalsContact O-N 3.17Å; K114-H117 PolarHBondContact O-N 3.44Å; K114-Y118 HydrophobicContact CB-CD2 4Å; K114-Y118 HydrophobicContact CB-CE2 4.12Å; K114-Y118 WeakPolarHBondContact O-CD2 3.22Å; K114-Y118 PolarHBondContact O-N 3.4Å |
| 115 | V | 78.7 | Confident | 86.7 | Confident | 61 Ų | 61 | 84 Ų | 84 | 37% | 0.37 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -53.5 | -38.4 | 180 | 168.8 | 0 | 0 | 0 | 0 | 110.9 | W111 S112 H117 Y118 M119 | W111-V115 WeakPolarHBondContact O-CG2 3.27Å; W111-V115 PolarHBondContact O-N 3.45Å; S112-V115 WeakPolarHBondContact O-CB 3.29Å; S112-V115 PolarHBondContact O-N 2.85Å; V115-H117 PolarHBondContact O-N 3.28Å; V115-Y118 PolarHBondContact O-N 2.97Å; V115-M119 WeakPolarHBondContact O-CB 3.27Å; V115-M119 PolarHBondContact O-N 3.49Å |
| 116 | N | 83.1 | Confident | 86.3 | Confident | 53 Ų | 53 | 82.8 Ų | 82.8 | 28% | 0.283 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -57.5 | -46.9 | 174.8 | -69.5 | -21.5 | 0 | 0 | 0 | 112.1 | K114 Y120 H184 V188 | K114-N116 PolarHBondContact O-N 2.89Å; K114-N116 VanDerWaalsContact O-N 3.17Å; N116-Y120 PolarHBondContact O-N 3.44Å; N116-H184 PolarHBondContact O-NE2 3.17Å; N116-V188 WeakPolarHBondContact OD1-CG1 3.3Å; N116-V188 WeakPolarHBondContact OD1-CG2 3.41Å |
| 117 | H | 87.7 | Confident | 86 | Confident | 107 Ų | 107 | 77.7 Ų | 77.7 | 50% | 0.495 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -69.8 | -42 | 179.7 | -174 | 22.2 | 0 | 0 | 0 | 111.9 | K114 V115 M119 Y120 R121 | K114-H117 PolarHBondContact O-N 3.44Å; V115-H117 PolarHBondContact O-N 3.28Å; H117-M119 PolarHBondContact O-N 2.87Å; H117-Y120 WeakPolarHBondContact O-CB 3.49Å; H117-Y120 PolarHBondContact O-N 3Å; H117-R121 PolarHBondContact CE1-NE 2.89Å; H117-R121 VanDerWaalsContact CE1-NE 3.32Å; H117-R121 WeakPolarHBondContact O-CG 3.37Å; H117-R121 PolarHBondContact O-N 2.97Å |
| 118 | Y | 85.3 | Confident | 85.7 | Confident | 133 Ų | 133 | 73.7 Ų | 73.7 | 52% | 0.522 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -62.4 | -42.9 | 176.2 | -86 | -80.8 | 0 | 0 | 0 | 112.1 | W111 K114 V115 Y120 R121 Y122 | W111-Y118 HydrophobicContact CE3-CD2 4.29Å; W111-Y118 AromaticContact CE3-CE2 3.73Å; W111-Y118 HydrophobicContact CE3-CE2 3.73Å; W111-Y118 HydrophobicContact CH2-CE2 4.49Å; W111-Y118 HydrophobicContact CZ3-CD2 4.31Å; W111-Y118 AromaticContact CZ3-CE2 3.37Å; W111-Y118 HydrophobicContact CZ3-CE2 3.37Å; W111-Y118 AromaticContact CZ3-CZ 3.57Å; W111-Y118 WeakPolarHBondContact CZ3-OH 3.27Å; K114-Y118 HydrophobicContact CB-CD2 4Å; K114-Y118 HydrophobicContact CB-CE2 4.12Å; K114-Y118 WeakPolarHBondContact O-CD2 3.22Å; K114-Y118 PolarHBondContact O-N 3.4Å; V115-Y118 PolarHBondContact O-N 2.97Å; Y118-Y120 VanDerWaalsContact C-N 3.31Å; Y118-Y120 PolarHBondContact O-N 2.94Å; Y118-R121 PolarHBondContact O-N 3.25Å; Y118-Y122 VanDerWaalsContact O-CB 3.27Å; Y118-Y122 WeakPolarHBondContact O-CB 3.48Å; Y118-Y122 PolarHBondContact O-N 3.03Å |
| 119 | M | 86.6 | Confident | 85.4 | Confident | 50 Ų | 50 | 76.4 Ų | 76.4 | 25% | 0.246 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -61.3 | -42.7 | 176.1 | -169.2 | 65.8 | 69.4 | 0 | 0 | 110.8 | V115 H117 Y122 L123 L187 | V115-M119 WeakPolarHBondContact O-CB 3.27Å; V115-M119 PolarHBondContact O-N 3.49Å; H117-M119 PolarHBondContact O-N 2.87Å; M119-Y122 PolarHBondContact O-N 3.39Å; M119-L123 HydrophobicContact CG-CD1 4.22Å; M119-L123 WeakPolarHBondContact O-CB 3.32Å; M119-L123 WeakPolarHBondContact O-CG 3.44Å; M119-L123 PolarHBondContact O-N 3.45Å; M119-L187 HydrophobicContact SD-CD2 4.08Å |
| 120 | Y | 90.7 | Very high | 85.1 | Confident | 68 Ų | 68 | 73.1 Ų | 73.1 | 27% | 0.267 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -58.9 | -52.9 | 174.8 | -176.1 | -81.4 | 0 | 0 | 0 | 111.2 | N116 H117 Y118 Y122 L123 E124 V155 T156 H184 | N116-Y120 PolarHBondContact O-N 3.44Å; H117-Y120 WeakPolarHBondContact O-CB 3.49Å; H117-Y120 PolarHBondContact O-N 3Å; Y118-Y120 VanDerWaalsContact C-N 3.31Å; Y118-Y120 PolarHBondContact O-N 2.94Å; Y120-Y122 VanDerWaalsContact C-N 3.32Å; Y120-Y122 PolarHBondContact O-N 3.45Å; Y120-L123 PolarHBondContact O-N 2.86Å; Y120-E124 HydrophobicContact CD1-CB 4.47Å; Y120-E124 HydrophobicContact CE1-CB 4.31Å; Y120-E124 VanDerWaalsContact O-CB 3.27Å; Y120-E124 WeakPolarHBondContact O-CB 3.45Å; Y120-E124 PolarHBondContact O-N 3.45Å; Y120-V155 HydrophobicContact CD1-CG1 4.44Å; Y120-V155 HydrophobicContact CD2-CG1 3.58Å; Y120-V155 HydrophobicContact CE1-CG1 4.38Å; Y120-V155 HydrophobicContact CE2-CG1 3.53Å; Y120-V155 HydrophobicContact CG-CG1 4.05Å; Y120-T156 HydrophobicContact CE2-CG2 3.57Å; Y120-H184 HydrophobicContact CD2-CB 4.39Å; Y120-H184 PolarHBondContact N-CD2 2.91Å |
| 121 | R | 90.6 | Very high | 84.6 | Confident | 133 Ų | 133 | 73.4 Ų | 73.4 | 50% | 0.502 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -61.1 | -40.2 | -179.7 | -73 | -61.8 | -163.4 | -173.2 | 2 | 112.5 | H117 Y118 E124 E125 | H117-R121 PolarHBondContact CE1-NE 2.89Å; H117-R121 VanDerWaalsContact CE1-NE 3.32Å; H117-R121 WeakPolarHBondContact O-CG 3.37Å; H117-R121 PolarHBondContact O-N 2.97Å; Y118-R121 PolarHBondContact O-N 3.25Å; R121-E124 VanDerWaalsContact CD-OE2 3.27Å; R121-E124 WeakPolarHBondContact CD-OE2 3.18Å; R121-E124 IonicContact CZ-OE2 2.67Å; R121-E124 IonicContact NE-OE2 3.26Å; R121-E124 IonicContact NH1-OE1 3.93Å; R121-E124 IonicContact NH1-OE2 3.32Å; R121-E124 PolarHBondContact NH1-OE2 2.83Å; R121-E124 PolarHBondContact O-N 2.88Å; R121-E125 WeakPolarHBondContact O-CB 3.29Å; R121-E125 PolarHBondContact O-N 2.85Å |
| 122 | Y | 87.1 | Confident | 84.2 | Confident | 109 Ų | 109 | 76.8 Ų | 76.8 | 43% | 0.427 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -64.1 | -47.7 | 177.2 | -178.7 | -99.6 | 0 | 0 | 0 | 111.3 | Y118 M119 Y120 E125 Q126 | Y118-Y122 VanDerWaalsContact O-CB 3.27Å; Y118-Y122 WeakPolarHBondContact O-CB 3.48Å; Y118-Y122 PolarHBondContact O-N 3.03Å; M119-Y122 PolarHBondContact O-N 3.39Å; Y120-Y122 VanDerWaalsContact C-N 3.32Å; Y120-Y122 PolarHBondContact O-N 3.45Å; Y122-E125 PolarHBondContact O-N 3.33Å; Y122-Q126 HydrophobicContact CD1-CG 4.37Å; Y122-Q126 HydrophobicContact CE1-CG 4.01Å; Y122-Q126 WeakPolarHBondContact O-CG 3.39Å; Y122-Q126 PolarHBondContact O-N 2.73Å |
| 123 | L | 88 | Confident | 83.7 | Confident | 0 Ų | 0 | 75.9 Ų | 75.9 | 0% | 0 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -63.5 | -41.2 | 175.7 | -72.9 | 172.5 | 0 | 0 | 0 | 111.7 | M119 Y120 Q126 V127 M143 I146 V155 C183 H184 | M119-L123 HydrophobicContact CG-CD1 4.22Å; M119-L123 WeakPolarHBondContact O-CB 3.32Å; M119-L123 WeakPolarHBondContact O-CG 3.44Å; M119-L123 PolarHBondContact O-N 3.45Å; Y120-L123 PolarHBondContact O-N 2.86Å; L123-Q126 PolarHBondContact O-N 3.28Å; L123-V127 WeakPolarHBondContact O-CG2 3.41Å; L123-V127 PolarHBondContact O-N 3.39Å; L123-M143 HydrophobicContact CD2-CE 4.15Å; L123-I146 HydrophobicContact CD2-CD1 4.41Å; L123-V155 HydrophobicContact CB-CG1 4.07Å; L123-V155 HydrophobicContact CB-CG2 4.2Å; L123-C183 HydrophobicContact CD1-CB 4.24Å; L123-H184 HydrophobicContact CD1-CB 4Å |
| 124 | E | 90 | Very high | 82.9 | Confident | 53 Ų | 53 | 78.3 Ų | 78.3 | 25% | 0.248 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -57.6 | -48.2 | 174.7 | 179.8 | 177.8 | -131.4 | 0 | 0 | 111.1 | Y120 R121 Q126 V127 I128 V155 | Y120-E124 HydrophobicContact CD1-CB 4.47Å; Y120-E124 HydrophobicContact CE1-CB 4.31Å; Y120-E124 VanDerWaalsContact O-CB 3.27Å; Y120-E124 WeakPolarHBondContact O-CB 3.45Å; Y120-E124 PolarHBondContact O-N 3.45Å; R121-E124 VanDerWaalsContact CD-OE2 3.27Å; R121-E124 WeakPolarHBondContact CD-OE2 3.18Å; R121-E124 IonicContact CZ-OE2 2.67Å; R121-E124 IonicContact NE-OE2 3.26Å; R121-E124 IonicContact NH1-OE1 3.93Å; R121-E124 IonicContact NH1-OE2 3.32Å; R121-E124 PolarHBondContact NH1-OE2 2.83Å; R121-E124 PolarHBondContact O-N 2.88Å; E124-Q126 VanDerWaalsContact C-N 3.35Å; E124-Q126 PolarHBondContact O-N 3.48Å; E124-V127 PolarHBondContact O-N 3.36Å; E124-I128 HydrophobicContact CG-CD1 3.94Å; E124-I128 VanDerWaalsContact O-CG1 3.27Å; E124-I128 WeakPolarHBondContact O-CG1 3.37Å; E124-I128 PolarHBondContact O-N 3.31Å; E124-V155 HydrophobicContact CB-CG2 4.17Å |
| 125 | E | 86.8 | Confident | 81.9 | Confident | 87 Ų | 87 | 77.9 Ų | 77.9 | 41% | 0.407 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -61.8 | -41.3 | 175.6 | -172.1 | 179.7 | -177.3 | 0 | 0 | 112.1 | R121 Y122 I128 R129 | R121-E125 WeakPolarHBondContact O-CB 3.29Å; R121-E125 PolarHBondContact O-N 2.85Å; Y122-E125 PolarHBondContact O-N 3.33Å; E125-I128 PolarHBondContact O-N 2.87Å; E125-R129 WeakPolarHBondContact O-CB 3.39Å; E125-R129 VanDerWaalsContact O-CG 3.27Å; E125-R129 WeakPolarHBondContact O-CG 3.2Å; E125-R129 PolarHBondContact O-N 3.31Å; E125-R129 IonicContact OE1-CZ 3.49Å; E125-R129 VanDerWaalsContact OE1-CZ 3.32Å; E125-R129 IonicContact OE1-NE 2.79Å; E125-R129 PolarHBondContact OE1-NE 3.23Å; E125-R129 IonicContact OE1-NH2 3.69Å; E125-R129 PolarHBondContact OE1-NH2 3.49Å |
| 126 | Q | 83.4 | Confident | 81.1 | Confident | 12 Ų | 12 | 82.5 Ų | 82.5 | 6% | 0.056 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -65.4 | -39.1 | 175.9 | -65.9 | -43.3 | -61.7 | 0 | 0 | 112.2 | Y122 L123 E124 Y130 S139 M143 | Y122-Q126 HydrophobicContact CD1-CG 4.37Å; Y122-Q126 HydrophobicContact CE1-CG 4.01Å; Y122-Q126 WeakPolarHBondContact O-CG 3.39Å; Y122-Q126 PolarHBondContact O-N 2.73Å; L123-Q126 PolarHBondContact O-N 3.28Å; E124-Q126 VanDerWaalsContact C-N 3.35Å; E124-Q126 PolarHBondContact O-N 3.48Å; Q126-Y130 VanDerWaalsContact O-CB 3.32Å; Q126-Y130 WeakPolarHBondContact O-CB 3.36Å; Q126-Y130 PolarHBondContact O-N 3.14Å; Q126-S139 VanDerWaalsContact OE1-CB 3.23Å; Q126-S139 PolarHBondContact OE1-OG 3.37Å; Q126-M143 HydrophobicContact CB-CE 3.48Å; Q126-M143 VanDerWaalsContact CB-CE 3.48Å |
| 127 | V | 85.3 | Confident | 80.4 | Confident | 4 Ų | 4 | 83.9 Ų | 83.9 | 2% | 0.024 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -67.5 | -41 | 175.6 | 172.8 | 0 | 0 | 0 | 0 | 111.1 | L123 E124 Y130 R131 M143 V155 D160 Y161 | L123-V127 WeakPolarHBondContact O-CG2 3.41Å; L123-V127 PolarHBondContact O-N 3.39Å; E124-V127 PolarHBondContact O-N 3.36Å; V127-Y130 VanDerWaalsContact O-CB 3.3Å; V127-Y130 WeakPolarHBondContact O-CB 3.43Å; V127-Y130 PolarHBondContact O-N 2.89Å; V127-R131 WeakPolarHBondContact O-CG 3.36Å; V127-R131 PolarHBondContact O-N 3.41Å; V127-M143 HydrophobicContact CG2-CE 3.49Å; V127-M143 VanDerWaalsContact CG2-CE 3.49Å; V127-M143 HydrophobicContact CG2-SD 4.3Å; V127-V155 HydrophobicContact CB-CG2 4.17Å; V127-V155 HydrophobicContact CG2-CG2 3.71Å; V127-D160 HydrophobicContact CG1-CB 4.17Å; V127-Y161 HydrophobicContact CG1-CD1 4.09Å; V127-Y161 HydrophobicContact CG1-CE1 3.99Å |
| 128 | I | 85.1 | Confident | 79.4 | Confident | 74 Ų | 74 | 80.8 Ų | 80.8 | 38% | 0.379 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -61 | -49.7 | 175.2 | -69.1 | 165.6 | 0 | 0 | 0 | 110.1 | E124 E125 Y130 R131 E132 | E124-I128 HydrophobicContact CG-CD1 3.94Å; E124-I128 VanDerWaalsContact O-CG1 3.27Å; E124-I128 WeakPolarHBondContact O-CG1 3.37Å; E124-I128 PolarHBondContact O-N 3.31Å; E125-I128 PolarHBondContact O-N 2.87Å; I128-Y130 PolarHBondContact O-N 3.29Å; I128-R131 WeakPolarHBondContact O-CA 3.47Å; I128-R131 WeakPolarHBondContact O-CB 3.47Å; I128-R131 PolarHBondContact O-N 2.98Å; I128-E132 HydrophobicContact CG2-CG 4.5Å; I128-E132 PolarHBondContact O-N 2.9Å |
| 129 | R | 82 | Confident | 78.5 | Confident | 112 Ų | 112 | 75.4 Ų | 75.4 | 42% | 0.423 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -60 | -36 | 175.8 | -71.6 | 175.3 | -177.5 | -142.7 | 3.4 | 112.2 | E125 R131 E132 T133 | E125-R129 WeakPolarHBondContact O-CB 3.39Å; E125-R129 VanDerWaalsContact O-CG 3.27Å; E125-R129 WeakPolarHBondContact O-CG 3.2Å; E125-R129 PolarHBondContact O-N 3.31Å; E125-R129 IonicContact OE1-CZ 3.49Å; E125-R129 VanDerWaalsContact OE1-CZ 3.32Å; E125-R129 IonicContact OE1-NE 2.79Å; E125-R129 PolarHBondContact OE1-NE 3.23Å; E125-R129 IonicContact OE1-NH2 3.69Å; E125-R129 PolarHBondContact OE1-NH2 3.49Å; R129-R131 VanDerWaalsContact C-N 3.31Å; R129-R131 PolarHBondContact O-N 3.17Å; R129-E132 PolarHBondContact O-N 3.37Å; R129-T133 WeakPolarHBondContact O-CB 3.4Å; R129-T133 PolarHBondContact O-N 2.94Å; R129-T133 PolarHBondContact O-OG1 2.82Å |
| 130 | Y | 80.7 | Confident | 78 | Confident | 37 Ų | 37 | 73.1 Ų | 73.1 | 15% | 0.145 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -61.2 | -39.8 | 173.6 | -164.8 | -68.8 | 0 | 0 | 0 | 111.7 | Q126 V127 I128 T140 M143 D144 Y161 P167 | Q126-Y130 VanDerWaalsContact O-CB 3.32Å; Q126-Y130 WeakPolarHBondContact O-CB 3.36Å; Q126-Y130 PolarHBondContact O-N 3.14Å; V127-Y130 VanDerWaalsContact O-CB 3.3Å; V127-Y130 WeakPolarHBondContact O-CB 3.43Å; V127-Y130 PolarHBondContact O-N 2.89Å; I128-Y130 PolarHBondContact O-N 3.29Å; Y130-T140 VanDerWaalsContact CD2-CA 3.5Å; Y130-T140 HydrophobicContact CD2-CG2 3.75Å; Y130-T140 VanDerWaalsContact CE2-CB 3.47Å; Y130-T140 HydrophobicContact CE2-CG2 3.87Å; Y130-T140 HydrophobicContact CG-CG2 4.06Å; Y130-M143 HydrophobicContact CD2-CB 3.94Å; Y130-M143 HydrophobicContact CD2-CG 4.18Å; Y130-M143 HydrophobicContact CE2-CB 4.4Å; Y130-D144 PolarHBondContact OH-OD1 3.06Å; Y130-Y161 HydrophobicContact CD1-CD1 4.18Å; Y130-Y161 AromaticContact CD1-CE1 3.6Å; Y130-Y161 HydrophobicContact CD1-CE1 3.6Å; Y130-Y161 HydrophobicContact CE1-CE1 4.21Å; Y130-Y161 AromaticContact CG-CE1 3.85Å; Y130-Y161 HydrophobicContact CG-CE1 3.85Å; Y130-P167 HydrophobicContact CE1-CB 3.91Å; Y130-P167 HydrophobicContact CE1-CG 4.31Å; Y130-P167 HydrophobicContact CE2-CB 4.32Å; Y130-P167 HydrophobicContact CE2-CG 4.49Å; Y130-P167 WeakPolarHBondContact OH-CB 3.26Å |
| 131 | R | 78.4 | Confident | 77.3 | Confident | 87 Ų | 87 | 73.5 Ų | 73.5 | 33% | 0.328 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -74 | -30 | 178.5 | -68.6 | 175.1 | 70.8 | 176.8 | -4.3 | 113 | V127 I128 R129 D160 Y161 R164 | V127-R131 WeakPolarHBondContact O-CG 3.36Å; V127-R131 PolarHBondContact O-N 3.41Å; I128-R131 WeakPolarHBondContact O-CA 3.47Å; I128-R131 WeakPolarHBondContact O-CB 3.47Å; I128-R131 PolarHBondContact O-N 2.98Å; R129-R131 VanDerWaalsContact C-N 3.31Å; R129-R131 PolarHBondContact O-N 3.17Å; R131-D160 PolarHBondContact NH1-O 2.87Å; R131-Y161 HydrophobicContact CG-CD1 4.2Å; R131-Y161 PolarHBondContact NE-O 2.85Å; R131-R164 PolarHBondContact O-NE 3.33Å; R131-R164 PolarHBondContact O-NH1 2.98Å; R131-R164 PolarHBondContact O-NH2 3.33Å; R131-R164 VanDerWaalsContact O-NH2 3.13Å |
| 132 | E | 77.4 | Confident | 76.8 | Confident | 147 Ų | 147 | 68.9 Ų | 68.9 | 69% | 0.687 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -87.9 | -30.5 | -176.7 | -70.3 | 176.8 | 178.9 | 0 | 0 | 112.3 | I128 R129 | I128-E132 HydrophobicContact CG2-CG 4.5Å; I128-E132 PolarHBondContact O-N 2.9Å; R129-E132 PolarHBondContact O-N 3.37Å |
| 133 | T | 69 | Low | 76.6 | Confident | 44 Ų | 44 | 63.7 Ų | 63.7 | 27% | 0.27 | 31% | 0.307 | S | S | . | . | S | Bend | trans | -101 | 160.3 | -170 | -28.4 | 0 | 0 | 0 | 0 | 114.1 | R129 N137 | R129-T133 WeakPolarHBondContact O-CB 3.4Å; R129-T133 PolarHBondContact O-N 2.94Å; R129-T133 PolarHBondContact O-OG1 2.82Å; T133-N137 HydrophobicContact CG2-CB 3.99Å; T133-N137 VanDerWaalsContact CG2-CG 3.46Å; T133-N137 WeakPolarHBondContact CG2-ND2 3.36Å |
| 134 | E | 63.3 | Low | 76.3 | Confident | 157 Ų | 157 | 65.4 Ų | 65.4 | 73% | 0.734 | 32% | 0.316 | S | S | * | . | trans | -61.9 | 152.3 | 173.8 | -72 | -168.7 | 178.3 | 0 | 0 | 112.2 | E136 N137 | E134-E136 PolarHBondContact O-N 3.06Å; E134-N137 PolarHBondContact O-N 2.9Å | ||
| 135 | P | 61.7 | Low | 75.9 | Confident | 107 Ų | 107 | 65.4 Ų | 65.4 | 70% | 0.695 | 32% | 0.315 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.3 | -4.2 | -167.3 | 18.5 | -31.4 | 0 | 0 | 0 | 117 | T140 | P135-T140 PolarHBondContact O-OG1 3.02Š|
| 136 | E | 61.2 | Low | 75.9 | Confident | 159 Ų | 159 | 62.1 Ų | 62.1 | 74% | 0.743 | 30% | 0.3 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -115.8 | 7.6 | -171.9 | -62 | -167.7 | 162.2 | 0 | 0 | 115.5 | E134 | E134-E136 PolarHBondContact O-N 3.06Š|
| 137 | N | 68 | Low | 76 | Confident | 81 Ų | 81 | 61.5 Ų | 61.5 | 43% | 0.433 | 30% | 0.297 | S | S | . | . | S | Bend | trans | -70.7 | 152.7 | 179.1 | -101.3 | 21 | 0 | 0 | 0 | 113.8 | T133 E134 S139 T140 K141 | T133-N137 HydrophobicContact CG2-CB 3.99Å; T133-N137 VanDerWaalsContact CG2-CG 3.46Å; T133-N137 WeakPolarHBondContact CG2-ND2 3.36Å; E134-N137 PolarHBondContact O-N 2.9Å; N137-S139 PolarHBondContact O-N 2.88Å; N137-S139 VanDerWaalsContact O-N 3.09Å; N137-T140 HydrophobicContact CB-CG2 4.46Å; N137-T140 PolarHBondContact N-OG1 3.31Å; N137-T140 WeakPolarHBondContact O-CA 3.41Å; N137-T140 PolarHBondContact O-N 2.82Å; N137-T140 PolarHBondContact O-OG1 2.9Å; N137-K141 PolarHBondContact O-N 3.1Å |
| 138 | E | 66.6 | Low | 75.9 | Confident | 43 Ų | 43 | 67.5 Ų | 67.5 | 20% | 0.201 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -51.9 | -37.6 | 179.7 | -70.2 | -75.5 | 123.6 | 0 | 0 | 113.3 | A53 V54 H55 L142 | A53-E138 VanDerWaalsContact CA-OE2 3.26Å; A53-E138 WeakPolarHBondContact CA-OE2 3.48Å; V54-E138 PolarHBondContact N-OE2 3.31Å; H55-E138 HydrophobicContact CB-CG 4.23Å; H55-E138 IonicContact CD2-OE1 3.74Å; H55-E138 PolarHBondContact CD2-OE1 3.35Å; H55-E138 IonicContact CG-OE1 3.93Å; H55-E138 PolarHBondContact N-OE2 2.86Å; E138-L142 WeakPolarHBondContact O-CB 3.45Å; E138-L142 PolarHBondContact O-N 2.88Å |
| 139 | S | 67 | Low | 75.8 | Confident | 20 Ų | 20 | 70.4 Ų | 70.4 | 14% | 0.14 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -65 | -35.4 | 174.7 | -71.7 | 0 | 0 | 0 | 0 | 113.2 | Q126 N137 M143 | Q126-S139 VanDerWaalsContact OE1-CB 3.23Å; Q126-S139 PolarHBondContact OE1-OG 3.37Å; N137-S139 PolarHBondContact O-N 2.88Å; N137-S139 VanDerWaalsContact O-N 3.09Å; S139-M143 PolarHBondContact O-N 2.93Å; S139-M143 VanDerWaalsContact O-N 3.16Å |
| 140 | T | 74.8 | Confident | 75.9 | Confident | 1 Ų | 1 | 69.2 Ų | 69.2 | 1% | 0.006 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -70.4 | -44.8 | 178.7 | 65.3 | 0 | 0 | 0 | 0 | 110.7 | Y130 P135 N137 L142 M143 D144 | Y130-T140 VanDerWaalsContact CD2-CA 3.5Å; Y130-T140 HydrophobicContact CD2-CG2 3.75Å; Y130-T140 VanDerWaalsContact CE2-CB 3.47Å; Y130-T140 HydrophobicContact CE2-CG2 3.87Å; Y130-T140 HydrophobicContact CG-CG2 4.06Å; P135-T140 PolarHBondContact O-OG1 3.02Å; N137-T140 HydrophobicContact CB-CG2 4.46Å; N137-T140 PolarHBondContact N-OG1 3.31Å; N137-T140 WeakPolarHBondContact O-CA 3.41Å; N137-T140 PolarHBondContact O-N 2.82Å; N137-T140 PolarHBondContact O-OG1 2.9Å; T140-L142 PolarHBondContact O-N 2.78Å; T140-M143 PolarHBondContact O-N 2.54Å; T140-D144 WeakPolarHBondContact O-CB 3.38Å; T140-D144 PolarHBondContact O-N 3.05Å |
| 141 | K | 77.2 | Confident | 76.1 | Confident | 77 Ų | 77 | 68.3 Ų | 68.3 | 34% | 0.335 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -59.5 | -46.3 | 175.7 | -63.4 | -178.7 | -176.9 | 174 | 0 | 111.5 | P52 N137 M143 D144 F145 | P52-K141 VanDerWaalsContact CB-C 3.46Å; P52-K141 HydrophobicContact CB-CB 3.95Å; P52-K141 WeakPolarHBondContact CB-O 3.42Å; P52-K141 WeakPolarHBondContact O-CB 3.5Å; P52-K141 WeakPolarHBondContact O-CD 3.42Å; N137-K141 PolarHBondContact O-N 3.1Å; K141-M143 VanDerWaalsContact C-N 3.34Å; K141-M143 PolarHBondContact O-N 3.26Å; K141-D144 PolarHBondContact O-N 3.36Å; K141-F145 PolarHBondContact O-N 3.13Å |
| 142 | L | 79.3 | Confident | 76.6 | Confident | 35 Ų | 35 | 64.2 Ų | 64.2 | 18% | 0.183 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -58.8 | -47 | 179.9 | 180 | 62.3 | 0 | 0 | 0 | 111.5 | P52 A53 E138 T140 F145 I146 | P52-L142 HydrophobicContact CG-CB 4.43Å; P52-L142 HydrophobicContact CG-CD1 3.88Å; A53-L142 HydrophobicContact CB-CD1 4.43Å; E138-L142 WeakPolarHBondContact O-CB 3.45Å; E138-L142 PolarHBondContact O-N 2.88Å; T140-L142 PolarHBondContact O-N 2.78Å; L142-F145 PolarHBondContact O-N 2.92Å; L142-I146 HydrophobicContact CD1-CD1 4.21Å; L142-I146 HydrophobicContact CG-CD1 4.02Å; L142-I146 VanDerWaalsContact O-CG1 3.3Å; L142-I146 WeakPolarHBondContact O-CG1 3.33Å; L142-I146 PolarHBondContact O-N 2.87Å |
| 143 | M | 83.1 | Confident | 77.2 | Confident | 1 Ų | 1 | 57.2 Ų | 57.2 | 1% | 0.005 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -63.9 | -43.9 | 177.5 | -173.2 | 59.9 | 70.7 | 0 | 0 | 111.6 | L123 Q126 V127 Y130 S139 T140 K141 F145 I146 Q147 Y161 | L123-M143 HydrophobicContact CD2-CE 4.15Å; Q126-M143 HydrophobicContact CB-CE 3.48Å; Q126-M143 VanDerWaalsContact CB-CE 3.48Å; V127-M143 HydrophobicContact CG2-CE 3.49Å; V127-M143 VanDerWaalsContact CG2-CE 3.49Å; V127-M143 HydrophobicContact CG2-SD 4.3Å; Y130-M143 HydrophobicContact CD2-CB 3.94Å; Y130-M143 HydrophobicContact CD2-CG 4.18Å; Y130-M143 HydrophobicContact CE2-CB 4.4Å; S139-M143 PolarHBondContact O-N 2.93Å; S139-M143 VanDerWaalsContact O-N 3.16Å; T140-M143 PolarHBondContact O-N 2.54Å; K141-M143 VanDerWaalsContact C-N 3.34Å; K141-M143 PolarHBondContact O-N 3.26Å; M143-F145 VanDerWaalsContact C-N 3.28Å; M143-F145 PolarHBondContact O-N 3.38Å; M143-I146 PolarHBondContact O-N 3.32Å; M143-Q147 HydrophobicContact CG-CG 4.34Å; M143-Q147 WeakPolarHBondContact O-CB 3.19Å; M143-Q147 VanDerWaalsContact O-CG 3.24Å; M143-Q147 WeakPolarHBondContact O-CG 3.5Å; M143-Q147 PolarHBondContact O-N 3.44Å; M143-Q147 HydrophobicContact SD-CG 4.18Å; M143-Y161 WeakPolarHBondContact CG-OH 3.47Å |
| 144 | D | 82.8 | Confident | 78.1 | Confident | 35 Ų | 35 | 55.1 Ų | 55.1 | 19% | 0.187 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -57.8 | -40.4 | 177.8 | -89.1 | 5.4 | 0 | 0 | 0 | 112.9 | Y130 T140 K141 K148 S169 | Y130-D144 PolarHBondContact OH-OD1 3.06Å; T140-D144 WeakPolarHBondContact O-CB 3.38Å; T140-D144 PolarHBondContact O-N 3.05Å; K141-D144 PolarHBondContact O-N 3.36Å; D144-K148 WeakPolarHBondContact O-CB 3.2Å; D144-K148 VanDerWaalsContact O-CG 3.23Å; D144-K148 WeakPolarHBondContact O-CG 3.44Å; D144-K148 PolarHBondContact O-N 3.1Å; D144-S169 VanDerWaalsContact OD1-CB 3.23Å; D144-S169 WeakPolarHBondContact OD1-CB 3.25Å; D144-S169 PolarHBondContact OD1-OG 3.49Å |
| 145 | F | 81.7 | Confident | 79.3 | Confident | 53 Ų | 53 | 47.8 Ų | 47.8 | 23% | 0.232 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -69 | -45.4 | 175.3 | 170.9 | -97.8 | 0 | 0 | 0 | 112.2 | A49 H50 P52 K141 L142 M143 Q147 K148 K149 | A49-F145 WeakPolarHBondContact O-CD2 3.37Å; A49-F145 WeakPolarHBondContact O-CE2 3.49Å; H50-F145 WeakPolarHBondContact O-CE2 3.48Å; H50-F145 WeakPolarHBondContact O-CZ 3.32Å; P52-F145 HydrophobicContact CB-CB 3.57Å; P52-F145 HydrophobicContact CB-CG 4.18Å; P52-F145 HydrophobicContact CG-CB 3.35Å; P52-F145 HydrophobicContact CG-CD1 3.79Å; P52-F145 HydrophobicContact CG-CD2 4.34Å; P52-F145 HydrophobicContact CG-CG 3.57Å; K141-F145 PolarHBondContact O-N 3.13Å; L142-F145 PolarHBondContact O-N 2.92Å; M143-F145 VanDerWaalsContact C-N 3.28Å; M143-F145 PolarHBondContact O-N 3.38Å; F145-Q147 VanDerWaalsContact C-N 3.25Å; F145-Q147 PolarHBondContact O-N 3.19Å; F145-K148 PolarHBondContact O-N 3.21Å; F145-K149 HydrophobicContact CE1-CB 4.41Å; F145-K149 HydrophobicContact CE1-CG 4.5Å; F145-K149 HydrophobicContact CE2-CB 4.44Å; F145-K149 HydrophobicContact CZ-CB 4.32Å; F145-K149 HydrophobicContact CZ-CD 4.47Å; F145-K149 HydrophobicContact CZ-CG 4.21Å; F145-K149 WeakPolarHBondContact O-CB 3.33Å; F145-K149 PolarHBondContact O-N 2.68Å |
| 146 | I | 85 | Confident | 80.7 | Confident | 18 Ų | 18 | 45.9 Ų | 45.9 | 9% | 0.092 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -56 | -47.6 | 177.2 | -70.6 | 167.5 | 0 | 0 | 0 | 109.3 | L123 L142 M143 K149 F150 C183 L187 | L123-I146 HydrophobicContact CD2-CD1 4.41Å; L142-I146 HydrophobicContact CD1-CD1 4.21Å; L142-I146 HydrophobicContact CG-CD1 4.02Å; L142-I146 VanDerWaalsContact O-CG1 3.3Å; L142-I146 WeakPolarHBondContact O-CG1 3.33Å; L142-I146 PolarHBondContact O-N 2.87Å; M143-I146 PolarHBondContact O-N 3.32Å; I146-K149 PolarHBondContact O-N 3.28Å; I146-F150 HydrophobicContact CG2-CD2 4.2Å; I146-F150 WeakPolarHBondContact O-CB 3.5Å; I146-F150 WeakPolarHBondContact O-CD2 3.26Å; I146-F150 PolarHBondContact O-N 2.84Å; I146-C183 HydrophobicContact CG2-CB 4.23Å; I146-L187 HydrophobicContact CG2-CD1 3.76Å; I146-L187 HydrophobicContact CG2-CD2 4.44Å |
| 147 | Q | 86.8 | Confident | 81.8 | Confident | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -64.9 | -44.5 | -179 | -70.3 | 177.2 | -18.3 | 0 | 0 | 112.7 | M143 F145 G151 C152 G154 Y161 S169 C170 | M143-Q147 HydrophobicContact CG-CG 4.34Å; M143-Q147 WeakPolarHBondContact O-CB 3.19Å; M143-Q147 VanDerWaalsContact O-CG 3.24Å; M143-Q147 WeakPolarHBondContact O-CG 3.5Å; M143-Q147 PolarHBondContact O-N 3.44Å; M143-Q147 HydrophobicContact SD-CG 4.18Å; F145-Q147 VanDerWaalsContact C-N 3.25Å; F145-Q147 PolarHBondContact O-N 3.19Å; Q147-G151 VanDerWaalsContact O-CA 3.22Å; Q147-G151 WeakPolarHBondContact O-CA 3.45Å; Q147-G151 PolarHBondContact O-N 3.46Å; Q147-C152 WeakPolarHBondContact CA-O 3.43Å; Q147-C152 VanDerWaalsContact CB-O 3.3Å; Q147-C152 WeakPolarHBondContact CB-O 3.34Å; Q147-C152 WeakPolarHBondContact CG-O 3.47Å; Q147-C152 PolarHBondContact O-N 3.47Å; Q147-G154 VanDerWaalsContact NE2-N 3.15Å; Q147-Y161 PolarHBondContact NE2-OH 2.94Å; Q147-S169 PolarHBondContact OE1-OG 3.12Å; Q147-C170 VanDerWaalsContact CD-SG 3.56Å; Q147-C170 PolarHBondContact OE1-SG 3.38Å; Q147-C170 VanDerWaalsContact OE1-SG 3.37Å |
| 148 | K | 82.8 | Confident | 82.6 | Confident | 129 Ų | 129 | 37.9 Ų | 37.9 | 56% | 0.561 | 20% | 0.195 | S | C | * | . | H | α-helix | trans | -67.7 | -39.6 | 175.8 | -74.1 | 172.1 | -177.1 | 169.9 | 0 | 112.7 | D144 F145 | D144-K148 WeakPolarHBondContact O-CB 3.2Å; D144-K148 VanDerWaalsContact O-CG 3.23Å; D144-K148 WeakPolarHBondContact O-CG 3.44Å; D144-K148 PolarHBondContact O-N 3.1Å; F145-K148 PolarHBondContact O-N 3.21Å |
| 149 | K | 83.3 | Confident | 83.4 | Confident | 136 Ų | 136 | 39.3 Ų | 39.3 | 59% | 0.591 | 21% | 0.214 | S | C | * | . | H | α-helix | trans | -73.6 | -41.7 | -174.6 | -176.7 | 64.3 | 178.8 | -174.9 | 0 | 112 | F145 I146 | F145-K149 HydrophobicContact CE1-CB 4.41Å; F145-K149 HydrophobicContact CE1-CG 4.5Å; F145-K149 HydrophobicContact CE2-CB 4.44Å; F145-K149 HydrophobicContact CZ-CB 4.32Å; F145-K149 HydrophobicContact CZ-CD 4.47Å; F145-K149 HydrophobicContact CZ-CG 4.21Å; F145-K149 WeakPolarHBondContact O-CB 3.33Å; F145-K149 PolarHBondContact O-N 2.68Å; I146-K149 PolarHBondContact O-N 3.28Å |
| 150 | F | 85 | Confident | 84.3 | Confident | 86 Ų | 86 | 40.2 Ų | 40.2 | 38% | 0.377 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -100.1 | -7.5 | -177 | -68 | -78.2 | 0 | 0 | 0 | 113.6 | I146 C152 V186 L187 A190 | I146-F150 HydrophobicContact CG2-CD2 4.2Å; I146-F150 WeakPolarHBondContact O-CB 3.5Å; I146-F150 WeakPolarHBondContact O-CD2 3.26Å; I146-F150 PolarHBondContact O-N 2.84Å; F150-C152 VanDerWaalsContact C-N 3.32Å; F150-C152 PolarHBondContact O-N 2.92Å; F150-V186 HydrophobicContact CB-CG1 3.88Å; F150-V186 HydrophobicContact CD1-CG1 4.43Å; F150-L187 HydrophobicContact CB-CD1 4.38Å; F150-L187 HydrophobicContact CD2-CD1 3.87Å; F150-L187 HydrophobicContact CE2-CD1 4.3Å; F150-L187 HydrophobicContact CG-CD1 4.04Å; F150-A190 HydrophobicContact CD1-CB 4.12Å; F150-A190 HydrophobicContact CE1-CB 3.74Å |
| 151 | G | 84.4 | Confident | 84.7 | Confident | 19 Ų | 19 | 40.3 Ų | 40.3 | 20% | 0.196 | 22% | 0.217 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 65.3 | 35 | 179.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | Q147 S178 | Q147-G151 VanDerWaalsContact O-CA 3.22Å; Q147-G151 WeakPolarHBondContact O-CA 3.45Å; Q147-G151 PolarHBondContact O-N 3.46Å; G151-S178 VanDerWaalsContact O-O 3.05Å |
| 152 | C | 88.6 | Confident | 84.9 | Confident | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 22% | 0.224 | C | C | . | . | trans | -115.6 | 166 | -178.4 | 62.5 | 0 | 0 | 0 | 0 | 110.8 | Q147 F150 C183 V186 | Q147-C152 WeakPolarHBondContact CA-O 3.43Å; Q147-C152 VanDerWaalsContact CB-O 3.3Å; Q147-C152 WeakPolarHBondContact CB-O 3.34Å; Q147-C152 WeakPolarHBondContact CG-O 3.47Å; Q147-C152 PolarHBondContact O-N 3.47Å; F150-C152 VanDerWaalsContact C-N 3.32Å; F150-C152 PolarHBondContact O-N 2.92Å; C152-C183 VanDerWaalsContact C-SG 3.52Å; C152-C183 HydrophobicContact CB-CB 3.87Å; C152-C183 WeakPolarHBondContact CB-SG 2.93Å; C152-C183 WeakPolarHBondContact SG-CA 3.42Å; C152-C183 WeakPolarHBondContact SG-CB 3.22Å; C152-C183 CovalentContact SG-SG 2.04Å; C152-C183 PolarHBondContact SG-SG 2.98Å; C152-V186 HydrophobicContact CB-CB 4.14Å; C152-V186 HydrophobicContact CB-CG2 3.99Å | ||
| 153 | C | 89.2 | Confident | 84.7 | Confident | 0 Ų | 0 | 43.8 Ų | 43.8 | 0% | 0 | 26% | 0.256 | C | S | . | . | trans | -140.6 | 136.6 | 174.8 | -169.2 | 0 | 0 | 0 | 0 | 112.2 | S157 A158 C170 Y179 R181 | C153-S157 CarbonylContact O-C 3.24Å; C153-S157 VanDerWaalsContact O-C 3.24Å; C153-S157 WeakPolarHBondContact O-CA 3.06Å; C153-A158 HydrophobicContact CB-CB 4.27Å; C153-A158 VanDerWaalsContact SG-CB 3.6Å; C153-C170 HydrophobicContact CB-CB 3.82Å; C153-C170 WeakPolarHBondContact CB-SG 3.5Å; C153-C170 WeakPolarHBondContact SG-CB 3.4Å; C153-C170 CovalentContact SG-SG 2.04Å; C153-C170 PolarHBondContact SG-SG 3.48Å; C153-Y179 HydrophobicContact CB-CD1 4.08Å; C153-R181 PolarHBondContact N-O 3.32Å | ||
| 154 | G | 87.6 | Confident | 84.2 | Confident | 0 Ų | 0 | 50.1 Ų | 50.1 | 0% | 0 | 28% | 0.28 | C | S | . | . | S | Bend | trans | 63.1 | -164.9 | -176.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | Q147 S157 C183 | Q147-G154 VanDerWaalsContact NE2-N 3.15Å; G154-S157 WeakPolarHBondContact CA-O 3.42Å; G154-C183 WeakPolarHBondContact O-CB 3.37Å; G154-C183 PolarHBondContact O-N 3.06Å; G154-C183 PolarHBondContact O-SG 3.36Å; G154-C183 VanDerWaalsContact O-SG 3.4Å |
| 155 | V | 90.2 | Very high | 83.8 | Confident | 4 Ų | 4 | 53.7 Ų | 53.7 | 2% | 0.024 | 31% | 0.307 | C | S | . | . | S | Bend | trans | -79.8 | -56.6 | 176.2 | -170.8 | 0 | 0 | 0 | 0 | 109.6 | Y120 L123 E124 V127 D160 G182 C183 H184 | Y120-V155 HydrophobicContact CD1-CG1 4.44Å; Y120-V155 HydrophobicContact CD2-CG1 3.58Å; Y120-V155 HydrophobicContact CE1-CG1 4.38Å; Y120-V155 HydrophobicContact CE2-CG1 3.53Å; Y120-V155 HydrophobicContact CG-CG1 4.05Å; L123-V155 HydrophobicContact CB-CG1 4.07Å; L123-V155 HydrophobicContact CB-CG2 4.2Å; E124-V155 HydrophobicContact CB-CG2 4.17Å; V127-V155 HydrophobicContact CB-CG2 4.17Å; V127-V155 HydrophobicContact CG2-CG2 3.71Å; V155-D160 WeakPolarHBondContact CA-OD2 3.42Å; V155-D160 WeakPolarHBondContact CB-OD2 3.07Å; V155-D160 PolarHBondContact N-OD2 2.99Å; V155-G182 CarbonylContact O-C 3.25Å; V155-G182 VanDerWaalsContact O-C 3.25Å; V155-G182 WeakPolarHBondContact O-CA 3.45Å; V155-C183 PolarHBondContact O-N 2.79Å; V155-C183 VanDerWaalsContact O-N 3.15Å; V155-H184 HydrophobicContact CG1-CB 4.14Å; V155-H184 WeakPolarHBondContact O-CB 3.48Å; V155-H184 PolarHBondContact O-N 3.42Å |
| 156 | T | 89.2 | Confident | 83.6 | Confident | 66 Ų | 66 | 53.7 Ų | 53.7 | 41% | 0.405 | 31% | 0.313 | S | S | . | . | S | Bend | trans | -107.4 | -33.4 | 177.6 | 67.3 | 0 | 0 | 0 | 0 | 111.9 | Y120 D160 G182 | Y120-T156 HydrophobicContact CE2-CG2 3.57Å; T156-D160 PolarHBondContact N-OD2 2.78Å; T156-D160 PolarHBondContact OG1-OD1 3.29Å; T156-D160 PolarHBondContact OG1-OD2 3.29Å; T156-G182 WeakPolarHBondContact O-CA 3.4Å; T156-G182 PolarHBondContact O-N 3.39Å |
| 157 | S | 86 | Confident | 83.3 | Confident | 36 Ų | 36 | 53.2 Ų | 53.2 | 25% | 0.252 | 31% | 0.311 | S | S | . | . | S | Bend | trans | -166.7 | 171.5 | 179.4 | 69.2 | 0 | 0 | 0 | 0 | 112 | C153 G154 A159 D160 | C153-S157 CarbonylContact O-C 3.24Å; C153-S157 VanDerWaalsContact O-C 3.24Å; C153-S157 WeakPolarHBondContact O-CA 3.06Å; G154-S157 WeakPolarHBondContact CA-O 3.42Å; S157-A159 PolarHBondContact O-N 3.41Å; S157-A159 WeakPolarHBondContact OG-CB 3.33Å; S157-A159 PolarHBondContact OG-N 2.82Å; S157-D160 PolarHBondContact N-OD2 3.18Å; S157-D160 WeakPolarHBondContact O-CB 3.01Å; S157-D160 VanDerWaalsContact O-CG 3.28Å; S157-D160 PolarHBondContact O-N 2.85Å; S157-D160 VanDerWaalsContact O-N 3.1Å |
| 158 | A | 84.1 | Confident | 83 | Confident | 36 Ų | 36 | 61.5 Ų | 61.5 | 30% | 0.298 | 35% | 0.347 | S | S | . | . | G | 310 helix | trans | -57.5 | -19 | 172.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | C153 D160 P166 | C153-A158 HydrophobicContact CB-CB 4.27Å; C153-A158 VanDerWaalsContact SG-CB 3.6Å; A158-D160 PolarHBondContact O-N 3.01Å; A158-P166 HydrophobicContact CB-CB 4.37Å |
| 159 | A | 84.2 | Confident | 82.8 | Confident | 74 Ų | 74 | 55.4 Ų | 55.4 | 61% | 0.612 | 32% | 0.32 | S | S | * | . | G | 310 helix | trans | -69.6 | -17 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | S157 Y161 G162 | S157-A159 PolarHBondContact O-N 3.41Å; S157-A159 WeakPolarHBondContact OG-CB 3.33Å; S157-A159 PolarHBondContact OG-N 2.82Å; A159-Y161 PolarHBondContact O-N 2.7Å; A159-G162 WeakPolarHBondContact O-CA 3.06Å; A159-G162 PolarHBondContact O-N 3.39Å |
| 160 | D | 85.7 | Confident | 82.6 | Confident | 39 Ų | 39 | 49.2 Ų | 49.2 | 21% | 0.209 | 30% | 0.295 | C | S | . | . | G | 310 helix | trans | -65.1 | -21 | 179.9 | -60.6 | -36.3 | 0 | 0 | 0 | 112.8 | V127 R131 V155 T156 S157 A158 G162 | V127-D160 HydrophobicContact CG1-CB 4.17Å; R131-D160 PolarHBondContact NH1-O 2.87Å; V155-D160 WeakPolarHBondContact CA-OD2 3.42Å; V155-D160 WeakPolarHBondContact CB-OD2 3.07Å; V155-D160 PolarHBondContact N-OD2 2.99Å; T156-D160 PolarHBondContact N-OD2 2.78Å; T156-D160 PolarHBondContact OG1-OD1 3.29Å; T156-D160 PolarHBondContact OG1-OD2 3.29Å; S157-D160 PolarHBondContact N-OD2 3.18Å; S157-D160 WeakPolarHBondContact O-CB 3.01Å; S157-D160 VanDerWaalsContact O-CG 3.28Å; S157-D160 PolarHBondContact O-N 2.85Å; S157-D160 VanDerWaalsContact O-N 3.1Å; A158-D160 PolarHBondContact O-N 3.01Å; D160-G162 PolarHBondContact O-N 2.77Å |
| 161 | Y | 83 | Confident | 81.9 | Confident | 2 Ų | 2 | 49.9 Ų | 49.9 | 1% | 0.008 | 31% | 0.306 | C | S | . | . | G | 310 helix | trans | -70.8 | -7.8 | 171.1 | -70.8 | -71.5 | 0 | 0 | 0 | 113.6 | V127 Y130 R131 M143 Q147 A159 T163 R164 P166 P167 | V127-Y161 HydrophobicContact CG1-CD1 4.09Å; V127-Y161 HydrophobicContact CG1-CE1 3.99Å; Y130-Y161 HydrophobicContact CD1-CD1 4.18Å; Y130-Y161 AromaticContact CD1-CE1 3.6Å; Y130-Y161 HydrophobicContact CD1-CE1 3.6Å; Y130-Y161 HydrophobicContact CE1-CE1 4.21Å; Y130-Y161 AromaticContact CG-CE1 3.85Å; Y130-Y161 HydrophobicContact CG-CE1 3.85Å; R131-Y161 HydrophobicContact CG-CD1 4.2Å; R131-Y161 PolarHBondContact NE-O 2.85Å; M143-Y161 WeakPolarHBondContact CG-OH 3.47Å; Q147-Y161 PolarHBondContact NE2-OH 2.94Å; A159-Y161 PolarHBondContact O-N 2.7Å; Y161-T163 PolarHBondContact O-N 2.89Å; Y161-R164 PolarHBondContact O-N 2.94Å; Y161-P166 HydrophobicContact CD2-CB 4.08Å; Y161-P167 HydrophobicContact CE1-CG 4.28Å; Y161-P167 VanDerWaalsContact CE2-CD 3.42Å; Y161-P167 HydrophobicContact CE2-CG 4.04Å; Y161-P167 VanDerWaalsContact CZ-CD 3.47Å |
| 162 | G | 81.5 | Confident | 80.6 | Confident | 45 Ų | 45 | 52.6 Ų | 52.6 | 46% | 0.464 | 32% | 0.318 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 61.6 | -122.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | A159 D160 R164 | A159-G162 WeakPolarHBondContact O-CA 3.06Å; A159-G162 PolarHBondContact O-N 3.39Å; D160-G162 PolarHBondContact O-N 2.77Å; G162-R164 VanDerWaalsContact C-N 3.35Å |
| 163 | T | 74 | Confident | 78.9 | Confident | 141 Ų | 141 | 58.7 Ų | 58.7 | 87% | 0.865 | 36% | 0.356 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.6 | -13.7 | -177.9 | 52.7 | 0 | 0 | 0 | 0 | 114 | Y161 | Y161-T163 PolarHBondContact O-N 2.89Š|
| 164 | R | 72.9 | Confident | 77 | Confident | 133 Ų | 133 | 66.3 Ų | 66.3 | 50% | 0.502 | 39% | 0.389 | S | S | . | . | S | Bend | trans | -82.9 | 139.7 | 174.5 | -74.2 | -169.5 | 175.8 | -171.1 | 4.1 | 109.4 | R131 Y161 G162 | R131-R164 PolarHBondContact O-NE 3.33Å; R131-R164 PolarHBondContact O-NH1 2.98Å; R131-R164 PolarHBondContact O-NH2 3.33Å; R131-R164 VanDerWaalsContact O-NH2 3.13Å; Y161-R164 PolarHBondContact O-N 2.94Å; G162-R164 VanDerWaalsContact C-N 3.35Å |
| 165 | S | 74 | Confident | 75.2 | Confident | 110 Ų | 110 | 70.2 Ų | 70.2 | 77% | 0.769 | 42% | 0.416 | S | S | * | . | P | Polyproline II helix | trans | -58.2 | 138.5 | 171.3 | -54.7 | 0 | 0 | 0 | 0 | 109.7 | ||
| 166 | P | 77.7 | Confident | 73.4 | Confident | 53 Ų | 53 | 78.4 Ų | 78.4 | 34% | 0.344 | 46% | 0.458 | S | S | . | . | P | Polyproline II helix | trans | -58.6 | 149.5 | 177.4 | 25.1 | -33.7 | 0 | 0 | 0 | 110 | A158 Y161 C170 | A158-P166 HydrophobicContact CB-CB 4.37Å; Y161-P166 HydrophobicContact CD2-CB 4.08Å; P166-C170 HydrophobicContact CB-CB 4.19Å |
| 167 | P | 79.9 | Confident | 71.6 | Confident | 9 Ų | 9 | 83.5 Ų | 83.5 | 6% | 0.058 | 48% | 0.477 | C | S | . | . | P | Polyproline II helix | trans | -65.4 | 160.6 | -174.5 | 29.8 | -37.6 | 0 | 0 | 0 | 112.4 | Y130 Y161 S169 C170 T171 | Y130-P167 HydrophobicContact CE1-CB 3.91Å; Y130-P167 HydrophobicContact CE1-CG 4.31Å; Y130-P167 HydrophobicContact CE2-CB 4.32Å; Y130-P167 HydrophobicContact CE2-CG 4.49Å; Y130-P167 WeakPolarHBondContact OH-CB 3.26Å; Y161-P167 HydrophobicContact CE1-CG 4.28Å; Y161-P167 VanDerWaalsContact CE2-CD 3.42Å; Y161-P167 HydrophobicContact CE2-CG 4.04Å; Y161-P167 VanDerWaalsContact CZ-CD 3.47Å; P167-S169 WeakPolarHBondContact CB-OG 3.34Å; P167-S169 VanDerWaalsContact CG-OG 3.25Å; P167-S169 WeakPolarHBondContact CG-OG 3.2Å; P167-S169 PolarHBondContact O-N 3.05Å; P167-S169 VanDerWaalsContact O-N 3.13Å; P167-C170 WeakPolarHBondContact O-CB 3.38Å; P167-C170 PolarHBondContact O-N 3.44Å; P167-T171 PolarHBondContact O-OG1 2.04Å |
| 168 | K | 79.1 | Confident | 69.9 | Low | 174 Ų | 174 | 84.3 Ų | 84.3 | 76% | 0.757 | 48% | 0.483 | S | S | * | . | G | 310 helix | trans | -57.7 | -29 | 178.5 | -70.6 | -176.6 | -179.6 | 176.7 | 0 | 112.1 | C170 T171 V172 | K168-C170 PolarHBondContact O-N 3.36Å; K168-T171 VanDerWaalsContact CA-OG1 3.31Å; K168-T171 WeakPolarHBondContact CA-OG1 3.2Å; K168-T171 PolarHBondContact O-N 3.17Å; K168-T171 PolarHBondContact O-OG1 3.03Å; K168-V172 WeakPolarHBondContact O-CG2 3.23Å |
| 169 | S | 78.9 | Confident | 68.6 | Low | 0 Ų | 0 | 84.5 Ų | 84.5 | 0% | 0 | 48% | 0.476 | C | S | . | . | G | 310 helix | trans | -57.7 | -27.7 | 172.5 | 45.7 | 0 | 0 | 0 | 0 | 114 | D144 Q147 P167 | D144-S169 VanDerWaalsContact OD1-CB 3.23Å; D144-S169 WeakPolarHBondContact OD1-CB 3.25Å; D144-S169 PolarHBondContact OD1-OG 3.49Å; Q147-S169 PolarHBondContact OE1-OG 3.12Å; P167-S169 WeakPolarHBondContact CB-OG 3.34Å; P167-S169 VanDerWaalsContact CG-OG 3.25Å; P167-S169 WeakPolarHBondContact CG-OG 3.2Å; P167-S169 PolarHBondContact O-N 3.05Å; P167-S169 VanDerWaalsContact O-N 3.13Å |
| 170 | C | 79.7 | Confident | 67.6 | Low | 7 Ų | 7 | 85.4 Ų | 85.4 | 5% | 0.047 | 48% | 0.478 | C | S | . | . | G | 310 helix | trans | -82.6 | -10.1 | 172.2 | -66.9 | 0 | 0 | 0 | 0 | 114.2 | Q147 C153 P166 P167 K168 Y179 | Q147-C170 VanDerWaalsContact CD-SG 3.56Å; Q147-C170 PolarHBondContact OE1-SG 3.38Å; Q147-C170 VanDerWaalsContact OE1-SG 3.37Å; C153-C170 HydrophobicContact CB-CB 3.82Å; C153-C170 WeakPolarHBondContact CB-SG 3.5Å; C153-C170 WeakPolarHBondContact SG-CB 3.4Å; C153-C170 CovalentContact SG-SG 2.04Å; C153-C170 PolarHBondContact SG-SG 3.48Å; P166-C170 HydrophobicContact CB-CB 4.19Å; P167-C170 WeakPolarHBondContact O-CB 3.38Å; P167-C170 PolarHBondContact O-N 3.44Å; K168-C170 PolarHBondContact O-N 3.36Å; C170-Y179 HydrophobicContact CB-CD1 4.42Å; C170-Y179 VanDerWaalsContact O-CD1 3.29Å; C170-Y179 WeakPolarHBondContact O-CD1 3.43Å; C170-Y179 VanDerWaalsContact O-CD2 3.27Å; C170-Y179 WeakPolarHBondContact O-CD2 3.15Å; C170-Y179 WeakPolarHBondContact O-CE1 3.17Å; C170-Y179 WeakPolarHBondContact O-CE2 3.26Å |
| 171 | T | 69.7 | Low | 67.5 | Low | 100 Ų | 100 | 90.8 Ų | 90.8 | 61% | 0.613 | 50% | 0.495 | S | S | * | . | S | Bend | trans | -117.3 | 6.9 | -168.3 | 23.1 | 0 | 0 | 0 | 0 | 114.8 | P167 K168 | P167-T171 PolarHBondContact O-OG1 2.04Å; K168-T171 VanDerWaalsContact CA-OG1 3.31Å; K168-T171 WeakPolarHBondContact CA-OG1 3.2Å; K168-T171 PolarHBondContact O-N 3.17Å; K168-T171 PolarHBondContact O-OG1 3.03Å |
| 172 | V | 58.4 | Low | 67.8 | Low | 76 Ų | 76 | 90.8 Ų | 90.8 | 46% | 0.461 | 50% | 0.496 | S | S | . | . | S | Bend | trans | -100.8 | 100.9 | -171.9 | 174.2 | 0 | 0 | 0 | 0 | 112.5 | K168 Y179 | K168-V172 WeakPolarHBondContact O-CG2 3.23Å; V172-Y179 PolarHBondContact O-OH 3.43Å |
| 173 | T | 51.4 | Low | 68.2 | Low | 128 Ų | 128 | 88.6 Ų | 88.6 | 79% | 0.785 | 47% | 0.474 | S | S | * | . | S | Bend | trans | 70.4 | 27.4 | 146.9 | 51.6 | 0 | 0 | 0 | 0 | 121.9 | ||
| 174 | K | 50.9 | Low | 69.1 | Low | 159 Ų | 159 | 83.9 Ų | 83.9 | 69% | 0.691 | 44% | 0.442 | S | S | * | . | S | Bend | trans | -145.2 | 114.8 | 154.6 | -72 | -167.9 | 178 | 176.9 | 0 | 110.1 | ||
| 175 | S | 49.9 | Very low | 69.9 | Low | 83 Ų | 83 | 82.8 Ų | 82.8 | 58% | 0.58 | 44% | 0.442 | S | S | * | . | trans | 24.3 | 124 | 164.6 | 54.7 | 0 | 0 | 0 | 0 | 117.5 | Q177 S178 | S175-Q177 PolarHBondContact O-N 2.88Å; S175-S178 PolarHBondContact O-N 3.44Å | ||
| 176 | I | 51.8 | Low | 70.7 | Confident | 176 Ų | 176 | 79 Ų | 79 | 90% | 0.903 | 41% | 0.414 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -39.3 | -23.3 | 176.5 | -66.1 | 161.5 | 0 | 0 | 0 | 115.3 | ||
| 177 | Q | 50.5 | Low | 71.3 | Confident | 172 Ų | 172 | 77.4 Ų | 77.4 | 80% | 0.804 | 40% | 0.403 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.6 | -25.8 | 173.6 | -84.4 | 175.3 | -30.5 | 0 | 0 | 116.3 | S175 Y179 | S175-Q177 PolarHBondContact O-N 2.88Å; Q177-Y179 PolarHBondContact O-N 3.3Å |
| 178 | S | 51.4 | Low | 71.7 | Confident | 53 Ų | 53 | 78 Ų | 78 | 37% | 0.371 | 41% | 0.407 | S | S | . | . | G | 310 helix | trans | -73.2 | -28.6 | -171.6 | -134.1 | 0 | 0 | 0 | 0 | 113 | G151 S175 S180 | G151-S178 VanDerWaalsContact O-O 3.05Å; S175-S178 PolarHBondContact O-N 3.44Å; S178-S180 PolarHBondContact O-N 3.25Å |
| 179 | Y | 56.5 | Low | 72.2 | Confident | 41 Ų | 41 | 75 Ų | 75 | 16% | 0.161 | 40% | 0.395 | C | S | . | . | G | 310 helix | trans | -95.8 | 15 | -174.9 | -61.3 | -78.1 | 0 | 0 | 0 | 114.1 | C153 C170 V172 Q177 R181 | C153-Y179 HydrophobicContact CB-CD1 4.08Å; C170-Y179 HydrophobicContact CB-CD1 4.42Å; C170-Y179 VanDerWaalsContact O-CD1 3.29Å; C170-Y179 WeakPolarHBondContact O-CD1 3.43Å; C170-Y179 VanDerWaalsContact O-CD2 3.27Å; C170-Y179 WeakPolarHBondContact O-CD2 3.15Å; C170-Y179 WeakPolarHBondContact O-CE1 3.17Å; C170-Y179 WeakPolarHBondContact O-CE2 3.26Å; V172-Y179 PolarHBondContact O-OH 3.43Å; Q177-Y179 PolarHBondContact O-N 3.3Å; Y179-R181 VanDerWaalsContact C-N 3.31Å |
| 180 | S | 63.5 | Low | 72.7 | Confident | 93 Ų | 93 | 75.9 Ų | 75.9 | 65% | 0.65 | 40% | 0.402 | S | S | * | . | G | 310 helix | trans | -78.1 | -16.4 | 169.9 | -171.4 | 0 | 0 | 0 | 0 | 112.7 | S178 | S178-S180 PolarHBondContact O-N 3.25Š|
| 181 | R | 84 | Confident | 73 | Confident | 151 Ų | 151 | 78.6 Ų | 78.6 | 57% | 0.57 | 42% | 0.421 | S | S | * | . | S | Bend | trans | -98.1 | 134.8 | -178.5 | -64.5 | -168.4 | -177.4 | 177.6 | -0.3 | 111.7 | C153 Y179 V186 | C153-R181 PolarHBondContact N-O 3.32Å; Y179-R181 VanDerWaalsContact C-N 3.31Å; R181-V186 HydrophobicContact CB-CG2 3.85Å |
| 182 | G | 88.7 | Confident | 73.8 | Confident | 2 Ų | 2 | 81.4 Ų | 81.4 | 2% | 0.021 | 42% | 0.42 | C | S | . | . | trans | -67.6 | 147.6 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | V155 T156 H184 E185 V186 | V155-G182 CarbonylContact O-C 3.25Å; V155-G182 VanDerWaalsContact O-C 3.25Å; V155-G182 WeakPolarHBondContact O-CA 3.45Å; T156-G182 WeakPolarHBondContact O-CA 3.4Å; T156-G182 PolarHBondContact O-N 3.39Å; G182-H184 PolarHBondContact O-N 2.8Å; G182-E185 PolarHBondContact O-N 3.44Å; G182-V186 WeakPolarHBondContact O-CG2 3.29Å; G182-V186 PolarHBondContact O-N 3.12Å | ||
| 183 | C | 90.4 | Very high | 75.3 | Confident | 0 Ų | 0 | 81.4 Ų | 81.4 | 0% | 0 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -63.1 | -25.9 | 176.8 | -68.2 | 0 | 0 | 0 | 0 | 112.8 | L123 I146 C152 G154 V155 L187 | L123-C183 HydrophobicContact CD1-CB 4.24Å; I146-C183 HydrophobicContact CG2-CB 4.23Å; C152-C183 VanDerWaalsContact C-SG 3.52Å; C152-C183 HydrophobicContact CB-CB 3.87Å; C152-C183 WeakPolarHBondContact CB-SG 2.93Å; C152-C183 WeakPolarHBondContact SG-CA 3.42Å; C152-C183 WeakPolarHBondContact SG-CB 3.22Å; C152-C183 CovalentContact SG-SG 2.04Å; C152-C183 PolarHBondContact SG-SG 2.98Å; G154-C183 WeakPolarHBondContact O-CB 3.37Å; G154-C183 PolarHBondContact O-N 3.06Å; G154-C183 PolarHBondContact O-SG 3.36Å; G154-C183 VanDerWaalsContact O-SG 3.4Å; V155-C183 PolarHBondContact O-N 2.79Å; V155-C183 VanDerWaalsContact O-N 3.15Å; C183-L187 HydrophobicContact CB-CD1 4.13Å; C183-L187 VanDerWaalsContact O-CB 3.25Å; C183-L187 WeakPolarHBondContact O-CB 3.27Å; C183-L187 WeakPolarHBondContact O-CD1 3.23Å; C183-L187 PolarHBondContact O-N 3.12Å |
| 184 | H | 92 | Very high | 77.2 | Confident | 41 Ų | 41 | 79 Ų | 79 | 19% | 0.19 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -59.4 | -53.4 | 176 | 173.8 | -102.5 | 0 | 0 | 0 | 112.2 | N116 Y120 L123 V155 G182 L187 V188 | N116-H184 PolarHBondContact O-NE2 3.17Å; Y120-H184 HydrophobicContact CD2-CB 4.39Å; Y120-H184 PolarHBondContact N-CD2 2.91Å; L123-H184 HydrophobicContact CD1-CB 4Å; V155-H184 HydrophobicContact CG1-CB 4.14Å; V155-H184 WeakPolarHBondContact O-CB 3.48Å; V155-H184 PolarHBondContact O-N 3.42Å; G182-H184 PolarHBondContact O-N 2.8Å; H184-L187 PolarHBondContact O-N 3.48Å; H184-V188 VanDerWaalsContact O-CG2 3.26Å; H184-V188 WeakPolarHBondContact O-CG2 3.37Å; H184-V188 PolarHBondContact O-N 3.23Å |
| 185 | E | 90.4 | Very high | 78.9 | Confident | 110 Ų | 110 | 76 Ų | 76 | 51% | 0.514 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -64.1 | -45.9 | -179.1 | -172.4 | -173.4 | 165.2 | 0 | 0 | 110.8 | G182 L187 V188 E189 | G182-E185 PolarHBondContact O-N 3.44Å; E185-L187 PolarHBondContact O-N 3.26Å; E185-V188 PolarHBondContact O-N 2.96Å; E185-E189 WeakPolarHBondContact O-CB 3.4Å; E185-E189 PolarHBondContact O-N 3.27Å |
| 186 | V | 90.3 | Very high | 80.8 | Confident | 30 Ų | 30 | 76.7 Ų | 76.7 | 18% | 0.182 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -64.1 | -39.9 | -179.2 | 179.6 | 0 | 0 | 0 | 0 | 111.6 | F150 C152 R181 G182 A190 | F150-V186 HydrophobicContact CB-CG1 3.88Å; F150-V186 HydrophobicContact CD1-CG1 4.43Å; C152-V186 HydrophobicContact CB-CB 4.14Å; C152-V186 HydrophobicContact CB-CG2 3.99Å; R181-V186 HydrophobicContact CB-CG2 3.85Å; G182-V186 WeakPolarHBondContact O-CG2 3.29Å; G182-V186 PolarHBondContact O-N 3.12Å; V186-A190 WeakPolarHBondContact O-CB 3.24Å; V186-A190 PolarHBondContact O-N 3.45Å |
| 187 | L | 89.6 | Confident | 82.8 | Confident | 20 Ų | 20 | 72.7 Ų | 72.7 | 11% | 0.105 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -69.1 | -41 | 177.1 | -92.8 | 69.8 | 0 | 0 | 0 | 111.8 | M119 I146 F150 C183 H184 E185 E189 A190 C191 | M119-L187 HydrophobicContact SD-CD2 4.08Å; I146-L187 HydrophobicContact CG2-CD1 3.76Å; I146-L187 HydrophobicContact CG2-CD2 4.44Å; F150-L187 HydrophobicContact CB-CD1 4.38Å; F150-L187 HydrophobicContact CD2-CD1 3.87Å; F150-L187 HydrophobicContact CE2-CD1 4.3Å; F150-L187 HydrophobicContact CG-CD1 4.04Å; C183-L187 HydrophobicContact CB-CD1 4.13Å; C183-L187 VanDerWaalsContact O-CB 3.25Å; C183-L187 WeakPolarHBondContact O-CB 3.27Å; C183-L187 WeakPolarHBondContact O-CD1 3.23Å; C183-L187 PolarHBondContact O-N 3.12Å; H184-L187 PolarHBondContact O-N 3.48Å; E185-L187 PolarHBondContact O-N 3.26Å; L187-E189 VanDerWaalsContact C-N 3.32Å; L187-A190 PolarHBondContact O-N 3.15Å; L187-C191 WeakPolarHBondContact O-CB 3.3Å; L187-C191 PolarHBondContact O-N 2.83Å; L187-C191 PolarHBondContact O-SG 3.33Å |
| 188 | V | 88.7 | Confident | 84.7 | Confident | 23 Ų | 23 | 69.3 Ų | 69.3 | 14% | 0.139 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -62.5 | -43.3 | 176.4 | 170.7 | 0 | 0 | 0 | 0 | 110.3 | N116 H184 E185 C191 R192 | N116-V188 WeakPolarHBondContact OD1-CG1 3.3Å; N116-V188 WeakPolarHBondContact OD1-CG2 3.41Å; H184-V188 VanDerWaalsContact O-CG2 3.26Å; H184-V188 WeakPolarHBondContact O-CG2 3.37Å; H184-V188 PolarHBondContact O-N 3.23Å; E185-V188 PolarHBondContact O-N 2.96Å; V188-C191 PolarHBondContact O-N 2.92Å; V188-R192 WeakPolarHBondContact O-CG 3.34Å; V188-R192 PolarHBondContact O-N 3.38Å |
| 189 | E | 90.3 | Very high | 86.6 | Confident | 111 Ų | 111 | 69.7 Ų | 69.7 | 52% | 0.519 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -67.7 | -39.4 | 176.8 | -168.8 | 56.9 | -147.5 | 0 | 0 | 112 | E185 L187 C191 R192 S193 | E185-E189 WeakPolarHBondContact O-CB 3.4Å; E185-E189 PolarHBondContact O-N 3.27Å; L187-E189 VanDerWaalsContact C-N 3.32Å; E189-C191 PolarHBondContact O-N 3Å; E189-R192 PolarHBondContact O-N 3.28Å; E189-S193 WeakPolarHBondContact O-CB 3.16Å; E189-S193 PolarHBondContact O-N 2.9Å; E189-S193 PolarHBondContact O-OG 2.93Å |
| 190 | A | 88 | Confident | 88.3 | Confident | 17 Ų | 17 | 69.2 Ų | 69.2 | 14% | 0.14 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -62.1 | -42.9 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | F150 V186 L187 S193 N194 | F150-A190 HydrophobicContact CD1-CB 4.12Å; F150-A190 HydrophobicContact CE1-CB 3.74Å; V186-A190 WeakPolarHBondContact O-CB 3.24Å; V186-A190 PolarHBondContact O-N 3.45Å; L187-A190 PolarHBondContact O-N 3.15Å; A190-S193 WeakPolarHBondContact CA-OG 3.09Å; A190-S193 PolarHBondContact O-OG 3.37Å; A190-S193 VanDerWaalsContact O-OG 3.08Å; A190-N194 VanDerWaalsContact O-CB 3.29Å; A190-N194 WeakPolarHBondContact O-CB 3.17Å; A190-N194 PolarHBondContact O-N 2.91Å; A190-N194 PolarHBondContact O-ND2 2.92Å |
| 191 | C | 86.4 | Confident | 89.8 | Confident | 65 Ų | 65 | 68.3 Ų | 68.3 | 44% | 0.439 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -63.6 | -40.6 | 175.3 | -76.1 | 0 | 0 | 0 | 0 | 112 | L187 V188 E189 L195 | L187-C191 WeakPolarHBondContact O-CB 3.3Å; L187-C191 PolarHBondContact O-N 2.83Å; L187-C191 PolarHBondContact O-SG 3.33Å; V188-C191 PolarHBondContact O-N 2.92Å; E189-C191 PolarHBondContact O-N 3Å; C191-L195 WeakPolarHBondContact O-CA 3.21Å; C191-L195 WeakPolarHBondContact O-CB 3.45Å; C191-L195 PolarHBondContact O-N 3.34Å; C191-L195 VanDerWaalsContact O-N 3.07Å |
| 192 | R | 87.7 | Confident | 90.3 | Very high | 159 Ų | 159 | 63 Ų | 63 | 60% | 0.6 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -68.2 | -46.8 | 178 | -74.9 | 177.2 | 177.2 | -150.5 | -3.4 | 112.2 | V188 E189 N194 L195 | V188-R192 WeakPolarHBondContact O-CG 3.34Å; V188-R192 PolarHBondContact O-N 3.38Å; E189-R192 PolarHBondContact O-N 3.28Å; R192-N194 PolarHBondContact O-N 3.31Å; R192-L195 WeakPolarHBondContact O-CB 3.34Å; R192-L195 PolarHBondContact O-N 3.16Å |
| 193 | S | 89.8 | Confident | 90.5 | Very high | 75 Ų | 75 | 67.9 Ų | 67.9 | 52% | 0.524 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -67.2 | -34.1 | 179.6 | 56.2 | 0 | 0 | 0 | 0 | 113 | E189 A190 | E189-S193 WeakPolarHBondContact O-CB 3.16Å; E189-S193 PolarHBondContact O-N 2.9Å; E189-S193 PolarHBondContact O-OG 2.93Å; A190-S193 WeakPolarHBondContact CA-OG 3.09Å; A190-S193 PolarHBondContact O-OG 3.37Å; A190-S193 VanDerWaalsContact O-OG 3.08Å |
| 194 | N | 89.6 | Confident | 90.8 | Very high | 78 Ų | 78 | 70.9 Ų | 70.9 | 42% | 0.417 | 41% | 0.41 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -95.1 | 7.2 | 179.2 | -65.9 | -82.5 | 0 | 0 | 0 | 113.7 | A190 R192 S196 V197 I198 | A190-N194 VanDerWaalsContact O-CB 3.29Å; A190-N194 WeakPolarHBondContact O-CB 3.17Å; A190-N194 PolarHBondContact O-N 2.91Å; A190-N194 PolarHBondContact O-ND2 2.92Å; R192-N194 PolarHBondContact O-N 3.31Å; N194-S196 PolarHBondContact O-N 3.45Å; N194-V197 WeakPolarHBondContact O-CB 3.33Å; N194-V197 PolarHBondContact O-N 3.21Å; N194-I198 HydrophobicContact CB-CD1 4.5Å; N194-I198 WeakPolarHBondContact O-CG1 3.43Å; N194-I198 PolarHBondContact O-N 3.41Å |
| 195 | L | 88.2 | Confident | 90.8 | Very high | 97 Ų | 97 | 74.9 Ų | 74.9 | 51% | 0.508 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -55.4 | -41.1 | -177.7 | -171.7 | 144.7 | 0 | 0 | 0 | 111.6 | C191 R192 V197 I198 C199 | C191-L195 WeakPolarHBondContact O-CA 3.21Å; C191-L195 WeakPolarHBondContact O-CB 3.45Å; C191-L195 PolarHBondContact O-N 3.34Å; C191-L195 VanDerWaalsContact O-N 3.07Å; R192-L195 WeakPolarHBondContact O-CB 3.34Å; R192-L195 PolarHBondContact O-N 3.16Å; L195-V197 VanDerWaalsContact C-N 3.33Å; L195-V197 PolarHBondContact O-N 3.4Å; L195-I198 PolarHBondContact O-N 2.92Å; L195-C199 WeakPolarHBondContact O-CB 3.41Å; L195-C199 PolarHBondContact O-N 3.15Å; L195-C199 PolarHBondContact O-SG 3.04Å; L195-C199 VanDerWaalsContact O-SG 3.32Å |
| 196 | S | 90.1 | Very high | 91.1 | Very high | 97 Ų | 97 | 70.8 Ų | 70.8 | 68% | 0.678 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -58.8 | -41.6 | 176.2 | -53.2 | 0 | 0 | 0 | 0 | 112.7 | N194 G200 | N194-S196 PolarHBondContact O-N 3.45Å; S196-G200 PolarHBondContact O-N 3.01Å |
| 197 | V | 93 | Very high | 91.3 | Very high | 92 Ų | 92 | 74.6 Ų | 74.6 | 56% | 0.558 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -69.7 | -44.9 | 178.1 | -179.7 | 0 | 0 | 0 | 0 | 110.3 | N194 L195 C199 G200 V201 | N194-V197 WeakPolarHBondContact O-CB 3.33Å; N194-V197 PolarHBondContact O-N 3.21Å; L195-V197 VanDerWaalsContact C-N 3.33Å; L195-V197 PolarHBondContact O-N 3.4Å; V197-C199 PolarHBondContact O-N 2.74Å; V197-G200 PolarHBondContact O-N 2.93Å; V197-V201 HydrophobicContact CG1-CG2 4.48Å; V197-V201 WeakPolarHBondContact O-CG2 3.27Å; V197-V201 PolarHBondContact O-N 2.69Å |
| 198 | I | 89.5 | Confident | 91.5 | Very high | 100 Ų | 100 | 77.2 Ų | 77.2 | 51% | 0.513 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -60.2 | -47 | 178.7 | -64.5 | 166.7 | 0 | 0 | 0 | 110.4 | N194 L195 V201 G202 | N194-I198 HydrophobicContact CB-CD1 4.5Å; N194-I198 WeakPolarHBondContact O-CG1 3.43Å; N194-I198 PolarHBondContact O-N 3.41Å; L195-I198 PolarHBondContact O-N 2.92Å; I198-V201 PolarHBondContact O-N 2.95Å; I198-G202 PolarHBondContact O-N 2.83Å |
| 199 | C | 91.1 | Very high | 91.8 | Very high | 62 Ų | 62 | 77.5 Ų | 77.5 | 42% | 0.419 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -61.9 | -43 | 175.1 | -71.2 | 0 | 0 | 0 | 0 | 111.7 | L195 V197 V201 G202 I203 | L195-C199 WeakPolarHBondContact O-CB 3.41Å; L195-C199 PolarHBondContact O-N 3.15Å; L195-C199 PolarHBondContact O-SG 3.04Å; L195-C199 VanDerWaalsContact O-SG 3.32Å; V197-C199 PolarHBondContact O-N 2.74Å; C199-V201 PolarHBondContact O-N 3.29Å; C199-G202 PolarHBondContact O-N 3.4Å; C199-I203 VanDerWaalsContact O-CG1 3.27Å; C199-I203 WeakPolarHBondContact O-CG1 3.27Å; C199-I203 PolarHBondContact O-N 3.46Å |
| 200 | G | 94.1 | Very high | 92 | Very high | 31 Ų | 31 | 75.6 Ų | 75.6 | 32% | 0.32 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -60.3 | -43.3 | 177 | 0 | 0 | 0 | 0 | 0 | 113 | S196 V197 S204 | S196-G200 PolarHBondContact O-N 3.01Å; V197-G200 PolarHBondContact O-N 2.93Å; G200-S204 WeakPolarHBondContact O-CB 3.41Å; G200-S204 PolarHBondContact O-N 3.27Å; G200-S204 PolarHBondContact O-OG 3.5Å |
| 201 | V | 93.8 | Very high | 92.2 | Very high | 73 Ų | 73 | 76.8 Ų | 76.8 | 44% | 0.442 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -61.9 | -48.4 | 174.1 | 172.8 | 0 | 0 | 0 | 0 | 110.2 | V197 I198 C199 I203 S204 F205 | V197-V201 HydrophobicContact CG1-CG2 4.48Å; V197-V201 WeakPolarHBondContact O-CG2 3.27Å; V197-V201 PolarHBondContact O-N 2.69Å; I198-V201 PolarHBondContact O-N 2.95Å; C199-V201 PolarHBondContact O-N 3.29Å; V201-I203 PolarHBondContact O-N 3.46Å; V201-S204 WeakPolarHBondContact O-CB 3.45Å; V201-S204 PolarHBondContact O-N 3.3Å; V201-F205 HydrophobicContact CG1-CD2 3.68Å; V201-F205 HydrophobicContact CG1-CE2 3.58Å; V201-F205 VanDerWaalsContact O-CD2 3.26Å; V201-F205 WeakPolarHBondContact O-CD2 3.5Å; V201-F205 PolarHBondContact O-N 2.95Å |
| 202 | G | 93.8 | Very high | 92.4 | Very high | 41 Ų | 41 | 74.2 Ų | 74.2 | 42% | 0.423 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -58.6 | -44.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | I198 C199 S204 F205 A206 | I198-G202 PolarHBondContact O-N 2.83Å; C199-G202 PolarHBondContact O-N 3.4Å; G202-S204 VanDerWaalsContact C-N 3.34Å; G202-S204 PolarHBondContact O-N 2.93Å; G202-F205 PolarHBondContact O-N 3.32Å; G202-A206 PolarHBondContact O-N 3.19Å |
| 203 | I | 94.6 | Very high | 92.8 | Very high | 103 Ų | 103 | 67.6 Ų | 67.6 | 53% | 0.528 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -63.2 | -42 | 176.3 | -67.8 | 164.7 | 0 | 0 | 0 | 110.7 | C199 V201 F205 A206 L207 | C199-I203 VanDerWaalsContact O-CG1 3.27Å; C199-I203 WeakPolarHBondContact O-CG1 3.27Å; C199-I203 PolarHBondContact O-N 3.46Å; V201-I203 PolarHBondContact O-N 3.46Å; I203-F205 PolarHBondContact O-N 3.31Å; I203-A206 WeakPolarHBondContact O-CB 3.06Å; I203-A206 PolarHBondContact O-N 2.99Å; I203-L207 HydrophobicContact CG2-CD1 4.2Å; I203-L207 HydrophobicContact CG2-CG 4.4Å; I203-L207 WeakPolarHBondContact O-CG 3.38Å; I203-L207 PolarHBondContact O-N 2.76Å |
| 204 | S | 95 | Very high | 92.9 | Very high | 64 Ų | 64 | 67.5 Ų | 67.5 | 45% | 0.448 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -60.5 | -46 | 177.8 | -57.1 | 0 | 0 | 0 | 0 | 111.4 | G200 V201 G202 A206 L207 I208 | G200-S204 WeakPolarHBondContact O-CB 3.41Å; G200-S204 PolarHBondContact O-N 3.27Å; G200-S204 PolarHBondContact O-OG 3.5Å; V201-S204 WeakPolarHBondContact O-CB 3.45Å; V201-S204 PolarHBondContact O-N 3.3Å; G202-S204 VanDerWaalsContact C-N 3.34Å; G202-S204 PolarHBondContact O-N 2.93Å; S204-A206 PolarHBondContact O-N 3.3Å; S204-L207 PolarHBondContact O-N 2.84Å; S204-I208 VanDerWaalsContact O-CG1 3.31Å; S204-I208 WeakPolarHBondContact O-CG1 3Å; S204-I208 PolarHBondContact O-N 3.01Å |
| 205 | F | 93.5 | Very high | 93 | Very high | 124 Ų | 124 | 67.1 Ų | 67.1 | 54% | 0.544 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -60.9 | -43.3 | 173.9 | -85 | -75.5 | 0 | 0 | 0 | 112.1 | V201 G202 I203 L207 I208 L209 | V201-F205 HydrophobicContact CG1-CD2 3.68Å; V201-F205 HydrophobicContact CG1-CE2 3.58Å; V201-F205 VanDerWaalsContact O-CD2 3.26Å; V201-F205 WeakPolarHBondContact O-CD2 3.5Å; V201-F205 PolarHBondContact O-N 2.95Å; G202-F205 PolarHBondContact O-N 3.32Å; I203-F205 PolarHBondContact O-N 3.31Å; F205-L207 PolarHBondContact O-N 3.09Å; F205-I208 PolarHBondContact O-N 2.04Å; F205-L209 WeakPolarHBondContact O-CG 3.31Å; F205-L209 PolarHBondContact O-N 3.13Å |
| 206 | A | 95.3 | Very high | 93.2 | Very high | 25 Ų | 25 | 62.5 Ų | 62.5 | 21% | 0.207 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -60.1 | -44.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | F98 G202 I203 S204 I208 L209 I210 | F98-A206 HydrophobicContact CE2-CB 4.19Å; G202-A206 PolarHBondContact O-N 3.19Å; I203-A206 WeakPolarHBondContact O-CB 3.06Å; I203-A206 PolarHBondContact O-N 2.99Å; S204-A206 PolarHBondContact O-N 3.3Å; A206-I208 PolarHBondContact O-N 2.57Å; A206-L209 PolarHBondContact O-N 3.49Å; A206-I210 WeakPolarHBondContact O-CB 3.15Å; A206-I210 VanDerWaalsContact O-CG1 3.24Å; A206-I210 WeakPolarHBondContact O-CG1 3.48Å; A206-I210 PolarHBondContact O-N 3.34Å |
| 207 | L | 95.6 | Very high | 93.2 | Very high | 110 Ų | 110 | 62 Ų | 62 | 58% | 0.576 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -62.6 | -41.8 | 176.8 | -70.3 | 175.8 | 0 | 0 | 0 | 112 | I203 S204 F205 I210 S211 | I203-L207 HydrophobicContact CG2-CD1 4.2Å; I203-L207 HydrophobicContact CG2-CG 4.4Å; I203-L207 WeakPolarHBondContact O-CG 3.38Å; I203-L207 PolarHBondContact O-N 2.76Å; S204-L207 PolarHBondContact O-N 2.84Å; F205-L207 PolarHBondContact O-N 3.09Å; L207-I210 PolarHBondContact O-N 3.49Å; L207-S211 WeakPolarHBondContact O-CB 3.38Å; L207-S211 PolarHBondContact O-N 2.88Å; L207-S211 PolarHBondContact O-OG 3.04Å |
| 208 | I | 92.9 | Very high | 93.1 | Very high | 75 Ų | 75 | 61.4 Ų | 61.4 | 39% | 0.385 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -60.2 | -48.6 | 176.2 | -70.5 | 166.2 | 0 | 0 | 0 | 110.4 | F20 S204 F205 A206 I210 S211 G212 | F20-I208 HydrophobicContact CE1-CG2 4.27Å; F20-I208 HydrophobicContact CZ-CG2 3.65Å; S204-I208 VanDerWaalsContact O-CG1 3.31Å; S204-I208 WeakPolarHBondContact O-CG1 3Å; S204-I208 PolarHBondContact O-N 3.01Å; F205-I208 PolarHBondContact O-N 2.04Å; A206-I208 PolarHBondContact O-N 2.57Å; I208-I210 PolarHBondContact O-N 3.23Å; I208-S211 PolarHBondContact O-N 2.91Å; I208-S211 PolarHBondContact O-OG 3.1Å; I208-G212 PolarHBondContact O-N 3.02Å |
| 209 | L | 94.5 | Very high | 93.1 | Very high | 28 Ų | 28 | 56.9 Ų | 56.9 | 15% | 0.147 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -63.3 | -43.9 | 179.5 | -64.7 | 171.3 | 0 | 0 | 0 | 111.9 | V94 F98 L101 F205 A206 S211 G212 M213 | V94-L209 HydrophobicContact CG1-CB 4.01Å; V94-L209 HydrophobicContact CG1-CD2 3.88Å; V94-L209 WeakPolarHBondContact CG1-O 3.25Å; F98-L209 HydrophobicContact CB-CD1 4.33Å; F98-L209 HydrophobicContact CD2-CB 4.42Å; F98-L209 HydrophobicContact CD2-CD1 4.43Å; L101-L209 HydrophobicContact CD1-CD1 3.63Å; F205-L209 WeakPolarHBondContact O-CG 3.31Å; F205-L209 PolarHBondContact O-N 3.13Å; A206-L209 PolarHBondContact O-N 3.49Å; L209-S211 VanDerWaalsContact C-N 3.34Å; L209-S211 PolarHBondContact O-N 3.41Å; L209-G212 PolarHBondContact O-N 2.75Å; L209-M213 WeakPolarHBondContact O-CG 3.35Å; L209-M213 PolarHBondContact O-N 2.78Å |
| 210 | I | 95.2 | Very high | 93 | Very high | 72 Ų | 72 | 55.3 Ų | 55.3 | 37% | 0.369 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -61.2 | -44.2 | 176.5 | -68.1 | 165.7 | 0 | 0 | 0 | 110.6 | F98 A206 L207 I208 G212 M213 V214 | F98-I210 HydrophobicContact CD2-CG1 4.43Å; F98-I210 HydrophobicContact CE2-CD1 3.97Å; F98-I210 HydrophobicContact CE2-CG1 4Å; F98-I210 HydrophobicContact CZ-CD1 4.25Å; F98-I210 HydrophobicContact CZ-CG1 4.43Å; A206-I210 WeakPolarHBondContact O-CB 3.15Å; A206-I210 VanDerWaalsContact O-CG1 3.24Å; A206-I210 WeakPolarHBondContact O-CG1 3.48Å; A206-I210 PolarHBondContact O-N 3.34Å; L207-I210 PolarHBondContact O-N 3.49Å; I208-I210 PolarHBondContact O-N 3.23Å; I210-G212 VanDerWaalsContact C-N 3.31Å; I210-G212 PolarHBondContact O-N 3.22Å; I210-M213 HydrophobicContact CB-CE 4.39Å; I210-M213 HydrophobicContact CG1-CE 3.93Å; I210-M213 PolarHBondContact O-N 2.85Å; I210-V214 HydrophobicContact CG2-CG2 4.21Å; I210-V214 VanDerWaalsContact O-CG2 3.31Å; I210-V214 WeakPolarHBondContact O-CG2 3.33Å; I210-V214 PolarHBondContact O-N 3.44Å |
| 211 | S | 92.2 | Very high | 92.8 | Very high | 42 Ų | 42 | 57.5 Ų | 57.5 | 29% | 0.294 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -60 | -42.4 | 177.2 | 76.3 | 0 | 0 | 0 | 0 | 111.9 | L207 I208 L209 M213 V214 F215 | L207-S211 WeakPolarHBondContact O-CB 3.38Å; L207-S211 PolarHBondContact O-N 2.88Å; L207-S211 PolarHBondContact O-OG 3.04Å; I208-S211 PolarHBondContact O-N 2.91Å; I208-S211 PolarHBondContact O-OG 3.1Å; L209-S211 VanDerWaalsContact C-N 3.34Å; L209-S211 PolarHBondContact O-N 3.41Å; S211-M213 PolarHBondContact O-N 3.28Å; S211-V214 PolarHBondContact O-N 2.81Å; S211-F215 WeakPolarHBondContact O-CB 3.27Å; S211-F215 WeakPolarHBondContact O-CD2 3.43Å; S211-F215 VanDerWaalsContact O-CG 3.25Å; S211-F215 WeakPolarHBondContact O-CG 3.41Å; S211-F215 PolarHBondContact O-N 3.43Å |
| 212 | G | 91.9 | Very high | 92.5 | Very high | 10 Ų | 10 | 54.4 Ų | 54.4 | 10% | 0.103 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -61.1 | -43.1 | 175 | 0 | 0 | 0 | 0 | 0 | 112.6 | I208 L209 I210 S216 | I208-G212 PolarHBondContact O-N 3.02Å; L209-G212 PolarHBondContact O-N 2.75Å; I210-G212 VanDerWaalsContact C-N 3.31Å; I210-G212 PolarHBondContact O-N 3.22Å; G212-S216 WeakPolarHBondContact O-CB 3.32Å; G212-S216 PolarHBondContact O-N 3.03Å |
| 213 | M | 94.2 | Very high | 92.1 | Very high | 20 Ų | 20 | 53.1 Ų | 53.1 | 10% | 0.099 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -62.7 | -46.2 | 175.5 | -73 | -172.5 | -70.7 | 0 | 0 | 112.2 | F91 V94 F95 F98 L209 I210 S211 S216 M217 | F91-M213 HydrophobicContact CD2-CB 3.92Å; F91-M213 HydrophobicContact CD2-CG 4Å; F91-M213 HydrophobicContact CE2-CB 3.78Å; F91-M213 HydrophobicContact CE2-CG 3.98Å; F91-M213 HydrophobicContact CE2-SD 4.29Å; V94-M213 HydrophobicContact CB-CG 4.17Å; V94-M213 HydrophobicContact CG1-CG 3.56Å; V94-M213 HydrophobicContact CG1-SD 4.3Å; F95-M213 HydrophobicContact CB-SD 3.95Å; F95-M213 HydrophobicContact CD2-SD 4Å; F98-M213 HydrophobicContact CB-CE 4.23Å; F98-M213 HydrophobicContact CD1-CE 4.37Å; F98-M213 HydrophobicContact CD2-CE 4.43Å; F98-M213 HydrophobicContact CG-CE 4.09Å; L209-M213 WeakPolarHBondContact O-CG 3.35Å; L209-M213 PolarHBondContact O-N 2.78Å; I210-M213 HydrophobicContact CB-CE 4.39Å; I210-M213 HydrophobicContact CG1-CE 3.93Å; I210-M213 PolarHBondContact O-N 2.85Å; S211-M213 PolarHBondContact O-N 3.28Å; M213-S216 PolarHBondContact O-N 3.36Å; M213-M217 WeakPolarHBondContact O-CG 3.35Å; M213-M217 PolarHBondContact O-N 2.84Å |
| 214 | V | 93.6 | Very high | 91.8 | Very high | 73 Ų | 73 | 57 Ų | 57 | 44% | 0.442 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -64.2 | -47 | -179.9 | 173.7 | 0 | 0 | 0 | 0 | 110.8 | I210 S211 S216 M217 M218 | I210-V214 HydrophobicContact CG2-CG2 4.21Å; I210-V214 VanDerWaalsContact O-CG2 3.31Å; I210-V214 WeakPolarHBondContact O-CG2 3.33Å; I210-V214 PolarHBondContact O-N 3.44Å; S211-V214 PolarHBondContact O-N 2.81Å; V214-S216 VanDerWaalsContact C-N 3.34Å; V214-S216 PolarHBondContact O-N 2.89Å; V214-M217 PolarHBondContact O-N 3.42Å; V214-M218 HydrophobicContact CG1-CE 3.89Å; V214-M218 HydrophobicContact CG1-CG 4.44Å; V214-M218 HydrophobicContact CG1-SD 4.25Å; V214-M218 WeakPolarHBondContact O-CB 3.42Å; V214-M218 WeakPolarHBondContact O-CG 3.27Å; V214-M218 PolarHBondContact O-N 2.69Å |
| 215 | F | 91.1 | Very high | 91.3 | Very high | 70 Ų | 70 | 61.7 Ų | 61.7 | 31% | 0.307 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -61.8 | -42.3 | 176.5 | -65.6 | -37 | 0 | 0 | 0 | 112.2 | L13 M17 S211 M217 M218 L219 | L13-F215 HydrophobicContact CD2-CD1 3.72Å; L13-F215 HydrophobicContact CD2-CE1 3.64Å; M17-F215 HydrophobicContact SD-CB 4.36Å; S211-F215 WeakPolarHBondContact O-CB 3.27Å; S211-F215 WeakPolarHBondContact O-CD2 3.43Å; S211-F215 VanDerWaalsContact O-CG 3.25Å; S211-F215 WeakPolarHBondContact O-CG 3.41Å; S211-F215 PolarHBondContact O-N 3.43Å; F215-M217 PolarHBondContact O-N 3.22Å; F215-M218 HydrophobicContact CD1-CE 3.43Å; F215-M218 VanDerWaalsContact CD1-CE 3.43Å; F215-M218 HydrophobicContact CE1-CE 3.95Å; F215-M218 PolarHBondContact O-N 2.97Å; F215-L219 VanDerWaalsContact O-CB 3.29Å; F215-L219 WeakPolarHBondContact O-CB 3.42Å; F215-L219 PolarHBondContact O-N 2.96Å |
| 216 | S | 91.8 | Very high | 90.7 | Very high | 1 Ų | 1 | 61.8 Ų | 61.8 | 1% | 0.007 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -60.7 | -44.9 | 176.3 | -169.5 | 0 | 0 | 0 | 0 | 112.1 | L87 G212 M213 V214 C220 | L87-S216 VanDerWaalsContact CD1-OG 3.31Å; L87-S216 WeakPolarHBondContact CD1-OG 3.42Å; L87-S216 VanDerWaalsContact CD2-O 3.27Å; L87-S216 WeakPolarHBondContact CD2-O 3.34Å; L87-S216 VanDerWaalsContact CG-OG 3.31Å; L87-S216 WeakPolarHBondContact CG-OG 3.29Å; L87-S216 PolarHBondContact O-OG 2.79Å; G212-S216 WeakPolarHBondContact O-CB 3.32Å; G212-S216 PolarHBondContact O-N 3.03Å; M213-S216 PolarHBondContact O-N 3.36Å; V214-S216 VanDerWaalsContact C-N 3.34Å; V214-S216 PolarHBondContact O-N 2.89Å; S216-C220 VanDerWaalsContact O-CB 3.27Å; S216-C220 WeakPolarHBondContact O-CB 3.48Å; S216-C220 PolarHBondContact O-N 3.02Å |
| 217 | M | 91.5 | Very high | 89.8 | Confident | 87 Ų | 87 | 66.9 Ų | 66.9 | 43% | 0.429 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -68.1 | -43.7 | 178.4 | -71.2 | -66.8 | -83.4 | 0 | 0 | 112.2 | F91 M213 V214 F215 L219 C220 C221 | F91-M217 HydrophobicContact CD2-CG 3.61Å; F91-M217 HydrophobicContact CD2-SD 3.93Å; F91-M217 HydrophobicContact CE2-CG 3.47Å; F91-M217 VanDerWaalsContact CE2-CG 3.47Å; F91-M217 HydrophobicContact CE2-SD 3.89Å; F91-M217 HydrophobicContact CG-SD 4.28Å; F91-M217 HydrophobicContact CZ-CG 4.29Å; F91-M217 HydrophobicContact CZ-SD 4.24Å; M213-M217 WeakPolarHBondContact O-CG 3.35Å; M213-M217 PolarHBondContact O-N 2.84Å; V214-M217 PolarHBondContact O-N 3.42Å; F215-M217 PolarHBondContact O-N 3.22Å; M217-L219 VanDerWaalsContact C-N 3.34Å; M217-L219 PolarHBondContact O-N 3.37Å; M217-C220 PolarHBondContact O-N 3.29Å; M217-C221 WeakPolarHBondContact O-CB 2.97Å; M217-C221 PolarHBondContact O-N 3.36Å; M217-C221 PolarHBondContact O-SG 2.97Å; M217-C221 VanDerWaalsContact O-SG 3.32Å |
| 218 | M | 90.7 | Very high | 89.5 | Confident | 79 Ų | 79 | 64.7 Ų | 64.7 | 39% | 0.389 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -60.6 | -44 | 176.6 | -72.1 | -169.4 | -57.7 | 0 | 0 | 111.8 | L13 V214 F215 A222 | L13-M218 HydrophobicContact CD1-CE 4.04Å; L13-M218 HydrophobicContact CD2-CE 4.09Å; V214-M218 HydrophobicContact CG1-CE 3.89Å; V214-M218 HydrophobicContact CG1-CG 4.44Å; V214-M218 HydrophobicContact CG1-SD 4.25Å; V214-M218 WeakPolarHBondContact O-CB 3.42Å; V214-M218 WeakPolarHBondContact O-CG 3.27Å; V214-M218 PolarHBondContact O-N 2.69Å; F215-M218 HydrophobicContact CD1-CE 3.43Å; F215-M218 VanDerWaalsContact CD1-CE 3.43Å; F215-M218 HydrophobicContact CE1-CE 3.95Å; F215-M218 PolarHBondContact O-N 2.97Å; M218-A222 WeakPolarHBondContact O-CB 3.39Å; M218-A222 PolarHBondContact O-N 3Å |
| 219 | L | 89.2 | Confident | 89.4 | Confident | 4 Ų | 4 | 64.2 Ų | 64.2 | 2% | 0.021 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -66.2 | -39.4 | 177.6 | -170.5 | 81 | 0 | 0 | 0 | 110.7 | F10 K14 M17 A79 L87 F215 M217 A222 I223 | F10-L219 HydrophobicContact CD2-CD1 4.23Å; F10-L219 HydrophobicContact CE2-CD1 3.4Å; F10-L219 HydrophobicContact CE2-CG 4.36Å; F10-L219 HydrophobicContact CZ-CD1 3.61Å; K14-L219 HydrophobicContact CB-CD1 4.06Å; K14-L219 HydrophobicContact CG-CD1 4.46Å; M17-L219 HydrophobicContact SD-CD2 4.06Å; A79-L219 HydrophobicContact CB-CD2 4.29Å; L87-L219 HydrophobicContact CD1-CD2 4Å; L87-L219 HydrophobicContact CD2-CB 3.82Å; L87-L219 HydrophobicContact CD2-CD2 3.82Å; L87-L219 HydrophobicContact CD2-CG 3.94Å; F215-L219 VanDerWaalsContact O-CB 3.29Å; F215-L219 WeakPolarHBondContact O-CB 3.42Å; F215-L219 PolarHBondContact O-N 2.96Å; M217-L219 VanDerWaalsContact C-N 3.34Å; M217-L219 PolarHBondContact O-N 3.37Å; L219-A222 PolarHBondContact O-N 3.48Å; L219-I223 HydrophobicContact CD2-CD1 4.48Å; L219-I223 HydrophobicContact CG-CD1 4.01Å; L219-I223 WeakPolarHBondContact O-CD1 3.27Å; L219-I223 WeakPolarHBondContact O-CG1 3.42Å; L219-I223 PolarHBondContact O-N 3.23Å |
| 220 | C | 89.4 | Confident | 89.1 | Confident | 29 Ų | 29 | 66.2 Ų | 66.2 | 20% | 0.196 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -63.5 | -47.1 | 176.6 | -168.7 | 0 | 0 | 0 | 0 | 112.1 | L87 S216 M217 I223 R224 | L87-C220 HydrophobicContact CD2-CB 3.69Å; L87-C220 VanDerWaalsContact CD2-N 3.27Å; L87-C220 HydrophobicContact CG-CB 4.39Å; S216-C220 VanDerWaalsContact O-CB 3.27Å; S216-C220 WeakPolarHBondContact O-CB 3.48Å; S216-C220 PolarHBondContact O-N 3.02Å; M217-C220 PolarHBondContact O-N 3.29Å; C220-I223 PolarHBondContact O-N 2.98Å; C220-R224 PolarHBondContact O-N 3.27Å |
| 221 | C | 88.8 | Confident | 88.7 | Confident | 77 Ų | 77 | 65.8 Ų | 65.8 | 52% | 0.52 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -59.8 | -46.7 | 176.1 | -72.6 | 0 | 0 | 0 | 0 | 111.4 | M217 I223 R224 E225 | M217-C221 WeakPolarHBondContact O-CB 2.97Å; M217-C221 PolarHBondContact O-N 3.36Å; M217-C221 PolarHBondContact O-SG 2.97Å; M217-C221 VanDerWaalsContact O-SG 3.32Å; C221-I223 PolarHBondContact O-N 2.87Å; C221-R224 WeakPolarHBondContact O-CB 3.34Å; C221-R224 PolarHBondContact O-N 3.25Å; C221-E225 WeakPolarHBondContact O-CG 3.48Å; C221-E225 PolarHBondContact O-N 3.18Å; C221-E225 VanDerWaalsContact O-N 3.1Å |
| 222 | A | 87 | Confident | 88.5 | Confident | 8 Ų | 8 | 67.3 Ų | 67.3 | 7% | 0.066 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -66.7 | -36.3 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | F6 F10 M218 L219 R224 E225 L226 | F6-A222 HydrophobicContact CZ-CB 4.37Å; F10-A222 HydrophobicContact CD2-CB 3.52Å; F10-A222 HydrophobicContact CE2-CB 3.29Å; F10-A222 HydrophobicContact CZ-CB 4.3Å; M218-A222 WeakPolarHBondContact O-CB 3.39Å; M218-A222 PolarHBondContact O-N 3Å; L219-A222 PolarHBondContact O-N 3.48Å; A222-R224 VanDerWaalsContact C-N 3.32Å; A222-E225 PolarHBondContact O-N 3.29Å; A222-L226 WeakPolarHBondContact O-CD1 3.47Å; A222-L226 WeakPolarHBondContact O-CG 3.3Å; A222-L226 PolarHBondContact O-N 3.27Å |
| 223 | I | 86.4 | Confident | 88.3 | Confident | 15 Ų | 15 | 71.1 Ų | 71.1 | 8% | 0.077 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -63.6 | -40 | 172.6 | -68.1 | 161.6 | 0 | 0 | 0 | 110.7 | F10 E82 Q84 L87 L219 C220 C221 E225 L226 S227 | F10-I223 HydrophobicContact CZ-CG1 4.41Å; E82-I223 HydrophobicContact CB-CD1 3.87Å; E82-I223 HydrophobicContact CB-CG1 4.12Å; E82-I223 HydrophobicContact CG-CD1 4.38Å; E82-I223 WeakPolarHBondContact O-CG2 3.49Å; Q84-I223 HydrophobicContact CG-CB 4.32Å; Q84-I223 HydrophobicContact CG-CG2 3.74Å; L87-I223 HydrophobicContact CD2-CD1 4.23Å; L219-I223 HydrophobicContact CD2-CD1 4.48Å; L219-I223 HydrophobicContact CG-CD1 4.01Å; L219-I223 WeakPolarHBondContact O-CD1 3.27Å; L219-I223 WeakPolarHBondContact O-CG1 3.42Å; L219-I223 PolarHBondContact O-N 3.23Å; C220-I223 PolarHBondContact O-N 2.98Å; C221-I223 PolarHBondContact O-N 2.87Å; I223-E225 VanDerWaalsContact C-N 3.31Å; I223-E225 PolarHBondContact O-N 2.67Å; I223-L226 PolarHBondContact O-N 3.13Å; I223-L226 VanDerWaalsContact O-N 3.14Å; I223-S227 PolarHBondContact O-N 3.26Å; I223-S227 VanDerWaalsContact O-N 3.08Å; I223-S227 PolarHBondContact O-OG 2.88Å |
| 224 | R | 87.7 | Confident | 87.9 | Confident | 183 Ų | 183 | 74.8 Ų | 74.8 | 69% | 0.691 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -63.6 | -35 | 177.7 | -172 | 177.4 | 173.5 | -179.9 | -2.2 | 113.3 | Q84 C220 C221 A222 L226 S227 | Q84-R224 VanDerWaalsContact NE2-CB 3.27Å; C220-R224 PolarHBondContact O-N 3.27Å; C221-R224 WeakPolarHBondContact O-CB 3.34Å; C221-R224 PolarHBondContact O-N 3.25Å; A222-R224 VanDerWaalsContact C-N 3.32Å; R224-L226 VanDerWaalsContact C-N 3.28Å; R224-S227 PolarHBondContact O-OG 2.85Å; R224-S227 VanDerWaalsContact O-OG 3.05Å |
| 225 | E | 85.2 | Confident | 87.4 | Confident | 164 Ų | 164 | 74.9 Ų | 74.9 | 77% | 0.766 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -74.9 | -20.5 | 176.4 | -66.8 | -68.9 | 153.7 | 0 | 0 | 112.5 | C221 A222 I223 | C221-E225 WeakPolarHBondContact O-CG 3.48Å; C221-E225 PolarHBondContact O-N 3.18Å; C221-E225 VanDerWaalsContact O-N 3.1Å; A222-E225 PolarHBondContact O-N 3.29Å; I223-E225 VanDerWaalsContact C-N 3.31Å; I223-E225 PolarHBondContact O-N 2.67Å |
| 226 | L | 80.5 | Confident | 87.1 | Confident | 126 Ų | 126 | 75.3 Ų | 75.3 | 66% | 0.66 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -89.2 | -23.2 | 178.1 | -74.8 | 159.9 | 0 | 0 | 0 | 113.1 | F10 A222 I223 R224 | F10-L226 HydrophobicContact CE1-CD1 4.45Å; F10-L226 HydrophobicContact CZ-CD1 4.42Å; A222-L226 WeakPolarHBondContact O-CD1 3.47Å; A222-L226 WeakPolarHBondContact O-CG 3.3Å; A222-L226 PolarHBondContact O-N 3.27Å; I223-L226 PolarHBondContact O-N 3.13Å; I223-L226 VanDerWaalsContact O-N 3.14Å; R224-L226 VanDerWaalsContact C-N 3.28Å |
| 227 | S | 77.3 | Confident | 86.7 | Confident | 131 Ų | 131 | 82.1 Ų | 82.1 | 92% | 0.916 | 43% | 0.43 | S | S | * | . | trans | -87.8 | 0 | 178.5 | 65.2 | 0 | 0 | 0 | 0 | 112.5 | I223 R224 | I223-S227 PolarHBondContact O-N 3.26Å; I223-S227 VanDerWaalsContact O-N 3.08Å; I223-S227 PolarHBondContact O-OG 2.88Å; R224-S227 PolarHBondContact O-OG 2.85Å; R224-S227 VanDerWaalsContact O-OG 3.05Å |
Retrieved 227 of 227 residues in 122.6 ms
(Link to these results)