| 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 | 63.6 | Low | 86.6 | Confident | 167 Ų | 167 | 66.9 Ų | 66.9 | 82% | 0.823 | 33% | 0.332 | S | S | * | . | 0 | -63.4 | 0 | -66.5 | -70.5 | -149.7 | 0 | 0 | 113.7 | E4 R5 | M1-E4 WeakPolarHBondContact CA-OE2 3.05Å; M1-E4 PolarHBondContact N-OE2 3.13Å; M1-E4 PolarHBondContact O-N 3.29Å; M1-R5 WeakPolarHBondContact O-CG 3.25Å; M1-R5 PolarHBondContact O-N 2.99Å | |||
| 2 | E | 82.9 | Confident | 86.9 | Confident | 153 Ų | 153 | 65.8 Ų | 65.8 | 72% | 0.715 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -63.4 | -44.8 | -178.6 | -164 | 90.7 | -156.2 | 0 | 0 | 112.1 | R5 I6 | E2-R5 WeakPolarHBondContact O-CB 3.26Å; E2-R5 PolarHBondContact O-N 3.02Å; E2-I6 WeakPolarHBondContact O-CG1 3.49Å; E2-I6 PolarHBondContact O-N 3.25Å; E2-I6 VanDerWaalsContact O-N 3.07Å |
| 3 | L | 85.3 | Confident | 87.3 | Confident | 42 Ų | 42 | 64.5 Ų | 64.5 | 22% | 0.22 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -62 | -44 | 177.7 | -68.4 | 155.8 | 0 | 0 | 0 | 112.1 | R5 I6 V7 L36 L87 A90 | L3-R5 VanDerWaalsContact C-N 3.29Å; L3-R5 PolarHBondContact O-N 3.39Å; L3-I6 WeakPolarHBondContact O-CB 3.41Å; L3-I6 PolarHBondContact O-N 2.93Å; L3-I6 VanDerWaalsContact O-N 3.09Å; L3-V7 WeakPolarHBondContact O-CG2 3.46Å; L3-V7 PolarHBondContact O-N 2.73Å; L3-L36 HydrophobicContact CB-CD1 4.26Å; L3-L36 HydrophobicContact CB-CD2 4.39Å; L3-L87 HydrophobicContact CB-CD2 4.03Å; L3-L87 HydrophobicContact CD2-CB 4.24Å; L3-L87 HydrophobicContact CD2-CD2 3.5Å; L3-L87 HydrophobicContact CD2-CG 4.47Å; L3-L87 HydrophobicContact CG-CD2 4.39Å; L3-A90 HydrophobicContact CD2-CB 4.33Å |
| 4 | E | 85.6 | Confident | 87.7 | Confident | 41 Ų | 41 | 61.4 Ų | 61.4 | 19% | 0.192 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -64.7 | -32.7 | 175.5 | -66.1 | 156.8 | 155.4 | 0 | 0 | 112 | M1 I6 V7 S8 L36 | M1-E4 WeakPolarHBondContact CA-OE2 3.05Å; M1-E4 PolarHBondContact N-OE2 3.13Å; M1-E4 PolarHBondContact O-N 3.29Å; E4-I6 VanDerWaalsContact C-N 3.34Å; E4-V7 PolarHBondContact O-N 2.91Å; E4-S8 VanDerWaalsContact O-CB 3.29Å; E4-S8 WeakPolarHBondContact O-CB 3.35Å; E4-S8 PolarHBondContact O-N 3.03Å; E4-S8 PolarHBondContact O-OG 3.4Å; E4-L36 HydrophobicContact CG-CD2 3.9Å |
| 5 | R | 88.7 | Confident | 87.9 | Confident | 182 Ų | 182 | 57.3 Ų | 57.3 | 69% | 0.687 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -65.6 | -37.6 | 171.5 | -77.9 | -153.3 | 71.1 | 94.1 | 6.6 | 112.2 | M1 E2 L3 S8 S9 | M1-R5 WeakPolarHBondContact O-CG 3.25Å; M1-R5 PolarHBondContact O-N 2.99Å; E2-R5 WeakPolarHBondContact O-CB 3.26Å; E2-R5 PolarHBondContact O-N 3.02Å; L3-R5 VanDerWaalsContact C-N 3.29Å; L3-R5 PolarHBondContact O-N 3.39Å; R5-S8 VanDerWaalsContact CA-OG 3.32Å; R5-S8 WeakPolarHBondContact CA-OG 3.36Å; R5-S8 PolarHBondContact O-OG 3.43Å; R5-S8 VanDerWaalsContact O-OG 3.06Å; R5-S9 VanDerWaalsContact O-CB 3.26Å; R5-S9 WeakPolarHBondContact O-CB 3.13Å; R5-S9 PolarHBondContact O-N 3.42Å; R5-S9 PolarHBondContact O-OG 3.25Å; R5-S9 VanDerWaalsContact O-OG 3.06Å |
| 6 | I | 90.3 | Very high | 88 | Confident | 37 Ų | 37 | 61.1 Ų | 61.1 | 19% | 0.19 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -64.8 | -51.8 | 175 | -64.6 | 166.2 | 0 | 0 | 0 | 109.3 | E2 L3 E4 S8 S9 A10 Q86 L87 A90 | E2-I6 WeakPolarHBondContact O-CG1 3.49Å; E2-I6 PolarHBondContact O-N 3.25Å; E2-I6 VanDerWaalsContact O-N 3.07Å; L3-I6 WeakPolarHBondContact O-CB 3.41Å; L3-I6 PolarHBondContact O-N 2.93Å; L3-I6 VanDerWaalsContact O-N 3.09Å; E4-I6 VanDerWaalsContact C-N 3.34Å; I6-S8 PolarHBondContact O-N 3.19Å; I6-S9 PolarHBondContact O-N 3.43Å; I6-S9 PolarHBondContact O-OG 3.02Å; I6-A10 WeakPolarHBondContact O-CB 3.2Å; I6-A10 PolarHBondContact O-N 3.34Å; I6-Q86 HydrophobicContact CG2-CB 4.4Å; I6-L87 HydrophobicContact CB-CD2 4.26Å; I6-L87 HydrophobicContact CG2-CD2 4.2Å; I6-A90 HydrophobicContact CD1-CB 3.48Å; I6-A90 VanDerWaalsContact CD1-CB 3.48Å |
| 7 | V | 91.5 | Very high | 88.1 | Confident | 0 Ų | 0 | 63.4 Ų | 63.4 | 0% | 0 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -56.7 | -52.2 | 178 | 176.3 | 0 | 0 | 0 | 0 | 111.3 | L3 E4 S9 A10 L11 V35 L36 L39 L87 | L3-V7 WeakPolarHBondContact O-CG2 3.46Å; L3-V7 PolarHBondContact O-N 2.73Å; E4-V7 PolarHBondContact O-N 2.91Å; V7-S9 PolarHBondContact O-N 3.09Å; V7-A10 PolarHBondContact O-N 3.17Å; V7-L11 WeakPolarHBondContact O-CB 3.22Å; V7-L11 PolarHBondContact O-N 3.46Å; V7-V35 HydrophobicContact CG1-CB 4.05Å; V7-V35 HydrophobicContact CG1-CG1 3.65Å; V7-L36 HydrophobicContact CG2-CB 4.4Å; V7-L36 HydrophobicContact CG2-CD1 3.96Å; V7-L39 HydrophobicContact CG2-CD1 4.17Å; V7-L87 HydrophobicContact CG2-CD1 3.93Å; V7-L87 HydrophobicContact CG2-CD2 3.93Å; V7-L87 HydrophobicContact CG2-CG 4.42Å |
| 8 | S | 90.9 | Very high | 88.2 | Confident | 19 Ų | 19 | 63.4 Ų | 63.4 | 13% | 0.133 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -59.9 | -47 | -179.6 | 54.9 | 0 | 0 | 0 | 0 | 112.1 | E4 R5 I6 A10 L12 | E4-S8 VanDerWaalsContact O-CB 3.29Å; E4-S8 WeakPolarHBondContact O-CB 3.35Å; E4-S8 PolarHBondContact O-N 3.03Å; E4-S8 PolarHBondContact O-OG 3.4Å; R5-S8 VanDerWaalsContact CA-OG 3.32Å; R5-S8 WeakPolarHBondContact CA-OG 3.36Å; R5-S8 PolarHBondContact O-OG 3.43Å; R5-S8 VanDerWaalsContact O-OG 3.06Å; I6-S8 PolarHBondContact O-N 3.19Å; S8-A10 PolarHBondContact O-N 3.46Å; S8-L12 VanDerWaalsContact O-CB 3.28Å; S8-L12 WeakPolarHBondContact O-CB 3.45Å; S8-L12 WeakPolarHBondContact O-CD1 3.49Å; S8-L12 WeakPolarHBondContact O-CG 3.38Å; S8-L12 PolarHBondContact O-N 3.26Å |
| 9 | S | 91.2 | Very high | 88.2 | Confident | 70 Ų | 70 | 61.9 Ų | 61.9 | 49% | 0.49 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -62.5 | -41.8 | -179 | 68.8 | 0 | 0 | 0 | 0 | 113.1 | R5 I6 V7 A13 | R5-S9 VanDerWaalsContact O-CB 3.26Å; R5-S9 WeakPolarHBondContact O-CB 3.13Å; R5-S9 PolarHBondContact O-N 3.42Å; R5-S9 PolarHBondContact O-OG 3.25Å; R5-S9 VanDerWaalsContact O-OG 3.06Å; I6-S9 PolarHBondContact O-N 3.43Å; I6-S9 PolarHBondContact O-OG 3.02Å; V7-S9 PolarHBondContact O-N 3.09Å; S9-A13 WeakPolarHBondContact O-CB 3.35Å; S9-A13 PolarHBondContact O-N 3.06Å |
| 10 | A | 91.6 | Very high | 87.8 | Confident | 25 Ų | 25 | 64.5 Ų | 64.5 | 21% | 0.207 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -78.8 | -36.4 | -177.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | I6 V7 S8 A13 F14 L83 | I6-A10 WeakPolarHBondContact O-CB 3.2Å; I6-A10 PolarHBondContact O-N 3.34Å; V7-A10 PolarHBondContact O-N 3.17Å; S8-A10 PolarHBondContact O-N 3.46Å; A10-A13 PolarHBondContact O-N 3.11Å; A10-F14 WeakPolarHBondContact O-CB 3.19Å; A10-F14 PolarHBondContact O-N 2.69Å; A10-L83 HydrophobicContact CB-CD2 3.26Å; A10-L83 HydrophobicContact CB-CG 4.29Å |
| 11 | L | 91.1 | Very high | 87.6 | Confident | 0 Ų | 0 | 70.5 Ų | 70.5 | 0% | 0 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -64.4 | -45.8 | 173.1 | -173.9 | 66.4 | 0 | 0 | 0 | 110.9 | V7 A13 F14 V15 L27 F32 V35 M61 M79 | V7-L11 WeakPolarHBondContact O-CB 3.22Å; V7-L11 PolarHBondContact O-N 3.46Å; L11-A13 VanDerWaalsContact C-N 3.34Å; L11-A13 PolarHBondContact O-N 3.33Å; L11-F14 PolarHBondContact O-N 2.9Å; L11-V15 WeakPolarHBondContact O-CG2 3.44Å; L11-V15 PolarHBondContact O-N 3.22Å; L11-L27 HydrophobicContact CD2-CD2 4.43Å; L11-F32 HydrophobicContact CD2-CD1 4.3Å; L11-F32 HydrophobicContact CD2-CE1 4.1Å; L11-V35 HydrophobicContact CD2-CG2 4.36Å; L11-M61 HydrophobicContact CD1-CE 4.13Å; L11-M61 HydrophobicContact CD2-CE 4.01Å; L11-M61 HydrophobicContact CG-CE 4.48Å; L11-M79 HydrophobicContact CD1-CE 4.44Å; L11-M79 HydrophobicContact CD1-SD 3.97Å |
| 12 | L | 90.7 | Very high | 88.6 | Confident | 53 Ų | 53 | 63.7 Ų | 63.7 | 28% | 0.277 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -61.5 | -42.8 | 176.5 | -69.2 | 169.8 | 0 | 0 | 0 | 111.4 | S8 V15 Q16 L24 L27 | S8-L12 VanDerWaalsContact O-CB 3.28Å; S8-L12 WeakPolarHBondContact O-CB 3.45Å; S8-L12 WeakPolarHBondContact O-CD1 3.49Å; S8-L12 WeakPolarHBondContact O-CG 3.38Å; S8-L12 PolarHBondContact O-N 3.26Å; L12-V15 PolarHBondContact O-N 3.07Å; L12-Q16 WeakPolarHBondContact O-CB 3.3Å; L12-Q16 VanDerWaalsContact O-CG 3.22Å; L12-Q16 WeakPolarHBondContact O-CG 3.32Å; L12-Q16 PolarHBondContact O-N 3.13Å; L12-L24 HydrophobicContact CD2-CB 3.77Å; L12-L24 HydrophobicContact CD2-CD1 3.6Å; L12-L24 HydrophobicContact CD2-CD2 4.24Å; L12-L24 HydrophobicContact CD2-CG 4.06Å; L12-L27 HydrophobicContact CD2-CD1 3.79Å |
| 13 | A | 91.4 | Very high | 88.6 | Confident | 49 Ų | 49 | 61.4 Ų | 61.4 | 41% | 0.405 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -62.2 | -44.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | S9 A10 L11 Q16 T17 | S9-A13 WeakPolarHBondContact O-CB 3.35Å; S9-A13 PolarHBondContact O-N 3.06Å; A10-A13 PolarHBondContact O-N 3.11Å; L11-A13 VanDerWaalsContact C-N 3.34Å; L11-A13 PolarHBondContact O-N 3.33Å; A13-Q16 PolarHBondContact O-N 2.9Å; A13-T17 VanDerWaalsContact O-CG2 3.32Å; A13-T17 WeakPolarHBondContact O-CG2 3.39Å; A13-T17 PolarHBondContact O-N 2.9Å; A13-T17 PolarHBondContact O-OG1 3.13Å |
| 14 | F | 92.7 | Very high | 88.5 | Confident | 22 Ų | 22 | 61 Ų | 61 | 10% | 0.096 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -60.9 | -49.2 | 177.4 | 177.6 | -101.2 | 0 | 0 | 0 | 111.8 | A10 L11 Q16 T17 H18 F68 I71 M75 I76 M79 | A10-F14 WeakPolarHBondContact O-CB 3.19Å; A10-F14 PolarHBondContact O-N 2.69Å; L11-F14 PolarHBondContact O-N 2.9Å; F14-Q16 VanDerWaalsContact C-N 3.34Å; F14-Q16 PolarHBondContact O-N 3.15Å; F14-T17 PolarHBondContact O-N 3.04Å; F14-T17 VanDerWaalsContact O-N 3.15Å; F14-T17 PolarHBondContact O-OG1 2.64Å; F14-H18 AromaticContact CD2-CD2 3.62Å; F14-H18 AromaticContact CD2-NE2 3.87Å; F14-H18 AromaticContact CE2-CD2 3.36Å; F14-H18 WeakPolarHBondContact CE2-CD2 3.35Å; F14-H18 AromaticContact CE2-NE2 3.44Å; F14-H18 WeakPolarHBondContact CE2-NE2 3.39Å; F14-H18 AromaticContact CZ-CD2 3.68Å; F14-H18 PolarHBondContact O-CD2 3.03Å; F14-H18 PolarHBondContact O-N 3.44Å; F14-F68 HydrophobicContact CD1-CE2 4.23Å; F14-F68 HydrophobicContact CE1-CE2 4.02Å; F14-F68 HydrophobicContact CE1-CZ 4.17Å; F14-I71 HydrophobicContact CE1-CD1 3.82Å; F14-I71 HydrophobicContact CE1-CG2 4.27Å; F14-I71 HydrophobicContact CZ-CD1 4.38Å; F14-I71 HydrophobicContact CZ-CG2 3.82Å; F14-M75 HydrophobicContact CE2-CB 4.44Å; F14-M75 HydrophobicContact CZ-CB 4.45Å; F14-I76 HydrophobicContact CZ-CG1 4.33Å; F14-M79 HydrophobicContact CB-CG 4.07Å; F14-M79 HydrophobicContact CB-SD 3.82Å; F14-M79 HydrophobicContact CD1-CG 4.22Å; F14-M79 HydrophobicContact CD1-SD 3.36Å; F14-M79 WeakPolarHBondContact CD1-SD 3.46Å; F14-M79 HydrophobicContact CD2-CB 3.77Å; F14-M79 HydrophobicContact CD2-CG 3.7Å; F14-M79 HydrophobicContact CD2-SD 3.98Å; F14-M79 HydrophobicContact CE1-SD 3.79Å; F14-M79 HydrophobicContact CE2-CB 3.69Å; F14-M79 HydrophobicContact CE2-CG 4.11Å; F14-M79 HydrophobicContact CE2-SD 4.36Å; F14-M79 HydrophobicContact CG-CB 4.26Å; F14-M79 HydrophobicContact CG-CG 3.74Å; F14-M79 HydrophobicContact CG-SD 3.44Å; F14-M79 WeakPolarHBondContact CG-SD 3.5Å; F14-M79 HydrophobicContact CZ-CB 4.11Å; F14-M79 HydrophobicContact CZ-SD 4.25Å |
| 15 | V | 90.9 | Very high | 88.4 | Confident | 0 Ų | 0 | 63.6 Ų | 63.6 | 0% | 0 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -62.4 | -43.1 | 178.9 | 179.7 | 0 | 0 | 0 | 0 | 110.6 | L11 L12 T17 H18 L19 A22 L24 V65 F68 | L11-V15 WeakPolarHBondContact O-CG2 3.44Å; L11-V15 PolarHBondContact O-N 3.22Å; L12-V15 PolarHBondContact O-N 3.07Å; V15-T17 VanDerWaalsContact C-N 3.26Å; V15-T17 PolarHBondContact O-N 2.81Å; V15-H18 PolarHBondContact O-N 2.74Å; V15-L19 HydrophobicContact CG1-CB 4.23Å; V15-L19 HydrophobicContact CG1-CD1 4.36Å; V15-L19 CarbonylContact O-C 3.54Å; V15-L19 WeakPolarHBondContact O-CA 3.09Å; V15-L19 WeakPolarHBondContact O-CB 3.28Å; V15-L19 PolarHBondContact O-N 3.49Å; V15-A22 HydrophobicContact CG1-CB 3.77Å; V15-L24 HydrophobicContact CB-CD2 3.91Å; V15-L24 HydrophobicContact CG1-CD2 3.45Å; V15-L24 VanDerWaalsContact CG1-CD2 3.45Å; V15-V65 HydrophobicContact CG1-CG1 3.54Å; V15-V65 HydrophobicContact CG2-CG1 4.39Å; V15-F68 HydrophobicContact CG2-CD2 4.1Å; V15-F68 HydrophobicContact CG2-CE2 3.93Å |
| 16 | Q | 89.3 | Confident | 88.1 | Confident | 118 Ų | 118 | 56.6 Ų | 56.6 | 55% | 0.551 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -62.4 | -31.7 | 177 | -73.7 | 175.5 | 1.4 | 0 | 0 | 113.4 | L12 A13 F14 L24 | L12-Q16 WeakPolarHBondContact O-CB 3.3Å; L12-Q16 VanDerWaalsContact O-CG 3.22Å; L12-Q16 WeakPolarHBondContact O-CG 3.32Å; L12-Q16 PolarHBondContact O-N 3.13Å; A13-Q16 PolarHBondContact O-N 2.9Å; F14-Q16 VanDerWaalsContact C-N 3.34Å; F14-Q16 PolarHBondContact O-N 3.15Å; Q16-L24 HydrophobicContact CG-CD1 3.8Å |
| 17 | T | 90.9 | Very high | 88 | Confident | 99 Ų | 99 | 55.7 Ų | 55.7 | 61% | 0.607 | 33% | 0.33 | S | S | * | . | H | α-helix | trans | -73.1 | -32.2 | 177.5 | 54.1 | 0 | 0 | 0 | 0 | 113.6 | A13 F14 V15 | A13-T17 VanDerWaalsContact O-CG2 3.32Å; A13-T17 WeakPolarHBondContact O-CG2 3.39Å; A13-T17 PolarHBondContact O-N 2.9Å; A13-T17 PolarHBondContact O-OG1 3.13Å; F14-T17 PolarHBondContact O-N 3.04Å; F14-T17 VanDerWaalsContact O-N 3.15Å; F14-T17 PolarHBondContact O-OG1 2.64Å; V15-T17 VanDerWaalsContact C-N 3.26Å; V15-T17 PolarHBondContact O-N 2.81Å |
| 18 | H | 88.6 | Confident | 88 | Confident | 65 Ų | 65 | 59.4 Ų | 59.4 | 30% | 0.301 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -100.7 | -24.2 | -176.9 | -70.2 | -64.1 | 0 | 0 | 0 | 113.5 | F14 V15 I71 M75 | F14-H18 AromaticContact CD2-CD2 3.62Å; F14-H18 AromaticContact CD2-NE2 3.87Å; F14-H18 AromaticContact CE2-CD2 3.36Å; F14-H18 WeakPolarHBondContact CE2-CD2 3.35Å; F14-H18 AromaticContact CE2-NE2 3.44Å; F14-H18 WeakPolarHBondContact CE2-NE2 3.39Å; F14-H18 AromaticContact CZ-CD2 3.68Å; F14-H18 PolarHBondContact O-CD2 3.03Å; F14-H18 PolarHBondContact O-N 3.44Å; V15-H18 PolarHBondContact O-N 2.74Å; H18-I71 HydrophobicContact CB-CD1 3.8Å; H18-I71 HydrophobicContact CB-CG1 4Å; H18-M75 WeakPolarHBondContact CE1-CE 3.42Å; H18-M75 PolarHBondContact CE1-SD 3.09Å |
| 19 | L | 88.9 | Confident | 88 | Confident | 35 Ų | 35 | 64.4 Ų | 64.4 | 18% | 0.183 | 37% | 0.371 | C | S | . | . | trans | -140.2 | 80.5 | -176.6 | -60 | 171.8 | 0 | 0 | 0 | 109.6 | V15 E21 A22 V65 I71 | V15-L19 HydrophobicContact CG1-CB 4.23Å; V15-L19 HydrophobicContact CG1-CD1 4.36Å; V15-L19 CarbonylContact O-C 3.54Å; V15-L19 WeakPolarHBondContact O-CA 3.09Å; V15-L19 WeakPolarHBondContact O-CB 3.28Å; V15-L19 PolarHBondContact O-N 3.49Å; L19-E21 PolarHBondContact O-N 3.45Å; L19-A22 HydrophobicContact CB-CB 3.74Å; L19-A22 WeakPolarHBondContact O-CB 3.48Å; L19-A22 PolarHBondContact O-N 2.94Å; L19-A22 VanDerWaalsContact O-N 3.16Å; L19-V65 HydrophobicContact CD1-CG1 4.02Å; L19-I71 HydrophobicContact CD1-CD1 4.17Å; L19-I71 HydrophobicContact CG-CD1 4.44Å | ||
| 20 | P | 81.1 | Confident | 88 | Confident | 113 Ų | 113 | 66 Ų | 66 | 73% | 0.734 | 38% | 0.378 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.5 | -17.4 | -177 | 27.2 | -35.2 | 0 | 0 | 0 | 113.7 | ||
| 21 | E | 82.6 | Confident | 88.1 | Confident | 191 Ų | 191 | 65 Ų | 65 | 89% | 0.893 | 37% | 0.369 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98.7 | 2.3 | 178.1 | -63 | -177.1 | 177.1 | 0 | 0 | 113.1 | L19 D23 | L19-E21 PolarHBondContact O-N 3.45Å; E21-D23 PolarHBondContact O-N 3.15Å |
| 22 | A | 83.6 | Confident | 88.1 | Confident | 24 Ų | 24 | 66.3 Ų | 66.3 | 20% | 0.198 | 38% | 0.375 | C | S | . | . | trans | -66.9 | 131.9 | -178.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | V15 L19 L24 V65 | V15-A22 HydrophobicContact CG1-CB 3.77Å; L19-A22 HydrophobicContact CB-CB 3.74Å; L19-A22 WeakPolarHBondContact O-CB 3.48Å; L19-A22 PolarHBondContact O-N 2.94Å; L19-A22 VanDerWaalsContact O-N 3.16Å; A22-L24 HydrophobicContact CB-CD2 4.27Å; A22-L24 PolarHBondContact O-N 3.02Å; A22-V65 HydrophobicContact CB-CG1 4.06Å | ||
| 23 | D | 83.5 | Confident | 88.2 | Confident | 104 Ų | 104 | 66.2 Ų | 66.2 | 56% | 0.556 | 38% | 0.379 | S | S | * | . | trans | -78 | 115.4 | 167.5 | -174.8 | 6.9 | 0 | 0 | 0 | 109.3 | E21 S25 | E21-D23 PolarHBondContact O-N 3.15Å; D23-S25 WeakPolarHBondContact OD1-CB 3.03Å; D23-S25 PolarHBondContact OD1-N 2.93Å; D23-S25 PolarHBondContact OD1-OG 2.76Å; D23-S25 PolarHBondContact OD2-OG 2.9Å | ||
| 24 | L | 83.1 | Confident | 88.2 | Confident | 33 Ų | 33 | 68 Ų | 68 | 17% | 0.173 | 38% | 0.375 | C | S | . | . | trans | -97.1 | 2.5 | -178.1 | -55.3 | 172.6 | 0 | 0 | 0 | 112.1 | L12 V15 Q16 A22 G26 L27 | L12-L24 HydrophobicContact CD2-CB 3.77Å; L12-L24 HydrophobicContact CD2-CD1 3.6Å; L12-L24 HydrophobicContact CD2-CD2 4.24Å; L12-L24 HydrophobicContact CD2-CG 4.06Å; V15-L24 HydrophobicContact CB-CD2 3.91Å; V15-L24 HydrophobicContact CG1-CD2 3.45Å; V15-L24 VanDerWaalsContact CG1-CD2 3.45Å; Q16-L24 HydrophobicContact CG-CD1 3.8Å; A22-L24 HydrophobicContact CB-CD2 4.27Å; A22-L24 PolarHBondContact O-N 3.02Å; L24-G26 PolarHBondContact O-N 2.87Å; L24-L27 HydrophobicContact CB-CD1 4.42Å; L24-L27 HydrophobicContact CD2-CD1 4.02Å; L24-L27 PolarHBondContact O-N 2.73Å | ||
| 25 | S | 83.6 | Confident | 88.2 | Confident | 97 Ų | 97 | 67 Ų | 67 | 68% | 0.678 | 37% | 0.371 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.1 | -20.4 | -178.3 | 67.7 | 0 | 0 | 0 | 0 | 113.5 | D23 | D23-S25 WeakPolarHBondContact OD1-CB 3.03Å; D23-S25 PolarHBondContact OD1-N 2.93Å; D23-S25 PolarHBondContact OD1-OG 2.76Å; D23-S25 PolarHBondContact OD2-OG 2.9Å |
| 26 | G | 81.9 | Confident | 88.2 | Confident | 35 Ų | 35 | 68 Ų | 68 | 36% | 0.361 | 38% | 0.376 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80.1 | -8.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 115.2 | L24 D28 | L24-G26 PolarHBondContact O-N 2.87Å; G26-D28 PolarHBondContact O-N 2.88Å |
| 27 | L | 89.8 | Confident | 88.3 | Confident | 17 Ų | 17 | 63.6 Ų | 63.6 | 9% | 0.089 | 36% | 0.363 | C | S | . | . | trans | -83.8 | 106 | 176.5 | -68.7 | 171.8 | 0 | 0 | 0 | 110.1 | L11 L12 L24 I31 F32 M61 V65 | L11-L27 HydrophobicContact CD2-CD2 4.43Å; L12-L27 HydrophobicContact CD2-CD1 3.79Å; L24-L27 HydrophobicContact CB-CD1 4.42Å; L24-L27 HydrophobicContact CD2-CD1 4.02Å; L24-L27 PolarHBondContact O-N 2.73Å; L27-I31 HydrophobicContact CD2-CB 4.33Å; L27-I31 HydrophobicContact CD2-CG2 3.69Å; L27-F32 HydrophobicContact CB-CE1 4.2Å; L27-F32 HydrophobicContact CB-CZ 3.81Å; L27-M61 HydrophobicContact CD2-CE 4.25Å; L27-V65 HydrophobicContact CD1-CG2 4.11Å; L27-V65 HydrophobicContact CD2-CG2 4.07Å; L27-V65 HydrophobicContact CG-CG2 4.15Å | ||
| 28 | D | 90.8 | Very high | 88.3 | Confident | 78 Ų | 78 | 59.5 Ų | 59.5 | 42% | 0.417 | 34% | 0.338 | S | S | . | . | trans | -107.4 | -179.6 | 178.9 | 71.9 | 6.9 | 0 | 0 | 0 | 112.7 | G26 V30 I31 F32 | G26-D28 PolarHBondContact O-N 2.88Å; D28-V30 PolarHBondContact O-N 3.26Å; D28-V30 WeakPolarHBondContact OD1-CA 3.26Å; D28-V30 VanDerWaalsContact OD1-CB 3.3Å; D28-V30 WeakPolarHBondContact OD1-CB 3.32Å; D28-V30 PolarHBondContact OD1-N 3.2Å; D28-I31 PolarHBondContact O-N 3.16Å; D28-I31 WeakPolarHBondContact OD1-CG1 3.29Å; D28-I31 PolarHBondContact OD1-N 3.43Å; D28-F32 WeakPolarHBondContact O-CD2 3.08Å; D28-F32 WeakPolarHBondContact O-CE2 3.41Å; D28-F32 WeakPolarHBondContact O-CG 3.46Å; D28-F32 PolarHBondContact O-N 3.44Å; D28-F32 VanDerWaalsContact O-N 3.12Å | ||
| 29 | E | 90.9 | Very high | 88.3 | Confident | 124 Ų | 124 | 56.6 Ų | 56.6 | 58% | 0.579 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -57.4 | -34.7 | 177.1 | -170.9 | 175.3 | -177.8 | 0 | 0 | 112.3 | I31 F32 S33 | E29-I31 PolarHBondContact O-N 3.11Å; E29-F32 PolarHBondContact O-N 3.09Å; E29-S33 PolarHBondContact O-N 3.34Å; E29-S33 PolarHBondContact O-OG 2.99Å |
| 30 | V | 92.1 | Very high | 88.2 | Confident | 103 Ų | 103 | 60.5 Ų | 60.5 | 62% | 0.624 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -65.3 | -42.6 | -179.8 | -176.6 | 0 | 0 | 0 | 0 | 110.5 | D28 S33 Y34 | D28-V30 PolarHBondContact O-N 3.26Å; D28-V30 WeakPolarHBondContact OD1-CA 3.26Å; D28-V30 VanDerWaalsContact OD1-CB 3.3Å; D28-V30 WeakPolarHBondContact OD1-CB 3.32Å; D28-V30 PolarHBondContact OD1-N 3.2Å; V30-S33 PolarHBondContact O-N 3.32Å; V30-Y34 PolarHBondContact O-N 3.19Å |
| 31 | I | 92.4 | Very high | 88.4 | Confident | 5 Ų | 5 | 62.3 Ų | 62.3 | 3% | 0.026 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -66.2 | -41.6 | 175.9 | -56.7 | -51.3 | 0 | 0 | 0 | 111.1 | L27 D28 E29 S33 Y34 V35 M61 Y64 | L27-I31 HydrophobicContact CD2-CB 4.33Å; L27-I31 HydrophobicContact CD2-CG2 3.69Å; D28-I31 PolarHBondContact O-N 3.16Å; D28-I31 WeakPolarHBondContact OD1-CG1 3.29Å; D28-I31 PolarHBondContact OD1-N 3.43Å; E29-I31 PolarHBondContact O-N 3.11Å; I31-S33 VanDerWaalsContact C-N 3.33Å; I31-S33 PolarHBondContact O-N 2.73Å; I31-Y34 PolarHBondContact O-N 3.19Å; I31-V35 HydrophobicContact CG2-CG2 4.26Å; I31-V35 VanDerWaalsContact O-CG2 3.28Å; I31-V35 WeakPolarHBondContact O-CG2 3.47Å; I31-V35 PolarHBondContact O-N 3.06Å; I31-M61 HydrophobicContact CG2-SD 4.36Å; I31-Y64 HydrophobicContact CD1-CD1 3.96Å; I31-Y64 HydrophobicContact CD1-CD2 3.82Å; I31-Y64 HydrophobicContact CD1-CE1 3.56Å; I31-Y64 HydrophobicContact CD1-CE2 3.43Å; I31-Y64 VanDerWaalsContact CD1-CE2 3.43Å; I31-Y64 HydrophobicContact CD1-CG 4.1Å; I31-Y64 HydrophobicContact CG1-CD1 3.95Å; I31-Y64 HydrophobicContact CG1-CD2 4.33Å; I31-Y64 HydrophobicContact CG1-CE1 3.96Å; I31-Y64 HydrophobicContact CG1-CE2 4.37Å; I31-Y64 HydrophobicContact CG1-CG 4.16Å |
| 32 | F | 91.6 | Very high | 88.3 | Confident | 28 Ų | 28 | 54.1 Ų | 54.1 | 12% | 0.123 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -64.3 | -37.4 | 176.3 | -59.8 | -48.1 | 0 | 0 | 0 | 112.5 | L11 L27 D28 E29 L36 | L11-F32 HydrophobicContact CD2-CD1 4.3Å; L11-F32 HydrophobicContact CD2-CE1 4.1Å; L27-F32 HydrophobicContact CB-CE1 4.2Å; L27-F32 HydrophobicContact CB-CZ 3.81Å; D28-F32 WeakPolarHBondContact O-CD2 3.08Å; D28-F32 WeakPolarHBondContact O-CE2 3.41Å; D28-F32 WeakPolarHBondContact O-CG 3.46Å; D28-F32 PolarHBondContact O-N 3.44Å; D28-F32 VanDerWaalsContact O-N 3.12Å; E29-F32 PolarHBondContact O-N 3.09Å; F32-L36 VanDerWaalsContact O-CB 3.22Å; F32-L36 WeakPolarHBondContact O-CB 3.4Å; F32-L36 PolarHBondContact O-N 2.86Å |
| 33 | S | 92.1 | Very high | 87.7 | Confident | 51 Ų | 51 | 53.9 Ų | 53.9 | 36% | 0.357 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -66.8 | -39.6 | 173.6 | -58.2 | 0 | 0 | 0 | 0 | 112.3 | E29 V30 I31 L36 G37 | E29-S33 PolarHBondContact O-N 3.34Å; E29-S33 PolarHBondContact O-OG 2.99Å; V30-S33 PolarHBondContact O-N 3.32Å; I31-S33 VanDerWaalsContact C-N 3.33Å; I31-S33 PolarHBondContact O-N 2.73Å; S33-L36 PolarHBondContact O-N 3.19Å; S33-G37 PolarHBondContact O-N 3.15Å |
| 34 | Y | 92.9 | Very high | 86.9 | Confident | 85 Ų | 85 | 53.3 Ų | 53.3 | 33% | 0.333 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -61.2 | -51.1 | 174.2 | 168.3 | -104 | 0 | 0 | 0 | 111.4 | V30 I31 L36 G37 V38 F57 M60 | V30-Y34 PolarHBondContact O-N 3.19Å; I31-Y34 PolarHBondContact O-N 3.19Å; Y34-L36 VanDerWaalsContact C-N 3.28Å; Y34-L36 PolarHBondContact O-N 3.23Å; Y34-G37 PolarHBondContact O-N 3.03Å; Y34-G37 VanDerWaalsContact O-N 3.17Å; Y34-V38 HydrophobicContact CD2-CG2 4.3Å; Y34-V38 HydrophobicContact CE1-CG2 4.07Å; Y34-V38 HydrophobicContact CE2-CG2 3.81Å; Y34-V38 WeakPolarHBondContact O-CG2 3.45Å; Y34-V38 PolarHBondContact O-N 3.12Å; Y34-F57 HydrophobicContact CE1-CD2 4.2Å; Y34-F57 HydrophobicContact CE1-CE2 4.5Å; Y34-M60 HydrophobicContact CE1-CB 4.34Å; Y34-M60 HydrophobicContact CE1-CE 4.39Å |
| 35 | V | 92.1 | Very high | 86.2 | Confident | 2 Ų | 2 | 56.8 Ų | 56.8 | 1% | 0.012 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -61.7 | -39.1 | 178.6 | 175.8 | 0 | 0 | 0 | 0 | 110.7 | V7 L11 I31 V38 L39 F57 M61 | V7-V35 HydrophobicContact CG1-CB 4.05Å; V7-V35 HydrophobicContact CG1-CG1 3.65Å; L11-V35 HydrophobicContact CD2-CG2 4.36Å; I31-V35 HydrophobicContact CG2-CG2 4.26Å; I31-V35 VanDerWaalsContact O-CG2 3.28Å; I31-V35 WeakPolarHBondContact O-CG2 3.47Å; I31-V35 PolarHBondContact O-N 3.06Å; V35-V38 PolarHBondContact O-N 2.84Å; V35-L39 HydrophobicContact CG1-CD1 3.93Å; V35-L39 HydrophobicContact CG1-CG 4.42Å; V35-L39 WeakPolarHBondContact O-CB 3.44Å; V35-L39 WeakPolarHBondContact O-CG 3.42Å; V35-L39 PolarHBondContact O-N 3.14Å; V35-F57 HydrophobicContact CG2-CE2 4.22Å; V35-M61 HydrophobicContact CG2-SD 4.08Å |
| 36 | L | 91.3 | Very high | 85.5 | Confident | 20 Ų | 20 | 52.4 Ų | 52.4 | 11% | 0.105 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -61.1 | -47 | 174.6 | -179.3 | 63.3 | 0 | 0 | 0 | 111.6 | L3 E4 V7 F32 S33 Y34 V38 L39 E40 L87 | L3-L36 HydrophobicContact CB-CD1 4.26Å; L3-L36 HydrophobicContact CB-CD2 4.39Å; E4-L36 HydrophobicContact CG-CD2 3.9Å; V7-L36 HydrophobicContact CG2-CB 4.4Å; V7-L36 HydrophobicContact CG2-CD1 3.96Å; F32-L36 VanDerWaalsContact O-CB 3.22Å; F32-L36 WeakPolarHBondContact O-CB 3.4Å; F32-L36 PolarHBondContact O-N 2.86Å; S33-L36 PolarHBondContact O-N 3.19Å; Y34-L36 VanDerWaalsContact C-N 3.28Å; Y34-L36 PolarHBondContact O-N 3.23Å; L36-V38 PolarHBondContact O-N 3.39Å; L36-L39 PolarHBondContact O-N 2.98Å; L36-L39 VanDerWaalsContact O-N 3.16Å; L36-E40 WeakPolarHBondContact O-CG 3.48Å; L36-E40 PolarHBondContact O-N 3.43Å; L36-L87 HydrophobicContact CD1-CD1 3.69Å; L36-L87 HydrophobicContact CD1-CD2 4.11Å |
| 37 | G | 90.6 | Very high | 85.2 | Confident | 26 Ų | 26 | 52.3 Ų | 52.3 | 27% | 0.268 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -60.8 | -43.2 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | S33 Y34 L39 E40 D41 | S33-G37 PolarHBondContact O-N 3.15Å; Y34-G37 PolarHBondContact O-N 3.03Å; Y34-G37 VanDerWaalsContact O-N 3.17Å; G37-L39 VanDerWaalsContact C-N 3.3Å; G37-L39 PolarHBondContact O-N 3.38Å; G37-E40 WeakPolarHBondContact O-CB 3.28Å; G37-E40 PolarHBondContact O-N 3.28Å; G37-E40 VanDerWaalsContact O-N 3.15Å; G37-D41 PolarHBondContact O-N 3.42Å |
| 38 | V | 91.1 | Very high | 84.2 | Confident | 14 Ų | 14 | 53.8 Ų | 53.8 | 9% | 0.085 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -58.1 | -42.7 | 173.8 | 166.5 | 0 | 0 | 0 | 0 | 111.6 | Y34 V35 L36 E40 D41 L42 F52 F57 M80 | Y34-V38 HydrophobicContact CD2-CG2 4.3Å; Y34-V38 HydrophobicContact CE1-CG2 4.07Å; Y34-V38 HydrophobicContact CE2-CG2 3.81Å; Y34-V38 WeakPolarHBondContact O-CG2 3.45Å; Y34-V38 PolarHBondContact O-N 3.12Å; V35-V38 PolarHBondContact O-N 2.84Å; L36-V38 PolarHBondContact O-N 3.39Å; V38-E40 VanDerWaalsContact C-N 3.34Å; V38-D41 PolarHBondContact O-N 2.96Å; V38-L42 HydrophobicContact CG1-CD1 4.15Å; V38-L42 VanDerWaalsContact O-CG 3.3Å; V38-L42 WeakPolarHBondContact O-CG 3.26Å; V38-L42 PolarHBondContact O-N 2.97Å; V38-L42 VanDerWaalsContact O-N 3.15Å; V38-F52 HydrophobicContact CG1-CD2 4.22Å; V38-F52 HydrophobicContact CG1-CE2 3.29Å; V38-F52 HydrophobicContact CG1-CZ 3.68Å; V38-F57 HydrophobicContact CG1-CD2 4.27Å; V38-M80 HydrophobicContact CG1-CE 3.37Å |
| 39 | L | 89.6 | Confident | 83 | Confident | 4 Ų | 4 | 56.9 Ų | 56.9 | 2% | 0.021 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -70.8 | -29.5 | 178.9 | -69 | 168.4 | 0 | 0 | 0 | 112.8 | V7 V35 L36 G37 L42 G43 M80 L83 L87 | V7-L39 HydrophobicContact CG2-CD1 4.17Å; V35-L39 HydrophobicContact CG1-CD1 3.93Å; V35-L39 HydrophobicContact CG1-CG 4.42Å; V35-L39 WeakPolarHBondContact O-CB 3.44Å; V35-L39 WeakPolarHBondContact O-CG 3.42Å; V35-L39 PolarHBondContact O-N 3.14Å; L36-L39 PolarHBondContact O-N 2.98Å; L36-L39 VanDerWaalsContact O-N 3.16Å; G37-L39 VanDerWaalsContact C-N 3.3Å; G37-L39 PolarHBondContact O-N 3.38Å; L39-L42 HydrophobicContact CD2-CD1 4.38Å; L39-G43 PolarHBondContact O-N 3.34Å; L39-M80 HydrophobicContact CD2-CB 4Å; L39-M80 HydrophobicContact CD2-CE 4.29Å; L39-M80 HydrophobicContact CD2-CG 4.43Å; L39-M80 VanDerWaalsContact CD2-O 3.28Å; L39-M80 WeakPolarHBondContact CD2-O 3.46Å; L39-L83 HydrophobicContact CD1-CB 3.84Å; L39-L83 HydrophobicContact CD1-CD1 4.23Å; L39-L83 HydrophobicContact CD2-CB 4.06Å; L39-L87 HydrophobicContact CB-CD1 3.91Å; L39-L87 HydrophobicContact CD1-CD1 3.74Å; L39-L87 HydrophobicContact CG-CD1 4.47Å |
| 40 | E | 86.4 | Confident | 81.8 | Confident | 117 Ų | 117 | 59.9 Ų | 59.9 | 55% | 0.547 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -68.3 | -40.9 | 173.5 | -73.6 | -179 | 169.6 | 0 | 0 | 111.8 | L36 G37 V38 G43 | L36-E40 WeakPolarHBondContact O-CG 3.48Å; L36-E40 PolarHBondContact O-N 3.43Å; G37-E40 WeakPolarHBondContact O-CB 3.28Å; G37-E40 PolarHBondContact O-N 3.28Å; G37-E40 VanDerWaalsContact O-N 3.15Å; V38-E40 VanDerWaalsContact C-N 3.34Å; E40-G43 PolarHBondContact O-N 3.44Å |
| 41 | D | 84.2 | Confident | 80.8 | Confident | 151 Ų | 151 | 61.4 Ų | 61.4 | 81% | 0.807 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -69.7 | -33.1 | 179 | -71.2 | -20.7 | 0 | 0 | 0 | 112.5 | G37 V38 G43 | G37-D41 PolarHBondContact O-N 3.42Å; V38-D41 PolarHBondContact O-N 2.96Å; D41-G43 VanDerWaalsContact C-N 3.34Å; D41-G43 PolarHBondContact O-N 3.06Å |
| 42 | L | 80.9 | Confident | 80.5 | Confident | 18 Ų | 18 | 62.7 Ų | 62.7 | 9% | 0.094 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -67.6 | -31.3 | 177.2 | -80.3 | 175 | 0 | 0 | 0 | 113.7 | V38 L39 P47 F52 M80 | V38-L42 HydrophobicContact CG1-CD1 4.15Å; V38-L42 VanDerWaalsContact O-CG 3.3Å; V38-L42 WeakPolarHBondContact O-CG 3.26Å; V38-L42 PolarHBondContact O-N 2.97Å; V38-L42 VanDerWaalsContact O-N 3.15Å; L39-L42 HydrophobicContact CD2-CD1 4.38Å; L42-P47 HydrophobicContact CD1-CB 4.41Å; L42-P47 VanDerWaalsContact CD2-CA 3.47Å; L42-P47 HydrophobicContact CD2-CB 3.86Å; L42-F52 HydrophobicContact CD1-CD2 4.37Å; L42-F52 HydrophobicContact CD1-CE2 4.49Å; L42-F52 HydrophobicContact CD1-CG 4.43Å; L42-F52 HydrophobicContact CD2-CB 3.47Å; L42-F52 VanDerWaalsContact CD2-CB 3.47Å; L42-F52 HydrophobicContact CD2-CD1 4.26Å; L42-F52 HydrophobicContact CD2-CD2 3.91Å; L42-F52 HydrophobicContact CD2-CG 3.61Å; L42-F52 HydrophobicContact CG-CD2 4.19Å; L42-F52 HydrophobicContact CG-CG 4.32Å; L42-M80 HydrophobicContact CD1-CB 4.38Å; L42-M80 HydrophobicContact CD1-CE 3.38Å; L42-M80 HydrophobicContact CD1-SD 4.31Å |
| 43 | G | 70.3 | Confident | 80.4 | Confident | 20 Ų | 20 | 66.1 Ų | 66.1 | 21% | 0.206 | 37% | 0.372 | C | S | . | . | trans | 59.6 | -172.5 | -173.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | L39 E40 D41 S45 G46 S84 | L39-G43 PolarHBondContact O-N 3.34Å; E40-G43 PolarHBondContact O-N 3.44Å; D41-G43 VanDerWaalsContact C-N 3.34Å; D41-G43 PolarHBondContact O-N 3.06Å; G43-S45 PolarHBondContact O-N 2.96Å; G43-G46 PolarHBondContact O-N 3.3Å; G43-S84 VanDerWaalsContact C-OG 3.26Å; G43-S84 PolarHBondContact O-OG 2.89Å | ||
| 44 | P | 68.2 | Low | 80.2 | Confident | 91 Ų | 91 | 65 Ų | 65 | 59% | 0.591 | 36% | 0.361 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.8 | -14.5 | -174.1 | 28.2 | -34.2 | 0 | 0 | 0 | 113.8 | G46 | P44-G46 VanDerWaalsContact C-N 3.25Å; P44-G46 PolarHBondContact O-N 3.12Å |
| 45 | S | 68 | Low | 80.1 | Confident | 106 Ų | 106 | 66.9 Ų | 66.9 | 74% | 0.741 | 38% | 0.377 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.5 | -18 | -178.8 | -54.7 | 0 | 0 | 0 | 0 | 113 | G43 Q81 | G43-S45 PolarHBondContact O-N 2.96Å; S45-Q81 PolarHBondContact O-NE2 2.85Å |
| 46 | G | 68.5 | Low | 80.1 | Confident | 6 Ų | 6 | 68.6 Ų | 68.6 | 6% | 0.062 | 39% | 0.391 | C | S | . | . | trans | 80.7 | 175.9 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | G43 P44 S48 | G43-G46 PolarHBondContact O-N 3.3Å; P44-G46 VanDerWaalsContact C-N 3.25Å; P44-G46 PolarHBondContact O-N 3.12Å; G46-S48 PolarHBondContact O-N 3.24Å | ||
| 47 | P | 74.7 | Confident | 80.2 | Confident | 32 Ų | 32 | 67.7 Ų | 67.7 | 21% | 0.208 | 39% | 0.387 | C | S | . | . | trans | -67.6 | 124.3 | -179.6 | 26.7 | -31.7 | 0 | 0 | 0 | 111.6 | L42 F52 M54 M80 | L42-P47 HydrophobicContact CD1-CB 4.41Å; L42-P47 VanDerWaalsContact CD2-CA 3.47Å; L42-P47 HydrophobicContact CD2-CB 3.86Å; P47-F52 HydrophobicContact CB-CB 4.19Å; P47-F52 HydrophobicContact CB-CD1 3.59Å; P47-F52 HydrophobicContact CB-CE1 4.34Å; P47-F52 HydrophobicContact CB-CG 4.18Å; P47-M54 HydrophobicContact CB-CE 4.02Å; P47-M54 HydrophobicContact CG-CE 3.98Å; P47-M80 HydrophobicContact CG-CB 4.42Å | ||
| 48 | S | 70.6 | Confident | 80.3 | Confident | 49 Ų | 49 | 67.3 Ų | 67.3 | 34% | 0.343 | 38% | 0.379 | S | S | . | . | trans | -111.6 | 148.5 | 165.7 | 62.7 | 0 | 0 | 0 | 0 | 109.8 | G46 E50 N51 F52 | G46-S48 PolarHBondContact O-N 3.24Å; S48-E50 PolarHBondContact O-N 3.01Å; S48-N51 PolarHBondContact O-N 3.45Å; S48-N51 VanDerWaalsContact OG-CB 3.3Å; S48-N51 WeakPolarHBondContact OG-CB 3.17Å; S48-N51 VanDerWaalsContact OG-CG 3.32Å; S48-N51 PolarHBondContact OG-N 3.35Å; S48-F52 PolarHBondContact O-N 3.41Å | ||
| 49 | D | 64.3 | Low | 80.4 | Confident | 142 Ų | 142 | 73.9 Ų | 73.9 | 76% | 0.759 | 41% | 0.409 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.4 | -20.9 | -178.8 | -71.9 | -14 | 0 | 0 | 0 | 113 | ||
| 50 | E | 65.8 | Low | 80.6 | Confident | 188 Ų | 188 | 77 Ų | 77 | 88% | 0.879 | 42% | 0.424 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.3 | -22.6 | 177.6 | -61 | -163.9 | 146.9 | 0 | 0 | 114 | S48 | S48-E50 PolarHBondContact O-N 3.01Š|
| 51 | N | 71.9 | Confident | 80.9 | Confident | 134 Ų | 134 | 71.5 Ų | 71.5 | 72% | 0.717 | 40% | 0.399 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -107.3 | -17.7 | -174.1 | -67 | 14.6 | 0 | 0 | 0 | 113.1 | S48 | S48-N51 PolarHBondContact O-N 3.45Å; S48-N51 VanDerWaalsContact OG-CB 3.3Å; S48-N51 WeakPolarHBondContact OG-CB 3.17Å; S48-N51 VanDerWaalsContact OG-CG 3.32Å; S48-N51 PolarHBondContact OG-N 3.35Å |
| 52 | F | 85.3 | Confident | 81.3 | Confident | 32 Ų | 32 | 67.4 Ų | 67.4 | 14% | 0.14 | 38% | 0.375 | C | S | . | . | trans | -145.7 | 126 | -171.5 | -178.6 | -109.2 | 0 | 0 | 0 | 113.2 | V38 L42 P47 S48 M54 F57 M80 | V38-F52 HydrophobicContact CG1-CD2 4.22Å; V38-F52 HydrophobicContact CG1-CE2 3.29Å; V38-F52 HydrophobicContact CG1-CZ 3.68Å; L42-F52 HydrophobicContact CD1-CD2 4.37Å; L42-F52 HydrophobicContact CD1-CE2 4.49Å; L42-F52 HydrophobicContact CD1-CG 4.43Å; L42-F52 HydrophobicContact CD2-CB 3.47Å; L42-F52 VanDerWaalsContact CD2-CB 3.47Å; L42-F52 HydrophobicContact CD2-CD1 4.26Å; L42-F52 HydrophobicContact CD2-CD2 3.91Å; L42-F52 HydrophobicContact CD2-CG 3.61Å; L42-F52 HydrophobicContact CG-CD2 4.19Å; L42-F52 HydrophobicContact CG-CG 4.32Å; P47-F52 HydrophobicContact CB-CB 4.19Å; P47-F52 HydrophobicContact CB-CD1 3.59Å; P47-F52 HydrophobicContact CB-CE1 4.34Å; P47-F52 HydrophobicContact CB-CG 4.18Å; S48-F52 PolarHBondContact O-N 3.41Å; F52-M54 HydrophobicContact CD1-CB 4.29Å; F52-M54 HydrophobicContact CD1-SD 4.49Å; F52-M54 HydrophobicContact CE1-CB 4.25Å; F52-M54 HydrophobicContact CE1-SD 4.13Å; F52-M54 PolarHBondContact O-N 2.79Å; F52-M54 VanDerWaalsContact O-N 3.14Å; F52-F57 HydrophobicContact CE1-CB 3.99Å; F52-F57 HydrophobicContact CE1-CG 4.33Å; F52-F57 HydrophobicContact CE2-CB 4.27Å; F52-F57 HydrophobicContact CZ-CB 3.38Å; F52-F57 HydrophobicContact CZ-CD1 4.36Å; F52-F57 HydrophobicContact CZ-CD2 4.05Å; F52-F57 AromaticContact CZ-CG 3.68Å; F52-F57 HydrophobicContact CZ-CG 3.68Å; F52-M80 HydrophobicContact CE1-CE 3.68Å; F52-M80 HydrophobicContact CE1-SD 3.58Å; F52-M80 VanDerWaalsContact CE1-SD 3.58Å; F52-M80 HydrophobicContact CE2-CE 4.11Å; F52-M80 HydrophobicContact CZ-CE 3.36Å; F52-M80 HydrophobicContact CZ-SD 3.86Å | ||
| 53 | D | 89.1 | Confident | 81.9 | Confident | 100 Ų | 100 | 70.3 Ų | 70.3 | 54% | 0.535 | 40% | 0.402 | S | S | . | . | trans | -82.1 | 91.6 | 173.8 | -167.7 | -20.5 | 0 | 0 | 0 | 110.4 | D55 A56 F57 | D53-D55 VanDerWaalsContact C-N 3.27Å; D53-D55 PolarHBondContact O-N 2.93Å; D53-D55 PolarHBondContact OD1-N 2.94Å; D53-D55 VanDerWaalsContact OD1-N 3.14Å; D53-A56 HydrophobicContact CB-CB 3.91Å; D53-A56 PolarHBondContact OD1-N 3.33Å; D53-F57 PolarHBondContact O-N 2.69Å; D53-F57 VanDerWaalsContact O-N 3.14Å | ||
| 54 | M | 88.9 | Confident | 82.8 | Confident | 28 Ų | 28 | 73.7 Ų | 73.7 | 14% | 0.138 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -63.1 | -34.7 | 177.3 | -169.5 | 93.9 | 67.7 | 0 | 0 | 112.1 | P47 F52 F57 T58 I76 M80 | P47-M54 HydrophobicContact CB-CE 4.02Å; P47-M54 HydrophobicContact CG-CE 3.98Å; F52-M54 HydrophobicContact CD1-CB 4.29Å; F52-M54 HydrophobicContact CD1-SD 4.49Å; F52-M54 HydrophobicContact CE1-CB 4.25Å; F52-M54 HydrophobicContact CE1-SD 4.13Å; F52-M54 PolarHBondContact O-N 2.79Å; F52-M54 VanDerWaalsContact O-N 3.14Å; M54-F57 PolarHBondContact O-N 3.06Å; M54-T58 VanDerWaalsContact O-CB 3.32Å; M54-T58 WeakPolarHBondContact O-CB 3.36Å; M54-T58 PolarHBondContact O-N 2.77Å; M54-T58 PolarHBondContact O-OG1 3.33Å; M54-I76 HydrophobicContact SD-CB 4.37Å; M54-I76 HydrophobicContact SD-CG2 4.07Å; M54-M80 HydrophobicContact SD-SD 4.35Å |
| 55 | D | 90.8 | Very high | 83.9 | Confident | 125 Ų | 125 | 69.3 Ų | 69.3 | 67% | 0.668 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -70.9 | -42.9 | -177.6 | -68.9 | -35.1 | 0 | 0 | 0 | 109.9 | D53 F57 T58 E59 | D53-D55 VanDerWaalsContact C-N 3.27Å; D53-D55 PolarHBondContact O-N 2.93Å; D53-D55 PolarHBondContact OD1-N 2.94Å; D53-D55 VanDerWaalsContact OD1-N 3.14Å; D55-F57 PolarHBondContact O-N 3.06Å; D55-T58 PolarHBondContact O-N 3.22Å; D55-E59 WeakPolarHBondContact O-CB 3.36Å; D55-E59 PolarHBondContact O-N 3.3Å |
| 56 | A | 91.8 | Very high | 85 | Confident | 37 Ų | 37 | 68.5 Ų | 68.5 | 31% | 0.306 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -63.2 | -40.4 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | D53 E59 M60 | D53-A56 HydrophobicContact CB-CB 3.91Å; D53-A56 PolarHBondContact OD1-N 3.33Å; A56-E59 PolarHBondContact O-N 3.43Å; A56-M60 WeakPolarHBondContact O-CB 3.44Å; A56-M60 PolarHBondContact O-N 3.03Å |
| 57 | F | 93 | Very high | 86 | Confident | 1 Ų | 1 | 69 Ų | 69 | 0% | 0.004 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -63.2 | -43.3 | 174 | 172.2 | -98 | 0 | 0 | 0 | 111.9 | Y34 V35 V38 F52 D53 M54 D55 M60 M61 F68 I76 M80 | Y34-F57 HydrophobicContact CE1-CD2 4.2Å; Y34-F57 HydrophobicContact CE1-CE2 4.5Å; V35-F57 HydrophobicContact CG2-CE2 4.22Å; V38-F57 HydrophobicContact CG1-CD2 4.27Å; F52-F57 HydrophobicContact CE1-CB 3.99Å; F52-F57 HydrophobicContact CE1-CG 4.33Å; F52-F57 HydrophobicContact CE2-CB 4.27Å; F52-F57 HydrophobicContact CZ-CB 3.38Å; F52-F57 HydrophobicContact CZ-CD1 4.36Å; F52-F57 HydrophobicContact CZ-CD2 4.05Å; F52-F57 AromaticContact CZ-CG 3.68Å; F52-F57 HydrophobicContact CZ-CG 3.68Å; D53-F57 PolarHBondContact O-N 2.69Å; D53-F57 VanDerWaalsContact O-N 3.14Å; M54-F57 PolarHBondContact O-N 3.06Å; D55-F57 PolarHBondContact O-N 3.06Å; F57-M60 PolarHBondContact O-N 2.87Å; F57-M61 HydrophobicContact CD1-CG 4.32Å; F57-M61 HydrophobicContact CD2-CG 4.39Å; F57-M61 HydrophobicContact CE1-CG 3.88Å; F57-M61 HydrophobicContact CE2-CG 3.97Å; F57-M61 HydrophobicContact CE2-SD 4.36Å; F57-M61 HydrophobicContact CZ-CG 3.69Å; F57-M61 HydrophobicContact CZ-SD 4.26Å; F57-M61 WeakPolarHBondContact O-CB 3.37Å; F57-M61 VanDerWaalsContact O-CG 3.31Å; F57-M61 WeakPolarHBondContact O-CG 3.44Å; F57-M61 PolarHBondContact O-N 2.91Å; F57-F68 HydrophobicContact CE1-CE1 4.19Å; F57-F68 HydrophobicContact CE1-CZ 4.33Å; F57-I76 HydrophobicContact CD1-CG2 4.01Å; F57-I76 HydrophobicContact CE1-CG2 3.72Å; F57-M80 HydrophobicContact CD1-CE 4.38Å; F57-M80 HydrophobicContact CD1-SD 4Å; F57-M80 HydrophobicContact CD2-CE 4.19Å; F57-M80 HydrophobicContact CE1-CE 4.28Å; F57-M80 HydrophobicContact CE1-CG 4.47Å; F57-M80 HydrophobicContact CE1-SD 3.9Å; F57-M80 HydrophobicContact CE2-CE 4.06Å; F57-M80 HydrophobicContact CG-CE 4.34Å; F57-M80 HydrophobicContact CG-SD 4.47Å; F57-M80 HydrophobicContact CZ-CE 4.12Å; F57-M80 HydrophobicContact CZ-SD 4.27Å |
| 58 | T | 93.3 | Very high | 86.8 | Confident | 19 Ų | 19 | 67.4 Ų | 67.4 | 12% | 0.117 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -65.8 | -41.1 | 179.1 | -57.2 | 0 | 0 | 0 | 0 | 111.1 | M54 D55 M61 E62 F68 I76 | M54-T58 VanDerWaalsContact O-CB 3.32Å; M54-T58 WeakPolarHBondContact O-CB 3.36Å; M54-T58 PolarHBondContact O-N 2.77Å; M54-T58 PolarHBondContact O-OG1 3.33Å; D55-T58 PolarHBondContact O-N 3.22Å; T58-M61 PolarHBondContact O-N 3.3Å; T58-E62 WeakPolarHBondContact O-CB 3.19Å; T58-E62 PolarHBondContact O-N 3.32Å; T58-F68 HydrophobicContact CG2-CD1 4.24Å; T58-I76 HydrophobicContact CG2-CD1 4.06Å |
| 59 | E | 93.9 | Very high | 87.7 | Confident | 151 Ų | 151 | 67 Ų | 67 | 71% | 0.706 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -62 | -45.4 | 174.2 | -176.1 | 178.2 | -170.6 | 0 | 0 | 111.5 | D55 A56 M61 E62 A63 | D55-E59 WeakPolarHBondContact O-CB 3.36Å; D55-E59 PolarHBondContact O-N 3.3Å; A56-E59 PolarHBondContact O-N 3.43Å; E59-M61 VanDerWaalsContact C-N 3.32Å; E59-M61 PolarHBondContact O-N 3.36Å; E59-E62 PolarHBondContact O-N 3.44Å; E59-A63 PolarHBondContact O-N 2.91Å |
| 60 | M | 93.4 | Very high | 89 | Confident | 69 Ų | 69 | 67.9 Ų | 67.9 | 34% | 0.34 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -58.8 | -44.4 | 174.3 | -93.3 | -65.1 | -60.6 | 0 | 0 | 111.6 | Y34 A56 F57 A63 Y64 | Y34-M60 HydrophobicContact CE1-CB 4.34Å; Y34-M60 HydrophobicContact CE1-CE 4.39Å; A56-M60 WeakPolarHBondContact O-CB 3.44Å; A56-M60 PolarHBondContact O-N 3.03Å; F57-M60 PolarHBondContact O-N 2.87Å; M60-A63 WeakPolarHBondContact O-CB 3.28Å; M60-A63 PolarHBondContact O-N 2.67Å; M60-Y64 HydrophobicContact CE-CE2 3.91Å; M60-Y64 WeakPolarHBondContact O-CD2 3.33Å |
| 61 | M | 92.6 | Very high | 90.3 | Very high | 2 Ų | 2 | 59.5 Ų | 59.5 | 1% | 0.01 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -69.8 | -35.8 | 179.7 | -73 | -59.4 | -54.7 | 0 | 0 | 113.1 | L11 L27 I31 V35 F57 T58 E59 A63 Y64 V65 F68 | L11-M61 HydrophobicContact CD1-CE 4.13Å; L11-M61 HydrophobicContact CD2-CE 4.01Å; L11-M61 HydrophobicContact CG-CE 4.48Å; L27-M61 HydrophobicContact CD2-CE 4.25Å; I31-M61 HydrophobicContact CG2-SD 4.36Å; V35-M61 HydrophobicContact CG2-SD 4.08Å; F57-M61 HydrophobicContact CD1-CG 4.32Å; F57-M61 HydrophobicContact CD2-CG 4.39Å; F57-M61 HydrophobicContact CE1-CG 3.88Å; F57-M61 HydrophobicContact CE2-CG 3.97Å; F57-M61 HydrophobicContact CE2-SD 4.36Å; F57-M61 HydrophobicContact CZ-CG 3.69Å; F57-M61 HydrophobicContact CZ-SD 4.26Å; F57-M61 WeakPolarHBondContact O-CB 3.37Å; F57-M61 VanDerWaalsContact O-CG 3.31Å; F57-M61 WeakPolarHBondContact O-CG 3.44Å; F57-M61 PolarHBondContact O-N 2.91Å; T58-M61 PolarHBondContact O-N 3.3Å; E59-M61 VanDerWaalsContact C-N 3.32Å; E59-M61 PolarHBondContact O-N 3.36Å; M61-A63 PolarHBondContact O-N 2.91Å; M61-Y64 PolarHBondContact O-N 3.26Å; M61-Y64 VanDerWaalsContact O-N 3.14Å; M61-V65 HydrophobicContact CE-CG2 4.36Å; M61-V65 PolarHBondContact O-N 2.86Å; M61-F68 HydrophobicContact CB-CB 4.48Å; M61-F68 HydrophobicContact CB-CD1 3.28Å; M61-F68 HydrophobicContact CB-CD2 4.35Å; M61-F68 HydrophobicContact CB-CE1 3.4Å; M61-F68 VanDerWaalsContact CB-CE1 3.4Å; M61-F68 HydrophobicContact CB-CE2 4.44Å; M61-F68 HydrophobicContact CB-CG 3.79Å; M61-F68 HydrophobicContact CB-CZ 4.01Å; M61-F68 HydrophobicContact CE-CD2 4.42Å; M61-F68 HydrophobicContact CE-CE2 4.1Å; M61-F68 HydrophobicContact CE-CZ 4.27Å; M61-F68 HydrophobicContact CG-CD1 4.18Å; M61-F68 HydrophobicContact CG-CE1 3.77Å; M61-F68 HydrophobicContact CG-CZ 4.06Å |
| 62 | E | 92.9 | Very high | 91.2 | Very high | 65 Ų | 65 | 56.6 Ų | 56.6 | 30% | 0.304 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -60.2 | -31.9 | 175.7 | -178.7 | 66.7 | -163.7 | 0 | 0 | 112.2 | T58 E59 Y64 V65 G67 F68 G69 | T58-E62 WeakPolarHBondContact O-CB 3.19Å; T58-E62 PolarHBondContact O-N 3.32Å; E59-E62 PolarHBondContact O-N 3.44Å; E62-Y64 PolarHBondContact O-N 3.39Å; E62-V65 WeakPolarHBondContact CA-O 3.41Å; E62-V65 CarbonylContact O-C 3.52Å; E62-G67 VanDerWaalsContact CD-N 3.3Å; E62-G67 PolarHBondContact OE1-N 3.37Å; E62-G67 VanDerWaalsContact OE2-C 3.23Å; E62-G67 WeakPolarHBondContact OE2-CA 3.4Å; E62-G67 PolarHBondContact OE2-N 2.87Å; E62-G67 VanDerWaalsContact OE2-N 3.09Å; E62-F68 WeakPolarHBondContact OE2-CA 3.22Å; E62-F68 PolarHBondContact OE2-N 3.48Å; E62-G69 PolarHBondContact OE2-N 2.9Å |
| 63 | A | 91.7 | Very high | 91.4 | Very high | 80 Ų | 80 | 63.7 Ų | 63.7 | 66% | 0.661 | 35% | 0.345 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65 | -26.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | E59 M60 M61 | E59-A63 PolarHBondContact O-N 2.91Å; M60-A63 WeakPolarHBondContact O-CB 3.28Å; M60-A63 PolarHBondContact O-N 2.67Å; M61-A63 PolarHBondContact O-N 2.91Å |
| 64 | Y | 91 | Very high | 91.4 | Very high | 90 Ų | 90 | 61 Ų | 61 | 35% | 0.353 | 34% | 0.341 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -105.5 | -30.7 | 179.7 | -61.1 | -86.3 | 0 | 0 | 0 | 112.8 | I31 M60 M61 E62 | I31-Y64 HydrophobicContact CD1-CD1 3.96Å; I31-Y64 HydrophobicContact CD1-CD2 3.82Å; I31-Y64 HydrophobicContact CD1-CE1 3.56Å; I31-Y64 HydrophobicContact CD1-CE2 3.43Å; I31-Y64 VanDerWaalsContact CD1-CE2 3.43Å; I31-Y64 HydrophobicContact CD1-CG 4.1Å; I31-Y64 HydrophobicContact CG1-CD1 3.95Å; I31-Y64 HydrophobicContact CG1-CD2 4.33Å; I31-Y64 HydrophobicContact CG1-CE1 3.96Å; I31-Y64 HydrophobicContact CG1-CE2 4.37Å; I31-Y64 HydrophobicContact CG1-CG 4.16Å; M60-Y64 HydrophobicContact CE-CE2 3.91Å; M60-Y64 WeakPolarHBondContact O-CD2 3.33Å; M61-Y64 PolarHBondContact O-N 3.26Å; M61-Y64 VanDerWaalsContact O-N 3.14Å; E62-Y64 PolarHBondContact O-N 3.39Å |
| 65 | V | 90.9 | Very high | 91.6 | Very high | 0 Ų | 0 | 63 Ų | 63 | 0% | 0 | 35% | 0.351 | C | S | . | . | S | Bend | trans | -123.5 | 94 | -179.4 | -178.8 | 0 | 0 | 0 | 0 | 107.8 | V15 L19 A22 L27 M61 E62 G67 F68 | V15-V65 HydrophobicContact CG1-CG1 3.54Å; V15-V65 HydrophobicContact CG2-CG1 4.39Å; L19-V65 HydrophobicContact CD1-CG1 4.02Å; A22-V65 HydrophobicContact CB-CG1 4.06Å; L27-V65 HydrophobicContact CD1-CG2 4.11Å; L27-V65 HydrophobicContact CD2-CG2 4.07Å; L27-V65 HydrophobicContact CG-CG2 4.15Å; M61-V65 HydrophobicContact CE-CG2 4.36Å; M61-V65 PolarHBondContact O-N 2.86Å; E62-V65 WeakPolarHBondContact CA-O 3.41Å; E62-V65 CarbonylContact O-C 3.52Å; V65-G67 PolarHBondContact O-N 2.89Å; V65-F68 HydrophobicContact CB-CB 4.11Å; V65-F68 HydrophobicContact CB-CD2 4.33Å; V65-F68 HydrophobicContact CG1-CB 4.16Å; V65-F68 HydrophobicContact CG1-CD2 4.19Å; V65-F68 WeakPolarHBondContact O-CB 3.45Å; V65-F68 PolarHBondContact O-N 3.43Å; V65-F68 VanDerWaalsContact O-N 3.12Å |
| 66 | P | 90.5 | Very high | 91.6 | Very high | 89 Ų | 89 | 57.1 Ų | 57.1 | 58% | 0.578 | 32% | 0.319 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57 | 132.1 | 177.9 | -25.1 | 34.3 | 0 | 0 | 0 | 111.6 | ||
| 67 | G | 88.6 | Confident | 91.5 | Very high | 15 Ų | 15 | 55.8 Ų | 55.8 | 16% | 0.155 | 31% | 0.309 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 88.2 | -3 | -178.2 | 0 | 0 | 0 | 0 | 0 | 115 | E62 V65 G69 H70 | E62-G67 VanDerWaalsContact CD-N 3.3Å; E62-G67 PolarHBondContact OE1-N 3.37Å; E62-G67 VanDerWaalsContact OE2-C 3.23Å; E62-G67 WeakPolarHBondContact OE2-CA 3.4Å; E62-G67 PolarHBondContact OE2-N 2.87Å; E62-G67 VanDerWaalsContact OE2-N 3.09Å; V65-G67 PolarHBondContact O-N 2.89Å; G67-G69 VanDerWaalsContact C-N 3.26Å; G67-G69 PolarHBondContact O-N 3.27Å; G67-H70 WeakPolarHBondContact O-CB 3.14Å; G67-H70 PolarHBondContact O-N 3.25Å |
| 68 | F | 91.8 | Very high | 91.4 | Very high | 0 Ų | 0 | 59.8 Ų | 59.8 | 0% | 0 | 33% | 0.33 | C | S | . | . | G | 310 helix | trans | -57.4 | -36.2 | 174.8 | -165.9 | -90.1 | 0 | 0 | 0 | 113.1 | F14 V15 F57 T58 M61 E62 V65 H70 I71 I76 | F14-F68 HydrophobicContact CD1-CE2 4.23Å; F14-F68 HydrophobicContact CE1-CE2 4.02Å; F14-F68 HydrophobicContact CE1-CZ 4.17Å; V15-F68 HydrophobicContact CG2-CD2 4.1Å; V15-F68 HydrophobicContact CG2-CE2 3.93Å; F57-F68 HydrophobicContact CE1-CE1 4.19Å; F57-F68 HydrophobicContact CE1-CZ 4.33Å; T58-F68 HydrophobicContact CG2-CD1 4.24Å; M61-F68 HydrophobicContact CB-CB 4.48Å; M61-F68 HydrophobicContact CB-CD1 3.28Å; M61-F68 HydrophobicContact CB-CD2 4.35Å; M61-F68 HydrophobicContact CB-CE1 3.4Å; M61-F68 VanDerWaalsContact CB-CE1 3.4Å; M61-F68 HydrophobicContact CB-CE2 4.44Å; M61-F68 HydrophobicContact CB-CG 3.79Å; M61-F68 HydrophobicContact CB-CZ 4.01Å; M61-F68 HydrophobicContact CE-CD2 4.42Å; M61-F68 HydrophobicContact CE-CE2 4.1Å; M61-F68 HydrophobicContact CE-CZ 4.27Å; M61-F68 HydrophobicContact CG-CD1 4.18Å; M61-F68 HydrophobicContact CG-CE1 3.77Å; M61-F68 HydrophobicContact CG-CZ 4.06Å; E62-F68 WeakPolarHBondContact OE2-CA 3.22Å; E62-F68 PolarHBondContact OE2-N 3.48Å; V65-F68 HydrophobicContact CB-CB 4.11Å; V65-F68 HydrophobicContact CB-CD2 4.33Å; V65-F68 HydrophobicContact CG1-CB 4.16Å; V65-F68 HydrophobicContact CG1-CD2 4.19Å; V65-F68 WeakPolarHBondContact O-CB 3.45Å; V65-F68 PolarHBondContact O-N 3.43Å; V65-F68 VanDerWaalsContact O-N 3.12Å; F68-H70 PolarHBondContact O-N 3.49Å; F68-I71 HydrophobicContact CD2-CD1 3.84Å; F68-I71 HydrophobicContact CE2-CD1 4.09Å; F68-I71 HydrophobicContact CG-CD1 4.25Å; F68-I71 VanDerWaalsContact O-CB 3.26Å; F68-I71 WeakPolarHBondContact O-CB 3.22Å; F68-I71 VanDerWaalsContact O-CG1 3.28Å; F68-I71 WeakPolarHBondContact O-CG1 3.4Å; F68-I71 PolarHBondContact O-N 2.92Å; F68-I76 HydrophobicContact CD1-CD1 4.44Å; F68-I76 HydrophobicContact CE1-CD1 3.95Å; F68-I76 HydrophobicContact CE1-CG1 4.39Å; F68-I76 HydrophobicContact CE1-CG2 4.48Å |
| 69 | G | 90.4 | Very high | 91.4 | Very high | 40 Ų | 40 | 59.5 Ų | 59.5 | 41% | 0.412 | 33% | 0.328 | S | S | . | . | G | 310 helix | trans | -68.5 | -10.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 115 | E62 G67 I71 | E62-G69 PolarHBondContact OE2-N 2.9Å; G67-G69 VanDerWaalsContact C-N 3.26Å; G67-G69 PolarHBondContact O-N 3.27Å; G69-I71 VanDerWaalsContact C-N 3.3Å |
| 70 | H | 91.8 | Very high | 91.3 | Very high | 160 Ų | 160 | 52.3 Ų | 52.3 | 74% | 0.741 | 29% | 0.294 | S | S | * | . | G | 310 helix | trans | -82.9 | -11 | 170.7 | -67.3 | 77.3 | 0 | 0 | 0 | 112.4 | G67 F68 | G67-H70 WeakPolarHBondContact O-CB 3.14Å; G67-H70 PolarHBondContact O-N 3.25Å; F68-H70 PolarHBondContact O-N 3.49Å |
| 71 | I | 92.6 | Very high | 91.1 | Very high | 12 Ų | 12 | 53 Ų | 53 | 6% | 0.062 | 30% | 0.296 | C | S | . | . | S | Bend | trans | -72.3 | 128.9 | 176.7 | -56.1 | 174.7 | 0 | 0 | 0 | 108.3 | F14 H18 L19 F68 G69 R73 M75 I76 | F14-I71 HydrophobicContact CE1-CD1 3.82Å; F14-I71 HydrophobicContact CE1-CG2 4.27Å; F14-I71 HydrophobicContact CZ-CD1 4.38Å; F14-I71 HydrophobicContact CZ-CG2 3.82Å; H18-I71 HydrophobicContact CB-CD1 3.8Å; H18-I71 HydrophobicContact CB-CG1 4Å; L19-I71 HydrophobicContact CD1-CD1 4.17Å; L19-I71 HydrophobicContact CG-CD1 4.44Å; F68-I71 HydrophobicContact CD2-CD1 3.84Å; F68-I71 HydrophobicContact CE2-CD1 4.09Å; F68-I71 HydrophobicContact CG-CD1 4.25Å; F68-I71 VanDerWaalsContact O-CB 3.26Å; F68-I71 WeakPolarHBondContact O-CB 3.22Å; F68-I71 VanDerWaalsContact O-CG1 3.28Å; F68-I71 WeakPolarHBondContact O-CG1 3.4Å; F68-I71 PolarHBondContact O-N 2.92Å; G69-I71 VanDerWaalsContact C-N 3.3Å; I71-R73 PolarHBondContact O-N 3.04Å; I71-M75 HydrophobicContact CG2-CB 4.14Å; I71-M75 HydrophobicContact CG2-CE 4.44Å; I71-I76 HydrophobicContact CB-CD1 4.16Å; I71-I76 HydrophobicContact CB-CG1 4.13Å; I71-I76 HydrophobicContact CG2-CD1 4.37Å; I71-I76 HydrophobicContact CG2-CG1 3.8Å |
| 72 | P | 91.5 | Very high | 91 | Very high | 74 Ų | 74 | 59.3 Ų | 59.3 | 48% | 0.481 | 32% | 0.324 | S | S | . | . | trans | -55.6 | 132.9 | 177.6 | -27.8 | 35.3 | 0 | 0 | 0 | 112.4 | G74 M75 I76 | P72-G74 PolarHBondContact O-N 3.4Å; P72-M75 HydrophobicContact CB-CE 4.45Å; P72-M75 HydrophobicContact CB-CG 4.48Å; P72-M75 HydrophobicContact CG-CE 3.82Å; P72-M75 PolarHBondContact O-N 3.05Å; P72-I76 PolarHBondContact O-N 2.92Å | ||
| 73 | R | 89.9 | Confident | 90.9 | Very high | 181 Ų | 181 | 56.4 Ų | 56.4 | 68% | 0.683 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -47.3 | -37.7 | 178.7 | 72 | -179.4 | -169.5 | 173.9 | 6.5 | 114 | I71 M75 I76 G77 | I71-R73 PolarHBondContact O-N 3.04Å; R73-M75 VanDerWaalsContact C-N 3.33Å; R73-M75 PolarHBondContact O-N 3.06Å; R73-I76 PolarHBondContact O-N 2.95Å; R73-G77 PolarHBondContact O-N 3.49Å |
| 74 | G | 89.1 | Confident | 90.8 | Very high | 43 Ų | 43 | 52.8 Ų | 52.8 | 44% | 0.443 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -63.6 | -38.2 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | P72 G77 D78 | P72-G74 PolarHBondContact O-N 3.4Å; G74-G77 PolarHBondContact O-N 3.47Å; G74-D78 WeakPolarHBondContact O-CB 3.24Å; G74-D78 PolarHBondContact O-N 2.83Å |
| 75 | M | 91.4 | Very high | 90.7 | Very high | 71 Ų | 71 | 51.5 Ų | 51.5 | 35% | 0.35 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -73 | -35.2 | 178.1 | -64.6 | -152.4 | -76.2 | 0 | 0 | 112.1 | F14 H18 I71 P72 R73 M79 | F14-M75 HydrophobicContact CE2-CB 4.44Å; F14-M75 HydrophobicContact CZ-CB 4.45Å; H18-M75 WeakPolarHBondContact CE1-CE 3.42Å; H18-M75 PolarHBondContact CE1-SD 3.09Å; I71-M75 HydrophobicContact CG2-CB 4.14Å; I71-M75 HydrophobicContact CG2-CE 4.44Å; P72-M75 HydrophobicContact CB-CE 4.45Å; P72-M75 HydrophobicContact CB-CG 4.48Å; P72-M75 HydrophobicContact CG-CE 3.82Å; P72-M75 PolarHBondContact O-N 3.05Å; R73-M75 VanDerWaalsContact C-N 3.33Å; R73-M75 PolarHBondContact O-N 3.06Å; M75-M79 WeakPolarHBondContact O-CB 3.32Å; M75-M79 PolarHBondContact O-N 3.09Å |
| 76 | I | 91.8 | Very high | 90.6 | Very high | 1 Ų | 1 | 56.1 Ų | 56.1 | 1% | 0.005 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -64.6 | -48.4 | 173.3 | -58 | 174.4 | 0 | 0 | 0 | 109.5 | F14 M54 F57 T58 F68 I71 P72 R73 D78 M79 M80 | F14-I76 HydrophobicContact CZ-CG1 4.33Å; M54-I76 HydrophobicContact SD-CB 4.37Å; M54-I76 HydrophobicContact SD-CG2 4.07Å; F57-I76 HydrophobicContact CD1-CG2 4.01Å; F57-I76 HydrophobicContact CE1-CG2 3.72Å; T58-I76 HydrophobicContact CG2-CD1 4.06Å; F68-I76 HydrophobicContact CD1-CD1 4.44Å; F68-I76 HydrophobicContact CE1-CD1 3.95Å; F68-I76 HydrophobicContact CE1-CG1 4.39Å; F68-I76 HydrophobicContact CE1-CG2 4.48Å; I71-I76 HydrophobicContact CB-CD1 4.16Å; I71-I76 HydrophobicContact CB-CG1 4.13Å; I71-I76 HydrophobicContact CG2-CD1 4.37Å; I71-I76 HydrophobicContact CG2-CG1 3.8Å; P72-I76 PolarHBondContact O-N 2.92Å; R73-I76 PolarHBondContact O-N 2.95Å; I76-D78 PolarHBondContact O-N 3.18Å; I76-M79 WeakPolarHBondContact O-CB 3.31Å; I76-M79 PolarHBondContact O-N 3.07Å; I76-M80 HydrophobicContact CG2-CG 4.47Å; I76-M80 HydrophobicContact CG2-SD 4.28Å; I76-M80 VanDerWaalsContact O-CG 3.31Å; I76-M80 WeakPolarHBondContact O-CG 3.39Å; I76-M80 PolarHBondContact O-N 3.39Å |
| 77 | G | 90.3 | Very high | 90.6 | Very high | 8 Ų | 8 | 52.6 Ų | 52.6 | 8% | 0.082 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -58.9 | -45.5 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | R73 G74 M79 M80 Q81 | R73-G77 PolarHBondContact O-N 3.49Å; G74-G77 PolarHBondContact O-N 3.47Å; G77-M79 VanDerWaalsContact C-N 3.32Å; G77-M79 PolarHBondContact O-N 3.47Å; G77-M80 PolarHBondContact O-N 3.33Å; G77-Q81 PolarHBondContact O-N 3.48Å |
| 78 | D | 91 | Very high | 90.4 | Very high | 85 Ų | 85 | 53.8 Ų | 53.8 | 46% | 0.455 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -60.2 | -40.9 | 175.5 | -75.5 | -10.7 | 0 | 0 | 0 | 112.1 | G74 I76 K82 | G74-D78 WeakPolarHBondContact O-CB 3.24Å; G74-D78 PolarHBondContact O-N 2.83Å; I76-D78 PolarHBondContact O-N 3.18Å; D78-K82 WeakPolarHBondContact O-CB 3.37Å; D78-K82 WeakPolarHBondContact O-CD 3.21Å; D78-K82 WeakPolarHBondContact O-CG 3.35Å; D78-K82 PolarHBondContact O-N 3.02Å |
| 79 | M | 92.1 | Very high | 90.2 | Very high | 13 Ų | 13 | 57.6 Ų | 57.6 | 6% | 0.064 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -63.5 | -47.9 | 175.9 | 178 | -142.6 | 58.3 | 0 | 0 | 110.7 | L11 F14 M75 I76 G77 Q81 K82 L83 | L11-M79 HydrophobicContact CD1-CE 4.44Å; L11-M79 HydrophobicContact CD1-SD 3.97Å; F14-M79 HydrophobicContact CB-CG 4.07Å; F14-M79 HydrophobicContact CB-SD 3.82Å; F14-M79 HydrophobicContact CD1-CG 4.22Å; F14-M79 HydrophobicContact CD1-SD 3.36Å; F14-M79 WeakPolarHBondContact CD1-SD 3.46Å; F14-M79 HydrophobicContact CD2-CB 3.77Å; F14-M79 HydrophobicContact CD2-CG 3.7Å; F14-M79 HydrophobicContact CD2-SD 3.98Å; F14-M79 HydrophobicContact CE1-SD 3.79Å; F14-M79 HydrophobicContact CE2-CB 3.69Å; F14-M79 HydrophobicContact CE2-CG 4.11Å; F14-M79 HydrophobicContact CE2-SD 4.36Å; F14-M79 HydrophobicContact CG-CB 4.26Å; F14-M79 HydrophobicContact CG-CG 3.74Å; F14-M79 HydrophobicContact CG-SD 3.44Å; F14-M79 WeakPolarHBondContact CG-SD 3.5Å; F14-M79 HydrophobicContact CZ-CB 4.11Å; F14-M79 HydrophobicContact CZ-SD 4.25Å; M75-M79 WeakPolarHBondContact O-CB 3.32Å; M75-M79 PolarHBondContact O-N 3.09Å; I76-M79 WeakPolarHBondContact O-CB 3.31Å; I76-M79 PolarHBondContact O-N 3.07Å; G77-M79 VanDerWaalsContact C-N 3.32Å; G77-M79 PolarHBondContact O-N 3.47Å; M79-Q81 VanDerWaalsContact C-N 3.33Å; M79-Q81 PolarHBondContact O-N 2.77Å; M79-K82 PolarHBondContact O-N 3.42Å; M79-L83 HydrophobicContact CE-CD1 4.1Å; M79-L83 HydrophobicContact CG-CD1 3.93Å; M79-L83 HydrophobicContact CG-CG 4.48Å; M79-L83 WeakPolarHBondContact O-CB 3.49Å; M79-L83 WeakPolarHBondContact O-CG 3.3Å; M79-L83 PolarHBondContact O-N 3.13Å; M79-L83 HydrophobicContact SD-CD1 4.03Å |
| 80 | M | 91.3 | Very high | 89.9 | Confident | 1 Ų | 1 | 56.9 Ų | 56.9 | 1% | 0.005 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -61.2 | -41.8 | 179.4 | -67.2 | -175.6 | 86 | 0 | 0 | 111.9 | V38 L39 L42 P47 F52 M54 F57 I76 G77 L83 S84 | V38-M80 HydrophobicContact CG1-CE 3.37Å; L39-M80 HydrophobicContact CD2-CB 4Å; L39-M80 HydrophobicContact CD2-CE 4.29Å; L39-M80 HydrophobicContact CD2-CG 4.43Å; L39-M80 VanDerWaalsContact CD2-O 3.28Å; L39-M80 WeakPolarHBondContact CD2-O 3.46Å; L42-M80 HydrophobicContact CD1-CB 4.38Å; L42-M80 HydrophobicContact CD1-CE 3.38Å; L42-M80 HydrophobicContact CD1-SD 4.31Å; P47-M80 HydrophobicContact CG-CB 4.42Å; F52-M80 HydrophobicContact CE1-CE 3.68Å; F52-M80 HydrophobicContact CE1-SD 3.58Å; F52-M80 VanDerWaalsContact CE1-SD 3.58Å; F52-M80 HydrophobicContact CE2-CE 4.11Å; F52-M80 HydrophobicContact CZ-CE 3.36Å; F52-M80 HydrophobicContact CZ-SD 3.86Å; M54-M80 HydrophobicContact SD-SD 4.35Å; F57-M80 HydrophobicContact CD1-CE 4.38Å; F57-M80 HydrophobicContact CD1-SD 4Å; F57-M80 HydrophobicContact CD2-CE 4.19Å; F57-M80 HydrophobicContact CE1-CE 4.28Å; F57-M80 HydrophobicContact CE1-CG 4.47Å; F57-M80 HydrophobicContact CE1-SD 3.9Å; F57-M80 HydrophobicContact CE2-CE 4.06Å; F57-M80 HydrophobicContact CG-CE 4.34Å; F57-M80 HydrophobicContact CG-SD 4.47Å; F57-M80 HydrophobicContact CZ-CE 4.12Å; F57-M80 HydrophobicContact CZ-SD 4.27Å; I76-M80 HydrophobicContact CG2-CG 4.47Å; I76-M80 HydrophobicContact CG2-SD 4.28Å; I76-M80 VanDerWaalsContact O-CG 3.31Å; I76-M80 WeakPolarHBondContact O-CG 3.39Å; I76-M80 PolarHBondContact O-N 3.39Å; G77-M80 PolarHBondContact O-N 3.33Å; M80-L83 PolarHBondContact O-N 2.97Å; M80-S84 WeakPolarHBondContact O-CB 3.34Å; M80-S84 PolarHBondContact O-N 2.84Å |
| 81 | Q | 90.3 | Very high | 89.5 | Confident | 82 Ų | 82 | 56.5 Ų | 56.5 | 38% | 0.383 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -66 | -43.7 | 177.1 | -170.2 | 172.7 | 39.7 | 0 | 0 | 112.2 | S45 G77 M79 L83 S84 T85 | S45-Q81 PolarHBondContact O-NE2 2.85Å; G77-Q81 PolarHBondContact O-N 3.48Å; M79-Q81 VanDerWaalsContact C-N 3.33Å; M79-Q81 PolarHBondContact O-N 2.77Å; Q81-L83 VanDerWaalsContact C-N 3.32Å; Q81-L83 PolarHBondContact O-N 3.36Å; Q81-S84 PolarHBondContact O-N 3.29Å; Q81-T85 PolarHBondContact O-N 3.02Å; Q81-T85 PolarHBondContact O-OG1 3.42Å |
| 82 | K | 90.3 | Very high | 88.8 | Confident | 136 Ų | 136 | 60.6 Ų | 60.6 | 59% | 0.591 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -60 | -43.6 | 174.5 | -75.4 | 168.1 | -173.5 | 166.8 | 0 | 111.5 | D78 M79 T85 Q86 | D78-K82 WeakPolarHBondContact O-CB 3.37Å; D78-K82 WeakPolarHBondContact O-CD 3.21Å; D78-K82 WeakPolarHBondContact O-CG 3.35Å; D78-K82 PolarHBondContact O-N 3.02Å; M79-K82 PolarHBondContact O-N 3.42Å; K82-T85 PolarHBondContact O-N 3.35Å; K82-Q86 WeakPolarHBondContact O-CG 3.45Å; K82-Q86 PolarHBondContact O-N 2.7Å |
| 83 | L | 90.7 | Very high | 87.8 | Confident | 3 Ų | 3 | 64.1 Ų | 64.1 | 2% | 0.016 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -63.2 | -48.5 | 177.4 | -82.6 | 173.6 | 0 | 0 | 0 | 112.1 | A10 L39 M79 M80 Q81 T85 Q86 L87 | A10-L83 HydrophobicContact CB-CD2 3.26Å; A10-L83 HydrophobicContact CB-CG 4.29Å; L39-L83 HydrophobicContact CD1-CB 3.84Å; L39-L83 HydrophobicContact CD1-CD1 4.23Å; L39-L83 HydrophobicContact CD2-CB 4.06Å; M79-L83 HydrophobicContact CE-CD1 4.1Å; M79-L83 HydrophobicContact CG-CD1 3.93Å; M79-L83 HydrophobicContact CG-CG 4.48Å; M79-L83 WeakPolarHBondContact O-CB 3.49Å; M79-L83 WeakPolarHBondContact O-CG 3.3Å; M79-L83 PolarHBondContact O-N 3.13Å; M79-L83 HydrophobicContact SD-CD1 4.03Å; M80-L83 PolarHBondContact O-N 2.97Å; Q81-L83 VanDerWaalsContact C-N 3.32Å; Q81-L83 PolarHBondContact O-N 3.36Å; L83-T85 VanDerWaalsContact C-N 3.28Å; L83-T85 PolarHBondContact O-N 3.38Å; L83-Q86 PolarHBondContact O-N 2.94Å; L83-Q86 VanDerWaalsContact O-N 3.14Å; L83-L87 VanDerWaalsContact O-CG 3.3Å; L83-L87 WeakPolarHBondContact O-CG 3.39Å; L83-L87 PolarHBondContact O-N 2.92Å |
| 84 | S | 89.9 | Confident | 86.3 | Confident | 4 Ų | 4 | 62 Ų | 62 | 3% | 0.028 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -57.8 | -41.4 | 176.5 | 172.2 | 0 | 0 | 0 | 0 | 112.1 | G43 M80 Q81 L87 S88 | G43-S84 VanDerWaalsContact C-OG 3.26Å; G43-S84 PolarHBondContact O-OG 2.89Å; M80-S84 WeakPolarHBondContact O-CB 3.34Å; M80-S84 PolarHBondContact O-N 2.84Å; Q81-S84 PolarHBondContact O-N 3.29Å; S84-L87 PolarHBondContact O-N 3Å; S84-S88 WeakPolarHBondContact O-CB 3.29Å; S84-S88 PolarHBondContact O-N 3.43Å; S84-S88 PolarHBondContact O-OG 3.31Å |
| 85 | T | 88.8 | Confident | 84.7 | Confident | 63 Ų | 63 | 65.8 Ų | 65.8 | 39% | 0.387 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -63.3 | -46.1 | 175.4 | -52.6 | 0 | 0 | 0 | 0 | 111.2 | Q81 K82 L83 L87 S88 D89 | Q81-T85 PolarHBondContact O-N 3.02Å; Q81-T85 PolarHBondContact O-OG1 3.42Å; K82-T85 PolarHBondContact O-N 3.35Å; L83-T85 VanDerWaalsContact C-N 3.28Å; L83-T85 PolarHBondContact O-N 3.38Å; T85-L87 VanDerWaalsContact C-N 3.34Å; T85-L87 PolarHBondContact O-N 3.17Å; T85-S88 PolarHBondContact O-N 3.46Å; T85-D89 PolarHBondContact O-N 3.23Å |
| 86 | Q | 89.2 | Confident | 82.7 | Confident | 98 Ų | 98 | 69.1 Ų | 69.1 | 46% | 0.458 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -63 | -38.8 | 177.8 | -74.7 | -179.2 | 1.8 | 0 | 0 | 112.7 | I6 K82 L83 D89 A90 | I6-Q86 HydrophobicContact CG2-CB 4.4Å; K82-Q86 WeakPolarHBondContact O-CG 3.45Å; K82-Q86 PolarHBondContact O-N 2.7Å; L83-Q86 PolarHBondContact O-N 2.94Å; L83-Q86 VanDerWaalsContact O-N 3.14Å; Q86-D89 PolarHBondContact O-N 2.98Å; Q86-A90 WeakPolarHBondContact O-CB 3.5Å; Q86-A90 PolarHBondContact O-N 3.42Å |
| 87 | L | 88.9 | Confident | 80 | Confident | 14 Ų | 14 | 75.9 Ų | 75.9 | 7% | 0.073 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -67.4 | -41.5 | 176.2 | -69 | 173.3 | 0 | 0 | 0 | 111.6 | L3 I6 V7 L36 L39 L83 S84 T85 D89 A90 R91 | L3-L87 HydrophobicContact CB-CD2 4.03Å; L3-L87 HydrophobicContact CD2-CB 4.24Å; L3-L87 HydrophobicContact CD2-CD2 3.5Å; L3-L87 HydrophobicContact CD2-CG 4.47Å; L3-L87 HydrophobicContact CG-CD2 4.39Å; I6-L87 HydrophobicContact CB-CD2 4.26Å; I6-L87 HydrophobicContact CG2-CD2 4.2Å; V7-L87 HydrophobicContact CG2-CD1 3.93Å; V7-L87 HydrophobicContact CG2-CD2 3.93Å; V7-L87 HydrophobicContact CG2-CG 4.42Å; L36-L87 HydrophobicContact CD1-CD1 3.69Å; L36-L87 HydrophobicContact CD1-CD2 4.11Å; L39-L87 HydrophobicContact CB-CD1 3.91Å; L39-L87 HydrophobicContact CD1-CD1 3.74Å; L39-L87 HydrophobicContact CG-CD1 4.47Å; L83-L87 VanDerWaalsContact O-CG 3.3Å; L83-L87 WeakPolarHBondContact O-CG 3.39Å; L83-L87 PolarHBondContact O-N 2.92Å; S84-L87 PolarHBondContact O-N 3Å; T85-L87 VanDerWaalsContact C-N 3.34Å; T85-L87 PolarHBondContact O-N 3.17Å; L87-D89 VanDerWaalsContact C-N 3.34Å; L87-D89 PolarHBondContact O-N 3.2Å; L87-A90 PolarHBondContact O-N 2.94Å; L87-R91 WeakPolarHBondContact O-CB 2.83Å; L87-R91 PolarHBondContact O-N 2.94Å |
| 88 | S | 86.3 | Confident | 77.8 | Confident | 40 Ų | 40 | 80.3 Ų | 80.3 | 28% | 0.28 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -60.4 | -44.8 | 174.8 | -61.1 | 0 | 0 | 0 | 0 | 111.1 | S84 T85 R91 N92 | S84-S88 WeakPolarHBondContact O-CB 3.29Å; S84-S88 PolarHBondContact O-N 3.43Å; S84-S88 PolarHBondContact O-OG 3.31Å; T85-S88 PolarHBondContact O-N 3.46Å; S88-R91 PolarHBondContact O-N 3.46Å; S88-N92 WeakPolarHBondContact O-CB 3.31Å; S88-N92 PolarHBondContact O-N 2.91Å; S88-N92 PolarHBondContact O-ND2 2.98Å |
| 89 | D | 85.9 | Confident | 75.3 | Confident | 81 Ų | 81 | 85 Ų | 85 | 43% | 0.433 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -65.6 | -42 | 176.7 | -77.6 | -17.6 | 0 | 0 | 0 | 113 | T85 Q86 L87 R91 N92 K93 | T85-D89 PolarHBondContact O-N 3.23Å; Q86-D89 PolarHBondContact O-N 2.98Å; L87-D89 VanDerWaalsContact C-N 3.34Å; L87-D89 PolarHBondContact O-N 3.2Å; D89-R91 VanDerWaalsContact C-N 3.34Å; D89-N92 PolarHBondContact O-N 3.33Å; D89-K93 VanDerWaalsContact O-CG 3.3Å; D89-K93 WeakPolarHBondContact O-CG 3.43Å; D89-K93 PolarHBondContact O-N 3.12Å |
| 90 | A | 85.6 | Confident | 73 | Confident | 25 Ų | 25 | 90 Ų | 90 | 21% | 0.207 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -63.3 | -41.7 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | L3 I6 Q86 L87 K93 E94 | L3-A90 HydrophobicContact CD2-CB 4.33Å; I6-A90 HydrophobicContact CD1-CB 3.48Å; I6-A90 VanDerWaalsContact CD1-CB 3.48Å; Q86-A90 WeakPolarHBondContact O-CB 3.5Å; Q86-A90 PolarHBondContact O-N 3.42Å; L87-A90 PolarHBondContact O-N 2.94Å; A90-K93 PolarHBondContact O-N 3.45Å; A90-E94 PolarHBondContact O-N 3.28Å |
| 91 | R | 83.3 | Confident | 70.4 | Confident | 151 Ų | 151 | 95.5 Ų | 95.5 | 57% | 0.57 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -64.3 | -40.4 | 175.4 | -168.8 | 178.2 | -169.7 | 170.8 | 5.2 | 112.1 | L87 S88 D89 K93 E94 N95 | L87-R91 WeakPolarHBondContact O-CB 2.83Å; L87-R91 PolarHBondContact O-N 2.94Å; S88-R91 PolarHBondContact O-N 3.46Å; D89-R91 VanDerWaalsContact C-N 3.34Å; R91-K93 VanDerWaalsContact C-N 3.28Å; R91-K93 PolarHBondContact O-N 2.95Å; R91-E94 PolarHBondContact O-N 3.23Å; R91-N95 PolarHBondContact O-N 3.03Å; R91-N95 PolarHBondContact O-ND2 3.22Å |
| 92 | N | 76.6 | Confident | 67.6 | Low | 98 Ų | 98 | 97 Ų | 97 | 52% | 0.524 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -65.6 | -32.5 | 176 | -69.9 | -31.5 | 0 | 0 | 0 | 112.2 | S88 D89 L96 | S88-N92 WeakPolarHBondContact O-CB 3.31Å; S88-N92 PolarHBondContact O-N 2.91Å; S88-N92 PolarHBondContact O-ND2 2.98Å; D89-N92 PolarHBondContact O-N 3.33Å; N92-L96 WeakPolarHBondContact O-CG 3.42Å |
| 93 | K | 71.9 | Confident | 64.8 | Low | 148 Ų | 148 | 97.4 Ų | 97.4 | 64% | 0.643 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -75.4 | -34.8 | 175.8 | -71.2 | 169.2 | -176.1 | 174 | 0 | 113.1 | D89 A90 R91 N95 L96 | D89-K93 VanDerWaalsContact O-CG 3.3Å; D89-K93 WeakPolarHBondContact O-CG 3.43Å; D89-K93 PolarHBondContact O-N 3.12Å; A90-K93 PolarHBondContact O-N 3.45Å; R91-K93 VanDerWaalsContact C-N 3.28Å; R91-K93 PolarHBondContact O-N 2.95Å; K93-N95 VanDerWaalsContact C-N 3.28Å; K93-N95 PolarHBondContact O-N 3.33Å; K93-L96 PolarHBondContact O-N 3.48Å; K93-L96 VanDerWaalsContact O-N 3.12Å |
| 94 | E | 57.6 | Low | 62.5 | Low | 136 Ų | 136 | 106 Ų | 106 | 64% | 0.636 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -60.5 | -39.4 | 172.9 | -171.6 | -175.5 | 177.6 | 0 | 0 | 111.3 | A90 R91 L96 H97 | A90-E94 PolarHBondContact O-N 3.28Å; R91-E94 PolarHBondContact O-N 3.23Å; E94-L96 PolarHBondContact O-N 2.98Å; E94-H97 PolarHBondContact O-N 3.45Å |
| 95 | N | 54.8 | Low | 59.8 | Low | 124 Ų | 124 | 109.5 Ų | 109.5 | 66% | 0.663 | 61% | 0.606 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.7 | -7.6 | 176.3 | -74.7 | -75.7 | 0 | 0 | 0 | 114.5 | R91 K93 | R91-N95 PolarHBondContact O-N 3.03Å; R91-N95 PolarHBondContact O-ND2 3.22Å; K93-N95 VanDerWaalsContact C-N 3.28Å; K93-N95 PolarHBondContact O-N 3.33Å |
| 96 | L | 50.5 | Low | 57.3 | Low | 141 Ų | 141 | 115.5 Ų | 115.5 | 74% | 0.738 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.8 | 3.5 | 178.4 | -68 | 171.8 | 0 | 0 | 0 | 113.3 | N92 K93 E94 P98 | N92-L96 WeakPolarHBondContact O-CG 3.42Å; K93-L96 PolarHBondContact O-N 3.48Å; K93-L96 VanDerWaalsContact O-N 3.12Å; E94-L96 PolarHBondContact O-N 2.98Å; L96-P98 VanDerWaalsContact O-CD 3.27Å; L96-P98 WeakPolarHBondContact O-CD 3.22Å |
| 97 | H | 35 | Very low | 54.7 | Low | 142 Ų | 142 | 116.8 Ų | 116.8 | 66% | 0.657 | 64% | 0.644 | S | S | * | * | trans | -77.3 | 112.6 | 174.8 | -165.2 | 72.6 | 0 | 0 | 0 | 110.6 | E94 Q99 | E94-H97 PolarHBondContact O-N 3.45Å; H97-Q99 PolarHBondContact O-N 3.2Å | ||
| 98 | P | 43.7 | Very low | 52.7 | Low | 101 Ų | 101 | 121.6 Ų | 121.6 | 66% | 0.656 | 68% | 0.676 | S | S | * | * | trans | -79.5 | 112.1 | 177.1 | 11.4 | 5.1 | 0 | 0 | 0 | 108.7 | L96 S100 | L96-P98 VanDerWaalsContact O-CD 3.27Å; L96-P98 WeakPolarHBondContact O-CD 3.22Å; P98-S100 PolarHBondContact O-N 3.23Å | ||
| 99 | Q | 39.2 | Very low | 49.9 | Very low | 184 Ų | 184 | 127.7 Ų | 127.7 | 86% | 0.86 | 70% | 0.703 | S | S | * | * | trans | -60.6 | 101.1 | 159.3 | -75.1 | -99.7 | -49.8 | 0 | 0 | 108.2 | H97 S101 | H97-Q99 PolarHBondContact O-N 3.2Å; Q99-S101 PolarHBondContact O-N 3.23Å | ||
| 100 | S | 42.4 | Very low | 47.6 | Very low | 119 Ų | 119 | 133.3 Ų | 133.3 | 83% | 0.832 | 72% | 0.724 | S | S | * | * | trans | -70.8 | 104.4 | 169.2 | 56.7 | 0 | 0 | 0 | 0 | 110 | P98 | P98-S100 PolarHBondContact O-N 3.23Š| ||
| 101 | S | 37.3 | Very low | 45.7 | Very low | 115 Ų | 115 | 136.9 Ų | 136.9 | 80% | 0.804 | 75% | 0.745 | S | S | * | * | trans | -157.9 | 117.2 | 140.1 | 71.5 | 0 | 0 | 0 | 0 | 110.8 | Q99 | Q99-S101 PolarHBondContact O-N 3.23Š| ||
| 102 | C | 32.1 | Very low | 43 | Very low | 115 Ų | 115 | 137.6 Ų | 137.6 | 78% | 0.777 | 76% | 0.755 | S | S | * | * | trans | -51.3 | 128.7 | 172.4 | 176.7 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 103 | V | 31.4 | Very low | 40.9 | Very low | 143 Ų | 143 | 139.2 Ų | 139.2 | 87% | 0.867 | 77% | 0.769 | S | S | * | * | trans | -144.6 | 126.7 | 133.7 | -176.6 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 104 | Q | 42.4 | Very low | 39.3 | Very low | 184 Ų | 184 | 136.4 Ų | 136.4 | 86% | 0.86 | 77% | 0.766 | S | S | * | * | trans | -54 | 139.5 | 176.7 | -88.1 | 163 | -26.9 | 0 | 0 | 115.1 | ||||
| 105 | G | 33.5 | Very low | 37.9 | Very low | 77 Ų | 77 | 140.4 Ų | 140.4 | 79% | 0.794 | 78% | 0.775 | S | S | * | * | trans | -177.6 | 108 | 158.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 106 | Q | 35.4 | Very low | 36.8 | Very low | 190 Ų | 190 | 142.6 Ų | 142.6 | 89% | 0.888 | 78% | 0.781 | S | S | * | * | trans | -61.9 | 158 | 179.2 | -52.9 | 172 | -20.4 | 0 | 0 | 111 | ||||
| 107 | V | 33.8 | Very low | 35.9 | Very low | 125 Ų | 125 | 142.2 Ų | 142.2 | 76% | 0.758 | 79% | 0.787 | S | S | * | * | cis | -168.8 | 156.1 | 48.8 | 169.6 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 108 | P | 47.2 | Very low | 35.4 | Very low | 114 Ų | 114 | 143 Ų | 143 | 74% | 0.74 | 79% | 0.791 | S | S | * | * | trans | -96.5 | 149.2 | -165 | 35.9 | -29.1 | 0 | 0 | 0 | 114.6 | ||||
| 109 | I | 29 | Very low | 34.9 | Very low | 169 Ų | 169 | 148 Ų | 148 | 87% | 0.867 | 80% | 0.802 | S | S | * | * | trans | -145.5 | 107.2 | 163.8 | -56.4 | 179.7 | 0 | 0 | 0 | 109.5 | ||||
| 110 | F | 36.3 | Very low | 34.4 | Very low | 198 Ų | 198 | 146.3 Ų | 146.3 | 87% | 0.868 | 80% | 0.799 | S | S | * | * | trans | -86.3 | 166.5 | 142.1 | -97.1 | -90 | 0 | 0 | 0 | 107.1 | ||||
| 111 | P | 46.4 | Very low | 33.8 | Very low | 100 Ų | 100 | 149.1 Ų | 149.1 | 65% | 0.649 | 80% | 0.796 | S | S | * | * | cis | -126.5 | -175.8 | 10.2 | 27.4 | -2.1 | 0 | 0 | 0 | 111.7 | ||||
| 112 | E | 25.5 | Very low | 33.3 | Very low | 167 Ų | 167 | 150.9 Ų | 150.9 | 78% | 0.78 | 79% | 0.791 | S | S | * | * | 165.5 | 118.4 | 86.7 | -172.3 | 165.6 | 156.2 | 0 | 0 | 109.9 | |||||
| 113 | T | 34.3 | Very low | 33.1 | Very low | 131 Ų | 131 | 151.2 Ų | 151.2 | 80% | 0.804 | 79% | 0.786 | S | S | * | * | trans | -64.5 | 147.4 | 147.6 | 28.7 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 114 | P | 38.4 | Very low | 32.9 | Very low | 89 Ų | 89 | 149.3 Ų | 149.3 | 58% | 0.578 | 77% | 0.774 | S | S | * | * | -165.8 | -177.9 | 66.6 | 44.5 | -22.4 | 0 | 0 | 0 | 119 | |||||
| 115 | R | 26.9 | Very low | 32.1 | Very low | 220 Ų | 220 | 151.2 Ų | 151.2 | 83% | 0.83 | 77% | 0.773 | S | S | * | * | trans | 101.4 | 114.5 | 137.2 | -86.8 | 163.1 | -156.5 | -171.2 | 2.1 | 121.7 | ||||
| 116 | Q | 31.6 | Very low | 32.1 | Very low | 171 Ų | 171 | 152.7 Ų | 152.7 | 80% | 0.799 | 77% | 0.772 | S | S | * | * | trans | -40.2 | 154.8 | 143.2 | -66.7 | -175.9 | -30.1 | 0 | 0 | 113.6 | ||||
| 117 | P | 31.7 | Very low | 32.2 | Very low | 133 Ų | 133 | 149.2 Ų | 149.2 | 86% | 0.864 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -88 | 120 | 157.6 | 27.8 | -18.1 | 0 | 0 | 0 | 111.3 | ||
| 118 | E | 25.3 | Very low | 31.9 | Very low | 159 Ų | 159 | 147.9 Ų | 147.9 | 74% | 0.743 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -66.1 | 149.7 | 169.7 | -75.2 | 175.2 | 91.5 | 0 | 0 | 112.8 | ||
| 119 | K | 32.5 | Very low | 31.1 | Very low | 204 Ų | 204 | 146.6 Ų | 146.6 | 89% | 0.887 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 144.9 | 156 | -71.6 | -172 | 171.4 | -162.7 | 0 | 111 | ||
| 120 | L | 28.2 | Very low | 31.2 | Very low | 149 Ų | 149 | 145.5 Ų | 145.5 | 78% | 0.78 | 77% | 0.768 | S | S | * | * | trans | -144.3 | 108.2 | 159.1 | -125.6 | 129.3 | 0 | 0 | 0 | 106.2 | ||||
| 121 | K | 30.8 | Very low | 30.7 | Very low | 179 Ų | 179 | 139.6 Ų | 139.6 | 78% | 0.778 | 76% | 0.763 | S | S | * | * | 55.7 | 124.8 | 89.2 | -77.9 | -171.4 | 175.5 | -175.5 | 0 | 111.6 | |||||
| 122 | E | 26.9 | Very low | 29.8 | Very low | 152 Ų | 152 | 138.3 Ų | 138.3 | 71% | 0.71 | 77% | 0.768 | S | S | * | * | -178.2 | 159.6 | 61 | -125.2 | 161.6 | 67.8 | 0 | 0 | 104.9 | |||||
| 123 | D | 27.1 | Very low | 30.2 | Very low | 122 Ų | 122 | 136.1 Ų | 136.1 | 65% | 0.652 | 77% | 0.767 | S | S | * | * | cis | -175.7 | 153.3 | 31.1 | -139.5 | -21.7 | 0 | 0 | 0 | 112.1 | ||||
| 124 | T | 27.1 | Very low | 30.4 | Very low | 102 Ų | 102 | 138.4 Ų | 138.4 | 63% | 0.626 | 77% | 0.768 | S | S | * | * | trans | 75.6 | 115 | 136.3 | -70.6 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 125 | R | 27 | Very low | 30.1 | Very low | 224 Ų | 224 | 141.2 Ų | 141.2 | 85% | 0.845 | 78% | 0.778 | S | S | * | * | trans | 97.5 | 104.1 | 135.2 | -168.4 | 174.9 | -81.4 | 167.2 | -5.1 | 119.9 | ||||
| 126 | S | 32.9 | Very low | 30.6 | Very low | 108 Ų | 108 | 138.9 Ų | 138.9 | 76% | 0.755 | 78% | 0.777 | S | S | * | * | trans | -69.5 | 157.1 | 149.6 | -28 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 127 | P | 37.9 | Very low | 30.7 | Very low | 117 Ų | 117 | 135.1 Ų | 135.1 | 76% | 0.76 | 78% | 0.775 | S | S | * | * | -152.6 | 157.3 | 76.5 | 37.4 | -16.7 | 0 | 0 | 0 | 117.8 | |||||
| 128 | A | 26.6 | Very low | 31 | Very low | 98 Ų | 98 | 133.8 Ų | 133.8 | 81% | 0.81 | 78% | 0.775 | S | S | * | * | trans | 49.4 | 133.5 | 138.3 | 0 | 0 | 0 | 0 | 0 | 124.5 | ||||
| 129 | A | 30.3 | Very low | 31.2 | Very low | 87 Ų | 87 | 128.6 Ų | 128.6 | 72% | 0.719 | 77% | 0.765 | S | S | * | * | trans | 85.7 | 113.8 | 133.7 | 0 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 130 | T | 30.7 | Very low | 31.6 | Very low | 145 Ų | 145 | 124.4 Ų | 124.4 | 89% | 0.89 | 77% | 0.768 | S | S | * | * | 60.7 | 117.5 | 128.3 | -33.1 | 0 | 0 | 0 | 0 | 121 | |||||
| 131 | G | 27.2 | Very low | 32.3 | Very low | 75 Ų | 75 | 124.6 Ų | 124.6 | 77% | 0.773 | 77% | 0.765 | S | S | * | * | trans | 110.1 | 110 | 133.3 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 132 | G | 27.9 | Very low | 33.3 | Very low | 73 Ų | 73 | 124.3 Ų | 124.3 | 75% | 0.753 | 77% | 0.766 | S | S | * | * | 68.3 | 119.9 | 125.1 | 0 | 0 | 0 | 0 | 0 | 122 | |||||
| 133 | T | 32.8 | Very low | 34.7 | Very low | 121 Ų | 121 | 125.9 Ų | 125.9 | 74% | 0.742 | 77% | 0.773 | S | S | * | * | trans | 97.1 | 104.6 | 133.1 | -47.1 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 134 | Q | 38.5 | Very low | 36.2 | Very low | 178 Ų | 178 | 122.5 Ų | 122.5 | 83% | 0.832 | 76% | 0.755 | S | S | * | * | trans | 51.3 | 127.2 | 136.3 | -56.8 | 171.8 | -11.5 | 0 | 0 | 119.7 | ||||
| 135 | N | 31.6 | Very low | 38.1 | Very low | 148 Ų | 148 | 122 Ų | 122 | 79% | 0.791 | 75% | 0.748 | S | S | * | * | 179.9 | 130.8 | 91 | -149.7 | 17.1 | 0 | 0 | 0 | 112.8 | |||||
| 136 | E | 38.5 | Very low | 40.3 | Very low | 171 Ų | 171 | 117 Ų | 117 | 80% | 0.799 | 75% | 0.745 | S | S | * | * | trans | 19.2 | 127.8 | 146.3 | -71.9 | -97.6 | 96 | 0 | 0 | 121.2 | ||||
| 137 | A | 32.7 | Very low | 42.6 | Very low | 92 Ų | 92 | 112.8 Ų | 112.8 | 76% | 0.76 | 72% | 0.718 | S | S | * | * | 177.2 | 127.5 | 104.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 138 | A | 38.4 | Very low | 45.1 | Very low | 106 Ų | 106 | 107.2 Ų | 107.2 | 88% | 0.876 | 68% | 0.682 | S | S | * | * | trans | 66.1 | 90.6 | 139.4 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 139 | G | 29 | Very low | 48.1 | Very low | 50 Ų | 50 | 107.3 Ų | 107.3 | 52% | 0.515 | 67% | 0.669 | S | S | . | * | trans | -170.3 | 100 | 153 | 0 | 0 | 0 | 0 | 0 | 107.2 | E141 | G139-E141 PolarHBondContact O-N 3.13Š| ||
| 140 | A | 41.3 | Very low | 51 | Low | 116 Ų | 116 | 106.1 Ų | 106.1 | 96% | 0.959 | 65% | 0.653 | S | S | * | * | trans | -75.8 | 62.9 | 174 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 141 | E | 44 | Very low | 53.9 | Low | 153 Ų | 153 | 99.2 Ų | 99.2 | 72% | 0.715 | 61% | 0.61 | S | S | * | * | trans | -80.1 | 120 | 144.5 | 12.1 | -98 | 132.5 | 0 | 0 | 104.9 | G139 E143 | G139-E141 PolarHBondContact O-N 3.13Å; E141-E143 PolarHBondContact O-N 3.25Å | ||
| 142 | E | 51.9 | Low | 57 | Low | 173 Ų | 173 | 97.9 Ų | 97.9 | 81% | 0.808 | 59% | 0.585 | S | S | * | * | trans | -61.5 | 87.8 | 166.2 | -165.3 | 170.4 | -160.2 | 0 | 0 | 105.7 | L144 | E142-L144 PolarHBondContact O-N 3.49Š| ||
| 143 | E | 55.9 | Low | 60 | Low | 184 Ų | 184 | 101.9 Ų | 101.9 | 86% | 0.86 | 58% | 0.584 | S | S | * | * | trans | -65.1 | 88.5 | -173.6 | -153.7 | -179.3 | -161.6 | 0 | 0 | 106.5 | E141 L145 | E141-E143 PolarHBondContact O-N 3.25Å; E143-L145 PolarHBondContact O-N 2.89Å | ||
| 144 | L | 58.7 | Low | 62.8 | Low | 52 Ų | 52 | 100 Ų | 100 | 27% | 0.272 | 57% | 0.573 | S | S | . | * | P | Polyproline II helix | trans | -53.6 | 131.1 | 176.8 | -69.7 | 175.5 | 0 | 0 | 0 | 106.7 | E142 V148 D149 V160 Q164 | E142-L144 PolarHBondContact O-N 3.49Å; L144-V148 HydrophobicContact CB-CB 4.2Å; L144-V148 HydrophobicContact CB-CG1 4.46Å; L144-V148 HydrophobicContact CD1-CG1 4.45Å; L144-V148 HydrophobicContact CD2-CG1 4.29Å; L144-D149 WeakPolarHBondContact CD1-OD1 3.4Å; L144-V160 HydrophobicContact CD2-CG1 3.8Å; L144-Q164 VanDerWaalsContact CD2-NE2 3.27Å |
| 145 | L | 66.2 | Low | 65.2 | Low | 90 Ų | 90 | 93.8 Ų | 93.8 | 47% | 0.471 | 54% | 0.543 | S | S | . | . | P | Polyproline II helix | trans | -50.2 | 137.2 | -178.8 | -69.5 | 172.1 | 0 | 0 | 0 | 109.3 | E143 G147 V148 | E143-L145 PolarHBondContact O-N 2.89Å; L145-G147 PolarHBondContact O-N 3.33Å; L145-V148 HydrophobicContact CB-CG2 3.96Å; L145-V148 WeakPolarHBondContact O-CG2 3.46Å; L145-V148 PolarHBondContact O-N 3.44Å |
| 146 | P | 73.4 | Confident | 67.8 | Low | 121 Ų | 121 | 92.4 Ų | 92.4 | 79% | 0.786 | 54% | 0.542 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -50 | 117.6 | 179.2 | -25.8 | 32.1 | 0 | 0 | 0 | 110.3 | ||
| 147 | G | 81.9 | Confident | 69.9 | Low | 19 Ų | 19 | 90.8 Ų | 90.8 | 20% | 0.196 | 54% | 0.544 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 108.7 | -13.7 | -179.2 | 0 | 0 | 0 | 0 | 0 | 116 | L145 V150 L151 | L145-G147 PolarHBondContact O-N 3.33Å; G147-V150 PolarHBondContact O-N 3.14Å; G147-L151 WeakPolarHBondContact O-CG 3.41Å; G147-L151 PolarHBondContact O-N 3.14Å; G147-L151 VanDerWaalsContact O-N 3.09Å |
| 148 | V | 89.8 | Confident | 72.4 | Confident | 0 Ų | 0 | 87.1 Ų | 87.1 | 0% | 0 | 51% | 0.513 | C | S | . | . | H | α-helix | trans | -63.2 | -44.3 | 176.3 | 173.7 | 0 | 0 | 0 | 0 | 110.8 | L144 L145 V150 L151 L152 V160 A163 Q164 L167 | L144-V148 HydrophobicContact CB-CB 4.2Å; L144-V148 HydrophobicContact CB-CG1 4.46Å; L144-V148 HydrophobicContact CD1-CG1 4.45Å; L144-V148 HydrophobicContact CD2-CG1 4.29Å; L145-V148 HydrophobicContact CB-CG2 3.96Å; L145-V148 WeakPolarHBondContact O-CG2 3.46Å; L145-V148 PolarHBondContact O-N 3.44Å; V148-V150 VanDerWaalsContact C-N 3.28Å; V148-V150 PolarHBondContact O-N 3.46Å; V148-L151 PolarHBondContact O-N 3.14Å; V148-L151 VanDerWaalsContact O-N 3.16Å; V148-L152 HydrophobicContact CG1-CD1 3.91Å; V148-L152 HydrophobicContact CG1-CG 4.38Å; V148-L152 WeakPolarHBondContact O-CG 3.3Å; V148-L152 PolarHBondContact O-N 2.91Å; V148-V160 HydrophobicContact CG1-CG1 4.21Å; V148-A163 HydrophobicContact CG1-CB 4.01Å; V148-Q164 HydrophobicContact CG1-CG 4.2Å; V148-Q164 HydrophobicContact CG2-CB 4.49Å; V148-Q164 HydrophobicContact CG2-CG 3.61Å; V148-L167 HydrophobicContact CB-CD1 4.25Å; V148-L167 HydrophobicContact CG2-CD1 3.52Å |
| 149 | D | 90.3 | Very high | 74.8 | Confident | 100 Ų | 100 | 84.5 Ų | 84.5 | 54% | 0.535 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -59.6 | -40.4 | 178.8 | -62.1 | -34.6 | 0 | 0 | 0 | 111.9 | L144 L152 E153 | L144-D149 WeakPolarHBondContact CD1-OD1 3.4Å; D149-L152 PolarHBondContact O-N 2.93Å; D149-E153 WeakPolarHBondContact O-CB 3.49Å; D149-E153 PolarHBondContact O-N 3.45Å |
| 150 | V | 90.9 | Very high | 77.7 | Confident | 62 Ų | 62 | 85.1 Ų | 85.1 | 38% | 0.376 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -65.4 | -42.6 | 177.8 | -177.2 | 0 | 0 | 0 | 0 | 110.5 | G147 V148 L152 E153 V154 L174 | G147-V150 PolarHBondContact O-N 3.14Å; V148-V150 VanDerWaalsContact C-N 3.28Å; V148-V150 PolarHBondContact O-N 3.46Å; V150-L152 VanDerWaalsContact C-N 3.32Å; V150-L152 PolarHBondContact O-N 3.49Å; V150-E153 WeakPolarHBondContact O-CB 3.28Å; V150-E153 PolarHBondContact O-N 3.48Å; V150-V154 VanDerWaalsContact O-CG2 3.29Å; V150-V154 WeakPolarHBondContact O-CG2 3.33Å; V150-V154 PolarHBondContact O-N 2.92Å; V150-L174 HydrophobicContact CB-CD2 4.48Å; V150-L174 HydrophobicContact CG1-CD2 3.96Å |
| 151 | L | 90.9 | Very high | 79.9 | Confident | 0 Ų | 0 | 86 Ų | 86 | 0% | 0 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -64.3 | -36 | 176.1 | -71.5 | -179.5 | 0 | 0 | 0 | 112.7 | G147 V148 E153 V154 F155 A163 L167 L174 A177 V178 L181 | G147-L151 WeakPolarHBondContact O-CG 3.41Å; G147-L151 PolarHBondContact O-N 3.14Å; G147-L151 VanDerWaalsContact O-N 3.09Å; V148-L151 PolarHBondContact O-N 3.14Å; V148-L151 VanDerWaalsContact O-N 3.16Å; L151-E153 VanDerWaalsContact C-N 3.34Å; L151-V154 HydrophobicContact CD2-CG2 4.34Å; L151-F155 HydrophobicContact CD2-CD2 4.34Å; L151-F155 HydrophobicContact CD2-CE2 4.21Å; L151-F155 WeakPolarHBondContact O-CB 3.4Å; L151-F155 WeakPolarHBondContact O-CD2 3.35Å; L151-F155 PolarHBondContact O-N 3.18Å; L151-A163 HydrophobicContact CB-CB 3.87Å; L151-A163 HydrophobicContact CD1-CB 4.03Å; L151-L167 HydrophobicContact CD1-CD1 3.68Å; L151-L167 HydrophobicContact CD1-CD2 4.1Å; L151-L167 HydrophobicContact CD1-CG 3.58Å; L151-L174 HydrophobicContact CD1-CD1 4.33Å; L151-L174 HydrophobicContact CD2-CD1 3.75Å; L151-L174 HydrophobicContact CG-CD1 3.71Å; L151-A177 HydrophobicContact CD1-CB 4.04Å; L151-V178 HydrophobicContact CD2-CG2 3.49Å; L151-V178 VanDerWaalsContact CD2-CG2 3.49Å; L151-L181 HydrophobicContact CB-CD1 4.43Å; L151-L181 HydrophobicContact CD1-CD1 3.97Å; L151-L181 HydrophobicContact CD2-CD1 4.04Å; L151-L181 HydrophobicContact CG-CD1 4.39Å |
| 152 | L | 91.4 | Very high | 82 | Confident | 47 Ų | 47 | 81.6 Ų | 81.6 | 25% | 0.246 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -72.4 | -29.8 | 175.6 | -65.6 | 170.9 | 0 | 0 | 0 | 112.1 | V148 D149 V150 F155 C158 V160 A163 | V148-L152 HydrophobicContact CG1-CD1 3.91Å; V148-L152 HydrophobicContact CG1-CG 4.38Å; V148-L152 WeakPolarHBondContact O-CG 3.3Å; V148-L152 PolarHBondContact O-N 2.91Å; D149-L152 PolarHBondContact O-N 2.93Å; V150-L152 VanDerWaalsContact C-N 3.32Å; V150-L152 PolarHBondContact O-N 3.49Å; L152-F155 CarbonylContact O-C 3.5Å; L152-C158 VanDerWaalsContact CD2-O 3.24Å; L152-C158 WeakPolarHBondContact CD2-O 3.5Å; L152-V160 HydrophobicContact CD1-CB 4.5Å; L152-V160 HydrophobicContact CD1-CG2 3.85Å; L152-V160 HydrophobicContact CD2-CG2 4.46Å; L152-A163 HydrophobicContact CD2-CB 4.37Å; L152-A163 HydrophobicContact CG-CB 4.45Å |
| 153 | E | 91.2 | Very high | 83.7 | Confident | 157 Ų | 157 | 73.4 Ų | 73.4 | 73% | 0.734 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -69.4 | -46.2 | 172.9 | -172.7 | 175.4 | -175.4 | 0 | 0 | 111.6 | D149 V150 L151 | D149-E153 WeakPolarHBondContact O-CB 3.49Å; D149-E153 PolarHBondContact O-N 3.45Å; V150-E153 WeakPolarHBondContact O-CB 3.28Å; V150-E153 PolarHBondContact O-N 3.48Å; L151-E153 VanDerWaalsContact C-N 3.34Å |
| 154 | V | 92.1 | Very high | 85.4 | Confident | 82 Ų | 82 | 67.4 Ų | 67.4 | 50% | 0.497 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -78.7 | -24.4 | -179.9 | -62.1 | 0 | 0 | 0 | 0 | 113.7 | V150 L151 | V150-V154 VanDerWaalsContact O-CG2 3.29Å; V150-V154 WeakPolarHBondContact O-CG2 3.33Å; V150-V154 PolarHBondContact O-N 2.92Å; L151-V154 HydrophobicContact CD2-CG2 4.34Å |
| 155 | F | 89.3 | Confident | 86.8 | Confident | 47 Ų | 47 | 68 Ų | 68 | 21% | 0.206 | 38% | 0.378 | C | S | . | . | trans | -123.8 | 85.9 | 177 | -60.1 | -74.3 | 0 | 0 | 0 | 111.9 | L151 L152 T157 C158 V178 L181 V182 | L151-F155 HydrophobicContact CD2-CD2 4.34Å; L151-F155 HydrophobicContact CD2-CE2 4.21Å; L151-F155 WeakPolarHBondContact O-CB 3.4Å; L151-F155 WeakPolarHBondContact O-CD2 3.35Å; L151-F155 PolarHBondContact O-N 3.18Å; L152-F155 CarbonylContact O-C 3.5Å; F155-T157 PolarHBondContact O-N 2.92Å; F155-C158 HydrophobicContact CB-CB 3.51Å; F155-C158 VanDerWaalsContact O-CB 3.23Å; F155-C158 WeakPolarHBondContact O-CB 3.41Å; F155-C158 PolarHBondContact O-N 3.25Å; F155-V178 HydrophobicContact CE2-CB 4.37Å; F155-V178 HydrophobicContact CE2-CG1 4.11Å; F155-V178 HydrophobicContact CE2-CG2 4.17Å; F155-V178 HydrophobicContact CZ-CG1 3.93Å; F155-L181 HydrophobicContact CD2-CB 4.43Å; F155-L181 HydrophobicContact CD2-CD1 3.96Å; F155-L181 HydrophobicContact CE2-CB 4.14Å; F155-L181 HydrophobicContact CE2-CD1 4.15Å; F155-L181 HydrophobicContact CZ-CB 4.35Å; F155-V182 HydrophobicContact CE1-CG2 3.78Å; F155-V182 HydrophobicContact CZ-CG2 3.63Å | ||
| 156 | P | 86.5 | Confident | 87.8 | Confident | 118 Ų | 118 | 63.8 Ų | 63.8 | 77% | 0.766 | 36% | 0.356 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.7 | -16.1 | -178.3 | -24.8 | 34.4 | 0 | 0 | 0 | 115.3 | ||
| 157 | T | 82.4 | Confident | 88.6 | Confident | 137 Ų | 137 | 58.3 Ų | 58.3 | 84% | 0.84 | 32% | 0.319 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.5 | -6.7 | 176.8 | 57.5 | 0 | 0 | 0 | 0 | 113.3 | F155 | F155-T157 PolarHBondContact O-N 2.92Š|
| 158 | C | 85.3 | Confident | 88.9 | Confident | 16 Ų | 16 | 60.5 Ų | 60.5 | 11% | 0.108 | 34% | 0.336 | C | S | . | . | trans | -78 | 136 | 178.2 | -173.1 | 0 | 0 | 0 | 0 | 109.5 | L152 F155 Q162 | L152-C158 VanDerWaalsContact CD2-O 3.24Å; L152-C158 WeakPolarHBondContact CD2-O 3.5Å; F155-C158 HydrophobicContact CB-CB 3.51Å; F155-C158 VanDerWaalsContact O-CB 3.23Å; F155-C158 WeakPolarHBondContact O-CB 3.41Å; F155-C158 PolarHBondContact O-N 3.25Å; C158-Q162 VanDerWaalsContact SG-CB 3.56Å | ||
| 159 | S | 87.8 | Confident | 88.8 | Confident | 50 Ų | 50 | 65.9 Ų | 65.9 | 35% | 0.35 | 36% | 0.359 | S | S | . | . | trans | -83.4 | 157.8 | 172.6 | 75.8 | 0 | 0 | 0 | 0 | 111.2 | E161 Q162 A163 | S159-E161 PolarHBondContact O-N 3.41Å; S159-Q162 WeakPolarHBondContact O-CB 3.27Å; S159-Q162 PolarHBondContact O-N 3.01Å; S159-Q162 WeakPolarHBondContact OG-CG 3.42Å; S159-Q162 PolarHBondContact OG-N 3.37Å; S159-A163 PolarHBondContact O-N 2.88Å | ||
| 160 | V | 89.9 | Confident | 88.7 | Confident | 64 Ų | 64 | 61.8 Ų | 61.8 | 39% | 0.388 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -54.9 | -41 | 176.6 | -175.7 | 0 | 0 | 0 | 0 | 111.1 | L144 V148 L152 Q162 A163 Q164 | L144-V160 HydrophobicContact CD2-CG1 3.8Å; V148-V160 HydrophobicContact CG1-CG1 4.21Å; L152-V160 HydrophobicContact CD1-CB 4.5Å; L152-V160 HydrophobicContact CD1-CG2 3.85Å; L152-V160 HydrophobicContact CD2-CG2 4.46Å; V160-Q162 PolarHBondContact O-N 3.16Å; V160-A163 PolarHBondContact O-N 3.15Å; V160-Q164 HydrophobicContact CG1-CG 4.43Å; V160-Q164 WeakPolarHBondContact O-CB 3.3Å; V160-Q164 VanDerWaalsContact O-CG 3.28Å; V160-Q164 WeakPolarHBondContact O-CG 3.43Å; V160-Q164 PolarHBondContact O-N 3.43Å |
| 161 | E | 88 | Confident | 88.4 | Confident | 133 Ų | 133 | 70.3 Ų | 70.3 | 62% | 0.621 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -65.3 | -37.2 | 178.5 | -61 | -179.4 | 179.6 | 0 | 0 | 112.5 | S159 W165 | S159-E161 PolarHBondContact O-N 3.41Å; E161-W165 VanDerWaalsContact O-CB 3.23Å; E161-W165 WeakPolarHBondContact O-CB 3.42Å; E161-W165 PolarHBondContact O-N 3.47Å |
| 162 | Q | 87.1 | Confident | 88.1 | Confident | 62 Ų | 62 | 72.9 Ų | 72.9 | 29% | 0.29 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -68.1 | -45.3 | 176.8 | -75.7 | 172.5 | -26.4 | 0 | 0 | 111.5 | C158 S159 V160 W165 A166 L181 W192 | C158-Q162 VanDerWaalsContact SG-CB 3.56Å; S159-Q162 WeakPolarHBondContact O-CB 3.27Å; S159-Q162 PolarHBondContact O-N 3.01Å; S159-Q162 WeakPolarHBondContact OG-CG 3.42Å; S159-Q162 PolarHBondContact OG-N 3.37Å; V160-Q162 PolarHBondContact O-N 3.16Å; Q162-W165 PolarHBondContact O-N 3.04Å; Q162-A166 WeakPolarHBondContact O-CB 3.46Å; Q162-A166 PolarHBondContact O-N 3.36Å; Q162-L181 HydrophobicContact CB-CD2 4.32Å; Q162-W192 HydrophobicContact CB-CH2 4.43Å; Q162-W192 HydrophobicContact CB-CZ3 4.28Å; Q162-W192 HydrophobicContact CG-CE3 3.97Å; Q162-W192 HydrophobicContact CG-CH2 3.93Å; Q162-W192 HydrophobicContact CG-CZ3 3.62Å |
| 163 | A | 89.4 | Confident | 88 | Confident | 0 Ų | 0 | 74.6 Ų | 74.6 | 0% | 0 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -63.2 | -44.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | V148 L151 L152 S159 V160 A166 L167 | V148-A163 HydrophobicContact CG1-CB 4.01Å; L151-A163 HydrophobicContact CB-CB 3.87Å; L151-A163 HydrophobicContact CD1-CB 4.03Å; L152-A163 HydrophobicContact CD2-CB 4.37Å; L152-A163 HydrophobicContact CG-CB 4.45Å; S159-A163 PolarHBondContact O-N 2.88Å; V160-A163 PolarHBondContact O-N 3.15Å; A163-A166 PolarHBondContact O-N 2.85Å; A163-L167 WeakPolarHBondContact O-CB 3.4Å; A163-L167 WeakPolarHBondContact O-CG 3.21Å; A163-L167 PolarHBondContact O-N 2.98Å |
| 164 | Q | 90.4 | Very high | 88 | Confident | 59 Ų | 59 | 70.1 Ų | 70.1 | 28% | 0.276 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -62.9 | -42.7 | 175.8 | -75.4 | 176.4 | -8.4 | 0 | 0 | 112.2 | L144 V148 V160 A168 | L144-Q164 VanDerWaalsContact CD2-NE2 3.27Å; V148-Q164 HydrophobicContact CG1-CG 4.2Å; V148-Q164 HydrophobicContact CG2-CB 4.49Å; V148-Q164 HydrophobicContact CG2-CG 3.61Å; V160-Q164 HydrophobicContact CG1-CG 4.43Å; V160-Q164 WeakPolarHBondContact O-CB 3.3Å; V160-Q164 VanDerWaalsContact O-CG 3.28Å; V160-Q164 WeakPolarHBondContact O-CG 3.43Å; V160-Q164 PolarHBondContact O-N 3.43Å; Q164-A168 VanDerWaalsContact O-CB 3.26Å; Q164-A168 WeakPolarHBondContact O-CB 3.25Å; Q164-A168 PolarHBondContact O-N 3.35Å |
| 165 | W | 87.9 | Confident | 87.9 | Confident | 65 Ų | 65 | 72.6 Ų | 72.6 | 25% | 0.246 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -65.1 | -44 | 177.4 | 177.4 | 85.7 | 0 | 0 | 0 | 112.3 | E161 Q162 L167 A168 K169 M180 P189 W192 | E161-W165 VanDerWaalsContact O-CB 3.23Å; E161-W165 WeakPolarHBondContact O-CB 3.42Å; E161-W165 PolarHBondContact O-N 3.47Å; Q162-W165 PolarHBondContact O-N 3.04Å; W165-L167 PolarHBondContact O-N 3.42Å; W165-A168 PolarHBondContact O-N 3.15Å; W165-K169 HydrophobicContact CH2-CD 3.6Å; W165-K169 HydrophobicContact CZ2-CD 3.46Å; W165-K169 VanDerWaalsContact CZ2-CD 3.46Å; W165-K169 HydrophobicContact CZ3-CD 4.28Å; W165-K169 WeakPolarHBondContact O-CB 3.31Å; W165-K169 PolarHBondContact O-N 2.86Å; W165-M180 HydrophobicContact CH2-CE 4.03Å; W165-M180 HydrophobicContact CZ3-CE 3.99Å; W165-P189 HydrophobicContact CD2-CG 4.1Å; W165-P189 HydrophobicContact CG-CG 4.45Å; W165-P189 HydrophobicContact CH2-CG 4.37Å; W165-P189 HydrophobicContact CZ2-CG 3.56Å; W165-W192 HydrophobicContact CB-CH2 3.61Å; W165-W192 HydrophobicContact CB-CZ2 4.48Å; W165-W192 HydrophobicContact CB-CZ3 4.4Å; W165-W192 HydrophobicContact CD2-CH2 4.05Å; W165-W192 HydrophobicContact CD2-CZ3 4.12Å; W165-W192 HydrophobicContact CE3-CH2 4.34Å; W165-W192 HydrophobicContact CE3-CZ3 4.02Å; W165-W192 AromaticContact CG-CH2 3.72Å; W165-W192 HydrophobicContact CG-CH2 3.72Å; W165-W192 HydrophobicContact CG-CZ3 4.28Å |
| 166 | A | 88.5 | Confident | 88 | Confident | 1 Ų | 1 | 75.6 Ų | 75.6 | 1% | 0.008 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -60.9 | -45.6 | 177.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | Q162 A163 K169 A170 A177 L181 | Q162-A166 WeakPolarHBondContact O-CB 3.46Å; Q162-A166 PolarHBondContact O-N 3.36Å; A163-A166 PolarHBondContact O-N 2.85Å; A166-K169 PolarHBondContact O-N 2.93Å; A166-A170 WeakPolarHBondContact O-CB 3.15Å; A166-A170 PolarHBondContact O-N 3.14Å; A166-A177 HydrophobicContact CB-CB 4.08Å; A166-L181 HydrophobicContact CB-CD1 4.16Å; A166-L181 HydrophobicContact CB-CD2 4.17Å; A166-L181 HydrophobicContact CB-CG 3.86Å |
| 167 | L | 90.1 | Very high | 88.2 | Confident | 5 Ų | 5 | 70 Ų | 70 | 3% | 0.026 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -65.1 | -40.5 | 175.6 | -75.4 | 165.9 | 0 | 0 | 0 | 112.8 | V148 L151 A163 W165 K169 A170 R171 G172 L174 A177 | V148-L167 HydrophobicContact CB-CD1 4.25Å; V148-L167 HydrophobicContact CG2-CD1 3.52Å; L151-L167 HydrophobicContact CD1-CD1 3.68Å; L151-L167 HydrophobicContact CD1-CD2 4.1Å; L151-L167 HydrophobicContact CD1-CG 3.58Å; A163-L167 WeakPolarHBondContact O-CB 3.4Å; A163-L167 WeakPolarHBondContact O-CG 3.21Å; A163-L167 PolarHBondContact O-N 2.98Å; W165-L167 PolarHBondContact O-N 3.42Å; L167-K169 VanDerWaalsContact C-N 3.32Å; L167-K169 PolarHBondContact O-N 3.39Å; L167-A170 CarbonylContact O-C 3.47Å; L167-A170 PolarHBondContact O-N 2.94Å; L167-R171 PolarHBondContact O-N 3Å; L167-G172 PolarHBondContact O-N 3.42Å; L167-L174 HydrophobicContact CD2-CD1 4.17Å; L167-A177 HydrophobicContact CD2-CB 3.79Å; L167-A177 HydrophobicContact CG-CB 4.09Å |
| 168 | A | 88.4 | Confident | 88.6 | Confident | 66 Ų | 66 | 65.1 Ų | 65.1 | 55% | 0.545 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -63.3 | -39.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q164 W165 R171 | Q164-A168 VanDerWaalsContact O-CB 3.26Å; Q164-A168 WeakPolarHBondContact O-CB 3.25Å; Q164-A168 PolarHBondContact O-N 3.35Å; W165-A168 PolarHBondContact O-N 3.15Å; A168-R171 PolarHBondContact O-N 2.7Å |
| 169 | K | 86.6 | Confident | 88.8 | Confident | 112 Ų | 112 | 68.3 Ų | 68.3 | 49% | 0.487 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -72.7 | -37.9 | 178.1 | -170.2 | 163.8 | 170.6 | -163.7 | 0 | 112.1 | W165 A166 L167 R171 M180 | W165-K169 HydrophobicContact CH2-CD 3.6Å; W165-K169 HydrophobicContact CZ2-CD 3.46Å; W165-K169 VanDerWaalsContact CZ2-CD 3.46Å; W165-K169 HydrophobicContact CZ3-CD 4.28Å; W165-K169 WeakPolarHBondContact O-CB 3.31Å; W165-K169 PolarHBondContact O-N 2.86Å; A166-K169 PolarHBondContact O-N 2.93Å; L167-K169 VanDerWaalsContact C-N 3.32Å; L167-K169 PolarHBondContact O-N 3.39Å; K169-R171 PolarHBondContact O-N 2.87Å; K169-M180 HydrophobicContact CB-CE 4.37Å; K169-M180 HydrophobicContact CB-SD 4.37Å; K169-M180 HydrophobicContact CD-CE 3.41Å; K169-M180 VanDerWaalsContact CD-CE 3.41Å; K169-M180 HydrophobicContact CD-SD 4.27Å; K169-M180 HydrophobicContact CG-CE 3.9Å; K169-M180 HydrophobicContact CG-SD 4.09Å |
| 170 | A | 88.9 | Confident | 88.6 | Confident | 15 Ų | 15 | 67.6 Ų | 67.6 | 12% | 0.124 | 34% | 0.341 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -77.4 | 3.3 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | A166 L167 G172 D173 E176 A177 | A166-A170 WeakPolarHBondContact O-CB 3.15Å; A166-A170 PolarHBondContact O-N 3.14Å; L167-A170 CarbonylContact O-C 3.47Å; L167-A170 PolarHBondContact O-N 2.94Å; A170-G172 PolarHBondContact O-N 3.49Å; A170-D173 HydrophobicContact CB-CB 4.45Å; A170-D173 VanDerWaalsContact CB-O 3.28Å; A170-D173 WeakPolarHBondContact CB-O 3.3Å; A170-D173 WeakPolarHBondContact O-CB 3.46Å; A170-D173 PolarHBondContact O-N 2.94Å; A170-E176 HydrophobicContact CB-CB 3.88Å; A170-A177 HydrophobicContact CB-CB 3.95Å |
| 171 | R | 85 | Confident | 88.5 | Confident | 240 Ų | 240 | 66.1 Ų | 66.1 | 91% | 0.906 | 33% | 0.331 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.1 | 33.4 | -180 | -53.4 | -179.1 | 177.2 | -151.5 | -1.2 | 113.6 | L167 A168 K169 | L167-R171 PolarHBondContact O-N 3Å; A168-R171 PolarHBondContact O-N 2.7Å; K169-R171 PolarHBondContact O-N 2.87Å |
| 172 | G | 83.7 | Confident | 88.4 | Confident | 54 Ų | 54 | 64.1 Ų | 64.1 | 56% | 0.557 | 33% | 0.327 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 85 | 6.5 | -179.1 | 0 | 0 | 0 | 0 | 0 | 114.9 | L167 A170 | L167-G172 PolarHBondContact O-N 3.42Å; A170-G172 PolarHBondContact O-N 3.49Å |
| 173 | D | 89.9 | Confident | 88.1 | Confident | 84 Ų | 84 | 67.3 Ų | 67.3 | 45% | 0.449 | 34% | 0.342 | S | S | . | . | trans | -79.5 | 118.2 | 169.7 | -165.4 | -26.7 | 0 | 0 | 0 | 110.1 | A170 E175 E176 A177 | A170-D173 HydrophobicContact CB-CB 4.45Å; A170-D173 VanDerWaalsContact CB-O 3.28Å; A170-D173 WeakPolarHBondContact CB-O 3.3Å; A170-D173 WeakPolarHBondContact O-CB 3.46Å; A170-D173 PolarHBondContact O-N 2.94Å; D173-E175 PolarHBondContact OD1-N 3.49Å; D173-E176 HydrophobicContact CB-CB 4.12Å; D173-E176 HydrophobicContact CB-CG 4.31Å; D173-A177 VanDerWaalsContact O-CB 3.3Å; D173-A177 WeakPolarHBondContact O-CB 3.35Å; D173-A177 PolarHBondContact O-N 2.95Å; D173-A177 VanDerWaalsContact O-N 3.11Å | ||
| 174 | L | 91.1 | Very high | 86.7 | Confident | 63 Ų | 63 | 69 Ų | 69 | 33% | 0.33 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -70.3 | -40 | -177.4 | -172.7 | 71 | 0 | 0 | 0 | 111.4 | V150 L151 L167 A177 V178 | V150-L174 HydrophobicContact CB-CD2 4.48Å; V150-L174 HydrophobicContact CG1-CD2 3.96Å; L151-L174 HydrophobicContact CD1-CD1 4.33Å; L151-L174 HydrophobicContact CD2-CD1 3.75Å; L151-L174 HydrophobicContact CG-CD1 3.71Å; L167-L174 HydrophobicContact CD2-CD1 4.17Å; L174-A177 PolarHBondContact O-N 3.36Å; L174-V178 HydrophobicContact CG-CG2 4.47Å; L174-V178 VanDerWaalsContact O-CG2 3.23Å; L174-V178 WeakPolarHBondContact O-CG2 3.04Å; L174-V178 PolarHBondContact O-N 3.35Å |
| 175 | E | 90.9 | Very high | 85.1 | Confident | 133 Ų | 133 | 75.7 Ų | 75.7 | 62% | 0.621 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -67.6 | -44.7 | -175.4 | -169.6 | 68.1 | -159.1 | 0 | 0 | 110.4 | D173 A177 V178 Q179 | D173-E175 PolarHBondContact OD1-N 3.49Å; E175-A177 VanDerWaalsContact C-N 3.34Å; E175-A177 PolarHBondContact O-N 3.04Å; E175-V178 WeakPolarHBondContact O-CB 3.3Å; E175-V178 PolarHBondContact O-N 3.29Å; E175-Q179 PolarHBondContact O-N 3.03Å |
| 176 | E | 89.4 | Confident | 83.3 | Confident | 110 Ų | 110 | 81.4 Ų | 81.4 | 51% | 0.514 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -64 | -39.5 | 173.6 | -71.8 | -70.3 | 141.7 | 0 | 0 | 111.1 | A170 D173 V178 Q179 M180 | A170-E176 HydrophobicContact CB-CB 3.88Å; D173-E176 HydrophobicContact CB-CB 4.12Å; D173-E176 HydrophobicContact CB-CG 4.31Å; E176-V178 VanDerWaalsContact C-N 3.35Å; E176-V178 PolarHBondContact O-N 3.44Å; E176-Q179 PolarHBondContact O-N 3Å; E176-M180 VanDerWaalsContact O-CB 3.31Å; E176-M180 WeakPolarHBondContact O-CB 3.19Å; E176-M180 WeakPolarHBondContact O-CG 2.91Å; E176-M180 PolarHBondContact O-N 3.27Å |
| 177 | A | 90.9 | Very high | 81.5 | Confident | 0 Ų | 0 | 89 Ų | 89 | 0% | 0 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -64.2 | -37.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | L151 A166 L167 A170 D173 L174 E175 L181 | L151-A177 HydrophobicContact CD1-CB 4.04Å; A166-A177 HydrophobicContact CB-CB 4.08Å; L167-A177 HydrophobicContact CD2-CB 3.79Å; L167-A177 HydrophobicContact CG-CB 4.09Å; A170-A177 HydrophobicContact CB-CB 3.95Å; D173-A177 VanDerWaalsContact O-CB 3.3Å; D173-A177 WeakPolarHBondContact O-CB 3.35Å; D173-A177 PolarHBondContact O-N 2.95Å; D173-A177 VanDerWaalsContact O-N 3.11Å; L174-A177 PolarHBondContact O-N 3.36Å; E175-A177 VanDerWaalsContact C-N 3.34Å; E175-A177 PolarHBondContact O-N 3.04Å; A177-L181 WeakPolarHBondContact O-CG 3.4Å; A177-L181 PolarHBondContact O-N 2.86Å |
| 178 | V | 91.2 | Very high | 79.9 | Confident | 36 Ų | 36 | 90.4 Ų | 90.4 | 22% | 0.218 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -63.3 | -51.5 | 173.2 | 168 | 0 | 0 | 0 | 0 | 110 | L151 F155 L174 E175 E176 M180 L181 V182 | L151-V178 HydrophobicContact CD2-CG2 3.49Å; L151-V178 VanDerWaalsContact CD2-CG2 3.49Å; F155-V178 HydrophobicContact CE2-CB 4.37Å; F155-V178 HydrophobicContact CE2-CG1 4.11Å; F155-V178 HydrophobicContact CE2-CG2 4.17Å; F155-V178 HydrophobicContact CZ-CG1 3.93Å; L174-V178 HydrophobicContact CG-CG2 4.47Å; L174-V178 VanDerWaalsContact O-CG2 3.23Å; L174-V178 WeakPolarHBondContact O-CG2 3.04Å; L174-V178 PolarHBondContact O-N 3.35Å; E175-V178 WeakPolarHBondContact O-CB 3.3Å; E175-V178 PolarHBondContact O-N 3.29Å; E176-V178 VanDerWaalsContact C-N 3.35Å; E176-V178 PolarHBondContact O-N 3.44Å; V178-M180 VanDerWaalsContact C-N 3.26Å; V178-M180 PolarHBondContact O-N 3.38Å; V178-L181 PolarHBondContact O-N 2.84Å; V178-L181 VanDerWaalsContact O-N 3.07Å; V178-V182 WeakPolarHBondContact O-CG2 3.33Å; V178-V182 PolarHBondContact O-N 2.74Å |
| 179 | Q | 89.8 | Confident | 78.3 | Confident | 83 Ų | 83 | 89 Ų | 89 | 39% | 0.388 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -57.2 | -44.3 | 179 | -169.7 | 64.5 | 24.3 | 0 | 0 | 110.7 | E175 E176 L181 V182 E183 | E175-Q179 PolarHBondContact O-N 3.03Å; E176-Q179 PolarHBondContact O-N 3Å; Q179-L181 PolarHBondContact O-N 3.44Å; Q179-V182 PolarHBondContact O-N 2.79Å; Q179-E183 HydrophobicContact CG-CG 4.41Å; Q179-E183 PolarHBondContact NE2-OE1 2.87Å; Q179-E183 WeakPolarHBondContact O-CB 3.37Å; Q179-E183 WeakPolarHBondContact O-CG 3.36Å; Q179-E183 PolarHBondContact O-N 2.87Å |
| 180 | M | 84.4 | Confident | 76.5 | Confident | 35 Ų | 35 | 90.4 Ų | 90.4 | 17% | 0.172 | 47% | 0.469 | C | S | . | . | H | α-helix | trans | -61.2 | -43.3 | 175 | -75.4 | -165.4 | 66 | 0 | 0 | 112.8 | W165 K169 E176 V178 V182 E183 S184 | W165-M180 HydrophobicContact CH2-CE 4.03Å; W165-M180 HydrophobicContact CZ3-CE 3.99Å; K169-M180 HydrophobicContact CB-CE 4.37Å; K169-M180 HydrophobicContact CB-SD 4.37Å; K169-M180 HydrophobicContact CD-CE 3.41Å; K169-M180 VanDerWaalsContact CD-CE 3.41Å; K169-M180 HydrophobicContact CD-SD 4.27Å; K169-M180 HydrophobicContact CG-CE 3.9Å; K169-M180 HydrophobicContact CG-SD 4.09Å; E176-M180 VanDerWaalsContact O-CB 3.31Å; E176-M180 WeakPolarHBondContact O-CB 3.19Å; E176-M180 WeakPolarHBondContact O-CG 2.91Å; E176-M180 PolarHBondContact O-N 3.27Å; V178-M180 VanDerWaalsContact C-N 3.26Å; V178-M180 PolarHBondContact O-N 3.38Å; M180-V182 VanDerWaalsContact C-N 3.31Å; M180-V182 PolarHBondContact O-N 3.42Å; M180-E183 PolarHBondContact O-N 2.89Å; M180-S184 WeakPolarHBondContact O-CA 3.34Å; M180-S184 WeakPolarHBondContact O-CB 3.23Å; M180-S184 PolarHBondContact O-N 3.39Å; M180-S184 PolarHBondContact O-OG 3.38Å |
| 181 | L | 86.7 | Confident | 74.8 | Confident | 33 Ų | 33 | 92.7 Ų | 92.7 | 17% | 0.173 | 49% | 0.494 | C | S | . | . | H | α-helix | trans | -67.5 | -30.7 | 177.6 | -77.2 | 170.1 | 0 | 0 | 0 | 112.9 | L151 F155 Q162 A166 A177 V178 Q179 | L151-L181 HydrophobicContact CB-CD1 4.43Å; L151-L181 HydrophobicContact CD1-CD1 3.97Å; L151-L181 HydrophobicContact CD2-CD1 4.04Å; L151-L181 HydrophobicContact CG-CD1 4.39Å; F155-L181 HydrophobicContact CD2-CB 4.43Å; F155-L181 HydrophobicContact CD2-CD1 3.96Å; F155-L181 HydrophobicContact CE2-CB 4.14Å; F155-L181 HydrophobicContact CE2-CD1 4.15Å; F155-L181 HydrophobicContact CZ-CB 4.35Å; Q162-L181 HydrophobicContact CB-CD2 4.32Å; A166-L181 HydrophobicContact CB-CD1 4.16Å; A166-L181 HydrophobicContact CB-CD2 4.17Å; A166-L181 HydrophobicContact CB-CG 3.86Å; A177-L181 WeakPolarHBondContact O-CG 3.4Å; A177-L181 PolarHBondContact O-N 2.86Å; V178-L181 PolarHBondContact O-N 2.84Å; V178-L181 VanDerWaalsContact O-N 3.07Å; Q179-L181 PolarHBondContact O-N 3.44Å |
| 182 | V | 86.8 | Confident | 73.4 | Confident | 90 Ų | 90 | 86.2 Ų | 86.2 | 55% | 0.545 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -74.6 | -41.4 | 175.7 | 174.8 | 0 | 0 | 0 | 0 | 111.6 | F155 V178 Q179 M180 | F155-V182 HydrophobicContact CE1-CG2 3.78Å; F155-V182 HydrophobicContact CZ-CG2 3.63Å; V178-V182 WeakPolarHBondContact O-CG2 3.33Å; V178-V182 PolarHBondContact O-N 2.74Å; Q179-V182 PolarHBondContact O-N 2.79Å; M180-V182 VanDerWaalsContact C-N 3.31Å; M180-V182 PolarHBondContact O-N 3.42Å |
| 183 | E | 80.2 | Confident | 71.8 | Confident | 129 Ų | 129 | 90.7 Ų | 90.7 | 60% | 0.603 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -81.5 | -30.7 | -178.5 | -69 | 179.8 | 169 | 0 | 0 | 113.2 | Q179 M180 K185 | Q179-E183 HydrophobicContact CG-CG 4.41Å; Q179-E183 PolarHBondContact NE2-OE1 2.87Å; Q179-E183 WeakPolarHBondContact O-CB 3.37Å; Q179-E183 WeakPolarHBondContact O-CG 3.36Å; Q179-E183 PolarHBondContact O-N 2.87Å; M180-E183 PolarHBondContact O-N 2.89Å; E183-K185 PolarHBondContact O-N 2.82Å |
| 184 | S | 60.8 | Low | 69.5 | Low | 35 Ų | 35 | 88.9 Ų | 88.9 | 25% | 0.245 | 48% | 0.482 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -75.4 | 24.5 | -170.4 | 62.9 | 0 | 0 | 0 | 0 | 116.3 | M180 E186 | M180-S184 WeakPolarHBondContact O-CA 3.34Å; M180-S184 WeakPolarHBondContact O-CB 3.23Å; M180-S184 PolarHBondContact O-N 3.39Å; M180-S184 PolarHBondContact O-OG 3.38Å; S184-E186 PolarHBondContact O-N 3.42Å |
| 185 | K | 56.2 | Low | 67.4 | Low | 201 Ų | 201 | 91.1 Ų | 91.1 | 87% | 0.874 | 50% | 0.5 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.2 | -7.3 | 162.6 | -155.4 | 173.3 | -179.3 | 177.5 | 0 | 112.5 | E183 | E183-K185 PolarHBondContact O-N 2.82Š|
| 186 | E | 49.5 | Very low | 65.2 | Low | 185 Ų | 185 | 91 Ų | 91 | 86% | 0.864 | 50% | 0.504 | S | S | * | . | S | Bend | trans | -131.9 | -11 | -177.4 | -149.2 | 171 | -178.7 | 0 | 0 | 116 | S184 | S184-E186 PolarHBondContact O-N 3.42Š|
| 187 | E | 51 | Low | 63.3 | Low | 160 Ų | 160 | 93.5 Ų | 93.5 | 75% | 0.748 | 52% | 0.516 | S | S | * | . | trans | -140.9 | 57.6 | -173.8 | -154 | 166.8 | -178.7 | 0 | 0 | 114 | ||||
| 188 | G | 56.5 | Low | 61.2 | Low | 35 Ų | 35 | 101.4 Ų | 101.4 | 36% | 0.361 | 56% | 0.558 | S | S | . | * | S | Bend | trans | -87.3 | 172.5 | 166.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||
| 189 | P | 55.8 | Low | 59.2 | Low | 35 Ų | 35 | 103.8 Ų | 103.8 | 23% | 0.227 | 57% | 0.569 | C | S | . | * | trans | -54.5 | 144.5 | 170.5 | -21.2 | 33 | 0 | 0 | 0 | 111.8 | W165 G191 W192 | W165-P189 HydrophobicContact CD2-CG 4.1Å; W165-P189 HydrophobicContact CG-CG 4.45Å; W165-P189 HydrophobicContact CH2-CG 4.37Å; W165-P189 HydrophobicContact CZ2-CG 3.56Å; P189-G191 PolarHBondContact O-N 2.77Å; P189-W192 HydrophobicContact CG-CD2 4.44Å; P189-W192 HydrophobicContact CG-CE3 4.33Å; P189-W192 HydrophobicContact CG-CH2 4.37Å; P189-W192 HydrophobicContact CG-CZ2 4.47Å; P189-W192 HydrophobicContact CG-CZ3 4.28Å; P189-W192 PolarHBondContact O-N 3.45Å | ||
| 190 | P | 48.1 | Very low | 57.2 | Low | 142 Ų | 142 | 104 Ų | 104 | 92% | 0.922 | 58% | 0.578 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.4 | 101.6 | 178 | 26.6 | -32.4 | 0 | 0 | 0 | 109.4 | ||
| 191 | G | 52.9 | Low | 55.8 | Low | 63 Ų | 63 | 113.9 Ų | 113.9 | 65% | 0.649 | 61% | 0.613 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 151.4 | -14.5 | -175.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | P189 | P189-G191 PolarHBondContact O-N 2.77Š|
| 192 | W | 54.8 | Low | 54.2 | Low | 104 Ų | 104 | 123.2 Ų | 123.2 | 39% | 0.394 | 65% | 0.646 | S | S | . | * | S | Bend | trans | -96.4 | -8.9 | 177 | -63.1 | -8.7 | 0 | 0 | 0 | 114 | Q162 W165 P189 G194 | Q162-W192 HydrophobicContact CB-CH2 4.43Å; Q162-W192 HydrophobicContact CB-CZ3 4.28Å; Q162-W192 HydrophobicContact CG-CE3 3.97Å; Q162-W192 HydrophobicContact CG-CH2 3.93Å; Q162-W192 HydrophobicContact CG-CZ3 3.62Å; W165-W192 HydrophobicContact CB-CH2 3.61Å; W165-W192 HydrophobicContact CB-CZ2 4.48Å; W165-W192 HydrophobicContact CB-CZ3 4.4Å; W165-W192 HydrophobicContact CD2-CH2 4.05Å; W165-W192 HydrophobicContact CD2-CZ3 4.12Å; W165-W192 HydrophobicContact CE3-CH2 4.34Å; W165-W192 HydrophobicContact CE3-CZ3 4.02Å; W165-W192 AromaticContact CG-CH2 3.72Å; W165-W192 HydrophobicContact CG-CH2 3.72Å; W165-W192 HydrophobicContact CG-CZ3 4.28Å; P189-W192 HydrophobicContact CG-CD2 4.44Å; P189-W192 HydrophobicContact CG-CE3 4.33Å; P189-W192 HydrophobicContact CG-CH2 4.37Å; P189-W192 HydrophobicContact CG-CZ2 4.47Å; P189-W192 HydrophobicContact CG-CZ3 4.28Å; P189-W192 PolarHBondContact O-N 3.45Å; W192-G194 PolarHBondContact O-N 2.98Å |
| 193 | D | 50.6 | Low | 52.5 | Low | 149 Ų | 149 | 125.3 Ų | 125.3 | 80% | 0.797 | 65% | 0.653 | S | S | * | * | trans | -78.7 | 58.3 | 161.1 | -69.7 | -48.5 | 0 | 0 | 0 | 110.9 | ||||
| 194 | G | 42.8 | Very low | 51.8 | Low | 46 Ų | 46 | 129.9 Ų | 129.9 | 47% | 0.474 | 67% | 0.665 | S | S | . | * | trans | -86.2 | 143 | 168.3 | 0 | 0 | 0 | 0 | 0 | 110.2 | W192 N196 | W192-G194 PolarHBondContact O-N 2.98Å; G194-N196 PolarHBondContact O-N 3.38Å | ||
| 195 | P | 45.4 | Very low | 51.9 | Low | 110 Ų | 110 | 130.9 Ų | 130.9 | 71% | 0.714 | 68% | 0.68 | S | S | * | * | trans | -59.7 | 119.7 | 177.9 | 27.6 | -32.2 | 0 | 0 | 0 | 107.6 | Q197 | P195-Q197 HydrophobicContact CB-CG 4.45Å; P195-Q197 PolarHBondContact O-N 3.27Å | ||
| 196 | N | 45.9 | Very low | 52.6 | Low | 130 Ų | 130 | 122.8 Ų | 122.8 | 70% | 0.695 | 65% | 0.649 | S | S | * | * | trans | -61.6 | 71.1 | -179.6 | -154 | -22.2 | 0 | 0 | 0 | 110.6 | G194 L199 | G194-N196 PolarHBondContact O-N 3.38Å; N196-L199 WeakPolarHBondContact OD1-CD1 3.48Å; N196-L199 WeakPolarHBondContact OD1-CG 3.46Å | ||
| 197 | Q | 49.9 | Very low | 54 | Low | 163 Ų | 163 | 120.1 Ų | 120.1 | 76% | 0.762 | 64% | 0.636 | S | S | * | * | trans | -112.7 | 2.8 | -174.4 | -79.7 | -144.8 | 67.6 | 0 | 0 | 114.3 | P195 | P195-Q197 HydrophobicContact CB-CG 4.45Å; P195-Q197 PolarHBondContact O-N 3.27Å | ||
| 198 | D | 45 | Very low | 55.4 | Low | 165 Ų | 165 | 121.4 Ų | 121.4 | 88% | 0.882 | 64% | 0.639 | S | S | * | * | trans | -127.1 | 35.6 | 169.6 | -77.7 | -41.5 | 0 | 0 | 0 | 112.6 | ||||
| 199 | L | 51.1 | Low | 56.7 | Low | 87 Ų | 87 | 126.1 Ų | 126.1 | 46% | 0.455 | 66% | 0.656 | S | S | . | * | S | Bend | trans | -63 | 128.2 | 152.9 | -88.8 | 161.6 | 0 | 0 | 0 | 107.6 | N196 R201 L203 | N196-L199 WeakPolarHBondContact OD1-CD1 3.48Å; N196-L199 WeakPolarHBondContact OD1-CG 3.46Å; L199-R201 PolarHBondContact O-N 3.31Å; L199-L203 HydrophobicContact CD2-CD1 3.89Å |
| 200 | P | 46.4 | Very low | 58.2 | Low | 88 Ų | 88 | 129.9 Ų | 129.9 | 57% | 0.571 | 67% | 0.671 | S | S | * | * | trans | -52.4 | 126.2 | 165.3 | 21.2 | -29.3 | 0 | 0 | 0 | 106.6 | R202 L203 | P200-R202 PolarHBondContact O-N 3.14Å; P200-L203 PolarHBondContact O-N 2.84Å | ||
| 201 | R | 54.8 | Low | 60.1 | Low | 242 Ų | 242 | 126.4 Ų | 126.4 | 91% | 0.913 | 64% | 0.644 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -48.8 | -2.5 | -174.9 | -125.3 | 176.2 | -76.3 | -153.1 | -3.6 | 115.8 | L199 | L199-R201 PolarHBondContact O-N 3.31Š|
| 202 | R | 52.7 | Low | 61.9 | Low | 229 Ų | 229 | 131.6 Ų | 131.6 | 86% | 0.864 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.8 | -21.2 | 176.8 | -69.2 | -85.3 | -142.8 | -121.2 | -2.3 | 115.3 | P200 | P200-R202 PolarHBondContact O-N 3.14Š|
| 203 | L | 52.4 | Low | 63.4 | Low | 133 Ų | 133 | 129.9 Ų | 129.9 | 70% | 0.696 | 65% | 0.653 | S | S | * | * | S | Bend | trans | -106.2 | -6.2 | -174.3 | -65.7 | 179 | 0 | 0 | 0 | 115 | L199 P200 G205 | L199-L203 HydrophobicContact CD2-CD1 3.89Å; P200-L203 PolarHBondContact O-N 2.84Å; L203-G205 PolarHBondContact O-N 3.08Å |
| 204 | R | 64.3 | Low | 65.2 | Low | 226 Ų | 226 | 126.8 Ų | 126.8 | 85% | 0.853 | 63% | 0.632 | S | S | * | * | S | Bend | trans | -79.4 | 114.1 | 170.9 | -165.4 | 175.3 | -167.8 | 178.4 | 3.5 | 108.4 | ||
| 205 | G | 63.7 | Low | 67.4 | Low | 55 Ų | 55 | 128.3 Ų | 128.3 | 57% | 0.567 | 63% | 0.628 | S | S | * | * | P | Polyproline II helix | trans | -53.6 | 145.4 | 171.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | L203 | L203-G205 PolarHBondContact O-N 3.08Š|
| 206 | P | 71.5 | Confident | 69.4 | Low | 32 Ų | 32 | 127.4 Ų | 127.4 | 21% | 0.208 | 62% | 0.617 | C | S | . | * | P | Polyproline II helix | trans | -60.8 | 149.6 | -177.7 | -15.1 | 27.1 | 0 | 0 | 0 | 111 | E210 L211 F214 | P206-E210 HydrophobicContact CB-CB 4.44Å; P206-L211 HydrophobicContact CB-CB 4.31Å; P206-L211 HydrophobicContact CB-CD1 4.22Å; P206-L211 HydrophobicContact CG-CD1 3.82Å; P206-F214 HydrophobicContact CB-CB 3.83Å; P206-F214 HydrophobicContact CB-CD1 4.48Å; P206-F214 HydrophobicContact CB-CG 4.09Å; P206-F214 HydrophobicContact CG-CB 3.3Å; P206-F214 HydrophobicContact CG-CD1 3.16Å; P206-F214 HydrophobicContact CG-CD2 3.62Å; P206-F214 HydrophobicContact CG-CE1 3.72Å; P206-F214 HydrophobicContact CG-CE2 4.13Å; P206-F214 HydrophobicContact CG-CG 3.08Å; P206-F214 HydrophobicContact CG-CZ 4.17Å |
| 207 | Q | 78.9 | Confident | 71.3 | Confident | 128 Ų | 128 | 129.2 Ų | 129.2 | 60% | 0.598 | 62% | 0.621 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 148 | 167.7 | -173.9 | 171.1 | -11.1 | 0 | 0 | 109.7 | D209 E210 L211 | Q207-D209 PolarHBondContact O-N 3.24Å; Q207-E210 CarbonylContact O-C 3.43Å; Q207-E210 WeakPolarHBondContact O-CA 3.29Å; Q207-E210 PolarHBondContact O-N 3.38Å; Q207-L211 PolarHBondContact O-N 3.01Å |
| 208 | K | 79.4 | Confident | 73.1 | Confident | 187 Ų | 187 | 127.4 Ų | 127.4 | 81% | 0.813 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -50.9 | -35.4 | -175.6 | -76.2 | -173.8 | 175 | -178.7 | 0 | 113.5 | E210 | K208-E210 VanDerWaalsContact C-N 3.33Š|
| 209 | D | 84.6 | Confident | 75.1 | Confident | 134 Ų | 134 | 127 Ų | 127 | 72% | 0.717 | 60% | 0.598 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.2 | -26.3 | 179.9 | -54.8 | -43.9 | 0 | 0 | 0 | 112.7 | Q207 | Q207-D209 PolarHBondContact O-N 3.24Š|
| 210 | E | 86.5 | Confident | 76.6 | Confident | 115 Ų | 115 | 127.6 Ų | 127.6 | 54% | 0.537 | 60% | 0.6 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -103 | -6.9 | -179.3 | -61.2 | 179.9 | 174.4 | 0 | 0 | 113.1 | P206 Q207 K208 K212 S213 F214 | P206-E210 HydrophobicContact CB-CB 4.44Å; Q207-E210 CarbonylContact O-C 3.43Å; Q207-E210 WeakPolarHBondContact O-CA 3.29Å; Q207-E210 PolarHBondContact O-N 3.38Å; K208-E210 VanDerWaalsContact C-N 3.33Å; E210-K212 VanDerWaalsContact C-N 3.28Å; E210-K212 PolarHBondContact O-N 3.49Å; E210-S213 WeakPolarHBondContact CA-OG 3.18Å; E210-S213 PolarHBondContact O-N 3.45Å; E210-S213 PolarHBondContact O-OG 3.35Å; E210-F214 WeakPolarHBondContact O-CB 3.32Å; E210-F214 PolarHBondContact O-N 3.4Å |
| 211 | L | 88.9 | Confident | 78 | Confident | 69 Ų | 69 | 132.4 Ų | 132.4 | 36% | 0.361 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -59.7 | -39.8 | -178.5 | -177.9 | 61.6 | 0 | 0 | 0 | 111.6 | P206 Q207 F214 I215 | P206-L211 HydrophobicContact CB-CB 4.31Å; P206-L211 HydrophobicContact CB-CD1 4.22Å; P206-L211 HydrophobicContact CG-CD1 3.82Å; Q207-L211 PolarHBondContact O-N 3.01Å; L211-F214 PolarHBondContact O-N 3.03Å; L211-I215 HydrophobicContact CD1-CD1 3.8Å; L211-I215 HydrophobicContact CD1-CG1 4.09Å; L211-I215 HydrophobicContact CD2-CD1 4.49Å; L211-I215 HydrophobicContact CG-CD1 3.75Å; L211-I215 HydrophobicContact CG-CG1 4.41Å; L211-I215 WeakPolarHBondContact O-CB 3.39Å; L211-I215 WeakPolarHBondContact O-CG1 3.24Å; L211-I215 PolarHBondContact O-N 3.36Å |
| 212 | K | 89.5 | Confident | 79 | Confident | 171 Ų | 171 | 123.9 Ų | 123.9 | 74% | 0.743 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -62.6 | -48.1 | 177 | -67.7 | -175.8 | 179.8 | -178.9 | 0 | 111.7 | E210 F214 I215 L216 | E210-K212 VanDerWaalsContact C-N 3.28Å; E210-K212 PolarHBondContact O-N 3.49Å; K212-F214 VanDerWaalsContact C-N 3.34Å; K212-I215 PolarHBondContact O-N 3.49Å; K212-L216 WeakPolarHBondContact O-CB 3.45Å; K212-L216 PolarHBondContact O-N 3.25Å |
| 213 | S | 86.2 | Confident | 80.1 | Confident | 69 Ų | 69 | 117.6 Ų | 117.6 | 48% | 0.483 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -64.8 | -38.1 | 177.3 | 38.1 | 0 | 0 | 0 | 0 | 112.2 | E210 Q217 | E210-S213 WeakPolarHBondContact CA-OG 3.18Å; E210-S213 PolarHBondContact O-N 3.45Å; E210-S213 PolarHBondContact O-OG 3.35Å; S213-Q217 VanDerWaalsContact O-CB 3.25Å; S213-Q217 WeakPolarHBondContact O-CB 3.23Å; S213-Q217 PolarHBondContact O-N 3.05Å |
| 214 | F | 88.6 | Confident | 81.3 | Confident | 83 Ų | 83 | 114.4 Ų | 114.4 | 36% | 0.364 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -67.5 | -44.3 | 177.8 | 176.6 | -94.4 | 0 | 0 | 0 | 112.4 | P206 E210 L211 K212 Q217 K218 | P206-F214 HydrophobicContact CB-CB 3.83Å; P206-F214 HydrophobicContact CB-CD1 4.48Å; P206-F214 HydrophobicContact CB-CG 4.09Å; P206-F214 HydrophobicContact CG-CB 3.3Å; P206-F214 HydrophobicContact CG-CD1 3.16Å; P206-F214 HydrophobicContact CG-CD2 3.62Å; P206-F214 HydrophobicContact CG-CE1 3.72Å; P206-F214 HydrophobicContact CG-CE2 4.13Å; P206-F214 HydrophobicContact CG-CG 3.08Å; P206-F214 HydrophobicContact CG-CZ 4.17Å; E210-F214 WeakPolarHBondContact O-CB 3.32Å; E210-F214 PolarHBondContact O-N 3.4Å; L211-F214 PolarHBondContact O-N 3.03Å; K212-F214 VanDerWaalsContact C-N 3.34Å; F214-Q217 PolarHBondContact O-N 3.44Å; F214-K218 HydrophobicContact CE1-CD 3.84Å; F214-K218 HydrophobicContact CZ-CD 3.97Å; F214-K218 WeakPolarHBondContact O-CB 3.31Å; F214-K218 PolarHBondContact O-N 3Å |
| 215 | I | 89.3 | Confident | 81.9 | Confident | 78 Ų | 78 | 107.2 Ų | 107.2 | 40% | 0.4 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -63.8 | -45.6 | 176.8 | -68.1 | 168.5 | 0 | 0 | 0 | 109.6 | L211 K212 K218 Y219 | L211-I215 HydrophobicContact CD1-CD1 3.8Å; L211-I215 HydrophobicContact CD1-CG1 4.09Å; L211-I215 HydrophobicContact CD2-CD1 4.49Å; L211-I215 HydrophobicContact CG-CD1 3.75Å; L211-I215 HydrophobicContact CG-CG1 4.41Å; L211-I215 WeakPolarHBondContact O-CB 3.39Å; L211-I215 WeakPolarHBondContact O-CG1 3.24Å; L211-I215 PolarHBondContact O-N 3.36Å; K212-I215 PolarHBondContact O-N 3.49Å; I215-K218 PolarHBondContact O-N 2.62Å; I215-Y219 HydrophobicContact CG2-CD2 3.99Å; I215-Y219 WeakPolarHBondContact O-CB 3.3Å; I215-Y219 VanDerWaalsContact O-CD2 3.31Å; I215-Y219 WeakPolarHBondContact O-CD2 3.5Å; I215-Y219 PolarHBondContact O-N 3.02Å |
| 216 | L | 88.5 | Confident | 82.4 | Confident | 92 Ų | 92 | 110 Ų | 110 | 48% | 0.482 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -58.2 | -52.4 | 173.9 | -105.8 | 71.6 | 0 | 0 | 0 | 110.9 | K212 K218 Y219 M220 | K212-L216 WeakPolarHBondContact O-CB 3.45Å; K212-L216 PolarHBondContact O-N 3.25Å; L216-K218 VanDerWaalsContact C-N 3.28Å; L216-K218 PolarHBondContact O-N 2.67Å; L216-Y219 PolarHBondContact O-N 3.01Å; L216-M220 HydrophobicContact CB-CE 3.98Å; L216-M220 HydrophobicContact CD2-CE 3.69Å; L216-M220 HydrophobicContact CD2-SD 3.84Å; L216-M220 HydrophobicContact CG-CB 4.48Å; L216-M220 HydrophobicContact CG-CE 3.81Å; L216-M220 HydrophobicContact CG-SD 3.79Å; L216-M220 VanDerWaalsContact O-CA 3.3Å; L216-M220 WeakPolarHBondContact O-CA 3.36Å; L216-M220 WeakPolarHBondContact O-CB 3.46Å; L216-M220 PolarHBondContact O-N 3.03Å |
| 217 | Q | 84.1 | Confident | 82.8 | Confident | 167 Ų | 167 | 114.9 Ų | 114.9 | 78% | 0.78 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -62.2 | -36 | -178.2 | -176.4 | 179.6 | -11.1 | 0 | 0 | 113.1 | S213 F214 | S213-Q217 VanDerWaalsContact O-CB 3.25Å; S213-Q217 WeakPolarHBondContact O-CB 3.23Å; S213-Q217 PolarHBondContact O-N 3.05Å; F214-Q217 PolarHBondContact O-N 3.44Å |
| 218 | K | 88.3 | Confident | 82.8 | Confident | 125 Ų | 125 | 116.6 Ų | 116.6 | 54% | 0.543 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -78.3 | -34.1 | -176.1 | -174.2 | 173.9 | 178.2 | -164.3 | 0 | 113 | F214 I215 L216 | F214-K218 HydrophobicContact CE1-CD 3.84Å; F214-K218 HydrophobicContact CZ-CD 3.97Å; F214-K218 WeakPolarHBondContact O-CB 3.31Å; F214-K218 PolarHBondContact O-N 3Å; I215-K218 PolarHBondContact O-N 2.62Å; L216-K218 VanDerWaalsContact C-N 3.28Å; L216-K218 PolarHBondContact O-N 2.67Å |
| 219 | Y | 86.3 | Confident | 82.9 | Confident | 156 Ų | 156 | 114.7 Ų | 114.7 | 61% | 0.612 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -119.6 | -13.9 | -170.2 | -59.9 | -75.8 | 0 | 0 | 0 | 114.1 | I215 L216 M221 | I215-Y219 HydrophobicContact CG2-CD2 3.99Å; I215-Y219 WeakPolarHBondContact O-CB 3.3Å; I215-Y219 VanDerWaalsContact O-CD2 3.31Å; I215-Y219 WeakPolarHBondContact O-CD2 3.5Å; I215-Y219 PolarHBondContact O-N 3.02Å; L216-Y219 PolarHBondContact O-N 3.01Å; Y219-M221 PolarHBondContact O-N 2.9Å |
| 220 | M | 84.2 | Confident | 82.7 | Confident | 101 Ų | 101 | 113.4 Ų | 113.4 | 50% | 0.498 | 57% | 0.572 | S | S | . | * | trans | -86.3 | 101.8 | 178.5 | -160.1 | -179.5 | 46.7 | 0 | 0 | 109.3 | L216 V222 | L216-M220 HydrophobicContact CB-CE 3.98Å; L216-M220 HydrophobicContact CD2-CE 3.69Å; L216-M220 HydrophobicContact CD2-SD 3.84Å; L216-M220 HydrophobicContact CG-CB 4.48Å; L216-M220 HydrophobicContact CG-CE 3.81Å; L216-M220 HydrophobicContact CG-SD 3.79Å; L216-M220 VanDerWaalsContact O-CA 3.3Å; L216-M220 WeakPolarHBondContact O-CA 3.36Å; L216-M220 WeakPolarHBondContact O-CB 3.46Å; L216-M220 PolarHBondContact O-N 3.03Å; M220-V222 VanDerWaalsContact C-N 3.34Å; M220-V222 HydrophobicContact CB-CG2 4.28Å; M220-V222 HydrophobicContact CE-CG2 3.36Å; M220-V222 HydrophobicContact CG-CG2 3.43Å; M220-V222 VanDerWaalsContact CG-CG2 3.43Å; M220-V222 PolarHBondContact O-N 2.64Å; M220-V222 VanDerWaalsContact O-N 3.14Å; M220-V222 HydrophobicContact SD-CG2 3.5Å; M220-V222 WeakPolarHBondContact SD-CG2 3.48Å | ||
| 221 | M | 76 | Confident | 82.4 | Confident | 188 Ų | 188 | 115.6 Ų | 115.6 | 93% | 0.926 | 58% | 0.582 | S | S | * | * | trans | -77.9 | 88.5 | 163.2 | -70.4 | 174.6 | 63.6 | 0 | 0 | 108.1 | Y219 D223 | Y219-M221 PolarHBondContact O-N 2.9Å; M221-D223 PolarHBondContact O-N 2.81Å | ||
| 222 | V | 74.6 | Confident | 81.9 | Confident | 64 Ų | 64 | 122.5 Ų | 122.5 | 39% | 0.388 | 60% | 0.603 | S | S | . | * | trans | -84.6 | 107.9 | 171.8 | -173.8 | 0 | 0 | 0 | 0 | 108.1 | M220 S224 | M220-V222 VanDerWaalsContact C-N 3.34Å; M220-V222 HydrophobicContact CB-CG2 4.28Å; M220-V222 HydrophobicContact CE-CG2 3.36Å; M220-V222 HydrophobicContact CG-CG2 3.43Å; M220-V222 VanDerWaalsContact CG-CG2 3.43Å; M220-V222 PolarHBondContact O-N 2.64Å; M220-V222 VanDerWaalsContact O-N 3.14Å; M220-V222 HydrophobicContact SD-CG2 3.5Å; M220-V222 WeakPolarHBondContact SD-CG2 3.48Å; V222-S224 PolarHBondContact O-N 3.47Å; V222-S224 PolarHBondContact O-OG 2.89Å | ||
| 223 | D | 77.2 | Confident | 81.3 | Confident | 96 Ų | 96 | 119 Ų | 119 | 51% | 0.513 | 60% | 0.598 | S | S | . | * | trans | -72 | 82.6 | 163.9 | -163.7 | -24.5 | 0 | 0 | 0 | 109 | M221 A225 E226 D227 | M221-D223 PolarHBondContact O-N 2.81Å; D223-A225 PolarHBondContact O-N 2.7Å; D223-A225 VanDerWaalsContact O-N 3.13Å; D223-A225 WeakPolarHBondContact OD1-CB 3.23Å; D223-A225 PolarHBondContact OD1-N 3.46Å; D223-A225 VanDerWaalsContact OD1-N 3.08Å; D223-E226 HydrophobicContact CB-CB 4.25Å; D223-E226 PolarHBondContact O-N 3.48Å; D223-E226 PolarHBondContact OD1-N 3.26Å; D223-D227 PolarHBondContact O-N 3.01Å | ||
| 224 | S | 75.9 | Confident | 80.7 | Confident | 67 Ų | 67 | 123.7 Ų | 123.7 | 47% | 0.469 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -64.5 | -15.2 | -179.3 | -54.7 | 0 | 0 | 0 | 0 | 112 | V222 Q228 | V222-S224 PolarHBondContact O-N 3.47Å; V222-S224 PolarHBondContact O-OG 2.89Å; S224-Q228 VanDerWaalsContact O-CG 3.29Å; S224-Q228 WeakPolarHBondContact O-CG 3.37Å |
| 225 | A | 78.3 | Confident | 80.2 | Confident | 74 Ų | 74 | 123.6 Ų | 123.6 | 61% | 0.612 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -81.6 | -38.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | D223 | D223-A225 PolarHBondContact O-N 2.7Å; D223-A225 VanDerWaalsContact O-N 3.13Å; D223-A225 WeakPolarHBondContact OD1-CB 3.23Å; D223-A225 PolarHBondContact OD1-N 3.46Å; D223-A225 VanDerWaalsContact OD1-N 3.08Å |
| 226 | E | 73.6 | Confident | 79.6 | Confident | 115 Ų | 115 | 125.9 Ų | 125.9 | 54% | 0.537 | 65% | 0.649 | S | S | . | * | H | α-helix | trans | -70.7 | -39.2 | 174.6 | -154.6 | 84.5 | -124.8 | 0 | 0 | 111.1 | D223 Q228 K229 | D223-E226 HydrophobicContact CB-CB 4.25Å; D223-E226 PolarHBondContact O-N 3.48Å; D223-E226 PolarHBondContact OD1-N 3.26Å; E226-Q228 VanDerWaalsContact C-N 3.3Å; E226-Q228 PolarHBondContact O-N 2.96Å; E226-K229 VanDerWaalsContact O-CB 3.22Å; E226-K229 WeakPolarHBondContact O-CB 3.35Å; E226-K229 PolarHBondContact O-N 2.93Å; E226-K229 IonicContact OE1-NZ 2.64Å |
| 227 | D | 78.9 | Confident | 78.9 | Confident | 133 Ų | 133 | 130.4 Ų | 130.4 | 71% | 0.711 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -64.7 | -30.8 | 179.6 | -98.1 | 9 | 0 | 0 | 0 | 113.5 | D223 K229 | D223-D227 PolarHBondContact O-N 3.01Å; D227-K229 PolarHBondContact O-N 3.36Å |
| 228 | Q | 79.9 | Confident | 78.2 | Confident | 165 Ų | 165 | 129.5 Ų | 129.5 | 77% | 0.771 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.5 | -15.1 | 174.3 | -71.9 | 178.3 | 24.7 | 0 | 0 | 112.7 | S224 E226 V230 | S224-Q228 VanDerWaalsContact O-CG 3.29Å; S224-Q228 WeakPolarHBondContact O-CG 3.37Å; E226-Q228 VanDerWaalsContact C-N 3.3Å; E226-Q228 PolarHBondContact O-N 2.96Å; Q228-V230 PolarHBondContact O-N 2.9Å; Q228-V230 VanDerWaalsContact O-N 3.13Å |
| 229 | K | 82.3 | Confident | 77.4 | Confident | 147 Ų | 147 | 127 Ų | 127 | 64% | 0.639 | 66% | 0.663 | S | S | * | * | trans | -86.4 | 87.9 | -177.9 | -165.1 | 178.4 | 176.3 | -171.7 | 0 | 109.4 | E226 D227 H231 | E226-K229 VanDerWaalsContact O-CB 3.22Å; E226-K229 WeakPolarHBondContact O-CB 3.35Å; E226-K229 PolarHBondContact O-N 2.93Å; E226-K229 IonicContact OE1-NZ 2.64Å; D227-K229 PolarHBondContact O-N 3.36Å; K229-H231 PolarHBondContact O-N 2.88Å | ||
| 230 | V | 79.1 | Confident | 76.6 | Confident | 107 Ų | 107 | 125.4 Ų | 125.4 | 65% | 0.648 | 67% | 0.672 | S | S | * | * | trans | -61.6 | 106.6 | 172.6 | -177.8 | 0 | 0 | 0 | 0 | 109.3 | Q228 R232 | Q228-V230 PolarHBondContact O-N 2.9Å; Q228-V230 VanDerWaalsContact O-N 3.13Å; V230-R232 HydrophobicContact CG1-CG 4.16Å; V230-R232 PolarHBondContact O-N 2.93Å | ||
| 231 | H | 79.9 | Confident | 76 | Confident | 161 Ų | 161 | 128.2 Ų | 128.2 | 75% | 0.745 | 68% | 0.681 | S | S | * | * | trans | -63.5 | 101.7 | 172.1 | -177.3 | -85.9 | 0 | 0 | 0 | 108.8 | K229 P233 | K229-H231 PolarHBondContact O-N 2.88Å; H231-P233 WeakPolarHBondContact O-CD 3.22Å | ||
| 232 | R | 78.4 | Confident | 75.6 | Confident | 214 Ų | 214 | 127.6 Ų | 127.6 | 81% | 0.808 | 67% | 0.674 | S | S | * | * | trans | -94 | 94.6 | 172.2 | -68.2 | -172.5 | -177.4 | 150 | 2.9 | 107.7 | V230 M234 | V230-R232 HydrophobicContact CG1-CG 4.16Å; V230-R232 PolarHBondContact O-N 2.93Å; R232-M234 PolarHBondContact O-N 2.89Å; R232-M234 VanDerWaalsContact O-N 3.11Å | ||
| 233 | P | 78.6 | Confident | 75.4 | Confident | 97 Ų | 97 | 130.5 Ų | 130.5 | 63% | 0.63 | 69% | 0.686 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 125.2 | 172.3 | 24.4 | -31.3 | 0 | 0 | 0 | 107.5 | H231 A235 | H231-P233 WeakPolarHBondContact O-CD 3.22Å; P233-A235 PolarHBondContact O-N 3.35Å |
| 234 | M | 72.7 | Confident | 75.2 | Confident | 167 Ų | 167 | 130.7 Ų | 130.7 | 82% | 0.823 | 69% | 0.686 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 126.6 | 176.1 | -95 | -175 | 169.8 | 0 | 0 | 108.3 | R232 | R232-M234 PolarHBondContact O-N 2.89Å; R232-M234 VanDerWaalsContact O-N 3.11Å |
| 235 | A | 77.3 | Confident | 75.1 | Confident | 81 Ų | 81 | 135 Ų | 135 | 67% | 0.669 | 69% | 0.692 | S | S | * | * | P | Polyproline II helix | trans | -51.7 | 134.6 | 170.8 | 0 | 0 | 0 | 0 | 0 | 108.6 | P233 K237 | P233-A235 PolarHBondContact O-N 3.35Å; A235-K237 PolarHBondContact O-N 3.29Å |
| 236 | P | 77.9 | Confident | 75.1 | Confident | 126 Ų | 126 | 138.6 Ų | 138.6 | 82% | 0.818 | 69% | 0.691 | S | S | * | * | P | Polyproline II helix | trans | -48.6 | 121.7 | 177.2 | -27.3 | 34 | 0 | 0 | 0 | 109.2 | E238 | P236-E238 PolarHBondContact O-N 3.06Š|
| 237 | K | 72.7 | Confident | 75.2 | Confident | 187 Ų | 187 | 138 Ų | 138 | 81% | 0.813 | 69% | 0.69 | S | S | * | * | trans | -58.6 | 106.6 | -179.2 | -70.1 | 179.9 | 179.5 | 174.9 | 0 | 107.5 | A235 A239 | A235-K237 PolarHBondContact O-N 3.29Å; K237-A239 PolarHBondContact O-N 3.25Å | ||
| 238 | E | 70.8 | Confident | 75.1 | Confident | 148 Ų | 148 | 138 Ų | 138 | 69% | 0.692 | 69% | 0.69 | S | S | * | * | trans | -64 | 102.2 | 174.6 | -153.8 | -179.7 | 177.4 | 0 | 0 | 106.2 | P236 K241 | P236-E238 PolarHBondContact O-N 3.06Å; E238-K241 WeakPolarHBondContact OE1-CE 3.42Å; E238-K241 IonicContact OE1-NZ 2.9Å; E238-K241 PolarHBondContact OE1-NZ 3.32Å | ||
| 239 | A | 70.1 | Confident | 75 | Confident | 74 Ų | 74 | 137.7 Ų | 137.7 | 61% | 0.612 | 69% | 0.694 | S | S | * | * | trans | -55.7 | 134.3 | -179.5 | 0 | 0 | 0 | 0 | 0 | 107.9 | K237 K241 | K237-A239 PolarHBondContact O-N 3.25Å; A239-K241 PolarHBondContact O-N 2.88Å | ||
| 240 | P | 71 | Confident | 74.6 | Confident | 121 Ų | 121 | 136.2 Ų | 136.2 | 79% | 0.786 | 69% | 0.689 | S | S | * | * | trans | -55.7 | 116.1 | -175.7 | 20.3 | -31 | 0 | 0 | 0 | 108.7 | K242 | P240-K242 PolarHBondContact O-N 3.03Š| ||
| 241 | K | 70.1 | Confident | 74.3 | Confident | 160 Ų | 160 | 135.1 Ų | 135.1 | 70% | 0.696 | 68% | 0.683 | S | S | * | * | trans | -57 | 109.3 | -179.4 | -69.5 | 173.5 | -176.4 | 158.2 | 0 | 107.1 | E238 A239 L243 | E238-K241 WeakPolarHBondContact OE1-CE 3.42Å; E238-K241 IonicContact OE1-NZ 2.9Å; E238-K241 PolarHBondContact OE1-NZ 3.32Å; A239-K241 PolarHBondContact O-N 2.88Å; K241-L243 PolarHBondContact O-N 2.95Å; K241-L243 VanDerWaalsContact O-N 3.09Å | ||
| 242 | K | 69.4 | Low | 73.7 | Confident | 176 Ų | 176 | 129.2 Ų | 129.2 | 77% | 0.765 | 66% | 0.658 | S | S | * | * | trans | -60.6 | 116.5 | 174.5 | -67.2 | 178.9 | -178.4 | 172.8 | 0 | 106.4 | P240 I244 | P240-K242 PolarHBondContact O-N 3.03Å; K242-I244 PolarHBondContact O-N 3.07Å | ||
| 243 | L | 69.8 | Low | 73 | Confident | 125 Ų | 125 | 123.2 Ų | 123.2 | 65% | 0.654 | 65% | 0.649 | S | S | * | * | trans | -56.6 | 115.7 | 176.3 | -104.4 | 93.9 | 0 | 0 | 0 | 108.8 | K241 T254 | K241-L243 PolarHBondContact O-N 2.95Å; K241-L243 VanDerWaalsContact O-N 3.09Å; L243-T254 WeakPolarHBondContact O-CG2 3.33Å | ||
| 244 | I | 72.6 | Confident | 72.2 | Confident | 100 Ų | 100 | 122.2 Ų | 122.2 | 51% | 0.513 | 64% | 0.641 | S | S | . | * | trans | -78.8 | 122 | 170 | -62.5 | 177.3 | 0 | 0 | 0 | 106.7 | K242 Y246 V251 | K242-I244 PolarHBondContact O-N 3.07Å; I244-Y246 HydrophobicContact CB-CE2 4.43Å; I244-Y246 HydrophobicContact CG2-CD2 4.35Å; I244-Y246 HydrophobicContact CG2-CE1 4.38Å; I244-Y246 HydrophobicContact CG2-CE2 3.69Å; I244-V251 HydrophobicContact CG2-CB 4.2Å; I244-V251 HydrophobicContact CG2-CG1 3.64Å; I244-V251 HydrophobicContact CG2-CG2 3.82Å | ||
| 245 | R | 74.1 | Confident | 71.6 | Confident | 157 Ų | 157 | 122.2 Ų | 122.2 | 59% | 0.592 | 64% | 0.636 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -102.2 | 146.3 | 173.5 | -60.5 | -175.2 | 84 | 100.1 | -3.2 | 109.2 | V252 T254 | R245-V252 PolarHBondContact N-O 3.48Å; R245-V252 PolarHBondContact O-N 3.11Å; R245-T254 HydrophobicContact CG-CG2 3.84Å |
| 246 | Y | 77.6 | Confident | 70.7 | Confident | 149 Ų | 149 | 121.6 Ų | 121.6 | 58% | 0.584 | 64% | 0.638 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -115.6 | 137.5 | 177.4 | -65 | -91.7 | 0 | 0 | 0 | 110.3 | I244 Q250 V251 | I244-Y246 HydrophobicContact CB-CE2 4.43Å; I244-Y246 HydrophobicContact CG2-CD2 4.35Å; I244-Y246 HydrophobicContact CG2-CE1 4.38Å; I244-Y246 HydrophobicContact CG2-CE2 3.69Å; Y246-Q250 WeakPolarHBondContact CA-O 3.47Å; Y246-V251 HydrophobicContact CD1-CG2 4.12Å; Y246-V251 HydrophobicContact CE1-CG2 3.45Å; Y246-V251 VanDerWaalsContact CE1-CG2 3.45Å |
| 247 | I | 76.8 | Confident | 69.6 | Low | 103 Ų | 103 | 124.5 Ų | 124.5 | 53% | 0.528 | 64% | 0.641 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -132 | 127.7 | 164.9 | -59.1 | 176.3 | 0 | 0 | 0 | 105.1 | N249 Q250 V252 | I247-N249 VanDerWaalsContact C-N 3.28Å; I247-N249 PolarHBondContact O-N 3.28Å; I247-Q250 PolarHBondContact N-O 3.24Å; I247-Q250 VanDerWaalsContact N-O 3.15Å; I247-Q250 WeakPolarHBondContact O-CB 3.28Å; I247-Q250 PolarHBondContact O-N 2.85Å; I247-V252 HydrophobicContact CB-CG2 4.23Å; I247-V252 HydrophobicContact CD1-CG2 4.26Å; I247-V252 HydrophobicContact CG1-CG2 4.15Å |
| 248 | D | 75.6 | Confident | 68.8 | Low | 132 Ų | 132 | 126.4 Ų | 126.4 | 71% | 0.706 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 48.6 | 46.3 | -177.4 | -54.8 | -35.1 | 0 | 0 | 0 | 113.6 | Q250 | D248-Q250 PolarHBondContact O-N 3.47Å; D248-Q250 VanDerWaalsContact O-N 3.07Å |
| 249 | N | 78.1 | Confident | 68.1 | Low | 159 Ų | 159 | 128.7 Ų | 128.7 | 85% | 0.85 | 65% | 0.651 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 59.7 | 14 | -177.2 | -56 | -22.1 | 0 | 0 | 0 | 115.2 | I247 | I247-N249 VanDerWaalsContact C-N 3.28Å; I247-N249 PolarHBondContact O-N 3.28Å |
| 250 | Q | 73.5 | Confident | 67.4 | Low | 116 Ų | 116 | 131.5 Ų | 131.5 | 54% | 0.542 | 65% | 0.649 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -106.7 | 136.2 | 177.1 | -166.8 | 175.1 | 79.2 | 0 | 0 | 111.6 | Y246 I247 D248 V252 | Y246-Q250 WeakPolarHBondContact CA-O 3.47Å; I247-Q250 PolarHBondContact N-O 3.24Å; I247-Q250 VanDerWaalsContact N-O 3.15Å; I247-Q250 WeakPolarHBondContact O-CB 3.28Å; I247-Q250 PolarHBondContact O-N 2.85Å; D248-Q250 PolarHBondContact O-N 3.47Å; D248-Q250 VanDerWaalsContact O-N 3.07Å; Q250-V252 WeakPolarHBondContact O-CG2 3.4Å |
| 251 | V | 73.8 | Confident | 66.7 | Low | 84 Ų | 84 | 133.6 Ų | 133.6 | 51% | 0.509 | 65% | 0.654 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -69.4 | 127.1 | 178.2 | 169.2 | 0 | 0 | 0 | 0 | 111 | I244 Y246 | I244-V251 HydrophobicContact CG2-CB 4.2Å; I244-V251 HydrophobicContact CG2-CG1 3.64Å; I244-V251 HydrophobicContact CG2-CG2 3.82Å; Y246-V251 HydrophobicContact CD1-CG2 4.12Å; Y246-V251 HydrophobicContact CE1-CG2 3.45Å; Y246-V251 VanDerWaalsContact CE1-CG2 3.45Å |
| 252 | V | 67.9 | Low | 66.3 | Low | 37 Ų | 37 | 130.3 Ų | 130.3 | 22% | 0.224 | 65% | 0.647 | C | S | . | * | E | Extended strand (participates in β ladder) | trans | -124.6 | 134.6 | 177.4 | -156.1 | 0 | 0 | 0 | 0 | 110.6 | R245 I247 Q250 | R245-V252 PolarHBondContact N-O 3.48Å; R245-V252 PolarHBondContact O-N 3.11Å; I247-V252 HydrophobicContact CB-CG2 4.23Å; I247-V252 HydrophobicContact CD1-CG2 4.26Å; I247-V252 HydrophobicContact CG1-CG2 4.15Å; Q250-V252 WeakPolarHBondContact O-CG2 3.4Å |
| 253 | S | 62.9 | Low | 65.9 | Low | 89 Ų | 89 | 130.5 Ų | 130.5 | 62% | 0.622 | 64% | 0.643 | S | S | * | * | trans | -77 | 141.8 | 179.3 | 179.2 | 0 | 0 | 0 | 0 | 111.9 | K255 | S253-K255 VanDerWaalsContact C-N 3.29Å; S253-K255 PolarHBondContact O-N 3.45Å; S253-K255 PolarHBondContact OG-N 2.98Å | ||
| 254 | T | 60.8 | Low | 65.4 | Low | 75 Ų | 75 | 129.3 Ų | 129.3 | 46% | 0.46 | 64% | 0.637 | S | S | . | * | S | Bend | trans | -79.8 | -5.5 | 179.2 | 50.3 | 0 | 0 | 0 | 0 | 114.4 | L243 R245 G256 | L243-T254 WeakPolarHBondContact O-CG2 3.33Å; R245-T254 HydrophobicContact CG-CG2 3.84Å; T254-G256 PolarHBondContact O-N 3.3Å |
| 255 | K | 61.1 | Low | 64.9 | Low | 167 Ų | 167 | 128.9 Ų | 128.9 | 73% | 0.726 | 64% | 0.641 | S | S | * | * | S | Bend | trans | -78.6 | 53.7 | -178.8 | -75.5 | -83.8 | -176.1 | 175 | 0 | 112.1 | S253 E257 | S253-K255 VanDerWaalsContact C-N 3.29Å; S253-K255 PolarHBondContact O-N 3.45Å; S253-K255 PolarHBondContact OG-N 2.98Å; K255-E257 PolarHBondContact O-N 3.16Å |
| 256 | G | 57.3 | Low | 64.3 | Low | 68 Ų | 68 | 127.8 Ų | 127.8 | 70% | 0.701 | 64% | 0.642 | S | S | * | * | trans | 46.8 | 24 | 157.2 | 0 | 0 | 0 | 0 | 0 | 118.5 | T254 R258 | T254-G256 PolarHBondContact O-N 3.3Å; G256-R258 PolarHBondContact O-N 3.09Å; G256-R258 VanDerWaalsContact O-N 3.15Å | ||
| 257 | E | 55.3 | Low | 63.5 | Low | 188 Ų | 188 | 122.9 Ų | 122.9 | 88% | 0.879 | 63% | 0.633 | S | S | * | * | trans | -77.2 | 104.1 | 170.4 | -83.9 | -178.5 | 162 | 0 | 0 | 107.2 | K255 | K255-E257 PolarHBondContact O-N 3.16Š| ||
| 258 | R | 55.7 | Low | 62.7 | Low | 226 Ų | 226 | 122.4 Ų | 122.4 | 85% | 0.853 | 63% | 0.628 | S | S | * | * | trans | -59.4 | 127.8 | -175.4 | -74.9 | 170.6 | 149.3 | -178.2 | -7.2 | 110.7 | G256 | G256-R258 PolarHBondContact O-N 3.09Å; G256-R258 VanDerWaalsContact O-N 3.15Å | ||
| 259 | F | 56.5 | Low | 61.9 | Low | 197 Ų | 197 | 122.4 Ų | 122.4 | 86% | 0.864 | 62% | 0.624 | S | S | * | * | trans | 60.2 | 108.1 | 166 | -62.1 | -85.2 | 0 | 0 | 0 | 117 | ||||
| 260 | K | 56.3 | Low | 61.2 | Low | 133 Ų | 133 | 120.6 Ų | 120.6 | 58% | 0.578 | 61% | 0.612 | S | S | * | * | trans | -90.2 | 118.3 | 149.2 | -74.5 | -170.9 | 174.2 | -175.5 | 0 | 107.1 | V262 | K260-V262 PolarHBondContact O-N 3.21Š| ||
| 261 | D | 54.7 | Low | 60.8 | Low | 164 Ų | 164 | 123 Ų | 123 | 88% | 0.877 | 62% | 0.621 | S | S | * | * | trans | -66.5 | 102.9 | 171.4 | -131.3 | -0.8 | 0 | 0 | 0 | 107.3 | R263 | D261-R263 VanDerWaalsContact C-N 3.26Å; D261-R263 PolarHBondContact O-N 2.93Å | ||
| 262 | V | 62.4 | Low | 60.2 | Low | 92 Ų | 92 | 123.1 Ų | 123.1 | 56% | 0.558 | 63% | 0.63 | S | S | * | * | trans | -74 | 87.7 | 177.1 | -177.6 | 0 | 0 | 0 | 0 | 107 | K260 N264 | K260-V262 PolarHBondContact O-N 3.21Å; V262-N264 PolarHBondContact O-N 3.07Å; V262-N264 VanDerWaalsContact O-N 3.13Å | ||
| 263 | R | 60.5 | Low | 60 | Low | 179 Ų | 179 | 126.3 Ų | 126.3 | 68% | 0.675 | 65% | 0.65 | S | S | * | * | trans | -72.4 | 101.7 | 172.7 | -175 | 170.6 | 179 | 141.9 | -11 | 108 | D261 P265 E268 | D261-R263 VanDerWaalsContact C-N 3.26Å; D261-R263 PolarHBondContact O-N 2.93Å; R263-P265 VanDerWaalsContact O-CD 3.25Å; R263-P265 WeakPolarHBondContact O-CD 3.28Å; R263-E268 IonicContact CZ-OE1 3.18Å; R263-E268 IonicContact CZ-OE2 3.68Å; R263-E268 IonicContact NE-OE1 2.69Å; R263-E268 IonicContact NE-OE2 3.96Å; R263-E268 PolarHBondContact NE-OE2 3.46Å; R263-E268 IonicContact NH2-OE1 3.8Å; R263-E268 PolarHBondContact NH2-OE1 3.31Å; R263-E268 IonicContact NH2-OE2 2.74Å; R263-E268 PolarHBondContact NH2-OE2 2.89Å | ||
| 264 | N | 60.3 | Low | 60 | Low | 101 Ų | 101 | 130.1 Ų | 130.1 | 54% | 0.54 | 65% | 0.652 | S | S | . | * | trans | -60.8 | 113 | 172.4 | -65.9 | -33.4 | 0 | 0 | 0 | 108.9 | V262 E266 A267 | V262-N264 PolarHBondContact O-N 3.07Å; V262-N264 VanDerWaalsContact O-N 3.13Å; N264-E266 PolarHBondContact O-N 3.33Å; N264-A267 HydrophobicContact CB-CB 4.19Å; N264-A267 PolarHBondContact O-N 3.38Å; N264-A267 VanDerWaalsContact O-N 3.13Å | ||
| 265 | P | 62.2 | Low | 60.4 | Low | 91 Ų | 91 | 132.8 Ų | 132.8 | 59% | 0.591 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -62.8 | -29.2 | -179.9 | 25.8 | -33.3 | 0 | 0 | 0 | 111.5 | R263 A267 E268 E269 | R263-P265 VanDerWaalsContact O-CD 3.25Å; R263-P265 WeakPolarHBondContact O-CD 3.28Å; P265-A267 VanDerWaalsContact C-N 3.29Å; P265-A267 PolarHBondContact O-N 2.94Å; P265-E268 PolarHBondContact O-N 2.91Å; P265-E268 VanDerWaalsContact O-N 3.11Å; P265-E269 PolarHBondContact O-N 3.48Å |
| 266 | E | 60.2 | Low | 60.6 | Low | 133 Ų | 133 | 130.6 Ų | 130.6 | 62% | 0.621 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -59.5 | -37.8 | 175.8 | -144.5 | -174.2 | 178.6 | 0 | 0 | 112.3 | N264 E268 M270 | N264-E266 PolarHBondContact O-N 3.33Å; E266-E268 VanDerWaalsContact C-N 3.3Å; E266-E268 PolarHBondContact O-N 2.84Å; E266-M270 HydrophobicContact CG-CE 3.87Å; E266-M270 VanDerWaalsContact O-CG 3.26Å; E266-M270 WeakPolarHBondContact O-CG 3.26Å; E266-M270 PolarHBondContact O-N 3.42Å; E266-M270 VanDerWaalsContact O-N 3.09Å |
| 267 | A | 61 | Low | 61.2 | Low | 46 Ų | 46 | 134.6 Ų | 134.6 | 38% | 0.38 | 66% | 0.663 | S | S | . | * | H | α-helix | trans | -74.7 | -21.3 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | N264 P265 K271 | N264-A267 HydrophobicContact CB-CB 4.19Å; N264-A267 PolarHBondContact O-N 3.38Å; N264-A267 VanDerWaalsContact O-N 3.13Å; P265-A267 VanDerWaalsContact C-N 3.29Å; P265-A267 PolarHBondContact O-N 2.94Å; A267-K271 WeakPolarHBondContact O-CG 3.4Å |
| 268 | E | 59.7 | Low | 62.1 | Low | 93 Ų | 93 | 134.8 Ų | 134.8 | 44% | 0.435 | 66% | 0.661 | S | S | . | * | H | α-helix | trans | -82.5 | -39.8 | 175 | -176.2 | 160.6 | -161.7 | 0 | 0 | 111.5 | R263 P265 E266 M270 K271 A272 | R263-E268 IonicContact CZ-OE1 3.18Å; R263-E268 IonicContact CZ-OE2 3.68Å; R263-E268 IonicContact NE-OE1 2.69Å; R263-E268 IonicContact NE-OE2 3.96Å; R263-E268 PolarHBondContact NE-OE2 3.46Å; R263-E268 IonicContact NH2-OE1 3.8Å; R263-E268 PolarHBondContact NH2-OE1 3.31Å; R263-E268 IonicContact NH2-OE2 2.74Å; R263-E268 PolarHBondContact NH2-OE2 2.89Å; P265-E268 PolarHBondContact O-N 2.91Å; P265-E268 VanDerWaalsContact O-N 3.11Å; E266-E268 VanDerWaalsContact C-N 3.3Å; E266-E268 PolarHBondContact O-N 2.84Å; E268-M270 VanDerWaalsContact C-N 3.33Å; E268-M270 PolarHBondContact O-N 3.5Å; E268-K271 PolarHBondContact O-N 3.01Å; E268-A272 PolarHBondContact O-N 3.29Å |
| 269 | E | 60.5 | Low | 62.9 | Low | 133 Ų | 133 | 129.9 Ų | 129.9 | 62% | 0.621 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -61.8 | -39.7 | 172.4 | -69.9 | 179.7 | -176.7 | 0 | 0 | 111.8 | P265 K271 A272 T273 | P265-E269 PolarHBondContact O-N 3.48Å; E269-K271 VanDerWaalsContact C-N 3.28Å; E269-K271 PolarHBondContact O-N 3.43Å; E269-A272 PolarHBondContact O-N 2.95Å; E269-T273 PolarHBondContact O-N 3.42Å; E269-T273 PolarHBondContact O-OG1 3.35Å |
| 270 | M | 62.8 | Low | 63.6 | Low | 120 Ų | 120 | 124.9 Ų | 124.9 | 59% | 0.591 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -62.5 | -33 | 175.1 | -71.5 | -178 | -155.9 | 0 | 0 | 113.1 | E266 E268 | E266-M270 HydrophobicContact CG-CE 3.87Å; E266-M270 VanDerWaalsContact O-CG 3.26Å; E266-M270 WeakPolarHBondContact O-CG 3.26Å; E266-M270 PolarHBondContact O-N 3.42Å; E266-M270 VanDerWaalsContact O-N 3.09Å; E268-M270 VanDerWaalsContact C-N 3.33Å; E268-M270 PolarHBondContact O-N 3.5Å |
| 271 | K | 64.8 | Low | 64.2 | Low | 168 Ų | 168 | 129.4 Ų | 129.4 | 73% | 0.73 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -75.5 | -37.6 | 175.7 | -71.3 | 174.3 | -175 | 177.2 | 0 | 112.1 | A267 E268 E269 T273 Y274 | A267-K271 WeakPolarHBondContact O-CG 3.4Å; E268-K271 PolarHBondContact O-N 3.01Å; E269-K271 VanDerWaalsContact C-N 3.28Å; E269-K271 PolarHBondContact O-N 3.43Å; K271-T273 VanDerWaalsContact C-N 3.28Å; K271-T273 PolarHBondContact O-N 3.07Å; K271-Y274 PolarHBondContact O-N 3.35Å |
| 272 | A | 62 | Low | 65 | Low | 86 Ų | 86 | 131.2 Ų | 131.2 | 71% | 0.711 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -66.5 | -31.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | E268 E269 Y274 | E268-A272 PolarHBondContact O-N 3.29Å; E269-A272 PolarHBondContact O-N 2.95Å; A272-Y274 VanDerWaalsContact C-N 3.28Å; A272-Y274 PolarHBondContact O-N 2.99Å |
| 273 | T | 63.2 | Low | 65.3 | Low | 104 Ų | 104 | 135.8 Ų | 135.8 | 64% | 0.638 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.6 | -1.6 | -178.1 | -42.1 | 0 | 0 | 0 | 0 | 113.1 | E269 K271 I275 | E269-T273 PolarHBondContact O-N 3.42Å; E269-T273 PolarHBondContact O-OG1 3.35Å; K271-T273 VanDerWaalsContact C-N 3.28Å; K271-T273 PolarHBondContact O-N 3.07Å; T273-I275 PolarHBondContact O-N 3.23Å |
| 274 | Y | 62.2 | Low | 65.4 | Low | 169 Ų | 169 | 138.4 Ų | 138.4 | 66% | 0.663 | 69% | 0.685 | S | S | * | * | trans | -75.3 | 86.9 | 179 | -167.1 | -104.1 | 0 | 0 | 0 | 111.4 | K271 A272 N276 | K271-Y274 PolarHBondContact O-N 3.35Å; A272-Y274 VanDerWaalsContact C-N 3.28Å; A272-Y274 PolarHBondContact O-N 2.99Å; Y274-N276 WeakPolarHBondContact CE1-OD1 3.2Å; Y274-N276 PolarHBondContact O-N 2.84Å | ||
| 275 | I | 70.4 | Confident | 65.3 | Low | 130 Ų | 130 | 141.3 Ų | 141.3 | 67% | 0.667 | 69% | 0.693 | S | S | * | * | trans | -83.4 | 108.2 | 175.4 | -58 | 171.8 | 0 | 0 | 0 | 108.7 | T273 L277 | T273-I275 PolarHBondContact O-N 3.23Å; I275-L277 VanDerWaalsContact C-N 3.33Å; I275-L277 HydrophobicContact CG2-CG 4.21Å; I275-L277 PolarHBondContact O-N 3.34Å | ||
| 276 | N | 65.8 | Low | 64.7 | Low | 121 Ų | 121 | 149 Ų | 149 | 65% | 0.647 | 72% | 0.721 | S | S | * | * | trans | -71.4 | 86.4 | 170.1 | -75.6 | -61.5 | 0 | 0 | 0 | 110.3 | Y274 K278 | Y274-N276 WeakPolarHBondContact CE1-OD1 3.2Å; Y274-N276 PolarHBondContact O-N 2.84Å; N276-K278 PolarHBondContact O-N 3Å | ||
| 277 | L | 68.7 | Low | 64.9 | Low | 153 Ų | 153 | 149.8 Ų | 149.8 | 80% | 0.801 | 73% | 0.726 | S | S | * | * | trans | -66.4 | 112.4 | 170.9 | -80 | 142.9 | 0 | 0 | 0 | 109.2 | I275 | I275-L277 VanDerWaalsContact C-N 3.33Å; I275-L277 HydrophobicContact CG2-CG 4.21Å; I275-L277 PolarHBondContact O-N 3.34Å | ||
| 278 | K | 73.8 | Confident | 65.1 | Low | 192 Ų | 192 | 155.2 Ų | 155.2 | 84% | 0.835 | 74% | 0.744 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 139.7 | 171.3 | -70.7 | -174.8 | 178.9 | 176.5 | 0 | 109 | N276 A280 | N276-K278 PolarHBondContact O-N 3Å; K278-A280 PolarHBondContact O-N 2.88Å |
| 279 | P | 72.8 | Confident | 65.4 | Low | 122 Ų | 122 | 158.7 Ų | 158.7 | 79% | 0.792 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -55.3 | 136.5 | 174.8 | -22.3 | 31.3 | 0 | 0 | 0 | 110.7 | R281 | P279-R281 PolarHBondContact O-N 3.01Š|
| 280 | A | 70.6 | Confident | 65.7 | Low | 93 Ų | 93 | 160.2 Ų | 160.2 | 77% | 0.769 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 126 | 179.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | K278 K282 | K278-A280 PolarHBondContact O-N 2.88Å; A280-K282 PolarHBondContact O-N 2.74Å |
| 281 | R | 70.6 | Confident | 65.9 | Low | 228 Ų | 228 | 162.7 Ų | 162.7 | 86% | 0.86 | 78% | 0.78 | S | S | * | * | trans | -62 | 109.1 | 171.5 | -88 | 178.3 | 159.6 | 170.5 | -6.5 | 107.9 | P279 Y283 | P279-R281 PolarHBondContact O-N 3.01Å; R281-Y283 PolarHBondContact O-N 3.27Å | ||
| 282 | K | 71.6 | Confident | 65.9 | Low | 202 Ų | 202 | 162.3 Ų | 162.3 | 88% | 0.878 | 78% | 0.784 | S | S | * | * | trans | -64.6 | 103.4 | 168.2 | -65.6 | -168 | 178.9 | -173.7 | 0 | 107.6 | A280 R284 | A280-K282 PolarHBondContact O-N 2.74Å; K282-R284 PolarHBondContact O-N 2.87Å; K282-R284 VanDerWaalsContact O-N 3.13Å | ||
| 283 | Y | 67.1 | Low | 66.2 | Low | 188 Ų | 188 | 167.8 Ų | 167.8 | 74% | 0.737 | 79% | 0.789 | S | S | * | * | trans | -66 | 107.9 | 163.9 | -96.5 | -97.4 | 0 | 0 | 0 | 107.2 | R281 F285 | R281-Y283 PolarHBondContact O-N 3.27Å; Y283-F285 HydrophobicContact CD1-CE2 4.41Å; Y283-F285 PolarHBondContact O-N 2.73Å | ||
| 284 | R | 63.9 | Low | 66.5 | Low | 233 Ų | 233 | 172.7 Ų | 172.7 | 88% | 0.879 | 80% | 0.8 | S | S | * | * | trans | -75.2 | 105.4 | 162.3 | -82 | -172 | 166.1 | 177 | -3.9 | 106.6 | K282 | K282-R284 PolarHBondContact O-N 2.87Å; K282-R284 VanDerWaalsContact O-N 3.13Å | ||
| 285 | F | 58.4 | Low | 66.8 | Low | 162 Ų | 162 | 173 Ų | 173 | 71% | 0.711 | 81% | 0.812 | S | S | * | * | trans | -79.1 | 127.2 | 157.8 | -80.2 | -86.8 | 0 | 0 | 0 | 107.4 | Y283 | Y283-F285 HydrophobicContact CD1-CE2 4.41Å; Y283-F285 PolarHBondContact O-N 2.73Å | ||
| 286 | H | 48 | Very low | 66.5 | Low | 252 Ų | 252 | 176.9 Ų | 176.9 | 100% | 1.167 | 83% | 0.825 | S | S | * | * | trans | 87.5 | 0 | 176.1 | -46.8 | -59.4 | 0 | 0 | 0 | 116.3 |
Retrieved 286 of 286 residues in 51.1 ms
(Link to these results)