| 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 | 35 | Very low | 49.7 | Very low | 148 Ų | 148 | 75.4 Ų | 75.4 | 73% | 0.729 | 43% | 0.431 | S | S | * | . | 0 | -77.3 | 0 | -158.2 | 159 | 83 | 0 | 0 | 112.9 | S3 V4 L5 I390 | M1-S3 PolarHBondContact O-N 3.46Å; M1-V4 WeakPolarHBondContact O-CA 3.43Å; M1-V4 WeakPolarHBondContact O-CB 3.43Å; M1-V4 PolarHBondContact O-N 3.31Å; M1-L5 HydrophobicContact CG-CD1 3.59Å; M1-L5 WeakPolarHBondContact O-CD1 3.42Å; M1-L5 PolarHBondContact O-N 3.18Å; M1-I390 HydrophobicContact CE-CD1 3.8Å | |||
| 2 | K | 37.5 | Very low | 51 | Low | 145 Ų | 145 | 72.7 Ų | 72.7 | 63% | 0.63 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -49 | -48.6 | -172.2 | -174.1 | -176.3 | 172.2 | -166.6 | 0 | 115.8 | V4 L5 D6 | K2-V4 VanDerWaalsContact C-N 3.28Å; K2-V4 PolarHBondContact O-N 3.42Å; K2-L5 PolarHBondContact O-N 3.29Å; K2-D6 WeakPolarHBondContact O-CB 3.39Å; K2-D6 PolarHBondContact O-N 3.05Å |
| 3 | S | 36.7 | Very low | 52 | Low | 97 Ų | 97 | 70 Ų | 70 | 68% | 0.678 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -66.3 | -28.7 | 179.1 | 64.2 | 0 | 0 | 0 | 0 | 113.6 | M1 G7 | M1-S3 PolarHBondContact O-N 3.46Å; S3-G7 PolarHBondContact O-N 3.48Å |
| 4 | V | 50.8 | Low | 52.9 | Low | 94 Ų | 94 | 76.4 Ų | 76.4 | 57% | 0.57 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -70.5 | -45.6 | 174.4 | -177.5 | 0 | 0 | 0 | 0 | 109.8 | M1 K2 G7 V8 | M1-V4 WeakPolarHBondContact O-CA 3.43Å; M1-V4 WeakPolarHBondContact O-CB 3.43Å; M1-V4 PolarHBondContact O-N 3.31Å; K2-V4 VanDerWaalsContact C-N 3.28Å; K2-V4 PolarHBondContact O-N 3.42Å; V4-G7 PolarHBondContact O-N 3.06Å; V4-V8 WeakPolarHBondContact O-CG2 3.5Å; V4-V8 PolarHBondContact O-N 3.48Å |
| 5 | L | 44.3 | Very low | 53.9 | Low | 42 Ų | 42 | 77.4 Ų | 77.4 | 22% | 0.22 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -63.3 | -43.5 | 174.5 | -85.2 | 72.5 | 0 | 0 | 0 | 111.9 | M1 K2 G7 A9 L342 | M1-L5 HydrophobicContact CG-CD1 3.59Å; M1-L5 WeakPolarHBondContact O-CD1 3.42Å; M1-L5 PolarHBondContact O-N 3.18Å; K2-L5 PolarHBondContact O-N 3.29Å; L5-G7 VanDerWaalsContact C-N 3.28Å; L5-G7 PolarHBondContact O-N 3.26Å; L5-A9 WeakPolarHBondContact O-CB 3.5Å; L5-A9 PolarHBondContact O-N 3.37Å; L5-L342 HydrophobicContact CB-CD1 4.26Å; L5-L342 HydrophobicContact CD2-CD1 3.82Å; L5-L342 HydrophobicContact CD2-CD2 4Å; L5-L342 HydrophobicContact CG-CD1 3.93Å |
| 6 | D | 50.7 | Low | 54 | Low | 74 Ų | 74 | 76.4 Ų | 76.4 | 40% | 0.396 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -63.7 | -34.2 | 176.3 | -78.6 | -34.3 | 0 | 0 | 0 | 111.5 | K2 D10 | K2-D6 WeakPolarHBondContact O-CB 3.39Å; K2-D6 PolarHBondContact O-N 3.05Å; D6-D10 WeakPolarHBondContact O-CB 3.44Å; D6-D10 PolarHBondContact O-N 2.91Å |
| 7 | G | 55.8 | Low | 54 | Low | 34 Ų | 34 | 73.4 Ų | 73.4 | 35% | 0.351 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -70.9 | -48.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | S3 V4 L5 A9 D10 T11 | S3-G7 PolarHBondContact O-N 3.48Å; V4-G7 PolarHBondContact O-N 3.06Å; L5-G7 VanDerWaalsContact C-N 3.28Å; L5-G7 PolarHBondContact O-N 3.26Å; G7-A9 VanDerWaalsContact C-N 3.35Å; G7-A9 PolarHBondContact O-N 2.97Å; G7-D10 PolarHBondContact O-N 3.48Å; G7-T11 PolarHBondContact O-N 3.36Å; G7-T11 PolarHBondContact O-OG1 3.36Å; G7-T11 VanDerWaalsContact O-OG1 3.04Å |
| 8 | V | 57.7 | Low | 54.3 | Low | 65 Ų | 65 | 72.6 Ų | 72.6 | 39% | 0.394 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -59 | -47.7 | 173.6 | 172.7 | 0 | 0 | 0 | 0 | 110.1 | V4 D10 T11 T12 V345 | V4-V8 WeakPolarHBondContact O-CG2 3.5Å; V4-V8 PolarHBondContact O-N 3.48Å; V8-D10 VanDerWaalsContact C-N 3.33Å; V8-D10 PolarHBondContact O-N 3.03Å; V8-T11 PolarHBondContact O-N 3.42Å; V8-T12 WeakPolarHBondContact O-CB 3.36Å; V8-T12 PolarHBondContact O-N 2.72Å; V8-T12 PolarHBondContact O-OG1 3.29Å; V8-T12 VanDerWaalsContact O-OG1 3.06Å; V8-V345 HydrophobicContact CG1-CG1 4.4Å |
| 9 | A | 49.2 | Very low | 53.8 | Low | 4 Ų | 4 | 70.7 Ų | 70.7 | 3% | 0.033 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -63.5 | -34.5 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | L5 G7 F13 K338 | L5-A9 WeakPolarHBondContact O-CB 3.5Å; L5-A9 PolarHBondContact O-N 3.37Å; G7-A9 VanDerWaalsContact C-N 3.35Å; G7-A9 PolarHBondContact O-N 2.97Å; A9-F13 WeakPolarHBondContact O-CB 3.42Å; A9-F13 PolarHBondContact O-N 3.43Å; A9-K338 HydrophobicContact CB-CB 4.45Å |
| 10 | D | 62.6 | Low | 53.2 | Low | 37 Ų | 37 | 69.5 Ų | 69.5 | 20% | 0.198 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -71.5 | -44.8 | 175.7 | -159.3 | 75 | 0 | 0 | 0 | 111.8 | D6 G7 V8 F13 R14 K338 | D6-D10 WeakPolarHBondContact O-CB 3.44Å; D6-D10 PolarHBondContact O-N 2.91Å; G7-D10 PolarHBondContact O-N 3.48Å; V8-D10 VanDerWaalsContact C-N 3.33Å; V8-D10 PolarHBondContact O-N 3.03Å; D10-F13 PolarHBondContact O-N 3.44Å; D10-R14 WeakPolarHBondContact O-CG 3.23Å; D10-R14 PolarHBondContact O-N 3.19Å; D10-R14 IonicContact OD2-CZ 2.97Å; D10-R14 IonicContact OD2-NE 2.8Å; D10-R14 PolarHBondContact OD2-NE 3.16Å; D10-R14 IonicContact OD2-NH2 3.21Å; D10-R14 PolarHBondContact OD2-NH2 3.36Å; D10-K338 WeakPolarHBondContact OD1-CE 3.29Å; D10-K338 IonicContact OD1-NZ 2.62Å; D10-K338 PolarHBondContact OD1-NZ 3.43Å |
| 11 | T | 66.2 | Low | 52.7 | Low | 89 Ų | 89 | 72.7 Ų | 72.7 | 55% | 0.546 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -61 | -53.5 | 176.7 | -56.2 | 0 | 0 | 0 | 0 | 111 | G7 V8 F13 R14 T15 | G7-T11 PolarHBondContact O-N 3.36Å; G7-T11 PolarHBondContact O-OG1 3.36Å; G7-T11 VanDerWaalsContact O-OG1 3.04Å; V8-T11 PolarHBondContact O-N 3.42Å; T11-F13 VanDerWaalsContact C-N 3.32Å; T11-F13 PolarHBondContact O-N 3.23Å; T11-R14 PolarHBondContact O-N 3.24Å; T11-T15 PolarHBondContact O-N 3.49Å; T11-T15 PolarHBondContact O-OG1 3.34Å; T11-T15 VanDerWaalsContact O-OG1 3.12Å |
| 12 | T | 65.4 | Low | 52.9 | Low | 43 Ų | 43 | 75.5 Ų | 75.5 | 26% | 0.264 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -62.6 | -37.8 | 179 | -54.7 | 0 | 0 | 0 | 0 | 111.9 | V8 T15 I16 V341 V345 | V8-T12 WeakPolarHBondContact O-CB 3.36Å; V8-T12 PolarHBondContact O-N 2.72Å; V8-T12 PolarHBondContact O-OG1 3.29Å; V8-T12 VanDerWaalsContact O-OG1 3.06Å; T12-T15 PolarHBondContact O-N 2.91Å; T12-I16 HydrophobicContact CG2-CD1 3.83Å; T12-I16 HydrophobicContact CG2-CG1 4.44Å; T12-I16 WeakPolarHBondContact O-CB 3.41Å; T12-I16 VanDerWaalsContact O-CG1 3.29Å; T12-I16 WeakPolarHBondContact O-CG1 3.49Å; T12-I16 PolarHBondContact O-N 2.94Å; T12-V341 HydrophobicContact CG2-CG1 3.52Å; T12-V345 HydrophobicContact CG2-CG2 4.05Å |
| 13 | F | 63.6 | Low | 52.9 | Low | 38 Ų | 38 | 75.6 Ų | 75.6 | 17% | 0.167 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -61.7 | -47.2 | 174.3 | 178.5 | -103 | 0 | 0 | 0 | 111.7 | A9 D10 T11 T15 I16 T17 A337 V341 | A9-F13 WeakPolarHBondContact O-CB 3.42Å; A9-F13 PolarHBondContact O-N 3.43Å; D10-F13 PolarHBondContact O-N 3.44Å; T11-F13 VanDerWaalsContact C-N 3.32Å; T11-F13 PolarHBondContact O-N 3.23Å; F13-T15 PolarHBondContact O-N 3.45Å; F13-I16 PolarHBondContact O-N 2.89Å; F13-T17 HydrophobicContact CD1-CG2 4.35Å; F13-T17 HydrophobicContact CD2-CG2 4.29Å; F13-T17 HydrophobicContact CE1-CG2 3.92Å; F13-T17 HydrophobicContact CE2-CG2 3.84Å; F13-T17 HydrophobicContact CZ-CG2 3.64Å; F13-T17 WeakPolarHBondContact O-CG2 3.42Å; F13-T17 PolarHBondContact O-N 3.35Å; F13-T17 PolarHBondContact O-OG1 3.14Å; F13-T17 VanDerWaalsContact O-OG1 3.06Å; F13-A337 HydrophobicContact CD2-CB 4.07Å; F13-A337 HydrophobicContact CE2-CB 3.58Å; F13-A337 HydrophobicContact CZ-CB 4.33Å; F13-V341 HydrophobicContact CB-CG2 4.33Å; F13-V341 HydrophobicContact CD2-CG2 4.21Å |
| 14 | R | 65.1 | Low | 52.7 | Low | 160 Ų | 160 | 73.6 Ų | 73.6 | 60% | 0.604 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -56.9 | -50.8 | 176.6 | -71.6 | 178.8 | -159.2 | -160.4 | 8 | 111.4 | D10 T11 I16 T17 S18 | D10-R14 WeakPolarHBondContact O-CG 3.23Å; D10-R14 PolarHBondContact O-N 3.19Å; D10-R14 IonicContact OD2-CZ 2.97Å; D10-R14 IonicContact OD2-NE 2.8Å; D10-R14 PolarHBondContact OD2-NE 3.16Å; D10-R14 IonicContact OD2-NH2 3.21Å; D10-R14 PolarHBondContact OD2-NH2 3.36Å; T11-R14 PolarHBondContact O-N 3.24Å; R14-I16 VanDerWaalsContact C-N 3.35Å; R14-I16 PolarHBondContact O-N 3.01Å; R14-T17 WeakPolarHBondContact CA-OG1 3.2Å; R14-T17 PolarHBondContact O-N 3.03Å; R14-T17 VanDerWaalsContact O-N 3.13Å; R14-T17 PolarHBondContact O-OG1 3.43Å; R14-S18 PolarHBondContact O-N 3.28Å; R14-S18 PolarHBondContact O-OG 3.04Å |
| 15 | T | 67.6 | Low | 51.9 | Low | 91 Ų | 91 | 73.6 Ų | 73.6 | 56% | 0.558 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -58.6 | -42.8 | 179.7 | -54 | 0 | 0 | 0 | 0 | 112.6 | T11 T12 F13 S18 G19 | T11-T15 PolarHBondContact O-N 3.49Å; T11-T15 PolarHBondContact O-OG1 3.34Å; T11-T15 VanDerWaalsContact O-OG1 3.12Å; T12-T15 PolarHBondContact O-N 2.91Å; F13-T15 PolarHBondContact O-N 3.45Å; T15-S18 WeakPolarHBondContact CA-OG 3.42Å; T15-S18 PolarHBondContact O-OG 3.28Å; T15-G19 PolarHBondContact O-N 3.38Å; T15-G19 VanDerWaalsContact O-N 3.11Å |
| 16 | I | 55.2 | Low | 51.5 | Low | 61 Ų | 61 | 78.9 Ų | 78.9 | 31% | 0.313 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -66.2 | -42.9 | 175.9 | -68.2 | 170.3 | 0 | 0 | 0 | 110.6 | T12 F13 R14 G19 L20 V341 | T12-I16 HydrophobicContact CG2-CD1 3.83Å; T12-I16 HydrophobicContact CG2-CG1 4.44Å; T12-I16 WeakPolarHBondContact O-CB 3.41Å; T12-I16 VanDerWaalsContact O-CG1 3.29Å; T12-I16 WeakPolarHBondContact O-CG1 3.49Å; T12-I16 PolarHBondContact O-N 2.94Å; F13-I16 PolarHBondContact O-N 2.89Å; R14-I16 VanDerWaalsContact C-N 3.35Å; R14-I16 PolarHBondContact O-N 3.01Å; I16-G19 PolarHBondContact O-N 3.33Å; I16-L20 HydrophobicContact CG2-CD1 3.9Å; I16-L20 HydrophobicContact CG2-CG 4.48Å; I16-L20 WeakPolarHBondContact O-CG 3.3Å; I16-L20 PolarHBondContact O-N 2.87Å; I16-V341 HydrophobicContact CD1-CG2 4.48Å |
| 17 | T | 54.4 | Low | 50.7 | Low | 25 Ų | 25 | 82.9 Ų | 82.9 | 15% | 0.153 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -66.3 | -37.7 | 178.7 | 51.3 | 0 | 0 | 0 | 0 | 113.4 | F13 R14 L20 Q21 | F13-T17 HydrophobicContact CD1-CG2 4.35Å; F13-T17 HydrophobicContact CD2-CG2 4.29Å; F13-T17 HydrophobicContact CE1-CG2 3.92Å; F13-T17 HydrophobicContact CE2-CG2 3.84Å; F13-T17 HydrophobicContact CZ-CG2 3.64Å; F13-T17 WeakPolarHBondContact O-CG2 3.42Å; F13-T17 PolarHBondContact O-N 3.35Å; F13-T17 PolarHBondContact O-OG1 3.14Å; F13-T17 VanDerWaalsContact O-OG1 3.06Å; R14-T17 WeakPolarHBondContact CA-OG1 3.2Å; R14-T17 PolarHBondContact O-N 3.03Å; R14-T17 VanDerWaalsContact O-N 3.13Å; R14-T17 PolarHBondContact O-OG1 3.43Å; T17-L20 PolarHBondContact O-N 3.37Å; T17-Q21 PolarHBondContact O-N 2.99Å; T17-Q21 VanDerWaalsContact O-N 3.08Å |
| 18 | S | 59.7 | Low | 49.6 | Very low | 59 Ų | 59 | 85.8 Ų | 85.8 | 41% | 0.413 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -68.2 | -37.9 | 175.8 | 53.4 | 0 | 0 | 0 | 0 | 112.3 | R14 T15 L20 Q21 Y22 | R14-S18 PolarHBondContact O-N 3.28Å; R14-S18 PolarHBondContact O-OG 3.04Å; T15-S18 WeakPolarHBondContact CA-OG 3.42Å; T15-S18 PolarHBondContact O-OG 3.28Å; S18-L20 VanDerWaalsContact C-N 3.34Å; S18-Q21 PolarHBondContact O-N 3.01Å; S18-Y22 PolarHBondContact O-N 2.82Å |
| 19 | G | 45 | Very low | 48.1 | Very low | 37 Ų | 37 | 89.5 Ų | 89.5 | 38% | 0.381 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.1 | -38.2 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | T15 I16 Y22 L23 | T15-G19 PolarHBondContact O-N 3.38Å; T15-G19 VanDerWaalsContact O-N 3.11Å; I16-G19 PolarHBondContact O-N 3.33Å; G19-Y22 PolarHBondContact O-N 2.96Å; G19-L23 PolarHBondContact O-N 3.12Å |
| 20 | L | 41.5 | Very low | 47 | Very low | 46 Ų | 46 | 98.5 Ų | 98.5 | 24% | 0.241 | 54% | 0.536 | C | S | . | . | H | α-helix | trans | -71.5 | -25.7 | 176.7 | -72.4 | 171.1 | 0 | 0 | 0 | 113.7 | I16 T17 S18 G24 | I16-L20 HydrophobicContact CG2-CD1 3.9Å; I16-L20 HydrophobicContact CG2-CG 4.48Å; I16-L20 WeakPolarHBondContact O-CG 3.3Å; I16-L20 PolarHBondContact O-N 2.87Å; T17-L20 PolarHBondContact O-N 3.37Å; S18-L20 VanDerWaalsContact C-N 3.34Å; L20-G24 PolarHBondContact O-N 3.48Å |
| 21 | Q | 43.4 | Very low | 45.4 | Very low | 137 Ų | 137 | 103.4 Ų | 103.4 | 64% | 0.64 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -67.2 | -38.6 | 172.1 | -76.9 | 178.5 | -58.7 | 0 | 0 | 111.8 | T17 S18 L23 G24 | T17-Q21 PolarHBondContact O-N 2.99Å; T17-Q21 VanDerWaalsContact O-N 3.08Å; S18-Q21 PolarHBondContact O-N 3.01Å; Q21-L23 VanDerWaalsContact C-N 3.34Å; Q21-L23 PolarHBondContact O-N 3.25Å; Q21-G24 PolarHBondContact O-N 3.35Å |
| 22 | Y | 38.3 | Very low | 43.5 | Very low | 207 Ų | 207 | 106 Ų | 106 | 81% | 0.812 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -66.8 | -32.7 | 178 | -109.7 | -89.1 | 0 | 0 | 0 | 113.5 | S18 G19 G24 | S18-Y22 PolarHBondContact O-N 2.82Å; G19-Y22 PolarHBondContact O-N 2.96Å; Y22-G24 VanDerWaalsContact C-N 3.29Å; Y22-G24 PolarHBondContact O-N 2.77Å |
| 23 | L | 38 | Very low | 42.2 | Very low | 148 Ų | 148 | 109.2 Ų | 109.2 | 78% | 0.775 | 59% | 0.594 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.7 | -12.1 | 176.2 | -71.1 | 167.8 | 0 | 0 | 0 | 113.8 | G19 Q21 | G19-L23 PolarHBondContact O-N 3.12Å; Q21-L23 VanDerWaalsContact C-N 3.34Å; Q21-L23 PolarHBondContact O-N 3.25Å |
| 24 | G | 32.6 | Very low | 40.5 | Very low | 54 Ų | 54 | 115.2 Ų | 115.2 | 56% | 0.557 | 63% | 0.626 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.5 | 9.8 | -179.5 | 0 | 0 | 0 | 0 | 0 | 115 | L20 Q21 Y22 | L20-G24 PolarHBondContact O-N 3.48Å; Q21-G24 PolarHBondContact O-N 3.35Å; Y22-G24 VanDerWaalsContact C-N 3.29Å; Y22-G24 PolarHBondContact O-N 2.77Å |
| 25 | S | 33.7 | Very low | 38.7 | Very low | 95 Ų | 95 | 114.1 Ų | 114.1 | 66% | 0.664 | 63% | 0.632 | S | S | * | * | S | Bend | trans | -102.4 | 6.5 | -174.9 | -164.9 | 0 | 0 | 0 | 0 | 114.7 | ||
| 26 | N | 35.9 | Very low | 36.7 | Very low | 153 Ų | 153 | 115.9 Ų | 115.9 | 82% | 0.818 | 64% | 0.638 | S | S | * | * | trans | -115.4 | 48.1 | 179.3 | -73 | 0.1 | 0 | 0 | 0 | 111.6 | ||||
| 27 | D | 33.7 | Very low | 35.3 | Very low | 158 Ų | 158 | 119.2 Ų | 119.2 | 85% | 0.845 | 66% | 0.656 | S | S | * | * | P | Polyproline II helix | trans | -83.4 | 132.9 | 165.1 | -86.6 | -30 | 0 | 0 | 0 | 109.5 | ||
| 28 | A | 33 | Very low | 33.9 | Very low | 94 Ų | 94 | 124.7 Ų | 124.7 | 78% | 0.777 | 68% | 0.684 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 141.1 | -166.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||
| 29 | N | 26 | Very low | 32.2 | Very low | 143 Ų | 143 | 130.4 Ų | 130.4 | 77% | 0.765 | 71% | 0.709 | S | S | * | * | P | Polyproline II helix | trans | -89.8 | 127.3 | 161.4 | -152.5 | 58.2 | 0 | 0 | 0 | 108.6 | D31 | N29-D31 PolarHBondContact ND2-OD2 3.17Å; N29-D31 VanDerWaalsContact ND2-OD2 3.16Å |
| 30 | Y | 26.2 | Very low | 31.3 | Very low | 194 Ų | 194 | 138.7 Ų | 138.7 | 76% | 0.761 | 74% | 0.735 | S | S | * | * | trans | -116.3 | 110.8 | -176.1 | -147.8 | -68.7 | 0 | 0 | 0 | 107.1 | ||||
| 31 | D | 28.1 | Very low | 30.5 | Very low | 140 Ų | 140 | 140 Ų | 140 | 75% | 0.749 | 76% | 0.76 | S | S | * | * | trans | -142.4 | 125.6 | 172.4 | -81.2 | -54.7 | 0 | 0 | 0 | 108.7 | N29 | N29-D31 PolarHBondContact ND2-OD2 3.17Å; N29-D31 VanDerWaalsContact ND2-OD2 3.16Å | ||
| 32 | D | 27.3 | Very low | 29.5 | Very low | 143 Ų | 143 | 138.8 Ų | 138.8 | 77% | 0.765 | 77% | 0.766 | S | S | * | * | trans | -90.3 | 164.6 | -179 | -99.9 | -39.5 | 0 | 0 | 0 | 111.9 | ||||
| 33 | P | 38.7 | Very low | 28.8 | Very low | 111 Ų | 111 | 137 Ų | 137 | 72% | 0.721 | 77% | 0.77 | S | S | * | * | trans | -105.2 | 144.8 | -150.8 | 37.5 | -35.3 | 0 | 0 | 0 | 116.2 | ||||
| 34 | I | 27.2 | Very low | 28 | Very low | 164 Ų | 164 | 135.1 Ų | 135.1 | 84% | 0.841 | 77% | 0.769 | S | S | * | * | trans | -145.2 | 146.3 | 149.4 | -65 | -167.9 | 0 | 0 | 0 | 110.1 | ||||
| 35 | N | 27.1 | Very low | 27.5 | Very low | 136 Ų | 136 | 140.9 Ų | 140.9 | 73% | 0.727 | 78% | 0.784 | S | S | * | * | trans | -41.1 | 161.4 | 172.3 | -53.4 | -13.4 | 0 | 0 | 0 | 115.2 | ||||
| 36 | D | 25.7 | Very low | 27.1 | Very low | 129 Ų | 129 | 144.8 Ų | 144.8 | 69% | 0.69 | 79% | 0.792 | S | S | * | * | cis | -164.1 | 160.1 | 38.8 | -130 | -28.9 | 0 | 0 | 0 | 115.5 | ||||
| 37 | L | 26.6 | Very low | 26.7 | Very low | 130 Ų | 130 | 146.9 Ų | 146.9 | 68% | 0.681 | 79% | 0.794 | S | S | * | * | trans | 43.9 | 120.4 | 151.2 | -73.6 | 153.3 | 0 | 0 | 0 | 124.2 | ||||
| 38 | N | 23.8 | Very low | 26.3 | Very low | 140 Ų | 140 | 145.4 Ų | 145.4 | 75% | 0.749 | 79% | 0.793 | S | S | * | * | trans | 58.8 | 111.5 | 136 | -71.9 | -25 | 0 | 0 | 0 | 122.2 | ||||
| 39 | L | 25.4 | Very low | 25.9 | Very low | 179 Ų | 179 | 148.9 Ų | 148.9 | 94% | 0.937 | 80% | 0.797 | S | S | * | * | -157.8 | 154.6 | 110 | -134.9 | 71.8 | 0 | 0 | 0 | 113.5 | |||||
| 40 | K | 24.7 | Very low | 25.8 | Very low | 211 Ų | 211 | 147.4 Ų | 147.4 | 92% | 0.917 | 80% | 0.798 | S | S | * | * | trans | -81.6 | 149.2 | -175.8 | -73.1 | 169.8 | 170.7 | 172.2 | 0 | 113.2 | ||||
| 41 | G | 24.5 | Very low | 25.6 | Very low | 75 Ų | 75 | 142.5 Ų | 142.5 | 77% | 0.773 | 80% | 0.797 | S | S | * | * | trans | 174.4 | 95.9 | 165.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 42 | S | 22.8 | Very low | 25.4 | Very low | 110 Ų | 110 | 146.2 Ų | 146.2 | 77% | 0.769 | 81% | 0.807 | S | S | * | * | trans | -26.1 | 155.9 | 162.4 | 58 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 43 | L | 23.3 | Very low | 25.1 | Very low | 170 Ų | 170 | 150.1 Ų | 150.1 | 89% | 0.89 | 81% | 0.811 | S | S | * | * | cis | -161.7 | 152.9 | 48.8 | -155.4 | 91 | 0 | 0 | 0 | 111.9 | ||||
| 44 | S | 21.4 | Very low | 24.3 | Very low | 109 Ų | 109 | 149.8 Ų | 149.8 | 76% | 0.762 | 81% | 0.812 | S | S | * | * | trans | -144.4 | 129 | 174.3 | 61.9 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 45 | M | 23.4 | Very low | 24.1 | Very low | 174 Ų | 174 | 151.8 Ų | 151.8 | 86% | 0.857 | 81% | 0.814 | S | S | * | * | trans | -155.8 | 129.2 | 156.1 | -84.1 | -170.9 | 72.1 | 0 | 0 | 106.3 | ||||
| 46 | Q | 24.3 | Very low | 23.8 | Very low | 178 Ų | 178 | 151.5 Ų | 151.5 | 83% | 0.832 | 82% | 0.817 | S | S | * | * | cis | 81.6 | 120.9 | 44.1 | -160.9 | 163.6 | 5.9 | 0 | 0 | 113.5 | ||||
| 47 | K | 27.3 | Very low | 24 | Very low | 197 Ų | 197 | 150.3 Ų | 150.3 | 86% | 0.857 | 82% | 0.816 | S | S | * | * | trans | -60.2 | 163.6 | 178.3 | -70.2 | 178.5 | 174.8 | 177 | 0 | 112.2 | ||||
| 48 | P | 26.3 | Very low | 23.8 | Very low | 127 Ų | 127 | 149.6 Ų | 149.6 | 83% | 0.825 | 82% | 0.817 | S | S | * | * | -134.3 | 173.9 | 123.5 | 33.3 | -19.8 | 0 | 0 | 0 | 114.4 | |||||
| 49 | L | 24.2 | Very low | 23.8 | Very low | 166 Ų | 166 | 149.5 Ų | 149.5 | 87% | 0.869 | 82% | 0.817 | S | S | * | * | trans | -134 | 149.9 | 178.2 | -166.8 | 137.2 | 0 | 0 | 0 | 107.8 | ||||
| 50 | S | 23.4 | Very low | 23.9 | Very low | 113 Ų | 113 | 150.6 Ų | 150.6 | 79% | 0.79 | 82% | 0.817 | S | S | * | * | trans | 120.1 | 151.3 | -177.9 | 65 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 51 | A | 23 | Very low | 23.9 | Very low | 90 Ų | 90 | 149.1 Ų | 149.1 | 74% | 0.744 | 81% | 0.814 | S | S | * | * | cis | -164.8 | 155.4 | -22.8 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 52 | F | 23.5 | Very low | 23.9 | Very low | 219 Ų | 219 | 152 Ų | 152 | 96% | 0.961 | 81% | 0.811 | S | S | * | * | trans | -153.3 | 153.2 | 153.4 | -134.6 | -92.8 | 0 | 0 | 0 | 111.8 | ||||
| 53 | R | 20.4 | Very low | 24.1 | Very low | 225 Ų | 225 | 153.2 Ų | 153.2 | 85% | 0.849 | 81% | 0.807 | S | S | * | * | trans | -134.9 | 131.8 | -161 | -173.2 | -178.4 | -167.1 | -173.3 | 5.7 | 112.7 | ||||
| 54 | S | 21.7 | Very low | 24.1 | Very low | 104 Ų | 104 | 153.6 Ų | 153.6 | 73% | 0.727 | 81% | 0.809 | S | S | * | * | trans | 60.3 | 127.9 | 153.5 | -167 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 55 | K | 22.6 | Very low | 24.3 | Very low | 206 Ų | 206 | 157.8 Ų | 157.8 | 90% | 0.896 | 81% | 0.813 | S | S | * | * | -157.8 | 136.7 | 123.5 | -107.7 | 177.4 | -176.9 | -176.5 | 0 | 111.6 | |||||
| 56 | V | 21.7 | Very low | 24.4 | Very low | 130 Ų | 130 | 152.9 Ų | 152.9 | 79% | 0.788 | 81% | 0.808 | S | S | * | * | trans | -151.4 | 150.1 | 178.3 | 175.7 | 0 | 0 | 0 | 0 | 103.3 | ||||
| 57 | P | 29.8 | Very low | 24.5 | Very low | 103 Ų | 103 | 152.4 Ų | 152.4 | 67% | 0.669 | 81% | 0.809 | S | S | * | * | cis | -125 | -152 | 28.9 | 47.8 | -32.6 | 0 | 0 | 0 | 112.2 | ||||
| 58 | T | 23.3 | Very low | 24.6 | Very low | 115 Ų | 115 | 148.5 Ų | 148.5 | 71% | 0.706 | 80% | 0.804 | S | S | * | * | cis | -149.9 | 168.9 | 1.6 | 23.2 | 0 | 0 | 0 | 0 | 107 | ||||
| 59 | D | 23.4 | Very low | 24.8 | Very low | 138 Ų | 138 | 150.8 Ų | 150.8 | 74% | 0.738 | 80% | 0.801 | S | S | * | * | cis | -171.4 | 148.8 | -29.9 | -94.9 | -0.2 | 0 | 0 | 0 | 107.1 | ||||
| 60 | E | 26.8 | Very low | 24.9 | Very low | 203 Ų | 203 | 151.1 Ų | 151.1 | 95% | 0.949 | 80% | 0.796 | S | S | * | * | trans | -175.8 | 150.7 | 144.9 | -105.1 | 179.1 | -178.8 | 0 | 0 | 112.2 | ||||
| 61 | E | 25.8 | Very low | 25.3 | Very low | 180 Ų | 180 | 152 Ų | 152 | 84% | 0.841 | 80% | 0.799 | S | S | * | * | trans | -75.8 | 167.4 | -166 | -68.9 | -176.8 | 102.7 | 0 | 0 | 114.1 | ||||
| 62 | L | 23.8 | Very low | 25.8 | Very low | 136 Ų | 136 | 153.5 Ų | 153.5 | 71% | 0.712 | 80% | 0.799 | S | S | * | * | -170.6 | 128.4 | 54.3 | -167.8 | 72.1 | 0 | 0 | 0 | 115.2 | |||||
| 63 | I | 26.3 | Very low | 25.9 | Very low | 134 Ų | 134 | 150 Ų | 150 | 69% | 0.687 | 79% | 0.791 | S | S | * | * | trans | 56.4 | 106.1 | 153.2 | -59.9 | 168.9 | 0 | 0 | 0 | 119.7 | K65 | I63-K65 HydrophobicContact CG2-CG 4.44Š| ||
| 64 | L | 23 | Very low | 26.6 | Very low | 178 Ų | 178 | 144.2 Ų | 144.2 | 93% | 0.932 | 79% | 0.79 | S | S | * | * | trans | -108.7 | 128 | 154.4 | -176.3 | 75.4 | 0 | 0 | 0 | 108.7 | ||||
| 65 | K | 26.3 | Very low | 27.2 | Very low | 197 Ų | 197 | 144.8 Ų | 144.8 | 86% | 0.857 | 79% | 0.79 | S | S | * | * | trans | -112.3 | 106.5 | 175.9 | -100.7 | -173.8 | 176.2 | 179.2 | 0 | 112.7 | I63 | I63-K65 HydrophobicContact CG2-CG 4.44Š| ||
| 66 | G | 25.6 | Very low | 27.5 | Very low | 71 Ų | 71 | 142.5 Ų | 142.5 | 73% | 0.732 | 79% | 0.787 | S | S | * | * | trans | 59.4 | 102.1 | 139.3 | 0 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 67 | I | 26.7 | Very low | 28.1 | Very low | 168 Ų | 168 | 143.9 Ų | 143.9 | 86% | 0.862 | 79% | 0.789 | S | S | * | * | trans | -97.2 | 136 | 153.5 | -61.1 | 168.9 | 0 | 0 | 0 | 108.6 | ||||
| 68 | P | 29.5 | Very low | 28.4 | Very low | 116 Ų | 116 | 148.3 Ų | 148.3 | 75% | 0.753 | 80% | 0.798 | S | S | * | * | trans | -118.7 | 119.6 | 139.1 | 32.8 | -23.5 | 0 | 0 | 0 | 109 | ||||
| 69 | F | 29.4 | Very low | 28.7 | Very low | 174 Ų | 174 | 146.2 Ų | 146.2 | 76% | 0.763 | 80% | 0.8 | S | S | * | * | 67.9 | 102.4 | 77 | -142.3 | -89 | 0 | 0 | 0 | 113.3 | |||||
| 70 | F | 27.5 | Very low | 29.1 | Very low | 173 Ų | 173 | 147.8 Ų | 147.8 | 76% | 0.759 | 81% | 0.809 | S | S | * | * | trans | 23.9 | 119.5 | 166.1 | -69.2 | -85.2 | 0 | 0 | 0 | 120.6 | T72 | F70-T72 PolarHBondContact O-N 3.47Š| ||
| 71 | P | 30.2 | Very low | 29.2 | Very low | 131 Ų | 131 | 149.1 Ų | 149.1 | 85% | 0.851 | 81% | 0.805 | S | S | * | * | trans | -79.1 | 116.9 | 162.5 | 31.9 | -30.4 | 0 | 0 | 0 | 111.4 | ||||
| 72 | T | 33.6 | Very low | 29.3 | Very low | 123 Ų | 123 | 146.1 Ų | 146.1 | 76% | 0.755 | 80% | 0.799 | S | S | * | * | trans | -89.7 | 106.1 | 158.9 | 50.4 | 0 | 0 | 0 | 0 | 109.4 | F70 | F70-T72 PolarHBondContact O-N 3.47Š| ||
| 73 | N | 26.4 | Very low | 29.6 | Very low | 146 Ų | 146 | 146.5 Ų | 146.5 | 78% | 0.781 | 81% | 0.807 | S | S | * | * | trans | 162.7 | 142.2 | 143.7 | -81.5 | -20.3 | 0 | 0 | 0 | 111.5 | T75 | N73-T75 PolarHBondContact O-N 3.28Š| ||
| 74 | A | 34.3 | Very low | 29.5 | Very low | 102 Ų | 102 | 149.3 Ų | 149.3 | 84% | 0.843 | 82% | 0.815 | S | S | * | * | S | Bend | trans | -102.2 | 48.7 | -166.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||
| 75 | T | 34.1 | Very low | 29.9 | Very low | 117 Ų | 117 | 152.2 Ų | 152.2 | 72% | 0.718 | 81% | 0.813 | S | S | * | * | trans | -127.6 | -5.2 | -176.8 | 42.2 | 0 | 0 | 0 | 0 | 116.4 | N73 L77 | N73-T75 PolarHBondContact O-N 3.28Å; T75-L77 VanDerWaalsContact C-N 3.32Å; T75-L77 PolarHBondContact O-N 3.01Å | ||
| 76 | D | 29.7 | Very low | 30 | Very low | 157 Ų | 157 | 149.3 Ų | 149.3 | 84% | 0.84 | 81% | 0.807 | S | S | * | * | trans | -87.8 | 6.8 | 176.5 | -73 | -25 | 0 | 0 | 0 | 114.1 | F78 | D76-F78 PolarHBondContact O-N 3.35Š| ||
| 77 | L | 34.8 | Very low | 30.5 | Very low | 159 Ų | 159 | 154.9 Ų | 154.9 | 83% | 0.832 | 81% | 0.814 | S | S | * | * | S | Bend | trans | -80.1 | 9.5 | -179.5 | -146.9 | 81.4 | 0 | 0 | 0 | 114.5 | T75 | T75-L77 VanDerWaalsContact C-N 3.32Å; T75-L77 PolarHBondContact O-N 3.01Å |
| 78 | F | 36.3 | Very low | 30.9 | Very low | 196 Ų | 196 | 150.7 Ų | 150.7 | 86% | 0.86 | 80% | 0.797 | S | S | * | * | trans | -127.6 | 65.5 | 173.9 | -83.4 | -80.5 | 0 | 0 | 0 | 111.2 | D76 N80 | D76-F78 PolarHBondContact O-N 3.35Å; F78-N80 VanDerWaalsContact C-N 3.3Å; F78-N80 PolarHBondContact O-N 3.14Å | ||
| 79 | G | 28.7 | Very low | 31.4 | Very low | 72 Ų | 72 | 153.4 Ų | 153.4 | 74% | 0.742 | 81% | 0.805 | S | S | * | * | trans | -68.8 | 80.2 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | R81 | G79-R81 PolarHBondContact O-N 3.43Å; G79-R81 VanDerWaalsContact O-N 3.12Å | ||
| 80 | N | 31.5 | Very low | 31.7 | Very low | 171 Ų | 171 | 151.3 Ų | 151.3 | 91% | 0.914 | 80% | 0.801 | S | S | * | * | trans | -61.1 | 109.8 | 170.4 | -160.7 | 9.2 | 0 | 0 | 0 | 109.1 | F78 | F78-N80 VanDerWaalsContact C-N 3.3Å; F78-N80 PolarHBondContact O-N 3.14Å | ||
| 81 | R | 30.4 | Very low | 32.5 | Very low | 230 Ų | 230 | 148.4 Ų | 148.4 | 87% | 0.868 | 79% | 0.793 | S | S | * | * | trans | -130 | 129.2 | -179.4 | -160.8 | 172.8 | -71.8 | -171.1 | 0.1 | 112 | G79 | G79-R81 PolarHBondContact O-N 3.43Å; G79-R81 VanDerWaalsContact O-N 3.12Å | ||
| 82 | T | 28.2 | Very low | 33 | Very low | 117 Ų | 117 | 150.6 Ų | 150.6 | 72% | 0.718 | 79% | 0.791 | S | S | * | * | trans | -61.4 | 143.4 | -172.1 | 42.4 | 0 | 0 | 0 | 0 | 114.1 | F84 | T82-F84 PolarHBondContact O-N 3.18Š| ||
| 83 | T | 28.6 | Very low | 34 | Very low | 144 Ų | 144 | 148 Ų | 148 | 88% | 0.883 | 78% | 0.778 | S | S | * | * | trans | -64.6 | 108.8 | 170.5 | 48.6 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 84 | F | 25.2 | Very low | 35 | Very low | 194 Ų | 194 | 142.5 Ų | 142.5 | 85% | 0.851 | 76% | 0.755 | S | S | * | * | trans | -90.6 | 128.6 | 155.3 | -99.2 | -98.8 | 0 | 0 | 0 | 108.5 | T82 | T82-F84 PolarHBondContact O-N 3.18Š| ||
| 85 | R | 30.3 | Very low | 35.9 | Very low | 239 Ų | 239 | 145.2 Ų | 145.2 | 90% | 0.902 | 75% | 0.75 | S | S | * | * | trans | -82.5 | 123.1 | 162.8 | -98.1 | -176.8 | 175.6 | 168.6 | -1.3 | 107.3 | ||||
| 86 | D | 29.9 | Very low | 36.5 | Very low | 135 Ų | 135 | 147.4 Ų | 147.4 | 72% | 0.722 | 76% | 0.758 | S | S | * | * | trans | -107.6 | 122.5 | 168.5 | -142.6 | -20.8 | 0 | 0 | 0 | 108 | T88 | D86-T88 PolarHBondContact O-N 3.01Å; D86-T88 VanDerWaalsContact O-N 3.08Å | ||
| 87 | E | 35.1 | Very low | 37.3 | Very low | 188 Ų | 188 | 147.5 Ų | 147.5 | 88% | 0.879 | 75% | 0.751 | S | S | * | * | trans | -87 | 54.9 | -176 | -71.5 | -166.8 | 144.5 | 0 | 0 | 111.5 | ||||
| 88 | T | 36 | Very low | 38.6 | Very low | 81 Ų | 81 | 143.6 Ų | 143.6 | 50% | 0.497 | 73% | 0.729 | S | S | . | * | S | Bend | trans | -126.4 | 139.8 | 169.8 | 56 | 0 | 0 | 0 | 0 | 110.6 | D86 N90 | D86-T88 PolarHBondContact O-N 3.01Å; D86-T88 VanDerWaalsContact O-N 3.08Å; T88-N90 PolarHBondContact O-N 3.37Å |
| 89 | N | 40.2 | Very low | 40.1 | Very low | 172 Ų | 172 | 136.7 Ų | 136.7 | 92% | 0.92 | 70% | 0.702 | S | S | * | * | trans | -74.2 | 41.5 | -178.5 | -72.7 | -24.6 | 0 | 0 | 0 | 113 | ||||
| 90 | N | 35.3 | Very low | 42.4 | Very low | 130 Ų | 130 | 134.3 Ų | 134.3 | 70% | 0.695 | 67% | 0.671 | S | S | * | * | trans | -81.7 | 117.9 | 168.3 | -75.1 | -23.5 | 0 | 0 | 0 | 108.2 | T88 Q92 | T88-N90 PolarHBondContact O-N 3.37Å; N90-Q92 VanDerWaalsContact C-N 3.32Å; N90-Q92 PolarHBondContact O-N 3.42Å | ||
| 91 | I | 44.4 | Very low | 44.6 | Very low | 112 Ų | 112 | 129.9 Ų | 129.9 | 57% | 0.574 | 65% | 0.645 | S | S | * | * | trans | -66.8 | 94.8 | 173 | -59.6 | 172.7 | 0 | 0 | 0 | 107.3 | C93 | I91-C93 PolarHBondContact O-N 3.26Š| ||
| 92 | Q | 40.2 | Very low | 47 | Very low | 177 Ų | 177 | 119.8 Ų | 119.8 | 83% | 0.827 | 61% | 0.61 | S | S | * | * | trans | -84.3 | 96.7 | -178.7 | -161.3 | 166.9 | 21.3 | 0 | 0 | 108.9 | N90 G94 | N90-Q92 VanDerWaalsContact C-N 3.32Å; N90-Q92 PolarHBondContact O-N 3.42Å; Q92-G94 PolarHBondContact O-N 3.37Å | ||
| 93 | C | 55.5 | Low | 49.6 | Very low | 69 Ų | 69 | 115.1 Ų | 115.1 | 47% | 0.466 | 58% | 0.58 | S | S | . | * | trans | -65.1 | 77.9 | 174.1 | -59.9 | 0 | 0 | 0 | 0 | 110.3 | I91 C102 | I91-C93 PolarHBondContact O-N 3.26Å; C93-C102 HydrophobicContact CB-CB 3.91Å; C93-C102 WeakPolarHBondContact CB-SG 3.49Å; C93-C102 WeakPolarHBondContact SG-CB 3.47Å; C93-C102 CovalentContact SG-SG 2.04Å; C93-C102 PolarHBondContact SG-SG 3.17Å | ||
| 94 | G | 46.5 | Very low | 52.2 | Low | 30 Ų | 30 | 109.4 Ų | 109.4 | 31% | 0.309 | 54% | 0.543 | S | S | . | . | trans | -97.7 | 153 | -175.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q92 N96 F97 | Q92-G94 PolarHBondContact O-N 3.37Å; G94-N96 PolarHBondContact O-N 2.92Å; G94-F97 PolarHBondContact O-N 3.26Å | ||
| 95 | E | 52.6 | Low | 55.1 | Low | 159 Ų | 159 | 102.5 Ų | 102.5 | 74% | 0.743 | 52% | 0.515 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.7 | -9.1 | -168.7 | -58.5 | -176.5 | 139.3 | 0 | 0 | 116 | K365 | E95-K365 IonicContact OE1-NZ 2.82Å; E95-K365 PolarHBondContact OE1-NZ 3.03Å |
| 96 | N | 46.8 | Very low | 57.9 | Low | 163 Ų | 163 | 91.6 Ų | 91.6 | 87% | 0.872 | 47% | 0.474 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -113 | -4.7 | -179.1 | -65.1 | -62.3 | 0 | 0 | 0 | 114.5 | G94 | G94-N96 PolarHBondContact O-N 2.92Š|
| 97 | F | 47.7 | Very low | 60.8 | Low | 159 Ų | 159 | 88.2 Ų | 88.2 | 70% | 0.697 | 46% | 0.459 | S | S | * | . | trans | -151.4 | 79.4 | 179.1 | -154.8 | -90.4 | 0 | 0 | 0 | 112.1 | G94 D99 | G94-F97 PolarHBondContact O-N 3.26Å; F97-D99 PolarHBondContact O-N 3.18Å | ||
| 98 | M | 60.5 | Low | 63.5 | Low | 77 Ų | 77 | 84.1 Ų | 84.1 | 38% | 0.379 | 45% | 0.448 | S | S | . | . | trans | -71 | 95.4 | 170 | -68.1 | -62.7 | -141.2 | 0 | 0 | 110.1 | F103 D261 | M98-F103 HydrophobicContact CB-CE2 4.29Å; M98-D261 WeakPolarHBondContact CE-OD1 3.47Å | ||
| 99 | D | 69.7 | Low | 66.2 | Low | 52 Ų | 52 | 84.5 Ų | 84.5 | 28% | 0.278 | 45% | 0.454 | S | S | . | . | trans | -73.8 | 147.8 | 164.8 | -161 | -6.4 | 0 | 0 | 0 | 109.4 | F97 E101 C102 K178 | F97-D99 PolarHBondContact O-N 3.18Å; D99-E101 PolarHBondContact O-N 3.38Å; D99-E101 VanDerWaalsContact O-N 3.12Å; D99-C102 WeakPolarHBondContact O-CB 3.33Å; D99-C102 PolarHBondContact O-N 3.44Å; D99-C102 VanDerWaalsContact O-N 3.09Å; D99-K178 IonicContact OD1-NZ 2.82Å; D99-K178 IonicContact OD2-NZ 2.62Å; D99-K178 PolarHBondContact OD2-NZ 3.41Å | ||
| 100 | M | 76.1 | Confident | 68.7 | Low | 21 Ų | 21 | 78.9 Ų | 78.9 | 10% | 0.103 | 42% | 0.422 | C | S | . | . | G | 310 helix | trans | -58.1 | -27.9 | -178.3 | -74.6 | -76.1 | -176.5 | 0 | 0 | 112.4 | C102 F103 M104 F172 F184 P264 L265 | M100-C102 PolarHBondContact O-N 3.49Å; M100-F103 PolarHBondContact O-N 3.19Å; M100-M104 VanDerWaalsContact O-CG 3.29Å; M100-M104 WeakPolarHBondContact O-CG 3.48Å; M100-F172 HydrophobicContact SD-CE2 4.04Å; M100-F184 HydrophobicContact CE-CB 3.89Å; M100-F184 HydrophobicContact CE-CD1 3.87Å; M100-F184 HydrophobicContact CE-CD2 3.9Å; M100-F184 HydrophobicContact CE-CE1 4.42Å; M100-F184 HydrophobicContact CE-CE2 4.44Å; M100-F184 HydrophobicContact CE-CG 3.58Å; M100-F184 HydrophobicContact SD-CD2 4.21Å; M100-F184 HydrophobicContact SD-CE2 4.35Å; M100-F184 HydrophobicContact SD-CG 4.47Å; M100-P264 HydrophobicContact CE-CB 3.68Å; M100-P264 HydrophobicContact CE-CG 4.5Å; M100-P264 HydrophobicContact SD-CB 3.39Å; M100-P264 WeakPolarHBondContact SD-CB 3.43Å; M100-P264 HydrophobicContact SD-CG 3.66Å; M100-L265 HydrophobicContact CE-CD1 3.55Å; M100-L265 HydrophobicContact CE-CG 4.13Å |
| 101 | E | 77.8 | Confident | 71.4 | Confident | 78 Ų | 78 | 74.4 Ų | 74.4 | 36% | 0.364 | 40% | 0.397 | S | S | . | . | G | 310 helix | trans | -60.5 | -28.3 | 177.5 | -74 | 177.4 | 158.3 | 0 | 0 | 113.5 | D99 F103 M104 K178 | D99-E101 PolarHBondContact O-N 3.38Å; D99-E101 VanDerWaalsContact O-N 3.12Å; E101-F103 PolarHBondContact O-N 3.33Å; E101-F103 VanDerWaalsContact O-N 3.08Å; E101-M104 HydrophobicContact CG-SD 4.35Å; E101-M104 WeakPolarHBondContact O-CB 3.47Å; E101-M104 PolarHBondContact O-N 3.02Å; E101-K178 WeakPolarHBondContact OE1-CE 3.34Å; E101-K178 IonicContact OE1-NZ 2.64Å; E101-K178 PolarHBondContact OE1-NZ 3.45Å; E101-K178 IonicContact OE2-NZ 3.15Å; E101-K178 PolarHBondContact OE2-NZ 2.78Å |
| 102 | C | 80.6 | Confident | 73.8 | Confident | 18 Ų | 18 | 74.7 Ų | 74.7 | 12% | 0.122 | 40% | 0.399 | C | S | . | . | G | 310 helix | trans | -64.4 | -13.5 | 178.5 | -67 | 0 | 0 | 0 | 0 | 114.2 | C93 D99 M100 | C93-C102 HydrophobicContact CB-CB 3.91Å; C93-C102 WeakPolarHBondContact CB-SG 3.49Å; C93-C102 WeakPolarHBondContact SG-CB 3.47Å; C93-C102 CovalentContact SG-SG 2.04Å; C93-C102 PolarHBondContact SG-SG 3.17Å; D99-C102 WeakPolarHBondContact O-CB 3.33Å; D99-C102 PolarHBondContact O-N 3.44Å; D99-C102 VanDerWaalsContact O-N 3.09Å; M100-C102 PolarHBondContact O-N 3.49Å |
| 103 | F | 82 | Confident | 76.4 | Confident | 20 Ų | 20 | 68.3 Ų | 68.3 | 9% | 0.088 | 38% | 0.377 | C | S | . | . | G | 310 helix | trans | -102.3 | 0.2 | 178.9 | -58.3 | -103.5 | 0 | 0 | 0 | 111.9 | M98 M100 E101 I105 F172 D261 P264 | M98-F103 HydrophobicContact CB-CE2 4.29Å; M100-F103 PolarHBondContact O-N 3.19Å; E101-F103 PolarHBondContact O-N 3.33Å; E101-F103 VanDerWaalsContact O-N 3.08Å; F103-I105 PolarHBondContact O-N 3.49Å; F103-F172 HydrophobicContact CB-CE1 4.16Å; F103-F172 HydrophobicContact CB-CZ 3.9Å; F103-D261 WeakPolarHBondContact CD1-O 3.39Å; F103-D261 WeakPolarHBondContact CE1-O 3.41Å; F103-P264 HydrophobicContact CB-CG 4.34Å; F103-P264 HydrophobicContact CD1-CG 3.72Å; F103-P264 HydrophobicContact CD2-CB 4.45Å; F103-P264 HydrophobicContact CD2-CG 3.72Å; F103-P264 HydrophobicContact CE1-CG 3.83Å; F103-P264 HydrophobicContact CE2-CB 4.17Å; F103-P264 HydrophobicContact CE2-CG 3.85Å; F103-P264 HydrophobicContact CG-CG 3.67Å; F103-P264 HydrophobicContact CZ-CB 4.2Å; F103-P264 HydrophobicContact CZ-CG 3.91Å |
| 104 | M | 83.8 | Confident | 78.1 | Confident | 24 Ų | 24 | 65 Ų | 65 | 12% | 0.118 | 36% | 0.355 | C | S | . | . | trans | -101.1 | 49 | -169.7 | -46.2 | -164.6 | 89.3 | 0 | 0 | 111.9 | M100 E101 L106 F172 H176 | M100-M104 VanDerWaalsContact O-CG 3.29Å; M100-M104 WeakPolarHBondContact O-CG 3.48Å; E101-M104 HydrophobicContact CG-SD 4.35Å; E101-M104 WeakPolarHBondContact O-CB 3.47Å; E101-M104 PolarHBondContact O-N 3.02Å; M104-L106 PolarHBondContact O-N 3.21Å; M104-F172 HydrophobicContact CE-CD1 4.22Å; M104-F172 HydrophobicContact CE-CD2 4.13Å; M104-F172 HydrophobicContact CE-CE1 4.37Å; M104-F172 HydrophobicContact CE-CE2 4.28Å; M104-F172 HydrophobicContact CE-CG 4.11Å; M104-F172 HydrophobicContact CE-CZ 4.41Å; M104-F172 WeakPolarHBondContact CE-O 3.22Å; M104-F172 HydrophobicContact CG-CE1 4.4Å; M104-F172 HydrophobicContact CG-CZ 4.3Å; M104-H176 HydrophobicContact CE-CB 4.23Å | ||
| 105 | I | 85.8 | Confident | 80.4 | Confident | 49 Ų | 49 | 64.3 Ų | 64.3 | 25% | 0.251 | 35% | 0.345 | S | S | . | . | trans | -85.2 | -4.9 | -164.9 | 60.7 | 164 | 0 | 0 | 0 | 115.5 | F103 D368 K371 T372 | F103-I105 PolarHBondContact O-N 3.49Å; I105-D368 HydrophobicContact CD1-CB 3.88Å; I105-D368 WeakPolarHBondContact CD1-O 3.42Å; I105-K371 HydrophobicContact CD1-CB 3.42Å; I105-K371 VanDerWaalsContact CD1-CB 3.42Å; I105-K371 HydrophobicContact CD1-CD 4.26Å; I105-K371 HydrophobicContact CD1-CG 4.47Å; I105-K371 HydrophobicContact CG1-CB 4.49Å; I105-T372 VanDerWaalsContact CD1-OG1 3.31Å; I105-T372 WeakPolarHBondContact CD1-OG1 3.4Å | ||
| 106 | L | 88.8 | Confident | 82.4 | Confident | 9 Ų | 9 | 60.5 Ų | 60.5 | 5% | 0.047 | 33% | 0.333 | C | S | . | . | trans | -70.8 | 134.8 | -173.9 | -68.2 | 98 | 0 | 0 | 0 | 111.6 | M104 Q110 Q111 V114 H173 A375 | M104-L106 PolarHBondContact O-N 3.21Å; L106-Q110 HydrophobicContact CB-CB 4.26Å; L106-Q110 HydrophobicContact CD2-CB 4.07Å; L106-Q111 HydrophobicContact CB-CG 3.8Å; L106-Q111 PolarHBondContact O-NE2 3.05Å; L106-V114 HydrophobicContact CD2-CG2 4.06Å; L106-H173 HydrophobicContact CD1-CB 4.24Å; L106-H173 WeakPolarHBondContact CD1-CD2 3.44Å; L106-A375 HydrophobicContact CD1-CB 4.14Å; L106-A375 HydrophobicContact CD2-CB 4.06Å; L106-A375 HydrophobicContact CG-CB 4.49Å | ||
| 107 | T | 90.8 | Very high | 84.7 | Confident | 65 Ų | 65 | 56.2 Ų | 56.2 | 40% | 0.399 | 31% | 0.309 | S | S | . | . | trans | -69.9 | 156.5 | 172.2 | 63 | 0 | 0 | 0 | 0 | 111.9 | S109 Q110 Q111 | T107-S109 PolarHBondContact O-N 3.06Å; T107-S109 VanDerWaalsContact O-N 3.1Å; T107-S109 PolarHBondContact OG1-OG 3.4Å; T107-Q110 WeakPolarHBondContact O-CA 3.29Å; T107-Q110 WeakPolarHBondContact O-CB 3.3Å; T107-Q110 PolarHBondContact O-N 2.7Å; T107-Q110 VanDerWaalsContact OG1-CG 3.31Å; T107-Q110 WeakPolarHBondContact OG1-CG 3.32Å; T107-Q110 PolarHBondContact OG1-OE1 3.39Å; T107-Q111 WeakPolarHBondContact O-CG 3.21Å; T107-Q111 PolarHBondContact O-N 3.05Å | ||
| 108 | P | 91.7 | Very high | 86.9 | Confident | 102 Ų | 102 | 48.6 Ų | 48.6 | 66% | 0.662 | 28% | 0.275 | S | S | * | . | H | α-helix | trans | -55.8 | -32.4 | -176.5 | -28.6 | 36.2 | 0 | 0 | 0 | 115.4 | L112 | P108-L112 WeakPolarHBondContact O-CB 3.39Å; P108-L112 PolarHBondContact O-N 2.72Å |
| 109 | S | 92.6 | Very high | 88.5 | Confident | 88 Ų | 88 | 49.1 Ų | 49.1 | 62% | 0.615 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -71.4 | -39.2 | 175.7 | 54.4 | 0 | 0 | 0 | 0 | 112.3 | T107 A113 | T107-S109 PolarHBondContact O-N 3.06Å; T107-S109 VanDerWaalsContact O-N 3.1Å; T107-S109 PolarHBondContact OG1-OG 3.4Å; S109-A113 WeakPolarHBondContact O-CB 3.39Å; S109-A113 PolarHBondContact O-N 2.91Å |
| 110 | Q | 93.1 | Very high | 89.7 | Confident | 54 Ų | 54 | 50.6 Ų | 50.6 | 25% | 0.252 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -68.6 | -43.1 | 173.6 | -65.7 | 162.4 | -32.5 | 0 | 0 | 110.9 | L106 T107 L112 A113 V114 F376 | L106-Q110 HydrophobicContact CB-CB 4.26Å; L106-Q110 HydrophobicContact CD2-CB 4.07Å; T107-Q110 WeakPolarHBondContact O-CA 3.29Å; T107-Q110 WeakPolarHBondContact O-CB 3.3Å; T107-Q110 PolarHBondContact O-N 2.7Å; T107-Q110 VanDerWaalsContact OG1-CG 3.31Å; T107-Q110 WeakPolarHBondContact OG1-CG 3.32Å; T107-Q110 PolarHBondContact OG1-OE1 3.39Å; Q110-L112 VanDerWaalsContact C-N 3.33Å; Q110-L112 PolarHBondContact O-N 3.31Å; Q110-A113 PolarHBondContact O-N 3.14Å; Q110-V114 WeakPolarHBondContact O-CB 3.38Å; Q110-V114 VanDerWaalsContact O-CG2 3.24Å; Q110-V114 WeakPolarHBondContact O-CG2 3.46Å; Q110-V114 PolarHBondContact O-N 2.89Å; Q110-F376 HydrophobicContact CB-CE2 4.31Å; Q110-F376 HydrophobicContact CB-CZ 4.03Å; Q110-F376 HydrophobicContact CG-CE2 4.23Å; Q110-F376 HydrophobicContact CG-CZ 4.09Å |
| 111 | Q | 93.3 | Very high | 90.6 | Very high | 36 Ų | 36 | 51.4 Ų | 51.4 | 17% | 0.168 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -54.8 | -48.3 | 174.1 | -66.7 | 175.7 | 13.8 | 0 | 0 | 111.1 | L106 T107 V114 A115 H176 | L106-Q111 HydrophobicContact CB-CG 3.8Å; L106-Q111 PolarHBondContact O-NE2 3.05Å; T107-Q111 WeakPolarHBondContact O-CG 3.21Å; T107-Q111 PolarHBondContact O-N 3.05Å; Q111-V114 PolarHBondContact O-N 3.42Å; Q111-A115 VanDerWaalsContact O-CB 3.23Å; Q111-A115 WeakPolarHBondContact O-CB 3.33Å; Q111-A115 PolarHBondContact O-N 3.27Å; Q111-H176 PolarHBondContact NE2-CE1 2.72Å; Q111-H176 VanDerWaalsContact NE2-CE1 3.27Å; Q111-H176 PolarHBondContact NE2-NE2 2.74Å |
| 112 | L | 94 | Very high | 91.4 | Very high | 118 Ų | 118 | 47.9 Ų | 47.9 | 62% | 0.618 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -61.2 | -46.8 | 176.1 | 178.2 | 62.1 | 0 | 0 | 0 | 112.2 | P108 Q110 V114 A115 V116 | P108-L112 WeakPolarHBondContact O-CB 3.39Å; P108-L112 PolarHBondContact O-N 2.72Å; Q110-L112 VanDerWaalsContact C-N 3.33Å; Q110-L112 PolarHBondContact O-N 3.31Å; L112-V114 PolarHBondContact O-N 3.36Å; L112-A115 PolarHBondContact O-N 3.3Å; L112-V116 HydrophobicContact CD1-CG2 4.19Å; L112-V116 WeakPolarHBondContact O-CG2 3.37Å; L112-V116 PolarHBondContact O-N 3.02Å |
| 113 | A | 94.1 | Very high | 92.1 | Very high | 43 Ų | 43 | 50.9 Ų | 50.9 | 36% | 0.355 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -60.1 | -46.9 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | S109 Q110 V116 M117 | S109-A113 WeakPolarHBondContact O-CB 3.39Å; S109-A113 PolarHBondContact O-N 2.91Å; Q110-A113 PolarHBondContact O-N 3.14Å; A113-V116 PolarHBondContact O-N 3.04Å; A113-M117 WeakPolarHBondContact O-CB 3.31Å; A113-M117 WeakPolarHBondContact O-CG 3.25Å; A113-M117 PolarHBondContact O-N 2.89Å |
| 114 | V | 92.3 | Very high | 92.7 | Very high | 1 Ų | 1 | 54.3 Ų | 54.3 | 1% | 0.006 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -69.6 | -33.5 | -179.7 | -178.7 | 0 | 0 | 0 | 0 | 111.5 | L106 Q110 Q111 L112 M117 S118 F169 F376 M379 | L106-V114 HydrophobicContact CD2-CG2 4.06Å; Q110-V114 WeakPolarHBondContact O-CB 3.38Å; Q110-V114 VanDerWaalsContact O-CG2 3.24Å; Q110-V114 WeakPolarHBondContact O-CG2 3.46Å; Q110-V114 PolarHBondContact O-N 2.89Å; Q111-V114 PolarHBondContact O-N 3.42Å; L112-V114 PolarHBondContact O-N 3.36Å; V114-M117 HydrophobicContact CG2-CE 4.13Å; V114-S118 VanDerWaalsContact O-CB 3.32Å; V114-S118 WeakPolarHBondContact O-CB 3.28Å; V114-S118 PolarHBondContact O-N 3.16Å; V114-S118 PolarHBondContact O-OG 3.34Å; V114-F169 HydrophobicContact CG1-CD1 4.11Å; V114-F169 HydrophobicContact CG1-CE1 3.23Å; V114-F169 HydrophobicContact CG1-CZ 3.76Å; V114-F376 HydrophobicContact CG2-CD1 3.84Å; V114-F376 HydrophobicContact CG2-CE1 3.39Å; V114-F376 HydrophobicContact CG2-CE2 4.24Å; V114-F376 HydrophobicContact CG2-CG 4.44Å; V114-F376 HydrophobicContact CG2-CZ 3.6Å; V114-M379 HydrophobicContact CG1-CE 3.54Å |
| 115 | A | 94.4 | Very high | 93.3 | Very high | 14 Ų | 14 | 53.2 Ų | 53.2 | 12% | 0.116 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -63.4 | -48.4 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q111 L112 S118 L119 L170 V174 | Q111-A115 VanDerWaalsContact O-CB 3.23Å; Q111-A115 WeakPolarHBondContact O-CB 3.33Å; Q111-A115 PolarHBondContact O-N 3.27Å; L112-A115 PolarHBondContact O-N 3.3Å; A115-S118 PolarHBondContact O-OG 3.01Å; A115-S118 VanDerWaalsContact O-OG 3.1Å; A115-L119 WeakPolarHBondContact O-CB 3.4Å; A115-L119 VanDerWaalsContact O-CG 3.31Å; A115-L119 WeakPolarHBondContact O-CG 3.35Å; A115-L119 PolarHBondContact O-N 3.3Å; A115-L170 HydrophobicContact CB-CD2 3.83Å; A115-V174 HydrophobicContact CB-CG2 4.02Å |
| 116 | V | 95.4 | Very high | 93.7 | Very high | 79 Ų | 79 | 52.5 Ų | 52.5 | 48% | 0.479 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -63.1 | -44.5 | 178.1 | 172 | 0 | 0 | 0 | 0 | 111 | L112 A113 T120 | L112-V116 HydrophobicContact CD1-CG2 4.19Å; L112-V116 WeakPolarHBondContact O-CG2 3.37Å; L112-V116 PolarHBondContact O-N 3.02Å; A113-V116 PolarHBondContact O-N 3.04Å; V116-T120 HydrophobicContact CG1-CG2 4.43Å; V116-T120 WeakPolarHBondContact O-CB 3.41Å; V116-T120 VanDerWaalsContact O-CG2 3.3Å; V116-T120 WeakPolarHBondContact O-CG2 3.45Å; V116-T120 PolarHBondContact O-N 3.48Å; V116-T120 PolarHBondContact O-OG1 3.36Å |
| 117 | M | 93.5 | Very high | 94.1 | Very high | 73 Ų | 73 | 57.3 Ų | 57.3 | 36% | 0.36 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -64.1 | -47.7 | 178 | -72.2 | -173.2 | -62.1 | 0 | 0 | 112.7 | A113 V114 T120 L121 F376 | A113-M117 WeakPolarHBondContact O-CB 3.31Å; A113-M117 WeakPolarHBondContact O-CG 3.25Å; A113-M117 PolarHBondContact O-N 2.89Å; V114-M117 HydrophobicContact CG2-CE 4.13Å; M117-T120 PolarHBondContact O-N 3.04Å; M117-T120 PolarHBondContact O-OG1 2.99Å; M117-L121 WeakPolarHBondContact O-CB 3.48Å; M117-L121 PolarHBondContact O-N 2.7Å; M117-F376 HydrophobicContact CE-CD1 3.72Å; M117-F376 HydrophobicContact CE-CE1 3.66Å |
| 118 | S | 94 | Very high | 94.2 | Very high | 0 Ų | 0 | 56.3 Ų | 56.3 | 0% | 0 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -65 | -41.6 | -180 | 54.6 | 0 | 0 | 0 | 0 | 112.6 | V114 A115 G122 V166 L170 | V114-S118 VanDerWaalsContact O-CB 3.32Å; V114-S118 WeakPolarHBondContact O-CB 3.28Å; V114-S118 PolarHBondContact O-N 3.16Å; V114-S118 PolarHBondContact O-OG 3.34Å; A115-S118 PolarHBondContact O-OG 3.01Å; A115-S118 VanDerWaalsContact O-OG 3.1Å; S118-G122 VanDerWaalsContact O-CA 3.24Å; S118-G122 WeakPolarHBondContact O-CA 3.37Å; S118-G122 PolarHBondContact O-N 3.37Å; S118-V166 WeakPolarHBondContact O-CG2 3.39Å; S118-L170 WeakPolarHBondContact OG-CD2 3.39Å |
| 119 | L | 95.4 | Very high | 94.4 | Very high | 87 Ų | 87 | 51.6 Ų | 51.6 | 46% | 0.455 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -65.5 | -46.9 | 176.4 | -73 | 171 | 0 | 0 | 0 | 112.1 | A115 T123 V166 L170 | A115-L119 WeakPolarHBondContact O-CB 3.4Å; A115-L119 VanDerWaalsContact O-CG 3.31Å; A115-L119 WeakPolarHBondContact O-CG 3.35Å; A115-L119 PolarHBondContact O-N 3.3Å; L119-T123 WeakPolarHBondContact O-CB 3.37Å; L119-T123 VanDerWaalsContact O-CG2 3.26Å; L119-T123 WeakPolarHBondContact O-CG2 3.2Å; L119-T123 PolarHBondContact O-N 3.34Å; L119-T123 PolarHBondContact O-OG1 3.37Å; L119-V166 HydrophobicContact CD2-CG1 4.18Å; L119-L170 HydrophobicContact CD1-CD1 4.5Å; L119-L170 HydrophobicContact CD2-CD1 3.59Å; L119-L170 HydrophobicContact CG-CD1 3.88Å |
| 120 | T | 94.4 | Very high | 94.5 | Very high | 84 Ų | 84 | 51.2 Ų | 51.2 | 52% | 0.515 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -69.1 | -49.7 | -178.7 | 52.1 | 0 | 0 | 0 | 0 | 112.4 | V116 M117 T123 F124 | V116-T120 HydrophobicContact CG1-CG2 4.43Å; V116-T120 WeakPolarHBondContact O-CB 3.41Å; V116-T120 VanDerWaalsContact O-CG2 3.3Å; V116-T120 WeakPolarHBondContact O-CG2 3.45Å; V116-T120 PolarHBondContact O-N 3.48Å; V116-T120 PolarHBondContact O-OG1 3.36Å; M117-T120 PolarHBondContact O-N 3.04Å; M117-T120 PolarHBondContact O-OG1 2.99Å; T120-T123 PolarHBondContact O-OG1 3.42Å; T120-T123 VanDerWaalsContact O-OG1 3.12Å; T120-F124 VanDerWaalsContact O-CB 3.31Å; T120-F124 WeakPolarHBondContact O-CB 3.33Å; T120-F124 PolarHBondContact O-N 2.94Å; T120-F124 VanDerWaalsContact O-N 3.13Å |
| 121 | L | 94.1 | Very high | 94.5 | Very high | 38 Ų | 38 | 51.9 Ų | 51.9 | 20% | 0.199 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -69.1 | -36 | 179.4 | -169.2 | 62 | 0 | 0 | 0 | 111.6 | M117 T125 L382 L383 T386 | M117-L121 WeakPolarHBondContact O-CB 3.48Å; M117-L121 PolarHBondContact O-N 2.7Å; L121-T125 VanDerWaalsContact O-CB 3.32Å; L121-T125 WeakPolarHBondContact O-CB 3.3Å; L121-T125 PolarHBondContact O-N 2.97Å; L121-T125 PolarHBondContact O-OG1 3.35Å; L121-L382 HydrophobicContact CB-CD2 4.39Å; L121-L382 HydrophobicContact CD2-CB 3.75Å; L121-L382 HydrophobicContact CG-CB 4.07Å; L121-L382 HydrophobicContact CG-CD2 4.49Å; L121-L383 HydrophobicContact CD1-CD1 4.37Å; L121-L383 HydrophobicContact CD2-CB 4.25Å; L121-T386 HydrophobicContact CD1-CG2 4.2Å; L121-T386 WeakPolarHBondContact CD1-OG1 3.45Å |
| 122 | G | 95.3 | Very high | 94.5 | Very high | 3 Ų | 3 | 50.9 Ų | 50.9 | 3% | 0.031 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -65.3 | -53.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | S118 F124 T125 V126 | S118-G122 VanDerWaalsContact O-CA 3.24Å; S118-G122 WeakPolarHBondContact O-CA 3.37Å; S118-G122 PolarHBondContact O-N 3.37Å; G122-F124 VanDerWaalsContact C-N 3.3Å; G122-F124 PolarHBondContact O-N 2.91Å; G122-T125 WeakPolarHBondContact O-CB 3.3Å; G122-T125 PolarHBondContact O-N 2.95Å; G122-V126 WeakPolarHBondContact O-CG2 3.47Å; G122-V126 PolarHBondContact O-N 3.03Å |
| 123 | T | 94.6 | Very high | 94.5 | Very high | 82 Ų | 82 | 46.8 Ų | 46.8 | 50% | 0.503 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -59.1 | -41.7 | 176.7 | 49.6 | 0 | 0 | 0 | 0 | 111.8 | L119 T120 V126 L127 | L119-T123 WeakPolarHBondContact O-CB 3.37Å; L119-T123 VanDerWaalsContact O-CG2 3.26Å; L119-T123 WeakPolarHBondContact O-CG2 3.2Å; L119-T123 PolarHBondContact O-N 3.34Å; L119-T123 PolarHBondContact O-OG1 3.37Å; T120-T123 PolarHBondContact O-OG1 3.42Å; T120-T123 VanDerWaalsContact O-OG1 3.12Å; T123-V126 PolarHBondContact O-N 3.22Å; T123-L127 WeakPolarHBondContact O-CB 3.34Å; T123-L127 VanDerWaalsContact O-CG 3.27Å; T123-L127 WeakPolarHBondContact O-CG 3.38Å; T123-L127 PolarHBondContact O-N 3.43Å |
| 124 | F | 95.3 | Very high | 94.5 | Very high | 92 Ų | 92 | 47.7 Ų | 47.7 | 40% | 0.404 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -62 | -46.7 | 174.7 | -170.4 | -103.6 | 0 | 0 | 0 | 112.3 | T120 G122 V126 L127 E128 T386 | T120-F124 VanDerWaalsContact O-CB 3.31Å; T120-F124 WeakPolarHBondContact O-CB 3.33Å; T120-F124 PolarHBondContact O-N 2.94Å; T120-F124 VanDerWaalsContact O-N 3.13Å; G122-F124 VanDerWaalsContact C-N 3.3Å; G122-F124 PolarHBondContact O-N 2.91Å; F124-V126 VanDerWaalsContact C-N 3.35Å; F124-V126 PolarHBondContact O-N 2.94Å; F124-L127 PolarHBondContact O-N 3.23Å; F124-E128 HydrophobicContact CD1-CG 4.36Å; F124-E128 HydrophobicContact CE1-CG 3.98Å; F124-E128 WeakPolarHBondContact CE1-OE2 3.34Å; F124-E128 HydrophobicContact CE2-CG 4.33Å; F124-E128 HydrophobicContact CZ-CG 3.96Å; F124-E128 VanDerWaalsContact CZ-OE1 3.26Å; F124-E128 WeakPolarHBondContact CZ-OE1 3.5Å; F124-E128 PolarHBondContact O-N 3.19Å; F124-T386 HydrophobicContact CD1-CG2 3.55Å; F124-T386 HydrophobicContact CE1-CG2 3.63Å |
| 125 | T | 95.6 | Very high | 94.5 | Very high | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -57.4 | -44.7 | 176 | -60.1 | 0 | 0 | 0 | 0 | 112.3 | L121 G122 N129 T386 | L121-T125 VanDerWaalsContact O-CB 3.32Å; L121-T125 WeakPolarHBondContact O-CB 3.3Å; L121-T125 PolarHBondContact O-N 2.97Å; L121-T125 PolarHBondContact O-OG1 3.35Å; G122-T125 WeakPolarHBondContact O-CB 3.3Å; G122-T125 PolarHBondContact O-N 2.95Å; T125-N129 WeakPolarHBondContact O-CB 3.19Å; T125-N129 PolarHBondContact O-N 2.89Å; T125-N129 PolarHBondContact O-ND2 2.93Å; T125-T386 PolarHBondContact OG1-OG1 3Å |
| 126 | V | 96.2 | Very high | 94.4 | Very high | 35 Ų | 35 | 47.8 Ų | 47.8 | 21% | 0.212 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -63.9 | -46.8 | 178.4 | 171.1 | 0 | 0 | 0 | 0 | 110.7 | G122 T123 F124 L130 S162 V163 | G122-V126 WeakPolarHBondContact O-CG2 3.47Å; G122-V126 PolarHBondContact O-N 3.03Å; T123-V126 PolarHBondContact O-N 3.22Å; F124-V126 VanDerWaalsContact C-N 3.35Å; F124-V126 PolarHBondContact O-N 2.94Å; V126-L130 WeakPolarHBondContact O-CB 3.32Å; V126-L130 PolarHBondContact O-N 3.14Å; V126-S162 WeakPolarHBondContact CG2-OG 3.45Å; V126-V163 HydrophobicContact CG2-CG2 3.62Å |
| 127 | L | 95.3 | Very high | 94.2 | Very high | 110 Ų | 110 | 48.7 Ų | 48.7 | 58% | 0.576 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -62.4 | -47.2 | 179.9 | -71.2 | 170.8 | 0 | 0 | 0 | 112.1 | T123 F124 L130 V131 | T123-L127 WeakPolarHBondContact O-CB 3.34Å; T123-L127 VanDerWaalsContact O-CG 3.27Å; T123-L127 WeakPolarHBondContact O-CG 3.38Å; T123-L127 PolarHBondContact O-N 3.43Å; F124-L127 PolarHBondContact O-N 3.23Å; L127-L130 PolarHBondContact O-N 2.97Å; L127-V131 WeakPolarHBondContact O-CG2 3.11Å; L127-V131 PolarHBondContact O-N 3.05Å |
| 128 | E | 94.1 | Very high | 94 | Very high | 44 Ų | 44 | 51.5 Ų | 51.5 | 21% | 0.206 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -65.2 | -45.4 | 180 | -70.7 | -163.6 | 128.3 | 0 | 0 | 112.5 | F124 V131 V132 P389 | F124-E128 HydrophobicContact CD1-CG 4.36Å; F124-E128 HydrophobicContact CE1-CG 3.98Å; F124-E128 WeakPolarHBondContact CE1-OE2 3.34Å; F124-E128 HydrophobicContact CE2-CG 4.33Å; F124-E128 HydrophobicContact CZ-CG 3.96Å; F124-E128 VanDerWaalsContact CZ-OE1 3.26Å; F124-E128 WeakPolarHBondContact CZ-OE1 3.5Å; F124-E128 PolarHBondContact O-N 3.19Å; E128-V131 PolarHBondContact O-N 3.23Å; E128-V132 WeakPolarHBondContact O-CG2 3.28Å; E128-V132 PolarHBondContact O-N 2.99Å; E128-P389 HydrophobicContact CB-CB 3.9Å; E128-P389 HydrophobicContact CB-CG 3.93Å |
| 129 | N | 95.4 | Very high | 93.8 | Very high | 3 Ų | 3 | 52.7 Ų | 52.7 | 2% | 0.016 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -69.1 | -35.1 | 179.1 | -77.7 | -73.1 | 0 | 0 | 0 | 112.3 | T125 V132 L133 A155 L159 S385 P389 | T125-N129 WeakPolarHBondContact O-CB 3.19Å; T125-N129 PolarHBondContact O-N 2.89Å; T125-N129 PolarHBondContact O-ND2 2.93Å; N129-V132 PolarHBondContact O-N 2.95Å; N129-L133 WeakPolarHBondContact O-CB 3.44Å; N129-L133 PolarHBondContact O-N 2.94Å; N129-A155 HydrophobicContact CB-CB 4.42Å; N129-A155 WeakPolarHBondContact OD1-CA 3.45Å; N129-L159 HydrophobicContact CB-CB 4.31Å; N129-S385 PolarHBondContact ND2-O 3.25Å; N129-S385 VanDerWaalsContact ND2-O 3.08Å; N129-P389 VanDerWaalsContact OD1-CG 3.29Å; N129-P389 WeakPolarHBondContact OD1-CG 3.32Å |
| 130 | L | 95.3 | Very high | 93.3 | Very high | 79 Ų | 79 | 57.7 Ų | 57.7 | 41% | 0.414 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -62.7 | -43.3 | 172.4 | -178 | 62.2 | 0 | 0 | 0 | 111.5 | V126 L127 L133 C134 L159 | V126-L130 WeakPolarHBondContact O-CB 3.32Å; V126-L130 PolarHBondContact O-N 3.14Å; L127-L130 PolarHBondContact O-N 2.97Å; L130-L133 PolarHBondContact O-N 2.89Å; L130-C134 WeakPolarHBondContact O-CB 3.19Å; L130-C134 PolarHBondContact O-N 3.14Å; L130-C134 PolarHBondContact O-SG 3.46Å; L130-L159 HydrophobicContact CB-CD1 4.04Å; L130-L159 HydrophobicContact CD1-CD1 4.24Å |
| 131 | V | 93.3 | Very high | 93 | Very high | 69 Ų | 69 | 58.5 Ų | 58.5 | 42% | 0.418 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -61.4 | -46.1 | 175.1 | 167.2 | 0 | 0 | 0 | 0 | 111.3 | L127 E128 L133 C134 V135 F403 | L127-V131 WeakPolarHBondContact O-CG2 3.11Å; L127-V131 PolarHBondContact O-N 3.05Å; E128-V131 PolarHBondContact O-N 3.23Å; V131-L133 VanDerWaalsContact C-N 3.34Å; V131-L133 PolarHBondContact O-N 3.08Å; V131-C134 PolarHBondContact O-N 2.87Å; V131-V135 WeakPolarHBondContact O-CG2 3.5Å; V131-V135 PolarHBondContact O-N 3.47Å; V131-F403 HydrophobicContact CG1-CD2 3.89Å; V131-F403 HydrophobicContact CG1-CE2 3.68Å |
| 132 | V | 93.4 | Very high | 92.7 | Very high | 14 Ų | 14 | 56.9 Ų | 56.9 | 9% | 0.085 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -58.1 | -46.7 | 175.9 | 169.9 | 0 | 0 | 0 | 0 | 111 | E128 N129 V135 I136 I151 A155 P389 | E128-V132 WeakPolarHBondContact O-CG2 3.28Å; E128-V132 PolarHBondContact O-N 2.99Å; N129-V132 PolarHBondContact O-N 2.95Å; V132-V135 PolarHBondContact O-N 3.45Å; V132-I136 HydrophobicContact CG1-CD1 3.8Å; V132-I136 VanDerWaalsContact O-CG1 3.3Å; V132-I136 WeakPolarHBondContact O-CG1 3.4Å; V132-I136 PolarHBondContact O-N 3.39Å; V132-I151 HydrophobicContact CG1-CG2 4.2Å; V132-A155 HydrophobicContact CG1-CB 4.11Å; V132-P389 HydrophobicContact CG2-CB 3.89Å; V132-P389 HydrophobicContact CG2-CG 4.33Å |
| 133 | L | 94.2 | Very high | 92.4 | Very high | 33 Ų | 33 | 62.5 Ų | 62.5 | 17% | 0.173 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -62.9 | -46 | 179.3 | -174 | 59.9 | 0 | 0 | 0 | 111.7 | N129 L130 V131 V135 I136 L137 V156 | N129-L133 WeakPolarHBondContact O-CB 3.44Å; N129-L133 PolarHBondContact O-N 2.94Å; L130-L133 PolarHBondContact O-N 2.89Å; V131-L133 VanDerWaalsContact C-N 3.34Å; V131-L133 PolarHBondContact O-N 3.08Å; L133-V135 PolarHBondContact O-N 2.87Å; L133-I136 PolarHBondContact O-N 3.44Å; L133-L137 HydrophobicContact CD1-CD1 4.1Å; L133-L137 HydrophobicContact CD1-CG 4.2Å; L133-L137 HydrophobicContact CG-CD1 3.92Å; L133-L137 HydrophobicContact CG-CG 4.4Å; L133-L137 WeakPolarHBondContact O-CB 3.35Å; L133-L137 VanDerWaalsContact O-CG 3.29Å; L133-L137 WeakPolarHBondContact O-CG 3.43Å; L133-L137 PolarHBondContact O-N 3.29Å; L133-V156 HydrophobicContact CD1-CG2 3.94Å; L133-V156 HydrophobicContact CD2-CG2 3.88Å |
| 134 | C | 93.1 | Very high | 92.1 | Very high | 62 Ų | 62 | 62.5 Ų | 62.5 | 42% | 0.419 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -58.7 | -47.6 | 177.3 | -70 | 0 | 0 | 0 | 0 | 112.1 | L130 V131 I136 L137 Q138 | L130-C134 WeakPolarHBondContact O-CB 3.19Å; L130-C134 PolarHBondContact O-N 3.14Å; L130-C134 PolarHBondContact O-SG 3.46Å; V131-C134 PolarHBondContact O-N 2.87Å; C134-I136 VanDerWaalsContact C-N 3.33Å; C134-I136 PolarHBondContact O-N 3.36Å; C134-L137 PolarHBondContact O-N 3.01Å; C134-Q138 VanDerWaalsContact O-CB 3.3Å; C134-Q138 WeakPolarHBondContact O-CB 3.39Å; C134-Q138 PolarHBondContact O-N 2.89Å |
| 135 | V | 92.2 | Very high | 91.8 | Very high | 7 Ų | 7 | 64.7 Ų | 64.7 | 4% | 0.042 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -62 | -40.7 | 178.5 | 173.2 | 0 | 0 | 0 | 0 | 111.7 | V131 V132 L133 S139 L142 L399 A402 F403 | V131-V135 WeakPolarHBondContact O-CG2 3.5Å; V131-V135 PolarHBondContact O-N 3.47Å; V132-V135 PolarHBondContact O-N 3.45Å; L133-V135 PolarHBondContact O-N 2.87Å; V135-S139 VanDerWaalsContact O-CB 3.32Å; V135-S139 WeakPolarHBondContact O-CB 3.2Å; V135-S139 PolarHBondContact O-N 3.49Å; V135-S139 VanDerWaalsContact O-N 3.14Å; V135-L142 HydrophobicContact CG1-CD1 4.15Å; V135-L399 HydrophobicContact CB-CD1 4.45Å; V135-L399 HydrophobicContact CG1-CD1 3.84Å; V135-A402 HydrophobicContact CG1-CB 3.55Å; V135-F403 HydrophobicContact CG1-CB 4.48Å; V135-F403 HydrophobicContact CG2-CB 4.1Å; V135-F403 HydrophobicContact CG2-CD2 3.89Å |
| 136 | I | 92 | Very high | 91.4 | Very high | 10 Ų | 10 | 65.6 Ų | 65.6 | 5% | 0.051 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -65.3 | -47.3 | 176.3 | -68.9 | 170 | 0 | 0 | 0 | 110.3 | V132 L133 C134 L142 R143 Y148 I151 L399 | V132-I136 HydrophobicContact CG1-CD1 3.8Å; V132-I136 VanDerWaalsContact O-CG1 3.3Å; V132-I136 WeakPolarHBondContact O-CG1 3.4Å; V132-I136 PolarHBondContact O-N 3.39Å; L133-I136 PolarHBondContact O-N 3.44Å; C134-I136 VanDerWaalsContact C-N 3.33Å; C134-I136 PolarHBondContact O-N 3.36Å; I136-L142 HydrophobicContact CG1-CD1 4.47Å; I136-R143 WeakPolarHBondContact O-CG 3.48Å; I136-Y148 HydrophobicContact CD1-CD1 4.34Å; I136-Y148 HydrophobicContact CG1-CD1 4.23Å; I136-I151 HydrophobicContact CD1-CB 4.34Å; I136-I151 HydrophobicContact CD1-CG2 3.94Å; I136-L399 HydrophobicContact CG1-CD1 4.11Å |
| 137 | L | 91 | Very high | 91.1 | Very high | 98 Ų | 98 | 64.7 Ų | 64.7 | 51% | 0.513 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -66.2 | -42.8 | -177.9 | -69.2 | 175.6 | 0 | 0 | 0 | 112.6 | L133 C134 R143 | L133-L137 HydrophobicContact CD1-CD1 4.1Å; L133-L137 HydrophobicContact CD1-CG 4.2Å; L133-L137 HydrophobicContact CG-CD1 3.92Å; L133-L137 HydrophobicContact CG-CG 4.4Å; L133-L137 WeakPolarHBondContact O-CB 3.35Å; L133-L137 VanDerWaalsContact O-CG 3.29Å; L133-L137 WeakPolarHBondContact O-CG 3.43Å; L133-L137 PolarHBondContact O-N 3.29Å; C134-L137 PolarHBondContact O-N 3.01Å; L137-R143 PolarHBondContact O-NE 3.44Å; L137-R143 PolarHBondContact O-NH2 2.83Å |
| 138 | Q | 90.1 | Very high | 90.9 | Very high | 132 Ų | 132 | 60.3 Ų | 60.3 | 62% | 0.617 | 30% | 0.301 | S | S | * | . | H | α-helix | trans | -66.1 | -39.8 | 178.9 | -168.6 | 173 | 9.8 | 0 | 0 | 111.8 | C134 R140 S406 | C134-Q138 VanDerWaalsContact O-CB 3.3Å; C134-Q138 WeakPolarHBondContact O-CB 3.39Å; C134-Q138 PolarHBondContact O-N 2.89Å; Q138-R140 PolarHBondContact O-N 3Å; Q138-S406 PolarHBondContact OE1-OG 3.36Å |
| 139 | S | 89 | Confident | 90.8 | Very high | 24 Ų | 24 | 60 Ų | 60 | 17% | 0.168 | 30% | 0.3 | C | S | . | . | trans | -83.5 | 101.5 | -177 | -170.5 | 0 | 0 | 0 | 0 | 113.4 | V135 T141 L142 R143 | V135-S139 VanDerWaalsContact O-CB 3.32Å; V135-S139 WeakPolarHBondContact O-CB 3.2Å; V135-S139 PolarHBondContact O-N 3.49Å; V135-S139 VanDerWaalsContact O-N 3.14Å; S139-T141 PolarHBondContact O-N 3.26Å; S139-L142 PolarHBondContact O-N 3.38Å; S139-R143 PolarHBondContact O-N 2.91Å | ||
| 140 | R | 86.1 | Confident | 90.6 | Very high | 193 Ų | 193 | 60.5 Ų | 60.5 | 73% | 0.728 | 30% | 0.302 | S | S | * | . | H | α-helix | trans | -52.3 | -37.4 | 171.4 | -173.4 | 178.2 | 179.9 | 179.8 | 0.4 | 112.1 | Q138 L142 R143 C144 | Q138-R140 PolarHBondContact O-N 3Å; R140-L142 VanDerWaalsContact C-N 3.35Å; R140-L142 PolarHBondContact O-N 3.28Å; R140-R143 PolarHBondContact O-N 2.92Å; R140-C144 PolarHBondContact O-N 3.06Å; R140-C144 PolarHBondContact O-SG 3.02Å |
| 141 | T | 87.4 | Confident | 90.5 | Very high | 100 Ų | 100 | 57.1 Ų | 57.1 | 61% | 0.613 | 28% | 0.284 | S | S | * | . | H | α-helix | trans | -63.9 | -37.3 | 178.9 | -54 | 0 | 0 | 0 | 0 | 112.5 | S139 | S139-T141 PolarHBondContact O-N 3.26Å |
| 142 | L | 87.1 | Confident | 90.5 | Very high | 5 Ų | 5 | 54.3 Ų | 54.3 | 3% | 0.026 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -73.3 | -44.7 | 174.1 | -61 | -175.1 | 0 | 0 | 0 | 111.1 | V135 I136 S139 R140 C144 R145 Y148 D398 L399 A402 | V135-L142 HydrophobicContact CG1-CD1 4.15Å; I136-L142 HydrophobicContact CG1-CD1 4.47Å; S139-L142 PolarHBondContact O-N 3.38Å; R140-L142 VanDerWaalsContact C-N 3.35Å; R140-L142 PolarHBondContact O-N 3.28Å; L142-C144 PolarHBondContact O-N 3.45Å; L142-R145 WeakPolarHBondContact O-CB 3.44Å; L142-R145 PolarHBondContact O-N 2.99Å; L142-Y148 HydrophobicContact CB-CD1 4.32Å; L142-Y148 HydrophobicContact CB-CG 4.27Å; L142-Y148 HydrophobicContact CD1-CD1 4.42Å; L142-Y148 HydrophobicContact CD1-CE1 4.3Å; L142-Y148 HydrophobicContact CD2-CD1 4.3Å; L142-Y148 HydrophobicContact CD2-CD2 4.4Å; L142-Y148 HydrophobicContact CD2-CE1 3.87Å; L142-Y148 HydrophobicContact CD2-CE2 3.95Å; L142-D398 HydrophobicContact CD2-CB 4Å; L142-L399 HydrophobicContact CD1-CD1 3.95Å; L142-A402 HydrophobicContact CD1-CB 3.72Å; L142-A402 HydrophobicContact CG-CB 4.36Å |
| 143 | R | 90.1 | Very high | 90.6 | Very high | 121 Ų | 121 | 54 Ų | 54 | 46% | 0.457 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -61.6 | -22.3 | 176.3 | -69.1 | -165.6 | -78.7 | 126.4 | -6.4 | 114.8 | I136 L137 S139 R140 R145 H149 | I136-R143 WeakPolarHBondContact O-CG 3.48Å; L137-R143 PolarHBondContact O-NE 3.44Å; L137-R143 PolarHBondContact O-NH2 2.83Å; S139-R143 PolarHBondContact O-N 2.91Å; R140-R143 PolarHBondContact O-N 2.92Å; R143-R145 PolarHBondContact O-N 2.76Å; R143-H149 PolarHBondContact O-CE1 3.09Å |
| 144 | C | 87.6 | Confident | 90.6 | Very high | 82 Ų | 82 | 52.5 Ų | 52.5 | 55% | 0.554 | 26% | 0.26 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.2 | -12.2 | 172.8 | -72.9 | 0 | 0 | 0 | 0 | 113.6 | R140 L142 | R140-C144 PolarHBondContact O-N 3.06Å; R140-C144 PolarHBondContact O-SG 3.02Å; L142-C144 PolarHBondContact O-N 3.45Å |
| 145 | R | 89.1 | Confident | 90.8 | Very high | 138 Ų | 138 | 49.7 Ų | 49.7 | 52% | 0.521 | 24% | 0.241 | S | C | . | . | S | Bend | trans | -100 | 126.2 | -175.9 | -61.7 | -73.7 | -176.8 | 142.1 | 2.8 | 110.5 | L142 R143 S147 Y148 H149 | L142-R145 WeakPolarHBondContact O-CB 3.44Å; L142-R145 PolarHBondContact O-N 2.99Å; R143-R145 PolarHBondContact O-N 2.76Å; R145-S147 VanDerWaalsContact C-N 3.34Å; R145-S147 PolarHBondContact O-N 3.3Å; R145-Y148 HydrophobicContact CB-CD2 3.67Å; R145-Y148 HydrophobicContact CB-CE2 4.27Å; R145-Y148 HydrophobicContact CG-CD2 4.36Å; R145-Y148 PolarHBondContact O-N 3.49Å; R145-H149 PolarHBondContact O-CE1 3.44Å; R145-H149 PolarHBondContact O-ND1 2.88Å |
| 146 | P | 88.1 | Confident | 91 | Very high | 19 Ų | 19 | 51.6 Ų | 51.6 | 12% | 0.123 | 25% | 0.252 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -62.2 | -38.4 | -175.9 | 23 | -32.5 | 0 | 0 | 0 | 113 | Y148 H149 V223 A228 | P146-Y148 PolarHBondContact O-N 2.94Å; P146-Y148 VanDerWaalsContact O-N 3.15Å; P146-H149 WeakPolarHBondContact O-CB 3.35Å; P146-H149 PolarHBondContact O-N 3.15Å; P146-H149 PolarHBondContact O-ND1 3.22Å; P146-V223 HydrophobicContact CB-CG1 3.98Å; P146-V223 HydrophobicContact CG-CG1 3.89Å; P146-A228 HydrophobicContact CB-CB 3.73Å |
| 147 | S | 88.5 | Confident | 91.2 | Very high | 16 Ų | 16 | 51.2 Ų | 51.2 | 11% | 0.112 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -60.5 | -25.7 | -179.3 | 54.1 | 0 | 0 | 0 | 0 | 114.8 | R145 H149 F150 I151 | R145-S147 VanDerWaalsContact C-N 3.34Å; R145-S147 PolarHBondContact O-N 3.3Å; S147-H149 VanDerWaalsContact C-N 3.31Å; S147-F150 PolarHBondContact O-N 3.24Å; S147-I151 PolarHBondContact O-N 3.47Å |
| 148 | Y | 91.1 | Very high | 91.5 | Very high | 17 Ų | 17 | 46.6 Ų | 46.6 | 7% | 0.067 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -78.4 | -13.3 | 175.2 | -73.9 | -90.3 | 0 | 0 | 0 | 113.4 | I136 L142 R145 P146 I151 G152 S396 L399 | I136-Y148 HydrophobicContact CD1-CD1 4.34Å; I136-Y148 HydrophobicContact CG1-CD1 4.23Å; L142-Y148 HydrophobicContact CB-CD1 4.32Å; L142-Y148 HydrophobicContact CB-CG 4.27Å; L142-Y148 HydrophobicContact CD1-CD1 4.42Å; L142-Y148 HydrophobicContact CD1-CE1 4.3Å; L142-Y148 HydrophobicContact CD2-CD1 4.3Å; L142-Y148 HydrophobicContact CD2-CD2 4.4Å; L142-Y148 HydrophobicContact CD2-CE1 3.87Å; L142-Y148 HydrophobicContact CD2-CE2 3.95Å; R145-Y148 HydrophobicContact CB-CD2 3.67Å; R145-Y148 HydrophobicContact CB-CE2 4.27Å; R145-Y148 HydrophobicContact CG-CD2 4.36Å; R145-Y148 PolarHBondContact O-N 3.49Å; P146-Y148 PolarHBondContact O-N 2.94Å; P146-Y148 VanDerWaalsContact O-N 3.15Å; Y148-I151 HydrophobicContact CD1-CD1 4.12Å; Y148-I151 HydrophobicContact CE1-CD1 4.26Å; Y148-G152 PolarHBondContact O-N 3.05Å; Y148-S396 PolarHBondContact OH-OG 2.92Å; Y148-L399 HydrophobicContact CE1-CB 4.41Å; Y148-L399 HydrophobicContact CE1-CD1 4.32Å |
| 149 | H | 91.9 | Very high | 91.8 | Very high | 39 Ų | 39 | 42 Ų | 42 | 18% | 0.181 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -73.1 | -34.9 | 171.7 | -60.7 | 59.3 | 0 | 0 | 0 | 110.4 | R143 R145 P146 S147 S153 F232 | R143-H149 PolarHBondContact O-CE1 3.09Å; R145-H149 PolarHBondContact O-CE1 3.44Å; R145-H149 PolarHBondContact O-ND1 2.88Å; P146-H149 WeakPolarHBondContact O-CB 3.35Å; P146-H149 PolarHBondContact O-N 3.15Å; P146-H149 PolarHBondContact O-ND1 3.22Å; S147-H149 VanDerWaalsContact C-N 3.31Å; H149-S153 WeakPolarHBondContact O-CB 3.31Å; H149-S153 PolarHBondContact O-N 3.02Å; H149-F232 HydrophobicContact CB-CD1 4.04Å; H149-F232 HydrophobicContact CB-CE1 3.91Å |
| 150 | F | 92.6 | Very high | 92.1 | Very high | 13 Ų | 13 | 44.3 Ų | 44.3 | 6% | 0.057 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -68.9 | -39.7 | 173.1 | -52.2 | -48.1 | 0 | 0 | 0 | 111.9 | S147 S153 L154 L204 D208 A228 A231 F232 | S147-F150 PolarHBondContact O-N 3.24Å; F150-S153 WeakPolarHBondContact O-CB 3.47Å; F150-S153 PolarHBondContact O-N 3.22Å; F150-L154 WeakPolarHBondContact O-CB 3.25Å; F150-L154 PolarHBondContact O-N 3.14Å; F150-L204 HydrophobicContact CD1-CB 3.85Å; F150-L204 HydrophobicContact CD1-CD1 4.08Å; F150-L204 HydrophobicContact CE1-CB 4.06Å; F150-L204 HydrophobicContact CE1-CD1 4.1Å; F150-L204 HydrophobicContact CG-CB 4.26Å; F150-D208 HydrophobicContact CD2-CB 4.21Å; F150-D208 HydrophobicContact CE2-CB 4.05Å; F150-A228 HydrophobicContact CE1-CB 4.07Å; F150-A228 HydrophobicContact CE2-CB 4.42Å; F150-A228 HydrophobicContact CZ-CB 3.71Å; F150-A231 HydrophobicContact CE1-CB 4.5Å; F150-F232 HydrophobicContact CD1-CB 4.48Å |
| 151 | I | 92.4 | Very high | 92.5 | Very high | 8 Ų | 8 | 35.2 Ų | 35.2 | 4% | 0.041 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -66.9 | -41.3 | 174.7 | -59.6 | 170.3 | 0 | 0 | 0 | 110.9 | V132 I136 S147 Y148 L154 A155 Y392 | V132-I151 HydrophobicContact CG1-CG2 4.2Å; I136-I151 HydrophobicContact CD1-CB 4.34Å; I136-I151 HydrophobicContact CD1-CG2 3.94Å; S147-I151 PolarHBondContact O-N 3.47Å; Y148-I151 HydrophobicContact CD1-CD1 4.12Å; Y148-I151 HydrophobicContact CE1-CD1 4.26Å; I151-L154 PolarHBondContact O-N 3.47Å; I151-A155 WeakPolarHBondContact O-CB 3.22Å; I151-A155 PolarHBondContact O-N 3.44Å; I151-Y392 HydrophobicContact CD1-CD1 4.07Å; I151-Y392 HydrophobicContact CD1-CE1 4.35Å; I151-Y392 HydrophobicContact CG1-CD1 4.21Å; I151-Y392 HydrophobicContact CG1-CE1 4.08Å; I151-Y392 HydrophobicContact CG2-CD1 4.42Å; I151-Y392 HydrophobicContact CG2-CD2 3.9Å; I151-Y392 HydrophobicContact CG2-CE2 4.17Å; I151-Y392 HydrophobicContact CG2-CG 4.07Å |
| 152 | G | 94.2 | Very high | 92.9 | Very high | 10 Ų | 10 | 30.5 Ų | 30.5 | 10% | 0.103 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -65.6 | -41 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | Y148 L154 A155 V156 | Y148-G152 PolarHBondContact O-N 3.05Å; G152-L154 VanDerWaalsContact C-N 3.34Å; G152-L154 PolarHBondContact O-N 2.97Å; G152-A155 PolarHBondContact O-N 2.77Å; G152-V156 WeakPolarHBondContact O-CG2 3.28Å; G152-V156 PolarHBondContact O-N 3.26Å |
| 153 | S | 95.7 | Very high | 93.4 | Very high | 8 Ų | 8 | 33.8 Ų | 33.8 | 6% | 0.056 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -56.6 | -47.4 | 172.3 | 174.4 | 0 | 0 | 0 | 0 | 111.4 | H149 F150 V156 A157 S201 W236 | H149-S153 WeakPolarHBondContact O-CB 3.31Å; H149-S153 PolarHBondContact O-N 3.02Å; F150-S153 WeakPolarHBondContact O-CB 3.47Å; F150-S153 PolarHBondContact O-N 3.22Å; S153-V156 PolarHBondContact O-N 2.6Å; S153-A157 PolarHBondContact O-N 2.75Å; S153-S201 PolarHBondContact OG-OG 2.9Å; S153-W236 PolarHBondContact OG-NE1 3.11Å |
| 154 | L | 94.4 | Very high | 93.6 | Very high | 1 Ų | 1 | 30.5 Ų | 30.5 | 1% | 0.005 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -62.8 | -46.1 | 176.2 | -178.8 | 60.2 | 0 | 0 | 0 | 112.1 | F150 I151 G152 V156 A157 D158 S198 L202 N388 Y392 | F150-L154 WeakPolarHBondContact O-CB 3.25Å; F150-L154 PolarHBondContact O-N 3.14Å; I151-L154 PolarHBondContact O-N 3.47Å; G152-L154 VanDerWaalsContact C-N 3.34Å; G152-L154 PolarHBondContact O-N 2.97Å; L154-V156 VanDerWaalsContact C-N 3.27Å; L154-V156 PolarHBondContact O-N 3.46Å; L154-A157 PolarHBondContact O-N 2.97Å; L154-A157 VanDerWaalsContact O-N 3.1Å; L154-D158 WeakPolarHBondContact O-CB 3.36Å; L154-D158 PolarHBondContact O-N 2.93Å; L154-S198 WeakPolarHBondContact CD1-OG 3.22Å; L154-L202 HydrophobicContact CD1-CG 4.35Å; L154-L202 HydrophobicContact CD2-CD2 3.77Å; L154-L202 HydrophobicContact CD2-CG 4.25Å; L154-N388 HydrophobicContact CD2-CB 4.26Å; L154-Y392 HydrophobicContact CD2-CE2 3.7Å; L154-Y392 WeakPolarHBondContact CD2-OH 3.36Å |
| 155 | A | 95.7 | Very high | 94 | Very high | 2 Ų | 2 | 27.3 Ų | 27.3 | 2% | 0.017 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -61.8 | -33.6 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | N129 V132 I151 G152 L159 | N129-A155 HydrophobicContact CB-CB 4.42Å; N129-A155 WeakPolarHBondContact OD1-CA 3.45Å; V132-A155 HydrophobicContact CG1-CB 4.11Å; I151-A155 WeakPolarHBondContact O-CB 3.22Å; I151-A155 PolarHBondContact O-N 3.44Å; G152-A155 PolarHBondContact O-N 2.77Å; A155-L159 WeakPolarHBondContact O-CB 3.35Å; A155-L159 PolarHBondContact O-N 2.87Å |
| 156 | V | 96.8 | Very high | 94.3 | Very high | 48 Ų | 48 | 21.6 Ų | 21.6 | 29% | 0.291 | 12% | 0.121 | S | C | . | . | H | α-helix | trans | -70.2 | -43 | 172.4 | 172.4 | 0 | 0 | 0 | 0 | 111.3 | L133 G152 S153 L154 L159 L160 W236 | L133-V156 HydrophobicContact CD1-CG2 3.94Å; L133-V156 HydrophobicContact CD2-CG2 3.88Å; G152-V156 WeakPolarHBondContact O-CG2 3.28Å; G152-V156 PolarHBondContact O-N 3.26Å; S153-V156 PolarHBondContact O-N 2.6Å; L154-V156 VanDerWaalsContact C-N 3.27Å; L154-V156 PolarHBondContact O-N 3.46Å; V156-L159 PolarHBondContact O-N 3.31Å; V156-L160 HydrophobicContact CG1-CD1 3.85Å; V156-L160 HydrophobicContact CG1-CG 4.38Å; V156-L160 WeakPolarHBondContact O-CB 3.25Å; V156-L160 WeakPolarHBondContact O-CG 3.28Å; V156-L160 PolarHBondContact O-N 3.26Å; V156-W236 HydrophobicContact CB-CZ2 4.24Å; V156-W236 HydrophobicContact CG1-CH2 3.93Å; V156-W236 HydrophobicContact CG1-CZ2 3.92Å |
| 157 | A | 96.9 | Very high | 94.6 | Very high | 1 Ų | 1 | 26.7 Ų | 26.7 | 1% | 0.008 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -63.1 | -44.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | S153 L154 G161 A197 W236 | S153-A157 PolarHBondContact O-N 2.75Å; L154-A157 PolarHBondContact O-N 2.97Å; L154-A157 VanDerWaalsContact O-N 3.1Å; A157-G161 WeakPolarHBondContact O-CA 3.49Å; A157-G161 PolarHBondContact O-N 3.44Å; A157-A197 HydrophobicContact CB-CB 4.06Å; A157-W236 HydrophobicContact CB-CH2 3.94Å; A157-W236 HydrophobicContact CB-CZ2 3.79Å |
| 158 | D | 96.3 | Very high | 94.8 | Very high | 1 Ų | 1 | 26.8 Ų | 26.8 | 1% | 0.005 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -69 | -35.5 | 178.6 | -75.6 | -18.5 | 0 | 0 | 0 | 112 | L154 S162 S198 S385 N388 | L154-D158 WeakPolarHBondContact O-CB 3.36Å; L154-D158 PolarHBondContact O-N 2.93Å; D158-S162 VanDerWaalsContact O-CB 3.25Å; D158-S162 WeakPolarHBondContact O-CB 3.36Å; D158-S162 PolarHBondContact O-N 2.9Å; D158-S162 PolarHBondContact O-OG 3.01Å; D158-S198 PolarHBondContact OD1-OG 3.27Å; D158-S385 VanDerWaalsContact CG-CB 3.47Å; D158-S385 VanDerWaalsContact CG-OG 3.25Å; D158-S385 WeakPolarHBondContact OD1-CB 3.43Å; D158-S385 PolarHBondContact OD1-OG 3.45Å; D158-N388 PolarHBondContact OD2-ND2 3.15Å |
| 159 | L | 96.1 | Very high | 94.9 | Very high | 36 Ų | 36 | 26.6 Ų | 26.6 | 19% | 0.188 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -69.3 | -49.6 | 174.3 | -173.3 | 156.8 | 0 | 0 | 0 | 111.9 | N129 L130 A155 V156 S162 V163 | N129-L159 HydrophobicContact CB-CB 4.31Å; L130-L159 HydrophobicContact CB-CD1 4.04Å; L130-L159 HydrophobicContact CD1-CD1 4.24Å; A155-L159 WeakPolarHBondContact O-CB 3.35Å; A155-L159 PolarHBondContact O-N 2.87Å; V156-L159 PolarHBondContact O-N 3.31Å; L159-S162 PolarHBondContact O-OG 3.32Å; L159-S162 VanDerWaalsContact O-OG 3.13Å; L159-V163 HydrophobicContact CD2-CG2 4.49Å; L159-V163 WeakPolarHBondContact O-CG2 3.24Å; L159-V163 PolarHBondContact O-N 3.33Å; L159-V163 VanDerWaalsContact O-N 3.12Å |
| 160 | L | 95.9 | Very high | 94.9 | Very high | 73 Ų | 73 | 25.6 Ų | 25.6 | 38% | 0.382 | 14% | 0.135 | S | C | . | . | H | α-helix | trans | -63.9 | -45.3 | 177.6 | -69.6 | 174.3 | 0 | 0 | 0 | 111 | V156 V163 I164 W236 | V156-L160 HydrophobicContact CG1-CD1 3.85Å; V156-L160 HydrophobicContact CG1-CG 4.38Å; V156-L160 WeakPolarHBondContact O-CB 3.25Å; V156-L160 WeakPolarHBondContact O-CG 3.28Å; V156-L160 PolarHBondContact O-N 3.26Å; L160-V163 PolarHBondContact O-N 3.49Å; L160-I164 WeakPolarHBondContact O-CB 3.36Å; L160-I164 WeakPolarHBondContact O-CD1 3.39Å; L160-I164 WeakPolarHBondContact O-CG1 3.47Å; L160-I164 PolarHBondContact O-N 2.9Å; L160-W236 HydrophobicContact CD1-CH2 4.1Å; L160-W236 HydrophobicContact CD1-CZ3 4.37Å |
| 161 | G | 95.3 | Very high | 94.9 | Very high | 1 Ų | 1 | 25.5 Ų | 25.5 | 1% | 0.01 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -59.5 | -47.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | A157 F165 S194 | A157-G161 WeakPolarHBondContact O-CA 3.49Å; A157-G161 PolarHBondContact O-N 3.44Å; G161-F165 WeakPolarHBondContact O-CA 3.41Å; G161-F165 WeakPolarHBondContact O-CB 3.36Å; G161-F165 PolarHBondContact O-N 3.01Å; G161-S194 PolarHBondContact N-OG 3.24Å |
| 162 | S | 95.7 | Very high | 94.8 | Very high | 1 Ų | 1 | 26 Ų | 26 | 1% | 0.007 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -65.4 | -42.5 | 178.9 | 53.7 | 0 | 0 | 0 | 0 | 113.1 | V126 D158 L159 V166 | V126-S162 WeakPolarHBondContact CG2-OG 3.45Å; D158-S162 VanDerWaalsContact O-CB 3.25Å; D158-S162 WeakPolarHBondContact O-CB 3.36Å; D158-S162 PolarHBondContact O-N 2.9Å; D158-S162 PolarHBondContact O-OG 3.01Å; L159-S162 PolarHBondContact O-OG 3.32Å; L159-S162 VanDerWaalsContact O-OG 3.13Å; S162-V166 WeakPolarHBondContact O-CB 3.33Å; S162-V166 WeakPolarHBondContact O-CG2 3.34Å; S162-V166 PolarHBondContact O-N 3.38Å |
| 163 | V | 96.1 | Very high | 94.6 | Very high | 75 Ų | 75 | 27 Ų | 27 | 46% | 0.455 | 14% | 0.139 | S | C | . | . | H | α-helix | trans | -63 | -50.4 | 176.7 | 173.3 | 0 | 0 | 0 | 0 | 111.5 | V126 L159 L160 Y167 | V126-V163 HydrophobicContact CG2-CG2 3.62Å; L159-V163 HydrophobicContact CD2-CG2 4.49Å; L159-V163 WeakPolarHBondContact O-CG2 3.24Å; L159-V163 PolarHBondContact O-N 3.33Å; L159-V163 VanDerWaalsContact O-N 3.12Å; L160-V163 PolarHBondContact O-N 3.49Å; V163-Y167 WeakPolarHBondContact O-CB 3.2Å; V163-Y167 PolarHBondContact O-N 2.94Å; V163-Y167 VanDerWaalsContact O-N 3.13Å |
| 164 | I | 95.8 | Very high | 94.3 | Very high | 52 Ų | 52 | 28.4 Ų | 28.4 | 27% | 0.267 | 15% | 0.147 | S | C | . | . | H | α-helix | trans | -67.8 | -41.3 | -177.4 | -59.8 | 166.3 | 0 | 0 | 0 | 110.4 | L160 S168 V191 | L160-I164 WeakPolarHBondContact O-CB 3.36Å; L160-I164 WeakPolarHBondContact O-CD1 3.39Å; L160-I164 WeakPolarHBondContact O-CG1 3.47Å; L160-I164 PolarHBondContact O-N 2.9Å; I164-S168 VanDerWaalsContact O-CB 3.23Å; I164-S168 WeakPolarHBondContact O-CB 3.46Å; I164-S168 PolarHBondContact O-N 3.41Å; I164-S168 PolarHBondContact O-OG 2.85Å; I164-V191 HydrophobicContact CB-CG2 4.39Å; I164-V191 HydrophobicContact CG2-CG2 3.8Å |
| 165 | F | 95.1 | Very high | 94 | Very high | 15 Ų | 15 | 35.4 Ų | 35.4 | 7% | 0.066 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -62.2 | -54.1 | 177.2 | 178.3 | -85.2 | 0 | 0 | 0 | 111.1 | G161 Y167 S168 F169 V191 F195 S378 M379 L382 | G161-F165 WeakPolarHBondContact O-CA 3.41Å; G161-F165 WeakPolarHBondContact O-CB 3.36Å; G161-F165 PolarHBondContact O-N 3.01Å; F165-Y167 VanDerWaalsContact C-N 3.33Å; F165-Y167 PolarHBondContact O-N 3.04Å; F165-S168 PolarHBondContact O-N 2.81Å; F165-F169 HydrophobicContact CD1-CB 4.27Å; F165-F169 HydrophobicContact CE1-CB 4.1Å; F165-F169 AromaticContact CE1-CD2 3.85Å; F165-F169 HydrophobicContact CE1-CD2 3.85Å; F165-F169 HydrophobicContact CE1-CG 4.06Å; F165-F169 AromaticContact CE2-CD2 3.89Å; F165-F169 HydrophobicContact CE2-CD2 3.89Å; F165-F169 HydrophobicContact CZ-CB 4.38Å; F165-F169 AromaticContact CZ-CD2 3.38Å; F165-F169 HydrophobicContact CZ-CD2 3.38Å; F165-F169 AromaticContact CZ-CE2 3.97Å; F165-F169 HydrophobicContact CZ-CE2 3.97Å; F165-F169 HydrophobicContact CZ-CG 4.07Å; F165-F169 WeakPolarHBondContact O-CB 3.34Å; F165-F169 PolarHBondContact O-N 2.78Å; F165-V191 HydrophobicContact CB-CG2 4.2Å; F165-V191 HydrophobicContact CD2-CG1 4.04Å; F165-F195 HydrophobicContact CD2-CE2 4.21Å; F165-S378 WeakPolarHBondContact CZ-O 3.44Å; F165-M379 HydrophobicContact CE1-CE 3.65Å; F165-M379 HydrophobicContact CE1-SD 4Å; F165-M379 HydrophobicContact CZ-CE 3.88Å; F165-M379 HydrophobicContact CZ-SD 4.48Å; F165-L382 HydrophobicContact CB-CD1 4.07Å; F165-L382 HydrophobicContact CD1-CD1 3.27Å; F165-L382 HydrophobicContact CD1-CD2 4.2Å; F165-L382 HydrophobicContact CD1-CG 4.36Å; F165-L382 HydrophobicContact CE1-CD1 3.78Å; F165-L382 HydrophobicContact CE1-CD2 4.35Å; F165-L382 HydrophobicContact CG-CD1 3.75Å |
| 166 | V | 95.4 | Very high | 93.5 | Very high | 18 Ų | 18 | 39.1 Ų | 39.1 | 11% | 0.109 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -60.6 | -45.3 | -176.1 | 173.7 | 0 | 0 | 0 | 0 | 110.8 | S118 L119 S162 L170 L382 | S118-V166 WeakPolarHBondContact O-CG2 3.39Å; L119-V166 HydrophobicContact CD2-CG1 4.18Å; S162-V166 WeakPolarHBondContact O-CB 3.33Å; S162-V166 WeakPolarHBondContact O-CG2 3.34Å; S162-V166 PolarHBondContact O-N 3.38Å; V166-L170 HydrophobicContact CG1-CD1 3.72Å; V166-L170 HydrophobicContact CG1-CG 4.48Å; V166-L170 WeakPolarHBondContact O-CB 3.5Å; V166-L170 WeakPolarHBondContact O-CD1 3.39Å; V166-L170 WeakPolarHBondContact O-CG 3.36Å; V166-L170 PolarHBondContact O-N 2.98Å; V166-L170 VanDerWaalsContact O-N 3.14Å; V166-L382 HydrophobicContact CG2-CD2 3.69Å |
| 167 | Y | 94.7 | Very high | 93 | Very high | 125 Ų | 125 | 43.2 Ų | 43.2 | 49% | 0.49 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -58.4 | -55.4 | 175.9 | 176 | -94.4 | 0 | 0 | 0 | 111.5 | V163 F165 F169 L170 D171 | V163-Y167 WeakPolarHBondContact O-CB 3.2Å; V163-Y167 PolarHBondContact O-N 2.94Å; V163-Y167 VanDerWaalsContact O-N 3.13Å; F165-Y167 VanDerWaalsContact C-N 3.33Å; F165-Y167 PolarHBondContact O-N 3.04Å; Y167-F169 PolarHBondContact O-N 3.31Å; Y167-L170 PolarHBondContact O-N 3.1Å; Y167-D171 VanDerWaalsContact O-CB 3.23Å; Y167-D171 WeakPolarHBondContact O-CB 3.36Å; Y167-D171 PolarHBondContact O-N 3.31Å |
| 168 | S | 93.2 | Very high | 92.3 | Very high | 19 Ų | 19 | 48.3 Ų | 48.3 | 13% | 0.133 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -67.7 | -36.9 | -174.2 | -50.1 | 0 | 0 | 0 | 0 | 112.4 | I164 F165 F172 | I164-S168 VanDerWaalsContact O-CB 3.23Å; I164-S168 WeakPolarHBondContact O-CB 3.46Å; I164-S168 PolarHBondContact O-N 3.41Å; I164-S168 PolarHBondContact O-OG 2.85Å; F165-S168 PolarHBondContact O-N 2.81Å; S168-F172 VanDerWaalsContact O-CB 3.29Å; S168-F172 WeakPolarHBondContact O-CB 3.27Å; S168-F172 PolarHBondContact O-N 2.95Å |
| 169 | F | 91.9 | Very high | 91.9 | Very high | 12 Ų | 12 | 49.5 Ų | 49.5 | 5% | 0.053 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -67.4 | -40.7 | -179.8 | -167.4 | -71 | 0 | 0 | 0 | 111.5 | V114 F165 Y167 H173 A375 M379 | V114-F169 HydrophobicContact CG1-CD1 4.11Å; V114-F169 HydrophobicContact CG1-CE1 3.23Å; V114-F169 HydrophobicContact CG1-CZ 3.76Å; F165-F169 HydrophobicContact CD1-CB 4.27Å; F165-F169 HydrophobicContact CE1-CB 4.1Å; F165-F169 AromaticContact CE1-CD2 3.85Å; F165-F169 HydrophobicContact CE1-CD2 3.85Å; F165-F169 HydrophobicContact CE1-CG 4.06Å; F165-F169 AromaticContact CE2-CD2 3.89Å; F165-F169 HydrophobicContact CE2-CD2 3.89Å; F165-F169 HydrophobicContact CZ-CB 4.38Å; F165-F169 AromaticContact CZ-CD2 3.38Å; F165-F169 HydrophobicContact CZ-CD2 3.38Å; F165-F169 AromaticContact CZ-CE2 3.97Å; F165-F169 HydrophobicContact CZ-CE2 3.97Å; F165-F169 HydrophobicContact CZ-CG 4.07Å; F165-F169 WeakPolarHBondContact O-CB 3.34Å; F165-F169 PolarHBondContact O-N 2.78Å; Y167-F169 PolarHBondContact O-N 3.31Å; F169-H173 HydrophobicContact CD1-CB 4.34Å; F169-H173 AromaticContact CD1-ND1 3.33Å; F169-H173 VanDerWaalsContact CD1-ND1 3.33Å; F169-H173 WeakPolarHBondContact CD1-ND1 3.25Å; F169-H173 AromaticContact CD2-CE1 3.68Å; F169-H173 AromaticContact CD2-ND1 3.7Å; F169-H173 HydrophobicContact CE1-CB 3.94Å; F169-H173 AromaticContact CE1-CE1 3.74Å; F169-H173 AromaticContact CE1-CG 3.63Å; F169-H173 AromaticContact CE1-ND1 3.11Å; F169-H173 WeakPolarHBondContact CE1-ND1 3.3Å; F169-H173 AromaticContact CE2-CE1 3.35Å; F169-H173 WeakPolarHBondContact CE2-CE1 3.46Å; F169-H173 AromaticContact CE2-ND1 3.58Å; F169-H173 AromaticContact CG-ND1 3.58Å; F169-H173 AromaticContact CZ-CE1 3.37Å; F169-H173 WeakPolarHBondContact CZ-CE1 3.27Å; F169-H173 AromaticContact CZ-CG 3.91Å; F169-H173 AromaticContact CZ-ND1 3.27Å; F169-H173 VanDerWaalsContact CZ-ND1 3.27Å; F169-H173 WeakPolarHBondContact CZ-ND1 3.48Å; F169-H173 WeakPolarHBondContact O-CB 3.49Å; F169-H173 PolarHBondContact O-N 2.81Å; F169-H173 PolarHBondContact O-ND1 2.97Å; F169-A375 HydrophobicContact CZ-CB 4.22Å; F169-M379 HydrophobicContact CD1-CE 3.58Å; F169-M379 HydrophobicContact CD2-CE 3.78Å; F169-M379 HydrophobicContact CE1-CE 3.46Å; F169-M379 VanDerWaalsContact CE1-CE 3.46Å; F169-M379 HydrophobicContact CE2-CE 3.6Å; F169-M379 HydrophobicContact CG-CE 3.78Å; F169-M379 HydrophobicContact CZ-CE 3.45Å; F169-M379 VanDerWaalsContact CZ-CE 3.45Å |
| 170 | L | 93.5 | Very high | 91.6 | Very high | 18 Ų | 18 | 50.8 Ų | 50.8 | 9% | 0.094 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -72.2 | -46.2 | 176.5 | -68.9 | 170.2 | 0 | 0 | 0 | 112.2 | A115 S118 L119 V166 Y167 F172 V174 F175 | A115-L170 HydrophobicContact CB-CD2 3.83Å; S118-L170 WeakPolarHBondContact OG-CD2 3.39Å; L119-L170 HydrophobicContact CD1-CD1 4.5Å; L119-L170 HydrophobicContact CD2-CD1 3.59Å; L119-L170 HydrophobicContact CG-CD1 3.88Å; V166-L170 HydrophobicContact CG1-CD1 3.72Å; V166-L170 HydrophobicContact CG1-CG 4.48Å; V166-L170 WeakPolarHBondContact O-CB 3.5Å; V166-L170 WeakPolarHBondContact O-CD1 3.39Å; V166-L170 WeakPolarHBondContact O-CG 3.36Å; V166-L170 PolarHBondContact O-N 2.98Å; V166-L170 VanDerWaalsContact O-N 3.14Å; Y167-L170 PolarHBondContact O-N 3.1Å; L170-F172 PolarHBondContact O-N 2.98Å; L170-V174 HydrophobicContact CD2-CG2 3.85Å; L170-V174 WeakPolarHBondContact O-CA 3.29Å; L170-V174 WeakPolarHBondContact O-CB 3.41Å; L170-V174 PolarHBondContact O-N 3.41Å; L170-F175 HydrophobicContact CB-CD2 4.45Å; L170-F175 HydrophobicContact CB-CE2 4.31Å; L170-F175 WeakPolarHBondContact O-CD2 3.3Å; L170-F175 PolarHBondContact O-N 3.16Å |
| 171 | D | 92.6 | Very high | 91.2 | Very high | 12 Ų | 12 | 50 Ų | 50 | 6% | 0.064 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -57.7 | -36 | 178.7 | -163.3 | 47.5 | 0 | 0 | 0 | 110.9 | Y167 R177 K187 | Y167-D171 VanDerWaalsContact O-CB 3.23Å; Y167-D171 WeakPolarHBondContact O-CB 3.36Å; Y167-D171 PolarHBondContact O-N 3.31Å; D171-R177 VanDerWaalsContact O-CB 3.31Å; D171-R177 WeakPolarHBondContact O-CB 3.4Å; D171-R177 PolarHBondContact O-N 3.37Å; D171-R177 VanDerWaalsContact O-N 3.12Å; D171-R177 WeakPolarHBondContact OD1-CD 3.26Å; D171-R177 IonicContact OD1-NH1 3.26Å; D171-R177 PolarHBondContact OD1-NH1 2.88Å; D171-R177 WeakPolarHBondContact OD2-CD 2.99Å; D171-R177 IonicContact OD2-NH1 3.84Å; D171-K187 IonicContact OD2-NZ 2.73Å; D171-K187 PolarHBondContact OD2-NZ 2.73Å |
| 172 | F | 90.3 | Very high | 91 | Very high | 18 Ų | 18 | 55 Ų | 55 | 8% | 0.079 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -75.1 | -78.4 | 169.6 | -163.7 | -102.5 | 0 | 0 | 0 | 112 | M100 F103 M104 S168 L170 V174 H176 F184 P264 | M100-F172 HydrophobicContact SD-CE2 4.04Å; F103-F172 HydrophobicContact CB-CE1 4.16Å; F103-F172 HydrophobicContact CB-CZ 3.9Å; M104-F172 HydrophobicContact CE-CD1 4.22Å; M104-F172 HydrophobicContact CE-CD2 4.13Å; M104-F172 HydrophobicContact CE-CE1 4.37Å; M104-F172 HydrophobicContact CE-CE2 4.28Å; M104-F172 HydrophobicContact CE-CG 4.11Å; M104-F172 HydrophobicContact CE-CZ 4.41Å; M104-F172 WeakPolarHBondContact CE-O 3.22Å; M104-F172 HydrophobicContact CG-CE1 4.4Å; M104-F172 HydrophobicContact CG-CZ 4.3Å; S168-F172 VanDerWaalsContact O-CB 3.29Å; S168-F172 WeakPolarHBondContact O-CB 3.27Å; S168-F172 PolarHBondContact O-N 2.95Å; L170-F172 PolarHBondContact O-N 2.98Å; F172-V174 VanDerWaalsContact C-N 3.31Å; F172-V174 PolarHBondContact O-N 3.39Å; F172-V174 VanDerWaalsContact O-N 3.16Å; F172-H176 WeakPolarHBondContact O-CA 3.45Å; F172-H176 PolarHBondContact O-N 2.86Å; F172-H176 VanDerWaalsContact O-N 3.13Å; F172-F184 HydrophobicContact CD2-CE2 4.11Å; F172-F184 HydrophobicContact CE2-CD2 4.46Å; F172-F184 AromaticContact CE2-CE2 3.93Å; F172-F184 HydrophobicContact CE2-CE2 3.93Å; F172-P264 HydrophobicContact CZ-CG 4.34Å |
| 173 | H | 88.4 | Confident | 90.9 | Very high | 30 Ų | 30 | 57.9 Ų | 57.9 | 14% | 0.139 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -71.3 | -14.4 | -164 | -60.4 | 99.3 | 0 | 0 | 0 | 116.1 | L106 F169 | L106-H173 HydrophobicContact CD1-CB 4.24Å; L106-H173 WeakPolarHBondContact CD1-CD2 3.44Å; F169-H173 HydrophobicContact CD1-CB 4.34Å; F169-H173 AromaticContact CD1-ND1 3.33Å; F169-H173 VanDerWaalsContact CD1-ND1 3.33Å; F169-H173 WeakPolarHBondContact CD1-ND1 3.25Å; F169-H173 AromaticContact CD2-CE1 3.68Å; F169-H173 AromaticContact CD2-ND1 3.7Å; F169-H173 HydrophobicContact CE1-CB 3.94Å; F169-H173 AromaticContact CE1-CE1 3.74Å; F169-H173 AromaticContact CE1-CG 3.63Å; F169-H173 AromaticContact CE1-ND1 3.11Å; F169-H173 WeakPolarHBondContact CE1-ND1 3.3Å; F169-H173 AromaticContact CE2-CE1 3.35Å; F169-H173 WeakPolarHBondContact CE2-CE1 3.46Å; F169-H173 AromaticContact CE2-ND1 3.58Å; F169-H173 AromaticContact CG-ND1 3.58Å; F169-H173 AromaticContact CZ-CE1 3.37Å; F169-H173 WeakPolarHBondContact CZ-CE1 3.27Å; F169-H173 AromaticContact CZ-CG 3.91Å; F169-H173 AromaticContact CZ-ND1 3.27Å; F169-H173 VanDerWaalsContact CZ-ND1 3.27Å; F169-H173 WeakPolarHBondContact CZ-ND1 3.48Å; F169-H173 WeakPolarHBondContact O-CB 3.49Å; F169-H173 PolarHBondContact O-N 2.81Å; F169-H173 PolarHBondContact O-ND1 2.97Å |
| 174 | V | 89.6 | Confident | 90.7 | Very high | 38 Ų | 38 | 55.3 Ų | 55.3 | 23% | 0.23 | 27% | 0.271 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -115.3 | -49.1 | -176.8 | -174.2 | 0 | 0 | 0 | 0 | 110.8 | A115 L170 F172 H176 | A115-V174 HydrophobicContact CB-CG2 4.02Å; L170-V174 HydrophobicContact CD2-CG2 3.85Å; L170-V174 WeakPolarHBondContact O-CA 3.29Å; L170-V174 WeakPolarHBondContact O-CB 3.41Å; L170-V174 PolarHBondContact O-N 3.41Å; F172-V174 VanDerWaalsContact C-N 3.31Å; F172-V174 PolarHBondContact O-N 3.39Å; F172-V174 VanDerWaalsContact O-N 3.16Å; V174-H176 VanDerWaalsContact C-N 3.34Å; V174-H176 PolarHBondContact O-CE1 2.92Å; V174-H176 PolarHBondContact O-ND1 3.45Å |
| 175 | F | 89.1 | Confident | 90.6 | Very high | 148 Ų | 148 | 53.2 Ų | 53.2 | 65% | 0.649 | 26% | 0.26 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.4 | -3.5 | -177.3 | -62.8 | -67.8 | 0 | 0 | 0 | 114.2 | L170 R177 | L170-F175 HydrophobicContact CB-CD2 4.45Å; L170-F175 HydrophobicContact CB-CE2 4.31Å; L170-F175 WeakPolarHBondContact O-CD2 3.3Å; L170-F175 PolarHBondContact O-N 3.16Å; F175-R177 PolarHBondContact O-N 3.43Å |
| 176 | H | 84.4 | Confident | 90.6 | Very high | 80 Ų | 80 | 59.3 Ų | 59.3 | 37% | 0.37 | 29% | 0.287 | S | S | . | . | trans | 53.3 | 35.8 | 175.9 | -62.2 | 72 | 0 | 0 | 0 | 113.6 | M104 Q111 F172 V174 K178 | M104-H176 HydrophobicContact CE-CB 4.23Å; Q111-H176 PolarHBondContact NE2-CE1 2.72Å; Q111-H176 VanDerWaalsContact NE2-CE1 3.27Å; Q111-H176 PolarHBondContact NE2-NE2 2.74Å; F172-H176 WeakPolarHBondContact O-CA 3.45Å; F172-H176 PolarHBondContact O-N 2.86Å; F172-H176 VanDerWaalsContact O-N 3.13Å; V174-H176 VanDerWaalsContact C-N 3.34Å; V174-H176 PolarHBondContact O-CE1 2.92Å; V174-H176 PolarHBondContact O-ND1 3.45Å; H176-K178 PolarHBondContact O-N 3.15Å | ||
| 177 | R | 85.9 | Confident | 90.6 | Very high | 134 Ų | 134 | 59.5 Ų | 59.5 | 51% | 0.506 | 29% | 0.287 | S | S | . | . | trans | -81.1 | 117.2 | -172.9 | -166.2 | 178 | -169.9 | 168.9 | 3 | 111.5 | D171 F175 D179 | D171-R177 VanDerWaalsContact O-CB 3.31Å; D171-R177 WeakPolarHBondContact O-CB 3.4Å; D171-R177 PolarHBondContact O-N 3.37Å; D171-R177 VanDerWaalsContact O-N 3.12Å; D171-R177 WeakPolarHBondContact OD1-CD 3.26Å; D171-R177 IonicContact OD1-NH1 3.26Å; D171-R177 PolarHBondContact OD1-NH1 2.88Å; D171-R177 WeakPolarHBondContact OD2-CD 2.99Å; D171-R177 IonicContact OD2-NH1 3.84Å; F175-R177 PolarHBondContact O-N 3.43Å; R177-D179 PolarHBondContact O-N 2.82Å; R177-D179 VanDerWaalsContact O-N 3.08Å | ||
| 178 | K | 83.4 | Confident | 90.5 | Very high | 108 Ų | 108 | 54.8 Ų | 54.8 | 47% | 0.47 | 27% | 0.27 | S | S | . | . | trans | -71.3 | 99.1 | 171 | -60.2 | -162.9 | 180 | -157.7 | 0 | 110.6 | D99 E101 H176 | D99-K178 IonicContact OD1-NZ 2.82Å; D99-K178 IonicContact OD2-NZ 2.62Å; D99-K178 PolarHBondContact OD2-NZ 3.41Å; E101-K178 WeakPolarHBondContact OE1-CE 3.34Å; E101-K178 IonicContact OE1-NZ 2.64Å; E101-K178 PolarHBondContact OE1-NZ 3.45Å; E101-K178 IonicContact OE2-NZ 3.15Å; E101-K178 PolarHBondContact OE2-NZ 2.78Å; H176-K178 PolarHBondContact O-N 3.15Å | ||
| 179 | D | 86.5 | Confident | 90.6 | Very high | 27 Ų | 27 | 54.3 Ų | 54.3 | 14% | 0.144 | 27% | 0.268 | C | S | . | . | trans | -73.6 | 153.5 | 169.5 | -80.3 | -41.2 | 0 | 0 | 0 | 112 | R177 V183 F184 K187 | R177-D179 PolarHBondContact O-N 2.82Å; R177-D179 VanDerWaalsContact O-N 3.08Å; D179-V183 HydrophobicContact CB-CB 4.37Å; D179-V183 HydrophobicContact CB-CG1 4.25Å; D179-V183 WeakPolarHBondContact OD1-CG1 3.37Å; D179-F184 HydrophobicContact CB-CB 4.01Å; D179-K187 IonicContact OD1-NZ 3.97Å; D179-K187 PolarHBondContact OD1-NZ 2.97Å; D179-K187 WeakPolarHBondContact OD2-CD 3.32Å; D179-K187 WeakPolarHBondContact OD2-CE 3.19Å; D179-K187 IonicContact OD2-NZ 2.65Å; D179-K187 PolarHBondContact OD2-NZ 3.4Å | ||
| 180 | S | 89.9 | Confident | 90.8 | Very high | 62 Ų | 62 | 54.7 Ų | 54.7 | 43% | 0.434 | 28% | 0.275 | S | S | . | . | trans | -71.6 | 151.7 | 163.3 | 74.4 | 0 | 0 | 0 | 0 | 110.3 | N182 V183 F184 | S180-N182 PolarHBondContact O-N 3.11Å; S180-N182 VanDerWaalsContact O-N 3.1Å; S180-V183 PolarHBondContact O-N 3.46Å; S180-V183 WeakPolarHBondContact OG-CG2 3.09Å; S180-F184 PolarHBondContact O-N 2.97Å | ||
| 181 | P | 89.1 | Confident | 90.9 | Very high | 56 Ų | 56 | 54.7 Ų | 54.7 | 36% | 0.364 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -50.5 | -40.9 | -176.9 | -32.9 | 37.6 | 0 | 0 | 0 | 114.6 | L185 L265 | P181-L185 WeakPolarHBondContact O-CB 3.45Å; P181-L185 VanDerWaalsContact O-CG 3.27Å; P181-L185 WeakPolarHBondContact O-CG 3.41Å; P181-L185 PolarHBondContact O-N 3.05Å; P181-L265 HydrophobicContact CB-CD1 3.61Å; P181-L265 HydrophobicContact CB-CD2 4.4Å; P181-L265 HydrophobicContact CG-CD1 4.26Å |
| 182 | N | 91 | Very high | 91 | Very high | 106 Ų | 106 | 55.1 Ų | 55.1 | 57% | 0.567 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -71.8 | -33.7 | 179.6 | -64.7 | -10.3 | 0 | 0 | 0 | 112.6 | S180 F186 L247 | S180-N182 PolarHBondContact O-N 3.11Å; S180-N182 VanDerWaalsContact O-N 3.1Å; N182-F186 WeakPolarHBondContact O-CB 3.39Å; N182-F186 PolarHBondContact O-N 3.35Å; N182-L247 HydrophobicContact CB-CD1 4.07Å |
| 183 | V | 92.9 | Very high | 91.3 | Very high | 62 Ų | 62 | 54.8 Ų | 54.8 | 38% | 0.376 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -71.3 | -43 | 176.3 | 171.8 | 0 | 0 | 0 | 0 | 110.3 | D179 S180 F186 K187 | D179-V183 HydrophobicContact CB-CB 4.37Å; D179-V183 HydrophobicContact CB-CG1 4.25Å; D179-V183 WeakPolarHBondContact OD1-CG1 3.37Å; S180-V183 PolarHBondContact O-N 3.46Å; S180-V183 WeakPolarHBondContact OG-CG2 3.09Å; V183-F186 PolarHBondContact O-N 3.32Å; V183-K187 HydrophobicContact CG1-CD 4.44Å; V183-K187 WeakPolarHBondContact O-CG 3.2Å; V183-K187 PolarHBondContact O-N 3.23Å |
| 184 | F | 91.9 | Very high | 91.7 | Very high | 22 Ų | 22 | 53.7 Ų | 53.7 | 10% | 0.096 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -59.7 | -52.4 | 174.5 | -178.2 | -92.6 | 0 | 0 | 0 | 111.5 | M100 F172 D179 S180 F186 K187 L188 P264 L265 | M100-F184 HydrophobicContact CE-CB 3.89Å; M100-F184 HydrophobicContact CE-CD1 3.87Å; M100-F184 HydrophobicContact CE-CD2 3.9Å; M100-F184 HydrophobicContact CE-CE1 4.42Å; M100-F184 HydrophobicContact CE-CE2 4.44Å; M100-F184 HydrophobicContact CE-CG 3.58Å; M100-F184 HydrophobicContact SD-CD2 4.21Å; M100-F184 HydrophobicContact SD-CE2 4.35Å; M100-F184 HydrophobicContact SD-CG 4.47Å; F172-F184 HydrophobicContact CD2-CE2 4.11Å; F172-F184 HydrophobicContact CE2-CD2 4.46Å; F172-F184 AromaticContact CE2-CE2 3.93Å; F172-F184 HydrophobicContact CE2-CE2 3.93Å; D179-F184 HydrophobicContact CB-CB 4.01Å; S180-F184 PolarHBondContact O-N 2.97Å; F184-F186 VanDerWaalsContact C-N 3.26Å; F184-F186 PolarHBondContact O-N 3.45Å; F184-K187 PolarHBondContact O-N 2.95Å; F184-L188 HydrophobicContact CE1-CB 4.47Å; F184-L188 HydrophobicContact CE1-CD2 3.86Å; F184-L188 HydrophobicContact CZ-CD2 4.38Å; F184-L188 WeakPolarHBondContact O-CB 2.99Å; F184-L188 PolarHBondContact O-N 2.93Å; F184-P264 HydrophobicContact CE1-CB 3.93Å; F184-P264 HydrophobicContact CE1-CG 4.25Å; F184-P264 VanDerWaalsContact CE1-O 3.26Å; F184-P264 WeakPolarHBondContact CE1-O 3.35Å; F184-P264 HydrophobicContact CE2-CG 4.38Å; F184-P264 HydrophobicContact CZ-CB 4.02Å; F184-P264 HydrophobicContact CZ-CG 3.83Å; F184-L265 HydrophobicContact CD1-CD1 4.22Å |
| 185 | L | 93.9 | Very high | 91.8 | Very high | 7 Ų | 7 | 52.3 Ų | 52.3 | 4% | 0.037 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -63.4 | -29.7 | 178.4 | -70 | 175.5 | 0 | 0 | 0 | 112.7 | P181 G189 P246 L247 N251 L265 I266 | P181-L185 WeakPolarHBondContact O-CB 3.45Å; P181-L185 VanDerWaalsContact O-CG 3.27Å; P181-L185 WeakPolarHBondContact O-CG 3.41Å; P181-L185 PolarHBondContact O-N 3.05Å; L185-G189 WeakPolarHBondContact O-CA 3.26Å; L185-G189 PolarHBondContact O-N 2.94Å; L185-P246 HydrophobicContact CD2-CB 4.07Å; L185-L247 HydrophobicContact CB-CB 4.47Å; L185-L247 HydrophobicContact CB-CD1 4.07Å; L185-N251 HydrophobicContact CD1-CB 4.12Å; L185-L265 HydrophobicContact CD1-CB 4.49Å; L185-L265 HydrophobicContact CD2-CB 4.12Å; L185-L265 HydrophobicContact CG-CB 4.43Å; L185-L265 HydrophobicContact CG-CD1 4.32Å; L185-I266 HydrophobicContact CD2-CD1 3.72Å |
| 186 | F | 95.3 | Very high | 92.1 | Very high | 143 Ų | 143 | 45.7 Ų | 45.7 | 63% | 0.627 | 24% | 0.238 | S | C | * | . | H | α-helix | trans | -71 | -44.4 | 172.7 | 179.8 | -95.3 | 0 | 0 | 0 | 112.5 | N182 V183 F184 G189 G190 L247 | N182-F186 WeakPolarHBondContact O-CB 3.39Å; N182-F186 PolarHBondContact O-N 3.35Å; V183-F186 PolarHBondContact O-N 3.32Å; F184-F186 VanDerWaalsContact C-N 3.26Å; F184-F186 PolarHBondContact O-N 3.45Å; F186-G189 PolarHBondContact O-N 3.43Å; F186-G190 PolarHBondContact O-N 2.95Å; F186-L247 HydrophobicContact CB-CD2 4.44Å; F186-L247 HydrophobicContact CD2-CD2 4.25Å |
| 187 | K | 94.3 | Very high | 92.7 | Very high | 23 Ų | 23 | 41.9 Ų | 41.9 | 10% | 0.1 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -59.4 | -52.5 | 174.2 | -74.6 | 177.5 | -169.8 | 172.5 | 0 | 110.7 | D171 D179 V183 F184 G189 G190 V191 | D171-K187 IonicContact OD2-NZ 2.73Å; D171-K187 PolarHBondContact OD2-NZ 2.73Å; D179-K187 IonicContact OD1-NZ 3.97Å; D179-K187 PolarHBondContact OD1-NZ 2.97Å; D179-K187 WeakPolarHBondContact OD2-CD 3.32Å; D179-K187 WeakPolarHBondContact OD2-CE 3.19Å; D179-K187 IonicContact OD2-NZ 2.65Å; D179-K187 PolarHBondContact OD2-NZ 3.4Å; V183-K187 HydrophobicContact CG1-CD 4.44Å; V183-K187 WeakPolarHBondContact O-CG 3.2Å; V183-K187 PolarHBondContact O-N 3.23Å; F184-K187 PolarHBondContact O-N 2.95Å; K187-G189 PolarHBondContact O-N 2.96Å; K187-G190 PolarHBondContact O-N 3.46Å; K187-V191 WeakPolarHBondContact O-CG2 3.39Å; K187-V191 PolarHBondContact O-N 3.49Å; K187-V191 VanDerWaalsContact O-N 3.1Å |
| 188 | L | 93.8 | Very high | 93.1 | Very high | 26 Ų | 26 | 35.5 Ų | 35.5 | 14% | 0.136 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -60.7 | -44.7 | 177.8 | -177 | 57.9 | 0 | 0 | 0 | 111.3 | F184 G190 V191 T192 F263 I266 | F184-L188 HydrophobicContact CE1-CB 4.47Å; F184-L188 HydrophobicContact CE1-CD2 3.86Å; F184-L188 HydrophobicContact CZ-CD2 4.38Å; F184-L188 WeakPolarHBondContact O-CB 2.99Å; F184-L188 PolarHBondContact O-N 2.93Å; L188-G190 VanDerWaalsContact C-N 3.32Å; L188-G190 PolarHBondContact O-N 2.95Å; L188-V191 WeakPolarHBondContact O-CB 3.37Å; L188-V191 PolarHBondContact O-N 3.37Å; L188-V191 VanDerWaalsContact O-N 3.11Å; L188-T192 WeakPolarHBondContact O-CB 3.26Å; L188-T192 PolarHBondContact O-N 3.35Å; L188-T192 PolarHBondContact O-OG1 3.29Å; L188-T192 VanDerWaalsContact O-OG1 3.07Å; L188-F263 HydrophobicContact CD1-CD1 4.01Å; L188-F263 HydrophobicContact CD1-CE1 3.92Å; L188-F263 HydrophobicContact CD2-CD1 4.03Å; L188-I266 HydrophobicContact CD2-CD1 3.9Å; L188-I266 HydrophobicContact CD2-CG1 3.71Å |
| 189 | G | 95.8 | Very high | 93.6 | Very high | 9 Ų | 9 | 30.4 Ų | 30.4 | 9% | 0.093 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -58.8 | -38.8 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | L185 F186 K187 T192 A193 A243 | L185-G189 WeakPolarHBondContact O-CA 3.26Å; L185-G189 PolarHBondContact O-N 2.94Å; F186-G189 PolarHBondContact O-N 3.43Å; K187-G189 PolarHBondContact O-N 2.96Å; G189-T192 PolarHBondContact O-N 2.96Å; G189-A193 WeakPolarHBondContact O-CB 3.47Å; G189-A193 PolarHBondContact O-N 3.4Å; G189-A243 WeakPolarHBondContact O-CB 3.47Å |
| 190 | G | 96.1 | Very high | 94 | Very high | 19 Ų | 19 | 29.4 Ų | 29.4 | 20% | 0.196 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -63 | -40.5 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | F186 K187 L188 S194 | F186-G190 PolarHBondContact O-N 2.95Å; K187-G190 PolarHBondContact O-N 3.46Å; L188-G190 VanDerWaalsContact C-N 3.32Å; L188-G190 PolarHBondContact O-N 2.95Å; G190-S194 WeakPolarHBondContact O-CB 3.48Å; G190-S194 PolarHBondContact O-N 3.1Å; G190-S194 PolarHBondContact O-OG 3.48Å |
| 191 | V | 94.6 | Very high | 94.2 | Very high | 18 Ų | 18 | 26.4 Ų | 26.4 | 11% | 0.109 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -64.4 | -52.5 | 173.4 | 174.3 | 0 | 0 | 0 | 0 | 110.8 | I164 F165 K187 L188 A193 S194 F195 | I164-V191 HydrophobicContact CB-CG2 4.39Å; I164-V191 HydrophobicContact CG2-CG2 3.8Å; F165-V191 HydrophobicContact CB-CG2 4.2Å; F165-V191 HydrophobicContact CD2-CG1 4.04Å; K187-V191 WeakPolarHBondContact O-CG2 3.39Å; K187-V191 PolarHBondContact O-N 3.49Å; K187-V191 VanDerWaalsContact O-N 3.1Å; L188-V191 WeakPolarHBondContact O-CB 3.37Å; L188-V191 PolarHBondContact O-N 3.37Å; L188-V191 VanDerWaalsContact O-N 3.11Å; V191-A193 PolarHBondContact O-N 3.47Å; V191-S194 PolarHBondContact O-N 2.84Å; V191-F195 HydrophobicContact CG1-CD2 3.61Å; V191-F195 HydrophobicContact CG1-CE2 3.61Å; V191-F195 WeakPolarHBondContact O-CD2 3.48Å; V191-F195 PolarHBondContact O-N 3.41Å |
| 192 | T | 95.1 | Very high | 94.3 | Very high | 21 Ų | 21 | 24.1 Ų | 24.1 | 13% | 0.129 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -61 | -42.4 | -180 | -58.5 | 0 | 0 | 0 | 0 | 112.3 | L188 G189 S194 F195 T196 A243 | L188-T192 WeakPolarHBondContact O-CB 3.26Å; L188-T192 PolarHBondContact O-N 3.35Å; L188-T192 PolarHBondContact O-OG1 3.29Å; L188-T192 VanDerWaalsContact O-OG1 3.07Å; G189-T192 PolarHBondContact O-N 2.96Å; T192-S194 VanDerWaalsContact C-N 3.34Å; T192-S194 PolarHBondContact O-N 2.83Å; T192-F195 PolarHBondContact O-N 3.04Å; T192-T196 VanDerWaalsContact O-CB 3.26Å; T192-T196 WeakPolarHBondContact O-CB 3.5Å; T192-T196 PolarHBondContact O-N 3.36Å; T192-T196 PolarHBondContact O-OG1 3.32Å; T192-A243 HydrophobicContact CG2-CB 3.96Å |
| 193 | A | 96.9 | Very high | 94.4 | Very high | 12 Ų | 12 | 21.5 Ų | 21.5 | 10% | 0.099 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -61.1 | -44.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | G189 V191 A197 I240 A243 | G189-A193 WeakPolarHBondContact O-CB 3.47Å; G189-A193 PolarHBondContact O-N 3.4Å; V191-A193 PolarHBondContact O-N 3.47Å; A193-A197 VanDerWaalsContact O-CB 3.22Å; A193-A197 WeakPolarHBondContact O-CB 3.38Å; A193-A197 PolarHBondContact O-N 3.21Å; A193-I240 HydrophobicContact CB-CG1 4.38Å; A193-A243 HydrophobicContact CB-CB 3.63Å |
| 194 | S | 96.1 | Very high | 94.5 | Very high | 6 Ų | 6 | 19.6 Ų | 19.6 | 4% | 0.042 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -66.9 | -44.2 | -179.2 | -57.8 | 0 | 0 | 0 | 0 | 111.8 | G161 G190 V191 T192 A197 S198 | G161-S194 PolarHBondContact N-OG 3.24Å; G190-S194 WeakPolarHBondContact O-CB 3.48Å; G190-S194 PolarHBondContact O-N 3.1Å; G190-S194 PolarHBondContact O-OG 3.48Å; V191-S194 PolarHBondContact O-N 2.84Å; T192-S194 VanDerWaalsContact C-N 3.34Å; T192-S194 PolarHBondContact O-N 2.83Å; S194-A197 PolarHBondContact O-N 3.35Å; S194-S198 WeakPolarHBondContact O-CB 3.4Å; S194-S198 PolarHBondContact O-N 3.2Å |
| 195 | F | 92.5 | Very high | 94.4 | Very high | 10 Ų | 10 | 18.8 Ų | 18.8 | 4% | 0.044 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -68.6 | -40 | 176.2 | -77.6 | -57.8 | 0 | 0 | 0 | 113 | F165 V191 T192 A197 S198 V199 W351 C381 | F165-F195 HydrophobicContact CD2-CE2 4.21Å; V191-F195 HydrophobicContact CG1-CD2 3.61Å; V191-F195 HydrophobicContact CG1-CE2 3.61Å; V191-F195 WeakPolarHBondContact O-CD2 3.48Å; V191-F195 PolarHBondContact O-N 3.41Å; T192-F195 PolarHBondContact O-N 3.04Å; F195-A197 VanDerWaalsContact C-N 3.31Å; F195-A197 PolarHBondContact O-N 2.91Å; F195-S198 WeakPolarHBondContact O-CB 3.5Å; F195-S198 PolarHBondContact O-N 3.47Å; F195-V199 WeakPolarHBondContact O-CG2 3.35Å; F195-V199 PolarHBondContact O-N 2.82Å; F195-W351 HydrophobicContact CB-CH2 4.25Å; F195-C381 HydrophobicContact CD1-CB 4.44Å; F195-C381 HydrophobicContact CE1-CB 3.68Å; F195-C381 HydrophobicContact CE2-CB 3.96Å; F195-C381 HydrophobicContact CZ-CB 3.44Å; F195-C381 VanDerWaalsContact CZ-CB 3.44Å |
| 196 | T | 95.4 | Very high | 94.2 | Very high | 9 Ų | 9 | 18.4 Ų | 18.4 | 6% | 0.055 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -62.9 | -39.6 | 174.2 | -52.7 | 0 | 0 | 0 | 0 | 110.8 | T192 G200 W274 | T192-T196 VanDerWaalsContact O-CB 3.26Å; T192-T196 WeakPolarHBondContact O-CB 3.5Å; T192-T196 PolarHBondContact O-N 3.36Å; T192-T196 PolarHBondContact O-OG1 3.32Å; T196-G200 PolarHBondContact O-N 3.01Å; T196-W274 PolarHBondContact OG1-NE1 3.14Å |
| 197 | A | 96.5 | Very high | 94 | Very high | 0 Ų | 0 | 14.2 Ų | 14.2 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -69.9 | -31.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | A157 A193 S194 F195 S201 M235 W236 S239 | A157-A197 HydrophobicContact CB-CB 4.06Å; A193-A197 VanDerWaalsContact O-CB 3.22Å; A193-A197 WeakPolarHBondContact O-CB 3.38Å; A193-A197 PolarHBondContact O-N 3.21Å; S194-A197 PolarHBondContact O-N 3.35Å; F195-A197 VanDerWaalsContact C-N 3.31Å; F195-A197 PolarHBondContact O-N 2.91Å; A197-S201 VanDerWaalsContact O-CB 3.28Å; A197-S201 WeakPolarHBondContact O-CB 3.34Å; A197-S201 PolarHBondContact O-N 3.01Å; A197-S201 PolarHBondContact O-OG 2.98Å; A197-M235 HydrophobicContact CB-SD 4.15Å; A197-W236 HydrophobicContact CB-CD2 4.06Å; A197-W236 HydrophobicContact CB-CE3 4.08Å; A197-W236 HydrophobicContact CB-CH2 4.19Å; A197-W236 HydrophobicContact CB-CZ2 4.17Å; A197-W236 HydrophobicContact CB-CZ3 4.14Å; A197-S239 PolarHBondContact N-OG 2.84Å |
| 198 | S | 94.8 | Very high | 93.8 | Very high | 0 Ų | 0 | 13.3 Ų | 13.3 | 0% | 0 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -66.4 | -51.7 | 173.4 | -177.2 | 0 | 0 | 0 | 0 | 110.5 | L154 D158 S194 F195 G200 S201 L202 | L154-S198 WeakPolarHBondContact CD1-OG 3.22Å; D158-S198 PolarHBondContact OD1-OG 3.27Å; S194-S198 WeakPolarHBondContact O-CB 3.4Å; S194-S198 PolarHBondContact O-N 3.2Å; F195-S198 WeakPolarHBondContact O-CB 3.5Å; F195-S198 PolarHBondContact O-N 3.47Å; S198-G200 PolarHBondContact O-N 3.38Å; S198-S201 PolarHBondContact O-N 3.4Å; S198-S201 VanDerWaalsContact O-N 3.15Å; S198-L202 WeakPolarHBondContact O-CG 3.49Å; S198-L202 PolarHBondContact O-N 3.19Å |
| 199 | V | 93.6 | Very high | 93.6 | Very high | 1 Ų | 1 | 15.4 Ų | 15.4 | 1% | 0.006 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -60.2 | -43.4 | 173.6 | 177.2 | 0 | 0 | 0 | 0 | 111.6 | F195 S201 L202 F203 L281 V282 I285 W351 | F195-V199 WeakPolarHBondContact O-CG2 3.35Å; F195-V199 PolarHBondContact O-N 2.82Å; V199-S201 VanDerWaalsContact C-N 3.32Å; V199-S201 PolarHBondContact O-N 3.42Å; V199-L202 WeakPolarHBondContact O-CB 3.47Å; V199-L202 PolarHBondContact O-N 3.44Å; V199-F203 WeakPolarHBondContact O-CB 3.5Å; V199-F203 PolarHBondContact O-N 3.06Å; V199-L281 HydrophobicContact CG1-CB 3.83Å; V199-L281 HydrophobicContact CG1-CD1 4.18Å; V199-V282 HydrophobicContact CG1-CG2 4.33Å; V199-I285 HydrophobicContact CG1-CD1 4.22Å; V199-W351 HydrophobicContact CG2-CH2 3.58Å; V199-W351 HydrophobicContact CG2-CZ2 3.17Å; V199-W351 HydrophobicContact CG2-CZ3 4.41Å |
| 200 | G | 94.9 | Very high | 93.2 | Very high | 5 Ų | 5 | 18.8 Ų | 18.8 | 5% | 0.052 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -61.5 | -37 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | T196 S198 F203 L204 | T196-G200 PolarHBondContact O-N 3.01Å; S198-G200 PolarHBondContact O-N 3.38Å; G200-F203 PolarHBondContact O-N 2.96Å; G200-L204 WeakPolarHBondContact O-CG 3.23Å; G200-L204 PolarHBondContact O-N 3.26Å |
| 201 | S | 94.8 | Very high | 92.9 | Very high | 0 Ų | 0 | 19.5 Ų | 19.5 | 0% | 0 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -70.4 | -35.6 | 174.6 | -60.5 | 0 | 0 | 0 | 0 | 112.3 | S153 A197 S198 V199 T205 M235 | S153-S201 PolarHBondContact OG-OG 2.9Å; A197-S201 VanDerWaalsContact O-CB 3.28Å; A197-S201 WeakPolarHBondContact O-CB 3.34Å; A197-S201 PolarHBondContact O-N 3.01Å; A197-S201 PolarHBondContact O-OG 2.98Å; S198-S201 PolarHBondContact O-N 3.4Å; S198-S201 VanDerWaalsContact O-N 3.15Å; V199-S201 VanDerWaalsContact C-N 3.32Å; V199-S201 PolarHBondContact O-N 3.42Å; S201-T205 WeakPolarHBondContact O-CB 3.33Å; S201-T205 PolarHBondContact O-N 2.93Å; S201-T205 PolarHBondContact O-OG1 3.08Å; S201-M235 WeakPolarHBondContact OG-CE 3.35Å |
| 202 | L | 90.9 | Very high | 92.4 | Very high | 8 Ų | 8 | 20 Ų | 20 | 4% | 0.042 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -65.9 | -40.4 | 171.1 | -70.4 | 171.9 | 0 | 0 | 0 | 111.7 | L154 S198 V199 T205 A206 I285 L347 | L154-L202 HydrophobicContact CD1-CG 4.35Å; L154-L202 HydrophobicContact CD2-CD2 3.77Å; L154-L202 HydrophobicContact CD2-CG 4.25Å; S198-L202 WeakPolarHBondContact O-CG 3.49Å; S198-L202 PolarHBondContact O-N 3.19Å; V199-L202 WeakPolarHBondContact O-CB 3.47Å; V199-L202 PolarHBondContact O-N 3.44Å; L202-T205 WeakPolarHBondContact O-CB 3.14Å; L202-T205 PolarHBondContact O-N 2.95Å; L202-A206 PolarHBondContact O-N 3.31Å; L202-I285 HydrophobicContact CB-CD1 4.02Å; L202-L347 HydrophobicContact CD1-CD1 4.19Å |
| 203 | F | 93.1 | Very high | 91.9 | Very high | 50 Ų | 50 | 22.2 Ų | 22.2 | 22% | 0.219 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -62.7 | -48.3 | 174.2 | 174.5 | -98.9 | 0 | 0 | 0 | 112.4 | V199 G200 T205 A206 I207 L281 F284 I285 | V199-F203 WeakPolarHBondContact O-CB 3.5Å; V199-F203 PolarHBondContact O-N 3.06Å; G200-F203 PolarHBondContact O-N 2.96Å; F203-T205 VanDerWaalsContact C-N 3.26Å; F203-T205 PolarHBondContact O-N 3.46Å; F203-A206 WeakPolarHBondContact O-CB 3.45Å; F203-A206 PolarHBondContact O-N 3.12Å; F203-A206 VanDerWaalsContact O-N 3.1Å; F203-I207 HydrophobicContact CD1-CD1 3.91Å; F203-I207 HydrophobicContact CE1-CD1 3.39Å; F203-I207 HydrophobicContact CE1-CG1 4.49Å; F203-I207 HydrophobicContact CE2-CD1 4.32Å; F203-I207 HydrophobicContact CZ-CD1 3.63Å; F203-I207 PolarHBondContact O-N 3.13Å; F203-L281 HydrophobicContact CB-CD2 4.41Å; F203-L281 HydrophobicContact CD1-CD2 4.26Å; F203-L281 HydrophobicContact CD2-CD2 3.74Å; F203-L281 HydrophobicContact CE1-CD2 4.43Å; F203-L281 HydrophobicContact CE2-CD2 3.93Å; F203-L281 HydrophobicContact CG-CD2 3.9Å; F203-L281 HydrophobicContact CZ-CD2 4.27Å; F203-F284 HydrophobicContact CD2-CB 4.5Å; F203-F284 AromaticContact CD2-CD1 3.59Å; F203-F284 HydrophobicContact CD2-CD1 3.59Å; F203-F284 HydrophobicContact CD2-CE1 4.13Å; F203-F284 HydrophobicContact CD2-CG 4.26Å; F203-F284 HydrophobicContact CE2-CB 4.23Å; F203-F284 AromaticContact CE2-CD1 3.27Å; F203-F284 HydrophobicContact CE2-CD1 3.27Å; F203-F284 HydrophobicContact CE2-CD2 4.41Å; F203-F284 AromaticContact CE2-CE1 3.62Å; F203-F284 HydrophobicContact CE2-CE1 3.62Å; F203-F284 AromaticContact CE2-CG 3.73Å; F203-F284 HydrophobicContact CE2-CG 3.73Å; F203-F284 HydrophobicContact CE2-CZ 4.32Å; F203-F284 HydrophobicContact CZ-CD1 4.39Å; F203-F284 HydrophobicContact CZ-CE1 4.38Å; F203-I285 HydrophobicContact CB-CD1 4.05Å; F203-I285 HydrophobicContact CB-CG1 4.12Å; F203-I285 HydrophobicContact CD2-CG1 4.41Å |
| 204 | L | 93.6 | Very high | 91.2 | Very high | 22 Ų | 22 | 24.3 Ų | 24.3 | 12% | 0.115 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -60.6 | -36.6 | 173.8 | -71 | 175.8 | 0 | 0 | 0 | 112 | F150 G200 I207 D208 A231 F232 M235 | F150-L204 HydrophobicContact CD1-CB 3.85Å; F150-L204 HydrophobicContact CD1-CD1 4.08Å; F150-L204 HydrophobicContact CE1-CB 4.06Å; F150-L204 HydrophobicContact CE1-CD1 4.1Å; F150-L204 HydrophobicContact CG-CB 4.26Å; G200-L204 WeakPolarHBondContact O-CG 3.23Å; G200-L204 PolarHBondContact O-N 3.26Å; L204-I207 PolarHBondContact O-N 2.67Å; L204-D208 PolarHBondContact O-N 2.97Å; L204-A231 HydrophobicContact CD2-CB 4.17Å; L204-F232 HydrophobicContact CD1-CB 4.18Å; L204-M235 HydrophobicContact CD1-CB 3.98Å; L204-M235 HydrophobicContact CD1-CE 4.25Å; L204-M235 HydrophobicContact CD1-CG 4.15Å |
| 205 | T | 91.1 | Very high | 90.7 | Very high | 5 Ų | 5 | 31.3 Ų | 31.3 | 3% | 0.031 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -65.7 | -41.6 | 173.1 | -60 | 0 | 0 | 0 | 0 | 111.7 | S201 L202 F203 I207 D208 R209 | S201-T205 WeakPolarHBondContact O-CB 3.33Å; S201-T205 PolarHBondContact O-N 2.93Å; S201-T205 PolarHBondContact O-OG1 3.08Å; L202-T205 WeakPolarHBondContact O-CB 3.14Å; L202-T205 PolarHBondContact O-N 2.95Å; F203-T205 VanDerWaalsContact C-N 3.26Å; F203-T205 PolarHBondContact O-N 3.46Å; T205-I207 VanDerWaalsContact C-N 3.33Å; T205-I207 PolarHBondContact O-N 3.4Å; T205-D208 PolarHBondContact O-N 3.13Å; T205-R209 WeakPolarHBondContact O-CG 3.4Å; T205-R209 PolarHBondContact O-N 3.18Å |
| 206 | A | 89.5 | Confident | 90.4 | Very high | 0 Ų | 0 | 34.9 Ų | 34.9 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -61.9 | -40.6 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | L202 F203 R209 Y210 I285 A288 Y289 | L202-A206 PolarHBondContact O-N 3.31Å; F203-A206 WeakPolarHBondContact O-CB 3.45Å; F203-A206 PolarHBondContact O-N 3.12Å; F203-A206 VanDerWaalsContact O-N 3.1Å; A206-R209 PolarHBondContact O-N 2.98Å; A206-Y210 WeakPolarHBondContact O-CB 3.37Å; A206-Y210 PolarHBondContact O-N 2.89Å; A206-I285 HydrophobicContact CB-CG1 4.43Å; A206-A288 HydrophobicContact CB-CB 4.23Å; A206-Y289 HydrophobicContact CB-CE1 4.5Å; A206-Y289 HydrophobicContact CB-CE2 4.5Å |
| 207 | I | 91 | Very high | 90.1 | Very high | 55 Ų | 55 | 42.9 Ų | 42.9 | 28% | 0.282 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -63.2 | -46.6 | 173.6 | -69.5 | 174.3 | 0 | 0 | 0 | 111.8 | F203 L204 T205 R209 Y210 I211 F284 | F203-I207 HydrophobicContact CD1-CD1 3.91Å; F203-I207 HydrophobicContact CE1-CD1 3.39Å; F203-I207 HydrophobicContact CE1-CG1 4.49Å; F203-I207 HydrophobicContact CE2-CD1 4.32Å; F203-I207 HydrophobicContact CZ-CD1 3.63Å; F203-I207 PolarHBondContact O-N 3.13Å; L204-I207 PolarHBondContact O-N 2.67Å; T205-I207 VanDerWaalsContact C-N 3.33Å; T205-I207 PolarHBondContact O-N 3.4Å; I207-R209 VanDerWaalsContact C-N 3.29Å; I207-R209 PolarHBondContact O-N 2.99Å; I207-Y210 PolarHBondContact O-N 3.29Å; I207-I211 HydrophobicContact CG2-CD1 3.64Å; I207-I211 HydrophobicContact CG2-CG1 4.28Å; I207-I211 WeakPolarHBondContact O-CG1 3.42Å; I207-I211 PolarHBondContact O-N 3.16Å; I207-F284 HydrophobicContact CG1-CE1 4.29Å |
| 208 | D | 90.9 | Very high | 89.8 | Confident | 3 Ų | 3 | 44.1 Ų | 44.1 | 2% | 0.016 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -54.1 | -47.1 | 174.8 | 172.4 | 74.2 | 0 | 0 | 0 | 111.2 | F150 L204 T205 S212 Y219 | F150-D208 HydrophobicContact CD2-CB 4.21Å; F150-D208 HydrophobicContact CE2-CB 4.05Å; L204-D208 PolarHBondContact O-N 2.97Å; T205-D208 PolarHBondContact O-N 3.13Å; D208-S212 WeakPolarHBondContact O-CB 3.44Å; D208-S212 PolarHBondContact O-N 3.44Å; D208-S212 PolarHBondContact O-OG 3.47Å; D208-Y219 VanDerWaalsContact OD1-CE2 3.28Å; D208-Y219 WeakPolarHBondContact OD1-CE2 3.26Å; D208-Y219 PolarHBondContact OD1-OH 3.5Å |
| 209 | R | 87.6 | Confident | 89.6 | Confident | 70 Ų | 70 | 46.3 Ų | 46.3 | 26% | 0.264 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -66 | -44.6 | 178.1 | -61.8 | -47.7 | 176.1 | -164.8 | -8.1 | 112.3 | T205 A206 I207 I211 S212 I213 I292 | T205-R209 WeakPolarHBondContact O-CG 3.4Å; T205-R209 PolarHBondContact O-N 3.18Å; A206-R209 PolarHBondContact O-N 2.98Å; I207-R209 VanDerWaalsContact C-N 3.29Å; I207-R209 PolarHBondContact O-N 2.99Å; R209-I211 PolarHBondContact O-N 3.24Å; R209-S212 WeakPolarHBondContact CA-OG 3.25Å; R209-S212 PolarHBondContact O-N 2.91Å; R209-S212 PolarHBondContact O-OG 3.18Å; R209-I213 PolarHBondContact O-N 2.82Å; R209-I213 VanDerWaalsContact O-N 3.15Å; R209-I292 HydrophobicContact CB-CD1 3.76Å |
| 210 | Y | 87.4 | Confident | 89.4 | Confident | 80 Ų | 80 | 56.8 Ų | 56.8 | 31% | 0.314 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -57 | -50.3 | 176.7 | -179.5 | -87.5 | 0 | 0 | 0 | 111.4 | A206 I207 S212 I213 H214 Y291 | A206-Y210 WeakPolarHBondContact O-CB 3.37Å; A206-Y210 PolarHBondContact O-N 2.89Å; I207-Y210 PolarHBondContact O-N 3.29Å; Y210-S212 PolarHBondContact O-N 2.73Å; Y210-I213 PolarHBondContact O-N 2.79Å; Y210-H214 HydrophobicContact CD1-CB 4.44Å; Y210-H214 HydrophobicContact CE1-CB 4.11Å; Y210-H214 AromaticContact CZ-ND1 3.65Å; Y210-H214 VanDerWaalsContact O-CB 3.27Å; Y210-H214 WeakPolarHBondContact O-CB 3.34Å; Y210-H214 PolarHBondContact O-N 2.96Å; Y210-H214 PolarHBondContact OH-ND1 2.77Å; Y210-Y291 AromaticContact CD2-CD1 3.87Å; Y210-Y291 HydrophobicContact CD2-CD1 3.87Å; Y210-Y291 HydrophobicContact CD2-CE1 4.1Å; Y210-Y291 AromaticContact CE2-CD1 3.54Å; Y210-Y291 HydrophobicContact CE2-CD1 3.54Å; Y210-Y291 AromaticContact CE2-CE1 3.49Å; Y210-Y291 HydrophobicContact CE2-CE1 3.49Å; Y210-Y291 VanDerWaalsContact CE2-CE1 3.49Å; Y210-Y291 HydrophobicContact CE2-CG 4.4Å |
| 211 | I | 89.8 | Confident | 89.2 | Confident | 35 Ų | 35 | 66 Ų | 66 | 18% | 0.179 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -63.3 | -42.5 | 179.1 | -62.2 | 168.6 | 0 | 0 | 0 | 110.6 | I207 R209 I213 H214 R215 Y219 I222 V223 | I207-I211 HydrophobicContact CG2-CD1 3.64Å; I207-I211 HydrophobicContact CG2-CG1 4.28Å; I207-I211 WeakPolarHBondContact O-CG1 3.42Å; I207-I211 PolarHBondContact O-N 3.16Å; R209-I211 PolarHBondContact O-N 3.24Å; I211-I213 PolarHBondContact O-N 2.68Å; I211-H214 PolarHBondContact O-N 3.41Å; I211-R215 PolarHBondContact O-N 3.19Å; I211-Y219 HydrophobicContact CG2-CD2 4.12Å; I211-I222 HydrophobicContact CD1-CG2 4.18Å; I211-I222 HydrophobicContact CG2-CB 4.28Å; I211-I222 HydrophobicContact CG2-CD1 4.06Å; I211-I222 HydrophobicContact CG2-CG2 3.99Å; I211-V223 HydrophobicContact CD1-CG2 4.2Å; I211-V223 HydrophobicContact CG2-CG2 4.17Å |
| 212 | S | 85.6 | Confident | 89 | Confident | 29 Ų | 29 | 69 Ų | 69 | 20% | 0.203 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -60.4 | -31.7 | -179.4 | 76.2 | 0 | 0 | 0 | 0 | 113.5 | D208 R209 Y210 P216 Y219 | D208-S212 WeakPolarHBondContact O-CB 3.44Å; D208-S212 PolarHBondContact O-N 3.44Å; D208-S212 PolarHBondContact O-OG 3.47Å; R209-S212 WeakPolarHBondContact CA-OG 3.25Å; R209-S212 PolarHBondContact O-N 2.91Å; R209-S212 PolarHBondContact O-OG 3.18Å; Y210-S212 PolarHBondContact O-N 2.73Å; S212-P216 WeakPolarHBondContact O-CA 3.36Å; S212-Y219 VanDerWaalsContact CA-CD2 3.5Å |
| 213 | I | 83.1 | Confident | 89.1 | Confident | 67 Ų | 67 | 69.5 Ų | 69.5 | 34% | 0.344 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -94.9 | -33.6 | -178.4 | -66.8 | 172.3 | 0 | 0 | 0 | 111.8 | R209 Y210 I211 I292 K295 | R209-I213 PolarHBondContact O-N 2.82Å; R209-I213 VanDerWaalsContact O-N 3.15Å; Y210-I213 PolarHBondContact O-N 2.79Å; I211-I213 PolarHBondContact O-N 2.68Å; I213-I292 HydrophobicContact CD1-CB 4.42Å; I213-I292 HydrophobicContact CD1-CG1 4.22Å; I213-I292 HydrophobicContact CD1-CG2 3.52Å; I213-K295 HydrophobicContact CG2-CD 4.12Å; I213-K295 HydrophobicContact CG2-CG 4.22Å |
| 214 | H | 83.6 | Confident | 89.1 | Confident | 55 Ų | 55 | 69.3 Ų | 69.3 | 26% | 0.255 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -78.2 | -38.8 | 179.1 | -161.6 | 121.1 | 0 | 0 | 0 | 112.2 | Y210 I211 Y291 K295 | Y210-H214 HydrophobicContact CD1-CB 4.44Å; Y210-H214 HydrophobicContact CE1-CB 4.11Å; Y210-H214 AromaticContact CZ-ND1 3.65Å; Y210-H214 VanDerWaalsContact O-CB 3.27Å; Y210-H214 WeakPolarHBondContact O-CB 3.34Å; Y210-H214 PolarHBondContact O-N 2.96Å; Y210-H214 PolarHBondContact OH-ND1 2.77Å; I211-H214 PolarHBondContact O-N 3.41Å; H214-Y291 PolarHBondContact ND1-OH 3.33Å; H214-K295 PolarHBondContact ND1-NZ 2.76Å |
| 215 | R | 85.9 | Confident | 89 | Confident | 154 Ų | 154 | 75.6 Ų | 75.6 | 58% | 0.581 | 34% | 0.344 | S | S | * | . | S | Bend | trans | -130.8 | 61.3 | -176.6 | -59.8 | -64.5 | -176.8 | -179.9 | -0 | 111.8 | I211 L217 A218 Y219 I222 | I211-R215 PolarHBondContact O-N 3.19Å; R215-L217 VanDerWaalsContact C-N 3.33Å; R215-L217 PolarHBondContact O-N 2.82Å; R215-A218 HydrophobicContact CB-CB 4.27Å; R215-A218 CarbonylContact O-C 3.58Å; R215-A218 PolarHBondContact O-N 3.36Å; R215-Y219 PolarHBondContact O-N 3.35Å; R215-I222 HydrophobicContact CB-CD1 4.33Å |
| 216 | P | 85.4 | Confident | 89 | Confident | 85 Ų | 85 | 79.6 Ų | 79.6 | 55% | 0.552 | 37% | 0.368 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.5 | -39.9 | -172.1 | 22.1 | -34 | 0 | 0 | 0 | 113.9 | S212 | S212-P216 WeakPolarHBondContact O-CA 3.36Š|
| 217 | L | 89.3 | Confident | 89.2 | Confident | 177 Ų | 177 | 85.3 Ų | 85.3 | 93% | 0.927 | 39% | 0.393 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.5 | -33.2 | 178.7 | -59.5 | 178.6 | 0 | 0 | 0 | 113 | R215 | R215-L217 VanDerWaalsContact C-N 3.33Å; R215-L217 PolarHBondContact O-N 2.82Å |
| 218 | A | 90.9 | Very high | 89.3 | Confident | 26 Ų | 26 | 82.8 Ų | 82.8 | 22% | 0.215 | 38% | 0.381 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -92.8 | -11.7 | -179.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | R215 R220 R221 I222 | R215-A218 HydrophobicContact CB-CB 4.27Å; R215-A218 CarbonylContact O-C 3.58Å; R215-A218 PolarHBondContact O-N 3.36Å; A218-R220 VanDerWaalsContact C-N 3.33Å; A218-R220 PolarHBondContact O-N 3.49Å; A218-R221 WeakPolarHBondContact O-CA 3.25Å; A218-R221 WeakPolarHBondContact O-CB 3.42Å; A218-R221 PolarHBondContact O-N 3.44Å; A218-I222 HydrophobicContact CB-CD1 3.73Å; A218-I222 HydrophobicContact CB-CG1 4.29Å; A218-I222 WeakPolarHBondContact O-CG1 3.39Å; A218-I222 PolarHBondContact O-N 3.39Å |
| 219 | Y | 90.6 | Very high | 89.4 | Confident | 45 Ų | 45 | 85.1 Ų | 85.1 | 18% | 0.176 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -49.3 | -49.2 | -175.7 | 172.4 | -101.1 | 0 | 0 | 0 | 112.8 | D208 I211 S212 R215 R221 I222 V223 | D208-Y219 VanDerWaalsContact OD1-CE2 3.28Å; D208-Y219 WeakPolarHBondContact OD1-CE2 3.26Å; D208-Y219 PolarHBondContact OD1-OH 3.5Å; I211-Y219 HydrophobicContact CG2-CD2 4.12Å; S212-Y219 VanDerWaalsContact CA-CD2 3.5Å; R215-Y219 PolarHBondContact O-N 3.35Å; Y219-R221 PolarHBondContact O-N 3.01Å; Y219-I222 PolarHBondContact O-N 3.31Å; Y219-I222 VanDerWaalsContact O-N 3.14Å; Y219-V223 HydrophobicContact CD2-CB 4.28Å; Y219-V223 HydrophobicContact CD2-CG2 3.88Å; Y219-V223 HydrophobicContact CE2-CB 3.87Å; Y219-V223 HydrophobicContact CE2-CG1 4.33Å; Y219-V223 HydrophobicContact CE2-CG2 3.65Å; Y219-V223 PolarHBondContact O-N 3.19Å |
| 220 | R | 87.8 | Confident | 89.8 | Confident | 221 Ų | 221 | 86.7 Ų | 86.7 | 83% | 0.834 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -62.5 | -23.5 | 179.6 | -66.5 | -171 | -178.1 | -167.5 | 3.7 | 114.2 | A218 | A218-R220 VanDerWaalsContact C-N 3.33Å; A218-R220 PolarHBondContact O-N 3.49Å |
| 221 | R | 90.9 | Very high | 90.1 | Very high | 200 Ų | 200 | 84.4 Ų | 84.4 | 76% | 0.755 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -89.2 | -31.8 | 176.5 | -172.3 | -179.4 | 70 | 172.8 | 2.4 | 112 | A218 Y219 | A218-R221 WeakPolarHBondContact O-CA 3.25Å; A218-R221 WeakPolarHBondContact O-CB 3.42Å; A218-R221 PolarHBondContact O-N 3.44Å; Y219-R221 PolarHBondContact O-N 3.01Å |
| 222 | I | 91.7 | Very high | 90.4 | Very high | 61 Ų | 61 | 85.1 Ų | 85.1 | 31% | 0.313 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -79.7 | -54.1 | -178.4 | -64 | 166 | 0 | 0 | 0 | 110.5 | I211 R215 A218 Y219 T224 K227 | I211-I222 HydrophobicContact CD1-CG2 4.18Å; I211-I222 HydrophobicContact CG2-CB 4.28Å; I211-I222 HydrophobicContact CG2-CD1 4.06Å; I211-I222 HydrophobicContact CG2-CG2 3.99Å; R215-I222 HydrophobicContact CB-CD1 4.33Å; A218-I222 HydrophobicContact CB-CD1 3.73Å; A218-I222 HydrophobicContact CB-CG1 4.29Å; A218-I222 WeakPolarHBondContact O-CG1 3.39Å; A218-I222 PolarHBondContact O-N 3.39Å; Y219-I222 PolarHBondContact O-N 3.31Å; Y219-I222 VanDerWaalsContact O-N 3.14Å; I222-T224 PolarHBondContact O-N 3.04Å; I222-K227 VanDerWaalsContact O-CD 3.28Å; I222-K227 WeakPolarHBondContact O-CD 3.31Å |
| 223 | V | 92.7 | Very high | 90.9 | Very high | 19 Ų | 19 | 86.1 Ų | 86.1 | 12% | 0.115 | 41% | 0.414 | C | S | . | . | S | Bend | trans | -96.2 | 91.8 | -174.5 | -173.9 | 0 | 0 | 0 | 0 | 109.4 | P146 I211 Y219 | P146-V223 HydrophobicContact CB-CG1 3.98Å; P146-V223 HydrophobicContact CG-CG1 3.89Å; I211-V223 HydrophobicContact CD1-CG2 4.2Å; I211-V223 HydrophobicContact CG2-CG2 4.17Å; Y219-V223 HydrophobicContact CD2-CB 4.28Å; Y219-V223 HydrophobicContact CD2-CG2 3.88Å; Y219-V223 HydrophobicContact CE2-CB 3.87Å; Y219-V223 HydrophobicContact CE2-CG1 4.33Å; Y219-V223 HydrophobicContact CE2-CG2 3.65Å; Y219-V223 PolarHBondContact O-N 3.19Å |
| 224 | T | 93.3 | Very high | 91.5 | Very high | 46 Ų | 46 | 86.6 Ų | 86.6 | 28% | 0.282 | 42% | 0.42 | S | S | . | . | trans | -105.4 | 160.7 | 177.7 | 69.9 | 0 | 0 | 0 | 0 | 111.2 | I222 T226 K227 A228 | I222-T224 PolarHBondContact O-N 3.04Å; T224-T226 PolarHBondContact O-N 3.37Å; T224-K227 PolarHBondContact O-N 2.82Å; T224-A228 PolarHBondContact O-N 3.22Å | ||
| 225 | R | 90.3 | Very high | 92.2 | Very high | 154 Ų | 154 | 85 Ų | 85 | 58% | 0.581 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -55 | -48.4 | 179.5 | -166.3 | -168.2 | 75.6 | -167.6 | 3.2 | 112 | K227 A228 V229 | R225-K227 VanDerWaalsContact C-N 3.35Å; R225-K227 PolarHBondContact O-N 3.49Å; R225-A228 PolarHBondContact O-N 3.45Å; R225-V229 WeakPolarHBondContact O-CG2 3.12Å; R225-V229 PolarHBondContact O-N 2.89Å |
| 226 | T | 91.9 | Very high | 92.7 | Very high | 89 Ų | 89 | 79.8 Ų | 79.8 | 55% | 0.546 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -60.5 | -43.5 | -179.1 | -44.9 | 0 | 0 | 0 | 0 | 111.7 | T224 V229 I230 | T224-T226 PolarHBondContact O-N 3.37Å; T226-V229 PolarHBondContact O-N 3.36Å; T226-I230 HydrophobicContact CG2-CD1 4.16Å; T226-I230 WeakPolarHBondContact O-CG1 3.26Å; T226-I230 PolarHBondContact O-N 3.45Å |
| 227 | K | 93.9 | Very high | 93.3 | Very high | 121 Ų | 121 | 79.6 Ų | 79.6 | 53% | 0.526 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -66.2 | -39.1 | 176.6 | -72.3 | 178.8 | 173.6 | -176.8 | 0 | 112.4 | I222 T224 R225 A231 | I222-K227 VanDerWaalsContact O-CD 3.28Å; I222-K227 WeakPolarHBondContact O-CD 3.31Å; T224-K227 PolarHBondContact O-N 2.82Å; R225-K227 VanDerWaalsContact C-N 3.35Å; R225-K227 PolarHBondContact O-N 3.49Å; K227-A231 VanDerWaalsContact O-CB 3.25Å; K227-A231 WeakPolarHBondContact O-CB 3.34Å; K227-A231 PolarHBondContact O-N 3.37Å |
| 228 | A | 92.4 | Very high | 93.7 | Very high | 2 Ų | 2 | 75.7 Ų | 75.7 | 2% | 0.017 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -64 | -41.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112 | P146 F150 T224 R225 A231 F232 | P146-A228 HydrophobicContact CB-CB 3.73Å; F150-A228 HydrophobicContact CE1-CB 4.07Å; F150-A228 HydrophobicContact CE2-CB 4.42Å; F150-A228 HydrophobicContact CZ-CB 3.71Å; T224-A228 PolarHBondContact O-N 3.22Å; R225-A228 PolarHBondContact O-N 3.45Å; A228-A231 PolarHBondContact O-N 2.88Å; A228-F232 WeakPolarHBondContact O-CD1 3.24Å; A228-F232 PolarHBondContact O-N 2.71Å |
| 229 | V | 93.6 | Very high | 94 | Very high | 52 Ų | 52 | 74.6 Ų | 74.6 | 32% | 0.315 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -60.7 | -52.1 | 174.9 | 172.9 | 0 | 0 | 0 | 0 | 111.2 | R225 T226 A231 F232 S233 | R225-V229 WeakPolarHBondContact O-CG2 3.12Å; R225-V229 PolarHBondContact O-N 2.89Å; T226-V229 PolarHBondContact O-N 3.36Å; V229-A231 VanDerWaalsContact C-N 3.3Å; V229-A231 PolarHBondContact O-N 3.44Å; V229-F232 HydrophobicContact CB-CE1 4.16Å; V229-F232 HydrophobicContact CG1-CE1 4.39Å; V229-F232 HydrophobicContact CG1-CZ 4.37Å; V229-F232 HydrophobicContact CG2-CE1 3.97Å; V229-F232 PolarHBondContact O-N 3.5Å; V229-S233 WeakPolarHBondContact O-CB 3.32Å; V229-S233 PolarHBondContact O-N 3.2Å; V229-S233 PolarHBondContact O-OG 2.94Å |
| 230 | I | 95.7 | Very high | 94.3 | Very high | 102 Ų | 102 | 76.4 Ų | 76.4 | 52% | 0.523 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -56.5 | -46.2 | 176.5 | -66 | 163.7 | 0 | 0 | 0 | 110.7 | T226 S233 V234 | T226-I230 HydrophobicContact CG2-CD1 4.16Å; T226-I230 WeakPolarHBondContact O-CG1 3.26Å; T226-I230 PolarHBondContact O-N 3.45Å; I230-S233 PolarHBondContact O-N 2.86Å; I230-V234 HydrophobicContact CG2-CG2 4.3Å; I230-V234 WeakPolarHBondContact O-CB 3.47Å; I230-V234 VanDerWaalsContact O-CG2 3.31Å; I230-V234 WeakPolarHBondContact O-CG2 3.34Å; I230-V234 PolarHBondContact O-N 3.44Å |
| 231 | A | 94.7 | Very high | 94.8 | Very high | 33 Ų | 33 | 70.3 Ų | 70.3 | 27% | 0.273 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -62.3 | -46.5 | -177.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | F150 L204 K227 A228 V229 M235 | F150-A231 HydrophobicContact CE1-CB 4.5Å; L204-A231 HydrophobicContact CD2-CB 4.17Å; K227-A231 VanDerWaalsContact O-CB 3.25Å; K227-A231 WeakPolarHBondContact O-CB 3.34Å; K227-A231 PolarHBondContact O-N 3.37Å; A228-A231 PolarHBondContact O-N 2.88Å; V229-A231 VanDerWaalsContact C-N 3.3Å; V229-A231 PolarHBondContact O-N 3.44Å; A231-M235 WeakPolarHBondContact O-CB 3.48Å; A231-M235 PolarHBondContact O-N 2.95Å; A231-M235 VanDerWaalsContact O-N 3.14Å |
| 232 | F | 94.4 | Very high | 95 | Very high | 49 Ų | 49 | 61.9 Ų | 61.9 | 22% | 0.215 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -71.6 | -37.6 | 177.1 | 81.7 | -112 | 0 | 0 | 0 | 111.6 | H149 F150 L204 A228 V229 V234 M235 W236 | H149-F232 HydrophobicContact CB-CD1 4.04Å; H149-F232 HydrophobicContact CB-CE1 3.91Å; F150-F232 HydrophobicContact CD1-CB 4.48Å; L204-F232 HydrophobicContact CD1-CB 4.18Å; A228-F232 WeakPolarHBondContact O-CD1 3.24Å; A228-F232 PolarHBondContact O-N 2.71Å; V229-F232 HydrophobicContact CB-CE1 4.16Å; V229-F232 HydrophobicContact CG1-CE1 4.39Å; V229-F232 HydrophobicContact CG1-CZ 4.37Å; V229-F232 HydrophobicContact CG2-CE1 3.97Å; V229-F232 PolarHBondContact O-N 3.5Å; F232-V234 PolarHBondContact O-N 3.42Å; F232-M235 HydrophobicContact CB-CE 4.5Å; F232-M235 PolarHBondContact O-N 3.13Å; F232-W236 VanDerWaalsContact O-CD1 3.29Å; F232-W236 PolarHBondContact O-N 2.94Å |
| 233 | S | 96.3 | Very high | 95.2 | Very high | 50 Ų | 50 | 59.1 Ų | 59.1 | 35% | 0.35 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -61.8 | -41.9 | 177.9 | -62.9 | 0 | 0 | 0 | 0 | 112.5 | V229 I230 T237 | V229-S233 WeakPolarHBondContact O-CB 3.32Å; V229-S233 PolarHBondContact O-N 3.2Å; V229-S233 PolarHBondContact O-OG 2.94Å; I230-S233 PolarHBondContact O-N 2.86Å; S233-T237 WeakPolarHBondContact O-CB 3.4Å; S233-T237 PolarHBondContact O-N 3.41Å; S233-T237 PolarHBondContact O-OG1 3.26Å |
| 234 | V | 97.1 | Very high | 95.4 | Very high | 78 Ų | 78 | 60.5 Ų | 60.5 | 47% | 0.473 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -63.1 | -45.5 | 173.8 | 169.8 | 0 | 0 | 0 | 0 | 110.8 | I230 F232 W236 T237 L238 | I230-V234 HydrophobicContact CG2-CG2 4.3Å; I230-V234 WeakPolarHBondContact O-CB 3.47Å; I230-V234 VanDerWaalsContact O-CG2 3.31Å; I230-V234 WeakPolarHBondContact O-CG2 3.34Å; I230-V234 PolarHBondContact O-N 3.44Å; F232-V234 PolarHBondContact O-N 3.42Å; V234-W236 PolarHBondContact O-N 2.96Å; V234-T237 PolarHBondContact O-N 3.03Å; V234-L238 HydrophobicContact CG1-CD1 3.88Å; V234-L238 HydrophobicContact CG1-CG 4.38Å; V234-L238 WeakPolarHBondContact O-CG 3.15Å; V234-L238 PolarHBondContact O-N 3.2Å |
| 235 | M | 96.6 | Very high | 95.6 | Very high | 21 Ų | 21 | 60.6 Ų | 60.6 | 10% | 0.103 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -60.9 | -43.2 | 178.4 | 178.6 | -76.5 | -63.6 | 0 | 0 | 112.5 | A197 S201 L204 A231 F232 L238 S239 | A197-M235 HydrophobicContact CB-SD 4.15Å; S201-M235 WeakPolarHBondContact OG-CE 3.35Å; L204-M235 HydrophobicContact CD1-CB 3.98Å; L204-M235 HydrophobicContact CD1-CE 4.25Å; L204-M235 HydrophobicContact CD1-CG 4.15Å; A231-M235 WeakPolarHBondContact O-CB 3.48Å; A231-M235 PolarHBondContact O-N 2.95Å; A231-M235 VanDerWaalsContact O-N 3.14Å; F232-M235 HydrophobicContact CB-CE 4.5Å; F232-M235 PolarHBondContact O-N 3.13Å; M235-L238 PolarHBondContact O-N 3.12Å; M235-S239 WeakPolarHBondContact O-CB 3.43Å; M235-S239 PolarHBondContact O-N 3.3Å; M235-S239 PolarHBondContact O-OG 3.24Å |
| 236 | W | 97.9 | Very high | 95.8 | Very high | 44 Ų | 44 | 53.5 Ų | 53.5 | 17% | 0.167 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -62.7 | -45.3 | 174 | -89.4 | 89.7 | 0 | 0 | 0 | 112.2 | S153 V156 A157 L160 A197 F232 V234 L238 S239 I240 | S153-W236 PolarHBondContact OG-NE1 3.11Å; V156-W236 HydrophobicContact CB-CZ2 4.24Å; V156-W236 HydrophobicContact CG1-CH2 3.93Å; V156-W236 HydrophobicContact CG1-CZ2 3.92Å; A157-W236 HydrophobicContact CB-CH2 3.94Å; A157-W236 HydrophobicContact CB-CZ2 3.79Å; L160-W236 HydrophobicContact CD1-CH2 4.1Å; L160-W236 HydrophobicContact CD1-CZ3 4.37Å; A197-W236 HydrophobicContact CB-CD2 4.06Å; A197-W236 HydrophobicContact CB-CE3 4.08Å; A197-W236 HydrophobicContact CB-CH2 4.19Å; A197-W236 HydrophobicContact CB-CZ2 4.17Å; A197-W236 HydrophobicContact CB-CZ3 4.14Å; F232-W236 VanDerWaalsContact O-CD1 3.29Å; F232-W236 PolarHBondContact O-N 2.94Å; V234-W236 PolarHBondContact O-N 2.96Å; W236-L238 PolarHBondContact O-N 3.32Å; W236-S239 PolarHBondContact O-N 3.22Å; W236-I240 HydrophobicContact CE3-CD1 4.37Å; W236-I240 WeakPolarHBondContact O-CG1 3.48Å; W236-I240 PolarHBondContact O-N 3.15Å |
| 237 | T | 97.7 | Very high | 95.9 | Very high | 82 Ų | 82 | 51.9 Ų | 51.9 | 50% | 0.503 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -60.7 | -45.5 | 179.1 | -55 | 0 | 0 | 0 | 0 | 111 | S233 V234 I240 I241 | S233-T237 WeakPolarHBondContact O-CB 3.4Å; S233-T237 PolarHBondContact O-N 3.41Å; S233-T237 PolarHBondContact O-OG1 3.26Å; V234-T237 PolarHBondContact O-N 3.03Å; T237-I240 PolarHBondContact O-N 3.41Å; T237-I241 HydrophobicContact CG2-CD1 3.87Å; T237-I241 WeakPolarHBondContact O-CB 3.23Å; T237-I241 VanDerWaalsContact O-CG1 3.24Å; T237-I241 WeakPolarHBondContact O-CG1 3.36Å; T237-I241 PolarHBondContact O-N 2.91Å |
| 238 | L | 96.8 | Very high | 95.9 | Very high | 94 Ų | 94 | 51.8 Ų | 51.8 | 49% | 0.492 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -62.4 | -43.1 | 175.2 | -69.4 | 170.9 | 0 | 0 | 0 | 112.1 | V234 M235 W236 I240 I241 I242 | V234-L238 HydrophobicContact CG1-CD1 3.88Å; V234-L238 HydrophobicContact CG1-CG 4.38Å; V234-L238 WeakPolarHBondContact O-CG 3.15Å; V234-L238 PolarHBondContact O-N 3.2Å; M235-L238 PolarHBondContact O-N 3.12Å; W236-L238 PolarHBondContact O-N 3.32Å; L238-I240 VanDerWaalsContact C-N 3.35Å; L238-I240 PolarHBondContact O-N 3.06Å; L238-I241 PolarHBondContact O-N 3.49Å; L238-I242 WeakPolarHBondContact O-CB 3.02Å; L238-I242 WeakPolarHBondContact O-CD1 3.28Å; L238-I242 VanDerWaalsContact O-CG1 3.28Å; L238-I242 WeakPolarHBondContact O-CG1 3.5Å; L238-I242 PolarHBondContact O-N 3.31Å |
| 239 | S | 97.6 | Very high | 95.9 | Very high | 4 Ų | 4 | 52.4 Ų | 52.4 | 3% | 0.028 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -60.7 | -42.8 | 178.5 | -56.9 | 0 | 0 | 0 | 0 | 112.2 | A197 M235 W236 A243 | A197-S239 PolarHBondContact N-OG 2.84Å; M235-S239 WeakPolarHBondContact O-CB 3.43Å; M235-S239 PolarHBondContact O-N 3.3Å; M235-S239 PolarHBondContact O-OG 3.24Å; W236-S239 PolarHBondContact O-N 3.22Å; S239-A243 WeakPolarHBondContact O-CB 3.33Å; S239-A243 PolarHBondContact O-N 3.37Å; S239-A243 VanDerWaalsContact O-N 3.15Å |
| 240 | I | 97.4 | Very high | 95.9 | Very high | 83 Ų | 83 | 54.1 Ų | 54.1 | 43% | 0.426 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -68.4 | -45.2 | 176.5 | -66.8 | 165.7 | 0 | 0 | 0 | 110.8 | A193 W236 T237 L238 I242 A243 V244 | A193-I240 HydrophobicContact CB-CG1 4.38Å; W236-I240 HydrophobicContact CE3-CD1 4.37Å; W236-I240 WeakPolarHBondContact O-CG1 3.48Å; W236-I240 PolarHBondContact O-N 3.15Å; T237-I240 PolarHBondContact O-N 3.41Å; L238-I240 VanDerWaalsContact C-N 3.35Å; L238-I240 PolarHBondContact O-N 3.06Å; I240-I242 PolarHBondContact O-N 2.84Å; I240-A243 PolarHBondContact O-N 2.86Å; I240-V244 HydrophobicContact CG2-CG2 4.22Å; I240-V244 WeakPolarHBondContact O-CB 3.34Å; I240-V244 VanDerWaalsContact O-CG2 3.25Å; I240-V244 WeakPolarHBondContact O-CG2 3.34Å; I240-V244 PolarHBondContact O-N 3.21Å |
| 241 | I | 97.1 | Very high | 95.8 | Very high | 93 Ų | 93 | 50.2 Ų | 50.2 | 48% | 0.477 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -55.9 | -53.1 | 177.8 | -73.8 | 166.6 | 0 | 0 | 0 | 110.1 | T237 L238 A243 V244 L245 | T237-I241 HydrophobicContact CG2-CD1 3.87Å; T237-I241 WeakPolarHBondContact O-CB 3.23Å; T237-I241 VanDerWaalsContact O-CG1 3.24Å; T237-I241 WeakPolarHBondContact O-CG1 3.36Å; T237-I241 PolarHBondContact O-N 2.91Å; L238-I241 PolarHBondContact O-N 3.49Å; I241-A243 VanDerWaalsContact C-N 3.35Å; I241-A243 PolarHBondContact O-N 2.88Å; I241-V244 PolarHBondContact O-N 3.34Å; I241-L245 WeakPolarHBondContact O-CG 3.45Å; I241-L245 PolarHBondContact O-N 2.91Å |
| 242 | I | 96.2 | Very high | 95.5 | Very high | 23 Ų | 23 | 48.8 Ų | 48.8 | 12% | 0.118 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -56.9 | -48.6 | -179.1 | -70.1 | 160.4 | 0 | 0 | 0 | 110.8 | L238 I240 V244 L245 Y270 F273 L277 | L238-I242 WeakPolarHBondContact O-CB 3.02Å; L238-I242 WeakPolarHBondContact O-CD1 3.28Å; L238-I242 VanDerWaalsContact O-CG1 3.28Å; L238-I242 WeakPolarHBondContact O-CG1 3.5Å; L238-I242 PolarHBondContact O-N 3.31Å; I240-I242 PolarHBondContact O-N 2.84Å; I242-V244 VanDerWaalsContact C-N 3.27Å; I242-V244 PolarHBondContact O-N 2.94Å; I242-L245 WeakPolarHBondContact O-CB 3.42Å; I242-L245 WeakPolarHBondContact O-CG 3.49Å; I242-L245 PolarHBondContact O-N 2.94Å; I242-Y270 WeakPolarHBondContact O-CE2 3.39Å; I242-Y270 PolarHBondContact O-OH 2.92Å; I242-F273 HydrophobicContact CG1-CE1 4.32Å; I242-F273 HydrophobicContact CG2-CE1 4.09Å; I242-L277 HydrophobicContact CD1-CD2 3.53Å |
| 243 | A | 96.8 | Very high | 95.2 | Very high | 2 Ų | 2 | 53.1 Ų | 53.1 | 2% | 0.017 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -69.3 | -21.1 | -176.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | G189 T192 A193 S239 I240 I241 | G189-A243 WeakPolarHBondContact O-CB 3.47Å; T192-A243 HydrophobicContact CG2-CB 3.96Å; A193-A243 HydrophobicContact CB-CB 3.63Å; S239-A243 WeakPolarHBondContact O-CB 3.33Å; S239-A243 PolarHBondContact O-N 3.37Å; S239-A243 VanDerWaalsContact O-N 3.15Å; I240-A243 PolarHBondContact O-N 2.86Å; I241-A243 VanDerWaalsContact C-N 3.35Å; I241-A243 PolarHBondContact O-N 2.88Å |
| 244 | V | 96.4 | Very high | 94.9 | Very high | 49 Ų | 49 | 59 Ų | 59 | 30% | 0.297 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -92 | -10.5 | -179.7 | 170.8 | 0 | 0 | 0 | 0 | 112.3 | I240 I241 I242 L247 L248 | I240-V244 HydrophobicContact CG2-CG2 4.22Å; I240-V244 WeakPolarHBondContact O-CB 3.34Å; I240-V244 VanDerWaalsContact O-CG2 3.25Å; I240-V244 WeakPolarHBondContact O-CG2 3.34Å; I240-V244 PolarHBondContact O-N 3.21Å; I241-V244 PolarHBondContact O-N 3.34Å; I242-V244 VanDerWaalsContact C-N 3.27Å; I242-V244 PolarHBondContact O-N 2.94Å; V244-L247 WeakPolarHBondContact O-CB 3.33Å; V244-L247 PolarHBondContact O-N 3.36Å; V244-L247 VanDerWaalsContact O-N 3.12Å; V244-L248 HydrophobicContact CG1-CD1 3.94Å; V244-L248 HydrophobicContact CG1-CD2 4.5Å; V244-L248 HydrophobicContact CG1-CG 3.86Å; V244-L248 PolarHBondContact O-N 2.92Å |
| 245 | L | 96 | Very high | 94.6 | Very high | 48 Ų | 48 | 59.7 Ų | 59.7 | 25% | 0.251 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -53.3 | -43.3 | 177.8 | -65.5 | 172.8 | 0 | 0 | 0 | 114 | I241 I242 L247 L248 G249 W250 Y270 | I241-L245 WeakPolarHBondContact O-CG 3.45Å; I241-L245 PolarHBondContact O-N 2.91Å; I242-L245 WeakPolarHBondContact O-CB 3.42Å; I242-L245 WeakPolarHBondContact O-CG 3.49Å; I242-L245 PolarHBondContact O-N 2.94Å; L245-L247 VanDerWaalsContact C-N 3.33Å; L245-L247 PolarHBondContact O-N 3.36Å; L245-L248 PolarHBondContact O-N 3.32Å; L245-G249 PolarHBondContact O-N 2.96Å; L245-W250 HydrophobicContact CB-CB 4.32Å; L245-W250 HydrophobicContact CB-CE3 4.31Å; L245-W250 HydrophobicContact CD1-CE3 3.98Å; L245-W250 HydrophobicContact CD1-CZ3 4.1Å; L245-W250 PolarHBondContact O-N 3.25Å; L245-Y270 HydrophobicContact CB-CD2 4.34Å; L245-Y270 HydrophobicContact CB-CE2 4.09Å; L245-Y270 HydrophobicContact CD1-CE2 4.46Å |
| 246 | P | 95.1 | Very high | 94.1 | Very high | 4 Ų | 4 | 66 Ų | 66 | 3% | 0.026 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -64.6 | -37.4 | 178.4 | -23.7 | 36.5 | 0 | 0 | 0 | 113 | L185 G249 W250 N251 I266 Y270 | L185-P246 HydrophobicContact CD2-CB 4.07Å; P246-G249 PolarHBondContact O-N 3.12Å; P246-W250 WeakPolarHBondContact CA-O 3.26Å; P246-N251 PolarHBondContact O-ND2 3.15Å; P246-I266 HydrophobicContact CB-CD1 3.83Å; P246-I266 HydrophobicContact CG-CD1 3.91Å; P246-Y270 HydrophobicContact CG-CD1 3.83Å; P246-Y270 HydrophobicContact CG-CD2 3.88Å; P246-Y270 HydrophobicContact CG-CE1 3.55Å; P246-Y270 HydrophobicContact CG-CE2 3.61Å; P246-Y270 HydrophobicContact CG-CG 3.98Å; P246-Y270 VanDerWaalsContact CG-CZ 3.43Å |
| 247 | L | 94.1 | Very high | 93.7 | Very high | 55 Ų | 55 | 65.7 Ų | 65.7 | 29% | 0.288 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -68.1 | -35.2 | 176.9 | -174.6 | 66.4 | 0 | 0 | 0 | 111.9 | N182 L185 F186 V244 L245 | N182-L247 HydrophobicContact CB-CD1 4.07Å; L185-L247 HydrophobicContact CB-CB 4.47Å; L185-L247 HydrophobicContact CB-CD1 4.07Å; F186-L247 HydrophobicContact CB-CD2 4.44Å; F186-L247 HydrophobicContact CD2-CD2 4.25Å; V244-L247 WeakPolarHBondContact O-CB 3.33Å; V244-L247 PolarHBondContact O-N 3.36Å; V244-L247 VanDerWaalsContact O-N 3.12Å; L245-L247 VanDerWaalsContact C-N 3.33Å; L245-L247 PolarHBondContact O-N 3.36Å |
| 248 | L | 94.3 | Very high | 93.3 | Very high | 120 Ų | 120 | 66 Ų | 66 | 63% | 0.628 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -73.4 | -27 | 176.1 | -68.8 | 172.9 | 0 | 0 | 0 | 113 | V244 L245 R254 | V244-L248 HydrophobicContact CG1-CD1 3.94Å; V244-L248 HydrophobicContact CG1-CD2 4.5Å; V244-L248 HydrophobicContact CG1-CG 3.86Å; V244-L248 PolarHBondContact O-N 2.92Å; L245-L248 PolarHBondContact O-N 3.32Å; L248-R254 PolarHBondContact O-NH1 3.42Å |
| 249 | G | 91.4 | Very high | 93 | Very high | 15 Ų | 15 | 63.2 Ų | 63.2 | 16% | 0.155 | 32% | 0.323 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 155.5 | -5.3 | 172.4 | 0 | 0 | 0 | 0 | 0 | 116.9 | L245 P246 N251 | L245-G249 PolarHBondContact O-N 2.96Å; P246-G249 PolarHBondContact O-N 3.12Å; G249-N251 PolarHBondContact O-N 3.09Å |
| 250 | W | 94.3 | Very high | 92.7 | Very high | 87 Ų | 87 | 63 Ų | 63 | 33% | 0.33 | 32% | 0.322 | S | S | . | . | trans | -81.2 | 58.6 | 176.1 | -160.8 | -18.3 | 0 | 0 | 0 | 111.2 | L245 P246 L255 D267 N269 Y270 | L245-W250 HydrophobicContact CB-CB 4.32Å; L245-W250 HydrophobicContact CB-CE3 4.31Å; L245-W250 HydrophobicContact CD1-CE3 3.98Å; L245-W250 HydrophobicContact CD1-CZ3 4.1Å; L245-W250 PolarHBondContact O-N 3.25Å; P246-W250 WeakPolarHBondContact CA-O 3.26Å; W250-L255 HydrophobicContact CG-CD1 4.28Å; W250-D267 PolarHBondContact NE1-OD1 3.26Å; W250-N269 HydrophobicContact CZ2-CB 4.34Å; W250-Y270 HydrophobicContact CD2-CD2 4.29Å; W250-Y270 HydrophobicContact CE3-CD2 4.39Å; W250-Y270 HydrophobicContact CG-CD2 4.5Å | ||
| 251 | N | 93.1 | Very high | 92.2 | Very high | 20 Ų | 20 | 60.6 Ų | 60.6 | 11% | 0.107 | 31% | 0.309 | C | S | . | . | B | Isolated β-bridge | trans | -126.4 | 147.9 | 178.6 | 63.8 | 73.1 | 0 | 0 | 0 | 109.7 | L185 P246 G249 K253 R254 L255 L265 | L185-N251 HydrophobicContact CD1-CB 4.12Å; P246-N251 PolarHBondContact O-ND2 3.15Å; G249-N251 PolarHBondContact O-N 3.09Å; N251-K253 PolarHBondContact O-N 3.07Å; N251-R254 PolarHBondContact O-N 2.96Å; N251-R254 VanDerWaalsContact O-N 3.08Å; N251-R254 VanDerWaalsContact OD1-CB 3.3Å; N251-R254 WeakPolarHBondContact OD1-CB 3.04Å; N251-R254 PolarHBondContact OD1-N 2.95Å; N251-L255 PolarHBondContact O-N 2.91Å; N251-L255 VanDerWaalsContact O-N 3.14Å; N251-L265 WeakPolarHBondContact CA-O 3.35Å; N251-L265 VanDerWaalsContact CB-O 3.27Å; N251-L265 WeakPolarHBondContact CB-O 3.31Å |
| 252 | C | 90.3 | Very high | 91.8 | Very high | 3 Ų | 3 | 57 Ų | 57 | 2% | 0.02 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -61 | -34.1 | -170.5 | 60.2 | 0 | 0 | 0 | 0 | 112.5 | R254 L255 N256 S257 C259 L265 D267 | C252-R254 VanDerWaalsContact C-N 3.35Å; C252-R254 PolarHBondContact O-N 2.93Å; C252-L255 PolarHBondContact O-N 3.48Å; C252-N256 WeakPolarHBondContact O-CA 3.37Å; C252-N256 PolarHBondContact O-N 3.36Å; C252-S257 WeakPolarHBondContact CA-OG 3.27Å; C252-S257 WeakPolarHBondContact CB-O 3.45Å; C252-S257 PolarHBondContact O-N 2.84Å; C252-C259 HydrophobicContact CB-CB 3.89Å; C252-C259 WeakPolarHBondContact CB-SG 3.34Å; C252-C259 WeakPolarHBondContact SG-CB 3.49Å; C252-C259 CovalentContact SG-SG 2.04Å; C252-C259 PolarHBondContact SG-SG 3Å; C252-L265 PolarHBondContact N-O 2.69Å; C252-L265 VanDerWaalsContact N-O 3.11Å; C252-L265 VanDerWaalsContact SG-C 3.52Å; C252-L265 PolarHBondContact SG-O 3.12Å; C252-D267 HydrophobicContact CB-CB 4.41Å |
| 253 | K | 87.9 | Confident | 91.5 | Very high | 140 Ų | 140 | 57.8 Ų | 57.8 | 61% | 0.609 | 29% | 0.293 | S | S | * | . | H | α-helix | trans | -66.8 | -28.6 | 178.3 | -173.5 | 168.3 | -174.4 | 166.9 | 0 | 114.3 | N251 L265 | N251-K253 PolarHBondContact O-N 3.07Å; K253-L265 HydrophobicContact CB-CD2 4.27Å; K253-L265 HydrophobicContact CD-CD2 4.27Å |
| 254 | R | 90 | Very high | 91.2 | Very high | 173 Ų | 173 | 58 Ų | 58 | 65% | 0.653 | 30% | 0.295 | S | S | * | . | H | α-helix | trans | -89.4 | -30.5 | 177.8 | -167.8 | 177.5 | -167.2 | 166.1 | 4.4 | 112.4 | L248 N251 C252 | L248-R254 PolarHBondContact O-NH1 3.42Å; N251-R254 PolarHBondContact O-N 2.96Å; N251-R254 VanDerWaalsContact O-N 3.08Å; N251-R254 VanDerWaalsContact OD1-CB 3.3Å; N251-R254 WeakPolarHBondContact OD1-CB 3.04Å; N251-R254 PolarHBondContact OD1-N 2.95Å; C252-R254 VanDerWaalsContact C-N 3.35Å; C252-R254 PolarHBondContact O-N 2.93Å |
| 255 | L | 89.4 | Confident | 90.9 | Very high | 93 Ų | 93 | 57 Ų | 57 | 49% | 0.487 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -89.7 | -12.5 | -179.8 | -69.5 | 169.6 | 0 | 0 | 0 | 113.4 | W250 N251 C252 S257 | W250-L255 HydrophobicContact CG-CD1 4.28Å; N251-L255 PolarHBondContact O-N 2.91Å; N251-L255 VanDerWaalsContact O-N 3.14Å; C252-L255 PolarHBondContact O-N 3.48Å; L255-S257 PolarHBondContact O-N 3.03Å |
| 256 | N | 86.9 | Confident | 90.8 | Very high | 153 Ų | 153 | 55 Ų | 55 | 82% | 0.818 | 28% | 0.277 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.6 | 43.5 | -169.1 | -59.8 | -40 | 0 | 0 | 0 | 111.9 | C252 | C252-N256 WeakPolarHBondContact O-CA 3.37Å; C252-N256 PolarHBondContact O-N 3.36Å |
| 257 | S | 89.3 | Confident | 90.7 | Very high | 38 Ų | 38 | 54.9 Ų | 54.9 | 27% | 0.266 | 28% | 0.276 | S | S | . | . | trans | -108.1 | 175.1 | 179.3 | 57.1 | 0 | 0 | 0 | 0 | 111.4 | C252 L255 D267 | C252-S257 WeakPolarHBondContact CA-OG 3.27Å; C252-S257 WeakPolarHBondContact CB-O 3.45Å; C252-S257 PolarHBondContact O-N 2.84Å; L255-S257 PolarHBondContact O-N 3.03Å; S257-D267 VanDerWaalsContact CB-OD2 3.24Å; S257-D267 WeakPolarHBondContact CB-OD2 3.36Å; S257-D267 PolarHBondContact OG-OD2 3.19Å | ||
| 258 | V | 88.3 | Confident | 90.7 | Very high | 90 Ų | 90 | 54.8 Ų | 54.8 | 55% | 0.545 | 27% | 0.274 | S | S | . | . | P | Polyproline II helix | trans | -68.2 | 136.2 | 177.7 | -166.3 | 0 | 0 | 0 | 0 | 110 | E268 | V258-E268 HydrophobicContact CB-CG 4.31Å; V258-E268 HydrophobicContact CG1-CG 4.37Å; V258-E268 WeakPolarHBondContact CG1-OE1 3.42Å; V258-E268 PolarHBondContact O-N 2.85Å |
| 259 | C | 90.8 | Very high | 90.7 | Very high | 35 Ų | 35 | 53.4 Ų | 53.4 | 24% | 0.236 | 27% | 0.268 | C | S | . | . | B | Isolated β-bridge | trans | -96.3 | 146.7 | 176.6 | -54.5 | 0 | 0 | 0 | 0 | 110.5 | C252 I266 | C252-C259 HydrophobicContact CB-CB 3.89Å; C252-C259 WeakPolarHBondContact CB-SG 3.34Å; C252-C259 WeakPolarHBondContact SG-CB 3.49Å; C252-C259 CovalentContact SG-SG 2.04Å; C252-C259 PolarHBondContact SG-SG 3Å; C259-I266 VanDerWaalsContact CA-O 3.31Å; C259-I266 WeakPolarHBondContact CA-O 3.33Å |
| 260 | S | 91.5 | Very high | 90.9 | Very high | 0 Ų | 0 | 53.1 Ų | 53.1 | 0% | 0 | 26% | 0.262 | C | S | . | . | P | Polyproline II helix | trans | -59.7 | 139.1 | 169 | 169.5 | 0 | 0 | 0 | 0 | 112.3 | I262 F263 I266 D361 | S260-I262 VanDerWaalsContact C-N 3.26Å; S260-I262 PolarHBondContact OG-N 3.37Å; S260-F263 PolarHBondContact OG-N 2.91Å; S260-I266 PolarHBondContact N-O 3.13Å; S260-D361 VanDerWaalsContact CB-OD2 3.31Å; S260-D361 WeakPolarHBondContact CB-OD2 3.39Å; S260-D361 PolarHBondContact OG-OD2 3.12Å |
| 261 | D | 87.4 | Confident | 90.9 | Very high | 32 Ų | 32 | 49.2 Ų | 49.2 | 17% | 0.171 | 25% | 0.248 | C | C | . | . | S | Bend | trans | -77.5 | -13.7 | 173.5 | -77.9 | -23.4 | 0 | 0 | 0 | 112.1 | M98 F103 D361 K365 M366 | M98-D261 WeakPolarHBondContact CE-OD1 3.47Å; F103-D261 WeakPolarHBondContact CD1-O 3.39Å; F103-D261 WeakPolarHBondContact CE1-O 3.41Å; D261-D361 WeakPolarHBondContact CA-OD1 3.37Å; D261-D361 WeakPolarHBondContact CB-OD1 3.41Å; D261-D361 PolarHBondContact N-OD1 3.39Å; D261-K365 WeakPolarHBondContact OD2-CA 3.32Å; D261-M366 HydrophobicContact CB-CB 3.77Å; D261-M366 HydrophobicContact CB-CG 4.09Å; D261-M366 PolarHBondContact OD2-N 3.28Å |
| 262 | I | 88.6 | Confident | 91.1 | Very high | 17 Ų | 17 | 52.7 Ų | 52.7 | 9% | 0.087 | 26% | 0.264 | C | S | . | . | S | Bend | trans | -95.1 | -42.3 | 176.1 | -65.8 | 176.5 | 0 | 0 | 0 | 112 | S260 P264 I357 D361 M366 F374 | S260-I262 VanDerWaalsContact C-N 3.26Å; S260-I262 PolarHBondContact OG-N 3.37Å; I262-P264 WeakPolarHBondContact O-CD 3.28Å; I262-I357 HydrophobicContact CD1-CG2 3.67Å; I262-D361 HydrophobicContact CD1-CB 3.67Å; I262-D361 HydrophobicContact CG1-CB 4.15Å; I262-D361 PolarHBondContact N-OD1 3.08Å; I262-M366 HydrophobicContact CD1-CE 4.4Å; I262-M366 HydrophobicContact CD1-CG 4.43Å; I262-M366 HydrophobicContact CD1-SD 3.85Å; I262-M366 HydrophobicContact CG1-CG 4.1Å; I262-M366 HydrophobicContact CG1-SD 3.91Å; I262-F374 HydrophobicContact CD1-CD2 4.15Å; I262-F374 HydrophobicContact CD1-CE2 4.5Å; I262-F374 HydrophobicContact CD1-CG 4.34Å; I262-F374 HydrophobicContact CG2-CD1 3.48Å; I262-F374 VanDerWaalsContact CG2-CD1 3.48Å; I262-F374 HydrophobicContact CG2-CD2 4.18Å; I262-F374 HydrophobicContact CG2-CE1 3.26Å; I262-F374 HydrophobicContact CG2-CE2 3.98Å; I262-F374 HydrophobicContact CG2-CG 3.95Å; I262-F374 HydrophobicContact CG2-CZ 3.53Å |
| 263 | F | 90.6 | Very high | 91.4 | Very high | 39 Ų | 39 | 56.4 Ų | 56.4 | 17% | 0.171 | 28% | 0.28 | C | S | . | . | S | Bend | trans | -115.9 | 103.5 | -172.5 | -69.3 | -69.5 | 0 | 0 | 0 | 111.9 | L188 S260 L265 I266 L271 M358 F374 | L188-F263 HydrophobicContact CD1-CD1 4.01Å; L188-F263 HydrophobicContact CD1-CE1 3.92Å; L188-F263 HydrophobicContact CD2-CD1 4.03Å; S260-F263 PolarHBondContact OG-N 2.91Å; F263-L265 PolarHBondContact O-N 3.05Å; F263-I266 HydrophobicContact CB-CB 3.8Å; F263-I266 HydrophobicContact CB-CG1 3.69Å; F263-I266 HydrophobicContact CB-CG2 4.46Å; F263-I266 WeakPolarHBondContact O-CB 3.5Å; F263-I266 PolarHBondContact O-N 2.96Å; F263-I266 VanDerWaalsContact O-N 3.16Å; F263-L271 HydrophobicContact CD2-CD1 4.21Å; F263-L271 HydrophobicContact CD2-CD2 4.45Å; F263-L271 HydrophobicContact CE2-CD1 4.28Å; F263-M358 HydrophobicContact CE2-CE 3.88Å; F263-M358 HydrophobicContact CE2-CG 4.33Å; F263-M358 HydrophobicContact CE2-SD 4.29Å; F263-M358 HydrophobicContact CZ-CE 3.79Å; F263-F374 HydrophobicContact CE1-CE1 4.48Å; F263-F374 HydrophobicContact CE1-CZ 4.3Å; F263-F374 HydrophobicContact CE2-CZ 4.15Å; F263-F374 HydrophobicContact CZ-CE1 4.27Å; F263-F374 AromaticContact CZ-CZ 3.67Å; F263-F374 HydrophobicContact CZ-CZ 3.67Å |
| 264 | P | 89.2 | Confident | 91.8 | Very high | 8 Ų | 8 | 50.8 Ų | 50.8 | 5% | 0.052 | 26% | 0.255 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -49.3 | 138.7 | 175.4 | -25.1 | 28.4 | 0 | 0 | 0 | 113 | M100 F103 F172 F184 I262 I266 | M100-P264 HydrophobicContact CE-CB 3.68Å; M100-P264 HydrophobicContact CE-CG 4.5Å; M100-P264 HydrophobicContact SD-CB 3.39Å; M100-P264 WeakPolarHBondContact SD-CB 3.43Å; M100-P264 HydrophobicContact SD-CG 3.66Å; F103-P264 HydrophobicContact CB-CG 4.34Å; F103-P264 HydrophobicContact CD1-CG 3.72Å; F103-P264 HydrophobicContact CD2-CB 4.45Å; F103-P264 HydrophobicContact CD2-CG 3.72Å; F103-P264 HydrophobicContact CE1-CG 3.83Å; F103-P264 HydrophobicContact CE2-CB 4.17Å; F103-P264 HydrophobicContact CE2-CG 3.85Å; F103-P264 HydrophobicContact CG-CG 3.67Å; F103-P264 HydrophobicContact CZ-CB 4.2Å; F103-P264 HydrophobicContact CZ-CG 3.91Å; F172-P264 HydrophobicContact CZ-CG 4.34Å; F184-P264 HydrophobicContact CE1-CB 3.93Å; F184-P264 HydrophobicContact CE1-CG 4.25Å; F184-P264 VanDerWaalsContact CE1-O 3.26Å; F184-P264 WeakPolarHBondContact CE1-O 3.35Å; F184-P264 HydrophobicContact CE2-CG 4.38Å; F184-P264 HydrophobicContact CZ-CB 4.02Å; F184-P264 HydrophobicContact CZ-CG 3.83Å; I262-P264 WeakPolarHBondContact O-CD 3.28Å; P264-I266 PolarHBondContact O-N 3.35Å |
| 265 | L | 90.3 | Very high | 92.1 | Very high | 28 Ų | 28 | 43 Ų | 43 | 15% | 0.147 | 23% | 0.226 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 65.4 | -6.3 | 178.4 | -53.1 | 159.4 | 0 | 0 | 0 | 115.9 | M100 P181 F184 L185 N251 C252 K253 F263 | M100-L265 HydrophobicContact CE-CD1 3.55Å; M100-L265 HydrophobicContact CE-CG 4.13Å; P181-L265 HydrophobicContact CB-CD1 3.61Å; P181-L265 HydrophobicContact CB-CD2 4.4Å; P181-L265 HydrophobicContact CG-CD1 4.26Å; F184-L265 HydrophobicContact CD1-CD1 4.22Å; L185-L265 HydrophobicContact CD1-CB 4.49Å; L185-L265 HydrophobicContact CD2-CB 4.12Å; L185-L265 HydrophobicContact CG-CB 4.43Å; L185-L265 HydrophobicContact CG-CD1 4.32Å; N251-L265 WeakPolarHBondContact CA-O 3.35Å; N251-L265 VanDerWaalsContact CB-O 3.27Å; N251-L265 WeakPolarHBondContact CB-O 3.31Å; C252-L265 PolarHBondContact N-O 2.69Å; C252-L265 VanDerWaalsContact N-O 3.11Å; C252-L265 VanDerWaalsContact SG-C 3.52Å; C252-L265 PolarHBondContact SG-O 3.12Å; K253-L265 HydrophobicContact CB-CD2 4.27Å; K253-L265 HydrophobicContact CD-CD2 4.27Å; F263-L265 PolarHBondContact O-N 3.05Å |
| 266 | I | 93.9 | Very high | 92.4 | Very high | 6 Ų | 6 | 45.1 Ų | 45.1 | 3% | 0.031 | 23% | 0.232 | C | C | . | . | B | Isolated β-bridge | trans | -80.8 | 131.6 | 178.7 | -65.8 | -58.7 | 0 | 0 | 0 | 110.5 | L185 L188 P246 C259 S260 F263 P264 Y270 L271 | L185-I266 HydrophobicContact CD2-CD1 3.72Å; L188-I266 HydrophobicContact CD2-CD1 3.9Å; L188-I266 HydrophobicContact CD2-CG1 3.71Å; P246-I266 HydrophobicContact CB-CD1 3.83Å; P246-I266 HydrophobicContact CG-CD1 3.91Å; C259-I266 VanDerWaalsContact CA-O 3.31Å; C259-I266 WeakPolarHBondContact CA-O 3.33Å; S260-I266 PolarHBondContact N-O 3.13Å; F263-I266 HydrophobicContact CB-CB 3.8Å; F263-I266 HydrophobicContact CB-CG1 3.69Å; F263-I266 HydrophobicContact CB-CG2 4.46Å; F263-I266 WeakPolarHBondContact O-CB 3.5Å; F263-I266 PolarHBondContact O-N 2.96Å; F263-I266 VanDerWaalsContact O-N 3.16Å; P264-I266 PolarHBondContact O-N 3.35Å; I266-Y270 HydrophobicContact CD1-CD1 4.4Å; I266-Y270 HydrophobicContact CD1-CE1 4.38Å; I266-Y270 HydrophobicContact CG2-CD1 3.83Å; I266-L271 HydrophobicContact CG2-CB 4.05Å |
| 267 | D | 94.1 | Very high | 92.8 | Very high | 1 Ų | 1 | 40.1 Ų | 40.1 | 1% | 0.005 | 21% | 0.205 | C | C | . | . | B | Isolated β-bridge | trans | -75.2 | 137 | 171.9 | 168.1 | -103.5 | 0 | 0 | 0 | 111.1 | W250 C252 S257 N269 Y270 L271 | W250-D267 PolarHBondContact NE1-OD1 3.26Å; C252-D267 HydrophobicContact CB-CB 4.41Å; S257-D267 VanDerWaalsContact CB-OD2 3.24Å; S257-D267 WeakPolarHBondContact CB-OD2 3.36Å; S257-D267 PolarHBondContact OG-OD2 3.19Å; D267-N269 VanDerWaalsContact C-N 3.28Å; D267-N269 PolarHBondContact O-N 3.26Å; D267-N269 WeakPolarHBondContact OD1-CA 3.47Å; D267-N269 WeakPolarHBondContact OD1-CB 3.4Å; D267-N269 PolarHBondContact OD1-N 2.85Å; D267-N269 PolarHBondContact OD1-ND2 2.68Å; D267-N269 PolarHBondContact OD2-ND2 3.38Å; D267-N269 VanDerWaalsContact OD2-ND2 3.1Å; D267-Y270 WeakPolarHBondContact O-CB 3.33Å; D267-Y270 PolarHBondContact O-N 2.73Å; D267-Y270 PolarHBondContact OD1-N 2.65Å; D267-L271 PolarHBondContact O-N 2.68Å |
| 268 | E | 92.9 | Very high | 93 | Very high | 52 Ų | 52 | 38.4 Ų | 38.4 | 24% | 0.243 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -58.7 | -35.8 | 179.5 | -70.8 | 179.7 | 169.3 | 0 | 0 | 113.1 | V258 L271 M272 L362 | V258-E268 HydrophobicContact CB-CG 4.31Å; V258-E268 HydrophobicContact CG1-CG 4.37Å; V258-E268 WeakPolarHBondContact CG1-OE1 3.42Å; V258-E268 PolarHBondContact O-N 2.85Å; E268-L271 PolarHBondContact O-N 2.96Å; E268-M272 VanDerWaalsContact O-CB 3.31Å; E268-M272 WeakPolarHBondContact O-CB 3.47Å; E268-M272 PolarHBondContact O-N 3.37Å; E268-L362 HydrophobicContact CB-CD2 3.98Å; E268-L362 HydrophobicContact CG-CD2 4.37Å; E268-L362 WeakPolarHBondContact O-CD2 3.36Å |
| 269 | N | 94.4 | Very high | 93.3 | Very high | 91 Ų | 91 | 35.5 Ų | 35.5 | 49% | 0.487 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -70.3 | -36.6 | -180 | -47.1 | -87.9 | 0 | 0 | 0 | 111.5 | W250 D267 F273 | W250-N269 HydrophobicContact CZ2-CB 4.34Å; D267-N269 VanDerWaalsContact C-N 3.28Å; D267-N269 PolarHBondContact O-N 3.26Å; D267-N269 WeakPolarHBondContact OD1-CA 3.47Å; D267-N269 WeakPolarHBondContact OD1-CB 3.4Å; D267-N269 PolarHBondContact OD1-N 2.85Å; D267-N269 PolarHBondContact OD1-ND2 2.68Å; D267-N269 PolarHBondContact OD2-ND2 3.38Å; D267-N269 VanDerWaalsContact OD2-ND2 3.1Å; N269-F273 WeakPolarHBondContact O-CB 3.31Å; N269-F273 PolarHBondContact O-N 2.9Å |
| 270 | Y | 95.8 | Very high | 93.5 | Very high | 10 Ų | 10 | 37.2 Ų | 37.2 | 4% | 0.039 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -62.7 | -46.2 | 170.2 | 171.5 | -93.6 | 0 | 0 | 0 | 111.2 | I242 L245 P246 W250 I266 D267 F273 W274 | I242-Y270 WeakPolarHBondContact O-CE2 3.39Å; I242-Y270 PolarHBondContact O-OH 2.92Å; L245-Y270 HydrophobicContact CB-CD2 4.34Å; L245-Y270 HydrophobicContact CB-CE2 4.09Å; L245-Y270 HydrophobicContact CD1-CE2 4.46Å; P246-Y270 HydrophobicContact CG-CD1 3.83Å; P246-Y270 HydrophobicContact CG-CD2 3.88Å; P246-Y270 HydrophobicContact CG-CE1 3.55Å; P246-Y270 HydrophobicContact CG-CE2 3.61Å; P246-Y270 HydrophobicContact CG-CG 3.98Å; P246-Y270 VanDerWaalsContact CG-CZ 3.43Å; W250-Y270 HydrophobicContact CD2-CD2 4.29Å; W250-Y270 HydrophobicContact CE3-CD2 4.39Å; W250-Y270 HydrophobicContact CG-CD2 4.5Å; I266-Y270 HydrophobicContact CD1-CD1 4.4Å; I266-Y270 HydrophobicContact CD1-CE1 4.38Å; I266-Y270 HydrophobicContact CG2-CD1 3.83Å; D267-Y270 WeakPolarHBondContact O-CB 3.33Å; D267-Y270 PolarHBondContact O-N 2.73Å; D267-Y270 PolarHBondContact OD1-N 2.65Å; Y270-F273 PolarHBondContact O-N 2.62Å; Y270-W274 PolarHBondContact O-N 2.73Å |
| 271 | L | 95.4 | Very high | 93.5 | Very high | 5 Ų | 5 | 38.6 Ų | 38.6 | 3% | 0.026 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -61.5 | -45.8 | 179 | 179.6 | 58 | 0 | 0 | 0 | 111 | F263 I266 D267 E268 F273 W274 I275 D361 L362 | F263-L271 HydrophobicContact CD2-CD1 4.21Å; F263-L271 HydrophobicContact CD2-CD2 4.45Å; F263-L271 HydrophobicContact CE2-CD1 4.28Å; I266-L271 HydrophobicContact CG2-CB 4.05Å; D267-L271 PolarHBondContact O-N 2.68Å; E268-L271 PolarHBondContact O-N 2.96Å; L271-F273 PolarHBondContact O-N 3.27Å; L271-W274 PolarHBondContact O-N 2.85Å; L271-I275 HydrophobicContact CD1-CD1 3.86Å; L271-I275 HydrophobicContact CD1-CG1 4.15Å; L271-I275 HydrophobicContact CG-CD1 3.72Å; L271-I275 HydrophobicContact CG-CG1 4.46Å; L271-I275 WeakPolarHBondContact O-CB 3.37Å; L271-I275 WeakPolarHBondContact O-CD1 3.47Å; L271-I275 VanDerWaalsContact O-CG1 3.24Å; L271-I275 WeakPolarHBondContact O-CG1 3.38Å; L271-I275 PolarHBondContact O-N 3.13Å; L271-D361 WeakPolarHBondContact CD2-OD2 3.39Å; L271-L362 HydrophobicContact CB-CD2 4.23Å; L271-L362 HydrophobicContact CD2-CD2 4.09Å; L271-L362 HydrophobicContact CG-CD2 4.14Å |
| 272 | M | 95.8 | Very high | 93.8 | Very high | 92 Ų | 92 | 37.6 Ų | 37.6 | 45% | 0.453 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -58.3 | -45.7 | 174.1 | -171.8 | -170.8 | -59.3 | 0 | 0 | 112.5 | E268 W274 I275 F276 L362 | E268-M272 VanDerWaalsContact O-CB 3.31Å; E268-M272 WeakPolarHBondContact O-CB 3.47Å; E268-M272 PolarHBondContact O-N 3.37Å; M272-W274 PolarHBondContact O-N 3.46Å; M272-I275 PolarHBondContact O-N 2.95Å; M272-F276 VanDerWaalsContact O-CB 3.29Å; M272-F276 WeakPolarHBondContact O-CB 3.37Å; M272-F276 PolarHBondContact O-N 2.84Å; M272-L362 HydrophobicContact CB-CD1 3.71Å; M272-L362 HydrophobicContact CB-CD2 4.25Å; M272-L362 HydrophobicContact CE-CD1 4.46Å; M272-L362 HydrophobicContact CG-CD1 3.93Å |
| 273 | F | 96.7 | Very high | 94 | Very high | 81 Ų | 81 | 42.1 Ų | 42.1 | 36% | 0.355 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -59.2 | -45.6 | 175.3 | 166.9 | -103.4 | 0 | 0 | 0 | 111.9 | I242 N269 Y270 L271 F276 L277 | I242-F273 HydrophobicContact CG1-CE1 4.32Å; I242-F273 HydrophobicContact CG2-CE1 4.09Å; N269-F273 WeakPolarHBondContact O-CB 3.31Å; N269-F273 PolarHBondContact O-N 2.9Å; Y270-F273 PolarHBondContact O-N 2.62Å; L271-F273 PolarHBondContact O-N 3.27Å; F273-F276 PolarHBondContact O-N 3.07Å; F273-L277 HydrophobicContact CZ-CD2 4.44Å; F273-L277 WeakPolarHBondContact O-CB 3.37Å; F273-L277 PolarHBondContact O-N 3.32Å |
| 274 | W | 96.4 | Very high | 94.1 | Very high | 22 Ų | 22 | 44.4 Ų | 44.4 | 8% | 0.083 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -68.2 | -41.9 | -180 | -177.4 | 85.9 | 0 | 0 | 0 | 112.6 | T196 Y270 L271 M272 T278 W351 M358 | T196-W274 PolarHBondContact OG1-NE1 3.14Å; Y270-W274 PolarHBondContact O-N 2.73Å; L271-W274 PolarHBondContact O-N 2.85Å; M272-W274 PolarHBondContact O-N 3.46Å; W274-T278 HydrophobicContact CH2-CG2 4.49Å; W274-T278 VanDerWaalsContact O-CB 3.28Å; W274-T278 WeakPolarHBondContact O-CB 3.41Å; W274-T278 PolarHBondContact O-N 3.25Å; W274-T278 PolarHBondContact O-OG1 2.93Å; W274-W351 HydrophobicContact CH2-CZ3 4.03Å; W274-M358 HydrophobicContact CE3-SD 4.49Å; W274-M358 HydrophobicContact CH2-SD 4.48Å; W274-M358 HydrophobicContact CZ3-CE 4.4Å; W274-M358 HydrophobicContact CZ3-SD 3.67Å |
| 275 | I | 95.6 | Very high | 94.2 | Very high | 9 Ų | 9 | 44.1 Ų | 44.1 | 5% | 0.046 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -61 | -47.9 | 174.3 | -71.1 | 162.2 | 0 | 0 | 0 | 110.3 | L271 M272 T278 S279 L355 M358 V359 L362 | L271-I275 HydrophobicContact CD1-CD1 3.86Å; L271-I275 HydrophobicContact CD1-CG1 4.15Å; L271-I275 HydrophobicContact CG-CD1 3.72Å; L271-I275 HydrophobicContact CG-CG1 4.46Å; L271-I275 WeakPolarHBondContact O-CB 3.37Å; L271-I275 WeakPolarHBondContact O-CD1 3.47Å; L271-I275 VanDerWaalsContact O-CG1 3.24Å; L271-I275 WeakPolarHBondContact O-CG1 3.38Å; L271-I275 PolarHBondContact O-N 3.13Å; M272-I275 PolarHBondContact O-N 2.95Å; I275-T278 PolarHBondContact O-N 2.96Å; I275-S279 WeakPolarHBondContact O-CB 3.35Å; I275-S279 PolarHBondContact O-N 3.28Å; I275-S279 PolarHBondContact O-OG 3.38Å; I275-L355 HydrophobicContact CG2-CD2 4.47Å; I275-M358 HydrophobicContact CD1-CB 3.67Å; I275-M358 WeakPolarHBondContact CD1-O 3.39Å; I275-M358 HydrophobicContact CG1-CB 4.1Å; I275-V359 HydrophobicContact CG2-CG2 3.67Å; I275-L362 HydrophobicContact CD1-CD1 3.76Å; I275-L362 HydrophobicContact CD1-CG 4.29Å |
| 276 | F | 96.1 | Very high | 94.3 | Very high | 139 Ų | 139 | 44.6 Ų | 44.6 | 61% | 0.61 | 22% | 0.221 | S | C | * | . | H | α-helix | trans | -59.3 | -51.1 | 179.5 | 174.2 | -100.1 | 0 | 0 | 0 | 111.1 | M272 F273 T278 S279 V280 | M272-F276 VanDerWaalsContact O-CB 3.29Å; M272-F276 WeakPolarHBondContact O-CB 3.37Å; M272-F276 PolarHBondContact O-N 2.84Å; F273-F276 PolarHBondContact O-N 3.07Å; F276-T278 PolarHBondContact O-N 3.3Å; F276-S279 PolarHBondContact O-N 3.13Å; F276-V280 HydrophobicContact CD2-CG2 4.38Å; F276-V280 HydrophobicContact CE1-CG2 4.15Å; F276-V280 HydrophobicContact CE2-CG2 3.99Å; F276-V280 HydrophobicContact CZ-CG2 3.86Å; F276-V280 WeakPolarHBondContact O-CG2 3.3Å; F276-V280 PolarHBondContact O-N 3.1Å |
| 277 | L | 94.9 | Very high | 94.1 | Very high | 48 Ų | 48 | 51.1 Ų | 51.1 | 25% | 0.251 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -58.3 | -47.7 | 178.4 | 177.8 | 63.1 | 0 | 0 | 0 | 111.9 | I242 F273 V280 L281 | I242-L277 HydrophobicContact CD1-CD2 3.53Å; F273-L277 HydrophobicContact CZ-CD2 4.44Å; F273-L277 WeakPolarHBondContact O-CB 3.37Å; F273-L277 PolarHBondContact O-N 3.32Å; L277-V280 PolarHBondContact O-N 2.96Å; L277-L281 HydrophobicContact CD1-CD1 4.44Å; L277-L281 HydrophobicContact CG-CD1 4.37Å; L277-L281 WeakPolarHBondContact O-CG 3.39Å; L277-L281 PolarHBondContact O-N 2.94Å; L277-L281 VanDerWaalsContact O-N 3.09Å |
| 278 | T | 93.9 | Very high | 93.9 | Very high | 2 Ų | 2 | 51.1 Ų | 51.1 | 1% | 0.012 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -65 | -42 | -179.3 | -58.2 | 0 | 0 | 0 | 0 | 111.1 | W274 I275 F276 L281 V282 W351 L355 | W274-T278 HydrophobicContact CH2-CG2 4.49Å; W274-T278 VanDerWaalsContact O-CB 3.28Å; W274-T278 WeakPolarHBondContact O-CB 3.41Å; W274-T278 PolarHBondContact O-N 3.25Å; W274-T278 PolarHBondContact O-OG1 2.93Å; I275-T278 PolarHBondContact O-N 2.96Å; F276-T278 PolarHBondContact O-N 3.3Å; T278-L281 PolarHBondContact O-N 3.19Å; T278-V282 HydrophobicContact CG2-CG2 4.42Å; T278-V282 WeakPolarHBondContact O-CB 3.18Å; T278-V282 WeakPolarHBondContact O-CG2 3.14Å; T278-V282 PolarHBondContact O-N 3.49Å; T278-W351 HydrophobicContact CG2-CE3 3.87Å; T278-W351 HydrophobicContact CG2-CH2 4.24Å; T278-W351 HydrophobicContact CG2-CZ3 3.57Å; T278-L355 HydrophobicContact CG2-CD2 4.23Å |
| 279 | S | 94.4 | Very high | 93.7 | Very high | 28 Ų | 28 | 49 Ų | 49 | 20% | 0.196 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -63.1 | -44.3 | 177.4 | -59.9 | 0 | 0 | 0 | 0 | 111.8 | I275 F276 L281 V282 I283 | I275-S279 WeakPolarHBondContact O-CB 3.35Å; I275-S279 PolarHBondContact O-N 3.28Å; I275-S279 PolarHBondContact O-OG 3.38Å; F276-S279 PolarHBondContact O-N 3.13Å; S279-L281 VanDerWaalsContact C-N 3.34Å; S279-L281 PolarHBondContact O-N 3.32Å; S279-V282 PolarHBondContact O-N 2.88Å; S279-I283 WeakPolarHBondContact O-CB 3.05Å; S279-I283 WeakPolarHBondContact O-CD1 3.45Å; S279-I283 WeakPolarHBondContact O-CG1 3.38Å; S279-I283 PolarHBondContact O-N 3.11Å |
| 280 | V | 95 | Very high | 93.4 | Very high | 71 Ų | 71 | 48.6 Ų | 48.6 | 43% | 0.43 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -59.8 | -43.5 | 175.4 | 168.2 | 0 | 0 | 0 | 0 | 111.2 | F276 L277 F284 | F276-V280 HydrophobicContact CD2-CG2 4.38Å; F276-V280 HydrophobicContact CE1-CG2 4.15Å; F276-V280 HydrophobicContact CE2-CG2 3.99Å; F276-V280 HydrophobicContact CZ-CG2 3.86Å; F276-V280 WeakPolarHBondContact O-CG2 3.3Å; F276-V280 PolarHBondContact O-N 3.1Å; L277-V280 PolarHBondContact O-N 2.96Å; V280-F284 WeakPolarHBondContact O-CB 3.2Å; V280-F284 PolarHBondContact O-N 3.34Å |
| 281 | L | 93.1 | Very high | 93.1 | Very high | 30 Ų | 30 | 50.2 Ų | 50.2 | 16% | 0.157 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -64.6 | -46.3 | 176.6 | -69.1 | 171.9 | 0 | 0 | 0 | 112.1 | V199 F203 L277 T278 S279 F284 I285 | V199-L281 HydrophobicContact CG1-CB 3.83Å; V199-L281 HydrophobicContact CG1-CD1 4.18Å; F203-L281 HydrophobicContact CB-CD2 4.41Å; F203-L281 HydrophobicContact CD1-CD2 4.26Å; F203-L281 HydrophobicContact CD2-CD2 3.74Å; F203-L281 HydrophobicContact CE1-CD2 4.43Å; F203-L281 HydrophobicContact CE2-CD2 3.93Å; F203-L281 HydrophobicContact CG-CD2 3.9Å; F203-L281 HydrophobicContact CZ-CD2 4.27Å; L277-L281 HydrophobicContact CD1-CD1 4.44Å; L277-L281 HydrophobicContact CG-CD1 4.37Å; L277-L281 WeakPolarHBondContact O-CG 3.39Å; L277-L281 PolarHBondContact O-N 2.94Å; L277-L281 VanDerWaalsContact O-N 3.09Å; T278-L281 PolarHBondContact O-N 3.19Å; S279-L281 VanDerWaalsContact C-N 3.34Å; S279-L281 PolarHBondContact O-N 3.32Å; L281-F284 PolarHBondContact O-N 3.42Å; L281-I285 WeakPolarHBondContact O-CD1 3.34Å; L281-I285 VanDerWaalsContact O-CG1 3.23Å; L281-I285 WeakPolarHBondContact O-CG1 3.44Å; L281-I285 PolarHBondContact O-N 3.49Å |
| 282 | V | 92.4 | Very high | 92.6 | Very high | 10 Ų | 10 | 50.1 Ų | 50.1 | 6% | 0.061 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -63.5 | -45.9 | 178.9 | 169.6 | 0 | 0 | 0 | 0 | 111.3 | V199 T278 S279 F284 I285 I286 L347 W351 | V199-V282 HydrophobicContact CG1-CG2 4.33Å; T278-V282 HydrophobicContact CG2-CG2 4.42Å; T278-V282 WeakPolarHBondContact O-CB 3.18Å; T278-V282 WeakPolarHBondContact O-CG2 3.14Å; T278-V282 PolarHBondContact O-N 3.49Å; S279-V282 PolarHBondContact O-N 2.88Å; V282-F284 VanDerWaalsContact C-N 3.33Å; V282-F284 PolarHBondContact O-N 3.49Å; V282-I285 PolarHBondContact O-N 3.18Å; V282-I286 HydrophobicContact CG1-CD1 3.84Å; V282-I286 VanDerWaalsContact O-CG1 3.31Å; V282-I286 WeakPolarHBondContact O-CG1 3.32Å; V282-I286 PolarHBondContact O-N 3.1Å; V282-L347 HydrophobicContact CG1-CD2 4.14Å; V282-L347 HydrophobicContact CG1-CG 4.31Å; V282-W351 HydrophobicContact CG2-CD2 4.41Å; V282-W351 HydrophobicContact CG2-CG 4.28Å |
| 283 | I | 92.8 | Very high | 92.1 | Very high | 113 Ų | 113 | 46.4 Ų | 46.4 | 58% | 0.579 | 22% | 0.221 | S | C | * | . | H | α-helix | trans | -60.5 | -42.3 | 176 | -69.4 | 166 | 0 | 0 | 0 | 110.7 | S279 I286 Y287 | S279-I283 WeakPolarHBondContact O-CB 3.05Å; S279-I283 WeakPolarHBondContact O-CD1 3.45Å; S279-I283 WeakPolarHBondContact O-CG1 3.38Å; S279-I283 PolarHBondContact O-N 3.11Å; I283-I286 PolarHBondContact O-N 2.99Å; I283-Y287 WeakPolarHBondContact O-CB 3.45Å; I283-Y287 PolarHBondContact O-N 3.48Å |
| 284 | F | 92.7 | Very high | 91.5 | Very high | 87 Ų | 87 | 48.5 Ų | 48.5 | 38% | 0.382 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -63.5 | -42.2 | 175.5 | -174.8 | -81.2 | 0 | 0 | 0 | 112.3 | F203 I207 V280 L281 V282 Y287 A288 | F203-F284 HydrophobicContact CD2-CB 4.5Å; F203-F284 AromaticContact CD2-CD1 3.59Å; F203-F284 HydrophobicContact CD2-CD1 3.59Å; F203-F284 HydrophobicContact CD2-CE1 4.13Å; F203-F284 HydrophobicContact CD2-CG 4.26Å; F203-F284 HydrophobicContact CE2-CB 4.23Å; F203-F284 AromaticContact CE2-CD1 3.27Å; F203-F284 HydrophobicContact CE2-CD1 3.27Å; F203-F284 HydrophobicContact CE2-CD2 4.41Å; F203-F284 AromaticContact CE2-CE1 3.62Å; F203-F284 HydrophobicContact CE2-CE1 3.62Å; F203-F284 AromaticContact CE2-CG 3.73Å; F203-F284 HydrophobicContact CE2-CG 3.73Å; F203-F284 HydrophobicContact CE2-CZ 4.32Å; F203-F284 HydrophobicContact CZ-CD1 4.39Å; F203-F284 HydrophobicContact CZ-CE1 4.38Å; I207-F284 HydrophobicContact CG1-CE1 4.29Å; V280-F284 WeakPolarHBondContact O-CB 3.2Å; V280-F284 PolarHBondContact O-N 3.34Å; L281-F284 PolarHBondContact O-N 3.42Å; V282-F284 VanDerWaalsContact C-N 3.33Å; V282-F284 PolarHBondContact O-N 3.49Å; F284-Y287 PolarHBondContact O-N 3.39Å; F284-A288 HydrophobicContact CD1-CB 4.45Å; F284-A288 HydrophobicContact CE1-CB 4.27Å; F284-A288 VanDerWaalsContact O-CB 3.25Å; F284-A288 WeakPolarHBondContact O-CB 3.35Å; F284-A288 PolarHBondContact O-N 3.42Å |
| 285 | I | 91.9 | Very high | 91 | Very high | 1 Ų | 1 | 50.1 Ų | 50.1 | 1% | 0.005 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -60.7 | -45.8 | 176.5 | -69.3 | 160.9 | 0 | 0 | 0 | 110.4 | V199 L202 F203 A206 L281 V282 A288 Y289 L347 | V199-I285 HydrophobicContact CG1-CD1 4.22Å; L202-I285 HydrophobicContact CB-CD1 4.02Å; F203-I285 HydrophobicContact CB-CD1 4.05Å; F203-I285 HydrophobicContact CB-CG1 4.12Å; F203-I285 HydrophobicContact CD2-CG1 4.41Å; A206-I285 HydrophobicContact CB-CG1 4.43Å; L281-I285 WeakPolarHBondContact O-CD1 3.34Å; L281-I285 VanDerWaalsContact O-CG1 3.23Å; L281-I285 WeakPolarHBondContact O-CG1 3.44Å; L281-I285 PolarHBondContact O-N 3.49Å; V282-I285 PolarHBondContact O-N 3.18Å; I285-A288 PolarHBondContact O-N 3.3Å; I285-Y289 HydrophobicContact CG2-CD2 3.61Å; I285-Y289 HydrophobicContact CG2-CE2 3.47Å; I285-Y289 VanDerWaalsContact CG2-CE2 3.47Å; I285-Y289 WeakPolarHBondContact O-CD2 3.23Å; I285-Y289 PolarHBondContact O-N 3.17Å; I285-L347 HydrophobicContact CB-CD2 4.15Å; I285-L347 HydrophobicContact CG2-CD2 3.63Å |
| 286 | I | 91.2 | Very high | 90.2 | Very high | 38 Ų | 38 | 51.1 Ų | 51.1 | 20% | 0.195 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -59.1 | -52.5 | 176.1 | -70.5 | 169.6 | 0 | 0 | 0 | 110.1 | V282 I283 A288 Y289 I290 L344 L347 V348 | V282-I286 HydrophobicContact CG1-CD1 3.84Å; V282-I286 VanDerWaalsContact O-CG1 3.31Å; V282-I286 WeakPolarHBondContact O-CG1 3.32Å; V282-I286 PolarHBondContact O-N 3.1Å; I283-I286 PolarHBondContact O-N 2.99Å; I286-A288 PolarHBondContact O-N 3.3Å; I286-Y289 PolarHBondContact O-N 3.43Å; I286-I290 HydrophobicContact CG2-CD1 3.72Å; I286-I290 WeakPolarHBondContact O-CG1 3.29Å; I286-I290 PolarHBondContact O-N 2.97Å; I286-L344 HydrophobicContact CG1-CG 4.49Å; I286-L344 HydrophobicContact CG2-CD1 4.14Å; I286-L347 HydrophobicContact CG1-CD2 3.95Å; I286-V348 HydrophobicContact CD1-CG2 3.86Å |
| 287 | Y | 91.5 | Very high | 89.5 | Confident | 144 Ų | 144 | 47.6 Ų | 47.6 | 57% | 0.565 | 23% | 0.229 | S | C | * | . | H | α-helix | trans | -56.7 | -47.8 | 177.4 | 171.7 | -96.2 | 0 | 0 | 0 | 112.2 | I283 F284 Y289 I290 Y291 | I283-Y287 WeakPolarHBondContact O-CB 3.45Å; I283-Y287 PolarHBondContact O-N 3.48Å; F284-Y287 PolarHBondContact O-N 3.39Å; Y287-Y289 VanDerWaalsContact C-N 3.34Å; Y287-Y289 PolarHBondContact O-N 2.99Å; Y287-I290 PolarHBondContact O-N 2.97Å; Y287-Y291 WeakPolarHBondContact O-CB 3.05Å; Y287-Y291 PolarHBondContact O-N 3.3Å |
| 288 | A | 89.9 | Confident | 88.8 | Confident | 1 Ų | 1 | 48.6 Ų | 48.6 | 1% | 0.008 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -61 | -42.3 | 179.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | A206 F284 I285 I286 I292 | A206-A288 HydrophobicContact CB-CB 4.23Å; F284-A288 HydrophobicContact CD1-CB 4.45Å; F284-A288 HydrophobicContact CE1-CB 4.27Å; F284-A288 VanDerWaalsContact O-CB 3.25Å; F284-A288 WeakPolarHBondContact O-CB 3.35Å; F284-A288 PolarHBondContact O-N 3.42Å; I285-A288 PolarHBondContact O-N 3.3Å; I286-A288 PolarHBondContact O-N 3.3Å; A288-I292 WeakPolarHBondContact O-CB 3.4Å; A288-I292 WeakPolarHBondContact O-CD1 3.36Å; A288-I292 WeakPolarHBondContact O-CG1 3.35Å; A288-I292 PolarHBondContact O-N 3.07Å |
| 289 | Y | 88.5 | Confident | 87.9 | Confident | 7 Ų | 7 | 53 Ų | 53 | 3% | 0.027 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -72.5 | -36.3 | 177.5 | -73.7 | -44.1 | 0 | 0 | 0 | 113.7 | A206 I285 I286 Y287 I292 L293 L340 I343 | A206-Y289 HydrophobicContact CB-CE1 4.5Å; A206-Y289 HydrophobicContact CB-CE2 4.5Å; I285-Y289 HydrophobicContact CG2-CD2 3.61Å; I285-Y289 HydrophobicContact CG2-CE2 3.47Å; I285-Y289 VanDerWaalsContact CG2-CE2 3.47Å; I285-Y289 WeakPolarHBondContact O-CD2 3.23Å; I285-Y289 PolarHBondContact O-N 3.17Å; I286-Y289 PolarHBondContact O-N 3.43Å; Y287-Y289 VanDerWaalsContact C-N 3.34Å; Y287-Y289 PolarHBondContact O-N 2.99Å; Y289-I292 HydrophobicContact CD1-CD1 4Å; Y289-I292 HydrophobicContact CE1-CD1 4.48Å; Y289-I292 PolarHBondContact O-N 3.29Å; Y289-L293 WeakPolarHBondContact O-CB 3.5Å; Y289-L293 WeakPolarHBondContact O-CG 3.31Å; Y289-L293 PolarHBondContact O-N 2.95Å; Y289-L340 HydrophobicContact CD1-CD2 3.33Å; Y289-L340 HydrophobicContact CE1-CD2 3.62Å; Y289-L340 HydrophobicContact CG-CD2 4.12Å; Y289-I343 HydrophobicContact CD2-CG2 4.05Å; Y289-I343 HydrophobicContact CE2-CG2 3.59Å |
| 290 | I | 88.3 | Confident | 87.1 | Confident | 82 Ų | 82 | 52.7 Ų | 52.7 | 42% | 0.421 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -62.7 | -46.1 | 171.4 | -68.4 | 170.2 | 0 | 0 | 0 | 110.4 | I286 Y287 I292 L293 W294 L344 | I286-I290 HydrophobicContact CG2-CD1 3.72Å; I286-I290 WeakPolarHBondContact O-CG1 3.29Å; I286-I290 PolarHBondContact O-N 2.97Å; Y287-I290 PolarHBondContact O-N 2.97Å; I290-I292 VanDerWaalsContact C-N 3.33Å; I290-I292 PolarHBondContact O-N 2.81Å; I290-L293 WeakPolarHBondContact O-CB 3.24Å; I290-L293 PolarHBondContact O-N 2.95Å; I290-W294 WeakPolarHBondContact O-CB 3.42Å; I290-W294 PolarHBondContact O-N 2.83Å; I290-L344 HydrophobicContact CD1-CD1 4.24Å; I290-L344 HydrophobicContact CG1-CD1 3.69Å |
| 291 | Y | 88.3 | Confident | 86.3 | Confident | 44 Ų | 44 | 52.1 Ų | 52.1 | 17% | 0.173 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -60.5 | -41.8 | 175.9 | 177.3 | -91.9 | 0 | 0 | 0 | 112 | Y210 H214 Y287 W294 K295 | Y210-Y291 AromaticContact CD2-CD1 3.87Å; Y210-Y291 HydrophobicContact CD2-CD1 3.87Å; Y210-Y291 HydrophobicContact CD2-CE1 4.1Å; Y210-Y291 AromaticContact CE2-CD1 3.54Å; Y210-Y291 HydrophobicContact CE2-CD1 3.54Å; Y210-Y291 AromaticContact CE2-CE1 3.49Å; Y210-Y291 HydrophobicContact CE2-CE1 3.49Å; Y210-Y291 VanDerWaalsContact CE2-CE1 3.49Å; Y210-Y291 HydrophobicContact CE2-CG 4.4Å; H214-Y291 PolarHBondContact ND1-OH 3.33Å; Y287-Y291 WeakPolarHBondContact O-CB 3.05Å; Y287-Y291 PolarHBondContact O-N 3.3Å; Y291-W294 HydrophobicContact CD2-CE3 4.17Å; Y291-W294 HydrophobicContact CD2-CZ3 4.41Å; Y291-W294 HydrophobicContact CE2-CE3 4.23Å; Y291-W294 HydrophobicContact CE2-CZ3 4.1Å; Y291-W294 PolarHBondContact O-N 2.83Å; Y291-K295 HydrophobicContact CE1-CD 3.72Å; Y291-K295 VanDerWaalsContact O-CB 3.25Å; Y291-K295 WeakPolarHBondContact O-CB 3.23Å; Y291-K295 PolarHBondContact O-N 3.42Å; Y291-K295 PolarHBondContact OH-NZ 3.35Å |
| 292 | I | 85.4 | Confident | 85.5 | Confident | 3 Ų | 3 | 57.7 Ų | 57.7 | 2% | 0.015 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -61.4 | -45.7 | 175 | -75.8 | 163.1 | 0 | 0 | 0 | 111 | R209 I213 A288 Y289 I290 K295 A296 L340 | R209-I292 HydrophobicContact CB-CD1 3.76Å; I213-I292 HydrophobicContact CD1-CB 4.42Å; I213-I292 HydrophobicContact CD1-CG1 4.22Å; I213-I292 HydrophobicContact CD1-CG2 3.52Å; A288-I292 WeakPolarHBondContact O-CB 3.4Å; A288-I292 WeakPolarHBondContact O-CD1 3.36Å; A288-I292 WeakPolarHBondContact O-CG1 3.35Å; A288-I292 PolarHBondContact O-N 3.07Å; Y289-I292 HydrophobicContact CD1-CD1 4Å; Y289-I292 HydrophobicContact CE1-CD1 4.48Å; Y289-I292 PolarHBondContact O-N 3.29Å; I290-I292 VanDerWaalsContact C-N 3.33Å; I290-I292 PolarHBondContact O-N 2.81Å; I292-K295 PolarHBondContact O-N 3.21Å; I292-A296 VanDerWaalsContact O-CB 3.26Å; I292-A296 WeakPolarHBondContact O-CB 3.21Å; I292-A296 PolarHBondContact O-N 3.06Å; I292-L340 HydrophobicContact CG2-CD1 3.59Å |
| 293 | L | 84.3 | Confident | 84.4 | Confident | 15 Ų | 15 | 61.6 Ų | 61.6 | 8% | 0.079 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -60.5 | -49.6 | 176.8 | -79 | 168.9 | 0 | 0 | 0 | 111.6 | Y289 I290 K295 A296 H297 A337 L340 V341 | Y289-L293 WeakPolarHBondContact O-CB 3.5Å; Y289-L293 WeakPolarHBondContact O-CG 3.31Å; Y289-L293 PolarHBondContact O-N 2.95Å; I290-L293 WeakPolarHBondContact O-CB 3.24Å; I290-L293 PolarHBondContact O-N 2.95Å; L293-K295 PolarHBondContact O-N 3.02Å; L293-A296 PolarHBondContact O-N 2.81Å; L293-H297 WeakPolarHBondContact O-CB 3.31Å; L293-H297 PolarHBondContact O-N 2.93Å; L293-A337 HydrophobicContact CD2-CB 3.66Å; L293-L340 HydrophobicContact CD1-CB 4.29Å; L293-L340 HydrophobicContact CD2-CB 3.8Å; L293-L340 HydrophobicContact CD2-CD1 3.95Å; L293-L340 HydrophobicContact CG-CB 4.03Å; L293-L340 HydrophobicContact CG-CD1 4.19Å; L293-V341 HydrophobicContact CD1-CG2 3.84Å; L293-V341 HydrophobicContact CD2-CG2 4.25Å |
| 294 | W | 85.9 | Confident | 83.4 | Confident | 124 Ų | 124 | 61.4 Ų | 61.4 | 47% | 0.47 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -60 | -45.7 | 178.2 | 177.6 | 65.7 | 0 | 0 | 0 | 112.1 | I290 Y291 H297 H298 | I290-W294 WeakPolarHBondContact O-CB 3.42Å; I290-W294 PolarHBondContact O-N 2.83Å; Y291-W294 HydrophobicContact CD2-CE3 4.17Å; Y291-W294 HydrophobicContact CD2-CZ3 4.41Å; Y291-W294 HydrophobicContact CE2-CE3 4.23Å; Y291-W294 HydrophobicContact CE2-CZ3 4.1Å; Y291-W294 PolarHBondContact O-N 2.83Å; W294-H297 PolarHBondContact O-N 3.37Å; W294-H298 WeakPolarHBondContact O-CB 3.05Å; W294-H298 PolarHBondContact O-N 2.98Å |
| 295 | K | 84.1 | Confident | 82.2 | Confident | 56 Ų | 56 | 60.9 Ų | 60.9 | 24% | 0.243 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -67.5 | -37.8 | 179.1 | -171.2 | 161.1 | -176.1 | 164.4 | 0 | 112.8 | I213 H214 Y291 I292 L293 H299 | I213-K295 HydrophobicContact CG2-CD 4.12Å; I213-K295 HydrophobicContact CG2-CG 4.22Å; H214-K295 PolarHBondContact ND1-NZ 2.76Å; Y291-K295 HydrophobicContact CE1-CD 3.72Å; Y291-K295 VanDerWaalsContact O-CB 3.25Å; Y291-K295 WeakPolarHBondContact O-CB 3.23Å; Y291-K295 PolarHBondContact O-N 3.42Å; Y291-K295 PolarHBondContact OH-NZ 3.35Å; I292-K295 PolarHBondContact O-N 3.21Å; L293-K295 PolarHBondContact O-N 3.02Å; K295-H299 WeakPolarHBondContact O-CB 3.32Å; K295-H299 PolarHBondContact O-N 2.9Å |
| 296 | A | 79.2 | Confident | 80.9 | Confident | 30 Ų | 30 | 70 Ų | 70 | 25% | 0.248 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -65.6 | -45.3 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | I292 L293 H299 A300 | I292-A296 VanDerWaalsContact O-CB 3.26Å; I292-A296 WeakPolarHBondContact O-CB 3.21Å; I292-A296 PolarHBondContact O-N 3.06Å; L293-A296 PolarHBondContact O-N 2.81Å; A296-H299 PolarHBondContact O-N 3.19Å; A296-A300 PolarHBondContact O-N 3.42Å |
| 297 | H | 81.1 | Confident | 79.3 | Confident | 65 Ų | 65 | 71 Ų | 71 | 30% | 0.301 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -59.4 | -49.5 | 174.8 | -178.3 | -100.2 | 0 | 0 | 0 | 111.5 | L293 W294 H299 A300 V301 | L293-H297 WeakPolarHBondContact O-CB 3.31Å; L293-H297 PolarHBondContact O-N 2.93Å; W294-H297 PolarHBondContact O-N 3.37Å; H297-H299 VanDerWaalsContact C-N 3.29Å; H297-H299 PolarHBondContact O-N 3.42Å; H297-A300 PolarHBondContact O-N 3.26Å; H297-A300 VanDerWaalsContact O-N 3.12Å; H297-V301 WeakPolarHBondContact O-CG2 3.47Å; H297-V301 PolarHBondContact O-N 3.48Å |
| 298 | H | 80.2 | Confident | 77.4 | Confident | 70 Ų | 70 | 69 Ų | 69 | 32% | 0.324 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -61 | -38.8 | 179.2 | -166.2 | -5.4 | 0 | 0 | 0 | 112.1 | W294 R302 | W294-H298 WeakPolarHBondContact O-CB 3.05Å; W294-H298 PolarHBondContact O-N 2.98Å; H298-R302 PolarHBondContact CE1-NE 3.4Å; H298-R302 PolarHBondContact CE1-NH2 3.44Å; H298-R302 VanDerWaalsContact CE1-NH2 3.35Å; H298-R302 PolarHBondContact ND1-NE 3.34Å; H298-R302 PolarHBondContact NE2-NH2 3.01Å; H298-R302 WeakPolarHBondContact O-CG 3.48Å; H298-R302 PolarHBondContact O-N 2.96Å |
| 299 | H | 76.6 | Confident | 75.5 | Confident | 93 Ų | 93 | 77.2 Ų | 77.2 | 43% | 0.431 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -64.3 | -44.5 | 174 | -177.9 | -94.5 | 0 | 0 | 0 | 112.1 | K295 A296 H297 R302 M303 | K295-H299 WeakPolarHBondContact O-CB 3.32Å; K295-H299 PolarHBondContact O-N 2.9Å; A296-H299 PolarHBondContact O-N 3.19Å; H297-H299 VanDerWaalsContact C-N 3.29Å; H297-H299 PolarHBondContact O-N 3.42Å; H299-R302 PolarHBondContact O-N 3.36Å; H299-M303 WeakPolarHBondContact O-CB 3.38Å; H299-M303 WeakPolarHBondContact O-CG 3.37Å; H299-M303 PolarHBondContact O-N 3.42Å |
| 300 | A | 76.8 | Confident | 73.4 | Confident | 22 Ų | 22 | 85.4 Ų | 85.4 | 18% | 0.182 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -60.7 | -44.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112 | A296 H297 M303 L304 | A296-A300 PolarHBondContact O-N 3.42Å; H297-A300 PolarHBondContact O-N 3.26Å; H297-A300 VanDerWaalsContact O-N 3.12Å; A300-M303 PolarHBondContact O-N 3.48Å; A300-L304 WeakPolarHBondContact O-CG 3.26Å; A300-L304 PolarHBondContact O-N 2.93Å |
| 301 | V | 77.8 | Confident | 71.4 | Confident | 60 Ų | 60 | 86.3 Ų | 86.3 | 36% | 0.364 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -60.3 | -49.9 | 175 | 174.2 | 0 | 0 | 0 | 0 | 111.1 | H297 M303 L304 S305 | H297-V301 WeakPolarHBondContact O-CG2 3.47Å; H297-V301 PolarHBondContact O-N 3.48Å; V301-M303 VanDerWaalsContact C-N 3.25Å; V301-M303 PolarHBondContact O-N 3.48Å; V301-L304 PolarHBondContact O-N 3.44Å; V301-L304 VanDerWaalsContact O-N 3.09Å; V301-S305 PolarHBondContact O-N 2.94Å; V301-S305 PolarHBondContact O-OG 3.23Å |
| 302 | R | 77.1 | Confident | 69.6 | Low | 146 Ų | 146 | 90.5 Ų | 90.5 | 55% | 0.551 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -58.4 | -36.5 | 176.6 | -75.3 | 178.5 | -175 | 171.1 | 8.9 | 112.6 | H298 H299 R306 | H298-R302 PolarHBondContact CE1-NE 3.4Å; H298-R302 PolarHBondContact CE1-NH2 3.44Å; H298-R302 VanDerWaalsContact CE1-NH2 3.35Å; H298-R302 PolarHBondContact ND1-NE 3.34Å; H298-R302 PolarHBondContact NE2-NH2 3.01Å; H298-R302 WeakPolarHBondContact O-CG 3.48Å; H298-R302 PolarHBondContact O-N 2.96Å; H299-R302 PolarHBondContact O-N 3.36Å; R302-R306 WeakPolarHBondContact O-CB 3.46Å; R302-R306 WeakPolarHBondContact O-CG 3.3Å; R302-R306 PolarHBondContact O-N 2.94Å; R302-R306 VanDerWaalsContact O-N 3.12Å |
| 303 | M | 69.8 | Low | 68.1 | Low | 92 Ų | 92 | 94.1 Ų | 94.1 | 45% | 0.453 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -69 | -39.9 | 175.9 | -76.7 | -65.2 | -153.6 | 0 | 0 | 112.1 | H299 A300 V301 R306 A307 | H299-M303 WeakPolarHBondContact O-CB 3.38Å; H299-M303 WeakPolarHBondContact O-CG 3.37Å; H299-M303 PolarHBondContact O-N 3.42Å; A300-M303 PolarHBondContact O-N 3.48Å; V301-M303 VanDerWaalsContact C-N 3.25Å; V301-M303 PolarHBondContact O-N 3.48Å; M303-R306 PolarHBondContact O-N 3.29Å; M303-A307 WeakPolarHBondContact O-CB 3.37Å; M303-A307 PolarHBondContact O-N 3.09Å |
| 304 | L | 70 | Confident | 66.8 | Low | 110 Ų | 110 | 98 Ų | 98 | 58% | 0.576 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -64.4 | -45.7 | 174.9 | -70.5 | 169.1 | 0 | 0 | 0 | 111.7 | A300 V301 R306 A307 S308 | A300-L304 WeakPolarHBondContact O-CG 3.26Å; A300-L304 PolarHBondContact O-N 2.93Å; V301-L304 PolarHBondContact O-N 3.44Å; V301-L304 VanDerWaalsContact O-N 3.09Å; L304-R306 VanDerWaalsContact C-N 3.3Å; L304-R306 PolarHBondContact O-N 3.42Å; L304-A307 PolarHBondContact O-N 3.32Å; L304-S308 PolarHBondContact O-N 2.99Å |
| 305 | S | 69.4 | Low | 65.5 | Low | 76 Ų | 76 | 100.3 Ų | 100.3 | 53% | 0.531 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -59.3 | -39.7 | 175.9 | -52.3 | 0 | 0 | 0 | 0 | 112.4 | V301 | V301-S305 PolarHBondContact O-N 2.94Å; V301-S305 PolarHBondContact O-OG 3.23Å |
| 306 | R | 64.1 | Low | 64 | Low | 191 Ų | 191 | 100.3 Ų | 100.3 | 72% | 0.721 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -74.6 | -34.4 | 175.9 | -73.4 | 176.4 | 173.1 | -173.5 | -3.8 | 113.4 | R302 M303 L304 Q309 | R302-R306 WeakPolarHBondContact O-CB 3.46Å; R302-R306 WeakPolarHBondContact O-CG 3.3Å; R302-R306 PolarHBondContact O-N 2.94Å; R302-R306 VanDerWaalsContact O-N 3.12Å; M303-R306 PolarHBondContact O-N 3.29Å; L304-R306 VanDerWaalsContact C-N 3.3Å; L304-R306 PolarHBondContact O-N 3.42Å; R306-Q309 PolarHBondContact O-N 2.9Å |
| 307 | A | 58.1 | Low | 63.2 | Low | 61 Ų | 61 | 104 Ų | 104 | 50% | 0.504 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -69.5 | -33.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112 | M303 L304 Q309 K310 | M303-A307 WeakPolarHBondContact O-CB 3.37Å; M303-A307 PolarHBondContact O-N 3.09Å; L304-A307 PolarHBondContact O-N 3.32Å; A307-Q309 PolarHBondContact O-N 2.93Å; A307-Q309 VanDerWaalsContact O-N 3.14Å; A307-K310 CarbonylContact O-C 3.59Å; A307-K310 PolarHBondContact O-N 3.33Å |
| 308 | S | 51.5 | Low | 62.2 | Low | 102 Ų | 102 | 107.8 Ų | 107.8 | 71% | 0.713 | 57% | 0.573 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.9 | -23.8 | 174.1 | -160.2 | 0 | 0 | 0 | 0 | 113.4 | L304 | L304-S308 PolarHBondContact O-N 2.99Š|
| 309 | Q | 48.3 | Very low | 61.3 | Low | 172 Ų | 172 | 107.1 Ų | 107.1 | 80% | 0.804 | 59% | 0.585 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.6 | -4.6 | 175.5 | -74.7 | -163.3 | -30.3 | 0 | 0 | 115.2 | R306 A307 | R306-Q309 PolarHBondContact O-N 2.9Å; A307-Q309 PolarHBondContact O-N 2.93Å; A307-Q309 VanDerWaalsContact O-N 3.14Å |
| 310 | K | 45.7 | Very low | 60.5 | Low | 180 Ų | 180 | 107 Ų | 107 | 78% | 0.783 | 59% | 0.591 | S | S | * | * | trans | -138.8 | 57.1 | -178.3 | -71.1 | -167.7 | 176.7 | -175.8 | 0 | 113.5 | A307 L312 | A307-K310 CarbonylContact O-C 3.59Å; A307-K310 PolarHBondContact O-N 3.33Å; K310-L312 VanDerWaalsContact C-N 3.27Å; K310-L312 PolarHBondContact O-N 2.85Å | ||
| 311 | S | 45.7 | Very low | 59.3 | Low | 100 Ų | 100 | 114.1 Ų | 114.1 | 70% | 0.699 | 62% | 0.618 | S | S | * | * | trans | -73.3 | 81.1 | 156.6 | 45.7 | 0 | 0 | 0 | 0 | 109.9 | V313 | S311-V313 PolarHBondContact O-N 3.33Š| ||
| 312 | L | 50 | Low | 58.1 | Low | 133 Ų | 133 | 115.2 Ų | 115.2 | 70% | 0.696 | 62% | 0.624 | S | S | * | * | trans | -71.6 | 98.1 | 177.9 | -161.2 | 138.1 | 0 | 0 | 0 | 109.7 | K310 I314 | K310-L312 VanDerWaalsContact C-N 3.27Å; K310-L312 PolarHBondContact O-N 2.85Å; L312-I314 HydrophobicContact CD2-CD1 4.22Å; L312-I314 HydrophobicContact CD2-CG1 3.57Å; L312-I314 PolarHBondContact O-N 3.42Å | ||
| 313 | V | 54.9 | Low | 56.8 | Low | 79 Ų | 79 | 116.1 Ų | 116.1 | 48% | 0.479 | 64% | 0.635 | S | S | . | * | trans | -74.6 | 104.7 | 176 | 179.2 | 0 | 0 | 0 | 0 | 108.4 | S311 Y315 | S311-V313 PolarHBondContact O-N 3.33Å; V313-Y315 HydrophobicContact CG1-CD2 4.36Å; V313-Y315 HydrophobicContact CG1-CE1 4.46Å; V313-Y315 HydrophobicContact CG1-CE2 3.98Å | ||
| 314 | I | 56.8 | Low | 55.7 | Low | 95 Ų | 95 | 116.5 Ų | 116.5 | 49% | 0.487 | 64% | 0.643 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -83.4 | 115.5 | 170.8 | -55.8 | 178.2 | 0 | 0 | 0 | 107.6 | L312 | L312-I314 HydrophobicContact CD2-CD1 4.22Å; L312-I314 HydrophobicContact CD2-CG1 3.57Å; L312-I314 PolarHBondContact O-N 3.42Å |
| 315 | Y | 57.4 | Low | 54.7 | Low | 174 Ų | 174 | 116.3 Ų | 116.3 | 68% | 0.682 | 65% | 0.646 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -77.9 | 120.4 | 166.7 | -65.9 | -87.9 | 0 | 0 | 0 | 108.3 | V313 | V313-Y315 HydrophobicContact CG1-CD2 4.36Å; V313-Y315 HydrophobicContact CG1-CE1 4.46Å; V313-Y315 HydrophobicContact CG1-CE2 3.98Å |
| 316 | S | 54.4 | Low | 54 | Low | 55 Ų | 55 | 124 Ų | 124 | 39% | 0.385 | 66% | 0.663 | S | S | . | * | trans | -74 | 154.6 | 165.9 | -165.4 | 0 | 0 | 0 | 0 | 109.7 | D318 G319 | S316-D318 PolarHBondContact O-N 2.87Å; S316-D318 VanDerWaalsContact O-N 3.16Å; S316-G319 PolarHBondContact O-N 2.83Å | ||
| 317 | A | 60.5 | Low | 53.5 | Low | 107 Ų | 107 | 117.4 Ų | 117.4 | 88% | 0.884 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.6 | -28.6 | -179 | 0 | 0 | 0 | 0 | 0 | 113.3 | G319 | A317-G319 VanDerWaalsContact C-N 3.27Å; A317-G319 PolarHBondContact O-N 3.4Å |
| 318 | D | 61.6 | Low | 53.1 | Low | 145 Ų | 145 | 119.9 Ų | 119.9 | 78% | 0.775 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.1 | 20.5 | 175.9 | -64.1 | -42.6 | 0 | 0 | 0 | 114.2 | S316 T320 | S316-D318 PolarHBondContact O-N 2.87Å; S316-D318 VanDerWaalsContact O-N 3.16Å; D318-T320 PolarHBondContact O-N 2.86Å; D318-T320 PolarHBondContact O-OG1 2.88Å |
| 319 | G | 61.3 | Low | 53.1 | Low | 57 Ų | 57 | 119.6 Ų | 119.6 | 59% | 0.588 | 64% | 0.638 | S | S | * | * | trans | 67.2 | -0.9 | 176 | 0 | 0 | 0 | 0 | 0 | 115.9 | S316 A317 K321 | S316-G319 PolarHBondContact O-N 2.83Å; A317-G319 VanDerWaalsContact C-N 3.27Å; A317-G319 PolarHBondContact O-N 3.4Å; G319-K321 PolarHBondContact O-N 2.81Å | ||
| 320 | T | 59.1 | Low | 53.2 | Low | 89 Ų | 89 | 113.3 Ų | 113.3 | 55% | 0.546 | 62% | 0.615 | S | S | . | * | trans | -74.3 | 124 | -179.2 | -26.1 | 0 | 0 | 0 | 0 | 110.8 | D318 V322 | D318-T320 PolarHBondContact O-N 2.86Å; D318-T320 PolarHBondContact O-OG1 2.88Å; T320-V322 PolarHBondContact O-N 2.68Å; T320-V322 VanDerWaalsContact O-N 3.09Å | ||
| 321 | K | 51.2 | Low | 53.6 | Low | 173 Ų | 173 | 111.9 Ų | 111.9 | 75% | 0.752 | 61% | 0.605 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -72.9 | 97.1 | 179 | -67.1 | 177.5 | -180 | 175.4 | 0 | 110.9 | G319 Q323 | G319-K321 PolarHBondContact O-N 2.81Å; K321-Q323 PolarHBondContact O-N 3.22Å |
| 322 | V | 52.9 | Low | 54.1 | Low | 82 Ų | 82 | 111.4 Ų | 111.4 | 50% | 0.497 | 59% | 0.592 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -87.5 | 95.8 | 173.3 | -177.4 | 0 | 0 | 0 | 0 | 109.8 | T320 T324 | T320-V322 PolarHBondContact O-N 2.68Å; T320-V322 VanDerWaalsContact O-N 3.09Å; V322-T324 PolarHBondContact O-N 3.5Å |
| 323 | Q | 49.2 | Very low | 54.6 | Low | 165 Ų | 165 | 106.4 Ų | 106.4 | 77% | 0.771 | 57% | 0.566 | S | S | * | * | trans | -82.1 | 96 | 176.3 | -166.6 | 176.7 | 61.9 | 0 | 0 | 110.1 | K321 T325 | K321-Q323 PolarHBondContact O-N 3.22Å; Q323-T325 HydrophobicContact CG-CG2 4.45Å; Q323-T325 PolarHBondContact O-N 3.02Å | ||
| 324 | T | 48.3 | Very low | 55 | Low | 101 Ų | 101 | 106.7 Ų | 106.7 | 62% | 0.62 | 56% | 0.564 | S | S | * | * | trans | -66.9 | 80.5 | 171.5 | 27.8 | 0 | 0 | 0 | 0 | 111.5 | V322 R326 | V322-T324 PolarHBondContact O-N 3.5Å; T324-R326 PolarHBondContact O-N 2.99Å | ||
| 325 | T | 47.6 | Very low | 55.4 | Low | 106 Ų | 106 | 110 Ų | 110 | 65% | 0.65 | 57% | 0.571 | S | S | * | * | trans | -65.4 | 125.1 | 164.7 | 45 | 0 | 0 | 0 | 0 | 108.8 | Q323 P327 | Q323-T325 HydrophobicContact CG-CG2 4.45Å; Q323-T325 PolarHBondContact O-N 3.02Å; T325-P327 VanDerWaalsContact O-CD 3.25Å; T325-P327 WeakPolarHBondContact O-CD 3.45Å | ||
| 326 | R | 55.6 | Low | 56 | Low | 237 Ų | 237 | 105 Ų | 105 | 89% | 0.894 | 56% | 0.555 | S | S | * | * | trans | -117.8 | 72.1 | 176.5 | -154.7 | 172 | -169.3 | 153.5 | 4.2 | 111.2 | T324 | T324-R326 PolarHBondContact O-N 2.99Š| ||
| 327 | P | 53.3 | Low | 56.8 | Low | 53 Ų | 53 | 102.8 Ų | 102.8 | 34% | 0.344 | 54% | 0.54 | S | S | . | . | trans | -86.3 | -7.1 | -171.2 | 37.1 | -38.7 | 0 | 0 | 0 | 114.4 | T325 Q329 R331 | T325-P327 VanDerWaalsContact O-CD 3.25Å; T325-P327 WeakPolarHBondContact O-CD 3.45Å; P327-Q329 PolarHBondContact O-N 3.01Å; P327-R331 WeakPolarHBondContact O-CB 3.27Å; P327-R331 VanDerWaalsContact O-CG 3.31Å; P327-R331 WeakPolarHBondContact O-CG 3.45Å; P327-R331 PolarHBondContact O-N 3.14Å; P327-R331 VanDerWaalsContact O-N 3.16Å | ||
| 328 | D | 50.9 | Low | 57.5 | Low | 112 Ų | 112 | 100.1 Ų | 100.1 | 60% | 0.599 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -67.5 | -34.5 | -166 | -67.8 | -43.1 | 0 | 0 | 0 | 114.6 | R331 M332 | D328-R331 PolarHBondContact O-N 3.1Å; D328-M332 WeakPolarHBondContact O-CB 3.34Å; D328-M332 PolarHBondContact O-N 2.75Å |
| 329 | Q | 50.5 | Low | 58.3 | Low | 97 Ų | 97 | 94.3 Ų | 94.3 | 45% | 0.453 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -67.4 | -50.3 | -178.2 | -170.7 | 60.6 | 44.6 | 0 | 0 | 111.2 | P327 R331 M332 D333 | P327-Q329 PolarHBondContact O-N 3.01Å; Q329-R331 VanDerWaalsContact C-N 3.31Å; Q329-R331 PolarHBondContact O-N 2.9Å; Q329-M332 WeakPolarHBondContact O-CB 3.33Å; Q329-M332 PolarHBondContact O-N 3.37Å; Q329-D333 PolarHBondContact NE2-OD1 2.85Å; Q329-D333 VanDerWaalsContact NE2-OD1 3.11Å; Q329-D333 VanDerWaalsContact O-CG 3.28Å; Q329-D333 PolarHBondContact O-N 2.92Å |
| 330 | A | 50.7 | Low | 59.1 | Low | 39 Ų | 39 | 91.9 Ų | 91.9 | 32% | 0.322 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -61.6 | -38.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | M332 D333 I334 | A330-M332 VanDerWaalsContact C-N 3.27Å; A330-M332 PolarHBondContact O-N 2.93Å; A330-D333 PolarHBondContact O-N 3.28Å; A330-I334 WeakPolarHBondContact O-CG1 3.36Å; A330-I334 PolarHBondContact O-N 3.04Å; A330-I334 VanDerWaalsContact O-N 3.11Å |
| 331 | R | 54.8 | Low | 60.3 | Low | 151 Ų | 151 | 87.8 Ų | 87.8 | 57% | 0.57 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -68.9 | -21.6 | 174.6 | -71.2 | 177.5 | -175.2 | -109.1 | 5.3 | 113.6 | P327 D328 Q329 R335 | P327-R331 WeakPolarHBondContact O-CB 3.27Å; P327-R331 VanDerWaalsContact O-CG 3.31Å; P327-R331 WeakPolarHBondContact O-CG 3.45Å; P327-R331 PolarHBondContact O-N 3.14Å; P327-R331 VanDerWaalsContact O-N 3.16Å; D328-R331 PolarHBondContact O-N 3.1Å; Q329-R331 VanDerWaalsContact C-N 3.31Å; Q329-R331 PolarHBondContact O-N 2.9Å; R331-R335 WeakPolarHBondContact O-CG 3.47Å; R331-R335 PolarHBondContact O-NE 3.43Å |
| 332 | M | 55 | Low | 61.8 | Low | 90 Ų | 90 | 80.2 Ų | 80.2 | 44% | 0.443 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -81.7 | -43.9 | 173.5 | -175.6 | 166 | 62.3 | 0 | 0 | 110.8 | D328 Q329 A330 I334 R335 L336 | D328-M332 WeakPolarHBondContact O-CB 3.34Å; D328-M332 PolarHBondContact O-N 2.75Å; Q329-M332 WeakPolarHBondContact O-CB 3.33Å; Q329-M332 PolarHBondContact O-N 3.37Å; A330-M332 VanDerWaalsContact C-N 3.27Å; A330-M332 PolarHBondContact O-N 2.93Å; M332-I334 PolarHBondContact O-N 3.2Å; M332-R335 PolarHBondContact O-N 3.08Å; M332-L336 HydrophobicContact CG-CD1 4.17Å; M332-L336 WeakPolarHBondContact O-CG 3.33Å; M332-L336 PolarHBondContact O-N 3.45Å |
| 333 | D | 59.9 | Low | 63.3 | Low | 28 Ų | 28 | 77.2 Ų | 77.2 | 15% | 0.15 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -61.5 | -41.8 | 179.3 | -62.3 | -18.1 | 0 | 0 | 0 | 111.3 | Q329 A330 R335 L336 A337 | Q329-D333 PolarHBondContact NE2-OD1 2.85Å; Q329-D333 VanDerWaalsContact NE2-OD1 3.11Å; Q329-D333 VanDerWaalsContact O-CG 3.28Å; Q329-D333 PolarHBondContact O-N 2.92Å; A330-D333 PolarHBondContact O-N 3.28Å; D333-R335 PolarHBondContact O-N 3.06Å; D333-L336 PolarHBondContact O-N 2.77Å; D333-A337 WeakPolarHBondContact O-CB 3.46Å; D333-A337 PolarHBondContact O-N 3.29Å |
| 334 | I | 63.7 | Low | 65.1 | Low | 84 Ų | 84 | 70.6 Ų | 70.6 | 43% | 0.431 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -62.7 | -41.8 | 174.4 | -66.8 | 165.5 | 0 | 0 | 0 | 112.3 | A330 M332 A337 K338 | A330-I334 WeakPolarHBondContact O-CG1 3.36Å; A330-I334 PolarHBondContact O-N 3.04Å; A330-I334 VanDerWaalsContact O-N 3.11Å; M332-I334 PolarHBondContact O-N 3.2Å; I334-A337 PolarHBondContact O-N 2.94Å; I334-K338 PolarHBondContact O-N 3.14Å |
| 335 | R | 66.6 | Low | 67.1 | Low | 166 Ų | 166 | 67.3 Ų | 67.3 | 63% | 0.626 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -65.8 | -39.5 | 178 | -74.8 | -175.6 | -122.9 | -158.1 | 0.8 | 111.8 | R331 M332 D333 A337 T339 | R331-R335 WeakPolarHBondContact O-CG 3.47Å; R331-R335 PolarHBondContact O-NE 3.43Å; M332-R335 PolarHBondContact O-N 3.08Å; D333-R335 PolarHBondContact O-N 3.06Å; R335-A337 VanDerWaalsContact C-N 3.34Å; R335-T339 PolarHBondContact O-N 3.12Å; R335-T339 PolarHBondContact O-OG1 3.41Å |
| 336 | L | 68.5 | Low | 69.1 | Low | 67 Ų | 67 | 63.1 Ų | 63.1 | 35% | 0.351 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -62.8 | -43.4 | 174.3 | -69.2 | 169.3 | 0 | 0 | 0 | 110.6 | M332 D333 T339 L340 | M332-L336 HydrophobicContact CG-CD1 4.17Å; M332-L336 WeakPolarHBondContact O-CG 3.33Å; M332-L336 PolarHBondContact O-N 3.45Å; D333-L336 PolarHBondContact O-N 2.77Å; L336-T339 PolarHBondContact O-N 3.26Å; L336-T339 PolarHBondContact O-OG1 3.34Å; L336-L340 WeakPolarHBondContact O-CG 3.2Å; L336-L340 PolarHBondContact O-N 3.07Å; L336-L340 VanDerWaalsContact O-N 3.13Å |
| 337 | A | 71.6 | Confident | 70.6 | Confident | 9 Ų | 9 | 52.1 Ų | 52.1 | 7% | 0.074 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -60.8 | -48.3 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | F13 L293 D333 I334 R335 T339 L340 V341 | F13-A337 HydrophobicContact CD2-CB 4.07Å; F13-A337 HydrophobicContact CE2-CB 3.58Å; F13-A337 HydrophobicContact CZ-CB 4.33Å; L293-A337 HydrophobicContact CD2-CB 3.66Å; D333-A337 WeakPolarHBondContact O-CB 3.46Å; D333-A337 PolarHBondContact O-N 3.29Å; I334-A337 PolarHBondContact O-N 2.94Å; R335-A337 VanDerWaalsContact C-N 3.34Å; A337-T339 VanDerWaalsContact C-N 3.32Å; A337-T339 PolarHBondContact O-N 3.02Å; A337-L340 WeakPolarHBondContact O-CB 3.44Å; A337-L340 PolarHBondContact O-N 2.96Å; A337-V341 PolarHBondContact O-N 3.14Å |
| 338 | K | 75.4 | Confident | 72.4 | Confident | 52 Ų | 52 | 52.9 Ų | 52.9 | 23% | 0.226 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -55.5 | -44.9 | 177.4 | -73.6 | -167.5 | 173.9 | -158.6 | 0 | 113 | A9 D10 I334 L340 V341 L342 | A9-K338 HydrophobicContact CB-CB 4.45Å; D10-K338 WeakPolarHBondContact OD1-CE 3.29Å; D10-K338 IonicContact OD1-NZ 2.62Å; D10-K338 PolarHBondContact OD1-NZ 3.43Å; I334-K338 PolarHBondContact O-N 3.14Å; K338-L340 VanDerWaalsContact C-N 3.31Å; K338-L340 PolarHBondContact O-N 3.39Å; K338-V341 PolarHBondContact O-N 2.9Å; K338-L342 PolarHBondContact O-N 2.99Å |
| 339 | T | 77.9 | Confident | 74.4 | Confident | 22 Ų | 22 | 52 Ų | 52 | 14% | 0.135 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -68.9 | -26 | 177.7 | 59 | 0 | 0 | 0 | 0 | 113.8 | R335 L336 A337 I343 R395 | R335-T339 PolarHBondContact O-N 3.12Å; R335-T339 PolarHBondContact O-OG1 3.41Å; L336-T339 PolarHBondContact O-N 3.26Å; L336-T339 PolarHBondContact O-OG1 3.34Å; A337-T339 VanDerWaalsContact C-N 3.32Å; A337-T339 PolarHBondContact O-N 3.02Å; T339-I343 WeakPolarHBondContact O-CD1 3.24Å; T339-I343 VanDerWaalsContact O-CG1 3.26Å; T339-I343 WeakPolarHBondContact O-CG1 3.46Å; T339-I343 PolarHBondContact O-N 3.37Å; T339-I343 VanDerWaalsContact O-N 3.17Å; T339-R395 HydrophobicContact CG2-CG 4.24Å; T339-R395 VanDerWaalsContact OG1-CD 3.26Å; T339-R395 WeakPolarHBondContact OG1-CD 3.36Å; T339-R395 PolarHBondContact OG1-NE 2.55Å |
| 340 | L | 79 | Confident | 76.3 | Confident | 7 Ų | 7 | 47.5 Ų | 47.5 | 4% | 0.037 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -73.6 | -42.7 | 173.1 | -76.9 | 166.8 | 0 | 0 | 0 | 112 | Y289 I292 L293 L336 A337 K338 L342 I343 L344 R395 | Y289-L340 HydrophobicContact CD1-CD2 3.33Å; Y289-L340 HydrophobicContact CE1-CD2 3.62Å; Y289-L340 HydrophobicContact CG-CD2 4.12Å; I292-L340 HydrophobicContact CG2-CD1 3.59Å; L293-L340 HydrophobicContact CD1-CB 4.29Å; L293-L340 HydrophobicContact CD2-CB 3.8Å; L293-L340 HydrophobicContact CD2-CD1 3.95Å; L293-L340 HydrophobicContact CG-CB 4.03Å; L293-L340 HydrophobicContact CG-CD1 4.19Å; L336-L340 WeakPolarHBondContact O-CG 3.2Å; L336-L340 PolarHBondContact O-N 3.07Å; L336-L340 VanDerWaalsContact O-N 3.13Å; A337-L340 WeakPolarHBondContact O-CB 3.44Å; A337-L340 PolarHBondContact O-N 2.96Å; K338-L340 VanDerWaalsContact C-N 3.31Å; K338-L340 PolarHBondContact O-N 3.39Å; L340-L342 VanDerWaalsContact C-N 3.3Å; L340-L342 PolarHBondContact O-N 3.47Å; L340-I343 HydrophobicContact CD2-CD1 4.47Å; L340-I343 PolarHBondContact O-N 3.3Å; L340-L344 PolarHBondContact O-N 2.62Å; L340-R395 VanDerWaalsContact CG-NH2 3.27Å |
| 341 | V | 83.1 | Confident | 78.3 | Confident | 2 Ų | 2 | 46.1 Ų | 46.1 | 1% | 0.012 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -59.8 | -43.9 | 173.2 | 172.7 | 0 | 0 | 0 | 0 | 110.2 | T12 F13 I16 L293 A337 K338 I343 L344 V345 | T12-V341 HydrophobicContact CG2-CG1 3.52Å; F13-V341 HydrophobicContact CB-CG2 4.33Å; F13-V341 HydrophobicContact CD2-CG2 4.21Å; I16-V341 HydrophobicContact CD1-CG2 4.48Å; L293-V341 HydrophobicContact CD1-CG2 3.84Å; L293-V341 HydrophobicContact CD2-CG2 4.25Å; A337-V341 PolarHBondContact O-N 3.14Å; K338-V341 PolarHBondContact O-N 2.9Å; V341-I343 PolarHBondContact O-N 3.01Å; V341-L344 PolarHBondContact O-N 2.69Å; V341-V345 HydrophobicContact CG1-CG2 4.34Å; V341-V345 WeakPolarHBondContact O-CG2 3.21Å; V341-V345 PolarHBondContact O-N 2.82Å |
| 342 | L | 84.1 | Confident | 80.1 | Confident | 15 Ų | 15 | 40.5 Ų | 40.5 | 8% | 0.079 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -57.8 | -48.4 | 174.7 | 179.2 | 66.4 | 0 | 0 | 0 | 112.6 | L5 K338 L340 L344 V345 V346 I391 L394 | L5-L342 HydrophobicContact CB-CD1 4.26Å; L5-L342 HydrophobicContact CD2-CD1 3.82Å; L5-L342 HydrophobicContact CD2-CD2 4Å; L5-L342 HydrophobicContact CG-CD1 3.93Å; K338-L342 PolarHBondContact O-N 2.99Å; L340-L342 VanDerWaalsContact C-N 3.3Å; L340-L342 PolarHBondContact O-N 3.47Å; L342-L344 VanDerWaalsContact C-N 3.27Å; L342-L344 PolarHBondContact O-N 3.4Å; L342-V345 PolarHBondContact O-N 3.35Å; L342-V346 HydrophobicContact CD1-CG2 4.13Å; L342-V346 HydrophobicContact CG-CG2 4.46Å; L342-V346 WeakPolarHBondContact O-CB 3.34Å; L342-V346 VanDerWaalsContact O-CG2 3.23Å; L342-V346 WeakPolarHBondContact O-CG2 3.24Å; L342-V346 PolarHBondContact O-N 3.42Å; L342-I391 HydrophobicContact CD2-CG1 4.21Å; L342-L394 HydrophobicContact CD2-CD1 4.46Å |
| 343 | I | 84.6 | Confident | 82 | Confident | 19 Ų | 19 | 38.6 Ų | 38.6 | 10% | 0.097 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -54.6 | -46.1 | 175.7 | -71.4 | 157.6 | 0 | 0 | 0 | 110.7 | Y289 T339 L340 V341 V346 L347 I391 | Y289-I343 HydrophobicContact CD2-CG2 4.05Å; Y289-I343 HydrophobicContact CE2-CG2 3.59Å; T339-I343 WeakPolarHBondContact O-CD1 3.24Å; T339-I343 VanDerWaalsContact O-CG1 3.26Å; T339-I343 WeakPolarHBondContact O-CG1 3.46Å; T339-I343 PolarHBondContact O-N 3.37Å; T339-I343 VanDerWaalsContact O-N 3.17Å; L340-I343 HydrophobicContact CD2-CD1 4.47Å; L340-I343 PolarHBondContact O-N 3.3Å; V341-I343 PolarHBondContact O-N 3.01Å; I343-V346 PolarHBondContact O-N 3.03Å; I343-L347 WeakPolarHBondContact O-CB 3.16Å; I343-L347 PolarHBondContact O-N 3.48Å; I343-I391 HydrophobicContact CD1-CG2 3.73Å; I343-I391 HydrophobicContact CG1-CD1 3.87Å; I343-I391 HydrophobicContact CG1-CG1 4.32Å; I343-I391 HydrophobicContact CG1-CG2 3.54Å |
| 344 | L | 86.1 | Confident | 83.5 | Confident | 26 Ų | 26 | 37.4 Ų | 37.4 | 14% | 0.136 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -69.3 | -41 | -175.1 | -166.5 | 144.3 | 0 | 0 | 0 | 112.3 | I286 I290 L340 V341 L342 L347 V348 | I286-L344 HydrophobicContact CG1-CG 4.49Å; I286-L344 HydrophobicContact CG2-CD1 4.14Å; I290-L344 HydrophobicContact CD1-CD1 4.24Å; I290-L344 HydrophobicContact CG1-CD1 3.69Å; L340-L344 PolarHBondContact O-N 2.62Å; V341-L344 PolarHBondContact O-N 2.69Å; L342-L344 VanDerWaalsContact C-N 3.27Å; L342-L344 PolarHBondContact O-N 3.4Å; L344-L347 PolarHBondContact O-N 2.92Å; L344-V348 HydrophobicContact CD2-CG2 4.47Å; L344-V348 WeakPolarHBondContact O-CG2 3.49Å; L344-V348 PolarHBondContact O-N 3.44Å; L344-V348 VanDerWaalsContact O-N 3.08Å |
| 345 | V | 89.6 | Confident | 84.9 | Confident | 31 Ų | 31 | 34.4 Ų | 34.4 | 19% | 0.188 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -63.2 | -45.8 | 174.6 | 170.1 | 0 | 0 | 0 | 0 | 111.1 | V8 T12 V341 L342 L347 V348 I349 | V8-V345 HydrophobicContact CG1-CG1 4.4Å; T12-V345 HydrophobicContact CG2-CG2 4.05Å; V341-V345 HydrophobicContact CG1-CG2 4.34Å; V341-V345 WeakPolarHBondContact O-CG2 3.21Å; V341-V345 PolarHBondContact O-N 2.82Å; L342-V345 PolarHBondContact O-N 3.35Å; V345-L347 PolarHBondContact O-N 3.47Å; V345-V348 PolarHBondContact O-N 3.4Å; V345-I349 HydrophobicContact CG1-CD1 3.63Å; V345-I349 HydrophobicContact CG1-CG1 4.41Å; V345-I349 WeakPolarHBondContact O-CB 3.37Å; V345-I349 VanDerWaalsContact O-CG1 3.31Å; V345-I349 WeakPolarHBondContact O-CG1 3.37Å; V345-I349 PolarHBondContact O-N 2.95Å |
| 346 | V | 90.1 | Very high | 86.3 | Confident | 19 Ų | 19 | 29.3 Ų | 29.3 | 12% | 0.115 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -61.5 | -45.4 | 177.7 | 171.5 | 0 | 0 | 0 | 0 | 110.8 | L342 I343 V348 I349 C350 V387 | L342-V346 HydrophobicContact CD1-CG2 4.13Å; L342-V346 HydrophobicContact CG-CG2 4.46Å; L342-V346 WeakPolarHBondContact O-CB 3.34Å; L342-V346 VanDerWaalsContact O-CG2 3.23Å; L342-V346 WeakPolarHBondContact O-CG2 3.24Å; L342-V346 PolarHBondContact O-N 3.42Å; I343-V346 PolarHBondContact O-N 3.03Å; V346-V348 PolarHBondContact O-N 3.08Å; V346-I349 PolarHBondContact O-N 2.98Å; V346-C350 WeakPolarHBondContact O-CB 3.5Å; V346-C350 PolarHBondContact O-N 3.5Å; V346-C350 PolarHBondContact O-SG 3.35Å; V346-V387 HydrophobicContact CG1-CB 4.09Å; V346-V387 HydrophobicContact CG1-CG1 3.98Å; V346-V387 HydrophobicContact CG2-CG1 3.82Å |
| 347 | L | 87.9 | Confident | 87.5 | Confident | 5 Ų | 5 | 27 Ų | 27 | 3% | 0.026 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -59.7 | -45.6 | 179.1 | -169.6 | 74.8 | 0 | 0 | 0 | 111.7 | L202 V282 I285 I286 I343 L344 V345 W351 | L202-L347 HydrophobicContact CD1-CD1 4.19Å; V282-L347 HydrophobicContact CG1-CD2 4.14Å; V282-L347 HydrophobicContact CG1-CG 4.31Å; I285-L347 HydrophobicContact CB-CD2 4.15Å; I285-L347 HydrophobicContact CG2-CD2 3.63Å; I286-L347 HydrophobicContact CG1-CD2 3.95Å; I343-L347 WeakPolarHBondContact O-CB 3.16Å; I343-L347 PolarHBondContact O-N 3.48Å; L344-L347 PolarHBondContact O-N 2.92Å; V345-L347 PolarHBondContact O-N 3.47Å; L347-W351 WeakPolarHBondContact O-CB 3.23Å; L347-W351 PolarHBondContact O-N 2.96Å |
| 348 | V | 90.7 | Very high | 88.6 | Confident | 70 Ų | 70 | 27.2 Ų | 27.2 | 42% | 0.424 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -67 | -43.3 | 178.5 | 172.3 | 0 | 0 | 0 | 0 | 111.8 | I286 L344 V345 V346 C350 G352 | I286-V348 HydrophobicContact CD1-CG2 3.86Å; L344-V348 HydrophobicContact CD2-CG2 4.47Å; L344-V348 WeakPolarHBondContact O-CG2 3.49Å; L344-V348 PolarHBondContact O-N 3.44Å; L344-V348 VanDerWaalsContact O-N 3.08Å; V345-V348 PolarHBondContact O-N 3.4Å; V346-V348 PolarHBondContact O-N 3.08Å; V348-C350 VanDerWaalsContact C-N 3.34Å; V348-C350 PolarHBondContact O-N 3.46Å; V348-G352 WeakPolarHBondContact O-CA 3.36Å; V348-G352 PolarHBondContact O-N 2.93Å |
| 349 | I | 92.2 | Very high | 89.5 | Confident | 93 Ų | 93 | 27.4 Ų | 27.4 | 48% | 0.477 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -64.5 | -38.7 | 178.8 | -71.1 | 172.3 | 0 | 0 | 0 | 111.4 | V345 V346 P353 | V345-I349 HydrophobicContact CG1-CD1 3.63Å; V345-I349 HydrophobicContact CG1-CG1 4.41Å; V345-I349 WeakPolarHBondContact O-CB 3.37Å; V345-I349 VanDerWaalsContact O-CG1 3.31Å; V345-I349 WeakPolarHBondContact O-CG1 3.37Å; V345-I349 PolarHBondContact O-N 2.95Å; V346-I349 PolarHBondContact O-N 2.98Å; I349-P353 WeakPolarHBondContact O-CD 3.48Å |
| 350 | C | 91.7 | Very high | 90.3 | Very high | 2 Ų | 2 | 30.7 Ų | 30.7 | 1% | 0.014 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -80.7 | -42.5 | -176.6 | -58.2 | 0 | 0 | 0 | 0 | 112.8 | V346 V348 L354 L380 N384 | V346-C350 WeakPolarHBondContact O-CB 3.5Å; V346-C350 PolarHBondContact O-N 3.5Å; V346-C350 PolarHBondContact O-SG 3.35Å; V348-C350 VanDerWaalsContact C-N 3.34Å; V348-C350 PolarHBondContact O-N 3.46Å; C350-L354 WeakPolarHBondContact O-CD1 2.84Å; C350-L380 HydrophobicContact CB-CB 4.43Å; C350-N384 HydrophobicContact CB-CB 3.78Å |
| 351 | W | 91.5 | Very high | 90.9 | Very high | 10 Ų | 10 | 30.6 Ų | 30.6 | 4% | 0.038 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -89.4 | -31.4 | -176 | -72.8 | 90.1 | 0 | 0 | 0 | 114.2 | F195 V199 W274 T278 V282 L347 L354 L355 | F195-W351 HydrophobicContact CB-CH2 4.25Å; V199-W351 HydrophobicContact CG2-CH2 3.58Å; V199-W351 HydrophobicContact CG2-CZ2 3.17Å; V199-W351 HydrophobicContact CG2-CZ3 4.41Å; W274-W351 HydrophobicContact CH2-CZ3 4.03Å; T278-W351 HydrophobicContact CG2-CE3 3.87Å; T278-W351 HydrophobicContact CG2-CH2 4.24Å; T278-W351 HydrophobicContact CG2-CZ3 3.57Å; V282-W351 HydrophobicContact CG2-CD2 4.41Å; V282-W351 HydrophobicContact CG2-CG 4.28Å; L347-W351 WeakPolarHBondContact O-CB 3.23Å; L347-W351 PolarHBondContact O-N 2.96Å; W351-L354 PolarHBondContact O-N 3.48Å; W351-L355 HydrophobicContact CB-CD1 4.21Å; W351-L355 HydrophobicContact CE3-CD1 4.36Å; W351-L355 HydrophobicContact CE3-CD2 4.47Å; W351-L355 HydrophobicContact CE3-CG 4.3Å; W351-L355 WeakPolarHBondContact O-CB 3.46Å; W351-L355 WeakPolarHBondContact O-CG 3.11Å; W351-L355 PolarHBondContact O-N 2.97Å |
| 352 | G | 92.7 | Very high | 91.4 | Very high | 34 Ų | 34 | 31.6 Ų | 31.6 | 35% | 0.351 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -57.2 | -56.1 | -174.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | V348 L354 A356 | V348-G352 WeakPolarHBondContact O-CA 3.36Å; V348-G352 PolarHBondContact O-N 2.93Å; G352-L354 VanDerWaalsContact C-N 3.32Å; G352-L354 PolarHBondContact O-N 3.06Å; G352-A356 VanDerWaalsContact O-CB 3.29Å; G352-A356 WeakPolarHBondContact O-CB 3.4Å; G352-A356 PolarHBondContact O-N 3.16Å |
| 353 | P | 94.4 | Very high | 91.7 | Very high | 50 Ų | 50 | 37.9 Ų | 37.9 | 33% | 0.325 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -61.1 | -39.9 | -180 | -24.1 | 34.9 | 0 | 0 | 0 | 112.9 | I349 A356 I357 L380 | I349-P353 WeakPolarHBondContact O-CD 3.48Å; P353-A356 PolarHBondContact O-N 3.38Å; P353-I357 VanDerWaalsContact O-CG1 3.27Å; P353-I357 WeakPolarHBondContact O-CG1 3.32Å; P353-I357 PolarHBondContact O-N 3.19Å; P353-L380 HydrophobicContact CB-CD1 4.28Å; P353-L380 HydrophobicContact CG-CD1 4.08Å |
| 354 | L | 92.4 | Very high | 91.9 | Very high | 3 Ų | 3 | 45.6 Ų | 45.6 | 2% | 0.016 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -67.2 | -50.5 | -179.3 | -75.9 | 171.3 | 0 | 0 | 0 | 112.4 | C350 W351 G352 A356 I357 M358 F374 C377 C381 | C350-L354 WeakPolarHBondContact O-CD1 2.84Å; W351-L354 PolarHBondContact O-N 3.48Å; G352-L354 VanDerWaalsContact C-N 3.32Å; G352-L354 PolarHBondContact O-N 3.06Å; L354-A356 VanDerWaalsContact C-N 3.27Å; L354-A356 PolarHBondContact O-N 2.91Å; L354-I357 PolarHBondContact O-N 3.34Å; L354-M358 HydrophobicContact CD2-CE 4.48Å; L354-M358 WeakPolarHBondContact O-CB 3.33Å; L354-M358 VanDerWaalsContact O-CG 3.23Å; L354-M358 WeakPolarHBondContact O-CG 3.42Å; L354-M358 PolarHBondContact O-N 3.35Å; L354-F374 HydrophobicContact CD2-CD2 4.22Å; L354-F374 HydrophobicContact CD2-CE2 3.78Å; L354-F374 HydrophobicContact CD2-CZ 4.48Å; L354-C377 HydrophobicContact CD2-CB 3.88Å; L354-C377 HydrophobicContact CG-CB 4.38Å; L354-C381 WeakPolarHBondContact CD1-SG 3.31Å |
| 355 | L | 94 | Very high | 91.9 | Very high | 20 Ų | 20 | 51 Ų | 51 | 11% | 0.105 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -63.2 | -35.6 | 177.1 | -66.9 | 173 | 0 | 0 | 0 | 111.1 | I275 T278 W351 V359 | I275-L355 HydrophobicContact CG2-CD2 4.47Å; T278-L355 HydrophobicContact CG2-CD2 4.23Å; W351-L355 HydrophobicContact CB-CD1 4.21Å; W351-L355 HydrophobicContact CE3-CD1 4.36Å; W351-L355 HydrophobicContact CE3-CD2 4.47Å; W351-L355 HydrophobicContact CE3-CG 4.3Å; W351-L355 WeakPolarHBondContact O-CB 3.46Å; W351-L355 WeakPolarHBondContact O-CG 3.11Å; W351-L355 PolarHBondContact O-N 2.97Å; L355-V359 VanDerWaalsContact O-CB 3.31Å; L355-V359 WeakPolarHBondContact O-CB 2.92Å; L355-V359 WeakPolarHBondContact O-CG2 3.27Å; L355-V359 PolarHBondContact O-N 3.08Å |
| 356 | A | 94.6 | Very high | 91.7 | Very high | 59 Ų | 59 | 50 Ų | 50 | 49% | 0.488 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -64.4 | -45.1 | 176 | 0 | 0 | 0 | 0 | 0 | 112.7 | G352 P353 L354 V359 Y360 | G352-A356 VanDerWaalsContact O-CB 3.29Å; G352-A356 WeakPolarHBondContact O-CB 3.4Å; G352-A356 PolarHBondContact O-N 3.16Å; P353-A356 PolarHBondContact O-N 3.38Å; L354-A356 VanDerWaalsContact C-N 3.27Å; L354-A356 PolarHBondContact O-N 2.91Å; A356-V359 PolarHBondContact O-N 3.4Å; A356-Y360 PolarHBondContact O-N 3.48Å |
| 357 | I | 94.4 | Very high | 91.6 | Very high | 20 Ų | 20 | 54 Ų | 54 | 10% | 0.103 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -67.9 | -43 | 178.4 | -66.9 | 165.5 | 0 | 0 | 0 | 110.9 | I262 P353 L354 V359 Y360 D361 M366 I370 V373 F374 C377 | I262-I357 HydrophobicContact CD1-CG2 3.67Å; P353-I357 VanDerWaalsContact O-CG1 3.27Å; P353-I357 WeakPolarHBondContact O-CG1 3.32Å; P353-I357 PolarHBondContact O-N 3.19Å; L354-I357 PolarHBondContact O-N 3.34Å; I357-V359 VanDerWaalsContact C-N 3.28Å; I357-V359 PolarHBondContact O-N 3.02Å; I357-Y360 WeakPolarHBondContact O-CB 3.35Å; I357-Y360 PolarHBondContact O-N 3.11Å; I357-Y360 VanDerWaalsContact O-N 3.13Å; I357-D361 PolarHBondContact O-N 3.14Å; I357-D361 VanDerWaalsContact O-N 3.12Å; I357-M366 HydrophobicContact CG2-CE 4.01Å; I357-M366 HydrophobicContact CG2-SD 4.3Å; I357-I370 HydrophobicContact CG2-CG2 4.36Å; I357-V373 HydrophobicContact CD1-CG1 4.11Å; I357-F374 HydrophobicContact CB-CD2 4.26Å; I357-F374 HydrophobicContact CG2-CB 4.05Å; I357-F374 HydrophobicContact CG2-CD2 3.66Å; I357-F374 HydrophobicContact CG2-CG 4.24Å; I357-C377 HydrophobicContact CD1-CB 4.17Å |
| 358 | M | 94.1 | Very high | 91.6 | Very high | 12 Ų | 12 | 58 Ų | 58 | 6% | 0.059 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -66.8 | -27.1 | 176 | -64.7 | 176.1 | -174.3 | 0 | 0 | 113.1 | F263 W274 I275 L354 F374 | F263-M358 HydrophobicContact CE2-CE 3.88Å; F263-M358 HydrophobicContact CE2-CG 4.33Å; F263-M358 HydrophobicContact CE2-SD 4.29Å; F263-M358 HydrophobicContact CZ-CE 3.79Å; W274-M358 HydrophobicContact CE3-SD 4.49Å; W274-M358 HydrophobicContact CH2-SD 4.48Å; W274-M358 HydrophobicContact CZ3-CE 4.4Å; W274-M358 HydrophobicContact CZ3-SD 3.67Å; I275-M358 HydrophobicContact CD1-CB 3.67Å; I275-M358 WeakPolarHBondContact CD1-O 3.39Å; I275-M358 HydrophobicContact CG1-CB 4.1Å; L354-M358 HydrophobicContact CD2-CE 4.48Å; L354-M358 WeakPolarHBondContact O-CB 3.33Å; L354-M358 VanDerWaalsContact O-CG 3.23Å; L354-M358 WeakPolarHBondContact O-CG 3.42Å; L354-M358 PolarHBondContact O-N 3.35Å; M358-F374 HydrophobicContact CE-CE2 3.69Å; M358-F374 HydrophobicContact CE-CZ 3.84Å; M358-F374 HydrophobicContact CG-CE2 4.09Å |
| 359 | V | 95.3 | Very high | 91.5 | Very high | 56 Ų | 56 | 61 Ų | 61 | 34% | 0.339 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -73.2 | -36.8 | 170.7 | 164.7 | 0 | 0 | 0 | 0 | 111.2 | I275 L355 A356 I357 D361 L362 F363 | I275-V359 HydrophobicContact CG2-CG2 3.67Å; L355-V359 VanDerWaalsContact O-CB 3.31Å; L355-V359 WeakPolarHBondContact O-CB 2.92Å; L355-V359 WeakPolarHBondContact O-CG2 3.27Å; L355-V359 PolarHBondContact O-N 3.08Å; A356-V359 PolarHBondContact O-N 3.4Å; I357-V359 VanDerWaalsContact C-N 3.28Å; I357-V359 PolarHBondContact O-N 3.02Å; V359-D361 VanDerWaalsContact C-N 3.35Å; V359-L362 PolarHBondContact O-N 3.19Å; V359-F363 HydrophobicContact CG1-CD2 4.09Å; V359-F363 HydrophobicContact CG1-CE2 3.93Å; V359-F363 VanDerWaalsContact O-CD2 3.22Å; V359-F363 WeakPolarHBondContact O-CD2 3.37Å |
| 360 | Y | 94.4 | Very high | 91.4 | Very high | 91 Ų | 91 | 58.5 Ų | 58.5 | 36% | 0.357 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -60.8 | -45.2 | 175.6 | -173.3 | -68.9 | 0 | 0 | 0 | 111.1 | A356 I357 L362 F363 W364 M366 I370 | A356-Y360 PolarHBondContact O-N 3.48Å; I357-Y360 WeakPolarHBondContact O-CB 3.35Å; I357-Y360 PolarHBondContact O-N 3.11Å; I357-Y360 VanDerWaalsContact O-N 3.13Å; Y360-L362 PolarHBondContact O-N 3.23Å; Y360-L362 VanDerWaalsContact O-N 3.13Å; Y360-F363 PolarHBondContact O-N 2.85Å; Y360-W364 HydrophobicContact CD1-CB 3.78Å; Y360-W364 HydrophobicContact CE1-CB 3.37Å; Y360-W364 HydrophobicContact CE1-CG 4.37Å; Y360-W364 PolarHBondContact O-N 3.43Å; Y360-M366 HydrophobicContact CD1-CE 3.15Å; Y360-M366 HydrophobicContact CE1-CE 3.81Å; Y360-M366 HydrophobicContact CG-CE 3.68Å; Y360-I370 HydrophobicContact CE1-CD1 4.08Å; Y360-I370 HydrophobicContact CE2-CD1 4.47Å |
| 361 | D | 92.3 | Very high | 91.4 | Very high | 5 Ų | 5 | 60.3 Ų | 60.3 | 3% | 0.027 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -53.3 | -29.4 | 177.2 | -177.7 | 69.4 | 0 | 0 | 0 | 113.6 | S260 D261 I262 L271 I357 V359 M366 | S260-D361 VanDerWaalsContact CB-OD2 3.31Å; S260-D361 WeakPolarHBondContact CB-OD2 3.39Å; S260-D361 PolarHBondContact OG-OD2 3.12Å; D261-D361 WeakPolarHBondContact CA-OD1 3.37Å; D261-D361 WeakPolarHBondContact CB-OD1 3.41Å; D261-D361 PolarHBondContact N-OD1 3.39Å; I262-D361 HydrophobicContact CD1-CB 3.67Å; I262-D361 HydrophobicContact CG1-CB 4.15Å; I262-D361 PolarHBondContact N-OD1 3.08Å; L271-D361 WeakPolarHBondContact CD2-OD2 3.39Å; I357-D361 PolarHBondContact O-N 3.14Å; I357-D361 VanDerWaalsContact O-N 3.12Å; V359-D361 VanDerWaalsContact C-N 3.35Å; D361-M366 HydrophobicContact CB-CG 4.42Å |
| 362 | L | 91.7 | Very high | 91.3 | Very high | 23 Ų | 23 | 60.8 Ų | 60.8 | 12% | 0.12 | 31% | 0.31 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -79.8 | -11.6 | 176.6 | -64.1 | 177.9 | 0 | 0 | 0 | 115.1 | E268 L271 M272 I275 V359 Y360 | E268-L362 HydrophobicContact CB-CD2 3.98Å; E268-L362 HydrophobicContact CG-CD2 4.37Å; E268-L362 WeakPolarHBondContact O-CD2 3.36Å; L271-L362 HydrophobicContact CB-CD2 4.23Å; L271-L362 HydrophobicContact CD2-CD2 4.09Å; L271-L362 HydrophobicContact CG-CD2 4.14Å; M272-L362 HydrophobicContact CB-CD1 3.71Å; M272-L362 HydrophobicContact CB-CD2 4.25Å; M272-L362 HydrophobicContact CE-CD1 4.46Å; M272-L362 HydrophobicContact CG-CD1 3.93Å; I275-L362 HydrophobicContact CD1-CD1 3.76Å; I275-L362 HydrophobicContact CD1-CG 4.29Å; V359-L362 PolarHBondContact O-N 3.19Å; Y360-L362 PolarHBondContact O-N 3.23Å; Y360-L362 VanDerWaalsContact O-N 3.13Å |
| 363 | F | 90.8 | Very high | 91.3 | Very high | 147 Ų | 147 | 62.7 Ų | 62.7 | 65% | 0.645 | 32% | 0.315 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -124.9 | -24.8 | -173.2 | -67 | -62.3 | 0 | 0 | 0 | 113.5 | V359 Y360 | V359-F363 HydrophobicContact CG1-CD2 4.09Å; V359-F363 HydrophobicContact CG1-CE2 3.93Å; V359-F363 VanDerWaalsContact O-CD2 3.22Å; V359-F363 WeakPolarHBondContact O-CD2 3.37Å; Y360-F363 PolarHBondContact O-N 2.85Å |
| 364 | W | 89.3 | Confident | 91.2 | Very high | 182 Ų | 182 | 61.4 Ų | 61.4 | 69% | 0.689 | 30% | 0.304 | S | S | * | . | S | Bend | trans | -141.5 | 143.2 | -177.5 | -103.2 | -94.7 | 0 | 0 | 0 | 111.1 | Y360 | Y360-W364 HydrophobicContact CD1-CB 3.78Å; Y360-W364 HydrophobicContact CE1-CB 3.37Å; Y360-W364 HydrophobicContact CE1-CG 4.37Å; Y360-W364 PolarHBondContact O-N 3.43Å |
| 365 | K | 85.9 | Confident | 91.1 | Very high | 140 Ų | 140 | 61.4 Ų | 61.4 | 61% | 0.609 | 31% | 0.305 | S | S | * | . | P | Polyproline II helix | trans | -58.7 | 139 | 170.4 | -69.1 | -168.6 | 172.4 | -171.6 | 0 | 110.6 | E95 D261 | E95-K365 IonicContact OE1-NZ 2.82Å; E95-K365 PolarHBondContact OE1-NZ 3.03Å; D261-K365 WeakPolarHBondContact OD2-CA 3.32Å |
| 366 | M | 85.3 | Confident | 91 | Very high | 9 Ų | 9 | 63.9 Ų | 63.9 | 4% | 0.044 | 32% | 0.315 | C | S | . | . | P | Polyproline II helix | trans | -87.8 | 119.9 | -176.2 | -82.5 | -100.9 | 131.3 | 0 | 0 | 112.5 | D261 I262 I357 Y360 D361 I370 K371 | D261-M366 HydrophobicContact CB-CB 3.77Å; D261-M366 HydrophobicContact CB-CG 4.09Å; D261-M366 PolarHBondContact OD2-N 3.28Å; I262-M366 HydrophobicContact CD1-CE 4.4Å; I262-M366 HydrophobicContact CD1-CG 4.43Å; I262-M366 HydrophobicContact CD1-SD 3.85Å; I262-M366 HydrophobicContact CG1-CG 4.1Å; I262-M366 HydrophobicContact CG1-SD 3.91Å; I357-M366 HydrophobicContact CG2-CE 4.01Å; I357-M366 HydrophobicContact CG2-SD 4.3Å; Y360-M366 HydrophobicContact CD1-CE 3.15Å; Y360-M366 HydrophobicContact CE1-CE 3.81Å; Y360-M366 HydrophobicContact CG-CE 3.68Å; D361-M366 HydrophobicContact CB-CG 4.42Å; M366-I370 HydrophobicContact CE-CB 4.18Å; M366-I370 HydrophobicContact CE-CG2 3.45Å; M366-I370 VanDerWaalsContact CE-CG2 3.45Å; M366-I370 HydrophobicContact SD-CB 3.87Å; M366-I370 HydrophobicContact SD-CG2 3.59Å; M366-I370 VanDerWaalsContact SD-CG2 3.59Å; M366-K371 HydrophobicContact CB-CD 4.46Å; M366-K371 HydrophobicContact CB-CG 3.92Å; M366-K371 WeakPolarHBondContact O-CE 3.17Å; M366-K371 PolarHBondContact O-NZ 2.85Å; M366-K371 HydrophobicContact SD-CG 4.46Å |
| 367 | D | 88.7 | Confident | 91 | Very high | 104 Ų | 104 | 62 Ų | 62 | 56% | 0.556 | 30% | 0.298 | S | S | * | . | P | Polyproline II helix | trans | -66.4 | 149.7 | 164.6 | -66.3 | -35.8 | 0 | 0 | 0 | 111.2 | D369 I370 K371 | D367-D369 VanDerWaalsContact C-N 3.26Å; D367-D369 PolarHBondContact O-N 3.3Å; D367-I370 HydrophobicContact CB-CD1 4.25Å; D367-I370 HydrophobicContact CB-CG1 4.23Å; D367-I370 PolarHBondContact O-N 3.47Å; D367-K371 PolarHBondContact O-N 2.8Å; D367-K371 VanDerWaalsContact O-N 3.08Å |
| 368 | D | 87.4 | Confident | 90.8 | Very high | 87 Ų | 87 | 61.5 Ų | 61.5 | 47% | 0.465 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -64.8 | -28.1 | -176.8 | -66.1 | -22.7 | 0 | 0 | 0 | 113.1 | I105 I370 K371 T372 | I105-D368 HydrophobicContact CD1-CB 3.88Å; I105-D368 WeakPolarHBondContact CD1-O 3.42Å; D368-I370 VanDerWaalsContact C-N 3.31Å; D368-I370 PolarHBondContact O-N 3.2Å; D368-K371 PolarHBondContact O-N 2.99Å; D368-K371 IonicContact OD1-NZ 2.69Å; D368-K371 PolarHBondContact OD1-NZ 3.3Å; D368-T372 WeakPolarHBondContact O-CB 3.49Å; D368-T372 PolarHBondContact O-N 2.71Å; D368-T372 PolarHBondContact O-OG1 2.57Å |
| 369 | D | 89.3 | Confident | 90.6 | Very high | 134 Ų | 134 | 61.5 Ų | 61.5 | 72% | 0.717 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -61.3 | -39.5 | 170 | -78.2 | -31.9 | 0 | 0 | 0 | 111.7 | D367 T372 V373 | D367-D369 VanDerWaalsContact C-N 3.26Å; D367-D369 PolarHBondContact O-N 3.3Å; D369-T372 WeakPolarHBondContact O-CB 3.45Å; D369-T372 PolarHBondContact O-N 2.83Å; D369-V373 WeakPolarHBondContact O-CG2 3.42Å; D369-V373 PolarHBondContact O-N 2.9Å |
| 370 | I | 90.3 | Very high | 90.4 | Very high | 41 Ų | 41 | 60.8 Ų | 60.8 | 21% | 0.21 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -75.2 | -39.9 | -178.8 | -47.7 | 173.7 | 0 | 0 | 0 | 110.5 | I357 Y360 M366 D367 D368 T372 V373 F374 | I357-I370 HydrophobicContact CG2-CG2 4.36Å; Y360-I370 HydrophobicContact CE1-CD1 4.08Å; Y360-I370 HydrophobicContact CE2-CD1 4.47Å; M366-I370 HydrophobicContact CE-CB 4.18Å; M366-I370 HydrophobicContact CE-CG2 3.45Å; M366-I370 VanDerWaalsContact CE-CG2 3.45Å; M366-I370 HydrophobicContact SD-CB 3.87Å; M366-I370 HydrophobicContact SD-CG2 3.59Å; M366-I370 VanDerWaalsContact SD-CG2 3.59Å; D367-I370 HydrophobicContact CB-CD1 4.25Å; D367-I370 HydrophobicContact CB-CG1 4.23Å; D367-I370 PolarHBondContact O-N 3.47Å; D368-I370 VanDerWaalsContact C-N 3.31Å; D368-I370 PolarHBondContact O-N 3.2Å; I370-T372 VanDerWaalsContact C-N 3.26Å; I370-T372 PolarHBondContact O-N 3.35Å; I370-V373 PolarHBondContact O-N 3.1Å; I370-F374 PolarHBondContact O-N 2.97Å |
| 371 | K | 89.8 | Confident | 90 | Very high | 40 Ų | 40 | 57.1 Ų | 57.1 | 17% | 0.174 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -58.8 | -38.6 | 169.9 | -65.8 | 176.4 | -164.6 | 149.4 | 0 | 111.6 | I105 M366 D367 D368 F374 A375 | I105-K371 HydrophobicContact CD1-CB 3.42Å; I105-K371 VanDerWaalsContact CD1-CB 3.42Å; I105-K371 HydrophobicContact CD1-CD 4.26Å; I105-K371 HydrophobicContact CD1-CG 4.47Å; I105-K371 HydrophobicContact CG1-CB 4.49Å; M366-K371 HydrophobicContact CB-CD 4.46Å; M366-K371 HydrophobicContact CB-CG 3.92Å; M366-K371 WeakPolarHBondContact O-CE 3.17Å; M366-K371 PolarHBondContact O-NZ 2.85Å; M366-K371 HydrophobicContact SD-CG 4.46Å; D367-K371 PolarHBondContact O-N 2.8Å; D367-K371 VanDerWaalsContact O-N 3.08Å; D368-K371 PolarHBondContact O-N 2.99Å; D368-K371 IonicContact OD1-NZ 2.69Å; D368-K371 PolarHBondContact OD1-NZ 3.3Å; K371-F374 WeakPolarHBondContact O-CB 3.34Å; K371-F374 PolarHBondContact O-N 3.47Å; K371-A375 PolarHBondContact O-N 3.16Å; K371-A375 VanDerWaalsContact O-N 3.1Å |
| 372 | T | 90.8 | Very high | 89.9 | Confident | 19 Ų | 19 | 56.9 Ų | 56.9 | 12% | 0.117 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -64 | -47.9 | 174.8 | -61.2 | 0 | 0 | 0 | 0 | 110.5 | I105 D368 D369 I370 F374 A375 F376 | I105-T372 VanDerWaalsContact CD1-OG1 3.31Å; I105-T372 WeakPolarHBondContact CD1-OG1 3.4Å; D368-T372 WeakPolarHBondContact O-CB 3.49Å; D368-T372 PolarHBondContact O-N 2.71Å; D368-T372 PolarHBondContact O-OG1 2.57Å; D369-T372 WeakPolarHBondContact O-CB 3.45Å; D369-T372 PolarHBondContact O-N 2.83Å; I370-T372 VanDerWaalsContact C-N 3.26Å; I370-T372 PolarHBondContact O-N 3.35Å; T372-F374 VanDerWaalsContact C-N 3.28Å; T372-F374 PolarHBondContact O-N 3.44Å; T372-A375 WeakPolarHBondContact O-CB 3.31Å; T372-A375 PolarHBondContact O-N 2.96Å; T372-F376 HydrophobicContact CG2-CD2 4.35Å; T372-F376 HydrophobicContact CG2-CE2 4.09Å; T372-F376 VanDerWaalsContact O-CD2 3.31Å; T372-F376 WeakPolarHBondContact O-CD2 3.42Å; T372-F376 PolarHBondContact O-N 3.45Å |
| 373 | V | 92.8 | Very high | 89.8 | Confident | 75 Ų | 75 | 58.8 Ų | 58.8 | 46% | 0.455 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -58.5 | -39.8 | 174.3 | 171.3 | 0 | 0 | 0 | 0 | 111.4 | I357 D369 I370 A375 F376 C377 | I357-V373 HydrophobicContact CD1-CG1 4.11Å; D369-V373 WeakPolarHBondContact O-CG2 3.42Å; D369-V373 PolarHBondContact O-N 2.9Å; I370-V373 PolarHBondContact O-N 3.1Å; V373-A375 VanDerWaalsContact C-N 3.35Å; V373-A375 PolarHBondContact O-N 3.39Å; V373-F376 PolarHBondContact O-N 3.13Å; V373-C377 WeakPolarHBondContact O-CB 3.49Å; V373-C377 PolarHBondContact O-N 3.19Å; V373-C377 PolarHBondContact O-SG 3.22Å |
| 374 | F | 91.8 | Very high | 89.8 | Confident | 22 Ų | 22 | 51.9 Ų | 51.9 | 10% | 0.096 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -59.1 | -41.9 | 175.7 | -179.6 | -97.8 | 0 | 0 | 0 | 112.9 | I262 F263 L354 I357 M358 I370 K371 T372 F376 C377 S378 | I262-F374 HydrophobicContact CD1-CD2 4.15Å; I262-F374 HydrophobicContact CD1-CE2 4.5Å; I262-F374 HydrophobicContact CD1-CG 4.34Å; I262-F374 HydrophobicContact CG2-CD1 3.48Å; I262-F374 VanDerWaalsContact CG2-CD1 3.48Å; I262-F374 HydrophobicContact CG2-CD2 4.18Å; I262-F374 HydrophobicContact CG2-CE1 3.26Å; I262-F374 HydrophobicContact CG2-CE2 3.98Å; I262-F374 HydrophobicContact CG2-CG 3.95Å; I262-F374 HydrophobicContact CG2-CZ 3.53Å; F263-F374 HydrophobicContact CE1-CE1 4.48Å; F263-F374 HydrophobicContact CE1-CZ 4.3Å; F263-F374 HydrophobicContact CE2-CZ 4.15Å; F263-F374 HydrophobicContact CZ-CE1 4.27Å; F263-F374 AromaticContact CZ-CZ 3.67Å; F263-F374 HydrophobicContact CZ-CZ 3.67Å; L354-F374 HydrophobicContact CD2-CD2 4.22Å; L354-F374 HydrophobicContact CD2-CE2 3.78Å; L354-F374 HydrophobicContact CD2-CZ 4.48Å; I357-F374 HydrophobicContact CB-CD2 4.26Å; I357-F374 HydrophobicContact CG2-CB 4.05Å; I357-F374 HydrophobicContact CG2-CD2 3.66Å; I357-F374 HydrophobicContact CG2-CG 4.24Å; M358-F374 HydrophobicContact CE-CE2 3.69Å; M358-F374 HydrophobicContact CE-CZ 3.84Å; M358-F374 HydrophobicContact CG-CE2 4.09Å; I370-F374 PolarHBondContact O-N 2.97Å; K371-F374 WeakPolarHBondContact O-CB 3.34Å; K371-F374 PolarHBondContact O-N 3.47Å; T372-F374 VanDerWaalsContact C-N 3.28Å; T372-F374 PolarHBondContact O-N 3.44Å; F374-F376 VanDerWaalsContact C-N 3.28Å; F374-F376 PolarHBondContact O-N 2.99Å; F374-C377 PolarHBondContact O-N 3.49Å; F374-S378 VanDerWaalsContact CE1-OG 3.32Å; F374-S378 WeakPolarHBondContact CE1-OG 3.29Å; F374-S378 WeakPolarHBondContact O-CB 3.35Å; F374-S378 PolarHBondContact O-N 3.46Å; F374-S378 PolarHBondContact O-OG 3.29Å |
| 375 | A | 90.5 | Very high | 90 | Very high | 3 Ų | 3 | 43.2 Ų | 43.2 | 3% | 0.025 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -60.7 | -37.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | L106 F169 K371 T372 V373 | L106-A375 HydrophobicContact CD1-CB 4.14Å; L106-A375 HydrophobicContact CD2-CB 4.06Å; L106-A375 HydrophobicContact CG-CB 4.49Å; F169-A375 HydrophobicContact CZ-CB 4.22Å; K371-A375 PolarHBondContact O-N 3.16Å; K371-A375 VanDerWaalsContact O-N 3.1Å; T372-A375 WeakPolarHBondContact O-CB 3.31Å; T372-A375 PolarHBondContact O-N 2.96Å; V373-A375 VanDerWaalsContact C-N 3.35Å; V373-A375 PolarHBondContact O-N 3.39Å |
| 376 | F | 92.3 | Very high | 90.3 | Very high | 72 Ų | 72 | 36.9 Ų | 36.9 | 32% | 0.316 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -73.5 | -44.7 | 172.3 | -74.4 | -82.2 | 0 | 0 | 0 | 112.6 | Q110 V114 M117 T372 V373 F374 S378 M379 | Q110-F376 HydrophobicContact CB-CE2 4.31Å; Q110-F376 HydrophobicContact CB-CZ 4.03Å; Q110-F376 HydrophobicContact CG-CE2 4.23Å; Q110-F376 HydrophobicContact CG-CZ 4.09Å; V114-F376 HydrophobicContact CG2-CD1 3.84Å; V114-F376 HydrophobicContact CG2-CE1 3.39Å; V114-F376 HydrophobicContact CG2-CE2 4.24Å; V114-F376 HydrophobicContact CG2-CG 4.44Å; V114-F376 HydrophobicContact CG2-CZ 3.6Å; M117-F376 HydrophobicContact CE-CD1 3.72Å; M117-F376 HydrophobicContact CE-CE1 3.66Å; T372-F376 HydrophobicContact CG2-CD2 4.35Å; T372-F376 HydrophobicContact CG2-CE2 4.09Å; T372-F376 VanDerWaalsContact O-CD2 3.31Å; T372-F376 WeakPolarHBondContact O-CD2 3.42Å; T372-F376 PolarHBondContact O-N 3.45Å; V373-F376 PolarHBondContact O-N 3.13Å; F374-F376 VanDerWaalsContact C-N 3.28Å; F374-F376 PolarHBondContact O-N 2.99Å; F376-S378 PolarHBondContact O-N 2.9Å; F376-M379 WeakPolarHBondContact O-CB 3.49Å; F376-M379 PolarHBondContact O-N 2.85Å |
| 377 | C | 93.1 | Very high | 90.5 | Very high | 20 Ų | 20 | 37.4 Ų | 37.4 | 14% | 0.135 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -60.2 | -29.9 | 176.6 | -75.4 | 0 | 0 | 0 | 0 | 112.5 | L354 I357 V373 F374 M379 L380 | L354-C377 HydrophobicContact CD2-CB 3.88Å; L354-C377 HydrophobicContact CG-CB 4.38Å; I357-C377 HydrophobicContact CD1-CB 4.17Å; V373-C377 WeakPolarHBondContact O-CB 3.49Å; V373-C377 PolarHBondContact O-N 3.19Å; V373-C377 PolarHBondContact O-SG 3.22Å; F374-C377 PolarHBondContact O-N 3.49Å; C377-M379 PolarHBondContact O-N 2.96Å; C377-M379 VanDerWaalsContact O-N 3.16Å; C377-L380 HydrophobicContact CB-CD1 4.41Å; C377-L380 WeakPolarHBondContact O-CB 3.17Å; C377-L380 WeakPolarHBondContact O-CG 3.27Å; C377-L380 PolarHBondContact O-N 3.06Å |
| 378 | S | 90.9 | Very high | 90.5 | Very high | 9 Ų | 9 | 32.8 Ų | 32.8 | 6% | 0.063 | 18% | 0.175 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -59.6 | -23.7 | 175 | -65.7 | 0 | 0 | 0 | 0 | 113 | F165 F374 F376 L380 C381 | F165-S378 WeakPolarHBondContact CZ-O 3.44Å; F374-S378 VanDerWaalsContact CE1-OG 3.32Å; F374-S378 WeakPolarHBondContact CE1-OG 3.29Å; F374-S378 WeakPolarHBondContact O-CB 3.35Å; F374-S378 PolarHBondContact O-N 3.46Å; F374-S378 PolarHBondContact O-OG 3.29Å; F376-S378 PolarHBondContact O-N 2.9Å; S378-L380 VanDerWaalsContact C-N 3.26Å; S378-L380 PolarHBondContact O-N 3Å; S378-C381 VanDerWaalsContact O-CB 3.31Å; S378-C381 WeakPolarHBondContact O-CB 3.37Å; S378-C381 PolarHBondContact O-N 3.16Å |
| 379 | M | 90.3 | Very high | 90.6 | Very high | 12 Ų | 12 | 28.9 Ų | 28.9 | 6% | 0.059 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -72.1 | -18.1 | 173.2 | -60.6 | -65 | 140.3 | 0 | 0 | 113.2 | V114 F165 F169 F376 C377 C381 L382 L383 | V114-M379 HydrophobicContact CG1-CE 3.54Å; F165-M379 HydrophobicContact CE1-CE 3.65Å; F165-M379 HydrophobicContact CE1-SD 4Å; F165-M379 HydrophobicContact CZ-CE 3.88Å; F165-M379 HydrophobicContact CZ-SD 4.48Å; F169-M379 HydrophobicContact CD1-CE 3.58Å; F169-M379 HydrophobicContact CD2-CE 3.78Å; F169-M379 HydrophobicContact CE1-CE 3.46Å; F169-M379 VanDerWaalsContact CE1-CE 3.46Å; F169-M379 HydrophobicContact CE2-CE 3.6Å; F169-M379 HydrophobicContact CG-CE 3.78Å; F169-M379 HydrophobicContact CZ-CE 3.45Å; F169-M379 VanDerWaalsContact CZ-CE 3.45Å; F376-M379 WeakPolarHBondContact O-CB 3.49Å; F376-M379 PolarHBondContact O-N 2.85Å; C377-M379 PolarHBondContact O-N 2.96Å; C377-M379 VanDerWaalsContact O-N 3.16Å; M379-C381 PolarHBondContact O-N 3.38Å; M379-L382 WeakPolarHBondContact O-CB 3.02Å; M379-L382 PolarHBondContact O-N 3.02Å; M379-L382 VanDerWaalsContact O-N 3.14Å; M379-L383 PolarHBondContact O-N 3.16Å; M379-L383 VanDerWaalsContact O-N 3.07Å |
| 380 | L | 91.3 | Very high | 90.4 | Very high | 41 Ų | 41 | 23.9 Ų | 23.9 | 22% | 0.215 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -67 | -26.3 | 173.8 | -59.2 | 172.5 | 0 | 0 | 0 | 112.1 | C350 P353 C377 S378 L382 L383 N384 | C350-L380 HydrophobicContact CB-CB 4.43Å; P353-L380 HydrophobicContact CB-CD1 4.28Å; P353-L380 HydrophobicContact CG-CD1 4.08Å; C377-L380 HydrophobicContact CB-CD1 4.41Å; C377-L380 WeakPolarHBondContact O-CB 3.17Å; C377-L380 WeakPolarHBondContact O-CG 3.27Å; C377-L380 PolarHBondContact O-N 3.06Å; S378-L380 VanDerWaalsContact C-N 3.26Å; S378-L380 PolarHBondContact O-N 3Å; L380-L382 VanDerWaalsContact C-N 3.34Å; L380-L383 HydrophobicContact CD2-CD2 4.12Å; L380-L383 PolarHBondContact O-N 3.04Å; L380-N384 PolarHBondContact O-N 2.84Å |
| 381 | C | 86.5 | Confident | 90.1 | Very high | 15 Ų | 15 | 22.2 Ų | 22.2 | 10% | 0.101 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -58 | -45.8 | 168.7 | -75.4 | 0 | 0 | 0 | 0 | 111.9 | F195 L354 S378 M379 N384 S385 | F195-C381 HydrophobicContact CD1-CB 4.44Å; F195-C381 HydrophobicContact CE1-CB 3.68Å; F195-C381 HydrophobicContact CE2-CB 3.96Å; F195-C381 HydrophobicContact CZ-CB 3.44Å; F195-C381 VanDerWaalsContact CZ-CB 3.44Å; L354-C381 WeakPolarHBondContact CD1-SG 3.31Å; S378-C381 VanDerWaalsContact O-CB 3.31Å; S378-C381 WeakPolarHBondContact O-CB 3.37Å; S378-C381 PolarHBondContact O-N 3.16Å; M379-C381 PolarHBondContact O-N 3.38Å; C381-N384 WeakPolarHBondContact O-CB 3.1Å; C381-N384 PolarHBondContact O-N 2.91Å; C381-S385 PolarHBondContact O-N 2.9Å |
| 382 | L | 88.9 | Confident | 89.6 | Confident | 0 Ų | 0 | 21.4 Ų | 21.4 | 0% | 0 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -65.4 | -41.4 | 175.7 | -110.9 | 60.8 | 0 | 0 | 0 | 111.5 | L121 F165 V166 M379 L380 N384 S385 T386 | L121-L382 HydrophobicContact CB-CD2 4.39Å; L121-L382 HydrophobicContact CD2-CB 3.75Å; L121-L382 HydrophobicContact CG-CB 4.07Å; L121-L382 HydrophobicContact CG-CD2 4.49Å; F165-L382 HydrophobicContact CB-CD1 4.07Å; F165-L382 HydrophobicContact CD1-CD1 3.27Å; F165-L382 HydrophobicContact CD1-CD2 4.2Å; F165-L382 HydrophobicContact CD1-CG 4.36Å; F165-L382 HydrophobicContact CE1-CD1 3.78Å; F165-L382 HydrophobicContact CE1-CD2 4.35Å; F165-L382 HydrophobicContact CG-CD1 3.75Å; V166-L382 HydrophobicContact CG2-CD2 3.69Å; M379-L382 WeakPolarHBondContact O-CB 3.02Å; M379-L382 PolarHBondContact O-N 3.02Å; M379-L382 VanDerWaalsContact O-N 3.14Å; L380-L382 VanDerWaalsContact C-N 3.34Å; L382-N384 VanDerWaalsContact C-N 3.3Å; L382-N384 PolarHBondContact O-N 2.89Å; L382-S385 CarbonylContact O-C 3.57Å; L382-S385 PolarHBondContact O-N 2.83Å; L382-S385 VanDerWaalsContact O-N 3.13Å; L382-T386 PolarHBondContact O-N 3.36Å; L382-T386 PolarHBondContact O-OG1 2.9Å; L382-T386 VanDerWaalsContact O-OG1 3.07Å |
| 383 | L | 90.6 | Very high | 88.9 | Confident | 62 Ų | 62 | 22.5 Ų | 22.5 | 33% | 0.325 | 13% | 0.126 | S | C | . | . | H | α-helix | trans | -60.5 | -39.3 | 177.6 | -174.5 | 62.9 | 0 | 0 | 0 | 112 | L121 M379 L380 S385 T386 V387 | L121-L383 HydrophobicContact CD1-CD1 4.37Å; L121-L383 HydrophobicContact CD2-CB 4.25Å; M379-L383 PolarHBondContact O-N 3.16Å; M379-L383 VanDerWaalsContact O-N 3.07Å; L380-L383 HydrophobicContact CD2-CD2 4.12Å; L380-L383 PolarHBondContact O-N 3.04Å; L383-S385 PolarHBondContact O-N 3.25Å; L383-T386 WeakPolarHBondContact O-CB 3.14Å; L383-T386 PolarHBondContact O-N 3.04Å; L383-V387 HydrophobicContact CD1-CG2 4.08Å; L383-V387 HydrophobicContact CG-CG2 4.35Å; L383-V387 VanDerWaalsContact O-CG2 3.28Å; L383-V387 WeakPolarHBondContact O-CG2 3.45Å; L383-V387 PolarHBondContact O-N 3.06Å |
| 384 | N | 90.6 | Very high | 88.1 | Confident | 3 Ų | 3 | 22 Ų | 22 | 2% | 0.016 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -57.1 | -49.3 | 173.1 | -177 | 73.5 | 0 | 0 | 0 | 111.2 | C350 L380 C381 L382 T386 V387 N388 | C350-N384 HydrophobicContact CB-CB 3.78Å; L380-N384 PolarHBondContact O-N 2.84Å; C381-N384 WeakPolarHBondContact O-CB 3.1Å; C381-N384 PolarHBondContact O-N 2.91Å; L382-N384 VanDerWaalsContact C-N 3.3Å; L382-N384 PolarHBondContact O-N 2.89Å; N384-T386 VanDerWaalsContact C-N 3.34Å; N384-T386 PolarHBondContact O-N 3.34Å; N384-V387 PolarHBondContact O-N 2.98Å; N384-N388 VanDerWaalsContact O-CG 3.23Å; N384-N388 PolarHBondContact O-N 3.4Å; N384-N388 PolarHBondContact O-ND2 3.46Å |
| 385 | S | 92.2 | Very high | 87.3 | Confident | 0 Ų | 0 | 24 Ų | 24 | 0% | 0 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -67.9 | -27.9 | 178.2 | -64.1 | 0 | 0 | 0 | 0 | 114 | N129 D158 C381 L382 L383 P389 | N129-S385 PolarHBondContact ND2-O 3.25Å; N129-S385 VanDerWaalsContact ND2-O 3.08Å; D158-S385 VanDerWaalsContact CG-CB 3.47Å; D158-S385 VanDerWaalsContact CG-OG 3.25Å; D158-S385 WeakPolarHBondContact OD1-CB 3.43Å; D158-S385 PolarHBondContact OD1-OG 3.45Å; C381-S385 PolarHBondContact O-N 2.9Å; L382-S385 CarbonylContact O-C 3.57Å; L382-S385 PolarHBondContact O-N 2.83Å; L382-S385 VanDerWaalsContact O-N 3.13Å; L383-S385 PolarHBondContact O-N 3.25Å; S385-P389 VanDerWaalsContact O-CD 3.3Å; S385-P389 WeakPolarHBondContact O-CD 3.31Å |
| 386 | T | 92.1 | Very high | 86.8 | Confident | 7 Ų | 7 | 24.7 Ų | 24.7 | 4% | 0.043 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -67.6 | -48.4 | 169.4 | -58.1 | 0 | 0 | 0 | 0 | 111.7 | L121 F124 T125 L382 L383 N384 N388 P389 I390 | L121-T386 HydrophobicContact CD1-CG2 4.2Å; L121-T386 WeakPolarHBondContact CD1-OG1 3.45Å; F124-T386 HydrophobicContact CD1-CG2 3.55Å; F124-T386 HydrophobicContact CE1-CG2 3.63Å; T125-T386 PolarHBondContact OG1-OG1 3Å; L382-T386 PolarHBondContact O-N 3.36Å; L382-T386 PolarHBondContact O-OG1 2.9Å; L382-T386 VanDerWaalsContact O-OG1 3.07Å; L383-T386 WeakPolarHBondContact O-CB 3.14Å; L383-T386 PolarHBondContact O-N 3.04Å; N384-T386 VanDerWaalsContact C-N 3.34Å; N384-T386 PolarHBondContact O-N 3.34Å; T386-N388 VanDerWaalsContact C-N 3.27Å; T386-N388 PolarHBondContact O-N 3.4Å; T386-P389 WeakPolarHBondContact O-CD 3.29Å; T386-I390 HydrophobicContact CG2-CD1 4.44Å |
| 387 | V | 90.8 | Very high | 86.3 | Confident | 20 Ų | 20 | 28.2 Ų | 28.2 | 12% | 0.121 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -74.8 | -20.5 | -169.8 | 179.2 | 0 | 0 | 0 | 0 | 112.1 | V346 L383 N384 I390 I391 | V346-V387 HydrophobicContact CG1-CB 4.09Å; V346-V387 HydrophobicContact CG1-CG1 3.98Å; V346-V387 HydrophobicContact CG2-CG1 3.82Å; L383-V387 HydrophobicContact CD1-CG2 4.08Å; L383-V387 HydrophobicContact CG-CG2 4.35Å; L383-V387 VanDerWaalsContact O-CG2 3.28Å; L383-V387 WeakPolarHBondContact O-CG2 3.45Å; L383-V387 PolarHBondContact O-N 3.06Å; N384-V387 PolarHBondContact O-N 2.98Å; V387-I390 PolarHBondContact O-N 3.01Å; V387-I391 HydrophobicContact CG1-CD1 3.74Å; V387-I391 HydrophobicContact CG1-CG1 4.04Å; V387-I391 WeakPolarHBondContact O-CG1 3.23Å; V387-I391 PolarHBondContact O-N 3.02Å |
| 388 | N | 89.3 | Confident | 85.8 | Confident | 6 Ų | 6 | 30.3 Ų | 30.3 | 3% | 0.032 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -54.3 | -61.3 | 176.4 | -77.9 | -22.9 | 0 | 0 | 0 | 113.6 | L154 D158 N384 T386 I390 I391 Y392 | L154-N388 HydrophobicContact CD2-CB 4.26Å; D158-N388 PolarHBondContact OD2-ND2 3.15Å; N384-N388 VanDerWaalsContact O-CG 3.23Å; N384-N388 PolarHBondContact O-N 3.4Å; N384-N388 PolarHBondContact O-ND2 3.46Å; T386-N388 VanDerWaalsContact C-N 3.27Å; T386-N388 PolarHBondContact O-N 3.4Å; N388-I390 VanDerWaalsContact C-N 3.28Å; N388-I390 PolarHBondContact O-N 2.91Å; N388-I391 WeakPolarHBondContact O-CB 3.16Å; N388-I391 PolarHBondContact O-N 3.48Å; N388-Y392 HydrophobicContact CB-CE2 4.14Å; N388-Y392 WeakPolarHBondContact O-CD2 3.31Å; N388-Y392 WeakPolarHBondContact O-CE2 3.44Å; N388-Y392 PolarHBondContact O-N 3.18Å; N388-Y392 VanDerWaalsContact O-N 3.13Å |
| 389 | P | 87.9 | Confident | 85.4 | Confident | 6 Ų | 6 | 30.4 Ų | 30.4 | 4% | 0.039 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -46.6 | -45.4 | 171.7 | -33.7 | 35.8 | 0 | 0 | 0 | 115 | E128 N129 V132 S385 T386 I391 Y392 A393 | E128-P389 HydrophobicContact CB-CB 3.9Å; E128-P389 HydrophobicContact CB-CG 3.93Å; N129-P389 VanDerWaalsContact OD1-CG 3.29Å; N129-P389 WeakPolarHBondContact OD1-CG 3.32Å; V132-P389 HydrophobicContact CG2-CB 3.89Å; V132-P389 HydrophobicContact CG2-CG 4.33Å; S385-P389 VanDerWaalsContact O-CD 3.3Å; S385-P389 WeakPolarHBondContact O-CD 3.31Å; T386-P389 WeakPolarHBondContact O-CD 3.29Å; P389-I391 PolarHBondContact O-N 3.03Å; P389-Y392 PolarHBondContact O-N 2.89Å; P389-Y392 VanDerWaalsContact O-N 3.16Å; P389-A393 PolarHBondContact O-N 2.98Å |
| 390 | I | 84.8 | Confident | 85.2 | Confident | 29 Ų | 29 | 35 Ų | 35 | 15% | 0.149 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -63.4 | -44.9 | -177.8 | -59.8 | 170.2 | 0 | 0 | 0 | 110.4 | M1 T386 V387 N388 Y392 A393 L394 | M1-I390 HydrophobicContact CE-CD1 3.8Å; T386-I390 HydrophobicContact CG2-CD1 4.44Å; V387-I390 PolarHBondContact O-N 3.01Å; N388-I390 VanDerWaalsContact C-N 3.28Å; N388-I390 PolarHBondContact O-N 2.91Å; I390-Y392 VanDerWaalsContact C-N 3.31Å; I390-Y392 PolarHBondContact O-N 2.78Å; I390-A393 PolarHBondContact O-N 3.43Å; I390-L394 HydrophobicContact CG2-CD1 4.14Å; I390-L394 VanDerWaalsContact O-CG 3.3Å; I390-L394 WeakPolarHBondContact O-CG 3.48Å; I390-L394 PolarHBondContact O-N 3.12Å |
| 391 | I | 84.1 | Confident | 84.8 | Confident | 5 Ų | 5 | 40.9 Ų | 40.9 | 3% | 0.026 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -56.6 | -45.3 | 173.7 | -72.7 | 162.5 | 0 | 0 | 0 | 110.7 | L342 I343 V387 N388 P389 L394 R395 | L342-I391 HydrophobicContact CD2-CG1 4.21Å; I343-I391 HydrophobicContact CD1-CG2 3.73Å; I343-I391 HydrophobicContact CG1-CD1 3.87Å; I343-I391 HydrophobicContact CG1-CG1 4.32Å; I343-I391 HydrophobicContact CG1-CG2 3.54Å; V387-I391 HydrophobicContact CG1-CD1 3.74Å; V387-I391 HydrophobicContact CG1-CG1 4.04Å; V387-I391 WeakPolarHBondContact O-CG1 3.23Å; V387-I391 PolarHBondContact O-N 3.02Å; N388-I391 WeakPolarHBondContact O-CB 3.16Å; N388-I391 PolarHBondContact O-N 3.48Å; P389-I391 PolarHBondContact O-N 3.03Å; I391-L394 PolarHBondContact O-N 2.04Å; I391-R395 WeakPolarHBondContact O-CB 3.47Å; I391-R395 PolarHBondContact O-N 3.18Å |
| 392 | Y | 79.5 | Confident | 84.6 | Confident | 24 Ų | 24 | 40.4 Ų | 40.4 | 9% | 0.094 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -68.2 | -38.5 | 179.7 | -61.6 | -52.8 | 0 | 0 | 0 | 113.2 | I151 L154 N388 P389 I390 R395 S396 | I151-Y392 HydrophobicContact CD1-CD1 4.07Å; I151-Y392 HydrophobicContact CD1-CE1 4.35Å; I151-Y392 HydrophobicContact CG1-CD1 4.21Å; I151-Y392 HydrophobicContact CG1-CE1 4.08Å; I151-Y392 HydrophobicContact CG2-CD1 4.42Å; I151-Y392 HydrophobicContact CG2-CD2 3.9Å; I151-Y392 HydrophobicContact CG2-CE2 4.17Å; I151-Y392 HydrophobicContact CG2-CG 4.07Å; L154-Y392 HydrophobicContact CD2-CE2 3.7Å; L154-Y392 WeakPolarHBondContact CD2-OH 3.36Å; N388-Y392 HydrophobicContact CB-CE2 4.14Å; N388-Y392 WeakPolarHBondContact O-CD2 3.31Å; N388-Y392 WeakPolarHBondContact O-CE2 3.44Å; N388-Y392 PolarHBondContact O-N 3.18Å; N388-Y392 VanDerWaalsContact O-N 3.13Å; P389-Y392 PolarHBondContact O-N 2.89Å; P389-Y392 VanDerWaalsContact O-N 3.16Å; I390-Y392 VanDerWaalsContact C-N 3.31Å; I390-Y392 PolarHBondContact O-N 2.78Å; Y392-R395 PolarHBondContact O-N 3.13Å; Y392-S396 WeakPolarHBondContact O-CB 3.31Å; Y392-S396 PolarHBondContact O-N 3.4Å |
| 393 | A | 77.6 | Confident | 84.5 | Confident | 42 Ų | 42 | 44.6 Ų | 44.6 | 35% | 0.347 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -63 | -42.2 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | P389 I390 R400 | P389-A393 PolarHBondContact O-N 2.98Å; I390-A393 PolarHBondContact O-N 3.43Å; A393-R400 WeakPolarHBondContact O-CD 3.48Å; A393-R400 VanDerWaalsContact O-CZ 3.29Å; A393-R400 PolarHBondContact O-NE 3.39Å |
| 394 | L | 74.1 | Confident | 84.1 | Confident | 65 Ų | 65 | 45.6 Ų | 45.6 | 34% | 0.34 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -66 | -42.9 | 175.9 | -68.3 | 172.2 | 0 | 0 | 0 | 112.1 | L342 I390 I391 R400 | L342-L394 HydrophobicContact CD2-CD1 4.46Å; I390-L394 HydrophobicContact CG2-CD1 4.14Å; I390-L394 VanDerWaalsContact O-CG 3.3Å; I390-L394 WeakPolarHBondContact O-CG 3.48Å; I390-L394 PolarHBondContact O-N 3.12Å; I391-L394 PolarHBondContact O-N 2.04Å; L394-R400 PolarHBondContact O-NH2 2.94Å |
| 395 | R | 74.9 | Confident | 83.6 | Confident | 64 Ų | 64 | 48.8 Ų | 48.8 | 24% | 0.242 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -69.1 | -54.1 | 179.1 | -92.5 | -73.8 | -157.5 | 113.1 | 15.9 | 113.8 | T339 L340 I391 Y392 | T339-R395 HydrophobicContact CG2-CG 4.24Å; T339-R395 VanDerWaalsContact OG1-CD 3.26Å; T339-R395 WeakPolarHBondContact OG1-CD 3.36Å; T339-R395 PolarHBondContact OG1-NE 2.55Å; L340-R395 VanDerWaalsContact CG-NH2 3.27Å; I391-R395 WeakPolarHBondContact O-CB 3.47Å; I391-R395 PolarHBondContact O-N 3.18Å; Y392-R395 PolarHBondContact O-N 3.13Å |
| 396 | S | 81.6 | Confident | 82.8 | Confident | 17 Ų | 17 | 50.7 Ų | 50.7 | 12% | 0.119 | 25% | 0.25 | C | C | . | . | trans | -91.4 | 117.2 | -165.1 | -175.8 | 0 | 0 | 0 | 0 | 111.9 | Y148 Y392 D398 L399 R400 | Y148-S396 PolarHBondContact OH-OG 2.92Å; Y392-S396 WeakPolarHBondContact O-CB 3.31Å; Y392-S396 PolarHBondContact O-N 3.4Å; S396-D398 VanDerWaalsContact C-N 3.32Å; S396-D398 PolarHBondContact OG-N 3.38Å; S396-L399 PolarHBondContact OG-N 3.37Å; S396-R400 PolarHBondContact O-N 3.32Å; S396-R400 PolarHBondContact O-NE 2.99Å | ||
| 397 | K | 80.4 | Confident | 81.9 | Confident | 146 Ų | 146 | 52.3 Ų | 52.3 | 64% | 0.635 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -71.7 | -30 | 166.9 | -67.8 | -174.9 | -179.8 | -178.7 | 0 | 111.5 | R401 | K397-R401 WeakPolarHBondContact O-CB 3.39Å; K397-R401 VanDerWaalsContact O-CG 3.3Å; K397-R401 WeakPolarHBondContact O-CG 3.24Å; K397-R401 PolarHBondContact O-N 3.11Å |
| 398 | D | 82.8 | Confident | 80.2 | Confident | 63 Ų | 63 | 55.7 Ų | 55.7 | 34% | 0.337 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -73.9 | -40.6 | -177.3 | -53.2 | -24.9 | 0 | 0 | 0 | 111.1 | L142 S396 R401 A402 | L142-D398 HydrophobicContact CD2-CB 4Å; S396-D398 VanDerWaalsContact C-N 3.32Å; S396-D398 PolarHBondContact OG-N 3.38Å; D398-R401 PolarHBondContact O-N 2.97Å; D398-R401 IonicContact OD1-CZ 3.73Å; D398-R401 IonicContact OD1-NE 3.98Å; D398-R401 IonicContact OD1-NH2 2.7Å; D398-R401 PolarHBondContact OD1-NH2 3.38Å; D398-A402 WeakPolarHBondContact O-CB 3.49Å; D398-A402 PolarHBondContact O-N 3.45Å |
| 399 | L | 82.7 | Confident | 78.6 | Confident | 12 Ų | 12 | 62.6 Ų | 62.6 | 6% | 0.063 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -63 | -45.3 | 175.2 | -169.9 | 69 | 0 | 0 | 0 | 110.9 | V135 I136 L142 Y148 S396 A402 F403 | V135-L399 HydrophobicContact CB-CD1 4.45Å; V135-L399 HydrophobicContact CG1-CD1 3.84Å; I136-L399 HydrophobicContact CG1-CD1 4.11Å; L142-L399 HydrophobicContact CD1-CD1 3.95Å; Y148-L399 HydrophobicContact CE1-CB 4.41Å; Y148-L399 HydrophobicContact CE1-CD1 4.32Å; S396-L399 PolarHBondContact OG-N 3.37Å; L399-A402 PolarHBondContact O-N 2.95Å; L399-F403 WeakPolarHBondContact O-CB 3.47Å; L399-F403 PolarHBondContact O-N 3.37Å |
| 400 | R | 85.7 | Confident | 76.6 | Confident | 107 Ų | 107 | 64.8 Ų | 64.8 | 40% | 0.404 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -60.9 | -43.3 | 174.5 | -79.4 | 179.8 | -74.3 | -170.9 | -18.9 | 113 | A393 L394 S396 F403 L404 | A393-R400 WeakPolarHBondContact O-CD 3.48Å; A393-R400 VanDerWaalsContact O-CZ 3.29Å; A393-R400 PolarHBondContact O-NE 3.39Å; L394-R400 PolarHBondContact O-NH2 2.94Å; S396-R400 PolarHBondContact O-N 3.32Å; S396-R400 PolarHBondContact O-NE 2.99Å; R400-F403 PolarHBondContact O-N 3.46Å; R400-L404 WeakPolarHBondContact O-CG 3.44Å; R400-L404 PolarHBondContact O-N 3.46Å |
| 401 | R | 84.5 | Confident | 74.8 | Confident | 165 Ų | 165 | 71 Ų | 71 | 62% | 0.623 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -63.8 | -41.7 | 175.4 | -75.5 | -173.9 | -64.7 | 162.3 | -2.8 | 111.8 | K397 D398 L404 S405 | K397-R401 WeakPolarHBondContact O-CB 3.39Å; K397-R401 VanDerWaalsContact O-CG 3.3Å; K397-R401 WeakPolarHBondContact O-CG 3.24Å; K397-R401 PolarHBondContact O-N 3.11Å; D398-R401 PolarHBondContact O-N 2.97Å; D398-R401 IonicContact OD1-CZ 3.73Å; D398-R401 IonicContact OD1-NE 3.98Å; D398-R401 IonicContact OD1-NH2 2.7Å; D398-R401 PolarHBondContact OD1-NH2 3.38Å; R401-L404 PolarHBondContact O-N 3.23Å; R401-S405 WeakPolarHBondContact O-CB 3.31Å; R401-S405 PolarHBondContact O-N 3.47Å; R401-S405 PolarHBondContact O-OG 3.27Å |
| 402 | A | 82.1 | Confident | 72.8 | Confident | 6 Ų | 6 | 74.8 Ų | 74.8 | 5% | 0.05 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -62.9 | -43.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | V135 L142 D398 L399 S405 S406 | V135-A402 HydrophobicContact CG1-CB 3.55Å; L142-A402 HydrophobicContact CD1-CB 3.72Å; L142-A402 HydrophobicContact CG-CB 4.36Å; D398-A402 WeakPolarHBondContact O-CB 3.49Å; D398-A402 PolarHBondContact O-N 3.45Å; L399-A402 PolarHBondContact O-N 2.95Å; A402-S405 WeakPolarHBondContact CA-OG 3.29Å; A402-S405 PolarHBondContact O-N 3.33Å; A402-S405 PolarHBondContact O-OG 2.77Å; A402-S406 WeakPolarHBondContact O-CB 3.45Å; A402-S406 PolarHBondContact O-N 3.45Å; A402-S406 PolarHBondContact O-OG 3.03Å |
| 403 | F | 85.2 | Confident | 71 | Confident | 87 Ų | 87 | 77.9 Ų | 77.9 | 38% | 0.382 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -58.3 | -51.1 | 174 | 176.9 | -98.7 | 0 | 0 | 0 | 112 | V131 V135 L399 R400 S405 S406 C407 | V131-F403 HydrophobicContact CG1-CD2 3.89Å; V131-F403 HydrophobicContact CG1-CE2 3.68Å; V135-F403 HydrophobicContact CG1-CB 4.48Å; V135-F403 HydrophobicContact CG2-CB 4.1Å; V135-F403 HydrophobicContact CG2-CD2 3.89Å; L399-F403 WeakPolarHBondContact O-CB 3.47Å; L399-F403 PolarHBondContact O-N 3.37Å; R400-F403 PolarHBondContact O-N 3.46Å; F403-S405 VanDerWaalsContact C-N 3.31Å; F403-S405 PolarHBondContact O-N 3.06Å; F403-S406 PolarHBondContact O-N 3.45Å; F403-C407 PolarHBondContact O-N 3.4Å |
| 404 | L | 83.6 | Confident | 69.3 | Low | 83 Ų | 83 | 79.1 Ų | 79.1 | 44% | 0.435 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -60.7 | -37.5 | 176.7 | -70.5 | 171.8 | 0 | 0 | 0 | 112.7 | R400 R401 S406 C410 | R400-L404 WeakPolarHBondContact O-CG 3.44Å; R400-L404 PolarHBondContact O-N 3.46Å; R401-L404 PolarHBondContact O-N 3.23Å; L404-S406 VanDerWaalsContact C-N 3.26Å; L404-S406 PolarHBondContact O-N 2.86Å; L404-C410 HydrophobicContact CD2-CB 4.3Å |
| 405 | S | 80.3 | Confident | 67.9 | Low | 70 Ų | 70 | 82 Ų | 82 | 49% | 0.49 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -70.3 | -21.2 | 175.9 | 70.9 | 0 | 0 | 0 | 0 | 114.1 | R401 A402 F403 | R401-S405 WeakPolarHBondContact O-CB 3.31Å; R401-S405 PolarHBondContact O-N 3.47Å; R401-S405 PolarHBondContact O-OG 3.27Å; A402-S405 WeakPolarHBondContact CA-OG 3.29Å; A402-S405 PolarHBondContact O-N 3.33Å; A402-S405 PolarHBondContact O-OG 2.77Å; F403-S405 VanDerWaalsContact C-N 3.31Å; F403-S405 PolarHBondContact O-N 3.06Å |
| 406 | S | 73.9 | Confident | 66.3 | Low | 40 Ų | 40 | 86.2 Ų | 86.2 | 28% | 0.28 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -89.9 | -31 | 178.8 | -50.9 | 0 | 0 | 0 | 0 | 111.6 | Q138 A402 F403 L404 S408 | Q138-S406 PolarHBondContact OE1-OG 3.36Å; A402-S406 WeakPolarHBondContact O-CB 3.45Å; A402-S406 PolarHBondContact O-N 3.45Å; A402-S406 PolarHBondContact O-OG 3.03Å; F403-S406 PolarHBondContact O-N 3.45Å; L404-S406 VanDerWaalsContact C-N 3.26Å; L404-S406 PolarHBondContact O-N 2.86Å; S406-S408 PolarHBondContact O-N 3.2Å; S406-S408 VanDerWaalsContact O-N 3.17Å |
| 407 | C | 73.9 | Confident | 64.5 | Low | 41 Ų | 41 | 90.4 Ų | 90.4 | 28% | 0.277 | 47% | 0.47 | S | S | . | . | trans | -74.4 | 99 | 171.3 | -68.8 | 0 | 0 | 0 | 0 | 110.9 | F403 I409 C410 | F403-C407 PolarHBondContact O-N 3.4Å; C407-I409 PolarHBondContact O-N 3.21Å; C407-I409 VanDerWaalsContact O-N 3.08Å; C407-C410 PolarHBondContact O-N 2.86Å | ||
| 408 | S | 55.9 | Low | 62.8 | Low | 92 Ų | 92 | 88.3 Ų | 88.3 | 64% | 0.643 | 47% | 0.466 | S | S | * | . | G | 310 helix | trans | -51.5 | -32.3 | 178.4 | 50.5 | 0 | 0 | 0 | 0 | 114.2 | S406 C410 R411 | S406-S408 PolarHBondContact O-N 3.2Å; S406-S408 VanDerWaalsContact O-N 3.17Å; S408-C410 PolarHBondContact O-N 2.97Å; S408-R411 WeakPolarHBondContact O-CB 3.39Å; S408-R411 PolarHBondContact O-N 3.47Å |
| 409 | I | 55.7 | Low | 61 | Low | 151 Ų | 151 | 90.2 Ų | 90.2 | 77% | 0.774 | 48% | 0.476 | S | S | * | . | G | 310 helix | trans | -61 | -27.5 | 178 | -60.5 | 171.6 | 0 | 0 | 0 | 112.6 | C407 | C407-I409 PolarHBondContact O-N 3.21Å; C407-I409 VanDerWaalsContact O-N 3.08Å |
| 410 | C | 44.8 | Very low | 59.1 | Low | 51 Ų | 51 | 92.1 Ų | 92.1 | 35% | 0.345 | 49% | 0.49 | S | S | . | . | G | 310 helix | trans | -92.5 | -4.4 | 179.4 | -65.3 | 0 | 0 | 0 | 0 | 114.3 | L404 C407 S408 S412 S413 S414 | L404-C410 HydrophobicContact CD2-CB 4.3Å; C407-C410 PolarHBondContact O-N 2.86Å; S408-C410 PolarHBondContact O-N 2.97Å; C410-S412 VanDerWaalsContact C-N 3.33Å; C410-S412 PolarHBondContact O-N 3.12Å; C410-S413 PolarHBondContact O-N 3.08Å; C410-S414 PolarHBondContact O-N 3.29Å |
| 411 | R | 47.8 | Very low | 57.1 | Low | 161 Ų | 161 | 91.7 Ų | 91.7 | 61% | 0.608 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -63.1 | -35.8 | -177.4 | -84.4 | -174.9 | 168.8 | -169.2 | -5.2 | 113.5 | S408 S413 Q415 | S408-R411 WeakPolarHBondContact O-CB 3.39Å; S408-R411 PolarHBondContact O-N 3.47Å; R411-S413 PolarHBondContact O-N 3.24Å; R411-Q415 PolarHBondContact O-N 2.8Å |
| 412 | S | 41.8 | Very low | 55.1 | Low | 84 Ų | 84 | 89.4 Ų | 89.4 | 59% | 0.587 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -60.8 | -42.6 | -178.9 | 54.6 | 0 | 0 | 0 | 0 | 112.6 | C410 Q416 | C410-S412 VanDerWaalsContact C-N 3.33Å; C410-S412 PolarHBondContact O-N 3.12Å; S412-Q416 PolarHBondContact O-N 3.02Å |
| 413 | S | 41.8 | Very low | 53 | Low | 89 Ų | 89 | 91.8 Ų | 91.8 | 62% | 0.622 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -77.5 | -31.7 | -175.6 | -168.5 | 0 | 0 | 0 | 0 | 113.4 | C410 R411 | C410-S413 PolarHBondContact O-N 3.08Å; R411-S413 PolarHBondContact O-N 3.24Å |
| 414 | S | 42.2 | Very low | 51 | Low | 67 Ų | 67 | 92.7 Ų | 92.7 | 47% | 0.469 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -75.3 | -41.1 | 175.8 | -94.9 | 0 | 0 | 0 | 0 | 113.4 | C410 Q416 L417 D418 | C410-S414 PolarHBondContact O-N 3.29Å; S414-Q416 VanDerWaalsContact C-N 3.25Å; S414-Q416 PolarHBondContact O-N 3.42Å; S414-L417 PolarHBondContact O-N 3.09Å; S414-D418 PolarHBondContact O-N 3.35Å |
| 415 | Q | 44.5 | Very low | 48.8 | Very low | 127 Ų | 127 | 92.4 Ų | 92.4 | 59% | 0.593 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -62.5 | -34.5 | 178.2 | -75.9 | -177.3 | -60 | 0 | 0 | 112.1 | R411 N419 | R411-Q415 PolarHBondContact O-N 2.8Å; Q415-N419 WeakPolarHBondContact O-CB 3.38Å; Q415-N419 PolarHBondContact O-N 3.18Å; Q415-N419 PolarHBondContact O-ND2 3.18Å; Q415-N419 PolarHBondContact O-OD1 3.1Å |
| 416 | Q | 40.3 | Very low | 47 | Very low | 151 Ų | 151 | 95.2 Ų | 95.2 | 71% | 0.706 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -71.2 | -30.8 | 178.8 | -157.9 | 168.9 | 9.5 | 0 | 0 | 112.8 | S412 S414 S420 | S412-Q416 PolarHBondContact O-N 3.02Å; S414-Q416 VanDerWaalsContact C-N 3.25Å; S414-Q416 PolarHBondContact O-N 3.42Å; Q416-S420 WeakPolarHBondContact O-CB 3.21Å; Q416-S420 PolarHBondContact O-N 2.83Å; Q416-S420 PolarHBondContact O-OG 3.36Å |
| 417 | L | 44.5 | Very low | 45.5 | Very low | 106 Ų | 106 | 98.5 Ų | 98.5 | 56% | 0.555 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -79.3 | -41.2 | 177.1 | -170.9 | 64.3 | 0 | 0 | 0 | 112.9 | S414 S420 L421 | S414-L417 PolarHBondContact O-N 3.09Å; L417-S420 WeakPolarHBondContact CA-OG 3.4Å; L417-S420 PolarHBondContact O-OG 3.36Å; L417-S420 VanDerWaalsContact O-OG 3.06Å; L417-L421 HydrophobicContact CG-CD1 4.24Å; L417-L421 WeakPolarHBondContact O-CG 3.01Å; L417-L421 PolarHBondContact O-N 3.01Å; L417-L421 VanDerWaalsContact O-N 3.12Å |
| 418 | D | 45.1 | Very low | 43.9 | Very low | 101 Ų | 101 | 105.5 Ų | 105.5 | 54% | 0.54 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -67.4 | -43 | 175.7 | -72.8 | -27.7 | 0 | 0 | 0 | 110.7 | S414 S420 L421 E422 | S414-D418 PolarHBondContact O-N 3.35Å; D418-S420 VanDerWaalsContact C-N 3.32Å; D418-S420 PolarHBondContact O-N 3.47Å; D418-L421 PolarHBondContact O-N 3.29Å; D418-E422 VanDerWaalsContact O-CB 3.3Å; D418-E422 WeakPolarHBondContact O-CB 3.47Å; D418-E422 PolarHBondContact O-N 2.83Å |
| 419 | N | 45.2 | Very low | 43.1 | Very low | 103 Ų | 103 | 106 Ų | 106 | 55% | 0.551 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -62.8 | -34.5 | 177.3 | -70.8 | 1.4 | 0 | 0 | 0 | 113.3 | Q415 S423 | Q415-N419 WeakPolarHBondContact O-CB 3.38Å; Q415-N419 PolarHBondContact O-N 3.18Å; Q415-N419 PolarHBondContact O-ND2 3.18Å; Q415-N419 PolarHBondContact O-OD1 3.1Å; N419-S423 WeakPolarHBondContact O-CB 3.42Å; N419-S423 PolarHBondContact O-N 3.13Å; N419-S423 PolarHBondContact O-OG 3.13Å |
| 420 | S | 42.4 | Very low | 42.5 | Very low | 52 Ų | 52 | 101.1 Ų | 101.1 | 36% | 0.364 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -74.8 | -40.9 | 178.7 | 41.7 | 0 | 0 | 0 | 0 | 112 | Q416 L417 D418 E422 S423 D424 | Q416-S420 WeakPolarHBondContact O-CB 3.21Å; Q416-S420 PolarHBondContact O-N 2.83Å; Q416-S420 PolarHBondContact O-OG 3.36Å; L417-S420 WeakPolarHBondContact CA-OG 3.4Å; L417-S420 PolarHBondContact O-OG 3.36Å; L417-S420 VanDerWaalsContact O-OG 3.06Å; D418-S420 VanDerWaalsContact C-N 3.32Å; D418-S420 PolarHBondContact O-N 3.47Å; S420-E422 VanDerWaalsContact C-N 3.31Å; S420-E422 PolarHBondContact O-N 3.07Å; S420-S423 WeakPolarHBondContact CA-OG 3.49Å; S420-S423 PolarHBondContact O-N 3.03Å; S420-S423 PolarHBondContact O-OG 3.3Å; S420-D424 PolarHBondContact O-N 2.89Å |
| 421 | L | 43.6 | Very low | 42.3 | Very low | 99 Ų | 99 | 103.9 Ų | 103.9 | 52% | 0.518 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -64.2 | -35.8 | 171.4 | -73.6 | 167.5 | 0 | 0 | 0 | 112.2 | L417 D418 C425 | L417-L421 HydrophobicContact CG-CD1 4.24Å; L417-L421 WeakPolarHBondContact O-CG 3.01Å; L417-L421 PolarHBondContact O-N 3.01Å; L417-L421 VanDerWaalsContact O-N 3.12Å; D418-L421 PolarHBondContact O-N 3.29Å; L421-C425 WeakPolarHBondContact O-CB 3.4Å; L421-C425 PolarHBondContact O-N 3.21Å |
| 422 | E | 41.9 | Very low | 42.2 | Very low | 117 Ų | 117 | 100.3 Ų | 100.3 | 55% | 0.547 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -72.2 | -38.1 | 177.1 | -163.3 | 160 | -141.9 | 0 | 0 | 111.6 | D418 S420 C425 Q426 | D418-E422 VanDerWaalsContact O-CB 3.3Å; D418-E422 WeakPolarHBondContact O-CB 3.47Å; D418-E422 PolarHBondContact O-N 2.83Å; S420-E422 VanDerWaalsContact C-N 3.31Å; S420-E422 PolarHBondContact O-N 3.07Å; E422-C425 PolarHBondContact O-N 2.97Å; E422-Q426 WeakPolarHBondContact O-CG 3.15Å; E422-Q426 PolarHBondContact O-N 3.12Å |
| 423 | S | 39.5 | Very low | 42.3 | Very low | 56 Ų | 56 | 99.7 Ų | 99.7 | 39% | 0.392 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -64.6 | -39.4 | 171.7 | 63.2 | 0 | 0 | 0 | 0 | 113.3 | N419 S420 Q426 N427 | N419-S423 WeakPolarHBondContact O-CB 3.42Å; N419-S423 PolarHBondContact O-N 3.13Å; N419-S423 PolarHBondContact O-OG 3.13Å; S420-S423 WeakPolarHBondContact CA-OG 3.49Å; S420-S423 PolarHBondContact O-N 3.03Å; S420-S423 PolarHBondContact O-OG 3.3Å; S423-Q426 PolarHBondContact O-N 2.93Å; S423-N427 WeakPolarHBondContact O-CB 3.22Å; S423-N427 PolarHBondContact O-N 2.75Å |
| 424 | D | 42.8 | Very low | 42.3 | Very low | 106 Ų | 106 | 98.2 Ų | 98.2 | 57% | 0.567 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -67.6 | -37.3 | 175.4 | -89.4 | -7.9 | 0 | 0 | 0 | 111.9 | S420 R428 | S420-D424 PolarHBondContact O-N 2.89Å; D424-R428 WeakPolarHBondContact O-CB 3.47Å; D424-R428 PolarHBondContact O-N 2.81Å |
| 425 | C | 35.8 | Very low | 42.1 | Very low | 77 Ų | 77 | 100.5 Ų | 100.5 | 52% | 0.52 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -65.9 | -40.7 | 172.7 | -87 | 0 | 0 | 0 | 0 | 112.5 | L421 E422 N429 | L421-C425 WeakPolarHBondContact O-CB 3.4Å; L421-C425 PolarHBondContact O-N 3.21Å; E422-C425 PolarHBondContact O-N 2.97Å; C425-N429 WeakPolarHBondContact O-CB 3.02Å; C425-N429 VanDerWaalsContact O-CG 3.24Å; C425-N429 PolarHBondContact O-N 3.35Å; C425-N429 PolarHBondContact O-ND2 2.89Å |
| 426 | Q | 43.9 | Very low | 41.8 | Very low | 129 Ų | 129 | 103.3 Ų | 103.3 | 60% | 0.603 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -68.6 | -44.6 | 177.8 | -73.3 | 179.8 | 4 | 0 | 0 | 111.8 | E422 S423 R428 N429 A430 | E422-Q426 WeakPolarHBondContact O-CG 3.15Å; E422-Q426 PolarHBondContact O-N 3.12Å; S423-Q426 PolarHBondContact O-N 2.93Å; Q426-R428 PolarHBondContact O-N 2.97Å; Q426-N429 PolarHBondContact O-N 3.1Å; Q426-A430 WeakPolarHBondContact O-CB 3.43Å; Q426-A430 PolarHBondContact O-N 3.37Å |
| 427 | N | 40.9 | Very low | 41.6 | Very low | 108 Ų | 108 | 99.8 Ų | 99.8 | 58% | 0.578 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -61.8 | -40.7 | 174.8 | -94.2 | -18.1 | 0 | 0 | 0 | 112.6 | S423 N431 | S423-N427 WeakPolarHBondContact O-CB 3.22Å; S423-N427 PolarHBondContact O-N 2.75Å; N427-N431 PolarHBondContact O-N 3.18Å; N427-N431 VanDerWaalsContact O-N 3.14Å |
| 428 | R | 40.8 | Very low | 41.2 | Very low | 188 Ų | 188 | 98.4 Ų | 98.4 | 71% | 0.709 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -62.9 | -43.5 | 173.6 | -93 | -177.9 | 161.1 | 178 | -4 | 112.5 | D424 Q426 N431 I432 | D424-R428 WeakPolarHBondContact O-CB 3.47Å; D424-R428 PolarHBondContact O-N 2.81Å; Q426-R428 PolarHBondContact O-N 2.97Å; R428-N431 PolarHBondContact O-N 3.39Å; R428-I432 WeakPolarHBondContact O-CB 3.31Å; R428-I432 WeakPolarHBondContact O-CD1 3.31Å; R428-I432 VanDerWaalsContact O-CG1 3.23Å; R428-I432 WeakPolarHBondContact O-CG1 3.37Å; R428-I432 PolarHBondContact O-N 2.96Å |
| 429 | N | 39.1 | Very low | 40.8 | Very low | 103 Ų | 103 | 101.3 Ų | 101.3 | 55% | 0.551 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -70.7 | -33.4 | -179.2 | -72.4 | -23.1 | 0 | 0 | 0 | 112.6 | C425 Q426 I432 S433 | C425-N429 WeakPolarHBondContact O-CB 3.02Å; C425-N429 VanDerWaalsContact O-CG 3.24Å; C425-N429 PolarHBondContact O-N 3.35Å; C425-N429 PolarHBondContact O-ND2 2.89Å; Q426-N429 PolarHBondContact O-N 3.1Å; N429-I432 PolarHBondContact O-N 3.27Å; N429-S433 WeakPolarHBondContact O-CB 3.39Å; N429-S433 PolarHBondContact O-N 3.44Å; N429-S433 PolarHBondContact O-OG 2.76Å |
| 430 | A | 43.4 | Very low | 40.1 | Very low | 48 Ų | 48 | 101.6 Ų | 101.6 | 40% | 0.397 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -62.1 | -48 | 172 | 0 | 0 | 0 | 0 | 0 | 111.5 | Q426 I432 S433 A434 | Q426-A430 WeakPolarHBondContact O-CB 3.43Å; Q426-A430 PolarHBondContact O-N 3.37Å; A430-I432 PolarHBondContact O-N 3.49Å; A430-S433 WeakPolarHBondContact CA-OG 3.03Å; A430-S433 PolarHBondContact O-N 3.2Å; A430-S433 PolarHBondContact O-OG 2.82Å; A430-S433 VanDerWaalsContact O-OG 3.06Å; A430-A434 WeakPolarHBondContact O-CB 3.16Å; A430-A434 PolarHBondContact O-N 3.25Å |
| 431 | N | 41.7 | Very low | 39.5 | Very low | 110 Ų | 110 | 104.6 Ų | 104.6 | 59% | 0.588 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -66.6 | -34.7 | 178.2 | -71.3 | -11.6 | 0 | 0 | 0 | 112.9 | N427 R428 N435 | N427-N431 PolarHBondContact O-N 3.18Å; N427-N431 VanDerWaalsContact O-N 3.14Å; R428-N431 PolarHBondContact O-N 3.39Å; N431-N435 PolarHBondContact O-N 2.81Å; N431-N435 VanDerWaalsContact O-N 3.16Å |
| 432 | I | 45.3 | Very low | 38.9 | Very low | 85 Ų | 85 | 105.5 Ų | 105.5 | 44% | 0.436 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -70.7 | -35 | 175.9 | -68.7 | 164.7 | 0 | 0 | 0 | 111.8 | R428 N429 A430 R436 | R428-I432 WeakPolarHBondContact O-CB 3.31Å; R428-I432 WeakPolarHBondContact O-CD1 3.31Å; R428-I432 VanDerWaalsContact O-CG1 3.23Å; R428-I432 WeakPolarHBondContact O-CG1 3.37Å; R428-I432 PolarHBondContact O-N 2.96Å; N429-I432 PolarHBondContact O-N 3.27Å; A430-I432 PolarHBondContact O-N 3.49Å; I432-R436 WeakPolarHBondContact O-CG 3.37Å; I432-R436 PolarHBondContact O-N 2.64Å |
| 433 | S | 43.2 | Very low | 38.6 | Very low | 72 Ų | 72 | 110 Ų | 110 | 50% | 0.503 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -77.6 | -35.2 | 177.4 | 47.5 | 0 | 0 | 0 | 0 | 112.7 | N429 A430 R436 A437 | N429-S433 WeakPolarHBondContact O-CB 3.39Å; N429-S433 PolarHBondContact O-N 3.44Å; N429-S433 PolarHBondContact O-OG 2.76Å; A430-S433 WeakPolarHBondContact CA-OG 3.03Å; A430-S433 PolarHBondContact O-N 3.2Å; A430-S433 PolarHBondContact O-OG 2.82Å; A430-S433 VanDerWaalsContact O-OG 3.06Å; S433-R436 PolarHBondContact O-N 2.04Å; S433-A437 PolarHBondContact O-N 2.87Å |
| 434 | A | 41.3 | Very low | 38.2 | Very low | 58 Ų | 58 | 112.9 Ų | 112.9 | 48% | 0.479 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -60.2 | -47.1 | 170.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | A430 R436 A437 A438 | A430-A434 WeakPolarHBondContact O-CB 3.16Å; A430-A434 PolarHBondContact O-N 3.25Å; A434-R436 PolarHBondContact O-N 3.08Å; A434-A437 PolarHBondContact O-N 2.81Å; A434-A438 PolarHBondContact O-N 2.94Å |
| 435 | N | 39.4 | Very low | 37.6 | Very low | 115 Ų | 115 | 114.1 Ų | 114.1 | 62% | 0.615 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -66 | -37.7 | 178 | -77.2 | 2 | 0 | 0 | 0 | 112.8 | N431 A437 A438 E439 | N431-N435 PolarHBondContact O-N 2.81Å; N431-N435 VanDerWaalsContact O-N 3.16Å; N435-A437 VanDerWaalsContact C-N 3.33Å; N435-A437 PolarHBondContact O-N 3.12Å; N435-A438 PolarHBondContact O-N 2.89Å; N435-E439 PolarHBondContact O-N 2.96Å |
| 436 | R | 38.5 | Very low | 37.2 | Very low | 186 Ų | 186 | 116.8 Ų | 116.8 | 70% | 0.702 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -68.9 | -28 | 175.8 | -78.7 | -178.1 | 176.2 | 174.1 | 0.3 | 113.9 | I432 S433 A434 A438 | I432-R436 WeakPolarHBondContact O-CG 3.37Å; I432-R436 PolarHBondContact O-N 2.64Å; S433-R436 PolarHBondContact O-N 2.04Å; A434-R436 PolarHBondContact O-N 3.08Å; R436-A438 VanDerWaalsContact C-N 3.34Å |
| 437 | A | 36.2 | Very low | 36.6 | Very low | 76 Ų | 76 | 120.3 Ų | 120.3 | 63% | 0.628 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -70.4 | -32.1 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | S433 A434 N435 | S433-A437 PolarHBondContact O-N 2.87Å; A434-A437 PolarHBondContact O-N 2.81Å; N435-A437 VanDerWaalsContact C-N 3.33Å; N435-A437 PolarHBondContact O-N 3.12Å |
| 438 | A | 36.3 | Very low | 36.1 | Very low | 77 Ų | 77 | 123 Ų | 123 | 64% | 0.636 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -73.7 | -33.3 | 179.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | A434 N435 R436 S440 | A434-A438 PolarHBondContact O-N 2.94Å; N435-A438 PolarHBondContact O-N 2.89Å; R436-A438 VanDerWaalsContact C-N 3.34Å; A438-S440 PolarHBondContact O-N 3.23Å |
| 439 | E | 35.1 | Very low | 35.6 | Very low | 163 Ų | 163 | 118.1 Ų | 118.1 | 76% | 0.762 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -79.5 | -11.9 | -177.5 | -71.1 | -175.6 | 141.2 | 0 | 0 | 114.5 | N435 C441 | N435-E439 PolarHBondContact O-N 2.96Å; E439-C441 PolarHBondContact O-N 3.48Å |
| 440 | S | 30.6 | Very low | 35 | Very low | 108 Ų | 108 | 122.6 Ų | 122.6 | 76% | 0.755 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.8 | 4.9 | -175.5 | -168.7 | 0 | 0 | 0 | 0 | 115 | A438 | A438-S440 PolarHBondContact O-N 3.23Š|
| 441 | C | 30.4 | Very low | 34.3 | Very low | 116 Ų | 116 | 126.3 Ų | 126.3 | 78% | 0.784 | 71% | 0.71 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -133.5 | 48.7 | -175.3 | -161.5 | 0 | 0 | 0 | 0 | 114.5 | E439 | E439-C441 PolarHBondContact O-N 3.48Š|
| 442 | V | 31.1 | Very low | 33.7 | Very low | 117 Ų | 117 | 126.8 Ų | 126.8 | 71% | 0.709 | 72% | 0.717 | S | S | * | * | trans | -127.3 | 111 | 163.2 | -175.7 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 443 | K | 36.4 | Very low | 33 | Very low | 211 Ų | 211 | 130.3 Ų | 130.3 | 92% | 0.917 | 73% | 0.734 | S | S | * | * | trans | -72.9 | 121 | 166.8 | -79.5 | 178 | 175.1 | 175 | 0 | 109.2 | ||||
| 444 | T | 29.6 | Very low | 32.3 | Very low | 117 Ų | 117 | 132.5 Ų | 132.5 | 72% | 0.718 | 75% | 0.749 | S | S | * | * | trans | -135.1 | 123.6 | 163.4 | -45.7 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 445 | T | 30.3 | Very low | 31.8 | Very low | 132 Ų | 132 | 134.8 Ų | 134.8 | 81% | 0.81 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -66.4 | 132.5 | 179.3 | 43.9 | 0 | 0 | 0 | 0 | 112.8 | ||
| 446 | V | 28.4 | Very low | 31.4 | Very low | 134 Ų | 134 | 135 Ų | 135 | 81% | 0.812 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -85 | 118.7 | 171 | 178.7 | 0 | 0 | 0 | 0 | 110 | ||
| 447 | K | 30.8 | Very low | 31 | Very low | 202 Ų | 202 | 131.4 Ų | 131.4 | 88% | 0.878 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -82.1 | 124 | 163.4 | -77.8 | -176.2 | 175.9 | 179 | 0 | 109 | ||
| 448 | I | 29.4 | Very low | 30.9 | Very low | 164 Ų | 164 | 136.9 Ų | 136.9 | 84% | 0.841 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -81.4 | 118.9 | 176.1 | -60.3 | 172 | 0 | 0 | 0 | 108.8 | ||
| 449 | A | 30 | Very low | 30.7 | Very low | 87 Ų | 87 | 139.2 Ų | 139.2 | 72% | 0.719 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -85.9 | 128.3 | 169.3 | 0 | 0 | 0 | 0 | 0 | 110 | V451 | A449-V451 PolarHBondContact O-N 3.46Š|
| 450 | K | 28 | Very low | 30.5 | Very low | 196 Ų | 196 | 137.7 Ų | 137.7 | 85% | 0.852 | 79% | 0.793 | S | S | * | * | trans | -78.1 | 110.2 | 179.1 | -173.8 | -178.6 | -176.7 | -179.2 | 0 | 109.6 | ||||
| 451 | V | 28.8 | Very low | 30.8 | Very low | 126 Ų | 126 | 136.8 Ų | 136.8 | 76% | 0.764 | 79% | 0.792 | S | S | * | * | trans | -89.9 | 112.7 | 171.6 | 178.9 | 0 | 0 | 0 | 0 | 108.9 | A449 | A449-V451 PolarHBondContact O-N 3.46Š| ||
| 452 | T | 29.1 | Very low | 30.8 | Very low | 121 Ų | 121 | 140 Ų | 140 | 74% | 0.742 | 80% | 0.795 | S | S | * | * | trans | -81 | 116 | 173.2 | -48.2 | 0 | 0 | 0 | 0 | 109 | ||||
| 453 | M | 29.8 | Very low | 31 | Very low | 158 Ų | 158 | 138.7 Ų | 138.7 | 78% | 0.778 | 80% | 0.797 | S | S | * | * | trans | -90.5 | 111.8 | 170.3 | -68.8 | -170.7 | 71 | 0 | 0 | 109.9 | V455 | M453-V455 PolarHBondContact O-N 3.08Š| ||
| 454 | S | 28.5 | Very low | 30.8 | Very low | 118 Ų | 118 | 139.2 Ų | 139.2 | 83% | 0.825 | 82% | 0.817 | S | S | * | * | trans | -79.5 | 103.1 | 165.4 | 53.3 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 455 | V | 31.5 | Very low | 30.9 | Very low | 106 Ų | 106 | 140.3 Ų | 140.3 | 64% | 0.642 | 82% | 0.822 | S | S | * | * | trans | -96.4 | 109.4 | 171.3 | 171.8 | 0 | 0 | 0 | 0 | 108 | M453 T457 | M453-V455 PolarHBondContact O-N 3.08Å; V455-T457 HydrophobicContact CG1-CG2 3.82Å; V455-T457 PolarHBondContact O-N 3.17Å | ||
| 456 | S | 29.7 | Very low | 30.9 | Very low | 121 Ų | 121 | 140.7 Ų | 140.7 | 85% | 0.846 | 82% | 0.823 | S | S | * | * | trans | -87.7 | 93.4 | 171 | 52.3 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 457 | T | 31.7 | Very low | 31 | Very low | 110 Ų | 110 | 141.1 Ų | 141.1 | 68% | 0.675 | 82% | 0.823 | S | S | * | * | trans | -98.8 | 103.4 | 168.3 | 41 | 0 | 0 | 0 | 0 | 109.9 | V455 T459 | V455-T457 HydrophobicContact CG1-CG2 3.82Å; V455-T457 PolarHBondContact O-N 3.17Å; T457-T459 PolarHBondContact O-N 3.46Å | ||
| 458 | E | 32.9 | Very low | 31 | Very low | 190 Ų | 190 | 137.5 Ų | 137.5 | 89% | 0.888 | 82% | 0.82 | S | S | * | * | trans | -82.5 | 105.8 | 159.1 | -73.9 | -174 | 152.5 | 0 | 0 | 108.9 | ||||
| 459 | T | 33 | Very low | 31.1 | Very low | 127 Ų | 127 | 135.9 Ų | 135.9 | 78% | 0.779 | 82% | 0.819 | S | S | * | * | trans | -139 | 105 | 162.5 | 46.5 | 0 | 0 | 0 | 0 | 108.1 | T457 | T457-T459 PolarHBondContact O-N 3.46Š| ||
| 460 | S | 30.8 | Very low | 31.2 | Very low | 131 Ų | 131 | 139.1 Ų | 139.1 | 92% | 0.916 | 83% | 0.825 | S | S | * | * | trans | -95.8 | 110.1 | -179.2 | -55.7 | 0 | 0 | 0 | 0 | 111 | ||||
| 461 | A | 36.3 | Very low | 31.5 | Very low | 89 Ų | 89 | 135.1 Ų | 135.1 | 74% | 0.736 | 82% | 0.824 | S | S | * | * | trans | -146.5 | 144 | 158 | 0 | 0 | 0 | 0 | 0 | 104.9 | ||||
| 462 | E | 31.2 | Very low | 31.7 | Very low | 183 Ų | 183 | 135.8 Ų | 135.8 | 86% | 0.855 | 83% | 0.828 | S | S | * | * | cis | -161.5 | 164.5 | 23.5 | -142.3 | 165 | -158.8 | 0 | 0 | 109.9 | ||||
| 463 | A | 33.9 | Very low | 31.9 | Very low | 90 Ų | 90 | 137 Ų | 137 | 74% | 0.744 | 84% | 0.835 | S | S | * | * | trans | 44.8 | 116 | 155.7 | 0 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 464 | V | 33.2 | Very low | 32.1 | Very low | 221 Ų | 221 | 135.1 Ų | 135.1 | 100% | 1.339 | 84% | 0.841 | S | S | * | * | -140.4 | 0 | 95.8 | 168.8 | 0 | 0 | 0 | 0 | 108.2 |
Retrieved 464 of 464 residues in 260 ms
(Link to these results)