| 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 | 55.2 | Low | 63.7 | Low | 212 Ų | 212 | 106.3 Ų | 106.3 | 100% | 1.044 | 57% | 0.572 | S | S | * | * | 0 | -36.9 | 0 | -70.5 | -174.3 | 154.6 | 0 | 0 | 113.4 | S3 L4 | M1-S3 VanDerWaalsContact C-N 3.26Å; M1-S3 PolarHBondContact O-N 3.1Å; M1-L4 PolarHBondContact O-N 3.35Å | |||
| 2 | I | 66.9 | Low | 63.9 | Low | 127 Ų | 127 | 105.2 Ų | 105.2 | 65% | 0.651 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -53.3 | -37.7 | 175.3 | -107.4 | 80.4 | 0 | 0 | 0 | 113.9 | L4 L5 L6 | I2-L4 VanDerWaalsContact C-N 3.33Å; I2-L4 PolarHBondContact O-N 3.31Å; I2-L5 PolarHBondContact O-N 2.93Å; I2-L6 HydrophobicContact CG2-CD1 3.95Å; I2-L6 PolarHBondContact O-N 2.96Å; I2-L6 VanDerWaalsContact O-N 3.08Å |
| 3 | S | 69.2 | Low | 63.8 | Low | 93 Ų | 93 | 107.4 Ų | 107.4 | 65% | 0.65 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -61.6 | -37.1 | -175.3 | -172.1 | 0 | 0 | 0 | 0 | 113.2 | M1 F7 | M1-S3 VanDerWaalsContact C-N 3.26Å; M1-S3 PolarHBondContact O-N 3.1Å; S3-F7 WeakPolarHBondContact O-CB 3.43Å; S3-F7 PolarHBondContact O-N 3.23Å |
| 4 | L | 58.3 | Low | 63.7 | Low | 137 Ų | 137 | 101.6 Ų | 101.6 | 72% | 0.717 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -71.6 | -35.3 | 178.1 | -69.2 | 170.6 | 0 | 0 | 0 | 112.3 | M1 I2 F7 G8 | M1-L4 PolarHBondContact O-N 3.35Å; I2-L4 VanDerWaalsContact C-N 3.33Å; I2-L4 PolarHBondContact O-N 3.31Å; L4-F7 PolarHBondContact O-N 2.92Å; L4-G8 PolarHBondContact O-N 3.38Å |
| 5 | L | 60.8 | Low | 63.7 | Low | 117 Ų | 117 | 96.3 Ų | 96.3 | 61% | 0.613 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -66 | -45.4 | 176.2 | -77.7 | 160.3 | 0 | 0 | 0 | 111.1 | I2 G8 L9 | I2-L5 PolarHBondContact O-N 2.93Å; L5-G8 PolarHBondContact O-N 3.24Å; L5-L9 WeakPolarHBondContact O-CB 3.49Å; L5-L9 WeakPolarHBondContact O-CD1 3.42Å; L5-L9 WeakPolarHBondContact O-CG 3.5Å; L5-L9 PolarHBondContact O-N 3.17Å |
| 6 | L | 64.4 | Low | 63.5 | Low | 99 Ų | 99 | 98.4 Ų | 98.4 | 52% | 0.518 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -64.4 | -41.2 | 175.9 | -69.6 | 174.1 | 0 | 0 | 0 | 111.6 | I2 L9 L10 | I2-L6 HydrophobicContact CG2-CD1 3.95Å; I2-L6 PolarHBondContact O-N 2.96Å; I2-L6 VanDerWaalsContact O-N 3.08Å; L6-L9 HydrophobicContact CD2-CD1 4.45Å; L6-L9 PolarHBondContact O-N 3.48Å; L6-L10 VanDerWaalsContact O-CG 3.32Å; L6-L10 WeakPolarHBondContact O-CG 3.36Å; L6-L10 PolarHBondContact O-N 3.08Å |
| 7 | F | 69.6 | Low | 63.2 | Low | 111 Ų | 111 | 102.4 Ų | 102.4 | 49% | 0.487 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -61 | -45.1 | 174.3 | -172.6 | -108.5 | 0 | 0 | 0 | 111.3 | S3 L4 L9 L10 L11 F43 | S3-F7 WeakPolarHBondContact O-CB 3.43Å; S3-F7 PolarHBondContact O-N 3.23Å; L4-F7 PolarHBondContact O-N 2.92Å; F7-L9 VanDerWaalsContact C-N 3.34Å; F7-L9 PolarHBondContact O-N 2.9Å; F7-L10 PolarHBondContact O-N 3.19Å; F7-L11 HydrophobicContact CD1-CD1 3.87Å; F7-L11 HydrophobicContact CD1-CG 4.36Å; F7-L11 HydrophobicContact CE1-CD1 3.47Å; F7-L11 VanDerWaalsContact CE1-CD1 3.47Å; F7-L11 HydrophobicContact CE1-CG 4.13Å; F7-L11 HydrophobicContact CZ-CD1 3.96Å; F7-L11 HydrophobicContact CZ-CD2 4.27Å; F7-L11 HydrophobicContact CZ-CG 4.25Å; F7-L11 VanDerWaalsContact O-CG 3.3Å; F7-L11 WeakPolarHBondContact O-CG 3.29Å; F7-L11 PolarHBondContact O-N 2.89Å; F7-F43 HydrophobicContact CZ-CE1 4.38Å |
| 8 | G | 64 | Low | 62.9 | Low | 36 Ų | 36 | 98.4 Ų | 98.4 | 37% | 0.371 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -60.3 | -39.5 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | L4 L5 L11 L12 | L4-G8 PolarHBondContact O-N 3.38Å; L5-G8 PolarHBondContact O-N 3.24Å; G8-L11 PolarHBondContact O-N 3.47Å; G8-L12 WeakPolarHBondContact O-CB 3.3Å; G8-L12 PolarHBondContact O-N 3.18Å |
| 9 | L | 63.6 | Low | 62.5 | Low | 98 Ų | 98 | 97.6 Ų | 97.6 | 51% | 0.513 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -66.4 | -42 | 175.4 | -79.6 | 157 | 0 | 0 | 0 | 112.4 | L5 L6 F7 L12 Q13 | L5-L9 WeakPolarHBondContact O-CB 3.49Å; L5-L9 WeakPolarHBondContact O-CD1 3.42Å; L5-L9 WeakPolarHBondContact O-CG 3.5Å; L5-L9 PolarHBondContact O-N 3.17Å; L6-L9 HydrophobicContact CD2-CD1 4.45Å; L6-L9 PolarHBondContact O-N 3.48Å; F7-L9 VanDerWaalsContact C-N 3.34Å; F7-L9 PolarHBondContact O-N 2.9Å; L9-L12 PolarHBondContact O-N 3.3Å; L9-Q13 WeakPolarHBondContact O-CG 3.45Å; L9-Q13 PolarHBondContact O-N 3.48Å |
| 10 | L | 64.6 | Low | 62.2 | Low | 102 Ų | 102 | 95.5 Ų | 95.5 | 53% | 0.534 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.7 | -40.7 | 176 | -72.4 | 169.4 | 0 | 0 | 0 | 111.6 | L6 F7 Q13 S14 | L6-L10 VanDerWaalsContact O-CG 3.32Å; L6-L10 WeakPolarHBondContact O-CG 3.36Å; L6-L10 PolarHBondContact O-N 3.08Å; F7-L10 PolarHBondContact O-N 3.19Å; L10-Q13 PolarHBondContact O-N 3.33Å; L10-S14 PolarHBondContact O-N 2.81Å; L10-S14 PolarHBondContact O-OG 3.35Å |
| 11 | L | 64.7 | Low | 61.7 | Low | 37 Ų | 37 | 94.5 Ų | 94.5 | 19% | 0.194 | 51% | 0.507 | C | S | . | . | H | α-helix | trans | -63.7 | -43.9 | 173 | -68.1 | -175.6 | 0 | 0 | 0 | 111.3 | F7 G8 Q13 S14 C15 F43 | F7-L11 HydrophobicContact CD1-CD1 3.87Å; F7-L11 HydrophobicContact CD1-CG 4.36Å; F7-L11 HydrophobicContact CE1-CD1 3.47Å; F7-L11 VanDerWaalsContact CE1-CD1 3.47Å; F7-L11 HydrophobicContact CE1-CG 4.13Å; F7-L11 HydrophobicContact CZ-CD1 3.96Å; F7-L11 HydrophobicContact CZ-CD2 4.27Å; F7-L11 HydrophobicContact CZ-CG 4.25Å; F7-L11 VanDerWaalsContact O-CG 3.3Å; F7-L11 WeakPolarHBondContact O-CG 3.29Å; F7-L11 PolarHBondContact O-N 2.89Å; G8-L11 PolarHBondContact O-N 3.47Å; L11-Q13 VanDerWaalsContact C-N 3.34Å; L11-Q13 PolarHBondContact O-N 2.98Å; L11-S14 VanDerWaalsContact O-CB 3.32Å; L11-S14 WeakPolarHBondContact O-CB 3.38Å; L11-S14 PolarHBondContact O-N 3.23Å; L11-S14 VanDerWaalsContact O-N 3.13Å; L11-C15 PolarHBondContact O-N 2.91Å; L11-C15 PolarHBondContact O-SG 3.2Å; L11-F43 HydrophobicContact CD1-CD1 3.86Å; L11-F43 HydrophobicContact CD1-CE1 4.18Å; L11-F43 HydrophobicContact CD2-CB 4.07Å; L11-F43 HydrophobicContact CD2-CD1 3.2Å; L11-F43 HydrophobicContact CD2-CD2 4.41Å; L11-F43 HydrophobicContact CD2-CE1 3.67Å; L11-F43 HydrophobicContact CD2-CG 3.63Å; L11-F43 HydrophobicContact CD2-CZ 4.49Å; L11-F43 HydrophobicContact CG-CD1 4.13Å |
| 12 | L | 65.5 | Low | 61.6 | Low | 93 Ų | 93 | 90.7 Ų | 90.7 | 49% | 0.487 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -60.5 | -42 | 176.2 | -175.2 | 68.9 | 0 | 0 | 0 | 112.3 | G8 L9 S14 C15 L16 | G8-L12 WeakPolarHBondContact O-CB 3.3Å; G8-L12 PolarHBondContact O-N 3.18Å; L9-L12 PolarHBondContact O-N 3.3Å; L12-S14 VanDerWaalsContact C-N 3.3Å; L12-S14 PolarHBondContact O-N 2.87Å; L12-C15 WeakPolarHBondContact O-CB 3.43Å; L12-C15 PolarHBondContact O-N 3.22Å; L12-L16 PolarHBondContact O-N 2.88Å |
| 13 | Q | 62.2 | Low | 60.8 | Low | 134 Ų | 134 | 92.7 Ų | 92.7 | 63% | 0.626 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -62.1 | -39.4 | 174.8 | -76.7 | -175.2 | -20.2 | 0 | 0 | 111.8 | L9 L10 L11 C15 L16 Y17 | L9-Q13 WeakPolarHBondContact O-CG 3.45Å; L9-Q13 PolarHBondContact O-N 3.48Å; L10-Q13 PolarHBondContact O-N 3.33Å; L11-Q13 VanDerWaalsContact C-N 3.34Å; L11-Q13 PolarHBondContact O-N 2.98Å; Q13-C15 VanDerWaalsContact C-N 3.29Å; Q13-C15 PolarHBondContact O-N 3.06Å; Q13-L16 PolarHBondContact O-N 2.82Å; Q13-Y17 WeakPolarHBondContact O-CB 3.46Å; Q13-Y17 PolarHBondContact O-N 3.38Å |
| 14 | S | 63.2 | Low | 60 | Low | 26 Ų | 26 | 92.7 Ų | 92.7 | 18% | 0.182 | 49% | 0.49 | C | S | . | . | H | α-helix | trans | -62.5 | -38.4 | 174.7 | -52.7 | 0 | 0 | 0 | 0 | 111.7 | L10 L11 L12 Y17 C18 | L10-S14 PolarHBondContact O-N 2.81Å; L10-S14 PolarHBondContact O-OG 3.35Å; L11-S14 VanDerWaalsContact O-CB 3.32Å; L11-S14 WeakPolarHBondContact O-CB 3.38Å; L11-S14 PolarHBondContact O-N 3.23Å; L11-S14 VanDerWaalsContact O-N 3.13Å; L12-S14 VanDerWaalsContact C-N 3.3Å; L12-S14 PolarHBondContact O-N 2.87Å; S14-Y17 PolarHBondContact O-N 3.29Å; S14-C18 PolarHBondContact O-N 3.29Å |
| 15 | C | 64.1 | Low | 59.7 | Low | 23 Ų | 23 | 90.1 Ų | 90.1 | 16% | 0.155 | 49% | 0.489 | C | S | . | . | H | α-helix | trans | -65.2 | -36.9 | 175.1 | -60.2 | 0 | 0 | 0 | 0 | 112.3 | L11 L12 Q13 N44 C47 | L11-C15 PolarHBondContact O-N 2.91Å; L11-C15 PolarHBondContact O-SG 3.2Å; L12-C15 WeakPolarHBondContact O-CB 3.43Å; L12-C15 PolarHBondContact O-N 3.22Å; Q13-C15 VanDerWaalsContact C-N 3.29Å; Q13-C15 PolarHBondContact O-N 3.06Å; C15-N44 WeakPolarHBondContact CA-OD1 3.46Å; C15-N44 PolarHBondContact N-OD1 3.49Å; C15-N44 PolarHBondContact SG-OD1 3.47Å; C15-C47 HydrophobicContact CB-CB 4.04Å; C15-C47 WeakPolarHBondContact CB-SG 3.33Å; C15-C47 WeakPolarHBondContact SG-CB 3.24Å; C15-C47 CovalentContact SG-SG 2.07Å; C15-C47 PolarHBondContact SG-SG 2.9Å |
| 16 | L | 59.7 | Low | 59.4 | Low | 129 Ų | 129 | 87.8 Ų | 87.8 | 68% | 0.675 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -72.1 | -42.6 | 173.8 | -123.1 | 93.5 | 0 | 0 | 0 | 112.8 | L12 Q13 C18 S19 S20 | L12-L16 PolarHBondContact O-N 2.88Å; Q13-L16 PolarHBondContact O-N 2.82Å; L16-C18 VanDerWaalsContact C-N 3.32Å; L16-C18 PolarHBondContact O-N 3.44Å; L16-S19 PolarHBondContact O-N 2.89Å; L16-S20 PolarHBondContact O-N 3.42Å; L16-S20 VanDerWaalsContact O-N 3.11Å |
| 17 | Y | 59.2 | Low | 58.8 | Low | 166 Ų | 166 | 88.5 Ų | 88.5 | 65% | 0.651 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -62.4 | -39.3 | -175 | -147 | -90.7 | 0 | 0 | 0 | 111.6 | Q13 S14 S20 D21 | Q13-Y17 WeakPolarHBondContact O-CB 3.46Å; Q13-Y17 PolarHBondContact O-N 3.38Å; S14-Y17 PolarHBondContact O-N 3.29Å; Y17-S20 PolarHBondContact O-N 2.9Å; Y17-D21 WeakPolarHBondContact CD1-OD2 3.32Å; Y17-D21 PolarHBondContact O-N 3.49Å |
| 18 | C | 56.7 | Low | 58.1 | Low | 32 Ų | 32 | 89.2 Ų | 89.2 | 22% | 0.216 | 52% | 0.515 | C | S | . | . | H | α-helix | trans | -71.6 | -31.9 | 178.8 | -168.5 | 0 | 0 | 0 | 0 | 114.1 | S14 L16 S20 N22 N44 | S14-C18 PolarHBondContact O-N 3.29Å; L16-C18 VanDerWaalsContact C-N 3.32Å; L16-C18 PolarHBondContact O-N 3.44Å; C18-S20 VanDerWaalsContact C-N 3.34Å; C18-N22 PolarHBondContact O-N 3.04Å; C18-N44 WeakPolarHBondContact CB-ND2 3.33Å |
| 19 | S | 56.7 | Low | 57.4 | Low | 83 Ų | 83 | 94 Ų | 94 | 58% | 0.58 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -66.4 | -42.2 | 171.1 | -74.6 | 0 | 0 | 0 | 0 | 110.5 | L16 N22 E23 | L16-S19 PolarHBondContact O-N 2.89Å; S19-N22 PolarHBondContact O-N 3.25Å; S19-E23 PolarHBondContact O-N 3.46Å |
| 20 | S | 55.5 | Low | 57 | Low | 55 Ų | 55 | 98 Ų | 98 | 39% | 0.385 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -65.3 | -40.2 | 178.5 | -166.8 | 0 | 0 | 0 | 0 | 112.3 | L16 Y17 C18 N22 E23 N24 | L16-S20 PolarHBondContact O-N 3.42Å; L16-S20 VanDerWaalsContact O-N 3.11Å; Y17-S20 PolarHBondContact O-N 2.9Å; C18-S20 VanDerWaalsContact C-N 3.34Å; S20-N22 VanDerWaalsContact C-N 3.27Å; S20-N22 PolarHBondContact O-N 3.13Å; S20-E23 PolarHBondContact O-N 2.9Å; S20-N24 VanDerWaalsContact O-CB 3.29Å; S20-N24 WeakPolarHBondContact O-CB 3.02Å; S20-N24 PolarHBondContact O-N 3.22Å |
| 21 | D | 52.3 | Low | 56.4 | Low | 74 Ų | 74 | 101.9 Ų | 101.9 | 40% | 0.396 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -68.2 | -26.6 | 177.1 | -76.5 | -28.6 | 0 | 0 | 0 | 112.3 | Y17 N24 A25 | Y17-D21 WeakPolarHBondContact CD1-OD2 3.32Å; Y17-D21 PolarHBondContact O-N 3.49Å; D21-N24 CarbonylContact O-C 3.59Å; D21-N24 PolarHBondContact O-N 3.45Å; D21-A25 WeakPolarHBondContact O-CA 3.25Å; D21-A25 WeakPolarHBondContact O-CB 3.46Å; D21-A25 PolarHBondContact O-N 3.43Å |
| 22 | N | 51.9 | Low | 56 | Low | 132 Ų | 132 | 103.2 Ų | 103.2 | 71% | 0.706 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -76.7 | -27.3 | 174.8 | -142.9 | 39.8 | 0 | 0 | 0 | 112.2 | C18 S19 S20 | C18-N22 PolarHBondContact O-N 3.04Å; S19-N22 PolarHBondContact O-N 3.25Å; S20-N22 VanDerWaalsContact C-N 3.27Å; S20-N22 PolarHBondContact O-N 3.13Å |
| 23 | E | 51.1 | Low | 55.8 | Low | 169 Ų | 169 | 102.9 Ų | 102.9 | 79% | 0.79 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -76.5 | -37.6 | 166.1 | -81.9 | -170.1 | 105 | 0 | 0 | 112.4 | S19 S20 | S19-E23 PolarHBondContact O-N 3.46Å; S20-E23 PolarHBondContact O-N 2.9Å |
| 24 | N | 51.4 | Low | 56.2 | Low | 94 Ų | 94 | 101 Ų | 101 | 50% | 0.503 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -95.1 | 2 | -175.1 | -79.5 | 27.4 | 0 | 0 | 0 | 114.8 | S20 D21 G26 T27 | S20-N24 VanDerWaalsContact O-CB 3.29Å; S20-N24 WeakPolarHBondContact O-CB 3.02Å; S20-N24 PolarHBondContact O-N 3.22Å; D21-N24 CarbonylContact O-C 3.59Å; D21-N24 PolarHBondContact O-N 3.45Å; N24-G26 PolarHBondContact O-N 2.9Å; N24-T27 PolarHBondContact O-N 3.43Å; N24-T27 VanDerWaalsContact O-N 3.07Å |
| 25 | A | 52.8 | Low | 56.8 | Low | 82 Ų | 82 | 106.4 Ų | 106.4 | 68% | 0.678 | 60% | 0.601 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.6 | 1.1 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | D21 | D21-A25 WeakPolarHBondContact O-CA 3.25Å; D21-A25 WeakPolarHBondContact O-CB 3.46Å; D21-A25 PolarHBondContact O-N 3.43Å |
| 26 | G | 54.2 | Low | 57 | Low | 69 Ų | 69 | 111.6 Ų | 111.6 | 71% | 0.711 | 62% | 0.617 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.2 | -20.3 | 166.2 | 0 | 0 | 0 | 0 | 0 | 115.9 | N24 | N24-G26 PolarHBondContact O-N 2.9Š|
| 27 | T | 51.6 | Low | 57.4 | Low | 113 Ų | 113 | 110 Ų | 110 | 69% | 0.693 | 61% | 0.605 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -138.5 | -14 | -164.3 | 48.1 | 0 | 0 | 0 | 0 | 121.7 | N24 | N24-T27 PolarHBondContact O-N 3.43Å; N24-T27 VanDerWaalsContact O-N 3.07Å |
| 28 | T | 54.5 | Low | 58 | Low | 127 Ų | 127 | 111.2 Ų | 111.2 | 78% | 0.779 | 61% | 0.609 | S | S | * | * | trans | -144.4 | 117.4 | 178.1 | 41.8 | 0 | 0 | 0 | 0 | 115.3 | E30 | T28-E30 PolarHBondContact O-N 2.98Š| ||
| 29 | T | 50.8 | Low | 59 | Low | 135 Ų | 135 | 113.9 Ų | 113.9 | 83% | 0.828 | 62% | 0.616 | S | S | * | * | trans | -77.6 | 62.6 | -169.9 | -32.6 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 30 | E | 55.1 | Low | 59.7 | Low | 182 Ų | 182 | 113.2 Ų | 113.2 | 85% | 0.85 | 60% | 0.603 | S | S | * | * | trans | -106 | 91.6 | 158.8 | -69.8 | -166.1 | 166 | 0 | 0 | 107.3 | T28 P32 | T28-E30 PolarHBondContact O-N 2.98Å; E30-P32 WeakPolarHBondContact O-CD 3.43Å | ||
| 31 | K | 52 | Low | 60.4 | Low | 185 Ų | 185 | 113.8 Ų | 113.8 | 80% | 0.804 | 60% | 0.602 | S | S | * | * | trans | -61.6 | 108.4 | 171.4 | -75.9 | 174.2 | 178 | 170.9 | 0 | 106.7 | T33 | K31-T33 PolarHBondContact O-N 3.1Å; K31-T33 VanDerWaalsContact O-N 3.12Å | ||
| 32 | P | 55.7 | Low | 61.5 | Low | 64 Ų | 64 | 116.2 Ų | 116.2 | 42% | 0.416 | 61% | 0.609 | S | S | . | * | trans | -55.4 | 128.6 | 162 | 25.2 | -32.8 | 0 | 0 | 0 | 105.7 | E30 S34 W36 K37 | E30-P32 WeakPolarHBondContact O-CD 3.43Å; P32-S34 PolarHBondContact O-N 3.12Å; P32-W36 HydrophobicContact CB-CB 4.36Å; P32-K37 HydrophobicContact CG-CB 4.31Å | ||
| 33 | T | 62.2 | Low | 62.7 | Low | 86 Ų | 86 | 111.8 Ų | 111.8 | 53% | 0.528 | 58% | 0.584 | S | S | . | * | trans | -49 | 139.5 | 179.1 | 61.7 | 0 | 0 | 0 | 0 | 108.1 | K31 F35 W36 K37 | K31-T33 PolarHBondContact O-N 3.1Å; K31-T33 VanDerWaalsContact O-N 3.12Å; T33-F35 CarbonylContact O-C 3.54Å; T33-F35 PolarHBondContact O-N 2.07Å; T33-W36 PolarHBondContact O-N 3.39Å; T33-K37 PolarHBondContact O-N 2.88Å | ||
| 34 | S | 70.6 | Confident | 63.6 | Low | 95 Ų | 95 | 104.8 Ų | 104.8 | 66% | 0.664 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -48.1 | -28.5 | -171.8 | 51.9 | 0 | 0 | 0 | 0 | 114.5 | P32 R38 | P32-S34 PolarHBondContact O-N 3.12Å; S34-R38 WeakPolarHBondContact O-CG 3.33Å; S34-R38 PolarHBondContact O-N 2.67Å |
| 35 | F | 75.1 | Confident | 64.8 | Low | 140 Ų | 140 | 106.2 Ų | 106.2 | 61% | 0.614 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -63.9 | -52.4 | 171.9 | -177 | -97.6 | 0 | 0 | 0 | 113.5 | T33 K37 R38 F39 | T33-F35 CarbonylContact O-C 3.54Å; T33-F35 PolarHBondContact O-N 2.07Å; F35-K37 VanDerWaalsContact C-N 3.31Å; F35-K37 PolarHBondContact O-N 3.18Å; F35-R38 PolarHBondContact O-N 3.38Å; F35-F39 PolarHBondContact O-N 3.18Å |
| 36 | W | 67.6 | Low | 66 | Low | 131 Ų | 131 | 105.9 Ų | 105.9 | 50% | 0.496 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -60.5 | -40.7 | 178.8 | -78 | 120.7 | 0 | 0 | 0 | 111.6 | P32 T33 R38 F39 F40 | P32-W36 HydrophobicContact CB-CB 4.36Å; T33-W36 PolarHBondContact O-N 3.39Å; W36-R38 PolarHBondContact O-N 2.96Å; W36-F39 HydrophobicContact CE3-CD1 4.16Å; W36-F39 HydrophobicContact CZ3-CD1 4.11Å; W36-F39 HydrophobicContact CZ3-CE1 4.25Å; W36-F39 WeakPolarHBondContact O-CB 3.13Å; W36-F39 PolarHBondContact O-N 2.9Å; W36-F40 HydrophobicContact CB-CD2 4.34Å; W36-F40 HydrophobicContact CB-CE2 4.16Å; W36-F40 AromaticContact CE3-CE2 3.99Å; W36-F40 HydrophobicContact CE3-CE2 3.99Å; W36-F40 HydrophobicContact CE3-CZ 4.2Å; W36-F40 WeakPolarHBondContact O-CD2 3.44Å; W36-F40 PolarHBondContact O-N 3.27Å |
| 37 | K | 69.6 | Low | 66.8 | Low | 97 Ų | 97 | 104 Ų | 104 | 42% | 0.422 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -59 | -48.1 | 175.4 | -176.4 | 155.9 | -178 | 136 | 0 | 111.6 | P32 T33 F35 F39 F40 D41 | P32-K37 HydrophobicContact CG-CB 4.31Å; T33-K37 PolarHBondContact O-N 2.88Å; F35-K37 VanDerWaalsContact C-N 3.31Å; F35-K37 PolarHBondContact O-N 3.18Å; K37-F39 VanDerWaalsContact C-N 3.31Å; K37-F39 PolarHBondContact O-N 3.4Å; K37-F40 PolarHBondContact O-N 2.81Å; K37-D41 WeakPolarHBondContact O-CB 3.17Å; K37-D41 PolarHBondContact O-N 3.35Å |
| 38 | R | 70.6 | Confident | 67.9 | Low | 191 Ų | 191 | 102.5 Ų | 102.5 | 72% | 0.721 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -61.3 | -38.4 | 176 | -72.8 | 177.1 | -179.5 | -170.4 | 0.5 | 113 | S34 F35 W36 F42 | S34-R38 WeakPolarHBondContact O-CG 3.33Å; S34-R38 PolarHBondContact O-N 2.67Å; F35-R38 PolarHBondContact O-N 3.38Å; W36-R38 PolarHBondContact O-N 2.96Å; R38-F42 WeakPolarHBondContact O-CB 3.45Å; R38-F42 PolarHBondContact O-N 2.84Å |
| 39 | F | 77.9 | Confident | 69 | Low | 87 Ų | 87 | 100.5 Ų | 100.5 | 38% | 0.382 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.7 | -50.5 | 176.4 | -175.4 | -94.7 | 0 | 0 | 0 | 110.4 | F35 W36 K37 F42 F43 | F35-F39 PolarHBondContact O-N 3.18Å; W36-F39 HydrophobicContact CE3-CD1 4.16Å; W36-F39 HydrophobicContact CZ3-CD1 4.11Å; W36-F39 HydrophobicContact CZ3-CE1 4.25Å; W36-F39 WeakPolarHBondContact O-CB 3.13Å; W36-F39 PolarHBondContact O-N 2.9Å; K37-F39 VanDerWaalsContact C-N 3.31Å; K37-F39 PolarHBondContact O-N 3.4Å; F39-F42 WeakPolarHBondContact O-CB 3.36Å; F39-F42 PolarHBondContact O-N 2.95Å; F39-F43 AromaticContact CD1-CD2 3.85Å; F39-F43 HydrophobicContact CD1-CD2 3.85Å; F39-F43 AromaticContact CD1-CE2 3.81Å; F39-F43 HydrophobicContact CD1-CE2 3.81Å; F39-F43 AromaticContact CD2-CE2 3.91Å; F39-F43 HydrophobicContact CD2-CE2 3.91Å; F39-F43 AromaticContact CE1-CD2 3.7Å; F39-F43 HydrophobicContact CE1-CD2 3.7Å; F39-F43 AromaticContact CE1-CE2 3.34Å; F39-F43 HydrophobicContact CE1-CE2 3.34Å; F39-F43 HydrophobicContact CE1-CZ 4.3Å; F39-F43 HydrophobicContact CE2-CD2 4.43Å; F39-F43 AromaticContact CE2-CE2 3.48Å; F39-F43 HydrophobicContact CE2-CE2 3.48Å; F39-F43 VanDerWaalsContact CE2-CE2 3.48Å; F39-F43 HydrophobicContact CE2-CZ 4.23Å; F39-F43 HydrophobicContact CG-CD2 4.28Å; F39-F43 HydrophobicContact CG-CE2 4.09Å; F39-F43 HydrophobicContact CZ-CD2 4.03Å; F39-F43 AromaticContact CZ-CE2 3.19Å; F39-F43 HydrophobicContact CZ-CE2 3.19Å; F39-F43 AromaticContact CZ-CZ 3.87Å; F39-F43 HydrophobicContact CZ-CZ 3.87Å; F39-F43 WeakPolarHBondContact O-CD2 3.32Å; F39-F43 PolarHBondContact O-N 2.79Å; F39-F43 VanDerWaalsContact O-N 3.12Å |
| 40 | F | 72.6 | Confident | 70.1 | Confident | 70 Ų | 70 | 99.2 Ų | 99.2 | 31% | 0.307 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -62.8 | -43.6 | 176.6 | -70.1 | -58.5 | 0 | 0 | 0 | 112.3 | W36 K37 F42 F43 N44 | W36-F40 HydrophobicContact CB-CD2 4.34Å; W36-F40 HydrophobicContact CB-CE2 4.16Å; W36-F40 AromaticContact CE3-CE2 3.99Å; W36-F40 HydrophobicContact CE3-CE2 3.99Å; W36-F40 HydrophobicContact CE3-CZ 4.2Å; W36-F40 WeakPolarHBondContact O-CD2 3.44Å; W36-F40 PolarHBondContact O-N 3.27Å; K37-F40 PolarHBondContact O-N 2.81Å; F40-F42 VanDerWaalsContact C-N 3.27Å; F40-F42 PolarHBondContact O-N 2.93Å; F40-F43 PolarHBondContact O-N 2.77Å; F40-F43 VanDerWaalsContact O-N 3.17Å; F40-N44 WeakPolarHBondContact O-CB 3.3Å; F40-N44 PolarHBondContact O-N 2.92Å; F40-N44 PolarHBondContact O-ND2 3.38Å; F40-N44 PolarHBondContact O-OD1 3.27Å |
| 41 | D | 70 | Confident | 71 | Confident | 67 Ų | 67 | 97 Ų | 97 | 36% | 0.358 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -57.6 | -39.3 | 175.3 | -70 | -23.2 | 0 | 0 | 0 | 111.8 | K37 N44 F45 | K37-D41 WeakPolarHBondContact O-CB 3.17Å; K37-D41 PolarHBondContact O-N 3.35Å; D41-N44 PolarHBondContact O-N 3.11Å; D41-F45 PolarHBondContact O-N 3.29Å |
| 42 | F | 75.3 | Confident | 72.2 | Confident | 124 Ų | 124 | 91.4 Ų | 91.4 | 54% | 0.544 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -64.7 | -47.1 | 175.6 | -180 | -99.2 | 0 | 0 | 0 | 112 | R38 F39 F40 N44 F45 I46 | R38-F42 WeakPolarHBondContact O-CB 3.45Å; R38-F42 PolarHBondContact O-N 2.84Å; F39-F42 WeakPolarHBondContact O-CB 3.36Å; F39-F42 PolarHBondContact O-N 2.95Å; F40-F42 VanDerWaalsContact C-N 3.27Å; F40-F42 PolarHBondContact O-N 2.93Å; F42-N44 VanDerWaalsContact C-N 3.28Å; F42-N44 PolarHBondContact O-N 3.29Å; F42-F45 WeakPolarHBondContact O-CB 3.16Å; F42-F45 PolarHBondContact O-N 3.43Å; F42-I46 HydrophobicContact CD1-CG1 4.47Å; F42-I46 HydrophobicContact CE1-CG1 4.09Å; F42-I46 HydrophobicContact CZ-CD1 4.24Å; F42-I46 HydrophobicContact CZ-CG1 4.17Å; F42-I46 WeakPolarHBondContact O-CG1 3.4Å; F42-I46 PolarHBondContact O-N 3.18Å; F42-I46 VanDerWaalsContact O-N 3.07Å |
| 43 | F | 76.3 | Confident | 73.1 | Confident | 40 Ų | 40 | 95.7 Ų | 95.7 | 18% | 0.175 | 46% | 0.458 | C | S | . | . | H | α-helix | trans | -64.6 | -34.3 | 175.5 | -77.4 | -76.8 | 0 | 0 | 0 | 112.4 | F7 L11 F39 F40 F45 I46 C47 | F7-F43 HydrophobicContact CZ-CE1 4.38Å; L11-F43 HydrophobicContact CD1-CD1 3.86Å; L11-F43 HydrophobicContact CD1-CE1 4.18Å; L11-F43 HydrophobicContact CD2-CB 4.07Å; L11-F43 HydrophobicContact CD2-CD1 3.2Å; L11-F43 HydrophobicContact CD2-CD2 4.41Å; L11-F43 HydrophobicContact CD2-CE1 3.67Å; L11-F43 HydrophobicContact CD2-CG 3.63Å; L11-F43 HydrophobicContact CD2-CZ 4.49Å; L11-F43 HydrophobicContact CG-CD1 4.13Å; F39-F43 AromaticContact CD1-CD2 3.85Å; F39-F43 HydrophobicContact CD1-CD2 3.85Å; F39-F43 AromaticContact CD1-CE2 3.81Å; F39-F43 HydrophobicContact CD1-CE2 3.81Å; F39-F43 AromaticContact CD2-CE2 3.91Å; F39-F43 HydrophobicContact CD2-CE2 3.91Å; F39-F43 AromaticContact CE1-CD2 3.7Å; F39-F43 HydrophobicContact CE1-CD2 3.7Å; F39-F43 AromaticContact CE1-CE2 3.34Å; F39-F43 HydrophobicContact CE1-CE2 3.34Å; F39-F43 HydrophobicContact CE1-CZ 4.3Å; F39-F43 HydrophobicContact CE2-CD2 4.43Å; F39-F43 AromaticContact CE2-CE2 3.48Å; F39-F43 HydrophobicContact CE2-CE2 3.48Å; F39-F43 VanDerWaalsContact CE2-CE2 3.48Å; F39-F43 HydrophobicContact CE2-CZ 4.23Å; F39-F43 HydrophobicContact CG-CD2 4.28Å; F39-F43 HydrophobicContact CG-CE2 4.09Å; F39-F43 HydrophobicContact CZ-CD2 4.03Å; F39-F43 AromaticContact CZ-CE2 3.19Å; F39-F43 HydrophobicContact CZ-CE2 3.19Å; F39-F43 AromaticContact CZ-CZ 3.87Å; F39-F43 HydrophobicContact CZ-CZ 3.87Å; F39-F43 WeakPolarHBondContact O-CD2 3.32Å; F39-F43 PolarHBondContact O-N 2.79Å; F39-F43 VanDerWaalsContact O-N 3.12Å; F40-F43 PolarHBondContact O-N 2.77Å; F40-F43 VanDerWaalsContact O-N 3.17Å; F43-F45 VanDerWaalsContact C-N 3.34Å; F43-I46 PolarHBondContact O-N 3.21Å; F43-C47 WeakPolarHBondContact O-CB 3.43Å; F43-C47 PolarHBondContact O-N 2.83Å |
| 44 | N | 70.5 | Confident | 73.8 | Confident | 22 Ų | 22 | 94.1 Ų | 94.1 | 12% | 0.118 | 45% | 0.45 | C | S | . | . | H | α-helix | trans | -64.4 | -39.4 | 174.8 | -63.9 | -14.1 | 0 | 0 | 0 | 112 | C15 C18 F40 D41 F42 C47 T48 | C15-N44 WeakPolarHBondContact CA-OD1 3.46Å; C15-N44 PolarHBondContact N-OD1 3.49Å; C15-N44 PolarHBondContact SG-OD1 3.47Å; C18-N44 WeakPolarHBondContact CB-ND2 3.33Å; F40-N44 WeakPolarHBondContact O-CB 3.3Å; F40-N44 PolarHBondContact O-N 2.92Å; F40-N44 PolarHBondContact O-ND2 3.38Å; F40-N44 PolarHBondContact O-OD1 3.27Å; D41-N44 PolarHBondContact O-N 3.11Å; F42-N44 VanDerWaalsContact C-N 3.28Å; F42-N44 PolarHBondContact O-N 3.29Å; N44-C47 WeakPolarHBondContact O-CB 3.02Å; N44-C47 PolarHBondContact O-N 3.23Å; N44-T48 WeakPolarHBondContact O-CB 3.48Å; N44-T48 PolarHBondContact O-N 3.17Å; N44-T48 PolarHBondContact O-OG1 3.07Å |
| 45 | F | 75.9 | Confident | 74.1 | Confident | 123 Ų | 123 | 93.8 Ų | 93.8 | 54% | 0.539 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -63 | -45.5 | 173.4 | -179.7 | -105.8 | 0 | 0 | 0 | 111.4 | D41 F42 F43 T48 L49 | D41-F45 PolarHBondContact O-N 3.29Å; F42-F45 WeakPolarHBondContact O-CB 3.16Å; F42-F45 PolarHBondContact O-N 3.43Å; F43-F45 VanDerWaalsContact C-N 3.34Å; F45-T48 PolarHBondContact O-N 3.27Å; F45-L49 HydrophobicContact CD1-CD1 3.9Å; F45-L49 HydrophobicContact CE1-CD1 3.37Å; F45-L49 HydrophobicContact CE1-CG 4.15Å; F45-L49 HydrophobicContact CE2-CG 4.48Å; F45-L49 HydrophobicContact CZ-CD1 3.73Å; F45-L49 HydrophobicContact CZ-CD2 4.39Å; F45-L49 HydrophobicContact CZ-CG 4.12Å; F45-L49 WeakPolarHBondContact O-CG 3.45Å; F45-L49 PolarHBondContact O-N 3.24Å |
| 46 | I | 78.2 | Confident | 74.3 | Confident | 75 Ų | 75 | 90.6 Ų | 90.6 | 39% | 0.385 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -64.8 | -40.2 | 176.2 | -59.2 | -59.9 | 0 | 0 | 0 | 111.6 | F42 F43 L49 N50 | F42-I46 HydrophobicContact CD1-CG1 4.47Å; F42-I46 HydrophobicContact CE1-CG1 4.09Å; F42-I46 HydrophobicContact CZ-CD1 4.24Å; F42-I46 HydrophobicContact CZ-CG1 4.17Å; F42-I46 WeakPolarHBondContact O-CG1 3.4Å; F42-I46 PolarHBondContact O-N 3.18Å; F42-I46 VanDerWaalsContact O-N 3.07Å; F43-I46 PolarHBondContact O-N 3.21Å; I46-L49 HydrophobicContact CD1-CD1 4.46Å; I46-L49 PolarHBondContact O-N 2.93Å; I46-N50 WeakPolarHBondContact O-CB 3.22Å; I46-N50 PolarHBondContact O-N 3.37Å |
| 47 | C | 70.8 | Confident | 74.8 | Confident | 29 Ų | 29 | 88.5 Ų | 88.5 | 20% | 0.196 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -54.1 | -53 | 171.2 | -89.1 | 0 | 0 | 0 | 0 | 110.5 | C15 F43 N44 L49 N50 Q51 | C15-C47 HydrophobicContact CB-CB 4.04Å; C15-C47 WeakPolarHBondContact CB-SG 3.33Å; C15-C47 WeakPolarHBondContact SG-CB 3.24Å; C15-C47 CovalentContact SG-SG 2.07Å; C15-C47 PolarHBondContact SG-SG 2.9Å; F43-C47 WeakPolarHBondContact O-CB 3.43Å; F43-C47 PolarHBondContact O-N 2.83Å; N44-C47 WeakPolarHBondContact O-CB 3.02Å; N44-C47 PolarHBondContact O-N 3.23Å; C47-L49 VanDerWaalsContact C-N 3.31Å; C47-L49 PolarHBondContact O-N 3.42Å; C47-N50 PolarHBondContact O-N 3.3Å; C47-Q51 WeakPolarHBondContact O-CB 3.42Å; C47-Q51 PolarHBondContact O-N 2.84Å |
| 48 | T | 74.8 | Confident | 75.2 | Confident | 82 Ų | 82 | 90.4 Ų | 90.4 | 50% | 0.503 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -60.8 | -42.2 | -178.1 | -58.1 | 0 | 0 | 0 | 0 | 110.8 | N44 F45 T52 | N44-T48 WeakPolarHBondContact O-CB 3.48Å; N44-T48 PolarHBondContact O-N 3.17Å; N44-T48 PolarHBondContact O-OG1 3.07Å; F45-T48 PolarHBondContact O-N 3.27Å; T48-T52 WeakPolarHBondContact O-CB 3.46Å; T48-T52 PolarHBondContact O-N 3.2Å; T48-T52 PolarHBondContact O-OG1 3.41Å |
| 49 | L | 77.5 | Confident | 75.5 | Confident | 86 Ų | 86 | 89.5 Ų | 89.5 | 45% | 0.45 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -63.2 | -44.4 | 175.5 | -76.5 | 177.4 | 0 | 0 | 0 | 112.2 | F45 I46 C47 T52 W53 | F45-L49 HydrophobicContact CD1-CD1 3.9Å; F45-L49 HydrophobicContact CE1-CD1 3.37Å; F45-L49 HydrophobicContact CE1-CG 4.15Å; F45-L49 HydrophobicContact CE2-CG 4.48Å; F45-L49 HydrophobicContact CZ-CD1 3.73Å; F45-L49 HydrophobicContact CZ-CD2 4.39Å; F45-L49 HydrophobicContact CZ-CG 4.12Å; F45-L49 WeakPolarHBondContact O-CG 3.45Å; F45-L49 PolarHBondContact O-N 3.24Å; I46-L49 HydrophobicContact CD1-CD1 4.46Å; I46-L49 PolarHBondContact O-N 2.93Å; C47-L49 VanDerWaalsContact C-N 3.31Å; C47-L49 PolarHBondContact O-N 3.42Å; L49-T52 PolarHBondContact O-N 2.78Å; L49-W53 VanDerWaalsContact O-CB 3.24Å; L49-W53 WeakPolarHBondContact O-CB 3.47Å; L49-W53 PolarHBondContact O-N 3.41Å |
| 50 | N | 75.1 | Confident | 75.8 | Confident | 108 Ų | 108 | 91.9 Ų | 91.9 | 58% | 0.578 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -67.9 | -39.8 | -179.3 | -166.5 | 34.2 | 0 | 0 | 0 | 111.7 | I46 C47 W53 S54 | I46-N50 WeakPolarHBondContact O-CB 3.22Å; I46-N50 PolarHBondContact O-N 3.37Å; C47-N50 PolarHBondContact O-N 3.3Å; N50-W53 PolarHBondContact O-N 3.12Å; N50-S54 WeakPolarHBondContact O-CB 3.29Å; N50-S54 PolarHBondContact O-N 3.5Å |
| 51 | Q | 73.2 | Confident | 75.8 | Confident | 135 Ų | 135 | 91.4 Ų | 91.4 | 63% | 0.631 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -66.6 | -43.3 | 174.3 | -169.8 | 174.6 | -1.6 | 0 | 0 | 111.1 | C47 W53 S54 T55 | C47-Q51 WeakPolarHBondContact O-CB 3.42Å; C47-Q51 PolarHBondContact O-N 2.84Å; Q51-W53 PolarHBondContact O-N 2.78Å; Q51-S54 WeakPolarHBondContact O-CB 3.12Å; Q51-S54 PolarHBondContact O-N 3.24Å; Q51-T55 PolarHBondContact O-N 3.28Å; Q51-T55 PolarHBondContact O-OG1 2.89Å; Q51-T55 VanDerWaalsContact O-OG1 3.06Å |
| 52 | T | 76.4 | Confident | 75.8 | Confident | 68 Ų | 68 | 93.1 Ų | 93.1 | 42% | 0.417 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -61.2 | -44.5 | 175 | -59.7 | 0 | 0 | 0 | 0 | 111 | T48 L49 S54 T55 I56 | T48-T52 WeakPolarHBondContact O-CB 3.46Å; T48-T52 PolarHBondContact O-N 3.2Å; T48-T52 PolarHBondContact O-OG1 3.41Å; L49-T52 PolarHBondContact O-N 2.78Å; T52-S54 VanDerWaalsContact C-N 3.32Å; T52-S54 PolarHBondContact O-N 3.24Å; T52-T55 PolarHBondContact O-N 3.4Å; T52-I56 HydrophobicContact CG2-CD1 3.85Å; T52-I56 HydrophobicContact CG2-CG1 4.4Å; T52-I56 WeakPolarHBondContact O-CB 3.46Å; T52-I56 VanDerWaalsContact O-CG1 3.25Å; T52-I56 WeakPolarHBondContact O-CG1 3.37Å; T52-I56 PolarHBondContact O-N 3.46Å |
| 53 | W | 75.4 | Confident | 75.1 | Confident | 154 Ų | 154 | 92 Ų | 92 | 58% | 0.583 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -60.8 | -41.9 | 175.1 | -176.1 | -109.8 | 0 | 0 | 0 | 111.5 | L49 N50 Q51 I56 R57 | L49-W53 VanDerWaalsContact O-CB 3.24Å; L49-W53 WeakPolarHBondContact O-CB 3.47Å; L49-W53 PolarHBondContact O-N 3.41Å; N50-W53 PolarHBondContact O-N 3.12Å; Q51-W53 PolarHBondContact O-N 2.78Å; W53-I56 PolarHBondContact O-N 2.8Å; W53-R57 WeakPolarHBondContact O-CG 3.43Å; W53-R57 PolarHBondContact O-N 3.28Å |
| 54 | S | 76.6 | Confident | 74 | Confident | 53 Ų | 53 | 100.5 Ų | 100.5 | 37% | 0.371 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -63 | -43.1 | 174.6 | -155 | 0 | 0 | 0 | 0 | 112.5 | N50 Q51 T52 R57 N58 | N50-S54 WeakPolarHBondContact O-CB 3.29Å; N50-S54 PolarHBondContact O-N 3.5Å; Q51-S54 WeakPolarHBondContact O-CB 3.12Å; Q51-S54 PolarHBondContact O-N 3.24Å; T52-S54 VanDerWaalsContact C-N 3.32Å; T52-S54 PolarHBondContact O-N 3.24Å; S54-R57 PolarHBondContact O-N 2.89Å; S54-R57 PolarHBondContact OG-NH2 3.21Å; S54-N58 WeakPolarHBondContact O-CB 2.93Å; S54-N58 PolarHBondContact O-N 3.38Å |
| 55 | T | 76.9 | Confident | 74.2 | Confident | 88 Ų | 88 | 104.5 Ų | 104.5 | 54% | 0.54 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -63.8 | -42.7 | 175.3 | -58.1 | 0 | 0 | 0 | 0 | 111.6 | Q51 T52 N58 F59 | Q51-T55 PolarHBondContact O-N 3.28Å; Q51-T55 PolarHBondContact O-OG1 2.89Å; Q51-T55 VanDerWaalsContact O-OG1 3.06Å; T52-T55 PolarHBondContact O-N 3.4Å; T55-N58 PolarHBondContact O-N 2.97Å; T55-F59 VanDerWaalsContact O-CB 3.29Å; T55-F59 WeakPolarHBondContact O-CB 3.36Å; T55-F59 PolarHBondContact O-N 3.21Å |
| 56 | I | 78.5 | Confident | 74.1 | Confident | 73 Ų | 73 | 103.5 Ų | 103.5 | 37% | 0.374 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -60.4 | -48.2 | 175.1 | -70.8 | 168 | 0 | 0 | 0 | 109.7 | T52 W53 N58 F59 F60 | T52-I56 HydrophobicContact CG2-CD1 3.85Å; T52-I56 HydrophobicContact CG2-CG1 4.4Å; T52-I56 WeakPolarHBondContact O-CB 3.46Å; T52-I56 VanDerWaalsContact O-CG1 3.25Å; T52-I56 WeakPolarHBondContact O-CG1 3.37Å; T52-I56 PolarHBondContact O-N 3.46Å; W53-I56 PolarHBondContact O-N 2.8Å; I56-N58 VanDerWaalsContact C-N 3.32Å; I56-N58 PolarHBondContact O-N 3.23Å; I56-F59 PolarHBondContact O-N 2.94Å; I56-F60 HydrophobicContact CG2-CD2 3.75Å; I56-F60 HydrophobicContact CG2-CE2 4Å; I56-F60 VanDerWaalsContact O-CD2 3.3Å; I56-F60 WeakPolarHBondContact O-CD2 3.39Å; I56-F60 PolarHBondContact O-N 3.07Å |
| 57 | R | 79.9 | Confident | 73.9 | Confident | 87 Ų | 87 | 105.1 Ų | 105.1 | 33% | 0.328 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -57.8 | -44.9 | 176.7 | -74.7 | -175.6 | -56 | 172.7 | 7.8 | 112.2 | W53 S54 F60 G61 I62 | W53-R57 WeakPolarHBondContact O-CG 3.43Å; W53-R57 PolarHBondContact O-N 3.28Å; S54-R57 PolarHBondContact O-N 2.89Å; S54-R57 PolarHBondContact OG-NH2 3.21Å; R57-F60 PolarHBondContact O-N 3.25Å; R57-G61 CarbonylContact O-C 3.59Å; R57-G61 PolarHBondContact O-N 2.82Å; R57-I62 PolarHBondContact O-N 3.31Å |
| 58 | N | 76.7 | Confident | 74 | Confident | 137 Ų | 137 | 109.5 Ų | 109.5 | 73% | 0.733 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -66 | -41.4 | 178.6 | -164.1 | 2.4 | 0 | 0 | 0 | 111.4 | S54 T55 I56 F60 G61 | S54-N58 WeakPolarHBondContact O-CB 2.93Å; S54-N58 PolarHBondContact O-N 3.38Å; T55-N58 PolarHBondContact O-N 2.97Å; I56-N58 VanDerWaalsContact C-N 3.32Å; I56-N58 PolarHBondContact O-N 3.23Å; N58-F60 PolarHBondContact O-N 2.81Å; N58-G61 PolarHBondContact O-N 3.05Å; N58-G61 VanDerWaalsContact O-N 3.17Å |
| 59 | F | 77.9 | Confident | 74 | Confident | 171 Ų | 171 | 111.3 Ų | 111.3 | 75% | 0.75 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -62.4 | -42.4 | 176.8 | -174.8 | -95.7 | 0 | 0 | 0 | 112.6 | T55 I56 G61 | T55-F59 VanDerWaalsContact O-CB 3.29Å; T55-F59 WeakPolarHBondContact O-CB 3.36Å; T55-F59 PolarHBondContact O-N 3.21Å; I56-F59 PolarHBondContact O-N 2.94Å; F59-G61 VanDerWaalsContact C-N 3.3Å |
| 60 | F | 82.6 | Confident | 73.8 | Confident | 138 Ų | 138 | 112.9 Ų | 112.9 | 61% | 0.605 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.8 | -2.4 | 176.8 | -75.4 | -79.7 | 0 | 0 | 0 | 113.6 | I56 R57 N58 I62 | I56-F60 HydrophobicContact CG2-CD2 3.75Å; I56-F60 HydrophobicContact CG2-CE2 4Å; I56-F60 VanDerWaalsContact O-CD2 3.3Å; I56-F60 WeakPolarHBondContact O-CD2 3.39Å; I56-F60 PolarHBondContact O-N 3.07Å; R57-F60 PolarHBondContact O-N 3.25Å; N58-F60 PolarHBondContact O-N 2.81Å; F60-I62 HydrophobicContact CB-CD1 3.73Å; F60-I62 HydrophobicContact CB-CG1 3.8Å; F60-I62 HydrophobicContact CG-CD1 4.49Å; F60-I62 PolarHBondContact O-N 2.85Å |
| 61 | G | 74.4 | Confident | 73.7 | Confident | 60 Ų | 60 | 113.3 Ų | 113.3 | 62% | 0.619 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 62.5 | 21.2 | -175.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | R57 N58 F59 A63 | R57-G61 CarbonylContact O-C 3.59Å; R57-G61 PolarHBondContact O-N 2.82Å; N58-G61 PolarHBondContact O-N 3.05Å; N58-G61 VanDerWaalsContact O-N 3.17Å; F59-G61 VanDerWaalsContact C-N 3.3Å; G61-A63 PolarHBondContact O-N 3.12Å; G61-A63 VanDerWaalsContact O-N 3.1Å |
| 62 | I | 69.7 | Low | 73.7 | Confident | 103 Ų | 103 | 111.6 Ų | 111.6 | 53% | 0.528 | 60% | 0.602 | S | S | . | * | trans | -84.2 | 88.4 | -179 | -56.3 | 170 | 0 | 0 | 0 | 107.9 | R57 F60 | R57-I62 PolarHBondContact O-N 3.31Å; F60-I62 HydrophobicContact CB-CD1 3.73Å; F60-I62 HydrophobicContact CB-CG1 3.8Å; F60-I62 HydrophobicContact CG-CD1 4.49Å; F60-I62 PolarHBondContact O-N 2.85Å | ||
| 63 | A | 61 | Low | 73.5 | Confident | 100 Ų | 100 | 115.3 Ų | 115.3 | 83% | 0.826 | 62% | 0.617 | S | S | * | * | trans | -77.4 | 121.3 | 164 | 0 | 0 | 0 | 0 | 0 | 108.5 | G61 | G61-A63 PolarHBondContact O-N 3.12Å; G61-A63 VanDerWaalsContact O-N 3.1Å | ||
| 64 | L | 52.3 | Low | 73.3 | Confident | 219 Ų | 219 | 111.7 Ų | 111.7 | 100% | 1.147 | 62% | 0.62 | S | S | * | * | trans | -123.1 | 0 | 163.7 | -154.9 | 135.3 | 0 | 0 | 0 | 108.6 |
Retrieved 64 of 64 residues in 177.3 ms
(Link to these results)