| 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 | 62.3 | Low | 72.5 | Confident | 204 Ų | 204 | 115.6 Ų | 115.6 | 100% | 1.005 | 59% | 0.589 | S | S | * | * | 0 | -35.6 | 0 | -56.3 | -167.2 | -169 | 0 | 0 | 113.7 | P3 L4 | M1-P3 VanDerWaalsContact C-CD 3.46Å; M1-L4 PolarHBondContact O-N 3.47Å | |||
| 2 | K | 65.9 | Low | 71.7 | Confident | 178 Ų | 178 | 117.8 Ų | 117.8 | 77% | 0.774 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -53.2 | -40.6 | 175.4 | -100.7 | 163.7 | 170.7 | 174.9 | 0 | 117.6 | L4 L5 I6 | K2-L4 PolarHBondContact O-N 3.02Å; K2-L5 PolarHBondContact O-N 3.35Å; K2-I6 WeakPolarHBondContact O-CG1 3.48Å; K2-I6 PolarHBondContact O-N 3.48Å |
| 3 | P | 74.4 | Confident | 71.2 | Confident | 92 Ų | 92 | 116.8 Ų | 116.8 | 60% | 0.597 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -71.9 | -30.2 | -175.7 | 25.9 | -33.2 | 0 | 0 | 0 | 113.2 | M1 I6 M7 | M1-P3 VanDerWaalsContact C-CD 3.46Å; P3-I6 PolarHBondContact O-N 3.36Å; P3-M7 PolarHBondContact O-N 2.95Å; P3-M7 VanDerWaalsContact O-N 3.08Å |
| 4 | L | 77.8 | Confident | 70.4 | Confident | 111 Ų | 111 | 120 Ų | 120 | 58% | 0.581 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -66.8 | -38.9 | 178.1 | -76.2 | 168.5 | 0 | 0 | 0 | 112.2 | M1 K2 I6 M7 L8 | M1-L4 PolarHBondContact O-N 3.47Å; K2-L4 PolarHBondContact O-N 3.02Å; L4-I6 VanDerWaalsContact C-N 3.33Å; L4-M7 PolarHBondContact O-N 3.28Å; L4-L8 WeakPolarHBondContact O-CB 3.44Å; L4-L8 PolarHBondContact O-N 3.42Å |
| 5 | L | 75.1 | Confident | 69.7 | Low | 115 Ų | 115 | 119.3 Ų | 119.3 | 60% | 0.602 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -64.1 | -39.6 | 176.1 | -80.5 | 164.9 | 0 | 0 | 0 | 111.9 | K2 L8 V9 | K2-L5 PolarHBondContact O-N 3.35Å; L5-L8 PolarHBondContact O-N 3.44Å; L5-V9 VanDerWaalsContact O-CG2 3.29Å; L5-V9 WeakPolarHBondContact O-CG2 3.29Å; L5-V9 PolarHBondContact O-N 3.43Å |
| 6 | I | 79.3 | Confident | 69 | Low | 98 Ų | 98 | 116.9 Ų | 116.9 | 50% | 0.503 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -64 | -46.5 | 177.1 | -63.6 | 167 | 0 | 0 | 0 | 109.7 | K2 P3 L4 L8 V9 F10 | K2-I6 WeakPolarHBondContact O-CG1 3.48Å; K2-I6 PolarHBondContact O-N 3.48Å; P3-I6 PolarHBondContact O-N 3.36Å; L4-I6 VanDerWaalsContact C-N 3.33Å; I6-L8 VanDerWaalsContact C-N 3.35Å; I6-L8 PolarHBondContact O-N 3.46Å; I6-V9 PolarHBondContact O-N 3Å; I6-F10 HydrophobicContact CG2-CD2 3.76Å; I6-F10 HydrophobicContact CG2-CE2 3.66Å; I6-F10 VanDerWaalsContact O-CD2 3.25Å; I6-F10 WeakPolarHBondContact O-CD2 3Å; I6-F10 PolarHBondContact O-N 3.28Å |
| 7 | M | 74.2 | Confident | 68.5 | Low | 106 Ų | 106 | 115.2 Ų | 115.2 | 52% | 0.522 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -61.4 | -41.5 | 178 | -160.7 | -159.8 | 89.7 | 0 | 0 | 112.5 | P3 L4 F10 L11 | P3-M7 PolarHBondContact O-N 2.95Å; P3-M7 VanDerWaalsContact O-N 3.08Å; L4-M7 PolarHBondContact O-N 3.28Å; M7-F10 PolarHBondContact O-N 3.39Å; M7-L11 HydrophobicContact CE-CD1 3.55Å; M7-L11 WeakPolarHBondContact O-CG 3.47Å; M7-L11 PolarHBondContact O-N 3.1Å |
| 8 | L | 73.4 | Confident | 67.8 | Low | 78 Ų | 78 | 113.7 Ų | 113.7 | 41% | 0.408 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -61.2 | -47 | 175.5 | -87.9 | 154.2 | 0 | 0 | 0 | 111.5 | L4 L5 I6 F10 L11 F12 | L4-L8 WeakPolarHBondContact O-CB 3.44Å; L4-L8 PolarHBondContact O-N 3.42Å; L5-L8 PolarHBondContact O-N 3.44Å; I6-L8 VanDerWaalsContact C-N 3.35Å; I6-L8 PolarHBondContact O-N 3.46Å; L8-F10 VanDerWaalsContact C-N 3.33Å; L8-F10 PolarHBondContact O-N 3.41Å; L8-L11 PolarHBondContact O-N 3.36Å; L8-F12 HydrophobicContact CB-CD2 4.44Å; L8-F12 HydrophobicContact CB-CE2 4.26Å; L8-F12 HydrophobicContact CD2-CD2 4.42Å; L8-F12 HydrophobicContact CD2-CE2 3.56Å; L8-F12 HydrophobicContact CD2-CZ 4.17Å; L8-F12 WeakPolarHBondContact O-CD2 3.47Å; L8-F12 PolarHBondContact O-N 3.42Å |
| 9 | V | 76.3 | Confident | 67.3 | Low | 82 Ų | 82 | 110.6 Ų | 110.6 | 50% | 0.497 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -60.5 | -42.5 | 178.5 | 170.1 | 0 | 0 | 0 | 0 | 111.5 | L5 I6 F12 L13 | L5-V9 VanDerWaalsContact O-CG2 3.29Å; L5-V9 WeakPolarHBondContact O-CG2 3.29Å; L5-V9 PolarHBondContact O-N 3.43Å; I6-V9 PolarHBondContact O-N 3Å; V9-F12 PolarHBondContact O-N 3.41Å; V9-L13 HydrophobicContact CG1-CD1 3.63Å; V9-L13 WeakPolarHBondContact O-CB 2.89Å; V9-L13 WeakPolarHBondContact O-CD1 3.45Å; V9-L13 PolarHBondContact O-N 3.05Å |
| 10 | F | 70.8 | Confident | 66.9 | Low | 119 Ų | 119 | 106.3 Ų | 106.3 | 52% | 0.522 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -63.2 | -41.7 | 175.9 | -86.4 | -72.7 | 0 | 0 | 0 | 112.9 | I6 M7 L8 L13 W14 | I6-F10 HydrophobicContact CG2-CD2 3.76Å; I6-F10 HydrophobicContact CG2-CE2 3.66Å; I6-F10 VanDerWaalsContact O-CD2 3.25Å; I6-F10 WeakPolarHBondContact O-CD2 3Å; I6-F10 PolarHBondContact O-N 3.28Å; M7-F10 PolarHBondContact O-N 3.39Å; L8-F10 VanDerWaalsContact C-N 3.33Å; L8-F10 PolarHBondContact O-N 3.41Å; F10-L13 PolarHBondContact O-N 3.43Å; F10-W14 PolarHBondContact O-N 3.08Å; F10-W14 VanDerWaalsContact O-N 3.1Å |
| 11 | L | 68.1 | Low | 66.5 | Low | 89 Ų | 89 | 105.4 Ų | 105.4 | 47% | 0.466 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -63.1 | -44.8 | 176.8 | -74.5 | 172 | 0 | 0 | 0 | 112.1 | M7 L8 L13 W14 D15 | M7-L11 HydrophobicContact CE-CD1 3.55Å; M7-L11 WeakPolarHBondContact O-CG 3.47Å; M7-L11 PolarHBondContact O-N 3.1Å; L8-L11 PolarHBondContact O-N 3.36Å; L11-L13 VanDerWaalsContact C-N 3.31Å; L11-L13 PolarHBondContact O-N 3.04Å; L11-W14 PolarHBondContact O-N 3.23Å; L11-D15 PolarHBondContact O-N 3.05Å |
| 12 | F | 63.4 | Low | 66.5 | Low | 142 Ų | 142 | 101.5 Ų | 101.5 | 62% | 0.623 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -70.2 | -23.3 | 178.4 | -71.5 | -63.3 | 0 | 0 | 0 | 114 | L8 V9 P16 | L8-F12 HydrophobicContact CB-CD2 4.44Å; L8-F12 HydrophobicContact CB-CE2 4.26Å; L8-F12 HydrophobicContact CD2-CD2 4.42Å; L8-F12 HydrophobicContact CD2-CE2 3.56Å; L8-F12 HydrophobicContact CD2-CZ 4.17Å; L8-F12 WeakPolarHBondContact O-CD2 3.47Å; L8-F12 PolarHBondContact O-N 3.42Å; V9-F12 PolarHBondContact O-N 3.41Å; F12-P16 WeakPolarHBondContact O-CD 3.07Å; F12-P16 WeakPolarHBondContact O-CG 3.25Å |
| 13 | L | 64.4 | Low | 66.4 | Low | 105 Ų | 105 | 94.8 Ų | 94.8 | 55% | 0.55 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -81.5 | -31 | 175.2 | -87.1 | 155.5 | 0 | 0 | 0 | 112.6 | V9 F10 L11 P16 | V9-L13 HydrophobicContact CG1-CD1 3.63Å; V9-L13 WeakPolarHBondContact O-CB 2.89Å; V9-L13 WeakPolarHBondContact O-CD1 3.45Å; V9-L13 PolarHBondContact O-N 3.05Å; F10-L13 PolarHBondContact O-N 3.43Å; L11-L13 VanDerWaalsContact C-N 3.31Å; L11-L13 PolarHBondContact O-N 3.04Å; L13-P16 WeakPolarHBondContact O-CD 3.3Å |
| 14 | W | 60.2 | Low | 66.1 | Low | 161 Ų | 161 | 92.9 Ų | 92.9 | 61% | 0.61 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -73.4 | -35.5 | 175.9 | -83.5 | -27.3 | 0 | 0 | 0 | 113.2 | F10 L11 V17 L18 | F10-W14 PolarHBondContact O-N 3.08Å; F10-W14 VanDerWaalsContact O-N 3.1Å; L11-W14 PolarHBondContact O-N 3.23Å; W14-V17 PolarHBondContact O-N 2.93Å; W14-L18 HydrophobicContact CB-CD1 4.3Å; W14-L18 WeakPolarHBondContact O-CB 3.17Å; W14-L18 WeakPolarHBondContact O-CD1 3.43Å; W14-L18 VanDerWaalsContact O-CG 3.28Å; W14-L18 WeakPolarHBondContact O-CG 3.4Å; W14-L18 PolarHBondContact O-N 3.16Å |
| 15 | D | 60.8 | Low | 65.6 | Low | 110 Ų | 110 | 91.7 Ų | 91.7 | 59% | 0.588 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -56.9 | -49.7 | -179.5 | -123.1 | -36.4 | 0 | 0 | 0 | 114.8 | L11 V17 L18 A19 | L11-D15 PolarHBondContact O-N 3.05Å; D15-V17 PolarHBondContact O-N 2.99Å; D15-L18 PolarHBondContact O-N 3.46Å; D15-A19 VanDerWaalsContact O-CB 3.3Å; D15-A19 WeakPolarHBondContact O-CB 3.28Å; D15-A19 PolarHBondContact O-N 3.42Å |
| 16 | P | 58.4 | Low | 65.4 | Low | 80 Ų | 80 | 90 Ų | 90 | 52% | 0.519 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -70.9 | -32.3 | 180 | 24.7 | -32.5 | 0 | 0 | 0 | 113 | F12 L13 A19 G20 | F12-P16 WeakPolarHBondContact O-CD 3.07Å; F12-P16 WeakPolarHBondContact O-CG 3.25Å; L13-P16 WeakPolarHBondContact O-CD 3.3Å; P16-A19 PolarHBondContact O-N 3.09Å; P16-G20 PolarHBondContact O-N 3.44Å; P16-G20 VanDerWaalsContact O-N 3.09Å |
| 17 | V | 59.6 | Low | 65.4 | Low | 89 Ų | 89 | 86.3 Ų | 86.3 | 54% | 0.539 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -66.3 | -44.8 | 173.6 | 173.8 | 0 | 0 | 0 | 0 | 109.8 | W14 D15 G20 I21 | W14-V17 PolarHBondContact O-N 2.93Å; D15-V17 PolarHBondContact O-N 2.99Å; V17-G20 PolarHBondContact O-N 2.79Å; V17-I21 HydrophobicContact CG1-CD1 3.75Å; V17-I21 WeakPolarHBondContact O-CD1 3.37Å; V17-I21 WeakPolarHBondContact O-CG1 3.33Å; V17-I21 PolarHBondContact O-N 3.26Å |
| 18 | L | 55.8 | Low | 65.6 | Low | 88 Ų | 88 | 83.6 Ų | 83.6 | 46% | 0.461 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -66.4 | -36.8 | 174.9 | -73.3 | 165.7 | 0 | 0 | 0 | 112.2 | W14 D15 G20 I21 N22 | W14-L18 HydrophobicContact CB-CD1 4.3Å; W14-L18 WeakPolarHBondContact O-CB 3.17Å; W14-L18 WeakPolarHBondContact O-CD1 3.43Å; W14-L18 VanDerWaalsContact O-CG 3.28Å; W14-L18 WeakPolarHBondContact O-CG 3.4Å; W14-L18 PolarHBondContact O-N 3.16Å; D15-L18 PolarHBondContact O-N 3.46Å; L18-G20 PolarHBondContact O-N 3.36Å; L18-I21 CarbonylContact O-C 3.38Å; L18-I21 PolarHBondContact O-N 2.89Å; L18-N22 WeakPolarHBondContact O-CB 3.01Å; L18-N22 PolarHBondContact O-N 3.03Å; L18-N22 PolarHBondContact O-ND2 3.5Å |
| 19 | A | 58.5 | Low | 65.8 | Low | 55 Ų | 55 | 85.7 Ų | 85.7 | 46% | 0.455 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -63.7 | -38.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | D15 P16 S23 | D15-A19 VanDerWaalsContact O-CB 3.3Å; D15-A19 WeakPolarHBondContact O-CB 3.28Å; D15-A19 PolarHBondContact O-N 3.42Å; P16-A19 PolarHBondContact O-N 3.09Å; A19-S23 PolarHBondContact O-OG 2.03Å |
| 20 | G | 58.5 | Low | 66.2 | Low | 24 Ų | 24 | 86.5 Ų | 86.5 | 25% | 0.247 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -69.4 | -38.6 | 172 | 0 | 0 | 0 | 0 | 0 | 112.9 | P16 V17 L18 S23 L24 | P16-G20 PolarHBondContact O-N 3.44Å; P16-G20 VanDerWaalsContact O-N 3.09Å; V17-G20 PolarHBondContact O-N 2.79Å; L18-G20 PolarHBondContact O-N 3.36Å; G20-S23 PolarHBondContact O-N 3.39Å; G20-S23 PolarHBondContact O-OG 2.76Å; G20-L24 PolarHBondContact O-N 2.9Å |
| 21 | I | 60.4 | Low | 66.9 | Low | 88 Ų | 88 | 88.5 Ų | 88.5 | 45% | 0.451 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -69.8 | -31.6 | 176.4 | -63 | 162.3 | 0 | 0 | 0 | 111.5 | V17 L18 S23 P25 | V17-I21 HydrophobicContact CG1-CD1 3.75Å; V17-I21 WeakPolarHBondContact O-CD1 3.37Å; V17-I21 WeakPolarHBondContact O-CG1 3.33Å; V17-I21 PolarHBondContact O-N 3.26Å; L18-I21 CarbonylContact O-C 3.38Å; L18-I21 PolarHBondContact O-N 2.89Å; I21-S23 PolarHBondContact O-N 2.72Å; I21-P25 WeakPolarHBondContact O-CD 3.27Å; I21-P25 WeakPolarHBondContact O-CG 3.5Å |
| 22 | N | 60.3 | Low | 67.8 | Low | 122 Ų | 122 | 85.6 Ų | 85.6 | 65% | 0.652 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -71.7 | -20.1 | 177.7 | -72.7 | -35.3 | 0 | 0 | 0 | 113.1 | L18 | L18-N22 WeakPolarHBondContact O-CB 3.01Å; L18-N22 PolarHBondContact O-N 3.03Å; L18-N22 PolarHBondContact O-ND2 3.5Å |
| 23 | S | 64.1 | Low | 68.6 | Low | 36 Ų | 36 | 85.8 Ų | 85.8 | 25% | 0.252 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -98.2 | -16.8 | -179.4 | 42.6 | 0 | 0 | 0 | 0 | 113.8 | A19 G20 I21 S26 E27 F54 | A19-S23 PolarHBondContact O-OG 2.03Å; G20-S23 PolarHBondContact O-N 3.39Å; G20-S23 PolarHBondContact O-OG 2.76Å; I21-S23 PolarHBondContact O-N 2.72Å; S23-S26 WeakPolarHBondContact CA-OG 3.06Å; S23-S26 PolarHBondContact O-OG 3.38Å; S23-E27 PolarHBondContact O-N 2.92Å; S23-F54 WeakPolarHBondContact OG-CZ 3.32Å |
| 24 | L | 68.2 | Low | 69.2 | Low | 52 Ų | 52 | 88.6 Ų | 88.6 | 27% | 0.272 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -63.5 | -51 | 170.8 | -96.3 | 158.3 | 0 | 0 | 0 | 113.3 | G20 S26 E27 I28 F54 L56 | G20-L24 PolarHBondContact O-N 2.9Å; L24-S26 VanDerWaalsContact C-N 3.25Å; L24-S26 PolarHBondContact O-N 3.34Å; L24-E27 PolarHBondContact O-N 3.36Å; L24-E27 VanDerWaalsContact O-N 3.11Å; L24-I28 HydrophobicContact CD2-CD1 4.5Å; L24-I28 WeakPolarHBondContact O-CD1 3.49Å; L24-I28 VanDerWaalsContact O-CG1 3.24Å; L24-I28 WeakPolarHBondContact O-CG1 2.98Å; L24-I28 PolarHBondContact O-N 3.02Å; L24-F54 HydrophobicContact CD2-CB 3.8Å; L24-F54 HydrophobicContact CD2-CD2 4.49Å; L24-F54 HydrophobicContact CD2-CG 4.18Å; L24-F54 HydrophobicContact CG-CB 4.21Å; L24-F54 HydrophobicContact CG-CD1 4.47Å; L24-F54 HydrophobicContact CG-CD2 4.3Å; L24-F54 HydrophobicContact CG-CG 4.07Å; L24-L56 HydrophobicContact CD2-CD1 4.42Å; L24-L56 HydrophobicContact CD2-CD2 4.38Å |
| 25 | P | 67.6 | Low | 70.3 | Confident | 87 Ų | 87 | 87.2 Ų | 87.2 | 57% | 0.565 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -62.2 | -30.9 | 179.5 | -19.4 | 26.1 | 0 | 0 | 0 | 113.3 | I21 E27 | I21-P25 WeakPolarHBondContact O-CD 3.27Å; I21-P25 WeakPolarHBondContact O-CG 3.5Å; P25-E27 VanDerWaalsContact C-N 3.33Å |
| 26 | S | 70.8 | Confident | 71.7 | Confident | 79 Ų | 79 | 82 Ų | 82 | 55% | 0.552 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -76.4 | -23.8 | 178.2 | 58.5 | 0 | 0 | 0 | 0 | 112.6 | S23 L24 | S23-S26 WeakPolarHBondContact CA-OG 3.06Å; S23-S26 PolarHBondContact O-OG 3.38Å; L24-S26 VanDerWaalsContact C-N 3.25Å; L24-S26 PolarHBondContact O-N 3.34Å |
| 27 | E | 79.3 | Confident | 73.4 | Confident | 21 Ų | 21 | 80.9 Ų | 80.9 | 10% | 0.098 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -91.2 | -31.6 | 177.8 | -155 | 73.3 | -172.8 | 0 | 0 | 112.6 | S23 L24 P25 H29 K30 C38 C52 M53 L56 | S23-E27 PolarHBondContact O-N 2.92Å; L24-E27 PolarHBondContact O-N 3.36Å; L24-E27 VanDerWaalsContact O-N 3.11Å; P25-E27 VanDerWaalsContact C-N 3.33Å; E27-H29 PolarHBondContact O-N 2.82Å; E27-K30 VanDerWaalsContact CD-CD 3.42Å; E27-K30 HydrophobicContact CG-CD 4.41Å; E27-K30 WeakPolarHBondContact O-CB 3.39Å; E27-K30 PolarHBondContact O-N 3.42Å; E27-K30 WeakPolarHBondContact OE1-CD 3.16Å; E27-K30 IonicContact OE1-NZ 2.92Å; E27-K30 PolarHBondContact OE1-NZ 3.32Å; E27-K30 VanDerWaalsContact OE2-CD 3.24Å; E27-K30 WeakPolarHBondContact OE2-CD 3.27Å; E27-K30 IonicContact OE2-NZ 2.72Å; E27-K30 PolarHBondContact OE2-NZ 3.25Å; E27-C38 VanDerWaalsContact O-CB 3.29Å; E27-C38 WeakPolarHBondContact O-CB 3.33Å; E27-C52 HydrophobicContact CG-CB 4.41Å; E27-M53 HydrophobicContact CG-CB 3.95Å; E27-L56 HydrophobicContact CB-CD1 4.04Å; E27-L56 HydrophobicContact CG-CD1 4.18Å |
| 28 | I | 78.3 | Confident | 75 | Confident | 49 Ų | 49 | 76.8 Ų | 76.8 | 25% | 0.251 | 40% | 0.402 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62 | 130.2 | 173.4 | -65.3 | 161.9 | 0 | 0 | 0 | 109.1 | L24 K30 L56 | L24-I28 HydrophobicContact CD2-CD1 4.5Å; L24-I28 WeakPolarHBondContact O-CD1 3.49Å; L24-I28 VanDerWaalsContact O-CG1 3.24Å; L24-I28 WeakPolarHBondContact O-CG1 2.98Å; L24-I28 PolarHBondContact O-N 3.02Å; I28-K30 PolarHBondContact O-N 2.76Å; I28-L56 HydrophobicContact CG1-CD1 3.79Å; I28-L56 HydrophobicContact CG1-CD2 4.21Å |
| 29 | H | 78.6 | Confident | 76.6 | Confident | 121 Ų | 121 | 74.3 Ų | 74.3 | 56% | 0.56 | 39% | 0.387 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 68.8 | 5.4 | -172.6 | -53.7 | 97.2 | 0 | 0 | 0 | 116.7 | E27 I37 C38 R39 | E27-H29 PolarHBondContact O-N 2.82Å; H29-I37 HydrophobicContact CB-CG2 4.25Å; H29-C38 PolarHBondContact N-O 3.02Å; H29-R39 PolarHBondContact NE2-NH1 3.41Å |
| 30 | K | 84.3 | Confident | 78.2 | Confident | 100 Ų | 100 | 78 Ų | 78 | 44% | 0.435 | 40% | 0.398 | S | S | . | . | trans | -65.5 | 142 | 170.5 | -165.4 | -179.6 | 179.2 | -173.5 | 0 | 109.5 | E27 I28 C32 C38 | E27-K30 VanDerWaalsContact CD-CD 3.42Å; E27-K30 HydrophobicContact CG-CD 4.41Å; E27-K30 WeakPolarHBondContact O-CB 3.39Å; E27-K30 PolarHBondContact O-N 3.42Å; E27-K30 WeakPolarHBondContact OE1-CD 3.16Å; E27-K30 IonicContact OE1-NZ 2.92Å; E27-K30 PolarHBondContact OE1-NZ 3.32Å; E27-K30 VanDerWaalsContact OE2-CD 3.24Å; E27-K30 WeakPolarHBondContact OE2-CD 3.27Å; E27-K30 IonicContact OE2-NZ 2.72Å; E27-K30 PolarHBondContact OE2-NZ 3.25Å; I28-K30 PolarHBondContact O-N 2.76Å; K30-C32 PolarHBondContact O-N 2.81Å; K30-C38 PolarHBondContact O-N 2.83Å; K30-C38 PolarHBondContact O-SG 2.01Å; K30-C38 VanDerWaalsContact O-SG 3.41Å | ||
| 31 | K | 85.6 | Confident | 79.9 | Confident | 161 Ų | 161 | 84 Ų | 84 | 70% | 0.7 | 42% | 0.419 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -65.6 | 132.3 | 174.3 | -71.3 | -172.5 | 177.8 | -174.8 | 0 | 109.7 | G36 | K31-G36 CarbonylContact C-O 3.35Å; K31-G36 WeakPolarHBondContact CA-O 3.49Å |
| 32 | C | 87.1 | Confident | 81.4 | Confident | 27 Ų | 27 | 80.7 Ų | 80.7 | 18% | 0.182 | 40% | 0.404 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.8 | -168.8 | 171.9 | 66 | 0 | 0 | 0 | 0 | 110 | K30 K34 N35 G36 I37 C58 | K30-C32 PolarHBondContact O-N 2.81Å; C32-K34 PolarHBondContact O-N 3.46Å; C32-N35 PolarHBondContact O-N 2.94Å; C32-G36 PolarHBondContact N-O 3.23Å; C32-G36 PolarHBondContact O-N 3.1Å; C32-I37 PolarHBondContact SG-N 2.81Å; C32-I37 VanDerWaalsContact SG-N 3.37Å; C32-C58 HydrophobicContact CB-CB 3.84Å; C32-C58 WeakPolarHBondContact CB-SG 3.37Å; C32-C58 WeakPolarHBondContact SG-CA 3.4Å; C32-C58 WeakPolarHBondContact SG-CB 3.03Å; C32-C58 CovalentContact SG-SG 2.01Å; C32-C58 PolarHBondContact SG-SG 3.29Å |
| 33 | Y | 78.9 | Confident | 82.9 | Confident | 146 Ų | 146 | 81.3 Ų | 81.3 | 57% | 0.573 | 40% | 0.398 | S | S | * | . | G | 310 helix | trans | -41.9 | 133.1 | -168.3 | -173.2 | -100.9 | 0 | 0 | 0 | 114.6 | N35 G36 | Y33-N35 VanDerWaalsContact C-N 3.26Å; Y33-N35 PolarHBondContact O-N 3.34Å; Y33-N35 VanDerWaalsContact O-N 3.1Å; Y33-G36 PolarHBondContact O-N 3.44Å |
| 34 | K | 76.9 | Confident | 84.1 | Confident | 165 Ų | 165 | 89.3 Ų | 89.3 | 72% | 0.717 | 43% | 0.432 | S | S | * | . | G | 310 helix | trans | 41.4 | 48.8 | 175.3 | -70.1 | -174.5 | -178.7 | 165.9 | 0 | 114.2 | C32 | C32-K34 PolarHBondContact O-N 3.46Š|
| 35 | N | 84.8 | Confident | 85.1 | Confident | 132 Ų | 132 | 89.4 Ų | 89.4 | 71% | 0.706 | 44% | 0.437 | S | S | * | . | G | 310 helix | trans | 79.2 | 14.3 | 177.5 | -118.1 | 44.6 | 0 | 0 | 0 | 116 | C32 Y33 | C32-N35 PolarHBondContact O-N 2.94Å; Y33-N35 VanDerWaalsContact C-N 3.26Å; Y33-N35 PolarHBondContact O-N 3.34Å; Y33-N35 VanDerWaalsContact O-N 3.1Å |
| 36 | G | 90.4 | Very high | 86.3 | Confident | 1 Ų | 1 | 86.6 Ų | 86.6 | 1% | 0.01 | 42% | 0.416 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.5 | 167.6 | 171 | 0 | 0 | 0 | 0 | 0 | 113.2 | K31 C32 Y33 C59 | K31-G36 CarbonylContact C-O 3.35Å; K31-G36 WeakPolarHBondContact CA-O 3.49Å; C32-G36 PolarHBondContact N-O 3.23Å; C32-G36 PolarHBondContact O-N 3.1Å; Y33-G36 PolarHBondContact O-N 3.44Å; G36-C59 CarbonylContact C-O 3.48Å; G36-C59 WeakPolarHBondContact CA-O 3.35Å |
| 37 | I | 93 | Very high | 87.2 | Confident | 56 Ų | 56 | 87.8 Ų | 87.8 | 29% | 0.287 | 41% | 0.414 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.4 | 134 | 179.3 | -60.7 | -179.7 | 0 | 0 | 0 | 108.5 | H29 C32 R39 C59 | H29-I37 HydrophobicContact CB-CG2 4.25Å; C32-I37 PolarHBondContact SG-N 2.81Å; C32-I37 VanDerWaalsContact SG-N 3.37Å; I37-R39 HydrophobicContact CG2-CG 4.48Å; I37-C59 PolarHBondContact N-O 3.03Å; I37-C59 PolarHBondContact O-N 3.44Å |
| 38 | C | 93.2 | Very high | 87.9 | Confident | 2 Ų | 2 | 90.5 Ų | 90.5 | 1% | 0.014 | 43% | 0.429 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -72.1 | 126.4 | 173.8 | -56.9 | 0 | 0 | 0 | 0 | 110.7 | E27 H29 K30 C52 E57 | E27-C38 VanDerWaalsContact O-CB 3.29Å; E27-C38 WeakPolarHBondContact O-CB 3.33Å; H29-C38 PolarHBondContact N-O 3.02Å; K30-C38 PolarHBondContact O-N 2.83Å; K30-C38 PolarHBondContact O-SG 2.01Å; K30-C38 VanDerWaalsContact O-SG 3.41Å; C38-C52 HydrophobicContact CB-CB 3.73Å; C38-C52 WeakPolarHBondContact CB-SG 2.98Å; C38-C52 WeakPolarHBondContact SG-CB 3.07Å; C38-C52 CovalentContact SG-SG 2.03Å; C38-C52 PolarHBondContact SG-SG 2.81Å; C38-E57 CarbonylContact C-O 3.46Å; C38-E57 VanDerWaalsContact CA-O 3.26Å; C38-E57 WeakPolarHBondContact CA-O 3.5Å |
| 39 | R | 90.9 | Very high | 88.6 | Confident | 37 Ų | 37 | 91.6 Ų | 91.6 | 14% | 0.14 | 44% | 0.438 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.1 | 164.4 | 177 | -61.1 | -170.9 | -179.8 | -71.9 | -0.9 | 110.6 | H29 I37 E41 Y43 E46 L56 E57 | H29-R39 PolarHBondContact NE2-NH1 3.41Å; I37-R39 HydrophobicContact CG2-CG 4.48Å; R39-E41 VanDerWaalsContact C-N 3.28Å; R39-E41 WeakPolarHBondContact CB-O 3.36Å; R39-Y43 PolarHBondContact NH1-OH 2.98Å; R39-E46 VanDerWaalsContact CD-OE2 3.24Å; R39-E46 WeakPolarHBondContact CD-OE2 3.39Å; R39-E46 IonicContact CZ-OE1 3.6Å; R39-E46 IonicContact NE-OE1 3.03Å; R39-E46 PolarHBondContact NE-OE1 3.39Å; R39-E46 IonicContact NE-OE2 3.03Å; R39-E46 PolarHBondContact NE-OE2 2.95Å; R39-E46 IonicContact NH2-OE1 3.29Å; R39-E46 PolarHBondContact NH2-OE1 2.89Å; R39-L56 CarbonylContact O-C 3.5Å; R39-L56 WeakPolarHBondContact O-CA 3.26Å; R39-L56 WeakPolarHBondContact O-CB 3.43Å; R39-L56 WeakPolarHBondContact O-CD2 3.26Å; R39-E57 PolarHBondContact N-O 3.12Å; R39-E57 PolarHBondContact O-N 2.93Å |
| 40 | L | 91.2 | Very high | 89.2 | Confident | 132 Ų | 132 | 87.7 Ų | 87.7 | 69% | 0.691 | 43% | 0.427 | S | S | * | . | S | Bend | trans | -66.7 | -36.8 | 169.3 | -78.1 | 160.6 | 0 | 0 | 0 | 111.2 | L56 | L40-L56 HydrophobicContact CB-CD2 4.36Å; L40-L56 HydrophobicContact CD2-CD2 3.52Å; L40-L56 HydrophobicContact CG-CD2 3.76Å |
| 41 | E | 93.3 | Very high | 89.5 | Confident | 149 Ų | 149 | 90.5 Ų | 90.5 | 70% | 0.696 | 44% | 0.435 | S | S | * | . | S | Bend | trans | -150.6 | 138.9 | 176.8 | -173 | 174.7 | -165.5 | 0 | 0 | 107.7 | R39 E57 | R39-E41 VanDerWaalsContact C-N 3.28Å; R39-E41 WeakPolarHBondContact CB-O 3.36Å; E41-E57 WeakPolarHBondContact CA-OE2 3.45Å |
| 42 | C | 92.2 | Very high | 89.8 | Confident | 20 Ų | 20 | 83.9 Ų | 83.9 | 14% | 0.135 | 41% | 0.41 | C | S | . | . | trans | -69 | 143.6 | 174.1 | -62 | 0 | 0 | 0 | 0 | 111.1 | E46 E57 C59 | C42-E46 HydrophobicContact CB-CB 4.08Å; C42-E57 PolarHBondContact N-OE2 3.03Å; C42-E57 PolarHBondContact SG-OE2 2.94Å; C42-E57 VanDerWaalsContact SG-OE2 3.33Å; C42-C59 WeakPolarHBondContact CA-SG 3.39Å; C42-C59 HydrophobicContact CB-CB 3.79Å; C42-C59 WeakPolarHBondContact CB-SG 3.14Å; C42-C59 WeakPolarHBondContact SG-CA 3.5Å; C42-C59 WeakPolarHBondContact SG-CB 3.24Å; C42-C59 CovalentContact SG-SG 2.03Å; C42-C59 PolarHBondContact SG-SG 3.37Å | ||
| 43 | Y | 91.3 | Very high | 89.7 | Confident | 135 Ų | 135 | 88.3 Ų | 88.3 | 53% | 0.529 | 43% | 0.429 | S | S | . | . | trans | -68.6 | 160.9 | 171.5 | -60.3 | -52.8 | 0 | 0 | 0 | 111.3 | R39 S45 E46 | R39-Y43 PolarHBondContact NH1-OH 2.98Å; Y43-S45 PolarHBondContact O-N 3.34Å; Y43-E46 HydrophobicContact CD2-CG 4.43Å; Y43-E46 WeakPolarHBondContact CD2-OE2 3.34Å; Y43-E46 PolarHBondContact N-OE2 3.11Å; Y43-E46 VanDerWaalsContact N-OE2 3.12Å; Y43-E46 WeakPolarHBondContact O-CA 2.75Å; Y43-E46 PolarHBondContact O-N 3.05Å | ||
| 44 | E | 89.9 | Confident | 89.9 | Confident | 203 Ų | 203 | 86 Ų | 86 | 95% | 0.949 | 42% | 0.422 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.5 | -23.6 | 173.3 | -66.8 | -166.1 | 158.4 | 0 | 0 | 113 | E46 | E44-E46 VanDerWaalsContact C-N 3.32Š|
| 45 | S | 90.2 | Very high | 90.3 | Very high | 54 Ų | 54 | 86.5 Ų | 86.5 | 38% | 0.378 | 43% | 0.427 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.4 | -1.1 | 175.4 | 61.1 | 0 | 0 | 0 | 0 | 115.3 | Y43 G62 P66 | Y43-S45 PolarHBondContact O-N 3.34Å; S45-G62 PolarHBondContact O-N 3.48Å; S45-P66 VanDerWaalsContact CA-CG 3.43Å |
| 46 | E | 92.1 | Very high | 90.6 | Very high | 29 Ų | 29 | 80.2 Ų | 80.2 | 14% | 0.136 | 39% | 0.393 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.4 | 160.5 | -179.6 | -64.8 | 174.5 | 156.5 | 0 | 0 | 110.5 | R39 C42 Y43 E44 C59 V60 | R39-E46 VanDerWaalsContact CD-OE2 3.24Å; R39-E46 WeakPolarHBondContact CD-OE2 3.39Å; R39-E46 IonicContact CZ-OE1 3.6Å; R39-E46 IonicContact NE-OE1 3.03Å; R39-E46 PolarHBondContact NE-OE1 3.39Å; R39-E46 IonicContact NE-OE2 3.03Å; R39-E46 PolarHBondContact NE-OE2 2.95Å; R39-E46 IonicContact NH2-OE1 3.29Å; R39-E46 PolarHBondContact NH2-OE1 2.89Å; C42-E46 HydrophobicContact CB-CB 4.08Å; Y43-E46 HydrophobicContact CD2-CG 4.43Å; Y43-E46 WeakPolarHBondContact CD2-OE2 3.34Å; Y43-E46 PolarHBondContact N-OE2 3.11Å; Y43-E46 VanDerWaalsContact N-OE2 3.12Å; Y43-E46 WeakPolarHBondContact O-CA 2.75Å; Y43-E46 PolarHBondContact O-N 3.05Å; E44-E46 VanDerWaalsContact C-N 3.32Å; E46-C59 HydrophobicContact CB-CB 3.99Å; E46-C59 HydrophobicContact CG-CB 4.36Å; E46-C59 VanDerWaalsContact OE2-CB 3.26Å; E46-C59 WeakPolarHBondContact OE2-CB 3.4Å; E46-V60 CarbonylContact C-O 3.55Å; E46-V60 WeakPolarHBondContact CA-O 3.45Å; E46-V60 WeakPolarHBondContact CB-O 3.24Å |
| 47 | M | 90.8 | Very high | 90.8 | Very high | 104 Ų | 104 | 82.3 Ų | 82.3 | 51% | 0.512 | 40% | 0.403 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.5 | 133.4 | 174 | -67.9 | 179.3 | -179.5 | 0 | 0 | 109.8 | V49 V60 | M47-V49 PolarHBondContact O-N 2.78Å; M47-V60 HydrophobicContact CB-CG2 4.17Å; M47-V60 PolarHBondContact N-O 3.29Å; M47-V60 PolarHBondContact O-N 3.5Å |
| 48 | L | 92.9 | Very high | 90.8 | Very high | 77 Ų | 77 | 79.7 Ų | 79.7 | 40% | 0.403 | 39% | 0.39 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.9 | 120.1 | 170.3 | 175.9 | 67.8 | 0 | 0 | 0 | 109.8 | A50 Y51 E57 | L48-A50 WeakPolarHBondContact CD1-O 3.35Å; L48-Y51 HydrophobicContact CD1-CE1 4.23Å; L48-Y51 HydrophobicContact CD2-CE1 4.3Å; L48-E57 HydrophobicContact CD1-CB 3.62Å; L48-E57 HydrophobicContact CD1-CG 3.76Å |
| 49 | V | 92.9 | Very high | 90.8 | Very high | 72 Ų | 72 | 79.7 Ų | 79.7 | 44% | 0.436 | 39% | 0.39 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118 | -21.6 | 179.8 | -68.1 | 0 | 0 | 0 | 0 | 114 | M47 C58 V60 | M47-V49 PolarHBondContact O-N 2.78Å; V49-C58 HydrophobicContact CG2-CB 4.37Å; V49-C58 WeakPolarHBondContact CG2-O 3.24Å; V49-C58 PolarHBondContact N-O 3.04Å; V49-V60 HydrophobicContact CG1-CG1 4.47Å; V49-V60 HydrophobicContact CG1-CG2 3.51Å; V49-V60 HydrophobicContact CG2-CG1 3.81Å; V49-V60 HydrophobicContact CG2-CG2 4.26Å |
| 50 | A | 92.3 | Very high | 90.9 | Very high | 40 Ų | 40 | 79.5 Ų | 79.5 | 33% | 0.331 | 39% | 0.392 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -163.7 | -177.4 | 178.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | L48 C58 | L48-A50 WeakPolarHBondContact CD1-O 3.35Å; A50-C58 HydrophobicContact CB-CB 3.88Å; A50-C58 VanDerWaalsContact O-CB 3.27Å; A50-C58 WeakPolarHBondContact O-CB 3.19Å; A50-C58 PolarHBondContact O-N 3.33Å |
| 51 | Y | 90.6 | Very high | 90.8 | Very high | 158 Ų | 158 | 78.3 Ų | 78.3 | 62% | 0.62 | 39% | 0.39 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -115.8 | 143.5 | 169.1 | -64.2 | -80.7 | 0 | 0 | 0 | 110.1 | L48 L56 E57 | L48-Y51 HydrophobicContact CD1-CE1 4.23Å; L48-Y51 HydrophobicContact CD2-CE1 4.3Å; Y51-L56 CarbonylContact C-O 3.43Å; Y51-L56 VanDerWaalsContact CA-O 3.27Å; Y51-L56 WeakPolarHBondContact CA-O 3.13Å; Y51-E57 HydrophobicContact CD1-CG 4.45Å; Y51-E57 HydrophobicContact CE1-CG 4.2Å |
| 52 | C | 90.3 | Very high | 90.4 | Very high | 23 Ų | 23 | 71.5 Ų | 71.5 | 16% | 0.155 | 36% | 0.361 | C | S | . | . | trans | -91.8 | -174.3 | 169.9 | -54.3 | 0 | 0 | 0 | 0 | 110.6 | E27 C38 L56 | E27-C52 HydrophobicContact CG-CB 4.41Å; C38-C52 HydrophobicContact CB-CB 3.73Å; C38-C52 WeakPolarHBondContact CB-SG 2.98Å; C38-C52 WeakPolarHBondContact SG-CB 3.07Å; C38-C52 CovalentContact SG-SG 2.03Å; C38-C52 PolarHBondContact SG-SG 2.81Å; C52-L56 HydrophobicContact CB-CB 4.04Å; C52-L56 PolarHBondContact N-O 2.03Å | ||
| 53 | M | 86.4 | Confident | 89.7 | Confident | 119 Ų | 119 | 77.6 Ų | 77.6 | 59% | 0.586 | 39% | 0.392 | S | S | * | . | G | 310 helix | trans | -60.1 | 157.6 | 172.3 | -74.7 | -177.1 | 153 | 0 | 0 | 111.2 | E27 Q55 L56 | E27-M53 HydrophobicContact CG-CB 3.95Å; M53-Q55 PolarHBondContact O-N 3.16Å; M53-L56 WeakPolarHBondContact O-CB 3.29Å; M53-L56 WeakPolarHBondContact O-CG 2.99Å; M53-L56 PolarHBondContact O-N 3.27Å |
| 54 | F | 83.1 | Confident | 89 | Confident | 97 Ų | 97 | 76.5 Ų | 76.5 | 43% | 0.425 | 40% | 0.401 | S | S | . | . | G | 310 helix | trans | 58.8 | 29.6 | -179.3 | -53.7 | -77.4 | 0 | 0 | 0 | 114.8 | S23 L24 L56 | S23-F54 WeakPolarHBondContact OG-CZ 3.32Å; L24-F54 HydrophobicContact CD2-CB 3.8Å; L24-F54 HydrophobicContact CD2-CD2 4.49Å; L24-F54 HydrophobicContact CD2-CG 4.18Å; L24-F54 HydrophobicContact CG-CB 4.21Å; L24-F54 HydrophobicContact CG-CD1 4.47Å; L24-F54 HydrophobicContact CG-CD2 4.3Å; L24-F54 HydrophobicContact CG-CG 4.07Å; F54-L56 PolarHBondContact O-N 2.78Å; F54-L56 VanDerWaalsContact O-N 3.16Å |
| 55 | Q | 85.3 | Confident | 87.7 | Confident | 176 Ų | 176 | 69.9 Ų | 69.9 | 82% | 0.822 | 38% | 0.382 | S | S | * | . | G | 310 helix | trans | 61.3 | 19.4 | 179.1 | -55 | 177.3 | -9 | 0 | 0 | 113.9 | M53 | M53-Q55 PolarHBondContact O-N 3.16Š|
| 56 | L | 90.7 | Very high | 86.3 | Confident | 1 Ų | 1 | 74.6 Ų | 74.6 | 1% | 0.005 | 41% | 0.411 | C | S | . | . | trans | -66.6 | 146.7 | 171.5 | -65.2 | 173.8 | 0 | 0 | 0 | 110.1 | L24 E27 I28 R39 L40 Y51 C52 M53 F54 | L24-L56 HydrophobicContact CD2-CD1 4.42Å; L24-L56 HydrophobicContact CD2-CD2 4.38Å; E27-L56 HydrophobicContact CB-CD1 4.04Å; E27-L56 HydrophobicContact CG-CD1 4.18Å; I28-L56 HydrophobicContact CG1-CD1 3.79Å; I28-L56 HydrophobicContact CG1-CD2 4.21Å; R39-L56 CarbonylContact O-C 3.5Å; R39-L56 WeakPolarHBondContact O-CA 3.26Å; R39-L56 WeakPolarHBondContact O-CB 3.43Å; R39-L56 WeakPolarHBondContact O-CD2 3.26Å; L40-L56 HydrophobicContact CB-CD2 4.36Å; L40-L56 HydrophobicContact CD2-CD2 3.52Å; L40-L56 HydrophobicContact CG-CD2 3.76Å; Y51-L56 CarbonylContact C-O 3.43Å; Y51-L56 VanDerWaalsContact CA-O 3.27Å; Y51-L56 WeakPolarHBondContact CA-O 3.13Å; C52-L56 HydrophobicContact CB-CB 4.04Å; C52-L56 PolarHBondContact N-O 2.03Å; M53-L56 WeakPolarHBondContact O-CB 3.29Å; M53-L56 WeakPolarHBondContact O-CG 2.99Å; M53-L56 PolarHBondContact O-N 3.27Å; F54-L56 PolarHBondContact O-N 2.78Å; F54-L56 VanDerWaalsContact O-N 3.16Å | ||
| 57 | E | 94.1 | Very high | 86 | Confident | 45 Ų | 45 | 76.9 Ų | 76.9 | 21% | 0.21 | 42% | 0.424 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -81.4 | 134.2 | 176.6 | -66.5 | -165.5 | 160 | 0 | 0 | 110.9 | C38 R39 E41 C42 L48 Y51 | C38-E57 CarbonylContact C-O 3.46Å; C38-E57 VanDerWaalsContact CA-O 3.26Å; C38-E57 WeakPolarHBondContact CA-O 3.5Å; R39-E57 PolarHBondContact N-O 3.12Å; R39-E57 PolarHBondContact O-N 2.93Å; E41-E57 WeakPolarHBondContact CA-OE2 3.45Å; C42-E57 PolarHBondContact N-OE2 3.03Å; C42-E57 PolarHBondContact SG-OE2 2.94Å; C42-E57 VanDerWaalsContact SG-OE2 3.33Å; L48-E57 HydrophobicContact CD1-CB 3.62Å; L48-E57 HydrophobicContact CD1-CG 3.76Å; Y51-E57 HydrophobicContact CD1-CG 4.45Å; Y51-E57 HydrophobicContact CE1-CG 4.2Å |
| 58 | C | 93.7 | Very high | 85.8 | Confident | 1 Ų | 1 | 75.4 Ų | 75.4 | 1% | 0.007 | 42% | 0.42 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.4 | 109.1 | 168.6 | 175.5 | 0 | 0 | 0 | 0 | 108.9 | C32 V49 A50 | C32-C58 HydrophobicContact CB-CB 3.84Å; C32-C58 WeakPolarHBondContact CB-SG 3.37Å; C32-C58 WeakPolarHBondContact SG-CA 3.4Å; C32-C58 WeakPolarHBondContact SG-CB 3.03Å; C32-C58 CovalentContact SG-SG 2.01Å; C32-C58 PolarHBondContact SG-SG 3.29Å; V49-C58 HydrophobicContact CG2-CB 4.37Å; V49-C58 WeakPolarHBondContact CG2-O 3.24Å; V49-C58 PolarHBondContact N-O 3.04Å; A50-C58 HydrophobicContact CB-CB 3.88Å; A50-C58 VanDerWaalsContact O-CB 3.27Å; A50-C58 WeakPolarHBondContact O-CB 3.19Å; A50-C58 PolarHBondContact O-N 3.33Å |
| 59 | C | 93.4 | Very high | 85.4 | Confident | 2 Ų | 2 | 75.3 Ų | 75.3 | 1% | 0.014 | 42% | 0.421 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.7 | 130.2 | -170.8 | -52.1 | 0 | 0 | 0 | 0 | 110.7 | G36 I37 C42 E46 | G36-C59 CarbonylContact C-O 3.48Å; G36-C59 WeakPolarHBondContact CA-O 3.35Å; I37-C59 PolarHBondContact N-O 3.03Å; I37-C59 PolarHBondContact O-N 3.44Å; C42-C59 WeakPolarHBondContact CA-SG 3.39Å; C42-C59 HydrophobicContact CB-CB 3.79Å; C42-C59 WeakPolarHBondContact CB-SG 3.14Å; C42-C59 WeakPolarHBondContact SG-CA 3.5Å; C42-C59 WeakPolarHBondContact SG-CB 3.24Å; C42-C59 CovalentContact SG-SG 2.03Å; C42-C59 PolarHBondContact SG-SG 3.37Å; E46-C59 HydrophobicContact CB-CB 3.99Å; E46-C59 HydrophobicContact CG-CB 4.36Å; E46-C59 VanDerWaalsContact OE2-CB 3.26Å; E46-C59 WeakPolarHBondContact OE2-CB 3.4Å |
| 60 | V | 92.6 | Very high | 84.9 | Confident | 32 Ų | 32 | 75.5 Ų | 75.5 | 19% | 0.194 | 42% | 0.42 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.4 | 147.6 | 171.9 | -65.7 | 0 | 0 | 0 | 0 | 109.6 | E46 M47 V49 G62 | E46-V60 CarbonylContact C-O 3.55Å; E46-V60 WeakPolarHBondContact CA-O 3.45Å; E46-V60 WeakPolarHBondContact CB-O 3.24Å; M47-V60 HydrophobicContact CB-CG2 4.17Å; M47-V60 PolarHBondContact N-O 3.29Å; M47-V60 PolarHBondContact O-N 3.5Å; V49-V60 HydrophobicContact CG1-CG1 4.47Å; V49-V60 HydrophobicContact CG1-CG2 3.51Å; V49-V60 HydrophobicContact CG2-CG1 3.81Å; V49-V60 HydrophobicContact CG2-CG2 4.26Å; V60-G62 PolarHBondContact O-N 2.86Å |
| 61 | T | 89.8 | Confident | 84.5 | Confident | 107 Ų | 107 | 77.8 Ų | 77.8 | 66% | 0.656 | 43% | 0.425 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -56.5 | 128.2 | 172.9 | -50.5 | 0 | 0 | 0 | 0 | 110.1 | ||
| 62 | G | 83.8 | Confident | 84.1 | Confident | 7 Ų | 7 | 72.4 Ų | 72.4 | 7% | 0.072 | 41% | 0.412 | C | S | . | . | trans | -58.8 | 147.9 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | S45 V60 P64 A65 | S45-G62 PolarHBondContact O-N 3.48Å; V60-G62 PolarHBondContact O-N 2.86Å; G62-P64 CarbonylContact C-O 3.42Å; G62-P64 CarbonylContact O-C 3.59Å; G62-A65 WeakPolarHBondContact O-CA 3.49Å; G62-A65 PolarHBondContact O-N 3.05Å; G62-A65 VanDerWaalsContact O-N 3.16Å | ||
| 63 | N | 77.3 | Confident | 83.6 | Confident | 148 Ų | 148 | 75.9 Ų | 75.9 | 79% | 0.791 | 43% | 0.431 | S | S | * | . | S | Bend | trans | -132 | 113.8 | 173.6 | -170.3 | 5.8 | 0 | 0 | 0 | 109.9 | ||
| 64 | P | 76.1 | Confident | 83.4 | Confident | 111 Ų | 111 | 72.6 Ų | 72.6 | 72% | 0.721 | 42% | 0.419 | S | S | * | . | S | Bend | cis | -63.1 | 148 | 1.1 | 28.7 | -34.2 | 0 | 0 | 0 | 111.1 | G62 | G62-P64 CarbonylContact C-O 3.42Å; G62-P64 CarbonylContact O-C 3.59Å |
| 65 | A | 64.4 | Low | 83.4 | Confident | 65 Ų | 65 | 70.6 Ų | 70.6 | 54% | 0.537 | 42% | 0.418 | S | S | . | . | trans | -59.6 | 139.6 | 167 | 0 | 0 | 0 | 0 | 0 | 107.7 | G62 | G62-A65 WeakPolarHBondContact O-CA 3.49Å; G62-A65 PolarHBondContact O-N 3.05Å; G62-A65 VanDerWaalsContact O-N 3.16Å | ||
| 66 | P | 60 | Low | 83.3 | Confident | 152 Ų | 152 | 61 Ų | 61 | 99% | 0.987 | 38% | 0.381 | S | S | * | . | trans | -61 | 0 | 173.9 | 14.2 | -15.7 | 0 | 0 | 0 | 112.5 | S45 | S45-P66 VanDerWaalsContact CA-CG 3.43Š|
Retrieved 66 of 66 residues in 23.7 ms
(Link to these results)