| 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 | 48.8 | Very low | 76.5 | Confident | 150 Ų | 150 | 69 Ų | 69 | 74% | 0.739 | 38% | 0.384 | S | S | * | . | 0 | 89 | 0 | -80.6 | -155.5 | -75.5 | 0 | 0 | 109.2 | C6 N35 | M1-C6 WeakPolarHBondContact O-CB 3.5Å; M1-N35 PolarHBondContact N-OD1 3.41Å | |||
| 2 | T | 60.9 | Low | 77.6 | Confident | 30 Ų | 30 | 79.3 Ų | 79.3 | 18% | 0.184 | 41% | 0.412 | C | S | . | . | trans | -118.8 | 62.8 | 177.9 | 49.6 | 0 | 0 | 0 | 0 | 110.4 | M32 N35 | T2-M32 WeakPolarHBondContact OG1-CA 3.49Å; T2-M32 PolarHBondContact OG1-O 3.29Å; T2-N35 HydrophobicContact CG2-CB 4.37Å; T2-N35 PolarHBondContact N-OD1 2.92Å; T2-N35 PolarHBondContact OG1-OD1 3.43Å; T2-N35 VanDerWaalsContact OG1-OD1 3.06Å | ||
| 3 | C | 70.7 | Confident | 78.4 | Confident | 80 Ų | 80 | 74.6 Ų | 74.6 | 54% | 0.541 | 39% | 0.389 | S | S | . | . | trans | -83.6 | 156.7 | 156.5 | 75.3 | 0 | 0 | 0 | 0 | 109 | G5 C6 S7 | C3-G5 PolarHBondContact O-N 2.93Å; C3-C6 WeakPolarHBondContact O-CA 3.41Å; C3-C6 WeakPolarHBondContact O-CB 3.44Å; C3-C6 PolarHBondContact O-N 3.2Å; C3-S7 PolarHBondContact O-N 3.34Å | ||
| 4 | D | 72.2 | Confident | 79.1 | Confident | 125 Ų | 125 | 69.3 Ų | 69.3 | 67% | 0.668 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -53 | -33 | -175.4 | -165.3 | -94.4 | 0 | 0 | 0 | 113.8 | C6 S7 S8 | D4-C6 PolarHBondContact O-N 2.88Å; D4-S7 WeakPolarHBondContact CA-OG 3.39Å; D4-S7 PolarHBondContact O-OG 3.23Å; D4-S8 VanDerWaalsContact O-CB 3.3Å; D4-S8 WeakPolarHBondContact O-CB 3.08Å; D4-S8 PolarHBondContact O-N 2.9Å; D4-S8 PolarHBondContact O-OG 3.14Å |
| 5 | G | 79.5 | Confident | 79.7 | Confident | 46 Ų | 46 | 68.5 Ų | 68.5 | 47% | 0.474 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -68.3 | -32.9 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | C3 Q9 | C3-G5 PolarHBondContact O-N 2.93Å; G5-Q9 WeakPolarHBondContact O-CB 3.19Å; G5-Q9 PolarHBondContact O-N 2.95Å; G5-Q9 VanDerWaalsContact O-N 3.15Å |
| 6 | C | 79.3 | Confident | 80.2 | Confident | 13 Ų | 13 | 74.9 Ų | 74.9 | 9% | 0.088 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -73.7 | -45 | 177.7 | -67.5 | 0 | 0 | 0 | 0 | 111.9 | M1 C3 D4 S8 Q9 V10 K57 | M1-C6 WeakPolarHBondContact O-CB 3.5Å; C3-C6 WeakPolarHBondContact O-CA 3.41Å; C3-C6 WeakPolarHBondContact O-CB 3.44Å; C3-C6 PolarHBondContact O-N 3.2Å; D4-C6 PolarHBondContact O-N 2.88Å; C6-S8 VanDerWaalsContact C-N 3.31Å; C6-S8 PolarHBondContact O-N 3.22Å; C6-Q9 PolarHBondContact O-N 3.34Å; C6-V10 WeakPolarHBondContact O-CG2 3.4Å; C6-V10 PolarHBondContact O-N 3.47Å; C6-K57 PolarHBondContact SG-NZ 3.14Å |
| 7 | S | 81.9 | Confident | 80.5 | Confident | 19 Ų | 19 | 70.6 Ų | 70.6 | 13% | 0.133 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -60.6 | -43.7 | 175.6 | 46.3 | 0 | 0 | 0 | 0 | 110.8 | C3 D4 Q9 V10 R11 F30 | C3-S7 PolarHBondContact O-N 3.34Å; D4-S7 WeakPolarHBondContact CA-OG 3.39Å; D4-S7 PolarHBondContact O-OG 3.23Å; S7-Q9 VanDerWaalsContact C-N 3.33Å; S7-Q9 PolarHBondContact O-N 2.82Å; S7-V10 PolarHBondContact O-N 2.91Å; S7-R11 WeakPolarHBondContact O-CB 3.3Å; S7-R11 PolarHBondContact O-N 3.25Å; S7-F30 VanDerWaalsContact O-CZ 3.32Å; S7-F30 WeakPolarHBondContact O-CZ 3.42Å |
| 8 | S | 86.5 | Confident | 80.9 | Confident | 54 Ų | 54 | 69.3 Ų | 69.3 | 38% | 0.378 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -58.1 | -42 | 175.3 | -68 | 0 | 0 | 0 | 0 | 113.1 | D4 C6 R11 R12 | D4-S8 VanDerWaalsContact O-CB 3.3Å; D4-S8 WeakPolarHBondContact O-CB 3.08Å; D4-S8 PolarHBondContact O-N 2.9Å; D4-S8 PolarHBondContact O-OG 3.14Å; C6-S8 VanDerWaalsContact C-N 3.31Å; C6-S8 PolarHBondContact O-N 3.22Å; S8-R11 PolarHBondContact O-N 2.88Å; S8-R12 WeakPolarHBondContact O-CG 3.32Å; S8-R12 PolarHBondContact O-N 3.06Å |
| 9 | Q | 86.4 | Confident | 81.2 | Confident | 82 Ų | 82 | 72.4 Ų | 72.4 | 38% | 0.383 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -68.6 | -43.1 | 178.5 | -168.1 | 172.4 | 54.3 | 0 | 0 | 112.1 | G5 C6 S7 R11 R12 V13 T55 | G5-Q9 WeakPolarHBondContact O-CB 3.19Å; G5-Q9 PolarHBondContact O-N 2.95Å; G5-Q9 VanDerWaalsContact O-N 3.15Å; C6-Q9 PolarHBondContact O-N 3.34Å; S7-Q9 VanDerWaalsContact C-N 3.33Å; S7-Q9 PolarHBondContact O-N 2.82Å; Q9-R11 VanDerWaalsContact C-N 3.33Å; Q9-R11 PolarHBondContact O-N 3.5Å; Q9-R12 PolarHBondContact O-N 2.87Å; Q9-V13 WeakPolarHBondContact O-CG2 3.33Å; Q9-V13 PolarHBondContact O-N 3.06Å; Q9-T55 HydrophobicContact CG-CG2 4.21Å |
| 10 | V | 87.1 | Confident | 81.4 | Confident | 14 Ų | 14 | 74.8 Ų | 74.8 | 9% | 0.085 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -60.1 | -45.5 | 174.2 | 169.4 | 0 | 0 | 0 | 0 | 110.5 | C6 S7 R12 V13 L14 F30 V37 L52 | C6-V10 WeakPolarHBondContact O-CG2 3.4Å; C6-V10 PolarHBondContact O-N 3.47Å; S7-V10 PolarHBondContact O-N 2.91Å; V10-R12 VanDerWaalsContact C-N 3.35Å; V10-R12 PolarHBondContact O-N 2.81Å; V10-V13 PolarHBondContact O-N 3.1Å; V10-L14 HydrophobicContact CG1-CD1 3.66Å; V10-L14 HydrophobicContact CG1-CG 4.22Å; V10-L14 WeakPolarHBondContact O-CB 3.5Å; V10-L14 WeakPolarHBondContact O-CG 3.35Å; V10-L14 PolarHBondContact O-N 3.48Å; V10-F30 HydrophobicContact CB-CE1 4.05Å; V10-F30 HydrophobicContact CB-CZ 4.4Å; V10-F30 HydrophobicContact CG1-CE1 3.95Å; V10-F30 HydrophobicContact CG1-CZ 4.26Å; V10-V37 HydrophobicContact CG1-CG1 4.02Å; V10-V37 HydrophobicContact CG1-CG2 4.43Å; V10-L52 HydrophobicContact CB-CD2 4.42Å; V10-L52 HydrophobicContact CG1-CD2 3.75Å; V10-L52 HydrophobicContact CG2-CD2 4.14Å |
| 11 | R | 88.3 | Confident | 81.5 | Confident | 146 Ų | 146 | 74.3 Ų | 74.3 | 55% | 0.551 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -58.3 | -45.8 | 177.4 | -137.1 | 176.9 | -172.5 | -148.5 | 1.3 | 111.3 | S7 S8 Q9 V13 L14 S15 I28 F30 | S7-R11 WeakPolarHBondContact O-CB 3.3Å; S7-R11 PolarHBondContact O-N 3.25Å; S8-R11 PolarHBondContact O-N 2.88Å; Q9-R11 VanDerWaalsContact C-N 3.33Å; Q9-R11 PolarHBondContact O-N 3.5Å; R11-V13 PolarHBondContact O-N 3.15Å; R11-L14 PolarHBondContact O-N 2.86Å; R11-S15 WeakPolarHBondContact O-CB 3.47Å; R11-S15 PolarHBondContact O-N 2.85Å; R11-S15 PolarHBondContact O-OG 3.49Å; R11-S15 VanDerWaalsContact O-OG 3.05Å; R11-I28 HydrophobicContact CG-CD1 4.16Å; R11-F30 HydrophobicContact CB-CZ 4.16Å; R11-F30 HydrophobicContact CG-CE2 4.16Å; R11-F30 HydrophobicContact CG-CZ 4.22Å |
| 12 | R | 89.4 | Confident | 83.1 | Confident | 192 Ų | 192 | 72.8 Ų | 72.8 | 73% | 0.725 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -59.6 | -43.2 | 176.4 | -80.4 | -177.2 | 178.1 | 176.1 | 0.8 | 113 | S8 Q9 V10 S15 R16 | S8-R12 WeakPolarHBondContact O-CG 3.32Å; S8-R12 PolarHBondContact O-N 3.06Å; Q9-R12 PolarHBondContact O-N 2.87Å; V10-R12 VanDerWaalsContact C-N 3.35Å; V10-R12 PolarHBondContact O-N 2.81Å; R12-S15 PolarHBondContact O-N 3.28Å; R12-R16 PolarHBondContact O-N 3.06Å |
| 13 | V | 89 | Confident | 84.2 | Confident | 19 Ų | 19 | 73.8 Ų | 73.8 | 12% | 0.115 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -69.8 | -41.1 | -178.5 | 170.5 | 0 | 0 | 0 | 0 | 111.4 | Q9 V10 R11 R16 L17 Q51 T55 | Q9-V13 WeakPolarHBondContact O-CG2 3.33Å; Q9-V13 PolarHBondContact O-N 3.06Å; V10-V13 PolarHBondContact O-N 3.1Å; R11-V13 PolarHBondContact O-N 3.15Å; V13-R16 PolarHBondContact O-N 3.14Å; V13-L17 PolarHBondContact O-N 2.86Å; V13-Q51 HydrophobicContact CG1-CB 3.63Å; V13-Q51 VanDerWaalsContact CG1-O 3.25Å; V13-Q51 WeakPolarHBondContact CG1-O 3.17Å; V13-T55 HydrophobicContact CB-CG2 4.31Å; V13-T55 HydrophobicContact CG2-CG2 3.71Å |
| 14 | L | 87.9 | Confident | 85 | Confident | 0 Ų | 0 | 70.5 Ų | 70.5 | 0% | 0 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -68 | -38.2 | 174.5 | -67 | 175.3 | 0 | 0 | 0 | 112 | V10 R11 R16 L17 N18 I25 I28 V39 I48 | V10-L14 HydrophobicContact CG1-CD1 3.66Å; V10-L14 HydrophobicContact CG1-CG 4.22Å; V10-L14 WeakPolarHBondContact O-CB 3.5Å; V10-L14 WeakPolarHBondContact O-CG 3.35Å; V10-L14 PolarHBondContact O-N 3.48Å; R11-L14 PolarHBondContact O-N 2.86Å; L14-R16 VanDerWaalsContact C-N 3.32Å; L14-R16 PolarHBondContact O-N 2.61Å; L14-L17 VanDerWaalsContact O-CB 3.31Å; L14-L17 WeakPolarHBondContact O-CB 3.32Å; L14-L17 PolarHBondContact O-N 3.49Å; L14-L17 VanDerWaalsContact O-N 3.1Å; L14-N18 PolarHBondContact O-N 3.29Å; L14-N18 VanDerWaalsContact O-N 3.1Å; L14-I25 HydrophobicContact CB-CD1 3.8Å; L14-I25 HydrophobicContact CD2-CD1 4.32Å; L14-I25 WeakPolarHBondContact O-CD1 3.46Å; L14-I28 HydrophobicContact CB-CD1 3.62Å; L14-I28 HydrophobicContact CD1-CD1 3.77Å; L14-I28 HydrophobicContact CD1-CG1 4.07Å; L14-I28 HydrophobicContact CD1-CG2 4.03Å; L14-I28 HydrophobicContact CG-CD1 4.37Å; L14-V39 HydrophobicContact CD1-CG1 4.45Å; L14-V39 HydrophobicContact CD1-CG2 3.59Å; L14-I48 HydrophobicContact CD2-CG2 3.77Å |
| 15 | S | 87.6 | Confident | 85.9 | Confident | 58 Ų | 58 | 65.7 Ų | 65.7 | 41% | 0.406 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -58.6 | -42.5 | 174.4 | -71.8 | 0 | 0 | 0 | 0 | 112 | R11 R12 L17 N18 D19 | R11-S15 WeakPolarHBondContact O-CB 3.47Å; R11-S15 PolarHBondContact O-N 2.85Å; R11-S15 PolarHBondContact O-OG 3.49Å; R11-S15 VanDerWaalsContact O-OG 3.05Å; R12-S15 PolarHBondContact O-N 3.28Å; S15-L17 VanDerWaalsContact C-N 3.28Å; S15-L17 PolarHBondContact O-N 3.21Å; S15-N18 CarbonylContact O-C 3.55Å; S15-N18 WeakPolarHBondContact O-CA 3.43Å; S15-N18 WeakPolarHBondContact O-CB 3.36Å; S15-N18 PolarHBondContact O-N 3Å; S15-D19 PolarHBondContact O-N 3.06Å |
| 16 | R | 87.6 | Confident | 86.3 | Confident | 170 Ų | 170 | 67.6 Ų | 67.6 | 64% | 0.642 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -59.9 | -39.6 | 174.2 | -71.6 | -178.9 | -170 | 179.1 | 1.2 | 112.5 | R12 V13 L14 N18 D19 D20 | R12-R16 PolarHBondContact O-N 3.06Å; V13-R16 PolarHBondContact O-N 3.14Å; L14-R16 VanDerWaalsContact C-N 3.32Å; L14-R16 PolarHBondContact O-N 2.61Å; R16-N18 PolarHBondContact O-N 3.37Å; R16-D19 WeakPolarHBondContact O-CB 3.42Å; R16-D19 PolarHBondContact O-N 3.3Å; R16-D20 PolarHBondContact O-N 3.45Å |
| 17 | L | 86.5 | Confident | 86.8 | Confident | 2 Ų | 2 | 72.2 Ų | 72.2 | 1% | 0.01 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -62.2 | -34.1 | 176.7 | -164.6 | 71.1 | 0 | 0 | 0 | 111.6 | V13 L14 S15 N21 L43 I48 Q51 | V13-L17 PolarHBondContact O-N 2.86Å; L14-L17 VanDerWaalsContact O-CB 3.31Å; L14-L17 WeakPolarHBondContact O-CB 3.32Å; L14-L17 PolarHBondContact O-N 3.49Å; L14-L17 VanDerWaalsContact O-N 3.1Å; S15-L17 VanDerWaalsContact C-N 3.28Å; S15-L17 PolarHBondContact O-N 3.21Å; L17-N21 WeakPolarHBondContact O-CB 3.39Å; L17-N21 PolarHBondContact O-N 2.97Å; L17-N21 PolarHBondContact O-ND2 3.28Å; L17-L43 HydrophobicContact CD1-CD1 4.45Å; L17-L43 HydrophobicContact CD2-CD1 3.26Å; L17-L43 HydrophobicContact CG-CD1 3.56Å; L17-I48 HydrophobicContact CD2-CG1 4.46Å; L17-Q51 HydrophobicContact CB-CG 4.32Å; L17-Q51 HydrophobicContact CD1-CG 3.36Å; L17-Q51 HydrophobicContact CD2-CG 4.24Å; L17-Q51 HydrophobicContact CG-CG 4.17Å |
| 18 | N | 86.2 | Confident | 87.1 | Confident | 48 Ų | 48 | 72.5 Ų | 72.5 | 26% | 0.257 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -75.8 | -27.2 | 172.6 | -170.6 | 67.3 | 0 | 0 | 0 | 113.2 | L14 S15 R16 N21 P22 G23 S24 I25 | L14-N18 PolarHBondContact O-N 3.29Å; L14-N18 VanDerWaalsContact O-N 3.1Å; S15-N18 CarbonylContact O-C 3.55Å; S15-N18 WeakPolarHBondContact O-CA 3.43Å; S15-N18 WeakPolarHBondContact O-CB 3.36Å; S15-N18 PolarHBondContact O-N 3Å; R16-N18 PolarHBondContact O-N 3.37Å; N18-N21 CarbonylContact O-C 3Å; N18-N21 PolarHBondContact O-N 2.87Å; N18-N21 PolarHBondContact OD1-O 3.24Å; N18-P22 WeakPolarHBondContact O-CA 3.48Å; N18-P22 VanDerWaalsContact O-N 3.08Å; N18-G23 PolarHBondContact OD1-N 2.99Å; N18-S24 PolarHBondContact OD1-N 3.3Å; N18-S24 VanDerWaalsContact OD1-N 3.11Å; N18-I25 HydrophobicContact CB-CB 4.2Å; N18-I25 HydrophobicContact CB-CD1 4.32Å; N18-I25 HydrophobicContact CB-CG1 4.18Å; N18-I25 PolarHBondContact OD1-N 3.25Å; N18-I25 VanDerWaalsContact OD1-N 3.11Å |
| 19 | D | 86.7 | Confident | 87.2 | Confident | 128 Ų | 128 | 72.9 Ų | 72.9 | 68% | 0.684 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -68.9 | -43.1 | 170.4 | -73.3 | -48.1 | 0 | 0 | 0 | 111.2 | S15 R16 N21 | S15-D19 PolarHBondContact O-N 3.06Å; R16-D19 WeakPolarHBondContact O-CB 3.42Å; R16-D19 PolarHBondContact O-N 3.3Å; D19-N21 VanDerWaalsContact C-N 3.26Å; D19-N21 PolarHBondContact O-N 2.68Å |
| 20 | D | 85.3 | Confident | 87.3 | Confident | 120 Ų | 120 | 71.6 Ų | 71.6 | 64% | 0.642 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -65.9 | -29.7 | 173.8 | -76.1 | -62.7 | 0 | 0 | 0 | 112 | R16 | R16-D20 PolarHBondContact O-N 3.45Å |
| 21 | N | 84.3 | Confident | 87.2 | Confident | 65 Ų | 65 | 73.4 Ų | 73.4 | 35% | 0.348 | 39% | 0.386 | S | S | . | . | S | Bend | trans | -133 | 81.2 | 179.6 | -64.7 | -91.3 | 0 | 0 | 0 | 110.5 | L17 N18 D19 G23 S24 L43 | L17-N21 WeakPolarHBondContact O-CB 3.39Å; L17-N21 PolarHBondContact O-N 2.97Å; L17-N21 PolarHBondContact O-ND2 3.28Å; N18-N21 CarbonylContact O-C 3Å; N18-N21 PolarHBondContact O-N 2.87Å; N18-N21 PolarHBondContact OD1-O 3.24Å; D19-N21 VanDerWaalsContact C-N 3.26Å; D19-N21 PolarHBondContact O-N 2.68Å; N21-G23 PolarHBondContact O-N 2.82Å; N21-S24 WeakPolarHBondContact CB-OG 3.02Å; N21-S24 WeakPolarHBondContact O-CB 3.4Å; N21-S24 PolarHBondContact O-N 2.79Å; N21-S24 VanDerWaalsContact O-N 3.14Å; N21-S24 PolarHBondContact O-OG 3.01Å; N21-L43 HydrophobicContact CB-CD2 4.44Å |
| 22 | P | 82.9 | Confident | 86.9 | Confident | 117 Ų | 117 | 71.9 Ų | 71.9 | 76% | 0.76 | 39% | 0.387 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.6 | 128.4 | -174.5 | 16.7 | -28.1 | 0 | 0 | 0 | 112.8 | N18 S24 | N18-P22 WeakPolarHBondContact O-CA 3.48Å; N18-P22 VanDerWaalsContact O-N 3.08Å; P22-S24 VanDerWaalsContact C-N 3.34Å |
| 23 | G | 83.5 | Confident | 86.6 | Confident | 52 Ų | 52 | 68.5 Ų | 68.5 | 54% | 0.536 | 39% | 0.39 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 80.6 | 13 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | N18 N21 | N18-G23 PolarHBondContact OD1-N 2.99Å; N21-G23 PolarHBondContact O-N 2.82Å |
| 24 | S | 87.9 | Confident | 86.4 | Confident | 10 Ų | 10 | 70.8 Ų | 70.8 | 7% | 0.07 | 41% | 0.407 | C | S | . | . | trans | -83.9 | -29.2 | -180 | 64.9 | 0 | 0 | 0 | 0 | 112.7 | N18 N21 P22 T41 K42 | N18-S24 PolarHBondContact OD1-N 3.3Å; N18-S24 VanDerWaalsContact OD1-N 3.11Å; N21-S24 WeakPolarHBondContact CB-OG 3.02Å; N21-S24 WeakPolarHBondContact O-CB 3.4Å; N21-S24 PolarHBondContact O-N 2.79Å; N21-S24 VanDerWaalsContact O-N 3.14Å; N21-S24 PolarHBondContact O-OG 3.01Å; P22-S24 VanDerWaalsContact C-N 3.34Å; S24-T41 CarbonylContact O-C 3.5Å; S24-T41 WeakPolarHBondContact O-CA 3.36Å; S24-T41 VanDerWaalsContact O-CB 3.27Å; S24-T41 WeakPolarHBondContact O-CB 3.14Å; S24-T41 PolarHBondContact O-OG1 2.65Å; S24-K42 PolarHBondContact O-N 3.46Å | ||
| 25 | I | 89.8 | Confident | 86.3 | Confident | 25 Ų | 25 | 75 Ų | 75 | 13% | 0.128 | 43% | 0.43 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.8 | 122.5 | 173.6 | -56.3 | -173.4 | 0 | 0 | 0 | 109.6 | L14 N18 I28 V39 | L14-I25 HydrophobicContact CB-CD1 3.8Å; L14-I25 HydrophobicContact CD2-CD1 4.32Å; L14-I25 WeakPolarHBondContact O-CD1 3.46Å; N18-I25 HydrophobicContact CB-CB 4.2Å; N18-I25 HydrophobicContact CB-CD1 4.32Å; N18-I25 HydrophobicContact CB-CG1 4.18Å; N18-I25 PolarHBondContact OD1-N 3.25Å; N18-I25 VanDerWaalsContact OD1-N 3.11Å; I25-I28 HydrophobicContact CG2-CD1 4.15Å; I25-I28 HydrophobicContact CG2-CG1 3.79Å; I25-V39 HydrophobicContact CG2-CG1 4.06Å |
| 26 | A | 88.5 | Confident | 86.2 | Confident | 85 Ų | 85 | 75 Ų | 75 | 70% | 0.702 | 43% | 0.425 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -91.3 | -41.7 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112 | K40 | A26-K40 HydrophobicContact CB-CB 4.31Å; A26-K40 HydrophobicContact CB-CG 4.37Å; A26-K40 PolarHBondContact N-O 2.86Å |
| 27 | E | 89.5 | Confident | 86.2 | Confident | 111 Ų | 111 | 69.7 Ų | 69.7 | 52% | 0.519 | 41% | 0.411 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -154.8 | 147.8 | -175.2 | -167.1 | 175.8 | 76.8 | 0 | 0 | 111.7 | T29 V39 K40 | E27-T29 HydrophobicContact CG-CG2 4.19Å; E27-V39 WeakPolarHBondContact O-CA 3.26Å; E27-K40 HydrophobicContact CB-CB 3.98Å; E27-K40 PolarHBondContact N-O 3.04Å; E27-K40 PolarHBondContact O-N 3.13Å |
| 28 | I | 89.2 | Confident | 86.4 | Confident | 25 Ų | 25 | 73.6 Ų | 73.6 | 13% | 0.128 | 43% | 0.432 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.5 | 118.3 | 172.5 | -54.4 | 165.1 | 0 | 0 | 0 | 107.8 | R11 L14 I25 F30 V37 N38 V39 | R11-I28 HydrophobicContact CG-CD1 4.16Å; L14-I28 HydrophobicContact CB-CD1 3.62Å; L14-I28 HydrophobicContact CD1-CD1 3.77Å; L14-I28 HydrophobicContact CD1-CG1 4.07Å; L14-I28 HydrophobicContact CD1-CG2 4.03Å; L14-I28 HydrophobicContact CG-CD1 4.37Å; I25-I28 HydrophobicContact CG2-CD1 4.15Å; I25-I28 HydrophobicContact CG2-CG1 3.79Å; I28-F30 HydrophobicContact CG2-CD2 4.43Å; I28-F30 HydrophobicContact CG2-CE1 4.38Å; I28-F30 HydrophobicContact CG2-CE2 3.65Å; I28-F30 HydrophobicContact CG2-CZ 3.61Å; I28-V37 HydrophobicContact CG2-CG1 4.12Å; I28-N38 WeakPolarHBondContact CA-O 3.25Å; I28-V39 HydrophobicContact CG1-CG1 4.32Å; I28-V39 HydrophobicContact CG2-CG2 4.45Å |
| 29 | T | 88.7 | Confident | 86.5 | Confident | 61 Ų | 61 | 73.2 Ų | 73.2 | 37% | 0.374 | 43% | 0.431 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.4 | 146 | 175.9 | 47.2 | 0 | 0 | 0 | 0 | 110.8 | E27 N38 | E27-T29 HydrophobicContact CG-CG2 4.19Å; T29-N38 PolarHBondContact N-O 3.41Å; T29-N38 PolarHBondContact O-N 3.17Å; T29-N38 WeakPolarHBondContact OG1-CB 3.5Å |
| 30 | F | 87.3 | Confident | 86.7 | Confident | 56 Ų | 56 | 72.4 Ų | 72.4 | 25% | 0.246 | 42% | 0.421 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.6 | 118 | -177.8 | -62.3 | -88.8 | 0 | 0 | 0 | 108.7 | S7 V10 R11 I28 V37 | S7-F30 VanDerWaalsContact O-CZ 3.32Å; S7-F30 WeakPolarHBondContact O-CZ 3.42Å; V10-F30 HydrophobicContact CB-CE1 4.05Å; V10-F30 HydrophobicContact CB-CZ 4.4Å; V10-F30 HydrophobicContact CG1-CE1 3.95Å; V10-F30 HydrophobicContact CG1-CZ 4.26Å; R11-F30 HydrophobicContact CB-CZ 4.16Å; R11-F30 HydrophobicContact CG-CE2 4.16Å; R11-F30 HydrophobicContact CG-CZ 4.22Å; I28-F30 HydrophobicContact CG2-CD2 4.43Å; I28-F30 HydrophobicContact CG2-CE1 4.38Å; I28-F30 HydrophobicContact CG2-CE2 3.65Å; I28-F30 HydrophobicContact CG2-CZ 3.61Å; F30-V37 HydrophobicContact CD1-CB 4.41Å; F30-V37 HydrophobicContact CD1-CG1 4.13Å; F30-V37 HydrophobicContact CD1-CG2 3.68Å; F30-V37 HydrophobicContact CE1-CB 4.45Å; F30-V37 HydrophobicContact CE1-CG1 3.84Å; F30-V37 HydrophobicContact CE1-CG2 3.8Å; F30-V37 HydrophobicContact CZ-CG1 4.47Å |
| 31 | D | 86.2 | Confident | 87 | Confident | 51 Ų | 51 | 68.4 Ų | 68.4 | 27% | 0.273 | 40% | 0.401 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.5 | 97 | 170.4 | -176 | -24.3 | 0 | 0 | 0 | 107.8 | P33 S34 N35 L36 | D31-P33 WeakPolarHBondContact OD1-CD 3.34Å; D31-P33 WeakPolarHBondContact OD1-CG 3.28Å; D31-S34 VanDerWaalsContact CG-CB 3.45Å; D31-S34 VanDerWaalsContact CG-OG 3.29Å; D31-S34 WeakPolarHBondContact OD1-CB 3.47Å; D31-S34 PolarHBondContact OD1-N 2.96Å; D31-S34 PolarHBondContact OD1-OG 3.18Å; D31-S34 WeakPolarHBondContact OD2-CB 3.49Å; D31-S34 PolarHBondContact OD2-OG 3.05Å; D31-N35 CarbonylContact O-C 3.49Å; D31-N35 VanDerWaalsContact O-CA 3.32Å; D31-N35 WeakPolarHBondContact O-CA 3.43Å; D31-N35 PolarHBondContact O-N 3.49Å; D31-L36 HydrophobicContact CB-CB 4.2Å; D31-L36 PolarHBondContact N-O 2.93Å; D31-L36 PolarHBondContact O-N 3.21Å |
| 32 | M | 81 | Confident | 87.2 | Confident | 115 Ų | 115 | 73.9 Ų | 73.9 | 57% | 0.567 | 42% | 0.422 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.3 | -46.7 | 177.8 | -64.4 | -170.3 | -78.7 | 0 | 0 | 113.7 | T2 S34 N35 | T2-M32 WeakPolarHBondContact OG1-CA 3.49Å; T2-M32 PolarHBondContact OG1-O 3.29Å; M32-S34 VanDerWaalsContact C-N 3.27Å; M32-S34 PolarHBondContact O-N 3.03Å; M32-N35 PolarHBondContact O-N 2.82Å; M32-N35 VanDerWaalsContact O-N 3.14Å |
| 33 | P | 83.4 | Confident | 87.4 | Confident | 121 Ų | 121 | 69.8 Ų | 69.8 | 79% | 0.786 | 39% | 0.393 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.8 | -38.3 | 178.8 | 13.3 | -22 | 0 | 0 | 0 | 112.6 | D31 | D31-P33 WeakPolarHBondContact OD1-CD 3.34Å; D31-P33 WeakPolarHBondContact OD1-CG 3.28Å |
| 34 | S | 84.8 | Confident | 87.5 | Confident | 67 Ų | 67 | 73.2 Ų | 73.2 | 47% | 0.469 | 40% | 0.4 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -87.9 | -4.6 | 178.4 | -49.6 | 0 | 0 | 0 | 0 | 113.8 | D31 M32 L36 | D31-S34 VanDerWaalsContact CG-CB 3.45Å; D31-S34 VanDerWaalsContact CG-OG 3.29Å; D31-S34 WeakPolarHBondContact OD1-CB 3.47Å; D31-S34 PolarHBondContact OD1-N 2.96Å; D31-S34 PolarHBondContact OD1-OG 3.18Å; D31-S34 WeakPolarHBondContact OD2-CB 3.49Å; D31-S34 PolarHBondContact OD2-OG 3.05Å; M32-S34 VanDerWaalsContact C-N 3.27Å; M32-S34 PolarHBondContact O-N 3.03Å; S34-L36 PolarHBondContact O-N 3.34Å |
| 35 | N | 84.7 | Confident | 87.5 | Confident | 89 Ų | 89 | 77.9 Ų | 77.9 | 48% | 0.476 | 42% | 0.418 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 54.1 | 34.2 | -170.7 | -77.2 | -87.3 | 0 | 0 | 0 | 114.3 | M1 T2 D31 M32 | M1-N35 PolarHBondContact N-OD1 3.41Å; T2-N35 HydrophobicContact CG2-CB 4.37Å; T2-N35 PolarHBondContact N-OD1 2.92Å; T2-N35 PolarHBondContact OG1-OD1 3.43Å; T2-N35 VanDerWaalsContact OG1-OD1 3.06Å; D31-N35 CarbonylContact O-C 3.49Å; D31-N35 VanDerWaalsContact O-CA 3.32Å; D31-N35 WeakPolarHBondContact O-CA 3.43Å; D31-N35 PolarHBondContact O-N 3.49Å; M32-N35 PolarHBondContact O-N 2.82Å; M32-N35 VanDerWaalsContact O-N 3.14Å |
| 36 | L | 87.2 | Confident | 87.4 | Confident | 58 Ų | 58 | 82.2 Ų | 82.2 | 30% | 0.304 | 44% | 0.442 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.7 | 146.6 | -177.5 | -63.8 | 173.7 | 0 | 0 | 0 | 112.4 | D31 S34 V62 | D31-L36 HydrophobicContact CB-CB 4.2Å; D31-L36 PolarHBondContact N-O 2.93Å; D31-L36 PolarHBondContact O-N 3.21Å; S34-L36 PolarHBondContact O-N 3.34Å; L36-V62 HydrophobicContact CD2-CB 4.49Å; L36-V62 HydrophobicContact CD2-CG2 3.74Å |
| 37 | V | 87.4 | Confident | 87.3 | Confident | 58 Ų | 58 | 82.8 Ų | 82.8 | 35% | 0.352 | 43% | 0.43 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.2 | 120.2 | 167.7 | -176.7 | 0 | 0 | 0 | 0 | 107.9 | V10 I28 F30 V39 | V10-V37 HydrophobicContact CG1-CG1 4.02Å; V10-V37 HydrophobicContact CG1-CG2 4.43Å; I28-V37 HydrophobicContact CG2-CG1 4.12Å; F30-V37 HydrophobicContact CD1-CB 4.41Å; F30-V37 HydrophobicContact CD1-CG1 4.13Å; F30-V37 HydrophobicContact CD1-CG2 3.68Å; F30-V37 HydrophobicContact CE1-CB 4.45Å; F30-V37 HydrophobicContact CE1-CG1 3.84Å; F30-V37 HydrophobicContact CE1-CG2 3.8Å; F30-V37 HydrophobicContact CZ-CG1 4.47Å; V37-V39 HydrophobicContact CG1-CG2 3.95Å |
| 38 | N | 89.8 | Confident | 87.3 | Confident | 83 Ų | 83 | 78.7 Ų | 78.7 | 44% | 0.444 | 41% | 0.411 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.2 | 125.5 | 176.1 | -67.6 | -50.5 | 0 | 0 | 0 | 108.8 | I28 T29 | I28-N38 WeakPolarHBondContact CA-O 3.25Å; T29-N38 PolarHBondContact N-O 3.41Å; T29-N38 PolarHBondContact O-N 3.17Å; T29-N38 WeakPolarHBondContact OG1-CB 3.5Å |
| 39 | V | 89.4 | Confident | 87.3 | Confident | 40 Ų | 40 | 78.9 Ų | 78.9 | 24% | 0.242 | 41% | 0.412 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.7 | 119.7 | -179.1 | -173.4 | 0 | 0 | 0 | 0 | 108.4 | L14 I25 E27 I28 V37 T41 | L14-V39 HydrophobicContact CD1-CG1 4.45Å; L14-V39 HydrophobicContact CD1-CG2 3.59Å; I25-V39 HydrophobicContact CG2-CG1 4.06Å; E27-V39 WeakPolarHBondContact O-CA 3.26Å; I28-V39 HydrophobicContact CG1-CG1 4.32Å; I28-V39 HydrophobicContact CG2-CG2 4.45Å; V37-V39 HydrophobicContact CG1-CG2 3.95Å; V39-T41 HydrophobicContact CG1-CG2 3.9Å |
| 40 | K | 91 | Very high | 87.3 | Confident | 112 Ų | 112 | 79 Ų | 79 | 49% | 0.487 | 42% | 0.416 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.7 | 110.6 | 172.2 | -158.8 | 174.1 | -171.9 | 177.5 | 0 | 108 | A26 E27 S67 | A26-K40 HydrophobicContact CB-CB 4.31Å; A26-K40 HydrophobicContact CB-CG 4.37Å; A26-K40 PolarHBondContact N-O 2.86Å; E27-K40 HydrophobicContact CB-CB 3.98Å; E27-K40 PolarHBondContact N-O 3.04Å; E27-K40 PolarHBondContact O-N 3.13Å; K40-S67 WeakPolarHBondContact CE-OG 3.14Å |
| 41 | T | 90.6 | Very high | 87.3 | Confident | 35 Ų | 35 | 77.9 Ų | 77.9 | 22% | 0.215 | 41% | 0.411 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -151.4 | 155.7 | -172.3 | 178.5 | 0 | 0 | 0 | 0 | 112.3 | S24 V39 L43 I48 | S24-T41 CarbonylContact O-C 3.5Å; S24-T41 WeakPolarHBondContact O-CA 3.36Å; S24-T41 VanDerWaalsContact O-CB 3.27Å; S24-T41 WeakPolarHBondContact O-CB 3.14Å; S24-T41 PolarHBondContact O-OG1 2.65Å; V39-T41 HydrophobicContact CG1-CG2 3.9Å; T41-L43 VanDerWaalsContact C-N 3.31Å; T41-L43 HydrophobicContact CG2-CB 4.38Å; T41-L43 WeakPolarHBondContact OG1-CB 3.43Å; T41-L43 WeakPolarHBondContact OG1-CG 3.43Å; T41-L43 PolarHBondContact OG1-N 3.23Å; T41-I48 HydrophobicContact CG2-CD1 3.37Å; T41-I48 HydrophobicContact CG2-CG1 4.28Å |
| 42 | K | 88.6 | Confident | 87.3 | Confident | 181 Ų | 181 | 76.6 Ų | 76.6 | 79% | 0.787 | 40% | 0.404 | S | S | * | . | S | Bend | trans | -86.1 | -2.9 | 170.6 | -61.3 | 179 | -179.1 | 174.7 | 0 | 112.6 | S24 | S24-K42 PolarHBondContact O-N 3.46Š|
| 43 | L | 86.4 | Confident | 87.5 | Confident | 30 Ų | 30 | 77.3 Ų | 77.3 | 16% | 0.157 | 41% | 0.406 | C | S | . | . | S | Bend | trans | -84 | 150.5 | -178.5 | -61.1 | 173.3 | 0 | 0 | 0 | 111.5 | L17 N21 T41 Q47 I48 | L17-L43 HydrophobicContact CD1-CD1 4.45Å; L17-L43 HydrophobicContact CD2-CD1 3.26Å; L17-L43 HydrophobicContact CG-CD1 3.56Å; N21-L43 HydrophobicContact CB-CD2 4.44Å; T41-L43 VanDerWaalsContact C-N 3.31Å; T41-L43 HydrophobicContact CG2-CB 4.38Å; T41-L43 WeakPolarHBondContact OG1-CB 3.43Å; T41-L43 WeakPolarHBondContact OG1-CG 3.43Å; T41-L43 PolarHBondContact OG1-N 3.23Å; L43-Q47 HydrophobicContact CB-CB 4.33Å; L43-I48 HydrophobicContact CB-CG1 4.28Å |
| 44 | N | 87.3 | Confident | 87.5 | Confident | 125 Ų | 125 | 78 Ų | 78 | 67% | 0.668 | 40% | 0.397 | S | S | * | . | trans | -74 | 152.6 | 174.4 | -66.4 | -11.5 | 0 | 0 | 0 | 111 | D46 Q47 I48 | N44-D46 VanDerWaalsContact C-N 3.26Å; N44-D46 PolarHBondContact O-N 3.07Å; N44-D46 VanDerWaalsContact O-N 3.13Å; N44-Q47 WeakPolarHBondContact O-CB 3.27Å; N44-Q47 PolarHBondContact O-N 3.49Å; N44-I48 PolarHBondContact O-N 2.88Å | ||
| 45 | K | 86.7 | Confident | 87.3 | Confident | 107 Ų | 107 | 75.5 Ų | 75.5 | 47% | 0.465 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -39.9 | -50.9 | 175.5 | 158.6 | -174.5 | 159.2 | -176.5 | 0 | 113.4 | Q47 I48 M49 Y61 | K45-Q47 VanDerWaalsContact C-N 3.33Å; K45-Q47 PolarHBondContact O-N 3.39Å; K45-I48 PolarHBondContact O-N 3.44Å; K45-M49 HydrophobicContact CG-CG 4.26Å; K45-M49 WeakPolarHBondContact O-CB 3.42Å; K45-M49 WeakPolarHBondContact O-CG 3.2Å; K45-M49 PolarHBondContact O-N 2.88Å; K45-Y61 HydrophobicContact CB-CE2 4.47Å; K45-Y61 HydrophobicContact CD-CD1 4.22Å; K45-Y61 HydrophobicContact CD-CD2 4.26Å; K45-Y61 HydrophobicContact CD-CE1 4.39Å; K45-Y61 HydrophobicContact CD-CE2 4.42Å; K45-Y61 HydrophobicContact CD-CG 4.12Å; K45-Y61 HydrophobicContact CG-CD2 4.16Å; K45-Y61 HydrophobicContact CG-CE2 4.45Å; K45-Y61 HydrophobicContact CG-CG 4.38Å |
| 46 | D | 87.4 | Confident | 87 | Confident | 116 Ų | 116 | 77.1 Ų | 77.1 | 62% | 0.62 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -62.5 | -37.6 | -174.6 | -77.2 | -88.8 | 0 | 0 | 0 | 113.4 | N44 I48 M49 S50 | N44-D46 VanDerWaalsContact C-N 3.26Å; N44-D46 PolarHBondContact O-N 3.07Å; N44-D46 VanDerWaalsContact O-N 3.13Å; D46-I48 VanDerWaalsContact C-N 3.35Å; D46-I48 PolarHBondContact O-N 3.35Å; D46-M49 PolarHBondContact O-N 3.24Å; D46-S50 WeakPolarHBondContact O-CB 3.44Å; D46-S50 PolarHBondContact O-N 3.22Å |
| 47 | Q | 87.7 | Confident | 86.6 | Confident | 97 Ų | 97 | 76.9 Ų | 76.9 | 45% | 0.453 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -62.9 | -44.4 | 177.4 | -70.4 | -91.4 | -43.2 | 0 | 0 | 110.8 | L43 N44 K45 Q51 | L43-Q47 HydrophobicContact CB-CB 4.33Å; N44-Q47 WeakPolarHBondContact O-CB 3.27Å; N44-Q47 PolarHBondContact O-N 3.49Å; K45-Q47 VanDerWaalsContact C-N 3.33Å; K45-Q47 PolarHBondContact O-N 3.39Å; Q47-Q51 PolarHBondContact O-N 2.93Å |
| 48 | I | 88.9 | Confident | 86.3 | Confident | 25 Ų | 25 | 79.8 Ų | 79.8 | 13% | 0.128 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -68.3 | -48.7 | 179.2 | -51.9 | 172.2 | 0 | 0 | 0 | 110.1 | L14 L17 T41 L43 N44 K45 D46 S50 Q51 L52 | L14-I48 HydrophobicContact CD2-CG2 3.77Å; L17-I48 HydrophobicContact CD2-CG1 4.46Å; T41-I48 HydrophobicContact CG2-CD1 3.37Å; T41-I48 HydrophobicContact CG2-CG1 4.28Å; L43-I48 HydrophobicContact CB-CG1 4.28Å; N44-I48 PolarHBondContact O-N 2.88Å; K45-I48 PolarHBondContact O-N 3.44Å; D46-I48 VanDerWaalsContact C-N 3.35Å; D46-I48 PolarHBondContact O-N 3.35Å; I48-S50 VanDerWaalsContact C-N 3.35Å; I48-S50 PolarHBondContact O-N 3.39Å; I48-Q51 PolarHBondContact O-N 3.05Å; I48-L52 HydrophobicContact CG2-CD1 3.87Å; I48-L52 HydrophobicContact CG2-CG 4.33Å; I48-L52 WeakPolarHBondContact O-CG 3.46Å; I48-L52 PolarHBondContact O-N 3.06Å |
| 49 | M | 88.2 | Confident | 86 | Confident | 29 Ų | 29 | 78.3 Ų | 78.3 | 14% | 0.143 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -61.5 | -42.3 | -178.5 | -80.9 | -98.2 | 62.3 | 0 | 0 | 111.9 | K45 D46 Q51 L52 Q53 C59 | K45-M49 HydrophobicContact CG-CG 4.26Å; K45-M49 WeakPolarHBondContact O-CB 3.42Å; K45-M49 WeakPolarHBondContact O-CG 3.2Å; K45-M49 PolarHBondContact O-N 2.88Å; D46-M49 PolarHBondContact O-N 3.24Å; M49-Q51 VanDerWaalsContact C-N 3.28Å; M49-Q51 PolarHBondContact O-N 2.88Å; M49-L52 HydrophobicContact CE-CB 4.28Å; M49-L52 HydrophobicContact CE-CD1 4.29Å; M49-L52 PolarHBondContact O-N 3.48Å; M49-Q53 WeakPolarHBondContact O-CB 3.47Å; M49-Q53 VanDerWaalsContact O-CG 3.28Å; M49-Q53 WeakPolarHBondContact O-CG 3.31Å; M49-Q53 PolarHBondContact O-N 3.11Å; M49-C59 HydrophobicContact CE-CB 3.74Å |
| 50 | S | 88.6 | Confident | 85.9 | Confident | 65 Ų | 65 | 84.6 Ų | 84.6 | 46% | 0.455 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -60.2 | -38.2 | 177.8 | -173 | 0 | 0 | 0 | 0 | 112.1 | D46 I48 | D46-S50 WeakPolarHBondContact O-CB 3.44Å; D46-S50 PolarHBondContact O-N 3.22Å; I48-S50 VanDerWaalsContact C-N 3.35Å; I48-S50 PolarHBondContact O-N 3.39Å |
| 51 | Q | 87.1 | Confident | 85.8 | Confident | 31 Ų | 31 | 83.4 Ų | 83.4 | 15% | 0.145 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -73.3 | -44.2 | 174.9 | -65.7 | -63.3 | -12.1 | 0 | 0 | 112.2 | V13 L17 Q47 I48 M49 Q53 K54 | V13-Q51 HydrophobicContact CG1-CB 3.63Å; V13-Q51 VanDerWaalsContact CG1-O 3.25Å; V13-Q51 WeakPolarHBondContact CG1-O 3.17Å; L17-Q51 HydrophobicContact CB-CG 4.32Å; L17-Q51 HydrophobicContact CD1-CG 3.36Å; L17-Q51 HydrophobicContact CD2-CG 4.24Å; L17-Q51 HydrophobicContact CG-CG 4.17Å; Q47-Q51 PolarHBondContact O-N 2.93Å; I48-Q51 PolarHBondContact O-N 3.05Å; M49-Q51 VanDerWaalsContact C-N 3.28Å; M49-Q51 PolarHBondContact O-N 2.88Å; Q51-Q53 PolarHBondContact O-N 3.47Å; Q51-K54 VanDerWaalsContact O-CB 3.26Å; Q51-K54 WeakPolarHBondContact O-CB 3.43Å; Q51-K54 PolarHBondContact O-N 3.19Å; Q51-K54 VanDerWaalsContact OE1-CE 3.31Å |
| 52 | L | 86.4 | Confident | 85.6 | Confident | 25 Ų | 25 | 86.4 Ų | 86.4 | 13% | 0.131 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -59.2 | -36.4 | 177.7 | -74 | 173.2 | 0 | 0 | 0 | 112 | V10 I48 M49 K54 T55 C59 | V10-L52 HydrophobicContact CB-CD2 4.42Å; V10-L52 HydrophobicContact CG1-CD2 3.75Å; V10-L52 HydrophobicContact CG2-CD2 4.14Å; I48-L52 HydrophobicContact CG2-CD1 3.87Å; I48-L52 HydrophobicContact CG2-CG 4.33Å; I48-L52 WeakPolarHBondContact O-CG 3.46Å; I48-L52 PolarHBondContact O-N 3.06Å; M49-L52 HydrophobicContact CE-CB 4.28Å; M49-L52 HydrophobicContact CE-CD1 4.29Å; M49-L52 PolarHBondContact O-N 3.48Å; L52-K54 PolarHBondContact O-N 3.34Å; L52-T55 WeakPolarHBondContact O-CB 3.45Å; L52-T55 PolarHBondContact O-N 3.1Å; L52-T55 PolarHBondContact O-OG1 3.1Å; L52-C59 HydrophobicContact CB-CB 4.45Å |
| 53 | Q | 85.1 | Confident | 85.5 | Confident | 129 Ų | 129 | 82.2 Ų | 82.2 | 60% | 0.603 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -60.7 | -27.8 | 174.7 | -76.8 | 175.9 | -9.9 | 0 | 0 | 112.9 | M49 Q51 T55 C56 | M49-Q53 WeakPolarHBondContact O-CB 3.47Å; M49-Q53 VanDerWaalsContact O-CG 3.28Å; M49-Q53 WeakPolarHBondContact O-CG 3.31Å; M49-Q53 PolarHBondContact O-N 3.11Å; Q51-Q53 PolarHBondContact O-N 3.47Å; Q53-T55 PolarHBondContact O-N 3.37Å; Q53-C56 PolarHBondContact O-N 3.31Å |
| 54 | K | 84.5 | Confident | 85.4 | Confident | 136 Ų | 136 | 85 Ų | 85 | 59% | 0.591 | 46% | 0.462 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.8 | -14.2 | 174.3 | -59.5 | -178.7 | -174.1 | 168.1 | 0 | 113.6 | Q51 L52 C56 | Q51-K54 VanDerWaalsContact O-CB 3.26Å; Q51-K54 WeakPolarHBondContact O-CB 3.43Å; Q51-K54 PolarHBondContact O-N 3.19Å; Q51-K54 VanDerWaalsContact OE1-CE 3.31Å; L52-K54 PolarHBondContact O-N 3.34Å; K54-C56 PolarHBondContact O-N 2.93Å |
| 55 | T | 81.3 | Confident | 85.1 | Confident | 14 Ų | 14 | 89.8 Ų | 89.8 | 9% | 0.086 | 47% | 0.47 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -73.7 | -6.1 | 172.2 | 67.2 | 0 | 0 | 0 | 0 | 112.8 | Q9 V13 L52 Q53 K57 | Q9-T55 HydrophobicContact CG-CG2 4.21Å; V13-T55 HydrophobicContact CB-CG2 4.31Å; V13-T55 HydrophobicContact CG2-CG2 3.71Å; L52-T55 WeakPolarHBondContact O-CB 3.45Å; L52-T55 PolarHBondContact O-N 3.1Å; L52-T55 PolarHBondContact O-OG1 3.1Å; Q53-T55 PolarHBondContact O-N 3.37Å; T55-K57 PolarHBondContact O-N 3.4Å; T55-K57 VanDerWaalsContact O-N 3.14Å; T55-K57 PolarHBondContact OG1-N 3.44Å |
| 56 | C | 77 | Confident | 84.3 | Confident | 123 Ų | 123 | 89.6 Ų | 89.6 | 83% | 0.831 | 48% | 0.48 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.7 | 23.3 | -172.7 | -60.6 | 0 | 0 | 0 | 0 | 113.2 | Q53 K54 | Q53-C56 PolarHBondContact O-N 3.31Å; K54-C56 PolarHBondContact O-N 2.93Å |
| 57 | K | 80.1 | Confident | 83 | Confident | 53 Ų | 53 | 88.1 Ų | 88.1 | 23% | 0.23 | 48% | 0.479 | C | S | . | . | S | Bend | trans | -105.5 | 145.3 | 177.8 | -70 | 175.1 | 178.1 | 170.8 | 0 | 110.4 | C6 T55 C59 | C6-K57 PolarHBondContact SG-NZ 3.14Å; T55-K57 PolarHBondContact O-N 3.4Å; T55-K57 VanDerWaalsContact O-N 3.14Å; T55-K57 PolarHBondContact OG1-N 3.44Å; K57-C59 PolarHBondContact O-N 3.11Å; K57-C59 PolarHBondContact O-SG 2.6Å |
| 58 | P | 80.4 | Confident | 81.4 | Confident | 120 Ų | 120 | 93.1 Ų | 93.1 | 78% | 0.779 | 52% | 0.516 | S | S | * | . | trans | -66.5 | 117.8 | 172.6 | 27 | -31.7 | 0 | 0 | 0 | 109 | ||||
| 59 | C | 84 | Confident | 81.1 | Confident | 52 Ų | 52 | 96.6 Ų | 96.6 | 35% | 0.351 | 54% | 0.535 | S | S | . | . | trans | -131.2 | 131.1 | -179.9 | -55.7 | 0 | 0 | 0 | 0 | 107.5 | M49 L52 K57 | M49-C59 HydrophobicContact CE-CB 3.74Å; L52-C59 HydrophobicContact CB-CB 4.45Å; K57-C59 PolarHBondContact O-N 3.11Å; K57-C59 PolarHBondContact O-SG 2.6Å | ||
| 60 | E | 86.4 | Confident | 80.7 | Confident | 172 Ų | 172 | 100.1 Ų | 100.1 | 80% | 0.804 | 56% | 0.556 | S | S | * | * | trans | -119.9 | 143.1 | 173.7 | -169.5 | 174.9 | 103.9 | 0 | 0 | 109.8 | V62 | E60-V62 PolarHBondContact O-N 3.3Š| ||
| 61 | Y | 88.1 | Confident | 80.2 | Confident | 86 Ų | 86 | 102.1 Ų | 102.1 | 34% | 0.337 | 56% | 0.561 | S | S | . | * | trans | -78.4 | 118.4 | 170.9 | 169.2 | -93 | 0 | 0 | 0 | 109.5 | K45 S63 S64 | K45-Y61 HydrophobicContact CB-CE2 4.47Å; K45-Y61 HydrophobicContact CD-CD1 4.22Å; K45-Y61 HydrophobicContact CD-CD2 4.26Å; K45-Y61 HydrophobicContact CD-CE1 4.39Å; K45-Y61 HydrophobicContact CD-CE2 4.42Å; K45-Y61 HydrophobicContact CD-CG 4.12Å; K45-Y61 HydrophobicContact CG-CD2 4.16Å; K45-Y61 HydrophobicContact CG-CE2 4.45Å; K45-Y61 HydrophobicContact CG-CG 4.38Å; Y61-S63 WeakPolarHBondContact CE2-O 3.48Å; Y61-S64 WeakPolarHBondContact OH-CA 3.45Å; Y61-S64 WeakPolarHBondContact OH-CB 3.09Å; Y61-S64 PolarHBondContact OH-N 3.48Å; Y61-S64 PolarHBondContact OH-OG 3.5Å | ||
| 62 | V | 86.4 | Confident | 79.8 | Confident | 98 Ų | 98 | 106.2 Ų | 106.2 | 59% | 0.594 | 59% | 0.586 | S | S | * | * | trans | -88.4 | -53.7 | -177.4 | -178.2 | 0 | 0 | 0 | 0 | 111.6 | L36 E60 | L36-V62 HydrophobicContact CD2-CB 4.49Å; L36-V62 HydrophobicContact CD2-CG2 3.74Å; E60-V62 PolarHBondContact O-N 3.3Å | ||
| 63 | S | 87.4 | Confident | 79.4 | Confident | 94 Ų | 94 | 111.3 Ų | 111.3 | 66% | 0.657 | 61% | 0.614 | S | S | * | * | trans | -164.5 | 164.5 | 178.6 | 63.2 | 0 | 0 | 0 | 0 | 111 | Y61 | Y61-S63 WeakPolarHBondContact CE2-O 3.48Š| ||
| 64 | S | 85.3 | Confident | 79.1 | Confident | 89 Ų | 89 | 110.1 Ų | 110.1 | 62% | 0.622 | 62% | 0.615 | S | S | * | * | trans | -130.7 | 145.4 | 163.8 | 63.1 | 0 | 0 | 0 | 0 | 108 | Y61 | Y61-S64 WeakPolarHBondContact OH-CA 3.45Å; Y61-S64 WeakPolarHBondContact OH-CB 3.09Å; Y61-S64 PolarHBondContact OH-N 3.48Å; Y61-S64 PolarHBondContact OH-OG 3.5Å | ||
| 65 | R | 79 | Confident | 78.7 | Confident | 224 Ų | 224 | 108.3 Ų | 108.3 | 85% | 0.845 | 62% | 0.617 | S | S | * | * | trans | -122.3 | 130.6 | 172.1 | -160.6 | 172.9 | -175.9 | 138.4 | 0.2 | 107.3 | S67 | R65-S67 PolarHBondContact O-N 3.01Š| ||
| 66 | P | 71.5 | Confident | 78.5 | Confident | 104 Ų | 104 | 115.5 Ų | 115.5 | 68% | 0.675 | 66% | 0.657 | S | S | * | * | trans | -58 | 131.5 | 172.7 | 21.6 | -28.9 | 0 | 0 | 0 | 108.4 | V68 | P66-V68 PolarHBondContact O-N 3.43Š| ||
| 67 | S | 60 | Low | 78.6 | Confident | 85 Ų | 85 | 114.9 Ų | 114.9 | 59% | 0.594 | 64% | 0.643 | S | S | * | * | trans | -72.5 | 91.3 | 167.1 | -65.5 | 0 | 0 | 0 | 0 | 106.4 | K40 R65 | K40-S67 WeakPolarHBondContact CE-OG 3.14Å; R65-S67 PolarHBondContact O-N 3.01Å | ||
| 68 | V | 54.5 | Low | 78.4 | Confident | 202 Ų | 202 | 120.5 Ų | 120.5 | 100% | 1.224 | 68% | 0.68 | S | S | * | * | trans | -62.5 | 0 | 170 | -114.2 | 0 | 0 | 0 | 0 | 110.4 | P66 | P66-V68 PolarHBondContact O-N 3.43Š|
Retrieved 68 of 68 residues in 15.3 ms
(Link to these results)