| 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 | 44.9 | Very low | 75.4 | Confident | 241 Ų | 241 | 123.3 Ų | 123.3 | 100% | 1.187 | 65% | 0.649 | S | S | * | * | 0 | 102.2 | 0 | -69.6 | 165 | 80.7 | 0 | 0 | 107.8 | G3 | M1-G3 PolarHBondContact O-N 2.84Å; M1-G3 VanDerWaalsContact O-N 3.1Å | |||
| 2 | S | 55.5 | Low | 76.6 | Confident | 131 Ų | 131 | 120.9 Ų | 120.9 | 92% | 0.916 | 63% | 0.632 | S | S | * | * | trans | -72.7 | 104.4 | 178.1 | -156 | 0 | 0 | 0 | 0 | 107.6 | T4 | S2-T4 PolarHBondContact O-N 3.41Š| ||
| 3 | G | 60.1 | Low | 77.5 | Confident | 61 Ų | 61 | 126.5 Ų | 126.5 | 63% | 0.629 | 64% | 0.64 | S | S | * | * | trans | -55.3 | 137.2 | 179.9 | 0 | 0 | 0 | 0 | 0 | 110 | M1 N5 | M1-G3 PolarHBondContact O-N 2.84Å; M1-G3 VanDerWaalsContact O-N 3.1Å; G3-N5 PolarHBondContact O-N 3.3Å | ||
| 4 | T | 67.3 | Low | 78.5 | Confident | 77 Ų | 77 | 126.7 Ų | 126.7 | 47% | 0.472 | 64% | 0.639 | S | S | . | * | trans | -50.1 | 104.8 | 178.3 | -41.9 | 0 | 0 | 0 | 0 | 109.4 | S2 T8 R9 | S2-T4 PolarHBondContact O-N 3.41Å; T4-T8 HydrophobicContact CG2-CG2 3.71Å; T4-R9 HydrophobicContact CG2-CG 3.61Å; T4-R9 PolarHBondContact O-NE 3.43Å | ||
| 5 | N | 82.6 | Confident | 79.5 | Confident | 88 Ų | 88 | 129.2 Ų | 129.2 | 47% | 0.471 | 64% | 0.638 | S | S | . | * | trans | -64.1 | 160.7 | -178.3 | 69.3 | 47.2 | 0 | 0 | 0 | 109.8 | G3 W7 T8 R9 | G3-N5 PolarHBondContact O-N 3.3Å; N5-W7 PolarHBondContact O-N 3.18Å; N5-W7 VanDerWaalsContact O-N 3.11Å; N5-W7 WeakPolarHBondContact OD1-CA 3.36Å; N5-W7 VanDerWaalsContact OD1-CB 3.26Å; N5-W7 WeakPolarHBondContact OD1-CB 3.42Å; N5-W7 PolarHBondContact OD1-N 3.42Å; N5-W7 VanDerWaalsContact OD1-N 3.12Å; N5-T8 PolarHBondContact O-N 3.33Å; N5-T8 PolarHBondContact OD1-N 3.46Å; N5-T8 PolarHBondContact OD1-OG1 3.48Å; N5-T8 VanDerWaalsContact OD1-OG1 3.1Å; N5-R9 PolarHBondContact O-N 3.13Å | ||
| 6 | V | 81.4 | Confident | 80.3 | Confident | 110 Ų | 110 | 126.8 Ų | 126.8 | 67% | 0.667 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -55.2 | -35.1 | -174.4 | -178.2 | 0 | 0 | 0 | 0 | 111.5 | R9 S10 | V6-R9 PolarHBondContact O-N 3.26Å; V6-S10 WeakPolarHBondContact O-CB 3.37Å; V6-S10 PolarHBondContact O-N 3.46Å; V6-S10 PolarHBondContact O-OG 3.45Å; V6-S10 VanDerWaalsContact O-OG 3.11Å |
| 7 | W | 85.1 | Confident | 81 | Confident | 203 Ų | 203 | 124.4 Ų | 124.4 | 77% | 0.769 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -64.5 | -43 | 178.3 | -59.6 | 101.8 | 0 | 0 | 0 | 112.8 | N5 S10 R11 | N5-W7 PolarHBondContact O-N 3.18Å; N5-W7 VanDerWaalsContact O-N 3.11Å; N5-W7 WeakPolarHBondContact OD1-CA 3.36Å; N5-W7 VanDerWaalsContact OD1-CB 3.26Å; N5-W7 WeakPolarHBondContact OD1-CB 3.42Å; N5-W7 PolarHBondContact OD1-N 3.42Å; N5-W7 VanDerWaalsContact OD1-N 3.12Å; W7-S10 PolarHBondContact O-N 2.76Å; W7-R11 WeakPolarHBondContact O-CB 2.99Å; W7-R11 PolarHBondContact O-N 2.93Å |
| 8 | T | 87.6 | Confident | 81.8 | Confident | 72 Ų | 72 | 122.3 Ų | 122.3 | 44% | 0.442 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -65 | -41.2 | 178.4 | -47.2 | 0 | 0 | 0 | 0 | 111.1 | T4 N5 E12 | T4-T8 HydrophobicContact CG2-CG2 3.71Å; N5-T8 PolarHBondContact O-N 3.33Å; N5-T8 PolarHBondContact OD1-N 3.46Å; N5-T8 PolarHBondContact OD1-OG1 3.48Å; N5-T8 VanDerWaalsContact OD1-OG1 3.1Å; T8-E12 PolarHBondContact O-N 3.34Å; T8-E12 VanDerWaalsContact O-N 3.12Å |
| 9 | R | 85.8 | Confident | 82.5 | Confident | 159 Ų | 159 | 122.7 Ų | 122.7 | 60% | 0.6 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -66 | -44.7 | 177.2 | -61.3 | -173.8 | -176.9 | -142 | -4.1 | 112.4 | T4 N5 V6 R11 E12 R13 | T4-R9 HydrophobicContact CG2-CG 3.61Å; T4-R9 PolarHBondContact O-NE 3.43Å; N5-R9 PolarHBondContact O-N 3.13Å; V6-R9 PolarHBondContact O-N 3.26Å; R9-R11 VanDerWaalsContact C-N 3.35Å; R9-E12 PolarHBondContact O-N 2.93Å; R9-R13 WeakPolarHBondContact O-CG 3.46Å; R9-R13 PolarHBondContact O-N 2.04Å; R9-R13 VanDerWaalsContact O-N 3.11Å |
| 10 | S | 88.3 | Confident | 83.1 | Confident | 56 Ų | 56 | 117.5 Ų | 117.5 | 39% | 0.392 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -63.6 | -41 | 178.5 | -66.2 | 0 | 0 | 0 | 0 | 111.9 | V6 W7 E12 R13 M14 | V6-S10 WeakPolarHBondContact O-CB 3.37Å; V6-S10 PolarHBondContact O-N 3.46Å; V6-S10 PolarHBondContact O-OG 3.45Å; V6-S10 VanDerWaalsContact O-OG 3.11Å; W7-S10 PolarHBondContact O-N 2.76Å; S10-E12 PolarHBondContact O-N 3.2Å; S10-R13 PolarHBondContact O-N 3.22Å; S10-M14 WeakPolarHBondContact O-CG 3.39Å; S10-M14 PolarHBondContact O-N 3.39Å |
| 11 | R | 91.1 | Very high | 83.7 | Confident | 158 Ų | 158 | 115.9 Ų | 115.9 | 60% | 0.596 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -64 | -41.1 | 177.6 | -164.6 | -179.4 | -61.8 | -89.8 | 2.3 | 111.8 | W7 R9 M14 R15 | W7-R11 WeakPolarHBondContact O-CB 2.99Å; W7-R11 PolarHBondContact O-N 2.93Å; R9-R11 VanDerWaalsContact C-N 3.35Å; R11-M14 PolarHBondContact O-N 2.76Å; R11-R15 PolarHBondContact O-N 2.99Å |
| 12 | E | 89.8 | Confident | 86.1 | Confident | 95 Ų | 95 | 107.4 Ų | 107.4 | 44% | 0.444 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -65.1 | -38.8 | 177.5 | -165.4 | 56 | -150.3 | 0 | 0 | 112.3 | T8 R9 S10 M14 R15 | T8-E12 PolarHBondContact O-N 3.34Å; T8-E12 VanDerWaalsContact O-N 3.12Å; R9-E12 PolarHBondContact O-N 2.93Å; S10-E12 PolarHBondContact O-N 3.2Å; E12-M14 PolarHBondContact O-N 2.99Å; E12-R15 PolarHBondContact O-N 3.25Å; E12-R15 IonicContact OE2-CZ 3.89Å; E12-R15 IonicContact OE2-NH1 2.85Å; E12-R15 PolarHBondContact OE2-NH1 3.48Å |
| 13 | R | 88.4 | Confident | 88.1 | Confident | 194 Ų | 194 | 106.6 Ų | 106.6 | 73% | 0.732 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -62 | -43.2 | 172.5 | -72 | 175.2 | 66.5 | -170.6 | 1 | 112.2 | R9 S10 R15 R16 | R9-R13 WeakPolarHBondContact O-CG 3.46Å; R9-R13 PolarHBondContact O-N 2.04Å; R9-R13 VanDerWaalsContact O-N 3.11Å; S10-R13 PolarHBondContact O-N 3.22Å; R13-R15 VanDerWaalsContact C-N 3.32Å; R13-R15 PolarHBondContact O-N 3.09Å; R13-R16 PolarHBondContact O-N 2.72Å |
| 14 | M | 91.1 | Very high | 89.9 | Confident | 129 Ų | 129 | 103.7 Ų | 103.7 | 64% | 0.635 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -66.1 | -33.1 | 178.7 | -72.2 | -59.1 | -64 | 0 | 0 | 112.7 | S10 R11 E12 R16 F17 | S10-M14 WeakPolarHBondContact O-CG 3.39Å; S10-M14 PolarHBondContact O-N 3.39Å; R11-M14 PolarHBondContact O-N 2.76Å; E12-M14 PolarHBondContact O-N 2.99Å; M14-R16 PolarHBondContact O-N 3.28Å; M14-F17 VanDerWaalsContact O-CB 3.25Å; M14-F17 WeakPolarHBondContact O-CB 3.47Å; M14-F17 PolarHBondContact O-N 2.82Å; M14-F17 VanDerWaalsContact O-N 3.09Å |
| 15 | R | 92.9 | Very high | 91.3 | Very high | 164 Ų | 164 | 103.7 Ų | 103.7 | 62% | 0.619 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -60.2 | -31 | 175.4 | -78 | 179.1 | 176 | 147.4 | -6.6 | 113.4 | R11 E12 R13 F17 P18 | R11-R15 PolarHBondContact O-N 2.99Å; E12-R15 PolarHBondContact O-N 3.25Å; E12-R15 IonicContact OE2-CZ 3.89Å; E12-R15 IonicContact OE2-NH1 2.85Å; E12-R15 PolarHBondContact OE2-NH1 3.48Å; R13-R15 VanDerWaalsContact C-N 3.32Å; R13-R15 PolarHBondContact O-N 3.09Å; R15-F17 VanDerWaalsContact C-N 3.33Å; R15-P18 WeakPolarHBondContact O-CD 3.48Å |
| 16 | R | 92.3 | Very high | 92.1 | Very high | 91 Ų | 91 | 102 Ų | 102 | 34% | 0.343 | 49% | 0.494 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80.5 | -14.6 | 178.5 | -61.9 | 175 | 63.2 | -177.5 | 3.5 | 113.2 | R13 M14 E19 L20 G68 | R13-R16 PolarHBondContact O-N 2.72Å; M14-R16 PolarHBondContact O-N 3.28Å; R16-E19 PolarHBondContact O-N 2.91Å; R16-L20 HydrophobicContact CB-CD1 4.4Å; R16-L20 WeakPolarHBondContact O-CG 3.33Å; R16-L20 PolarHBondContact O-N 3.41Å; R16-L20 VanDerWaalsContact O-N 3.11Å; R16-G68 PolarHBondContact NH1-O 3.49Å; R16-G68 PolarHBondContact NH2-O 2.85Å |
| 17 | F | 93.1 | Very high | 92.9 | Very high | 86 Ų | 86 | 100.1 Ų | 100.1 | 38% | 0.377 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -59.3 | -43.6 | -174.2 | -177.4 | -97.1 | 0 | 0 | 0 | 113.9 | M14 R15 E19 L20 F21 I61 | M14-F17 VanDerWaalsContact O-CB 3.25Å; M14-F17 WeakPolarHBondContact O-CB 3.47Å; M14-F17 PolarHBondContact O-N 2.82Å; M14-F17 VanDerWaalsContact O-N 3.09Å; R15-F17 VanDerWaalsContact C-N 3.33Å; F17-E19 VanDerWaalsContact C-N 3.3Å; F17-E19 PolarHBondContact O-N 3.29Å; F17-L20 PolarHBondContact O-N 3.02Å; F17-F21 HydrophobicContact CE1-CB 4.3Å; F17-F21 HydrophobicContact CE1-CD2 4.23Å; F17-F21 HydrophobicContact CZ-CD2 4.12Å; F17-F21 VanDerWaalsContact O-CB 3.3Å; F17-F21 WeakPolarHBondContact O-CB 3.05Å; F17-F21 PolarHBondContact O-N 3.37Å; F17-I61 HydrophobicContact CD2-CG2 4.42Å; F17-I61 HydrophobicContact CE2-CD1 4.2Å; F17-I61 HydrophobicContact CE2-CG2 4Å; F17-I61 HydrophobicContact CZ-CD1 4.26Å |
| 18 | P | 95.2 | Very high | 93.5 | Very high | 86 Ų | 86 | 91.1 Ų | 91.1 | 56% | 0.558 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -59.1 | -40 | 178.6 | -24.9 | 35.8 | 0 | 0 | 0 | 113.3 | R15 F21 A22 | R15-P18 WeakPolarHBondContact O-CD 3.48Å; P18-F21 PolarHBondContact O-N 3.33Å; P18-A22 WeakPolarHBondContact O-CB 3.25Å; P18-A22 PolarHBondContact O-N 2.94Å |
| 19 | E | 94.5 | Very high | 94 | Very high | 130 Ų | 130 | 90 Ų | 90 | 61% | 0.607 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -67.3 | -44.1 | 177.3 | -171.9 | -176.1 | 175.5 | 0 | 0 | 111.5 | R16 F17 F21 A22 Q23 | R16-E19 PolarHBondContact O-N 2.91Å; F17-E19 VanDerWaalsContact C-N 3.3Å; F17-E19 PolarHBondContact O-N 3.29Å; E19-F21 VanDerWaalsContact C-N 3.31Å; E19-F21 PolarHBondContact O-N 3.05Å; E19-A22 PolarHBondContact O-N 3.34Å; E19-Q23 WeakPolarHBondContact O-CG 3.29Å; E19-Q23 PolarHBondContact O-N 3.47Å |
| 20 | L | 95.1 | Very high | 94.6 | Very high | 18 Ų | 18 | 84.5 Ų | 84.5 | 9% | 0.094 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -63.3 | -38.3 | 175.4 | -66.1 | 172.6 | 0 | 0 | 0 | 112.1 | R16 F17 Q23 A64 A65 | R16-L20 HydrophobicContact CB-CD1 4.4Å; R16-L20 WeakPolarHBondContact O-CG 3.33Å; R16-L20 PolarHBondContact O-N 3.41Å; R16-L20 VanDerWaalsContact O-N 3.11Å; F17-L20 PolarHBondContact O-N 3.02Å; L20-Q23 PolarHBondContact O-N 2.93Å; L20-A64 HydrophobicContact CD2-CB 3.83Å; L20-A65 HydrophobicContact CD1-CB 3.89Å |
| 21 | F | 95.7 | Very high | 95.1 | Very high | 84 Ų | 84 | 85 Ų | 85 | 37% | 0.368 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -66.1 | -41 | 176.2 | -175.1 | -91.8 | 0 | 0 | 0 | 111.4 | F17 P18 E19 Q23 C24 A28 L57 I61 | F17-F21 HydrophobicContact CE1-CB 4.3Å; F17-F21 HydrophobicContact CE1-CD2 4.23Å; F17-F21 HydrophobicContact CZ-CD2 4.12Å; F17-F21 VanDerWaalsContact O-CB 3.3Å; F17-F21 WeakPolarHBondContact O-CB 3.05Å; F17-F21 PolarHBondContact O-N 3.37Å; P18-F21 PolarHBondContact O-N 3.33Å; E19-F21 VanDerWaalsContact C-N 3.31Å; E19-F21 PolarHBondContact O-N 3.05Å; F21-Q23 VanDerWaalsContact C-N 3.27Å; F21-Q23 PolarHBondContact O-N 2.97Å; F21-C24 CarbonylContact O-C 3.49Å; F21-C24 PolarHBondContact O-N 3.35Å; F21-A28 HydrophobicContact CE1-CB 3.93Å; F21-A28 HydrophobicContact CE2-CB 4.05Å; F21-A28 HydrophobicContact CZ-CB 3.53Å; F21-L57 HydrophobicContact CE2-CD1 4.32Å; F21-L57 HydrophobicContact CE2-CD2 4.22Å; F21-I61 HydrophobicContact CD2-CD1 3.88Å |
| 22 | A | 95.9 | Very high | 95.3 | Very high | 64 Ų | 64 | 79 Ų | 79 | 53% | 0.529 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -62.1 | -32.9 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | P18 E19 C24 S25 | P18-A22 WeakPolarHBondContact O-CB 3.25Å; P18-A22 PolarHBondContact O-N 2.94Å; E19-A22 PolarHBondContact O-N 3.34Å; A22-C24 PolarHBondContact O-N 3.35Å; A22-S25 WeakPolarHBondContact O-CB 3.27Å; A22-S25 PolarHBondContact O-N 2.91Å |
| 23 | Q | 96.4 | Very high | 95.7 | Very high | 113 Ų | 113 | 81.9 Ų | 81.9 | 53% | 0.528 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -65.7 | -21.5 | 173.8 | -66.7 | 173.9 | 31.6 | 0 | 0 | 113.2 | E19 L20 F21 | E19-Q23 WeakPolarHBondContact O-CG 3.29Å; E19-Q23 PolarHBondContact O-N 3.47Å; L20-Q23 PolarHBondContact O-N 2.93Å; F21-Q23 VanDerWaalsContact C-N 3.27Å; F21-Q23 PolarHBondContact O-N 2.97Å |
| 24 | C | 97.9 | Very high | 96.1 | Very high | 0 Ų | 0 | 73.7 Ų | 73.7 | 0% | 0 | 40% | 0.398 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -107.6 | 31.2 | -179 | -59.9 | 0 | 0 | 0 | 0 | 112.2 | F21 A22 G26 E27 A28 L57 C60 I61 | F21-C24 CarbonylContact O-C 3.49Å; F21-C24 PolarHBondContact O-N 3.35Å; A22-C24 PolarHBondContact O-N 3.35Å; C24-G26 VanDerWaalsContact C-N 3.27Å; C24-G26 PolarHBondContact O-N 2.97Å; C24-E27 PolarHBondContact O-N 3.47Å; C24-A28 VanDerWaalsContact O-CB 3.3Å; C24-A28 WeakPolarHBondContact O-CB 3.25Å; C24-A28 PolarHBondContact O-N 3.17Å; C24-L57 HydrophobicContact CB-CD1 3.98Å; C24-C60 VanDerWaalsContact CA-SG 3.52Å; C24-C60 HydrophobicContact CB-CB 3.76Å; C24-C60 WeakPolarHBondContact CB-SG 3.25Å; C24-C60 WeakPolarHBondContact SG-CB 3.37Å; C24-C60 CovalentContact SG-SG 2.03Å; C24-C60 PolarHBondContact SG-SG 3.11Å; C24-I61 HydrophobicContact CB-CG1 4.26Å; C24-I61 PolarHBondContact SG-N 3.11Å; C24-I61 VanDerWaalsContact SG-N 3.39Å |
| 25 | S | 97.5 | Very high | 96.3 | Very high | 78 Ų | 78 | 69 Ų | 69 | 55% | 0.545 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -62.1 | -30.7 | -171.7 | 57.1 | 0 | 0 | 0 | 0 | 113.8 | A22 A29 | A22-S25 WeakPolarHBondContact O-CB 3.27Å; A22-S25 PolarHBondContact O-N 2.91Å; S25-A29 WeakPolarHBondContact O-CB 3.29Å; S25-A29 PolarHBondContact O-N 3.13Å |
| 26 | G | 98.2 | Very high | 96.4 | Very high | 51 Ų | 51 | 65.4 Ų | 65.4 | 53% | 0.526 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -65.9 | -51.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | C24 A28 A29 A30 | C24-G26 VanDerWaalsContact C-N 3.27Å; C24-G26 PolarHBondContact O-N 2.97Å; G26-A28 VanDerWaalsContact C-N 3.3Å; G26-A28 PolarHBondContact O-N 3.44Å; G26-A29 PolarHBondContact O-N 3.35Å; G26-A30 PolarHBondContact O-N 2.93Å |
| 27 | E | 98.4 | Very high | 96.5 | Very high | 71 Ų | 71 | 64.2 Ų | 64.2 | 33% | 0.332 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -64.4 | -37.4 | 176.1 | -60.9 | 84.5 | 168.6 | 0 | 0 | 111.1 | C24 A30 Y31 A56 L57 C60 | C24-E27 PolarHBondContact O-N 3.47Å; E27-A30 PolarHBondContact O-N 2.75Å; E27-Y31 PolarHBondContact O-N 2.98Å; E27-A56 HydrophobicContact CG-CB 4.38Å; E27-L57 HydrophobicContact CB-CB 4.02Å; E27-L57 HydrophobicContact CB-CD1 4.12Å; E27-C60 HydrophobicContact CG-CB 4.36Å |
| 28 | A | 98.1 | Very high | 96.4 | Very high | 14 Ų | 14 | 61.8 Ų | 61.8 | 12% | 0.116 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -62.8 | -44.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | F21 C24 G26 Y31 G32 L57 | F21-A28 HydrophobicContact CE1-CB 3.93Å; F21-A28 HydrophobicContact CE2-CB 4.05Å; F21-A28 HydrophobicContact CZ-CB 3.53Å; C24-A28 VanDerWaalsContact O-CB 3.3Å; C24-A28 WeakPolarHBondContact O-CB 3.25Å; C24-A28 PolarHBondContact O-N 3.17Å; G26-A28 VanDerWaalsContact C-N 3.3Å; G26-A28 PolarHBondContact O-N 3.44Å; A28-Y31 PolarHBondContact O-N 2.92Å; A28-G32 PolarHBondContact O-N 3.47Å; A28-L57 HydrophobicContact CB-CD1 3.89Å; A28-L57 HydrophobicContact CB-CD2 4.49Å |
| 29 | A | 98.5 | Very high | 96.1 | Very high | 49 Ų | 49 | 60.3 Ų | 60.3 | 41% | 0.405 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -65.4 | -39.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | S25 G26 G32 K33 | S25-A29 WeakPolarHBondContact O-CB 3.29Å; S25-A29 PolarHBondContact O-N 3.13Å; G26-A29 PolarHBondContact O-N 3.35Å; A29-G32 PolarHBondContact O-N 3.12Å; A29-K33 WeakPolarHBondContact O-CB 3.03Å; A29-K33 VanDerWaalsContact O-CG 3.26Å; A29-K33 WeakPolarHBondContact O-CG 3.24Å; A29-K33 PolarHBondContact O-N 3.46Å |
| 30 | A | 98.5 | Very high | 95.7 | Very high | 44 Ų | 44 | 58.8 Ų | 58.8 | 36% | 0.364 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -61.4 | -47.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | G26 E27 K33 C34 | G26-A30 PolarHBondContact O-N 2.93Å; E27-A30 PolarHBondContact O-N 2.75Å; A30-K33 PolarHBondContact O-N 3.37Å; A30-C34 PolarHBondContact O-N 3.48Å; A30-C34 VanDerWaalsContact O-N 3.13Å |
| 31 | Y | 98.2 | Very high | 95.2 | Very high | 67 Ų | 67 | 61.2 Ų | 61.2 | 26% | 0.263 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -61.7 | -46.9 | 176.2 | 177.3 | -114.7 | 0 | 0 | 0 | 112.3 | E27 A28 K33 C34 V35 C50 E53 F54 L57 | E27-Y31 PolarHBondContact O-N 2.98Å; A28-Y31 PolarHBondContact O-N 2.92Å; Y31-K33 VanDerWaalsContact C-N 3.3Å; Y31-K33 PolarHBondContact O-N 2.81Å; Y31-C34 PolarHBondContact O-N 3.06Å; Y31-C34 VanDerWaalsContact O-N 3.17Å; Y31-V35 HydrophobicContact CD1-CG2 4.46Å; Y31-V35 HydrophobicContact CD2-CG2 4.24Å; Y31-V35 HydrophobicContact CE1-CG2 4Å; Y31-V35 HydrophobicContact CE2-CG2 3.76Å; Y31-V35 WeakPolarHBondContact O-CG2 3.46Å; Y31-V35 PolarHBondContact O-N 2.94Å; Y31-C50 HydrophobicContact CD2-CB 3.93Å; Y31-C50 HydrophobicContact CE2-CB 3.73Å; Y31-E53 HydrophobicContact CD2-CB 4.06Å; Y31-F54 HydrophobicContact CD2-CB 3.92Å; Y31-F54 HydrophobicContact CE2-CB 3.74Å; Y31-F54 HydrophobicContact CE2-CD2 4.18Å; Y31-F54 HydrophobicContact CE2-CG 4.42Å; Y31-L57 HydrophobicContact CD1-CD2 3.93Å; Y31-L57 HydrophobicContact CG-CD2 4.25Å |
| 32 | G | 96.6 | Very high | 94.4 | Very high | 30 Ų | 30 | 69.6 Ų | 69.6 | 31% | 0.309 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -60.6 | -37.5 | 178 | 0 | 0 | 0 | 0 | 0 | 113.3 | A28 A29 V35 T36 | A28-G32 PolarHBondContact O-N 3.47Å; A29-G32 PolarHBondContact O-N 3.12Å; G32-V35 PolarHBondContact O-N 3.4Å; G32-T36 WeakPolarHBondContact O-CB 3.47Å; G32-T36 PolarHBondContact O-N 3.48Å; G32-T36 PolarHBondContact O-OG1 3.43Å |
| 33 | K | 97.4 | Very high | 93.9 | Very high | 156 Ų | 156 | 73 Ų | 73 | 68% | 0.678 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -62.7 | -45.8 | 173.9 | -76.2 | 172.9 | -175.4 | -179 | 0 | 111.6 | A29 A30 Y31 T36 A37 | A29-K33 WeakPolarHBondContact O-CB 3.03Å; A29-K33 VanDerWaalsContact O-CG 3.26Å; A29-K33 WeakPolarHBondContact O-CG 3.24Å; A29-K33 PolarHBondContact O-N 3.46Å; A30-K33 PolarHBondContact O-N 3.37Å; Y31-K33 VanDerWaalsContact C-N 3.3Å; Y31-K33 PolarHBondContact O-N 2.81Å; K33-T36 PolarHBondContact O-N 3.35Å; K33-A37 VanDerWaalsContact O-CB 3.29Å; K33-A37 WeakPolarHBondContact O-CB 3.46Å; K33-A37 PolarHBondContact O-N 3.14Å |
| 34 | C | 97 | Very high | 93.4 | Very high | 23 Ų | 23 | 75.6 Ų | 75.6 | 16% | 0.155 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -59.4 | -51.1 | 176 | 179.1 | 0 | 0 | 0 | 0 | 111.1 | A30 Y31 T36 A37 T38 C50 E53 | A30-C34 PolarHBondContact O-N 3.48Å; A30-C34 VanDerWaalsContact O-N 3.13Å; Y31-C34 PolarHBondContact O-N 3.06Å; Y31-C34 VanDerWaalsContact O-N 3.17Å; C34-T36 PolarHBondContact O-N 3.13Å; C34-A37 PolarHBondContact O-N 3.17Å; C34-T38 WeakPolarHBondContact O-CG2 3.34Å; C34-T38 PolarHBondContact O-N 2.93Å; C34-T38 PolarHBondContact O-OG1 2.03Å; C34-C50 HydrophobicContact CB-CB 3.78Å; C34-C50 WeakPolarHBondContact CB-SG 3.48Å; C34-C50 WeakPolarHBondContact SG-CA 3.43Å; C34-C50 WeakPolarHBondContact SG-CB 3.29Å; C34-C50 CovalentContact SG-SG 2.04Å; C34-C50 PolarHBondContact SG-SG 3.34Å; C34-E53 HydrophobicContact CB-CG 4.21Å |
| 35 | V | 95.9 | Very high | 93.1 | Very high | 30 Ų | 30 | 79.4 Ų | 79.4 | 18% | 0.182 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -56.8 | -51.3 | 179.7 | 173.5 | 0 | 0 | 0 | 0 | 110.5 | Y31 G32 A37 T38 T39 L45 C50 | Y31-V35 HydrophobicContact CD1-CG2 4.46Å; Y31-V35 HydrophobicContact CD2-CG2 4.24Å; Y31-V35 HydrophobicContact CE1-CG2 4Å; Y31-V35 HydrophobicContact CE2-CG2 3.76Å; Y31-V35 WeakPolarHBondContact O-CG2 3.46Å; Y31-V35 PolarHBondContact O-N 2.94Å; G32-V35 PolarHBondContact O-N 3.4Å; V35-A37 VanDerWaalsContact C-N 3.33Å; V35-A37 PolarHBondContact O-N 2.85Å; V35-T38 WeakPolarHBondContact CA-OG1 3.33Å; V35-T38 PolarHBondContact O-N 2.97Å; V35-T38 VanDerWaalsContact O-N 3.09Å; V35-T38 PolarHBondContact O-OG1 3.41Å; V35-T39 HydrophobicContact CG1-CG2 4.39Å; V35-T39 WeakPolarHBondContact O-CG2 3.47Å; V35-T39 PolarHBondContact O-N 3.37Å; V35-T39 PolarHBondContact O-OG1 3.16Å; V35-T39 VanDerWaalsContact O-OG1 3.06Å; V35-L45 HydrophobicContact CG1-CD2 4.4Å; V35-C50 HydrophobicContact CG2-CB 4.47Å; V35-C50 PolarHBondContact N-SG 2.81Å; V35-C50 VanDerWaalsContact N-SG 3.43Å |
| 36 | T | 94.9 | Very high | 92.7 | Very high | 89 Ų | 89 | 85.1 Ų | 85.1 | 55% | 0.546 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -59.1 | -43 | -179.6 | -54.9 | 0 | 0 | 0 | 0 | 112.1 | G32 K33 C34 T38 T39 T40 | G32-T36 WeakPolarHBondContact O-CB 3.47Å; G32-T36 PolarHBondContact O-N 3.48Å; G32-T36 PolarHBondContact O-OG1 3.43Å; K33-T36 PolarHBondContact O-N 3.35Å; C34-T36 PolarHBondContact O-N 3.13Å; T36-T38 VanDerWaalsContact C-N 3.34Å; T36-T38 PolarHBondContact O-N 3.39Å; T36-T39 PolarHBondContact O-N 3.28Å; T36-T39 PolarHBondContact O-OG1 3.01Å; T36-T40 PolarHBondContact O-N 3.32Å; T36-T40 VanDerWaalsContact O-N 3.12Å; T36-T40 PolarHBondContact O-OG1 2.82Å |
| 37 | A | 93.6 | Very high | 92.5 | Very high | 66 Ų | 66 | 91.1 Ų | 91.1 | 55% | 0.545 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -63.3 | -40.4 | 177 | 0 | 0 | 0 | 0 | 0 | 111.7 | K33 C34 V35 | K33-A37 VanDerWaalsContact O-CB 3.29Å; K33-A37 WeakPolarHBondContact O-CB 3.46Å; K33-A37 PolarHBondContact O-N 3.14Å; C34-A37 PolarHBondContact O-N 3.17Å; V35-A37 VanDerWaalsContact C-N 3.33Å; V35-A37 PolarHBondContact O-N 2.85Å |
| 38 | T | 90.6 | Very high | 92.3 | Very high | 35 Ų | 35 | 92.5 Ų | 92.5 | 22% | 0.215 | 49% | 0.49 | C | S | . | . | H | α-helix | trans | -75.2 | -21.2 | 179.3 | 60 | 0 | 0 | 0 | 0 | 114.2 | C34 V35 T36 L45 L49 | C34-T38 WeakPolarHBondContact O-CG2 3.34Å; C34-T38 PolarHBondContact O-N 2.93Å; C34-T38 PolarHBondContact O-OG1 2.03Å; V35-T38 WeakPolarHBondContact CA-OG1 3.33Å; V35-T38 PolarHBondContact O-N 2.97Å; V35-T38 VanDerWaalsContact O-N 3.09Å; V35-T38 PolarHBondContact O-OG1 3.41Å; T36-T38 VanDerWaalsContact C-N 3.34Å; T36-T38 PolarHBondContact O-N 3.39Å; T38-L45 VanDerWaalsContact OG1-CD1 3.25Å; T38-L45 WeakPolarHBondContact OG1-CD1 3.26Å; T38-L49 HydrophobicContact CG2-CB 4.45Å; T38-L49 HydrophobicContact CG2-CD1 4.39Å |
| 39 | T | 89.8 | Confident | 92.2 | Very high | 54 Ų | 54 | 96.1 Ų | 96.1 | 33% | 0.331 | 51% | 0.507 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -104.4 | 12 | 178 | 62.6 | 0 | 0 | 0 | 0 | 112.7 | V35 T36 G41 L45 | V35-T39 HydrophobicContact CG1-CG2 4.39Å; V35-T39 WeakPolarHBondContact O-CG2 3.47Å; V35-T39 PolarHBondContact O-N 3.37Å; V35-T39 PolarHBondContact O-OG1 3.16Å; V35-T39 VanDerWaalsContact O-OG1 3.06Å; T36-T39 PolarHBondContact O-N 3.28Å; T36-T39 PolarHBondContact O-OG1 3.01Å; T39-G41 PolarHBondContact O-N 3.24Å; T39-G41 VanDerWaalsContact O-N 3.13Å; T39-L45 HydrophobicContact CG2-CB 3.97Å; T39-L45 HydrophobicContact CG2-CD1 4.47Å |
| 40 | T | 86.5 | Confident | 92.1 | Very high | 98 Ų | 98 | 94.1 Ų | 94.1 | 60% | 0.601 | 49% | 0.49 | S | S | * | . | S | Bend | trans | -65.7 | 115.4 | 176.3 | -66.1 | 0 | 0 | 0 | 0 | 108.9 | T36 | T36-T40 PolarHBondContact O-N 3.32Å; T36-T40 VanDerWaalsContact O-N 3.12Å; T36-T40 PolarHBondContact O-OG1 2.82Å |
| 41 | G | 83.9 | Confident | 92.1 | Very high | 70 Ų | 70 | 94.5 Ų | 94.5 | 72% | 0.722 | 49% | 0.488 | S | S | * | . | S | Bend | trans | 98.3 | -137.1 | -176.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | T39 | T39-G41 PolarHBondContact O-N 3.24Å; T39-G41 VanDerWaalsContact O-N 3.13Å |
| 42 | R | 79.1 | Confident | 92.1 | Very high | 259 Ų | 259 | 99.6 Ų | 99.6 | 98% | 0.977 | 51% | 0.511 | S | S | * | . | S | Bend | trans | -103.7 | 16.1 | 178 | -63.5 | -172.7 | -178.1 | -177.8 | 0.9 | 113 | ||
| 43 | Q | 84.5 | Confident | 92.2 | Very high | 135 Ų | 135 | 101.2 Ų | 101.2 | 63% | 0.631 | 51% | 0.511 | S | S | * | . | P | Polyproline II helix | trans | -77.5 | 126 | 179.5 | -71.1 | -176.1 | -33.3 | 0 | 0 | 109.7 | ||
| 44 | E | 87.4 | Confident | 92.2 | Very high | 169 Ų | 169 | 98 Ų | 98 | 79% | 0.79 | 50% | 0.497 | S | S | * | . | P | Polyproline II helix | trans | -78.1 | 139.9 | 173.9 | -66.7 | -171.4 | 158.6 | 0 | 0 | 110.9 | R46 | E44-R46 PolarHBondContact O-N 3.3Š|
| 45 | L | 89.9 | Confident | 92.3 | Very high | 80 Ų | 80 | 100.4 Ų | 100.4 | 42% | 0.419 | 51% | 0.509 | S | S | . | . | P | Polyproline II helix | trans | -64.5 | 121.2 | 172 | -174.3 | 70.7 | 0 | 0 | 0 | 109.3 | V35 T38 T39 L49 | V35-L45 HydrophobicContact CG1-CD2 4.4Å; T38-L45 VanDerWaalsContact OG1-CD1 3.25Å; T38-L45 WeakPolarHBondContact OG1-CD1 3.26Å; T39-L45 HydrophobicContact CG2-CB 3.97Å; T39-L45 HydrophobicContact CG2-CD1 4.47Å; L45-L49 HydrophobicContact CD1-CB 4.46Å; L45-L49 HydrophobicContact CD1-CD1 4.33Å |
| 46 | R | 90.7 | Very high | 92.4 | Very high | 197 Ų | 197 | 101.2 Ų | 101.2 | 74% | 0.743 | 52% | 0.518 | S | S | * | . | P | Polyproline II helix | trans | -92.8 | 154.8 | 171.7 | -59.5 | -176.3 | 179.1 | 178.1 | -0.4 | 110.7 | E44 D48 L49 | E44-R46 PolarHBondContact O-N 3.3Å; R46-D48 PolarHBondContact O-N 3.26Å; R46-L49 HydrophobicContact CB-CD1 3.76Å; R46-L49 HydrophobicContact CB-CG 3.95Å; R46-L49 HydrophobicContact CG-CD1 4.37Å; R46-L49 WeakPolarHBondContact O-CG 3.35Å; R46-L49 PolarHBondContact O-N 3.45Å |
| 47 | K | 92.8 | Very high | 92.6 | Very high | 178 Ų | 178 | 97.6 Ų | 97.6 | 77% | 0.774 | 50% | 0.495 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54 | 139.8 | 175.7 | -167.1 | -168.7 | 167 | -172.1 | 0 | 110.3 | L49 | K47-L49 PolarHBondContact O-N 3.32Å; K47-L49 VanDerWaalsContact O-N 3.13Å |
| 48 | D | 95.1 | Very high | 92.8 | Very high | 99 Ų | 99 | 99.6 Ų | 99.6 | 53% | 0.529 | 49% | 0.492 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 65 | 7.5 | 173 | -52.5 | -36.5 | 0 | 0 | 0 | 116.5 | R46 C50 V51 | R46-D48 PolarHBondContact O-N 3.26Å; D48-C50 VanDerWaalsContact C-N 3.3Å; D48-C50 PolarHBondContact O-N 3.34Å; D48-V51 HydrophobicContact CB-CB 4.08Å; D48-V51 HydrophobicContact CB-CG1 4.45Å; D48-V51 WeakPolarHBondContact O-CB 3.45Å; D48-V51 WeakPolarHBondContact O-CG1 3.4Å; D48-V51 PolarHBondContact O-N 3.24Å |
| 49 | L | 95.3 | Very high | 93.1 | Very high | 91 Ų | 91 | 102 Ų | 102 | 48% | 0.476 | 51% | 0.506 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.2 | -37.5 | 176.6 | -76.6 | 179.1 | 0 | 0 | 0 | 113.5 | T38 L45 R46 K47 | T38-L49 HydrophobicContact CG2-CB 4.45Å; T38-L49 HydrophobicContact CG2-CD1 4.39Å; L45-L49 HydrophobicContact CD1-CB 4.46Å; L45-L49 HydrophobicContact CD1-CD1 4.33Å; R46-L49 HydrophobicContact CB-CD1 3.76Å; R46-L49 HydrophobicContact CB-CG 3.95Å; R46-L49 HydrophobicContact CG-CD1 4.37Å; R46-L49 WeakPolarHBondContact O-CG 3.35Å; R46-L49 PolarHBondContact O-N 3.45Å; K47-L49 PolarHBondContact O-N 3.32Å; K47-L49 VanDerWaalsContact O-N 3.13Å |
| 50 | C | 97 | Very high | 93.5 | Very high | 7 Ų | 7 | 100.7 Ų | 100.7 | 5% | 0.047 | 50% | 0.499 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -113.6 | 31.2 | 179.3 | -60.6 | 0 | 0 | 0 | 0 | 111.6 | Y31 C34 V35 D48 K52 E53 F54 | Y31-C50 HydrophobicContact CD2-CB 3.93Å; Y31-C50 HydrophobicContact CE2-CB 3.73Å; C34-C50 HydrophobicContact CB-CB 3.78Å; C34-C50 WeakPolarHBondContact CB-SG 3.48Å; C34-C50 WeakPolarHBondContact SG-CA 3.43Å; C34-C50 WeakPolarHBondContact SG-CB 3.29Å; C34-C50 CovalentContact SG-SG 2.04Å; C34-C50 PolarHBondContact SG-SG 3.34Å; V35-C50 HydrophobicContact CG2-CB 4.47Å; V35-C50 PolarHBondContact N-SG 2.81Å; V35-C50 VanDerWaalsContact N-SG 3.43Å; D48-C50 VanDerWaalsContact C-N 3.3Å; D48-C50 PolarHBondContact O-N 3.34Å; C50-K52 VanDerWaalsContact C-N 3.27Å; C50-K52 PolarHBondContact O-N 3.24Å; C50-E53 VanDerWaalsContact C-OE2 3.3Å; C50-E53 WeakPolarHBondContact CA-OE2 2.98Å; C50-E53 PolarHBondContact O-N 3.29Å; C50-F54 VanDerWaalsContact O-CB 3.27Å; C50-F54 WeakPolarHBondContact O-CB 3.3Å; C50-F54 PolarHBondContact O-N 3.16Å |
| 51 | V | 97.9 | Very high | 94 | Very high | 52 Ų | 52 | 97.2 Ų | 97.2 | 32% | 0.315 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -62.5 | -34.5 | -172.1 | 68.4 | 0 | 0 | 0 | 0 | 112.4 | D48 F54 D55 | D48-V51 HydrophobicContact CB-CB 4.08Å; D48-V51 HydrophobicContact CB-CG1 4.45Å; D48-V51 WeakPolarHBondContact O-CB 3.45Å; D48-V51 WeakPolarHBondContact O-CG1 3.4Å; D48-V51 PolarHBondContact O-N 3.24Å; V51-F54 PolarHBondContact O-N 3.34Å; V51-D55 WeakPolarHBondContact O-CB 3.45Å; V51-D55 PolarHBondContact O-N 3.44Å |
| 52 | K | 98.3 | Very high | 94.5 | Very high | 173 Ų | 173 | 97 Ų | 97 | 75% | 0.752 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -65.8 | -47.5 | -178.6 | -66.2 | -179.3 | -179.5 | 176.6 | 0 | 111.1 | C50 A56 | C50-K52 VanDerWaalsContact C-N 3.27Å; C50-K52 PolarHBondContact O-N 3.24Å; K52-A56 PolarHBondContact O-N 2.95Å |
| 53 | E | 98.4 | Very high | 95.3 | Very high | 64 Ų | 64 | 87.6 Ų | 87.6 | 30% | 0.299 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -69 | -38.4 | 177.8 | -59.6 | 77.6 | -174.7 | 0 | 0 | 110.9 | Y31 C34 C50 A56 L57 | Y31-E53 HydrophobicContact CD2-CB 4.06Å; C34-E53 HydrophobicContact CB-CG 4.21Å; C50-E53 VanDerWaalsContact C-OE2 3.3Å; C50-E53 WeakPolarHBondContact CA-OE2 2.98Å; C50-E53 PolarHBondContact O-N 3.29Å; E53-A56 PolarHBondContact O-N 3.46Å; E53-L57 WeakPolarHBondContact O-CB 3.32Å; E53-L57 PolarHBondContact O-N 3.21Å |
| 54 | F | 98.2 | Very high | 95.8 | Very high | 90 Ų | 90 | 81.6 Ų | 81.6 | 40% | 0.395 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -61.8 | -46.9 | 175.3 | 176.8 | -102.9 | 0 | 0 | 0 | 112.1 | Y31 C50 V51 A56 L57 K58 | Y31-F54 HydrophobicContact CD2-CB 3.92Å; Y31-F54 HydrophobicContact CE2-CB 3.74Å; Y31-F54 HydrophobicContact CE2-CD2 4.18Å; Y31-F54 HydrophobicContact CE2-CG 4.42Å; C50-F54 VanDerWaalsContact O-CB 3.27Å; C50-F54 WeakPolarHBondContact O-CB 3.3Å; C50-F54 PolarHBondContact O-N 3.16Å; V51-F54 PolarHBondContact O-N 3.34Å; F54-A56 VanDerWaalsContact C-N 3.32Å; F54-A56 PolarHBondContact O-N 3.43Å; F54-L57 PolarHBondContact O-N 3.49Å; F54-K58 HydrophobicContact CE1-CD 4Å; F54-K58 HydrophobicContact CZ-CD 4.39Å; F54-K58 VanDerWaalsContact O-CB 3.25Å; F54-K58 WeakPolarHBondContact O-CB 3.36Å; F54-K58 PolarHBondContact O-N 3.26Å |
| 55 | D | 98.5 | Very high | 96 | Very high | 73 Ų | 73 | 75.3 Ų | 75.3 | 39% | 0.39 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -65.9 | -36.2 | -179.7 | -82.9 | -25.8 | 0 | 0 | 0 | 111.8 | V51 T59 | V51-D55 WeakPolarHBondContact O-CB 3.45Å; V51-D55 PolarHBondContact O-N 3.44Å; D55-T59 VanDerWaalsContact O-CB 3.24Å; D55-T59 WeakPolarHBondContact O-CB 3.3Å; D55-T59 PolarHBondContact O-N 2.82Å; D55-T59 PolarHBondContact O-OG1 3.27Å |
| 56 | A | 98.5 | Very high | 96 | Very high | 47 Ų | 47 | 78.6 Ų | 78.6 | 39% | 0.388 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -61.2 | -50.8 | 172.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | E27 K52 E53 F54 K58 T59 C60 | E27-A56 HydrophobicContact CG-CB 4.38Å; K52-A56 PolarHBondContact O-N 2.95Å; E53-A56 PolarHBondContact O-N 3.46Å; F54-A56 VanDerWaalsContact C-N 3.32Å; F54-A56 PolarHBondContact O-N 3.43Å; A56-K58 PolarHBondContact O-N 3.46Å; A56-T59 PolarHBondContact O-N 3.09Å; A56-C60 PolarHBondContact O-N 3.26Å |
| 57 | L | 98.4 | Very high | 95.5 | Very high | 12 Ų | 12 | 76.9 Ų | 76.9 | 6% | 0.063 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -60 | -48 | 177.8 | 174.8 | 58.9 | 0 | 0 | 0 | 112.1 | F21 C24 E27 A28 Y31 E53 F54 T59 C60 I61 | F21-L57 HydrophobicContact CE2-CD1 4.32Å; F21-L57 HydrophobicContact CE2-CD2 4.22Å; C24-L57 HydrophobicContact CB-CD1 3.98Å; E27-L57 HydrophobicContact CB-CB 4.02Å; E27-L57 HydrophobicContact CB-CD1 4.12Å; A28-L57 HydrophobicContact CB-CD1 3.89Å; A28-L57 HydrophobicContact CB-CD2 4.49Å; Y31-L57 HydrophobicContact CD1-CD2 3.93Å; Y31-L57 HydrophobicContact CG-CD2 4.25Å; E53-L57 WeakPolarHBondContact O-CB 3.32Å; E53-L57 PolarHBondContact O-N 3.21Å; F54-L57 PolarHBondContact O-N 3.49Å; L57-T59 VanDerWaalsContact C-N 3.31Å; L57-T59 PolarHBondContact O-N 3.3Å; L57-C60 PolarHBondContact O-N 3.12Å; L57-I61 HydrophobicContact CD1-CD1 3.77Å; L57-I61 HydrophobicContact CD1-CG1 4.16Å; L57-I61 HydrophobicContact CG-CD1 3.94Å; L57-I61 WeakPolarHBondContact O-CG1 3.44Å; L57-I61 PolarHBondContact O-N 2.99Å |
| 58 | K | 97.8 | Very high | 94.1 | Very high | 109 Ų | 109 | 70 Ų | 70 | 47% | 0.474 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -57.8 | -45.3 | 177.1 | 176.5 | -175 | 171.2 | -169.6 | 0 | 111.1 | F54 A56 C60 I61 V62 | F54-K58 HydrophobicContact CE1-CD 4Å; F54-K58 HydrophobicContact CZ-CD 4.39Å; F54-K58 VanDerWaalsContact O-CB 3.25Å; F54-K58 WeakPolarHBondContact O-CB 3.36Å; F54-K58 PolarHBondContact O-N 3.26Å; A56-K58 PolarHBondContact O-N 3.46Å; K58-C60 VanDerWaalsContact C-N 3.35Å; K58-I61 PolarHBondContact O-N 3.28Å; K58-V62 HydrophobicContact CG-CG2 4.45Å; K58-V62 WeakPolarHBondContact O-CB 3.5Å; K58-V62 VanDerWaalsContact O-CG2 3.29Å; K58-V62 WeakPolarHBondContact O-CG2 3.47Å; K58-V62 PolarHBondContact O-N 3.11Å |
| 59 | T | 98.1 | Very high | 92.3 | Very high | 84 Ų | 84 | 70.6 Ų | 70.6 | 52% | 0.515 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -62.3 | -43.3 | 179 | -62 | 0 | 0 | 0 | 0 | 111.2 | D55 A56 L57 T63 | D55-T59 VanDerWaalsContact O-CB 3.24Å; D55-T59 WeakPolarHBondContact O-CB 3.3Å; D55-T59 PolarHBondContact O-N 2.82Å; D55-T59 PolarHBondContact O-OG1 3.27Å; A56-T59 PolarHBondContact O-N 3.09Å; L57-T59 VanDerWaalsContact C-N 3.31Å; L57-T59 PolarHBondContact O-N 3.3Å; T59-T63 VanDerWaalsContact O-CB 3.29Å; T59-T63 WeakPolarHBondContact O-CB 3.48Å; T59-T63 PolarHBondContact O-N 3.11Å; T59-T63 PolarHBondContact O-OG1 3.35Å |
| 60 | C | 97.9 | Very high | 89.8 | Confident | 27 Ų | 27 | 79 Ų | 79 | 18% | 0.182 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -59.8 | -51.9 | 175.1 | -179.9 | 0 | 0 | 0 | 0 | 111.4 | C24 E27 A56 L57 K58 V62 T63 A64 | C24-C60 VanDerWaalsContact CA-SG 3.52Å; C24-C60 HydrophobicContact CB-CB 3.76Å; C24-C60 WeakPolarHBondContact CB-SG 3.25Å; C24-C60 WeakPolarHBondContact SG-CB 3.37Å; C24-C60 CovalentContact SG-SG 2.03Å; C24-C60 PolarHBondContact SG-SG 3.11Å; E27-C60 HydrophobicContact CG-CB 4.36Å; A56-C60 PolarHBondContact O-N 3.26Å; L57-C60 PolarHBondContact O-N 3.12Å; K58-C60 VanDerWaalsContact C-N 3.35Å; C60-V62 PolarHBondContact O-N 3.38Å; C60-T63 PolarHBondContact O-N 3.34Å; C60-T63 VanDerWaalsContact O-N 3.14Å; C60-A64 WeakPolarHBondContact O-CB 3.48Å; C60-A64 PolarHBondContact O-N 3.03Å |
| 61 | I | 96.1 | Very high | 89.5 | Confident | 25 Ų | 25 | 82.7 Ų | 82.7 | 13% | 0.128 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -61 | -44.9 | -178.1 | -66.7 | 168.5 | 0 | 0 | 0 | 111.3 | F17 F21 C24 L57 K58 T63 A64 A65 | F17-I61 HydrophobicContact CD2-CG2 4.42Å; F17-I61 HydrophobicContact CE2-CD1 4.2Å; F17-I61 HydrophobicContact CE2-CG2 4Å; F17-I61 HydrophobicContact CZ-CD1 4.26Å; F21-I61 HydrophobicContact CD2-CD1 3.88Å; C24-I61 HydrophobicContact CB-CG1 4.26Å; C24-I61 PolarHBondContact SG-N 3.11Å; C24-I61 VanDerWaalsContact SG-N 3.39Å; L57-I61 HydrophobicContact CD1-CD1 3.77Å; L57-I61 HydrophobicContact CD1-CG1 4.16Å; L57-I61 HydrophobicContact CG-CD1 3.94Å; L57-I61 WeakPolarHBondContact O-CG1 3.44Å; L57-I61 PolarHBondContact O-N 2.99Å; K58-I61 PolarHBondContact O-N 3.28Å; I61-T63 VanDerWaalsContact C-N 3.29Å; I61-T63 PolarHBondContact O-N 3.49Å; I61-A64 PolarHBondContact O-N 3.25Å; I61-A65 VanDerWaalsContact O-CB 3.32Å; I61-A65 WeakPolarHBondContact O-CB 3.34Å; I61-A65 PolarHBondContact O-N 3.41Å |
| 62 | V | 95.6 | Very high | 89 | Confident | 67 Ų | 67 | 84.3 Ų | 84.3 | 41% | 0.406 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -63.2 | -38.8 | 178.3 | 169.7 | 0 | 0 | 0 | 0 | 111 | K58 C60 K66 | K58-V62 HydrophobicContact CG-CG2 4.45Å; K58-V62 WeakPolarHBondContact O-CB 3.5Å; K58-V62 VanDerWaalsContact O-CG2 3.29Å; K58-V62 WeakPolarHBondContact O-CG2 3.47Å; K58-V62 PolarHBondContact O-N 3.11Å; C60-V62 PolarHBondContact O-N 3.38Å; V62-K66 WeakPolarHBondContact O-CG 3.47Å; V62-K66 PolarHBondContact O-N 3Å |
| 63 | T | 95.6 | Very high | 88.5 | Confident | 61 Ų | 61 | 79.3 Ų | 79.3 | 37% | 0.374 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -68 | -44.6 | 177 | -59.1 | 0 | 0 | 0 | 0 | 111.3 | T59 C60 I61 A65 K66 K67 | T59-T63 VanDerWaalsContact O-CB 3.29Å; T59-T63 WeakPolarHBondContact O-CB 3.48Å; T59-T63 PolarHBondContact O-N 3.11Å; T59-T63 PolarHBondContact O-OG1 3.35Å; C60-T63 PolarHBondContact O-N 3.34Å; C60-T63 VanDerWaalsContact O-N 3.14Å; I61-T63 VanDerWaalsContact C-N 3.29Å; I61-T63 PolarHBondContact O-N 3.49Å; T63-A65 VanDerWaalsContact C-N 3.34Å; T63-A65 PolarHBondContact O-N 3.05Å; T63-K66 PolarHBondContact O-N 2.84Å; T63-K67 WeakPolarHBondContact O-CG 3.26Å; T63-K67 PolarHBondContact O-N 3.49Å; T63-K67 VanDerWaalsContact O-N 3.16Å |
| 64 | A | 93.9 | Very high | 87.9 | Confident | 8 Ų | 8 | 80.2 Ų | 80.2 | 7% | 0.066 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -61 | -42.8 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | L20 C60 I61 K66 K67 G68 | L20-A64 HydrophobicContact CD2-CB 3.83Å; C60-A64 WeakPolarHBondContact O-CB 3.48Å; C60-A64 PolarHBondContact O-N 3.03Å; I61-A64 PolarHBondContact O-N 3.25Å; A64-K66 VanDerWaalsContact C-N 3.29Å; A64-K66 PolarHBondContact O-N 3.45Å; A64-K67 PolarHBondContact O-N 3Å; A64-K67 VanDerWaalsContact O-N 3.16Å; A64-G68 PolarHBondContact O-N 3.12Å |
| 65 | A | 92.3 | Very high | 87.3 | Confident | 37 Ų | 37 | 79.6 Ų | 79.6 | 31% | 0.306 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -60.1 | -38.7 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | L20 I61 T63 G68 | L20-A65 HydrophobicContact CD1-CB 3.89Å; I61-A65 VanDerWaalsContact O-CB 3.32Å; I61-A65 WeakPolarHBondContact O-CB 3.34Å; I61-A65 PolarHBondContact O-N 3.41Å; T63-A65 VanDerWaalsContact C-N 3.34Å; T63-A65 PolarHBondContact O-N 3.05Å; A65-G68 PolarHBondContact O-N 3.04Å |
| 66 | K | 89.6 | Confident | 86.5 | Confident | 150 Ų | 150 | 80.1 Ų | 80.1 | 65% | 0.652 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -67.7 | -37.6 | 176.2 | -71.9 | 173 | -178.8 | -178.8 | 0 | 112.6 | V62 T63 A64 G68 V69 | V62-K66 WeakPolarHBondContact O-CG 3.47Å; V62-K66 PolarHBondContact O-N 3Å; T63-K66 PolarHBondContact O-N 2.84Å; A64-K66 VanDerWaalsContact C-N 3.29Å; A64-K66 PolarHBondContact O-N 3.45Å; K66-G68 PolarHBondContact O-N 3.1Å; K66-V69 PolarHBondContact O-N 3.1Å |
| 67 | K | 80.2 | Confident | 85.7 | Confident | 161 Ų | 161 | 82.4 Ų | 82.4 | 70% | 0.7 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -63.8 | -27.2 | 177.9 | -70 | 175.3 | 179.6 | 178 | 0 | 112.9 | T63 A64 | T63-K67 WeakPolarHBondContact O-CG 3.26Å; T63-K67 PolarHBondContact O-N 3.49Å; T63-K67 VanDerWaalsContact O-N 3.16Å; A64-K67 PolarHBondContact O-N 3Å; A64-K67 VanDerWaalsContact O-N 3.16Å |
| 68 | G | 63.9 | Low | 84.7 | Confident | 32 Ų | 32 | 87.8 Ų | 87.8 | 33% | 0.33 | 46% | 0.46 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90.7 | 10.4 | 178.5 | 0 | 0 | 0 | 0 | 0 | 115.3 | R16 A64 A65 K66 | R16-G68 PolarHBondContact NH1-O 3.49Å; R16-G68 PolarHBondContact NH2-O 2.85Å; A64-G68 PolarHBondContact O-N 3.12Å; A65-G68 PolarHBondContact O-N 3.04Å; K66-G68 PolarHBondContact O-N 3.1Å |
| 69 | V | 57.1 | Low | 83.6 | Confident | 113 Ų | 113 | 86.1 Ų | 86.1 | 69% | 0.685 | 46% | 0.459 | S | S | * | . | trans | -100.5 | 92.4 | 169.7 | -177.6 | 0 | 0 | 0 | 0 | 107.2 | K66 | K66-V69 PolarHBondContact O-N 3.1Š| ||
| 70 | K | 42.8 | Very low | 82.3 | Confident | 268 Ų | 268 | 86.3 Ų | 86.3 | 100% | 1.165 | 45% | 0.454 | S | S | * | . | trans | -110.9 | 0 | 159.4 | -80.5 | -178.9 | 177.1 | 171.2 | 0 | 107.5 |
Retrieved 70 of 70 residues in 98 ms
(Link to these results)