| 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 | 61.3 | Low | 82.9 | Confident | 176 Ų | 176 | 116.4 Ų | 116.4 | 87% | 0.867 | 55% | 0.548 | S | S | * | . | 0 | -78.1 | 0 | -62.4 | -53.4 | -81.3 | 0 | 0 | 108.5 | Q3 R4 E5 | M1-Q3 PolarHBondContact O-N 3.23Å; M1-Q3 VanDerWaalsContact O-N 3.09Å; M1-R4 WeakPolarHBondContact O-CA 3.23Å; M1-R4 VanDerWaalsContact O-CB 3.27Å; M1-R4 WeakPolarHBondContact O-CB 3.42Å; M1-R4 PolarHBondContact O-N 3Å; M1-E5 PolarHBondContact O-N 3.33Å | |||
| 2 | Q | 74.6 | Confident | 83.6 | Confident | 162 Ų | 162 | 107.8 Ų | 107.8 | 76% | 0.757 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -32.8 | -59.6 | -176.3 | -156.2 | 165.4 | 10.5 | 0 | 0 | 116.6 | R4 E5 E6 | Q2-R4 PolarHBondContact O-N 3.5Å; Q2-R4 VanDerWaalsContact O-N 3.09Å; Q2-E5 WeakPolarHBondContact CA-OE2 3.39Å; Q2-E5 PolarHBondContact N-OE2 2.91Å; Q2-E5 WeakPolarHBondContact O-CA 3.44Å; Q2-E5 WeakPolarHBondContact O-CB 3.07Å; Q2-E5 PolarHBondContact O-N 3.02Å; Q2-E6 WeakPolarHBondContact O-CB 3.5Å; Q2-E6 PolarHBondContact O-N 3.38Å |
| 3 | Q | 82 | Confident | 84.1 | Confident | 135 Ų | 135 | 103.8 Ų | 103.8 | 63% | 0.631 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -61.8 | -20.3 | -179.6 | -167.1 | -179.3 | 63.5 | 0 | 0 | 115.1 | M1 K7 | M1-Q3 PolarHBondContact O-N 3.23Å; M1-Q3 VanDerWaalsContact O-N 3.09Å; Q3-K7 WeakPolarHBondContact O-CG 3.13Å; Q3-K7 PolarHBondContact O-N 2.67Å |
| 4 | R | 82.7 | Confident | 84.7 | Confident | 194 Ų | 194 | 103.3 Ų | 103.3 | 73% | 0.732 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -80.6 | -37.7 | 171.7 | -176.9 | -178.1 | 177.4 | 174.8 | 1.4 | 111.3 | M1 Q2 Q8 | M1-R4 WeakPolarHBondContact O-CA 3.23Å; M1-R4 VanDerWaalsContact O-CB 3.27Å; M1-R4 WeakPolarHBondContact O-CB 3.42Å; M1-R4 PolarHBondContact O-N 3Å; Q2-R4 PolarHBondContact O-N 3.5Å; Q2-R4 VanDerWaalsContact O-N 3.09Å; R4-Q8 VanDerWaalsContact O-CB 3.25Å; R4-Q8 WeakPolarHBondContact O-CB 3.49Å; R4-Q8 PolarHBondContact O-N 2.88Å |
| 5 | E | 83.6 | Confident | 85.3 | Confident | 101 Ų | 101 | 100.5 Ų | 100.5 | 47% | 0.472 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -70.8 | -38.8 | 178.7 | -66.6 | 154.6 | 142 | 0 | 0 | 110.3 | M1 Q2 Q8 L9 | M1-E5 PolarHBondContact O-N 3.33Å; Q2-E5 WeakPolarHBondContact CA-OE2 3.39Å; Q2-E5 PolarHBondContact N-OE2 2.91Å; Q2-E5 WeakPolarHBondContact O-CA 3.44Å; Q2-E5 WeakPolarHBondContact O-CB 3.07Å; Q2-E5 PolarHBondContact O-N 3.02Å; E5-Q8 PolarHBondContact O-N 3.21Å; E5-L9 WeakPolarHBondContact O-CB 3.44Å; E5-L9 PolarHBondContact O-N 3.34Å |
| 6 | E | 84.8 | Confident | 85.7 | Confident | 107 Ų | 107 | 96.8 Ų | 96.8 | 50% | 0.5 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -58.1 | -54.7 | 169.8 | -174.9 | 172.5 | -134.1 | 0 | 0 | 111.9 | Q2 Q8 L9 E10 | Q2-E6 WeakPolarHBondContact O-CB 3.5Å; Q2-E6 PolarHBondContact O-N 3.38Å; E6-Q8 VanDerWaalsContact C-N 3.29Å; E6-Q8 PolarHBondContact O-N 2.98Å; E6-L9 WeakPolarHBondContact O-CA 3.41Å; E6-L9 VanDerWaalsContact O-CB 3.27Å; E6-L9 WeakPolarHBondContact O-CB 3.33Å; E6-L9 PolarHBondContact O-N 3.49Å; E6-E10 WeakPolarHBondContact O-CG 3.45Å; E6-E10 PolarHBondContact O-N 3.12Å |
| 7 | K | 87.6 | Confident | 86.1 | Confident | 126 Ų | 126 | 97.1 Ų | 97.1 | 55% | 0.548 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -64.2 | -30.3 | 176.4 | -73.1 | -178.1 | 175 | -171.4 | 0 | 114.2 | Q3 L9 E10 A11 | Q3-K7 WeakPolarHBondContact O-CG 3.13Å; Q3-K7 PolarHBondContact O-N 2.67Å; K7-L9 VanDerWaalsContact C-N 3.34Å; K7-E10 WeakPolarHBondContact CA-OE2 2.99Å; K7-A11 WeakPolarHBondContact O-CB 3.48Å; K7-A11 PolarHBondContact O-N 3.29Å |
| 8 | Q | 86.8 | Confident | 86.5 | Confident | 81 Ų | 81 | 95.6 Ų | 95.6 | 38% | 0.379 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -72.8 | -30.1 | 173.6 | -173.3 | 176.6 | -17.1 | 0 | 0 | 111.6 | R4 E5 E6 S12 K68 P70 | R4-Q8 VanDerWaalsContact O-CB 3.25Å; R4-Q8 WeakPolarHBondContact O-CB 3.49Å; R4-Q8 PolarHBondContact O-N 2.88Å; E5-Q8 PolarHBondContact O-N 3.21Å; E6-Q8 VanDerWaalsContact C-N 3.29Å; E6-Q8 PolarHBondContact O-N 2.98Å; Q8-S12 WeakPolarHBondContact O-CB 3.4Å; Q8-S12 PolarHBondContact O-N 3Å; Q8-S12 PolarHBondContact O-OG 3.46Å; Q8-K68 PolarHBondContact NE2-O 3.01Å; Q8-P70 HydrophobicContact CB-CG 4.31Å; Q8-P70 HydrophobicContact CG-CG 3.84Å |
| 9 | L | 87.8 | Confident | 87 | Confident | 39 Ų | 39 | 92.7 Ų | 92.7 | 20% | 0.204 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -69.1 | -53 | 172 | 177.6 | 68.3 | 0 | 0 | 0 | 111 | E5 E6 K7 A11 S12 V13 P70 F72 Q75 | E5-L9 WeakPolarHBondContact O-CB 3.44Å; E5-L9 PolarHBondContact O-N 3.34Å; E6-L9 WeakPolarHBondContact O-CA 3.41Å; E6-L9 VanDerWaalsContact O-CB 3.27Å; E6-L9 WeakPolarHBondContact O-CB 3.33Å; E6-L9 PolarHBondContact O-N 3.49Å; K7-L9 VanDerWaalsContact C-N 3.34Å; L9-A11 PolarHBondContact O-N 3.04Å; L9-S12 CarbonylContact O-C 3.55Å; L9-S12 WeakPolarHBondContact O-CA 3.4Å; L9-S12 WeakPolarHBondContact O-CB 3.44Å; L9-S12 PolarHBondContact O-N 3.35Å; L9-V13 HydrophobicContact CD1-CG2 4.24Å; L9-V13 HydrophobicContact CG-CG2 4.37Å; L9-V13 WeakPolarHBondContact O-CG2 3.44Å; L9-V13 PolarHBondContact O-N 3Å; L9-P70 HydrophobicContact CB-CG 4.49Å; L9-P70 HydrophobicContact CD1-CB 4.24Å; L9-F72 HydrophobicContact CD1-CD1 3.94Å; L9-F72 HydrophobicContact CD1-CE1 3.62Å; L9-Q75 VanDerWaalsContact CD1-OE1 3.27Å |
| 10 | E | 90.2 | Very high | 87.3 | Confident | 106 Ų | 106 | 91.9 Ų | 91.9 | 50% | 0.495 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -49.6 | -56.7 | 177.4 | -68.6 | 174.1 | 139.5 | 0 | 0 | 110.8 | E6 K7 S12 V13 D14 | E6-E10 WeakPolarHBondContact O-CG 3.45Å; E6-E10 PolarHBondContact O-N 3.12Å; K7-E10 WeakPolarHBondContact CA-OE2 2.99Å; E10-S12 PolarHBondContact O-N 2.8Å; E10-S12 VanDerWaalsContact O-N 3.12Å; E10-V13 WeakPolarHBondContact O-CA 3.34Å; E10-V13 WeakPolarHBondContact O-CB 3.34Å; E10-V13 PolarHBondContact O-N 2.71Å; E10-D14 PolarHBondContact O-N 3.08Å |
| 11 | A | 90.8 | Very high | 87.6 | Confident | 53 Ų | 53 | 89.3 Ų | 89.3 | 44% | 0.438 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -61.3 | -25.9 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | K7 L9 S15 | K7-A11 WeakPolarHBondContact O-CB 3.48Å; K7-A11 PolarHBondContact O-N 3.29Å; L9-A11 PolarHBondContact O-N 3.04Å; A11-S15 WeakPolarHBondContact O-CB 3.45Å; A11-S15 PolarHBondContact O-N 3.4Å; A11-S15 PolarHBondContact O-OG 3.2Å |
| 12 | S | 90.6 | Very high | 89.2 | Confident | 14 Ų | 14 | 85.5 Ų | 85.5 | 10% | 0.098 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -79.8 | -32.4 | 174.6 | -61.6 | 0 | 0 | 0 | 0 | 112.6 | Q8 L9 E10 L16 P70 | Q8-S12 WeakPolarHBondContact O-CB 3.4Å; Q8-S12 PolarHBondContact O-N 3Å; Q8-S12 PolarHBondContact O-OG 3.46Å; L9-S12 CarbonylContact O-C 3.55Å; L9-S12 WeakPolarHBondContact O-CA 3.4Å; L9-S12 WeakPolarHBondContact O-CB 3.44Å; L9-S12 PolarHBondContact O-N 3.35Å; E10-S12 PolarHBondContact O-N 2.8Å; E10-S12 VanDerWaalsContact O-N 3.12Å; S12-L16 WeakPolarHBondContact O-CB 3.25Å; S12-L16 PolarHBondContact O-N 2.82Å; S12-P70 VanDerWaalsContact OG-CD 3.24Å; S12-P70 WeakPolarHBondContact OG-CD 3.46Å |
| 13 | V | 90.7 | Very high | 90.2 | Very high | 55 Ų | 55 | 78.3 Ų | 78.3 | 33% | 0.333 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -69.6 | -47.4 | 172.9 | 172 | 0 | 0 | 0 | 0 | 110.1 | L9 E10 S15 L16 I17 F72 | L9-V13 HydrophobicContact CD1-CG2 4.24Å; L9-V13 HydrophobicContact CG-CG2 4.37Å; L9-V13 WeakPolarHBondContact O-CG2 3.44Å; L9-V13 PolarHBondContact O-N 3Å; E10-V13 WeakPolarHBondContact O-CA 3.34Å; E10-V13 WeakPolarHBondContact O-CB 3.34Å; E10-V13 PolarHBondContact O-N 2.71Å; V13-S15 VanDerWaalsContact C-N 3.28Å; V13-S15 PolarHBondContact O-N 2.88Å; V13-L16 WeakPolarHBondContact O-CB 3.33Å; V13-L16 PolarHBondContact O-N 3.21Å; V13-I17 HydrophobicContact CG1-CD1 3.72Å; V13-I17 HydrophobicContact CG1-CG1 4.31Å; V13-I17 WeakPolarHBondContact O-CG1 3.36Å; V13-I17 PolarHBondContact O-N 2.92Å; V13-F72 HydrophobicContact CG2-CE1 3.84Å; V13-F72 HydrophobicContact CG2-CZ 4.48Å |
| 14 | D | 92.8 | Very high | 90.8 | Very high | 97 Ų | 97 | 74.6 Ų | 74.6 | 52% | 0.519 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -58.1 | -41 | 175.4 | -66.6 | -28.8 | 0 | 0 | 0 | 112.1 | E10 S18 | E10-D14 PolarHBondContact O-N 3.08Å; D14-S18 WeakPolarHBondContact O-CB 3.45Å; D14-S18 PolarHBondContact O-N 3.47Å; D14-S18 PolarHBondContact O-OG 2.86Å |
| 15 | S | 92.6 | Very high | 91.4 | Very high | 62 Ų | 62 | 68.8 Ų | 68.8 | 43% | 0.434 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -62.5 | -41.3 | 174.5 | -63.3 | 0 | 0 | 0 | 0 | 112 | A11 V13 L19 | A11-S15 WeakPolarHBondContact O-CB 3.45Å; A11-S15 PolarHBondContact O-N 3.4Å; A11-S15 PolarHBondContact O-OG 3.2Å; V13-S15 VanDerWaalsContact C-N 3.28Å; V13-S15 PolarHBondContact O-N 2.88Å; S15-L19 WeakPolarHBondContact O-CG 3.35Å; S15-L19 PolarHBondContact O-N 3.49Å; S15-L19 VanDerWaalsContact O-N 3.1Å |
| 16 | L | 92.4 | Very high | 92 | Very high | 41 Ų | 41 | 64.6 Ų | 64.6 | 22% | 0.215 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -68.7 | -45.9 | 177.7 | -176.8 | 56.2 | 0 | 0 | 0 | 111.8 | S12 V13 S18 L19 V20 I60 M63 L64 | S12-L16 WeakPolarHBondContact O-CB 3.25Å; S12-L16 PolarHBondContact O-N 2.82Å; V13-L16 WeakPolarHBondContact O-CB 3.33Å; V13-L16 PolarHBondContact O-N 3.21Å; L16-S18 VanDerWaalsContact C-N 3.28Å; L16-S18 PolarHBondContact O-N 3.14Å; L16-L19 PolarHBondContact O-N 3.34Å; L16-V20 HydrophobicContact CD1-CG2 4.18Å; L16-V20 HydrophobicContact CG-CG2 4.47Å; L16-V20 WeakPolarHBondContact O-CB 2.76Å; L16-V20 WeakPolarHBondContact O-CG2 3Å; L16-V20 PolarHBondContact O-N 3.29Å; L16-I60 HydrophobicContact CD1-CG2 4.11Å; L16-M63 HydrophobicContact CB-CE 3.98Å; L16-M63 HydrophobicContact CB-SD 4.16Å; L16-M63 HydrophobicContact CD1-CE 3.89Å; L16-M63 HydrophobicContact CD1-SD 4.38Å; L16-M63 HydrophobicContact CD2-CE 4.36Å; L16-M63 HydrophobicContact CG-CE 4.29Å; L16-L64 HydrophobicContact CD1-CD2 4.35Å; L16-L64 HydrophobicContact CD2-CD2 4.16Å |
| 17 | I | 92.6 | Very high | 92.5 | Very high | 102 Ų | 102 | 63.4 Ų | 63.4 | 52% | 0.523 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -56.1 | -45.8 | 175.9 | -69.7 | 168.1 | 0 | 0 | 0 | 109.9 | V13 L19 V20 A21 | V13-I17 HydrophobicContact CG1-CD1 3.72Å; V13-I17 HydrophobicContact CG1-CG1 4.31Å; V13-I17 WeakPolarHBondContact O-CG1 3.36Å; V13-I17 PolarHBondContact O-N 2.92Å; I17-L19 PolarHBondContact O-N 3.32Å; I17-V20 PolarHBondContact O-N 2.92Å; I17-A21 WeakPolarHBondContact O-CB 3.43Å; I17-A21 PolarHBondContact O-N 2.88Å |
| 18 | S | 93.9 | Very high | 92.9 | Very high | 70 Ų | 70 | 63 Ų | 63 | 49% | 0.49 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -60.8 | -44.6 | 177.4 | -59.7 | 0 | 0 | 0 | 0 | 112.7 | D14 L16 A21 L22 | D14-S18 WeakPolarHBondContact O-CB 3.45Å; D14-S18 PolarHBondContact O-N 3.47Å; D14-S18 PolarHBondContact O-OG 2.86Å; L16-S18 VanDerWaalsContact C-N 3.28Å; L16-S18 PolarHBondContact O-N 3.14Å; S18-A21 PolarHBondContact O-N 2.92Å; S18-L22 WeakPolarHBondContact O-CG 3.44Å; S18-L22 PolarHBondContact O-N 2.7Å |
| 19 | L | 94.6 | Very high | 93.2 | Very high | 40 Ų | 40 | 62.2 Ų | 62.2 | 21% | 0.209 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -67.5 | -38.2 | 177.3 | -71.3 | 171.6 | 0 | 0 | 0 | 112.7 | S15 L16 I17 L22 T23 T59 I60 M63 | S15-L19 WeakPolarHBondContact O-CG 3.35Å; S15-L19 PolarHBondContact O-N 3.49Å; S15-L19 VanDerWaalsContact O-N 3.1Å; L16-L19 PolarHBondContact O-N 3.34Å; I17-L19 PolarHBondContact O-N 3.32Å; L19-L22 PolarHBondContact O-N 2.96Å; L19-T23 PolarHBondContact O-N 2.82Å; L19-T23 VanDerWaalsContact O-N 3.07Å; L19-T23 PolarHBondContact O-OG1 3.07Å; L19-T59 HydrophobicContact CD1-CG2 4.36Å; L19-T59 HydrophobicContact CD2-CG2 3.9Å; L19-I60 HydrophobicContact CB-CD1 4.32Å; L19-I60 HydrophobicContact CB-CG1 3.76Å; L19-I60 HydrophobicContact CD1-CG1 4.4Å; L19-M63 HydrophobicContact CD1-CB 4.33Å; L19-M63 HydrophobicContact CD1-CG 4.46Å; L19-M63 HydrophobicContact CD1-SD 4.03Å |
| 20 | V | 94.3 | Very high | 93.6 | Very high | 76 Ų | 76 | 61 Ų | 61 | 46% | 0.461 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -66.4 | -42.3 | 175.2 | 170.8 | 0 | 0 | 0 | 0 | 110.6 | L16 I17 L22 T23 K24 I60 | L16-V20 HydrophobicContact CD1-CG2 4.18Å; L16-V20 HydrophobicContact CG-CG2 4.47Å; L16-V20 WeakPolarHBondContact O-CB 2.76Å; L16-V20 WeakPolarHBondContact O-CG2 3Å; L16-V20 PolarHBondContact O-N 3.29Å; I17-V20 PolarHBondContact O-N 2.92Å; V20-L22 PolarHBondContact O-N 3.49Å; V20-T23 PolarHBondContact O-N 3.33Å; V20-K24 WeakPolarHBondContact O-CB 3.17Å; V20-K24 PolarHBondContact O-N 3.17Å; V20-I60 HydrophobicContact CG2-CD1 4.22Å |
| 21 | A | 93.4 | Very high | 93.8 | Very high | 38 Ų | 38 | 59.8 Ų | 59.8 | 31% | 0.314 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -61.3 | -43.6 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | I17 S18 T23 K24 N25 | I17-A21 WeakPolarHBondContact O-CB 3.43Å; I17-A21 PolarHBondContact O-N 2.88Å; S18-A21 PolarHBondContact O-N 2.92Å; A21-T23 VanDerWaalsContact C-N 3.31Å; A21-T23 PolarHBondContact O-N 3.18Å; A21-K24 PolarHBondContact O-N 3.39Å; A21-N25 WeakPolarHBondContact O-CB 3.41Å; A21-N25 PolarHBondContact O-N 2.71Å; A21-N25 PolarHBondContact O-OD1 3.42Å |
| 22 | L | 94.6 | Very high | 93.9 | Very high | 97 Ų | 97 | 63.6 Ų | 63.6 | 51% | 0.508 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -61 | -38.5 | 174 | -71.9 | 170.3 | 0 | 0 | 0 | 112.5 | S18 L19 V20 A26 Q56 | S18-L22 WeakPolarHBondContact O-CG 3.44Å; S18-L22 PolarHBondContact O-N 2.7Å; L19-L22 PolarHBondContact O-N 2.96Å; V20-L22 PolarHBondContact O-N 3.49Å; L22-A26 WeakPolarHBondContact O-CB 3.45Å; L22-A26 PolarHBondContact O-N 3.36Å; L22-A26 VanDerWaalsContact O-N 3.12Å; L22-Q56 PolarHBondContact O-NE2 2.9Å; L22-Q56 VanDerWaalsContact O-NE2 3.13Å |
| 23 | T | 96 | Very high | 94 | Very high | 10 Ų | 10 | 65.9 Ų | 65.9 | 6% | 0.061 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -70.5 | -43.9 | 178.3 | -50.3 | 0 | 0 | 0 | 0 | 111.3 | L19 V20 A21 N25 A26 L27 Q56 L57 I60 | L19-T23 PolarHBondContact O-N 2.82Å; L19-T23 VanDerWaalsContact O-N 3.07Å; L19-T23 PolarHBondContact O-OG1 3.07Å; V20-T23 PolarHBondContact O-N 3.33Å; A21-T23 VanDerWaalsContact C-N 3.31Å; A21-T23 PolarHBondContact O-N 3.18Å; T23-N25 PolarHBondContact O-N 2.63Å; T23-A26 PolarHBondContact O-N 3.4Å; T23-L27 HydrophobicContact CG2-CD1 4.45Å; T23-L27 WeakPolarHBondContact O-CG 3.32Å; T23-L27 PolarHBondContact O-N 3.22Å; T23-Q56 HydrophobicContact CG2-CB 4.42Å; T23-L57 HydrophobicContact CG2-CD2 4.04Å; T23-L57 HydrophobicContact CG2-CG 4.33Å; T23-I60 WeakPolarHBondContact OG1-CD1 3.45Å |
| 24 | K | 94.6 | Very high | 94.1 | Very high | 58 Ų | 58 | 67.1 Ų | 67.1 | 25% | 0.252 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -58.3 | -46.8 | 174.1 | -173.7 | -150.2 | 73.7 | -174.1 | 0 | 111.5 | V20 A21 A26 L27 Q28 E95 | V20-K24 WeakPolarHBondContact O-CB 3.17Å; V20-K24 PolarHBondContact O-N 3.17Å; A21-K24 PolarHBondContact O-N 3.39Å; K24-A26 VanDerWaalsContact C-N 3.33Å; K24-A26 PolarHBondContact O-N 3.29Å; K24-L27 PolarHBondContact O-N 3.29Å; K24-Q28 WeakPolarHBondContact O-CB 3.37Å; K24-Q28 PolarHBondContact O-N 2.93Å; K24-E95 IonicContact NZ-OE1 2.71Å; K24-E95 PolarHBondContact NZ-OE1 2.87Å; K24-E95 IonicContact NZ-OE2 3.92Å; K24-E95 PolarHBondContact NZ-OE2 2.9Å |
| 25 | N | 94.4 | Very high | 94.2 | Very high | 72 Ų | 72 | 68.6 Ų | 68.6 | 39% | 0.385 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -65.8 | -35.5 | -179.7 | -68.6 | -2.9 | 0 | 0 | 0 | 112.1 | A21 T23 S29 | A21-N25 WeakPolarHBondContact O-CB 3.41Å; A21-N25 PolarHBondContact O-N 2.71Å; A21-N25 PolarHBondContact O-OD1 3.42Å; T23-N25 PolarHBondContact O-N 2.63Å; N25-S29 VanDerWaalsContact O-CB 3.23Å; N25-S29 WeakPolarHBondContact O-CB 3.41Å; N25-S29 PolarHBondContact O-N 2.99Å; N25-S29 PolarHBondContact O-OG 3.25Å |
| 26 | A | 95.8 | Very high | 94.2 | Very high | 13 Ų | 13 | 70.1 Ų | 70.1 | 11% | 0.107 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -68.2 | -42.8 | 173 | 0 | 0 | 0 | 0 | 0 | 112.2 | L22 T23 K24 S29 F30 L52 L53 | L22-A26 WeakPolarHBondContact O-CB 3.45Å; L22-A26 PolarHBondContact O-N 3.36Å; L22-A26 VanDerWaalsContact O-N 3.12Å; T23-A26 PolarHBondContact O-N 3.4Å; K24-A26 VanDerWaalsContact C-N 3.33Å; K24-A26 PolarHBondContact O-N 3.29Å; A26-S29 PolarHBondContact O-N 2.93Å; A26-F30 WeakPolarHBondContact O-CB 3.45Å; A26-F30 PolarHBondContact O-N 3.24Å; A26-L52 HydrophobicContact CB-CD2 4.28Å; A26-L53 HydrophobicContact CB-CD2 3.75Å |
| 27 | L | 96.4 | Very high | 94.1 | Very high | 81 Ų | 81 | 72.3 Ų | 72.3 | 42% | 0.424 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -59.7 | -50.6 | 173.9 | -74.8 | 168.8 | 0 | 0 | 0 | 111.3 | T23 K24 S29 F30 I31 L53 | T23-L27 HydrophobicContact CG2-CD1 4.45Å; T23-L27 WeakPolarHBondContact O-CG 3.32Å; T23-L27 PolarHBondContact O-N 3.22Å; K24-L27 PolarHBondContact O-N 3.29Å; L27-S29 VanDerWaalsContact C-N 3.31Å; L27-S29 PolarHBondContact O-N 3.47Å; L27-F30 PolarHBondContact O-N 3.39Å; L27-F30 VanDerWaalsContact O-N 3.09Å; L27-I31 WeakPolarHBondContact O-CG1 3.27Å; L27-I31 PolarHBondContact O-N 3.48Å; L27-L53 HydrophobicContact CB-CD2 4.49Å; L27-L53 HydrophobicContact CD2-CD1 3.84Å; L27-L53 HydrophobicContact CD2-CD2 3.66Å; L27-L53 HydrophobicContact CD2-CG 4.39Å; L27-L53 HydrophobicContact CG-CD2 3.67Å |
| 28 | Q | 94.7 | Very high | 93.7 | Very high | 119 Ų | 119 | 74.8 Ų | 74.8 | 56% | 0.556 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -59.4 | -42.5 | 178.4 | -176 | 178.8 | -0.7 | 0 | 0 | 111.7 | K24 F30 Y32 | K24-Q28 WeakPolarHBondContact O-CB 3.37Å; K24-Q28 PolarHBondContact O-N 2.93Å; Q28-F30 VanDerWaalsContact C-N 3.31Å; Q28-F30 PolarHBondContact O-N 3.03Å; Q28-Y32 WeakPolarHBondContact O-CB 3.48Å; Q28-Y32 PolarHBondContact O-N 3.49Å |
| 29 | S | 93.9 | Very high | 93.4 | Very high | 63 Ų | 63 | 79.2 Ų | 79.2 | 44% | 0.441 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -67.6 | -28.7 | 176.7 | -63.9 | 0 | 0 | 0 | 0 | 113 | N25 A26 L27 K33 | N25-S29 VanDerWaalsContact O-CB 3.23Å; N25-S29 WeakPolarHBondContact O-CB 3.41Å; N25-S29 PolarHBondContact O-N 2.99Å; N25-S29 PolarHBondContact O-OG 3.25Å; A26-S29 PolarHBondContact O-N 2.93Å; L27-S29 VanDerWaalsContact C-N 3.31Å; L27-S29 PolarHBondContact O-N 3.47Å; S29-K33 WeakPolarHBondContact O-CD 3.31Å; S29-K33 WeakPolarHBondContact O-CE 3.37Å; S29-K33 VanDerWaalsContact O-CG 3.27Å; S29-K33 WeakPolarHBondContact O-CG 3.32Å; S29-K33 PolarHBondContact O-N 3.44Å |
| 30 | F | 95.3 | Very high | 93.1 | Very high | 13 Ų | 13 | 87.5 Ų | 87.5 | 6% | 0.057 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -80 | -42.4 | 176 | -178.5 | -138.4 | 0 | 0 | 0 | 111.9 | A26 L27 Q28 Y32 K33 L34 V46 N49 F50 L53 | A26-F30 WeakPolarHBondContact O-CB 3.45Å; A26-F30 PolarHBondContact O-N 3.24Å; L27-F30 PolarHBondContact O-N 3.39Å; L27-F30 VanDerWaalsContact O-N 3.09Å; Q28-F30 VanDerWaalsContact C-N 3.31Å; Q28-F30 PolarHBondContact O-N 3.03Å; F30-Y32 VanDerWaalsContact C-N 3.35Å; F30-Y32 PolarHBondContact O-N 2.94Å; F30-K33 PolarHBondContact O-N 2.85Å; F30-L34 HydrophobicContact CD1-CD1 4.09Å; F30-L34 HydrophobicContact CD2-CD1 4.16Å; F30-L34 HydrophobicContact CD2-CG 4.23Å; F30-L34 HydrophobicContact CE1-CD1 3.88Å; F30-L34 HydrophobicContact CE2-CD1 3.94Å; F30-L34 HydrophobicContact CE2-CD2 4.19Å; F30-L34 HydrophobicContact CE2-CG 3.97Å; F30-L34 HydrophobicContact CG-CD1 4.23Å; F30-L34 HydrophobicContact CZ-CD1 3.79Å; F30-L34 HydrophobicContact CZ-CD2 4.32Å; F30-L34 HydrophobicContact CZ-CG 4.25Å; F30-L34 WeakPolarHBondContact O-CG 3.42Å; F30-L34 PolarHBondContact O-N 3.34Å; F30-V46 HydrophobicContact CZ-CG1 4.2Å; F30-N49 HydrophobicContact CB-CB 4.36Å; F30-N49 HydrophobicContact CD1-CB 4.46Å; F30-N49 HydrophobicContact CD2-CB 3.49Å; F30-N49 VanDerWaalsContact CD2-CB 3.49Å; F30-N49 HydrophobicContact CE2-CB 3.81Å; F30-N49 HydrophobicContact CG-CB 3.87Å; F30-N49 HydrophobicContact CZ-CB 4.41Å; F30-F50 HydrophobicContact CE1-CD2 4.26Å; F30-F50 HydrophobicContact CE1-CE1 4.42Å; F30-F50 AromaticContact CE1-CE2 3.92Å; F30-F50 HydrophobicContact CE1-CE2 3.92Å; F30-F50 HydrophobicContact CE1-CZ 4Å; F30-F50 HydrophobicContact CZ-CD2 4.05Å; F30-F50 AromaticContact CZ-CE2 3.77Å; F30-F50 HydrophobicContact CZ-CE2 3.77Å; F30-F50 HydrophobicContact CZ-CZ 4.3Å; F30-L53 HydrophobicContact CD1-CD1 3.79Å; F30-L53 HydrophobicContact CE1-CD1 4.39Å |
| 31 | I | 94.8 | Very high | 92.9 | Very high | 82 Ų | 82 | 85.7 Ų | 85.7 | 42% | 0.421 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -57.7 | -47.8 | 172.5 | -67.5 | 163.8 | 0 | 0 | 0 | 110.1 | L27 K33 L34 E35 | L27-I31 WeakPolarHBondContact O-CG1 3.27Å; L27-I31 PolarHBondContact O-N 3.48Å; I31-K33 VanDerWaalsContact C-N 3.29Å; I31-K33 PolarHBondContact O-N 3.12Å; I31-L34 WeakPolarHBondContact O-CB 3.4Å; I31-L34 PolarHBondContact O-N 3.42Å; I31-E35 HydrophobicContact CG2-CG 4.29Å; I31-E35 WeakPolarHBondContact O-CG 3.41Å; I31-E35 PolarHBondContact O-N 2.99Å |
| 32 | Y | 93.9 | Very high | 92.8 | Very high | 132 Ų | 132 | 87.1 Ų | 87.1 | 52% | 0.518 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -55.2 | -42.7 | 177.4 | -179 | -92.7 | 0 | 0 | 0 | 112.7 | Q28 F30 E35 N36 | Q28-Y32 WeakPolarHBondContact O-CB 3.48Å; Q28-Y32 PolarHBondContact O-N 3.49Å; F30-Y32 VanDerWaalsContact C-N 3.35Å; F30-Y32 PolarHBondContact O-N 2.94Å; Y32-E35 PolarHBondContact O-N 3.35Å; Y32-N36 VanDerWaalsContact CD2-ND2 3.35Å; Y32-N36 WeakPolarHBondContact CD2-ND2 3.4Å; Y32-N36 HydrophobicContact CE1-CB 4.19Å; Y32-N36 HydrophobicContact CE2-CB 4.28Å; Y32-N36 WeakPolarHBondContact CE2-ND2 3.36Å; Y32-N36 VanDerWaalsContact O-CB 3.31Å; Y32-N36 WeakPolarHBondContact O-CB 3.47Å; Y32-N36 PolarHBondContact O-N 3.45Å; Y32-N36 PolarHBondContact O-ND2 2.95Å |
| 33 | K | 92.7 | Very high | 92.7 | Very high | 63 Ų | 63 | 90.9 Ų | 90.9 | 27% | 0.274 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -67.2 | -39.1 | 175.8 | -66.3 | 168.4 | -166.7 | 174 | 0 | 112.6 | S29 F30 I31 E35 E37 Y38 N49 | S29-K33 WeakPolarHBondContact O-CD 3.31Å; S29-K33 WeakPolarHBondContact O-CE 3.37Å; S29-K33 VanDerWaalsContact O-CG 3.27Å; S29-K33 WeakPolarHBondContact O-CG 3.32Å; S29-K33 PolarHBondContact O-N 3.44Å; F30-K33 PolarHBondContact O-N 2.85Å; I31-K33 VanDerWaalsContact C-N 3.29Å; I31-K33 PolarHBondContact O-N 3.12Å; K33-E35 VanDerWaalsContact C-N 3.29Å; K33-E35 PolarHBondContact O-N 3.48Å; K33-E37 HydrophobicContact CB-CB 4.46Å; K33-E37 CarbonylContact O-C 3.6Å; K33-E37 WeakPolarHBondContact O-CA 3.49Å; K33-E37 WeakPolarHBondContact O-CB 3.4Å; K33-E37 PolarHBondContact O-N 3.05Å; K33-Y38 PolarHBondContact O-N 3Å; K33-N49 PolarHBondContact NZ-OD1 2.85Å |
| 34 | L | 93.2 | Very high | 92.7 | Very high | 81 Ų | 81 | 94.1 Ų | 94.1 | 42% | 0.424 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -65.3 | -31.9 | 176.2 | -72 | 164.6 | 0 | 0 | 0 | 112.3 | F30 I31 L41 | F30-L34 HydrophobicContact CD1-CD1 4.09Å; F30-L34 HydrophobicContact CD2-CD1 4.16Å; F30-L34 HydrophobicContact CD2-CG 4.23Å; F30-L34 HydrophobicContact CE1-CD1 3.88Å; F30-L34 HydrophobicContact CE2-CD1 3.94Å; F30-L34 HydrophobicContact CE2-CD2 4.19Å; F30-L34 HydrophobicContact CE2-CG 3.97Å; F30-L34 HydrophobicContact CG-CD1 4.23Å; F30-L34 HydrophobicContact CZ-CD1 3.79Å; F30-L34 HydrophobicContact CZ-CD2 4.32Å; F30-L34 HydrophobicContact CZ-CG 4.25Å; F30-L34 WeakPolarHBondContact O-CG 3.42Å; F30-L34 PolarHBondContact O-N 3.34Å; I31-L34 WeakPolarHBondContact O-CB 3.4Å; I31-L34 PolarHBondContact O-N 3.42Å; L34-L41 HydrophobicContact CD2-CD2 3.63Å; L34-L41 HydrophobicContact CG-CD2 4.24Å |
| 35 | E | 93.7 | Very high | 92.5 | Very high | 128 Ų | 128 | 94.6 Ų | 94.6 | 60% | 0.598 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -88.6 | -37.3 | -179.2 | -68.6 | 175 | 159.2 | 0 | 0 | 113.3 | I31 Y32 K33 Y38 | I31-E35 HydrophobicContact CG2-CG 4.29Å; I31-E35 WeakPolarHBondContact O-CG 3.41Å; I31-E35 PolarHBondContact O-N 2.99Å; Y32-E35 PolarHBondContact O-N 3.35Å; K33-E35 VanDerWaalsContact C-N 3.29Å; K33-E35 PolarHBondContact O-N 3.48Å; E35-Y38 WeakPolarHBondContact O-CD1 3.48Å |
| 36 | N | 92.4 | Very high | 92.5 | Very high | 94 Ų | 94 | 92 Ų | 92 | 50% | 0.503 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -111.7 | -20.8 | -169.1 | -59.7 | -95.1 | 0 | 0 | 0 | 113.9 | Y32 | Y32-N36 VanDerWaalsContact CD2-ND2 3.35Å; Y32-N36 WeakPolarHBondContact CD2-ND2 3.4Å; Y32-N36 HydrophobicContact CE1-CB 4.19Å; Y32-N36 HydrophobicContact CE2-CB 4.28Å; Y32-N36 WeakPolarHBondContact CE2-ND2 3.36Å; Y32-N36 VanDerWaalsContact O-CB 3.31Å; Y32-N36 WeakPolarHBondContact O-CB 3.47Å; Y32-N36 PolarHBondContact O-N 3.45Å; Y32-N36 PolarHBondContact O-ND2 2.95Å |
| 37 | E | 90.8 | Very high | 92.4 | Very high | 87 Ų | 87 | 95.4 Ų | 95.4 | 41% | 0.407 | 45% | 0.452 | S | S | . | . | S | Bend | trans | -120.3 | 11.2 | -174.1 | -57.6 | -175 | 175.1 | 0 | 0 | 113.2 | K33 E39 R40 L41 | K33-E37 HydrophobicContact CB-CB 4.46Å; K33-E37 CarbonylContact O-C 3.6Å; K33-E37 WeakPolarHBondContact O-CA 3.49Å; K33-E37 WeakPolarHBondContact O-CB 3.4Å; K33-E37 PolarHBondContact O-N 3.05Å; E37-E39 VanDerWaalsContact C-N 3.26Å; E37-E39 PolarHBondContact O-N 3.09Å; E37-E39 VanDerWaalsContact O-N 3.12Å; E37-R40 CarbonylContact O-C 3.36Å; E37-R40 WeakPolarHBondContact O-CA 3.45Å; E37-R40 PolarHBondContact O-N 3.26Å; E37-L41 PolarHBondContact O-N 3.16Å |
| 38 | Y | 85.1 | Confident | 92.4 | Very high | 153 Ų | 153 | 96.5 Ų | 96.5 | 60% | 0.6 | 46% | 0.459 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.8 | -34.9 | -172.9 | 62.2 | -91.7 | 0 | 0 | 0 | 114.5 | K33 E35 R40 L41 | K33-Y38 PolarHBondContact O-N 3Å; E35-Y38 WeakPolarHBondContact O-CD1 3.48Å; Y38-R40 PolarHBondContact O-N 2.88Å; Y38-L41 PolarHBondContact O-N 3.39Å |
| 39 | E | 87.6 | Confident | 92.4 | Very high | 164 Ų | 164 | 91.9 Ų | 91.9 | 77% | 0.766 | 44% | 0.437 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.9 | -21.1 | 175.8 | -59.3 | -169.5 | 146 | 0 | 0 | 113.6 | E37 | E37-E39 VanDerWaalsContact C-N 3.26Å; E37-E39 PolarHBondContact O-N 3.09Å; E37-E39 VanDerWaalsContact O-N 3.12Å |
| 40 | R | 87.1 | Confident | 92.5 | Very high | 214 Ų | 214 | 94.2 Ų | 94.2 | 81% | 0.808 | 44% | 0.44 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -110.4 | -10 | -177.4 | -61.1 | 177.1 | -179.4 | -110.6 | -4.3 | 112.6 | E37 Y38 T42 | E37-R40 CarbonylContact O-C 3.36Å; E37-R40 WeakPolarHBondContact O-CA 3.45Å; E37-R40 PolarHBondContact O-N 3.26Å; Y38-R40 PolarHBondContact O-N 2.88Å; R40-T42 PolarHBondContact O-N 2.93Å |
| 41 | L | 89.7 | Confident | 92.5 | Very high | 38 Ų | 38 | 95.8 Ų | 95.8 | 20% | 0.199 | 46% | 0.46 | C | S | . | . | trans | -79.6 | 105.7 | -171 | -175.4 | 62.8 | 0 | 0 | 0 | 111.2 | L34 E37 Y38 N45 V46 | L34-L41 HydrophobicContact CD2-CD2 3.63Å; L34-L41 HydrophobicContact CG-CD2 4.24Å; E37-L41 PolarHBondContact O-N 3.16Å; Y38-L41 PolarHBondContact O-N 3.39Å; L41-N45 HydrophobicContact CD1-CB 4.11Å; L41-V46 HydrophobicContact CD1-CG2 4.22Å; L41-V46 HydrophobicContact CD2-CG2 3.86Å; L41-V46 HydrophobicContact CG-CG2 3.76Å | ||
| 42 | T | 92.4 | Very high | 92.6 | Very high | 68 Ų | 68 | 96.2 Ų | 96.2 | 42% | 0.417 | 46% | 0.463 | S | S | . | . | trans | -81.8 | 151.5 | 178.9 | 79.6 | 0 | 0 | 0 | 0 | 112 | R40 P44 N45 V46 | R40-T42 PolarHBondContact O-N 2.93Å; T42-P44 WeakPolarHBondContact OG1-CD 3.31Å; T42-N45 WeakPolarHBondContact O-CA 3.27Å; T42-N45 WeakPolarHBondContact O-CB 3.23Å; T42-N45 PolarHBondContact O-N 3.49Å; T42-N45 VanDerWaalsContact OG1-CG 3.29Å; T42-N45 PolarHBondContact OG1-OD1 3.32Å; T42-V46 PolarHBondContact O-N 2.93Å | ||
| 43 | W | 92.7 | Very high | 92.7 | Very high | 176 Ų | 176 | 90.6 Ų | 90.6 | 67% | 0.667 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -56.9 | -39.6 | 177.5 | 178.5 | -113.7 | 0 | 0 | 0 | 114.3 | N45 V46 L47 | W43-N45 VanDerWaalsContact C-N 3.31Å; W43-N45 PolarHBondContact O-N 3.44Å; W43-V46 HydrophobicContact CE3-CB 3.89Å; W43-V46 HydrophobicContact CE3-CG1 3.8Å; W43-V46 HydrophobicContact CE3-CG2 4.43Å; W43-V46 HydrophobicContact CZ3-CB 4.23Å; W43-V46 HydrophobicContact CZ3-CG1 3.6Å; W43-V46 WeakPolarHBondContact O-CB 3.19Å; W43-V46 PolarHBondContact O-N 3.39Å; W43-L47 HydrophobicContact CD2-CG 4.35Å; W43-L47 HydrophobicContact CH2-CD2 4.17Å; W43-L47 HydrophobicContact CZ2-CD1 4.41Å; W43-L47 HydrophobicContact CZ2-CD2 3.66Å; W43-L47 HydrophobicContact CZ2-CG 4.04Å; W43-L47 PolarHBondContact O-N 3.4Å |
| 44 | P | 94.6 | Very high | 92.9 | Very high | 78 Ų | 78 | 90.5 Ų | 90.5 | 51% | 0.506 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -52.8 | -45.8 | 167.9 | -29.6 | 36.5 | 0 | 0 | 0 | 113.2 | T42 V46 L47 D48 | T42-P44 WeakPolarHBondContact OG1-CD 3.31Å; P44-V46 VanDerWaalsContact C-N 3.34Å; P44-V46 PolarHBondContact O-N 3.49Å; P44-L47 WeakPolarHBondContact O-CB 3.29Å; P44-L47 PolarHBondContact O-N 3Å; P44-L47 VanDerWaalsContact O-N 3.15Å; P44-D48 PolarHBondContact O-N 3.28Å |
| 45 | N | 91 | Very high | 93 | Very high | 68 Ų | 68 | 88.4 Ų | 88.4 | 36% | 0.364 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -66.4 | -35.9 | 178.2 | -54.8 | 131.1 | 0 | 0 | 0 | 112.2 | L41 T42 W43 L47 D48 N49 | L41-N45 HydrophobicContact CD1-CB 4.11Å; T42-N45 WeakPolarHBondContact O-CA 3.27Å; T42-N45 WeakPolarHBondContact O-CB 3.23Å; T42-N45 PolarHBondContact O-N 3.49Å; T42-N45 VanDerWaalsContact OG1-CG 3.29Å; T42-N45 PolarHBondContact OG1-OD1 3.32Å; W43-N45 VanDerWaalsContact C-N 3.31Å; W43-N45 PolarHBondContact O-N 3.44Å; N45-L47 VanDerWaalsContact C-N 3.34Å; N45-D48 PolarHBondContact O-N 2.84Å; N45-N49 PolarHBondContact O-N 3.32Å; N45-N49 VanDerWaalsContact O-N 3.08Å; N45-N49 PolarHBondContact O-ND2 3.41Å |
| 46 | V | 93.8 | Very high | 93.1 | Very high | 18 Ų | 18 | 83.9 Ų | 83.9 | 11% | 0.109 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -57.8 | -48.6 | 171.5 | 173.6 | 0 | 0 | 0 | 0 | 110.2 | F30 L41 T42 W43 P44 D48 N49 F50 | F30-V46 HydrophobicContact CZ-CG1 4.2Å; L41-V46 HydrophobicContact CD1-CG2 4.22Å; L41-V46 HydrophobicContact CD2-CG2 3.86Å; L41-V46 HydrophobicContact CG-CG2 3.76Å; T42-V46 PolarHBondContact O-N 2.93Å; W43-V46 HydrophobicContact CE3-CB 3.89Å; W43-V46 HydrophobicContact CE3-CG1 3.8Å; W43-V46 HydrophobicContact CE3-CG2 4.43Å; W43-V46 HydrophobicContact CZ3-CB 4.23Å; W43-V46 HydrophobicContact CZ3-CG1 3.6Å; W43-V46 WeakPolarHBondContact O-CB 3.19Å; W43-V46 PolarHBondContact O-N 3.39Å; P44-V46 VanDerWaalsContact C-N 3.34Å; P44-V46 PolarHBondContact O-N 3.49Å; V46-D48 PolarHBondContact O-N 3.19Å; V46-N49 PolarHBondContact O-N 2.93Å; V46-F50 HydrophobicContact CG1-CD2 3.72Å; V46-F50 HydrophobicContact CG1-CE2 3.71Å; V46-F50 WeakPolarHBondContact O-CD2 3.3Å; V46-F50 PolarHBondContact O-N 2.76Å |
| 47 | L | 95.3 | Very high | 93.3 | Very high | 84 Ų | 84 | 83.7 Ų | 83.7 | 44% | 0.44 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -61.9 | -38.3 | 176.1 | -69.2 | 177.9 | 0 | 0 | 0 | 113 | W43 P44 N45 F50 G51 | W43-L47 HydrophobicContact CD2-CG 4.35Å; W43-L47 HydrophobicContact CH2-CD2 4.17Å; W43-L47 HydrophobicContact CZ2-CD1 4.41Å; W43-L47 HydrophobicContact CZ2-CD2 3.66Å; W43-L47 HydrophobicContact CZ2-CG 4.04Å; W43-L47 PolarHBondContact O-N 3.4Å; P44-L47 WeakPolarHBondContact O-CB 3.29Å; P44-L47 PolarHBondContact O-N 3Å; P44-L47 VanDerWaalsContact O-N 3.15Å; N45-L47 VanDerWaalsContact C-N 3.34Å; L47-F50 PolarHBondContact O-N 3.44Å; L47-G51 PolarHBondContact O-N 3.12Å |
| 48 | D | 95.2 | Very high | 93.5 | Very high | 104 Ų | 104 | 83.4 Ų | 83.4 | 56% | 0.556 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -61.9 | -44.9 | 176.6 | -63.6 | -37.8 | 0 | 0 | 0 | 111.7 | P44 N45 V46 G51 L52 | P44-D48 PolarHBondContact O-N 3.28Å; N45-D48 PolarHBondContact O-N 2.84Å; V46-D48 PolarHBondContact O-N 3.19Å; D48-G51 PolarHBondContact O-N 2.94Å; D48-L52 PolarHBondContact O-N 2.89Å |
| 49 | N | 94.4 | Very high | 93.9 | Very high | 21 Ų | 21 | 79.3 Ų | 79.3 | 11% | 0.112 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -67.8 | -40 | 177.3 | -67.6 | -93.3 | 0 | 0 | 0 | 110.9 | F30 K33 N45 V46 G51 L52 L53 | F30-N49 HydrophobicContact CB-CB 4.36Å; F30-N49 HydrophobicContact CD1-CB 4.46Å; F30-N49 HydrophobicContact CD2-CB 3.49Å; F30-N49 VanDerWaalsContact CD2-CB 3.49Å; F30-N49 HydrophobicContact CE2-CB 3.81Å; F30-N49 HydrophobicContact CG-CB 3.87Å; F30-N49 HydrophobicContact CZ-CB 4.41Å; K33-N49 PolarHBondContact NZ-OD1 2.85Å; N45-N49 PolarHBondContact O-N 3.32Å; N45-N49 VanDerWaalsContact O-N 3.08Å; N45-N49 PolarHBondContact O-ND2 3.41Å; V46-N49 PolarHBondContact O-N 2.93Å; N49-G51 VanDerWaalsContact C-N 3.35Å; N49-G51 PolarHBondContact O-N 2.68Å; N49-L52 PolarHBondContact O-N 2.96Å; N49-L53 VanDerWaalsContact O-CG 3.3Å; N49-L53 WeakPolarHBondContact O-CG 3.47Å; N49-L53 PolarHBondContact O-N 3.32Å |
| 50 | F | 96.1 | Very high | 94.2 | Very high | 112 Ų | 112 | 72.4 Ų | 72.4 | 49% | 0.491 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -62.9 | -38 | 172 | -88.3 | -68.5 | 0 | 0 | 0 | 112.9 | F30 V46 L47 L53 S54 | F30-F50 HydrophobicContact CE1-CD2 4.26Å; F30-F50 HydrophobicContact CE1-CE1 4.42Å; F30-F50 AromaticContact CE1-CE2 3.92Å; F30-F50 HydrophobicContact CE1-CE2 3.92Å; F30-F50 HydrophobicContact CE1-CZ 4Å; F30-F50 HydrophobicContact CZ-CD2 4.05Å; F30-F50 AromaticContact CZ-CE2 3.77Å; F30-F50 HydrophobicContact CZ-CE2 3.77Å; F30-F50 HydrophobicContact CZ-CZ 4.3Å; V46-F50 HydrophobicContact CG1-CD2 3.72Å; V46-F50 HydrophobicContact CG1-CE2 3.71Å; V46-F50 WeakPolarHBondContact O-CD2 3.3Å; V46-F50 PolarHBondContact O-N 2.76Å; L47-F50 PolarHBondContact O-N 3.44Å; F50-L53 PolarHBondContact O-N 3.37Å; F50-S54 VanDerWaalsContact O-CB 3.23Å; F50-S54 WeakPolarHBondContact O-CB 3.42Å; F50-S54 PolarHBondContact O-N 2.87Å |
| 51 | G | 96.5 | Very high | 94.4 | Very high | 46 Ų | 46 | 65.6 Ų | 65.6 | 47% | 0.474 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -63.5 | -43.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | L47 D48 N49 G55 | L47-G51 PolarHBondContact O-N 3.12Å; D48-G51 PolarHBondContact O-N 2.94Å; N49-G51 VanDerWaalsContact C-N 3.35Å; N49-G51 PolarHBondContact O-N 2.68Å; G51-G55 PolarHBondContact O-N 3.5Å |
| 52 | L | 95.9 | Very high | 94.5 | Very high | 92 Ų | 92 | 71 Ų | 71 | 48% | 0.482 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -60.1 | -51.3 | 173.4 | 175.9 | 61.4 | 0 | 0 | 0 | 111.8 | A26 D48 N49 S54 G55 Q56 | A26-L52 HydrophobicContact CB-CD2 4.28Å; D48-L52 PolarHBondContact O-N 2.89Å; N49-L52 PolarHBondContact O-N 2.96Å; L52-S54 PolarHBondContact O-N 2.98Å; L52-G55 PolarHBondContact O-N 3.38Å; L52-G55 VanDerWaalsContact O-N 3.14Å; L52-Q56 HydrophobicContact CD1-CG 4.33Å; L52-Q56 WeakPolarHBondContact O-CG 3.45Å; L52-Q56 PolarHBondContact O-N 3.04Å |
| 53 | L | 96.6 | Very high | 94.4 | Very high | 13 Ų | 13 | 69 Ų | 69 | 7% | 0.068 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -60.4 | -45.2 | 179.3 | -71.2 | 170 | 0 | 0 | 0 | 111.8 | A26 L27 F30 N49 F50 G55 Q56 L57 | A26-L53 HydrophobicContact CB-CD2 3.75Å; L27-L53 HydrophobicContact CB-CD2 4.49Å; L27-L53 HydrophobicContact CD2-CD1 3.84Å; L27-L53 HydrophobicContact CD2-CD2 3.66Å; L27-L53 HydrophobicContact CD2-CG 4.39Å; L27-L53 HydrophobicContact CG-CD2 3.67Å; F30-L53 HydrophobicContact CD1-CD1 3.79Å; F30-L53 HydrophobicContact CE1-CD1 4.39Å; N49-L53 VanDerWaalsContact O-CG 3.3Å; N49-L53 WeakPolarHBondContact O-CG 3.47Å; N49-L53 PolarHBondContact O-N 3.32Å; F50-L53 PolarHBondContact O-N 3.37Å; L53-G55 VanDerWaalsContact C-N 3.33Å; L53-G55 PolarHBondContact O-N 3.3Å; L53-Q56 PolarHBondContact O-N 2.96Å; L53-L57 WeakPolarHBondContact O-CB 3.35Å; L53-L57 WeakPolarHBondContact O-CG 3.45Å; L53-L57 PolarHBondContact O-N 3.15Å |
| 54 | S | 96.3 | Very high | 94.2 | Very high | 62 Ų | 62 | 64.5 Ų | 64.5 | 43% | 0.434 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -60.3 | -41.5 | 174.1 | -177 | 0 | 0 | 0 | 0 | 111.8 | F50 L52 N58 | F50-S54 VanDerWaalsContact O-CB 3.23Å; F50-S54 WeakPolarHBondContact O-CB 3.42Å; F50-S54 PolarHBondContact O-N 2.87Å; L52-S54 PolarHBondContact O-N 2.98Å; S54-N58 VanDerWaalsContact O-CB 3.25Å; S54-N58 WeakPolarHBondContact O-CB 3.35Å; S54-N58 PolarHBondContact O-N 2.97Å; S54-N58 PolarHBondContact O-ND2 2.89Å; S54-N58 PolarHBondContact OG-ND2 3.2Å |
| 55 | G | 96.4 | Very high | 93.8 | Very high | 37 Ų | 37 | 68 Ų | 68 | 38% | 0.381 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -62.1 | -42.7 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | G51 L52 L53 T59 | G51-G55 PolarHBondContact O-N 3.5Å; L52-G55 PolarHBondContact O-N 3.38Å; L52-G55 VanDerWaalsContact O-N 3.14Å; L53-G55 VanDerWaalsContact C-N 3.33Å; L53-G55 PolarHBondContact O-N 3.3Å; G55-T59 WeakPolarHBondContact O-CB 3.44Å; G55-T59 PolarHBondContact O-N 3.33Å; G55-T59 PolarHBondContact O-OG1 2.84Å |
| 56 | Q | 95.3 | Very high | 93.4 | Very high | 33 Ų | 33 | 68.3 Ų | 68.3 | 15% | 0.154 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -66.9 | -48.1 | 177.2 | -70.4 | 174.3 | -35.5 | 0 | 0 | 111.8 | L22 T23 L52 L53 N58 T59 I60 | L22-Q56 PolarHBondContact O-NE2 2.9Å; L22-Q56 VanDerWaalsContact O-NE2 3.13Å; T23-Q56 HydrophobicContact CG2-CB 4.42Å; L52-Q56 HydrophobicContact CD1-CG 4.33Å; L52-Q56 WeakPolarHBondContact O-CG 3.45Å; L52-Q56 PolarHBondContact O-N 3.04Å; L53-Q56 PolarHBondContact O-N 2.96Å; Q56-N58 VanDerWaalsContact C-N 3.31Å; Q56-N58 PolarHBondContact O-N 3.45Å; Q56-T59 WeakPolarHBondContact O-CA 3.34Å; Q56-T59 WeakPolarHBondContact O-CB 3.5Å; Q56-T59 PolarHBondContact O-N 3.33Å; Q56-I60 PolarHBondContact O-N 3.01Å |
| 57 | L | 95.6 | Very high | 92.3 | Very high | 89 Ų | 89 | 76.8 Ų | 76.8 | 47% | 0.466 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -62.4 | -35.7 | 175.8 | -69.7 | 172 | 0 | 0 | 0 | 112.6 | T23 L53 T59 N61 | T23-L57 HydrophobicContact CG2-CD2 4.04Å; T23-L57 HydrophobicContact CG2-CG 4.33Å; L53-L57 WeakPolarHBondContact O-CB 3.35Å; L53-L57 WeakPolarHBondContact O-CG 3.45Å; L53-L57 PolarHBondContact O-N 3.15Å; L57-T59 VanDerWaalsContact C-N 3.32Å; L57-N61 WeakPolarHBondContact O-CB 3.44Å; L57-N61 PolarHBondContact O-N 3.48Å; L57-N61 PolarHBondContact O-ND2 2.78Å |
| 58 | N | 95.4 | Very high | 91.2 | Very high | 82 Ų | 82 | 80.7 Ų | 80.7 | 44% | 0.439 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -67.6 | -31.5 | 171.3 | -87.6 | -75.4 | 0 | 0 | 0 | 112.4 | S54 Q56 K62 | S54-N58 VanDerWaalsContact O-CB 3.25Å; S54-N58 WeakPolarHBondContact O-CB 3.35Å; S54-N58 PolarHBondContact O-N 2.97Å; S54-N58 PolarHBondContact O-ND2 2.89Å; S54-N58 PolarHBondContact OG-ND2 3.2Å; Q56-N58 VanDerWaalsContact C-N 3.31Å; Q56-N58 PolarHBondContact O-N 3.45Å; N58-K62 WeakPolarHBondContact O-CB 3.5Å; N58-K62 VanDerWaalsContact O-CG 3.26Å; N58-K62 WeakPolarHBondContact O-CG 3.42Å; N58-K62 PolarHBondContact O-N 3.07Å |
| 59 | T | 94.3 | Very high | 90 | Very high | 66 Ų | 66 | 76.8 Ų | 76.8 | 41% | 0.405 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -71.6 | -44 | 176.8 | -58.3 | 0 | 0 | 0 | 0 | 111 | L19 G55 Q56 L57 N61 K62 M63 | L19-T59 HydrophobicContact CD1-CG2 4.36Å; L19-T59 HydrophobicContact CD2-CG2 3.9Å; G55-T59 WeakPolarHBondContact O-CB 3.44Å; G55-T59 PolarHBondContact O-N 3.33Å; G55-T59 PolarHBondContact O-OG1 2.84Å; Q56-T59 WeakPolarHBondContact O-CA 3.34Å; Q56-T59 WeakPolarHBondContact O-CB 3.5Å; Q56-T59 PolarHBondContact O-N 3.33Å; L57-T59 VanDerWaalsContact C-N 3.32Å; T59-N61 PolarHBondContact O-N 3.01Å; T59-K62 PolarHBondContact O-N 3.5Å; T59-M63 PolarHBondContact O-N 3.05Å |
| 60 | I | 93.6 | Very high | 89.1 | Confident | 20 Ų | 20 | 77.2 Ų | 77.2 | 10% | 0.103 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -58.1 | -47.7 | 170.6 | -67.3 | 169 | 0 | 0 | 0 | 110.4 | L16 L19 V20 T23 Q56 K62 M63 L64 | L16-I60 HydrophobicContact CD1-CG2 4.11Å; L19-I60 HydrophobicContact CB-CD1 4.32Å; L19-I60 HydrophobicContact CB-CG1 3.76Å; L19-I60 HydrophobicContact CD1-CG1 4.4Å; V20-I60 HydrophobicContact CG2-CD1 4.22Å; T23-I60 WeakPolarHBondContact OG1-CD1 3.45Å; Q56-I60 PolarHBondContact O-N 3.01Å; I60-K62 VanDerWaalsContact C-N 3.33Å; I60-K62 PolarHBondContact O-N 3.36Å; I60-M63 PolarHBondContact O-N 3.38Å; I60-M63 VanDerWaalsContact O-N 3.16Å; I60-L64 HydrophobicContact CG2-CD1 3.73Å; I60-L64 HydrophobicContact CG2-CG 4.28Å; I60-L64 WeakPolarHBondContact O-CG 3.36Å; I60-L64 PolarHBondContact O-N 2.86Å |
| 61 | N | 92.1 | Very high | 88.1 | Confident | 71 Ų | 71 | 74.7 Ų | 74.7 | 38% | 0.38 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -58.9 | -39.8 | 176.8 | -96.1 | -85.9 | 0 | 0 | 0 | 113.4 | L57 T59 K65 | L57-N61 WeakPolarHBondContact O-CB 3.44Å; L57-N61 PolarHBondContact O-N 3.48Å; L57-N61 PolarHBondContact O-ND2 2.78Å; T59-N61 PolarHBondContact O-N 3.01Å; N61-K65 WeakPolarHBondContact O-CB 3.48Å; N61-K65 WeakPolarHBondContact O-CD 3.49Å; N61-K65 WeakPolarHBondContact O-CG 3.37Å; N61-K65 PolarHBondContact O-N 3.47Å; N61-K65 PolarHBondContact OD1-NZ 3.1Å |
| 62 | K | 91.7 | Very high | 87.4 | Confident | 152 Ų | 152 | 75.2 Ų | 75.2 | 66% | 0.661 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -66.9 | -40.5 | 175.6 | -76.8 | 169.1 | -177.9 | 177.4 | 0 | 111.6 | N58 T59 I60 K65 N66 | N58-K62 WeakPolarHBondContact O-CB 3.5Å; N58-K62 VanDerWaalsContact O-CG 3.26Å; N58-K62 WeakPolarHBondContact O-CG 3.42Å; N58-K62 PolarHBondContact O-N 3.07Å; T59-K62 PolarHBondContact O-N 3.5Å; I60-K62 VanDerWaalsContact C-N 3.33Å; I60-K62 PolarHBondContact O-N 3.36Å; K62-K65 PolarHBondContact O-N 3.33Å; K62-N66 WeakPolarHBondContact O-CB 3.33Å; K62-N66 PolarHBondContact O-N 2.79Å |
| 63 | M | 89.6 | Confident | 86.6 | Confident | 25 Ų | 25 | 81.5 Ų | 81.5 | 12% | 0.123 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -64.5 | -47.2 | 177 | -164.4 | -142 | 77.2 | 0 | 0 | 111.6 | L16 L19 T59 I60 K65 N66 T69 F72 | L16-M63 HydrophobicContact CB-CE 3.98Å; L16-M63 HydrophobicContact CB-SD 4.16Å; L16-M63 HydrophobicContact CD1-CE 3.89Å; L16-M63 HydrophobicContact CD1-SD 4.38Å; L16-M63 HydrophobicContact CD2-CE 4.36Å; L16-M63 HydrophobicContact CG-CE 4.29Å; L19-M63 HydrophobicContact CD1-CB 4.33Å; L19-M63 HydrophobicContact CD1-CG 4.46Å; L19-M63 HydrophobicContact CD1-SD 4.03Å; T59-M63 PolarHBondContact O-N 3.05Å; I60-M63 PolarHBondContact O-N 3.38Å; I60-M63 VanDerWaalsContact O-N 3.16Å; M63-K65 PolarHBondContact O-N 3.49Å; M63-N66 WeakPolarHBondContact O-CB 3.3Å; M63-N66 PolarHBondContact O-N 2.98Å; M63-T69 HydrophobicContact CE-CG2 4.25Å; M63-T69 PolarHBondContact O-OG1 3.44Å; M63-F72 HydrophobicContact CE-CE2 4.03Å |
| 64 | L | 87.8 | Confident | 85.8 | Confident | 81 Ų | 81 | 85.4 Ų | 85.4 | 42% | 0.424 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -68.8 | -15.6 | 179 | -66.6 | 173.4 | 0 | 0 | 0 | 114.2 | L16 I60 F72 | L16-L64 HydrophobicContact CD1-CD2 4.35Å; L16-L64 HydrophobicContact CD2-CD2 4.16Å; I60-L64 HydrophobicContact CG2-CD1 3.73Å; I60-L64 HydrophobicContact CG2-CG 4.28Å; I60-L64 WeakPolarHBondContact O-CG 3.36Å; I60-L64 PolarHBondContact O-N 2.86Å; L64-F72 HydrophobicContact CD2-CD2 3.97Å; L64-F72 HydrophobicContact CD2-CE2 3.97Å |
| 65 | K | 86.6 | Confident | 85.2 | Confident | 153 Ų | 153 | 86.8 Ų | 86.8 | 67% | 0.665 | 44% | 0.436 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -103.7 | 2.3 | 176.4 | -66.7 | 172.3 | -172.5 | 174 | 0 | 113.2 | N61 K62 M63 | N61-K65 WeakPolarHBondContact O-CB 3.48Å; N61-K65 WeakPolarHBondContact O-CD 3.49Å; N61-K65 WeakPolarHBondContact O-CG 3.37Å; N61-K65 PolarHBondContact O-N 3.47Å; N61-K65 PolarHBondContact OD1-NZ 3.1Å; K62-K65 PolarHBondContact O-N 3.33Å; M63-K65 PolarHBondContact O-N 3.49Å |
| 66 | N | 83.8 | Confident | 84.8 | Confident | 73 Ų | 73 | 90.8 Ų | 90.8 | 39% | 0.39 | 45% | 0.453 | S | S | . | . | trans | -80.9 | 123.5 | -177.8 | -178.8 | 6.9 | 0 | 0 | 0 | 111.2 | K62 M63 K68 T69 | K62-N66 WeakPolarHBondContact O-CB 3.33Å; K62-N66 PolarHBondContact O-N 2.79Å; M63-N66 WeakPolarHBondContact O-CB 3.3Å; M63-N66 PolarHBondContact O-N 2.98Å; N66-K68 PolarHBondContact O-N 3.18Å; N66-K68 VanDerWaalsContact O-N 3.11Å; N66-K68 WeakPolarHBondContact OD1-CB 3.45Å; N66-K68 PolarHBondContact OD1-N 3.39Å; N66-T69 WeakPolarHBondContact O-CB 3.48Å; N66-T69 PolarHBondContact O-N 2.97Å | ||
| 67 | E | 70.6 | Confident | 84.4 | Confident | 197 Ų | 197 | 96.1 Ų | 96.1 | 92% | 0.921 | 48% | 0.481 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.9 | -18.9 | 177.7 | -58.6 | -178.2 | 145.9 | 0 | 0 | 113.7 | ||
| 68 | K | 71.1 | Confident | 84.1 | Confident | 166 Ų | 166 | 97.6 Ų | 97.6 | 72% | 0.722 | 49% | 0.488 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.6 | -12 | 174.5 | -60.9 | -178.2 | 179.8 | 178.3 | 0 | 113.7 | Q8 N66 | Q8-K68 PolarHBondContact NE2-O 3.01Å; N66-K68 PolarHBondContact O-N 3.18Å; N66-K68 VanDerWaalsContact O-N 3.11Å; N66-K68 WeakPolarHBondContact OD1-CB 3.45Å; N66-K68 PolarHBondContact OD1-N 3.39Å |
| 69 | T | 70.6 | Confident | 83.8 | Confident | 22 Ų | 22 | 95.8 Ų | 95.8 | 14% | 0.135 | 48% | 0.481 | C | S | . | . | S | Bend | trans | -87.7 | 131.1 | 174.5 | -65.8 | 0 | 0 | 0 | 0 | 108.5 | M63 N66 F72 | M63-T69 HydrophobicContact CE-CG2 4.25Å; M63-T69 PolarHBondContact O-OG1 3.44Å; N66-T69 WeakPolarHBondContact O-CB 3.48Å; N66-T69 PolarHBondContact O-N 2.97Å; T69-F72 HydrophobicContact CG2-CD2 4.41Å; T69-F72 HydrophobicContact CG2-CE2 3.63Å; T69-F72 HydrophobicContact CG2-CZ 4.13Å |
| 70 | P | 75.2 | Confident | 83.5 | Confident | 29 Ų | 29 | 100.8 Ų | 100.8 | 19% | 0.188 | 50% | 0.504 | C | S | . | . | trans | -54.5 | 142.1 | 177.5 | -27.9 | 37.6 | 0 | 0 | 0 | 112.1 | Q8 L9 S12 F72 | Q8-P70 HydrophobicContact CB-CG 4.31Å; Q8-P70 HydrophobicContact CG-CG 3.84Å; L9-P70 HydrophobicContact CB-CG 4.49Å; L9-P70 HydrophobicContact CD1-CB 4.24Å; S12-P70 VanDerWaalsContact OG-CD 3.24Å; S12-P70 WeakPolarHBondContact OG-CD 3.46Å; P70-F72 PolarHBondContact O-N 3.42Å | ||
| 71 | S | 75.1 | Confident | 83.2 | Confident | 60 Ų | 60 | 105.4 Ų | 105.4 | 42% | 0.42 | 53% | 0.533 | S | S | . | . | trans | -70.8 | 95.1 | -178 | 176.7 | 0 | 0 | 0 | 0 | 111.1 | R73 S74 | S71-R73 PolarHBondContact O-N 3.29Å; S71-R73 VanDerWaalsContact O-N 3.08Å; S71-S74 WeakPolarHBondContact CB-OG 3.19Å; S71-S74 PolarHBondContact O-N 2.71Å; S71-S74 VanDerWaalsContact O-N 3.08Å; S71-S74 PolarHBondContact O-OG 3Å; S71-S74 PolarHBondContact OG-OG 3.13Å | ||
| 72 | F | 81.5 | Confident | 83.2 | Confident | 57 Ų | 57 | 104.6 Ų | 104.6 | 25% | 0.25 | 53% | 0.529 | C | S | . | . | G | 310 helix | trans | -55 | -23.8 | 170.5 | -59.4 | -64.8 | 0 | 0 | 0 | 112.6 | L9 V13 M63 L64 T69 P70 S74 Q75 | L9-F72 HydrophobicContact CD1-CD1 3.94Å; L9-F72 HydrophobicContact CD1-CE1 3.62Å; V13-F72 HydrophobicContact CG2-CE1 3.84Å; V13-F72 HydrophobicContact CG2-CZ 4.48Å; M63-F72 HydrophobicContact CE-CE2 4.03Å; L64-F72 HydrophobicContact CD2-CD2 3.97Å; L64-F72 HydrophobicContact CD2-CE2 3.97Å; T69-F72 HydrophobicContact CG2-CD2 4.41Å; T69-F72 HydrophobicContact CG2-CE2 3.63Å; T69-F72 HydrophobicContact CG2-CZ 4.13Å; P70-F72 PolarHBondContact O-N 3.42Å; F72-S74 PolarHBondContact O-N 3.08Å; F72-Q75 PolarHBondContact O-N 2.69Å; F72-Q75 VanDerWaalsContact O-N 3.15Å |
| 73 | R | 79.3 | Confident | 83.1 | Confident | 223 Ų | 223 | 99.6 Ų | 99.6 | 84% | 0.842 | 51% | 0.513 | S | S | * | . | G | 310 helix | trans | -64 | -21.1 | 176.7 | -58.6 | -170 | -174.3 | 97.5 | -1 | 114.4 | S71 Q75 | S71-R73 PolarHBondContact O-N 3.29Å; S71-R73 VanDerWaalsContact O-N 3.08Å; R73-Q75 VanDerWaalsContact C-N 3.34Å |
| 74 | S | 80.9 | Confident | 83.1 | Confident | 96 Ų | 96 | 105.8 Ų | 105.8 | 67% | 0.671 | 54% | 0.542 | S | S | * | . | G | 310 helix | trans | -96.3 | 14.6 | 177.7 | 33.5 | 0 | 0 | 0 | 0 | 112.9 | S71 F72 | S71-S74 WeakPolarHBondContact CB-OG 3.19Å; S71-S74 PolarHBondContact O-N 2.71Å; S71-S74 VanDerWaalsContact O-N 3.08Å; S71-S74 PolarHBondContact O-OG 3Å; S71-S74 PolarHBondContact OG-OG 3.13Å; F72-S74 PolarHBondContact O-N 3.08Å |
| 75 | Q | 83.8 | Confident | 83.4 | Confident | 90 Ų | 90 | 109.6 Ų | 109.6 | 42% | 0.421 | 56% | 0.555 | S | S | . | * | trans | -125.3 | 149.3 | -179.6 | -63.6 | 176.7 | -11.3 | 0 | 0 | 109.9 | L9 F72 R73 | L9-Q75 VanDerWaalsContact CD1-OE1 3.27Å; F72-Q75 PolarHBondContact O-N 2.69Å; F72-Q75 VanDerWaalsContact O-N 3.15Å; R73-Q75 VanDerWaalsContact C-N 3.34Å | ||
| 76 | V | 86.6 | Confident | 83.6 | Confident | 122 Ų | 122 | 107 Ų | 107 | 74% | 0.739 | 55% | 0.553 | S | S | * | * | trans | -128 | 126.9 | -179.2 | -174.3 | 0 | 0 | 0 | 0 | 108.1 | I78 | V76-I78 HydrophobicContact CG1-CD1 4.25Å; V76-I78 HydrophobicContact CG1-CG1 3.87Å | ||
| 77 | I | 88.3 | Confident | 83.9 | Confident | 145 Ų | 145 | 107.1 Ų | 107.1 | 74% | 0.744 | 55% | 0.554 | S | S | * | * | trans | -86.1 | 124.8 | 173.9 | -60.7 | 174.6 | 0 | 0 | 0 | 107.7 | L110 | I77-L110 HydrophobicContact CG2-CD2 4.14Š| ||
| 78 | I | 88.6 | Confident | 85 | Confident | 120 Ų | 120 | 103.8 Ų | 103.8 | 62% | 0.615 | 54% | 0.543 | S | S | * | . | trans | -133.1 | 127.1 | 179.1 | -53.9 | 179.9 | 0 | 0 | 0 | 107.8 | V76 L80 | V76-I78 HydrophobicContact CG1-CD1 4.25Å; V76-I78 HydrophobicContact CG1-CG1 3.87Å; I78-L80 PolarHBondContact O-N 3.47Å | ||
| 79 | P | 89.5 | Confident | 85.9 | Confident | 44 Ų | 44 | 101.9 Ų | 101.9 | 29% | 0.286 | 54% | 0.54 | S | S | . | . | trans | -60.3 | 123.8 | 171.8 | -22.8 | 33.4 | 0 | 0 | 0 | 111.4 | L82 F101 V106 L110 | P79-L82 HydrophobicContact CB-CD2 3.53Å; P79-L82 HydrophobicContact CB-CG 4.05Å; P79-L82 HydrophobicContact CG-CD2 4.12Å; P79-F101 HydrophobicContact CB-CE1 4.16Å; P79-F101 HydrophobicContact CG-CE1 4.12Å; P79-V106 HydrophobicContact CG-CG1 3.97Å; P79-L110 HydrophobicContact CG-CD1 3.63Å | ||
| 80 | L | 87.6 | Confident | 86.8 | Confident | 170 Ų | 170 | 102.8 Ų | 102.8 | 89% | 0.89 | 54% | 0.544 | S | S | * | . | S | Bend | trans | -79.9 | -32.7 | 176.8 | -59.9 | -180 | 0 | 0 | 0 | 112.3 | I78 | I78-L80 PolarHBondContact O-N 3.47Š|
| 81 | V | 87.8 | Confident | 87.5 | Confident | 118 Ų | 118 | 102.8 Ų | 102.8 | 72% | 0.715 | 54% | 0.543 | S | S | * | . | trans | -141.1 | 139.8 | 178.4 | 179.9 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 82 | L | 90.8 | Very high | 88.4 | Confident | 53 Ų | 53 | 105.3 Ų | 105.3 | 28% | 0.277 | 56% | 0.556 | S | S | . | * | trans | -119.6 | 139.2 | 169.7 | -64.2 | -178.4 | 0 | 0 | 0 | 109 | P79 F101 H103 V106 | P79-L82 HydrophobicContact CB-CD2 3.53Å; P79-L82 HydrophobicContact CB-CG 4.05Å; P79-L82 HydrophobicContact CG-CD2 4.12Å; L82-F101 WeakPolarHBondContact CA-O 3.5Å; L82-F101 HydrophobicContact CD2-CD1 3.6Å; L82-F101 HydrophobicContact CD2-CE1 3.86Å; L82-H103 WeakPolarHBondContact CD1-ND1 3.49Å; L82-V106 HydrophobicContact CD1-CG2 4.25Å; L82-V106 HydrophobicContact CD2-CG2 3.41Å; L82-V106 VanDerWaalsContact CD2-CG2 3.41Å; L82-V106 HydrophobicContact CG-CG2 4.48Å | ||
| 83 | S | 89.4 | Confident | 88.6 | Confident | 48 Ų | 48 | 109.2 Ų | 109.2 | 34% | 0.336 | 58% | 0.579 | S | S | . | * | trans | -138.6 | 141.8 | -169.5 | 179.8 | 0 | 0 | 0 | 0 | 110.9 | K85 V100 F101 S102 | S83-K85 WeakPolarHBondContact OG-CB 3.42Å; S83-K85 PolarHBondContact OG-N 3.49Å; S83-K85 PolarHBondContact OG-O 2.63Å; S83-V100 WeakPolarHBondContact O-CG1 3.48Å; S83-F101 PolarHBondContact N-O 2.96Å; S83-F101 CarbonylContact O-C 3.58Å; S83-F101 VanDerWaalsContact O-O 3.11Å; S83-S102 WeakPolarHBondContact O-CA 3.48Å; S83-S102 PolarHBondContact O-N 2.97Å | ||
| 84 | Q | 90.9 | Very high | 89 | Confident | 155 Ų | 155 | 99.7 Ų | 99.7 | 72% | 0.724 | 55% | 0.546 | S | S | * | . | S | Bend | trans | -95.4 | -3.9 | 166.2 | -73 | -177.1 | -24.7 | 0 | 0 | 112.7 | ||
| 85 | K | 92.8 | Very high | 89.4 | Confident | 161 Ų | 161 | 100.1 Ų | 100.1 | 70% | 0.7 | 54% | 0.537 | S | S | * | . | S | Bend | trans | -80.4 | 145.4 | 173.1 | -61.9 | -178.3 | 179.7 | 179.4 | 0 | 109.8 | S83 | S83-K85 WeakPolarHBondContact OG-CB 3.42Å; S83-K85 PolarHBondContact OG-N 3.49Å; S83-K85 PolarHBondContact OG-O 2.63Å |
| 86 | P | 91 | Very high | 89.7 | Confident | 98 Ų | 98 | 103.6 Ų | 103.6 | 64% | 0.636 | 55% | 0.553 | S | S | * | * | trans | -54.3 | 147.5 | 166.4 | -25.8 | 35.5 | 0 | 0 | 0 | 112.5 | P99 V100 | P86-P99 CarbonylContact C-O 3.22Å; P86-P99 VanDerWaalsContact CA-O 3.23Å; P86-P99 WeakPolarHBondContact CA-O 3.42Å; P86-V100 HydrophobicContact CG-CG2 4.38Å | ||
| 87 | D | 91.5 | Very high | 89.7 | Confident | 76 Ų | 76 | 104.9 Ų | 104.9 | 41% | 0.406 | 55% | 0.545 | S | S | . | . | trans | -126.6 | 107.7 | 176.2 | -176.9 | -37.4 | 0 | 0 | 0 | 107.4 | D89 L90 T91 P99 | D87-D89 PolarHBondContact OD1-N 3.26Å; D87-L90 HydrophobicContact CB-CB 3.81Å; D87-L90 HydrophobicContact CB-CD2 4.45Å; D87-L90 PolarHBondContact O-N 2.94Å; D87-L90 WeakPolarHBondContact OD1-CB 3.23Å; D87-L90 PolarHBondContact OD1-N 2.98Å; D87-T91 WeakPolarHBondContact O-CB 3.45Å; D87-T91 PolarHBondContact O-N 3.33Å; D87-T91 PolarHBondContact O-OG1 2.8Å; D87-P99 PolarHBondContact N-O 3.49Å | ||
| 88 | D | 91.9 | Very high | 89.8 | Confident | 127 Ų | 127 | 98.4 Ų | 98.4 | 68% | 0.679 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -68.7 | -35.3 | -173.6 | -67.5 | -42.1 | 0 | 0 | 0 | 111.8 | T91 V92 | D88-T91 WeakPolarHBondContact O-CB 3.25Å; D88-T91 PolarHBondContact O-N 3.46Å; D88-V92 WeakPolarHBondContact O-CG2 3.27Å; D88-V92 PolarHBondContact O-N 3.33Å |
| 89 | D | 91.2 | Very high | 89.8 | Confident | 125 Ų | 125 | 95.8 Ų | 95.8 | 67% | 0.668 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -68.2 | -44.1 | 177.4 | -73.8 | -30.8 | 0 | 0 | 0 | 110.4 | D87 T91 V92 L93 | D87-D89 PolarHBondContact OD1-N 3.26Å; D89-T91 VanDerWaalsContact C-N 3.33Å; D89-T91 PolarHBondContact O-N 3.49Å; D89-V92 PolarHBondContact O-N 3.15Å; D89-L93 WeakPolarHBondContact O-CB 3.44Å; D89-L93 VanDerWaalsContact O-CG 3.25Å; D89-L93 WeakPolarHBondContact O-CG 3.42Å; D89-L93 PolarHBondContact O-N 3.42Å |
| 90 | L | 88.7 | Confident | 89.9 | Confident | 42 Ų | 42 | 95.4 Ų | 95.4 | 22% | 0.22 | 50% | 0.5 | C | S | . | . | H | α-helix | trans | -63.2 | -39 | 172.7 | -172.2 | 68.9 | 0 | 0 | 0 | 111.8 | D87 V92 L93 T94 V98 F101 | D87-L90 HydrophobicContact CB-CB 3.81Å; D87-L90 HydrophobicContact CB-CD2 4.45Å; D87-L90 PolarHBondContact O-N 2.94Å; D87-L90 WeakPolarHBondContact OD1-CB 3.23Å; D87-L90 PolarHBondContact OD1-N 2.98Å; L90-V92 VanDerWaalsContact C-N 3.34Å; L90-V92 PolarHBondContact O-N 2.78Å; L90-L93 PolarHBondContact O-N 3.24Å; L90-T94 HydrophobicContact CD1-CG2 3.93Å; L90-T94 HydrophobicContact CG-CG2 4.28Å; L90-T94 WeakPolarHBondContact O-CB 3.44Å; L90-T94 WeakPolarHBondContact O-CG2 3.35Å; L90-T94 PolarHBondContact O-N 3.08Å; L90-T94 PolarHBondContact O-OG1 2.99Å; L90-V98 HydrophobicContact CD2-CB 4.32Å; L90-V98 HydrophobicContact CD2-CG1 3.77Å; L90-V98 HydrophobicContact CG-CB 4.34Å; L90-V98 HydrophobicContact CG-CG1 4.31Å; L90-V98 WeakPolarHBondContact CG-O 3.33Å; L90-F101 HydrophobicContact CD2-CB 3.88Å; L90-F101 HydrophobicContact CD2-CG 4.5Å |
| 91 | T | 90.8 | Very high | 90.1 | Very high | 28 Ų | 28 | 89.8 Ų | 89.8 | 17% | 0.172 | 47% | 0.468 | C | S | . | . | H | α-helix | trans | -61.2 | -43.3 | 175.9 | -59.6 | 0 | 0 | 0 | 0 | 111 | D87 D88 D89 E95 Q96 P99 | D87-T91 WeakPolarHBondContact O-CB 3.45Å; D87-T91 PolarHBondContact O-N 3.33Å; D87-T91 PolarHBondContact O-OG1 2.8Å; D88-T91 WeakPolarHBondContact O-CB 3.25Å; D88-T91 PolarHBondContact O-N 3.46Å; D89-T91 VanDerWaalsContact C-N 3.33Å; D89-T91 PolarHBondContact O-N 3.49Å; T91-E95 PolarHBondContact O-N 2.88Å; T91-Q96 HydrophobicContact CG2-CB 4.48Å; T91-Q96 HydrophobicContact CG2-CG 4.06Å; T91-Q96 PolarHBondContact O-N 3.38Å; T91-P99 WeakPolarHBondContact OG1-CA 3.42Å |
| 92 | V | 92.9 | Very high | 90.3 | Very high | 113 Ų | 113 | 84.5 Ų | 84.5 | 69% | 0.685 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -68.4 | -51.1 | 176.2 | 170.2 | 0 | 0 | 0 | 0 | 111.1 | D88 D89 L90 T94 E95 | D88-V92 WeakPolarHBondContact O-CG2 3.27Å; D88-V92 PolarHBondContact O-N 3.33Å; D89-V92 PolarHBondContact O-N 3.15Å; L90-V92 VanDerWaalsContact C-N 3.34Å; L90-V92 PolarHBondContact O-N 2.78Å; V92-T94 VanDerWaalsContact C-N 3.27Å; V92-T94 PolarHBondContact O-N 3.08Å; V92-E95 PolarHBondContact O-N 3.43Å; V92-E95 VanDerWaalsContact O-N 3.14Å |
| 93 | L | 87.1 | Confident | 90.4 | Very high | 140 Ų | 140 | 88.7 Ų | 88.7 | 73% | 0.733 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -62.4 | -31.1 | -177.5 | -73.3 | 169.9 | 0 | 0 | 0 | 113.5 | D89 L90 | D89-L93 WeakPolarHBondContact O-CB 3.44Å; D89-L93 VanDerWaalsContact O-CG 3.25Å; D89-L93 WeakPolarHBondContact O-CG 3.42Å; D89-L93 PolarHBondContact O-N 3.42Å; L90-L93 PolarHBondContact O-N 3.24Å |
| 94 | T | 87.7 | Confident | 90.4 | Very high | 23 Ų | 23 | 93.4 Ų | 93.4 | 14% | 0.141 | 47% | 0.471 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -94.4 | 2.9 | 179 | 64.9 | 0 | 0 | 0 | 0 | 114 | L90 V92 R97 V98 | L90-T94 HydrophobicContact CD1-CG2 3.93Å; L90-T94 HydrophobicContact CG-CG2 4.28Å; L90-T94 WeakPolarHBondContact O-CB 3.44Å; L90-T94 WeakPolarHBondContact O-CG2 3.35Å; L90-T94 PolarHBondContact O-N 3.08Å; L90-T94 PolarHBondContact O-OG1 2.99Å; V92-T94 VanDerWaalsContact C-N 3.27Å; V92-T94 PolarHBondContact O-N 3.08Å; T94-R97 WeakPolarHBondContact O-CB 3.4Å; T94-R97 PolarHBondContact O-N 2.92Å; T94-R97 PolarHBondContact O-NE 3.29Å; T94-R97 PolarHBondContact O-NH2 2.9Å; T94-V98 HydrophobicContact CG2-CB 3.88Å; T94-V98 HydrophobicContact CG2-CG2 3.85Å; T94-V98 PolarHBondContact OG1-N 3.45Å; T94-V98 PolarHBondContact OG1-O 2.96Å |
| 95 | E | 89.3 | Confident | 90.4 | Very high | 104 Ų | 104 | 88.3 Ų | 88.3 | 49% | 0.486 | 45% | 0.448 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 57.5 | 51.9 | -177.1 | -57.2 | 163 | 134.9 | 0 | 0 | 111.4 | K24 T91 V92 R97 | K24-E95 IonicContact NZ-OE1 2.71Å; K24-E95 PolarHBondContact NZ-OE1 2.87Å; K24-E95 IonicContact NZ-OE2 3.92Å; K24-E95 PolarHBondContact NZ-OE2 2.9Å; T91-E95 PolarHBondContact O-N 2.88Å; V92-E95 PolarHBondContact O-N 3.43Å; V92-E95 VanDerWaalsContact O-N 3.14Å; E95-R97 PolarHBondContact O-N 2.82Å; E95-R97 VanDerWaalsContact O-N 3.08Å; E95-R97 IonicContact OE2-NH2 3.68Å |
| 96 | Q | 89.8 | Confident | 90.3 | Very high | 164 Ų | 164 | 81.6 Ų | 81.6 | 77% | 0.766 | 42% | 0.42 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 63.6 | 6 | -180 | -56.2 | 178.2 | -9.8 | 0 | 0 | 115.6 | T91 | T91-Q96 HydrophobicContact CG2-CB 4.48Å; T91-Q96 HydrophobicContact CG2-CG 4.06Å; T91-Q96 PolarHBondContact O-N 3.38Å |
| 97 | R | 86.8 | Confident | 90.3 | Very high | 148 Ų | 148 | 80.8 Ų | 80.8 | 56% | 0.558 | 42% | 0.416 | S | S | * | . | S | Bend | trans | -76.6 | -26.9 | 179.6 | -66.6 | 177.6 | -69.7 | 142.1 | 1.1 | 114.1 | T94 E95 Y109 | T94-R97 WeakPolarHBondContact O-CB 3.4Å; T94-R97 PolarHBondContact O-N 2.92Å; T94-R97 PolarHBondContact O-NE 3.29Å; T94-R97 PolarHBondContact O-NH2 2.9Å; E95-R97 PolarHBondContact O-N 2.82Å; E95-R97 VanDerWaalsContact O-N 3.08Å; E95-R97 IonicContact OE2-NH2 3.68Å; R97-Y109 PolarHBondContact O-OH 2.93Å |
| 98 | V | 90.1 | Very high | 90.3 | Very high | 9 Ų | 9 | 82.4 Ų | 82.4 | 6% | 0.055 | 42% | 0.424 | C | S | . | . | trans | -130.9 | 86.4 | -179.4 | -166.3 | 0 | 0 | 0 | 0 | 109.8 | L90 T94 V100 F101 I105 Y109 | L90-V98 HydrophobicContact CD2-CB 4.32Å; L90-V98 HydrophobicContact CD2-CG1 3.77Å; L90-V98 HydrophobicContact CG-CB 4.34Å; L90-V98 HydrophobicContact CG-CG1 4.31Å; L90-V98 WeakPolarHBondContact CG-O 3.33Å; T94-V98 HydrophobicContact CG2-CB 3.88Å; T94-V98 HydrophobicContact CG2-CG2 3.85Å; T94-V98 PolarHBondContact OG1-N 3.45Å; T94-V98 PolarHBondContact OG1-O 2.96Å; V98-V100 WeakPolarHBondContact CG1-O 3.5Å; V98-F101 HydrophobicContact CG1-CD2 4.19Å; V98-I105 HydrophobicContact CG1-CD1 3.66Å; V98-Y109 HydrophobicContact CG2-CD1 4.22Å; V98-Y109 HydrophobicContact CG2-CE1 3.61Å; V98-Y109 HydrophobicContact CG2-CE2 4.17Å | ||
| 99 | P | 88.6 | Confident | 90.1 | Very high | 66 Ų | 66 | 82.2 Ų | 82.2 | 43% | 0.429 | 42% | 0.415 | S | S | . | . | S | Bend | trans | -78.8 | -18.8 | -177.9 | 30.9 | -35.6 | 0 | 0 | 0 | 113.9 | P86 D87 T91 | P86-P99 CarbonylContact C-O 3.22Å; P86-P99 VanDerWaalsContact CA-O 3.23Å; P86-P99 WeakPolarHBondContact CA-O 3.42Å; D87-P99 PolarHBondContact N-O 3.49Å; T91-P99 WeakPolarHBondContact OG1-CA 3.42Å |
| 100 | V | 91.7 | Very high | 90.1 | Very high | 35 Ų | 35 | 79.3 Ų | 79.3 | 21% | 0.212 | 40% | 0.399 | C | S | . | . | trans | -146.4 | 143.1 | -172.5 | 177.2 | 0 | 0 | 0 | 0 | 107.2 | S83 P86 V98 I105 | S83-V100 WeakPolarHBondContact O-CG1 3.48Å; P86-V100 HydrophobicContact CG-CG2 4.38Å; V98-V100 WeakPolarHBondContact CG1-O 3.5Å; V100-I105 WeakPolarHBondContact O-CD1 3.35Å | ||
| 101 | F | 91.2 | Very high | 90.3 | Very high | 53 Ų | 53 | 83 Ų | 83 | 23% | 0.232 | 41% | 0.41 | C | S | . | . | trans | -114.3 | 78.2 | 175.5 | -155.5 | -118.9 | 0 | 0 | 0 | 111.9 | P79 L82 S83 L90 V98 I105 V106 | P79-F101 HydrophobicContact CB-CE1 4.16Å; P79-F101 HydrophobicContact CG-CE1 4.12Å; L82-F101 WeakPolarHBondContact CA-O 3.5Å; L82-F101 HydrophobicContact CD2-CD1 3.6Å; L82-F101 HydrophobicContact CD2-CE1 3.86Å; S83-F101 PolarHBondContact N-O 2.96Å; S83-F101 CarbonylContact O-C 3.58Å; S83-F101 VanDerWaalsContact O-O 3.11Å; L90-F101 HydrophobicContact CD2-CB 3.88Å; L90-F101 HydrophobicContact CD2-CG 4.5Å; V98-F101 HydrophobicContact CG1-CD2 4.19Å; F101-I105 HydrophobicContact CD2-CD1 4.18Å; F101-V106 HydrophobicContact CD1-CG2 4.01Å; F101-V106 HydrophobicContact CD2-CG2 4.34Å; F101-V106 HydrophobicContact CE1-CG2 3.73Å; F101-V106 HydrophobicContact CE2-CG2 4.07Å; F101-V106 HydrophobicContact CG-CG2 4.31Å; F101-V106 HydrophobicContact CZ-CG2 3.76Å | ||
| 102 | S | 92.6 | Very high | 90.3 | Very high | 7 Ų | 7 | 88.4 Ų | 88.4 | 5% | 0.049 | 44% | 0.443 | C | S | . | . | trans | -99.8 | 164.7 | -173.9 | 80.5 | 0 | 0 | 0 | 0 | 113.5 | S83 E104 I105 V106 | S83-S102 WeakPolarHBondContact O-CA 3.48Å; S83-S102 PolarHBondContact O-N 2.97Å; S102-E104 PolarHBondContact O-N 3.36Å; S102-E104 PolarHBondContact OG-N 3.07Å; S102-I105 PolarHBondContact O-N 2.99Å; S102-V106 WeakPolarHBondContact O-CG2 3.36Å; S102-V106 PolarHBondContact O-N 3.16Å | ||
| 103 | H | 92.1 | Very high | 90.2 | Very high | 141 Ų | 141 | 88.3 Ų | 88.3 | 65% | 0.653 | 43% | 0.433 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.6 | -21.1 | 173.5 | -65.9 | -86.4 | 0 | 0 | 0 | 114.8 | L82 P107 | L82-H103 WeakPolarHBondContact CD1-ND1 3.49Å; H103-P107 WeakPolarHBondContact O-CD 3.45Å |
| 104 | E | 90.8 | Very high | 90.4 | Very high | 147 Ų | 147 | 84.2 Ų | 84.2 | 69% | 0.687 | 42% | 0.415 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.1 | -36.7 | -176.8 | -64 | 166 | 124 | 0 | 0 | 111.9 | S102 | S102-E104 PolarHBondContact O-N 3.36Å; S102-E104 PolarHBondContact OG-N 3.07Å |
| 105 | I | 90 | Very high | 90.6 | Very high | 47 Ų | 47 | 88.1 Ų | 88.1 | 24% | 0.241 | 44% | 0.435 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -97.9 | -22.8 | -175.4 | 69.6 | 158.5 | 0 | 0 | 0 | 113.8 | V98 V100 F101 S102 P107 D108 Y109 | V98-I105 HydrophobicContact CG1-CD1 3.66Å; V100-I105 WeakPolarHBondContact O-CD1 3.35Å; F101-I105 HydrophobicContact CD2-CD1 4.18Å; S102-I105 PolarHBondContact O-N 2.99Å; I105-P107 VanDerWaalsContact C-N 3.31Å; I105-D108 PolarHBondContact O-N 2.96Å; I105-Y109 HydrophobicContact CB-CD2 3.98Å; I105-Y109 HydrophobicContact CB-CE2 4.07Å; I105-Y109 HydrophobicContact CD1-CD2 3.82Å; I105-Y109 HydrophobicContact CD1-CE2 3.79Å; I105-Y109 HydrophobicContact CG1-CD2 4.16Å; I105-Y109 HydrophobicContact CG1-CE2 4.41Å; I105-Y109 WeakPolarHBondContact O-CD2 3.42Å; I105-Y109 PolarHBondContact O-N 3.22Å; I105-Y109 VanDerWaalsContact O-N 3.12Å |
| 106 | V | 91.3 | Very high | 90.8 | Very high | 20 Ų | 20 | 87.3 Ų | 87.3 | 12% | 0.121 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -53.8 | -39.2 | 179.7 | 166.9 | 0 | 0 | 0 | 0 | 113.3 | P79 L82 F101 S102 D108 L110 | P79-V106 HydrophobicContact CG-CG1 3.97Å; L82-V106 HydrophobicContact CD1-CG2 4.25Å; L82-V106 HydrophobicContact CD2-CG2 3.41Å; L82-V106 VanDerWaalsContact CD2-CG2 3.41Å; L82-V106 HydrophobicContact CG-CG2 4.48Å; F101-V106 HydrophobicContact CD1-CG2 4.01Å; F101-V106 HydrophobicContact CD2-CG2 4.34Å; F101-V106 HydrophobicContact CE1-CG2 3.73Å; F101-V106 HydrophobicContact CE2-CG2 4.07Å; F101-V106 HydrophobicContact CG-CG2 4.31Å; F101-V106 HydrophobicContact CZ-CG2 3.76Å; S102-V106 WeakPolarHBondContact O-CG2 3.36Å; S102-V106 PolarHBondContact O-N 3.16Å; V106-D108 PolarHBondContact O-N 3.24Å; V106-L110 HydrophobicContact CG1-CD1 4.05Å; V106-L110 HydrophobicContact CG1-CG 4.45Å; V106-L110 WeakPolarHBondContact O-CB 3.34Å; V106-L110 PolarHBondContact O-N 2.86Å |
| 107 | P | 91.1 | Very high | 91 | Very high | 82 Ų | 82 | 86 Ų | 86 | 53% | 0.532 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -59 | -32 | 176 | -25.9 | 36.5 | 0 | 0 | 0 | 114.1 | H103 I105 R111 | H103-P107 WeakPolarHBondContact O-CD 3.45Å; I105-P107 VanDerWaalsContact C-N 3.31Å; P107-R111 WeakPolarHBondContact O-CB 3.39Å; P107-R111 PolarHBondContact O-N 3.12Å |
| 108 | D | 90.4 | Very high | 91.4 | Very high | 110 Ų | 110 | 82.3 Ų | 82.3 | 59% | 0.588 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -82.9 | -47.7 | 179.7 | -66.4 | -41.9 | 0 | 0 | 0 | 111.4 | I105 V106 L110 R111 | I105-D108 PolarHBondContact O-N 2.96Å; V106-D108 PolarHBondContact O-N 3.24Å; D108-L110 VanDerWaalsContact C-N 3.32Å; D108-L110 PolarHBondContact O-N 3.4Å; D108-R111 WeakPolarHBondContact O-CB 3.31Å; D108-R111 PolarHBondContact O-N 3.3Å |
| 109 | Y | 88.8 | Confident | 91.6 | Very high | 122 Ų | 122 | 85.2 Ų | 85.2 | 48% | 0.478 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -71.5 | -22.7 | -178.4 | -74.7 | -76.8 | 0 | 0 | 0 | 114.2 | R97 V98 I105 | R97-Y109 PolarHBondContact O-OH 2.93Å; V98-Y109 HydrophobicContact CG2-CD1 4.22Å; V98-Y109 HydrophobicContact CG2-CE1 3.61Å; V98-Y109 HydrophobicContact CG2-CE2 4.17Å; I105-Y109 HydrophobicContact CB-CD2 3.98Å; I105-Y109 HydrophobicContact CB-CE2 4.07Å; I105-Y109 HydrophobicContact CD1-CD2 3.82Å; I105-Y109 HydrophobicContact CD1-CE2 3.79Å; I105-Y109 HydrophobicContact CG1-CD2 4.16Å; I105-Y109 HydrophobicContact CG1-CE2 4.41Å; I105-Y109 WeakPolarHBondContact O-CD2 3.42Å; I105-Y109 PolarHBondContact O-N 3.22Å; I105-Y109 VanDerWaalsContact O-N 3.12Å |
| 110 | L | 91.2 | Very high | 91.9 | Very high | 65 Ų | 65 | 87.6 Ų | 87.6 | 34% | 0.34 | 45% | 0.445 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -104.3 | 16.8 | 171.5 | -59.8 | -173 | 0 | 0 | 0 | 113.1 | I77 P79 V106 D108 T112 | I77-L110 HydrophobicContact CG2-CD2 4.14Å; P79-L110 HydrophobicContact CG-CD1 3.63Å; V106-L110 HydrophobicContact CG1-CD1 4.05Å; V106-L110 HydrophobicContact CG1-CG 4.45Å; V106-L110 WeakPolarHBondContact O-CB 3.34Å; V106-L110 PolarHBondContact O-N 2.86Å; D108-L110 VanDerWaalsContact C-N 3.32Å; D108-L110 PolarHBondContact O-N 3.4Å; L110-T112 PolarHBondContact O-N 3.01Å |
| 111 | R | 91.9 | Very high | 92.1 | Very high | 119 Ų | 119 | 90.3 Ų | 90.3 | 45% | 0.449 | 46% | 0.455 | S | S | . | . | trans | -64.7 | 109.1 | 178.9 | -178.1 | 173.3 | 164.2 | 165.6 | -8.1 | 111.3 | P107 D108 K113 P114 | P107-R111 WeakPolarHBondContact O-CB 3.39Å; P107-R111 PolarHBondContact O-N 3.12Å; D108-R111 WeakPolarHBondContact O-CB 3.31Å; D108-R111 PolarHBondContact O-N 3.3Å; R111-K113 HydrophobicContact CG-CB 4.14Å; R111-K113 WeakPolarHBondContact CG-O 3.34Å; R111-K113 PolarHBondContact NE-O 3.32Å; R111-P114 PolarHBondContact NH2-O 2.79Å | ||
| 112 | T | 91.1 | Very high | 92.2 | Very high | 141 Ų | 141 | 93.9 Ų | 93.9 | 87% | 0.865 | 47% | 0.473 | S | S | * | . | trans | -88.3 | -12.2 | 169.9 | 54.7 | 0 | 0 | 0 | 0 | 113.3 | L110 | L110-T112 PolarHBondContact O-N 3.01Š| ||
| 113 | K | 91.4 | Very high | 92.3 | Very high | 111 Ų | 111 | 100.6 Ų | 100.6 | 48% | 0.483 | 50% | 0.501 | S | S | . | . | S | Bend | trans | -72.7 | 120.8 | 177.7 | -168.9 | -170 | -179.9 | -156.4 | 0 | 110.1 | R111 E119 | R111-K113 HydrophobicContact CG-CB 4.14Å; R111-K113 WeakPolarHBondContact CG-O 3.34Å; R111-K113 PolarHBondContact NE-O 3.32Å; K113-E119 WeakPolarHBondContact CE-OE1 3.33Å; K113-E119 WeakPolarHBondContact CE-OE2 3.21Å; K113-E119 IonicContact NZ-OE1 3.42Å; K113-E119 PolarHBondContact NZ-OE1 2.98Å; K113-E119 IonicContact NZ-OE2 2.7Å; K113-E119 PolarHBondContact NZ-OE2 2.9Å |
| 114 | P | 90.3 | Very high | 92.4 | Very high | 54 Ų | 54 | 99.4 Ų | 99.4 | 35% | 0.351 | 50% | 0.496 | S | S | . | . | trans | -66.6 | 178.2 | -179.2 | 28.3 | -34.7 | 0 | 0 | 0 | 113 | R111 V118 E119 | R111-P114 PolarHBondContact NH2-O 2.79Å; P114-V118 HydrophobicContact CB-CB 4.39Å; P114-V118 HydrophobicContact CB-CG1 4.34Å; P114-E119 HydrophobicContact CG-CG 3.86Å | ||
| 115 | D | 92.7 | Very high | 92.6 | Very high | 105 Ų | 105 | 98.5 Ų | 98.5 | 56% | 0.561 | 50% | 0.495 | S | S | * | . | trans | -73.1 | 148.6 | 178.6 | -66.1 | -55.2 | 0 | 0 | 0 | 112.2 | E117 V118 E119 | D115-E117 VanDerWaalsContact C-N 3.26Å; D115-E117 PolarHBondContact O-N 2.88Å; D115-E117 VanDerWaalsContact O-N 3.16Å; D115-V118 HydrophobicContact CB-CG2 4.38Å; D115-V118 WeakPolarHBondContact O-CA 3.34Å; D115-V118 WeakPolarHBondContact O-CB 3.38Å; D115-V118 PolarHBondContact O-N 2.93Å; D115-E119 PolarHBondContact O-N 2.78Å | ||
| 116 | P | 93.4 | Very high | 92.7 | Very high | 88 Ų | 88 | 99.9 Ų | 99.9 | 57% | 0.571 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -58.1 | -33.3 | -173.7 | -26.4 | 35.6 | 0 | 0 | 0 | 114.6 | E119 E120 | P116-E119 PolarHBondContact O-N 3.31Å; P116-E120 PolarHBondContact O-N 3.14Å |
| 117 | E | 94.6 | Very high | 92.8 | Very high | 137 Ų | 137 | 102.3 Ų | 102.3 | 64% | 0.64 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -66.4 | -38.9 | 175.6 | -165.6 | -171.6 | 150.3 | 0 | 0 | 111.5 | D115 E120 Q121 | D115-E117 VanDerWaalsContact C-N 3.26Å; D115-E117 PolarHBondContact O-N 2.88Å; D115-E117 VanDerWaalsContact O-N 3.16Å; E117-E120 PolarHBondContact O-N 3.47Å; E117-Q121 WeakPolarHBondContact O-CB 3.16Å; E117-Q121 VanDerWaalsContact O-CG 3.27Å; E117-Q121 WeakPolarHBondContact O-CG 3.42Å; E117-Q121 PolarHBondContact O-N 3.18Å; E117-Q121 PolarHBondContact OE1-NE2 3.3Å |
| 118 | V | 94.1 | Very high | 92.9 | Very high | 69 Ų | 69 | 102.9 Ų | 102.9 | 42% | 0.418 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -70 | -39.1 | 177.1 | -177.3 | 0 | 0 | 0 | 0 | 110.6 | P114 D115 E120 Q121 E122 | P114-V118 HydrophobicContact CB-CB 4.39Å; P114-V118 HydrophobicContact CB-CG1 4.34Å; D115-V118 HydrophobicContact CB-CG2 4.38Å; D115-V118 WeakPolarHBondContact O-CA 3.34Å; D115-V118 WeakPolarHBondContact O-CB 3.38Å; D115-V118 PolarHBondContact O-N 2.93Å; V118-E120 VanDerWaalsContact C-N 3.33Å; V118-E120 PolarHBondContact O-N 2.67Å; V118-Q121 PolarHBondContact O-N 3.01Å; V118-E122 WeakPolarHBondContact O-CB 3.41Å; V118-E122 PolarHBondContact O-N 2.93Å |
| 119 | E | 94.2 | Very high | 92.8 | Very high | 71 Ų | 71 | 100.7 Ų | 100.7 | 33% | 0.332 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -60.9 | -41 | 172.1 | -67.3 | -162.2 | 125.3 | 0 | 0 | 112.3 | K113 P114 D115 P116 K123 | K113-E119 WeakPolarHBondContact CE-OE1 3.33Å; K113-E119 WeakPolarHBondContact CE-OE2 3.21Å; K113-E119 IonicContact NZ-OE1 3.42Å; K113-E119 PolarHBondContact NZ-OE1 2.98Å; K113-E119 IonicContact NZ-OE2 2.7Å; K113-E119 PolarHBondContact NZ-OE2 2.9Å; P114-E119 HydrophobicContact CG-CG 3.86Å; D115-E119 PolarHBondContact O-N 2.78Å; P116-E119 PolarHBondContact O-N 3.31Å; E119-K123 WeakPolarHBondContact O-CB 3.24Å; E119-K123 PolarHBondContact O-N 3.19Å |
| 120 | E | 95.1 | Very high | 92.8 | Very high | 115 Ų | 115 | 98.9 Ų | 98.9 | 54% | 0.537 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -68.5 | -43.6 | 176.2 | 175.9 | 152.6 | -143.6 | 0 | 0 | 111.8 | P116 E117 V118 K123 Q124 | P116-E120 PolarHBondContact O-N 3.14Å; E117-E120 PolarHBondContact O-N 3.47Å; V118-E120 VanDerWaalsContact C-N 3.33Å; V118-E120 PolarHBondContact O-N 2.67Å; E120-K123 PolarHBondContact O-N 3.21Å; E120-Q124 HydrophobicContact CG-CG 4.35Å; E120-Q124 VanDerWaalsContact CG-NE2 3.32Å; E120-Q124 WeakPolarHBondContact O-CB 3.49Å; E120-Q124 VanDerWaalsContact O-CG 3.29Å; E120-Q124 WeakPolarHBondContact O-CG 3.27Å; E120-Q124 PolarHBondContact O-N 3.19Å; E120-Q124 PolarHBondContact OE1-NE2 2.87Å |
| 121 | Q | 95.4 | Very high | 92.8 | Very high | 93 Ų | 93 | 104.1 Ų | 104.1 | 44% | 0.435 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -60.6 | -45.4 | 175 | -72 | 176.5 | 22.9 | 0 | 0 | 111.8 | E117 V118 K123 Q124 L125 | E117-Q121 WeakPolarHBondContact O-CB 3.16Å; E117-Q121 VanDerWaalsContact O-CG 3.27Å; E117-Q121 WeakPolarHBondContact O-CG 3.42Å; E117-Q121 PolarHBondContact O-N 3.18Å; E117-Q121 PolarHBondContact OE1-NE2 3.3Å; V118-Q121 PolarHBondContact O-N 3.01Å; Q121-K123 PolarHBondContact O-N 3.32Å; Q121-Q124 PolarHBondContact O-N 3.25Å; Q121-L125 WeakPolarHBondContact O-CB 3.34Å; Q121-L125 VanDerWaalsContact O-CG 3.3Å; Q121-L125 WeakPolarHBondContact O-CG 3.5Å; Q121-L125 PolarHBondContact O-N 2.86Å |
| 122 | E | 93.9 | Very high | 92.6 | Very high | 127 Ų | 127 | 101.7 Ų | 101.7 | 59% | 0.593 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -61.2 | -45.1 | 175.4 | -174.5 | -179.8 | 171.2 | 0 | 0 | 111.2 | V118 Q124 L125 S126 | V118-E122 WeakPolarHBondContact O-CB 3.41Å; V118-E122 PolarHBondContact O-N 2.93Å; E122-Q124 PolarHBondContact O-N 3.4Å; E122-L125 PolarHBondContact O-N 3.35Å; E122-S126 WeakPolarHBondContact O-CB 3.44Å; E122-S126 PolarHBondContact O-N 2.96Å |
| 123 | K | 94.9 | Very high | 92.6 | Very high | 149 Ų | 149 | 96.8 Ų | 96.8 | 65% | 0.648 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -61.5 | -40.6 | 177 | 179.8 | -176.6 | 174.8 | -171.1 | 0 | 112.3 | E119 E120 Q121 T127 | E119-K123 WeakPolarHBondContact O-CB 3.24Å; E119-K123 PolarHBondContact O-N 3.19Å; E120-K123 PolarHBondContact O-N 3.21Å; Q121-K123 PolarHBondContact O-N 3.32Å; K123-T127 VanDerWaalsContact O-CB 3.31Å; K123-T127 WeakPolarHBondContact O-CB 3.46Å; K123-T127 PolarHBondContact O-N 3.21Å; K123-T127 PolarHBondContact O-OG1 3.4Å |
| 124 | Q | 94.8 | Very high | 92.4 | Very high | 116 Ų | 116 | 96.1 Ų | 96.1 | 54% | 0.542 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -65.2 | -48 | 175.5 | -72.8 | 178.6 | 23 | 0 | 0 | 111.1 | E120 Q121 E122 S126 T127 E128 | E120-Q124 HydrophobicContact CG-CG 4.35Å; E120-Q124 VanDerWaalsContact CG-NE2 3.32Å; E120-Q124 WeakPolarHBondContact O-CB 3.49Å; E120-Q124 VanDerWaalsContact O-CG 3.29Å; E120-Q124 WeakPolarHBondContact O-CG 3.27Å; E120-Q124 PolarHBondContact O-N 3.19Å; E120-Q124 PolarHBondContact OE1-NE2 2.87Å; Q121-Q124 PolarHBondContact O-N 3.25Å; E122-Q124 PolarHBondContact O-N 3.4Å; Q124-S126 PolarHBondContact O-N 2.92Å; Q124-T127 PolarHBondContact O-N 2.95Å; Q124-E128 PolarHBondContact O-N 3.09Å |
| 125 | L | 93.8 | Very high | 92.4 | Very high | 127 Ų | 127 | 98.9 Ų | 98.9 | 67% | 0.665 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -62.7 | -41.5 | 177.7 | -71.1 | 170.5 | 0 | 0 | 0 | 112.5 | Q121 E122 E128 A129 | Q121-L125 WeakPolarHBondContact O-CB 3.34Å; Q121-L125 VanDerWaalsContact O-CG 3.3Å; Q121-L125 WeakPolarHBondContact O-CG 3.5Å; Q121-L125 PolarHBondContact O-N 2.86Å; E122-L125 PolarHBondContact O-N 3.35Å; L125-E128 PolarHBondContact O-N 3.09Å; L125-A129 WeakPolarHBondContact O-CB 3.26Å; L125-A129 PolarHBondContact O-N 2.94Å |
| 126 | S | 93 | Very high | 92.3 | Very high | 76 Ų | 76 | 97.4 Ų | 97.4 | 53% | 0.531 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.6 | -41.9 | 174.9 | -176.2 | 0 | 0 | 0 | 0 | 111.7 | E122 Q124 E128 A129 A130 | E122-S126 WeakPolarHBondContact O-CB 3.44Å; E122-S126 PolarHBondContact O-N 2.96Å; Q124-S126 PolarHBondContact O-N 2.92Å; S126-E128 PolarHBondContact O-N 2.78Å; S126-A129 PolarHBondContact O-N 3.4Å; S126-A130 WeakPolarHBondContact O-CB 3.45Å; S126-A130 PolarHBondContact O-N 2.9Å |
| 127 | T | 93.6 | Very high | 92.2 | Very high | 71 Ų | 71 | 94.5 Ų | 94.5 | 44% | 0.436 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.9 | -38.9 | 174.8 | -57.7 | 0 | 0 | 0 | 0 | 112.1 | K123 Q124 | K123-T127 VanDerWaalsContact O-CB 3.31Å; K123-T127 WeakPolarHBondContact O-CB 3.46Å; K123-T127 PolarHBondContact O-N 3.21Å; K123-T127 PolarHBondContact O-OG1 3.4Å; Q124-T127 PolarHBondContact O-N 2.95Å |
| 128 | E | 91.9 | Very high | 92.1 | Very high | 94 Ų | 94 | 92.9 Ų | 92.9 | 44% | 0.439 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -71.8 | -44.3 | 176.8 | -169.6 | 59.6 | -145.5 | 0 | 0 | 111.6 | Q124 L125 S126 A130 R131 | Q124-E128 PolarHBondContact O-N 3.09Å; L125-E128 PolarHBondContact O-N 3.09Å; S126-E128 PolarHBondContact O-N 2.78Å; E128-A130 VanDerWaalsContact C-N 3.27Å; E128-A130 PolarHBondContact O-N 3.25Å; E128-R131 VanDerWaalsContact O-CB 3.31Å; E128-R131 WeakPolarHBondContact O-CB 3.25Å; E128-R131 PolarHBondContact O-N 2.99Å; E128-R131 IonicContact OE1-NH1 2.63Å; E128-R131 WeakPolarHBondContact OE2-CD 3.49Å; E128-R131 IonicContact OE2-CZ 3.54Å; E128-R131 VanDerWaalsContact OE2-CZ 3.28Å; E128-R131 IonicContact OE2-NE 2.63Å; E128-R131 IonicContact OE2-NH1 3.28Å; E128-R131 PolarHBondContact OE2-NH1 2.68Å |
| 129 | A | 88.1 | Confident | 92.1 | Very high | 64 Ų | 64 | 96.5 Ų | 96.5 | 53% | 0.529 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -57.8 | -40.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | L125 S126 R131 I132 | L125-A129 WeakPolarHBondContact O-CB 3.26Å; L125-A129 PolarHBondContact O-N 2.94Å; S126-A129 PolarHBondContact O-N 3.4Å; A129-R131 PolarHBondContact O-N 2.96Å; A129-I132 PolarHBondContact O-N 2.98Å |
| 130 | A | 90.1 | Very high | 91.9 | Very high | 85 Ų | 85 | 97.8 Ų | 97.8 | 70% | 0.702 | 52% | 0.52 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.2 | -13.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | S126 E128 I132 | S126-A130 WeakPolarHBondContact O-CB 3.45Å; S126-A130 PolarHBondContact O-N 2.9Å; E128-A130 VanDerWaalsContact C-N 3.27Å; E128-A130 PolarHBondContact O-N 3.25Å; A130-I132 VanDerWaalsContact C-N 3.35Å |
| 131 | R | 90.6 | Very high | 91.8 | Very high | 174 Ų | 174 | 96 Ų | 96 | 66% | 0.657 | 51% | 0.514 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.8 | -20.2 | 172.6 | -63.5 | 168.8 | -178.8 | -176.5 | -5.5 | 112.7 | E128 A129 | E128-R131 VanDerWaalsContact O-CB 3.31Å; E128-R131 WeakPolarHBondContact O-CB 3.25Å; E128-R131 PolarHBondContact O-N 2.99Å; E128-R131 IonicContact OE1-NH1 2.63Å; E128-R131 WeakPolarHBondContact OE2-CD 3.49Å; E128-R131 IonicContact OE2-CZ 3.54Å; E128-R131 VanDerWaalsContact OE2-CZ 3.28Å; E128-R131 IonicContact OE2-NE 2.63Å; E128-R131 IonicContact OE2-NH1 3.28Å; E128-R131 PolarHBondContact OE2-NH1 2.68Å; A129-R131 PolarHBondContact O-N 2.96Å |
| 132 | I | 88.9 | Confident | 91.8 | Very high | 69 Ų | 69 | 97.5 Ų | 97.5 | 35% | 0.354 | 52% | 0.521 | S | S | . | . | S | Bend | trans | -99.1 | 114.2 | -176.4 | -50.5 | -179.8 | 0 | 0 | 0 | 109.3 | A129 A130 V136 A137 | A129-I132 PolarHBondContact O-N 2.98Å; A130-I132 VanDerWaalsContact C-N 3.35Å; I132-V136 HydrophobicContact CG2-CB 4.23Å; I132-V136 HydrophobicContact CG2-CG1 4.24Å; I132-A137 HydrophobicContact CG2-CB 3.87Å |
| 133 | G | 89.5 | Confident | 91.8 | Very high | 37 Ų | 37 | 93.9 Ų | 93.9 | 38% | 0.381 | 51% | 0.512 | S | S | . | . | trans | -59.1 | 141.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | D135 V136 A137 | G133-D135 VanDerWaalsContact C-N 3.35Å; G133-D135 PolarHBondContact O-N 3.07Å; G133-V136 WeakPolarHBondContact O-CA 3.39Å; G133-V136 WeakPolarHBondContact O-CB 3.35Å; G133-V136 PolarHBondContact O-N 2.86Å; G133-A137 PolarHBondContact O-N 3.06Å | ||
| 134 | P | 87.9 | Confident | 91.8 | Very high | 97 Ų | 97 | 91.3 Ų | 91.3 | 63% | 0.63 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -59.5 | -39.4 | -167.8 | 21.4 | -33.2 | 0 | 0 | 0 | 113.7 | V136 A137 Q138 | P134-V136 VanDerWaalsContact C-N 3.28Å; P134-V136 PolarHBondContact O-N 2.91Å; P134-A137 PolarHBondContact O-N 3.24Å; P134-Q138 WeakPolarHBondContact O-CB 3.41Å; P134-Q138 WeakPolarHBondContact O-CG 3.22Å; P134-Q138 PolarHBondContact O-N 3.48Å |
| 135 | D | 90.3 | Very high | 91.8 | Very high | 112 Ų | 112 | 90.4 Ų | 90.4 | 60% | 0.599 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -61.8 | -33.7 | 174.1 | -65 | -97.5 | 0 | 0 | 0 | 113.7 | G133 K139 | G133-D135 VanDerWaalsContact C-N 3.35Å; G133-D135 PolarHBondContact O-N 3.07Å; D135-K139 WeakPolarHBondContact O-CB 3.45Å; D135-K139 WeakPolarHBondContact O-CD 3.47Å; D135-K139 VanDerWaalsContact O-CG 3.24Å; D135-K139 WeakPolarHBondContact O-CG 3.32Å; D135-K139 PolarHBondContact O-N 3.11Å |
| 136 | V | 91.3 | Very high | 91.9 | Very high | 74 Ų | 74 | 91.2 Ų | 91.2 | 45% | 0.448 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -75.5 | -45.2 | 178.2 | -178.1 | 0 | 0 | 0 | 0 | 109.3 | I132 G133 P134 Q138 K139 Q140 | I132-V136 HydrophobicContact CG2-CB 4.23Å; I132-V136 HydrophobicContact CG2-CG1 4.24Å; G133-V136 WeakPolarHBondContact O-CA 3.39Å; G133-V136 WeakPolarHBondContact O-CB 3.35Å; G133-V136 PolarHBondContact O-N 2.86Å; P134-V136 VanDerWaalsContact C-N 3.28Å; P134-V136 PolarHBondContact O-N 2.91Å; V136-Q138 PolarHBondContact O-N 2.9Å; V136-K139 PolarHBondContact O-N 3.38Å; V136-Q140 HydrophobicContact CG1-CG 4.47Å; V136-Q140 WeakPolarHBondContact O-CB 3.24Å; V136-Q140 WeakPolarHBondContact O-CG 3.36Å; V136-Q140 PolarHBondContact O-N 2.98Å |
| 137 | A | 89.8 | Confident | 92 | Very high | 27 Ų | 27 | 92.7 Ų | 92.7 | 22% | 0.223 | 50% | 0.502 | C | S | . | . | H | α-helix | trans | -57.4 | -48.3 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | I132 G133 P134 K139 Q140 I141 | I132-A137 HydrophobicContact CG2-CB 3.87Å; G133-A137 PolarHBondContact O-N 3.06Å; P134-A137 PolarHBondContact O-N 3.24Å; A137-K139 PolarHBondContact O-N 3.35Å; A137-Q140 PolarHBondContact O-N 3.32Å; A137-I141 WeakPolarHBondContact O-CB 3.46Å; A137-I141 WeakPolarHBondContact O-CD1 3.48Å; A137-I141 VanDerWaalsContact O-CG1 3.22Å; A137-I141 WeakPolarHBondContact O-CG1 3.37Å; A137-I141 PolarHBondContact O-N 3.42Å |
| 138 | Q | 92.2 | Very high | 92 | Very high | 104 Ų | 104 | 92.3 Ų | 92.3 | 49% | 0.486 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -60.6 | -43.5 | 178.1 | -76.6 | -65.6 | -26.1 | 0 | 0 | 112.8 | P134 V136 I141 Q142 | P134-Q138 WeakPolarHBondContact O-CB 3.41Å; P134-Q138 WeakPolarHBondContact O-CG 3.22Å; P134-Q138 PolarHBondContact O-N 3.48Å; V136-Q138 PolarHBondContact O-N 2.9Å; Q138-I141 PolarHBondContact O-N 3.29Å; Q138-Q142 VanDerWaalsContact O-CG 3.29Å; Q138-Q142 WeakPolarHBondContact O-CG 3.47Å; Q138-Q142 PolarHBondContact O-N 3.47Å |
| 139 | K | 94.8 | Very high | 92 | Very high | 145 Ų | 145 | 91.2 Ų | 91.2 | 63% | 0.63 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -64.1 | -40.4 | 175.9 | -73.5 | 167.6 | -173.5 | 167 | 0 | 112.1 | D135 V136 A137 A143 | D135-K139 WeakPolarHBondContact O-CB 3.45Å; D135-K139 WeakPolarHBondContact O-CD 3.47Å; D135-K139 VanDerWaalsContact O-CG 3.24Å; D135-K139 WeakPolarHBondContact O-CG 3.32Å; D135-K139 PolarHBondContact O-N 3.11Å; V136-K139 PolarHBondContact O-N 3.38Å; A137-K139 PolarHBondContact O-N 3.35Å; K139-A143 WeakPolarHBondContact O-CB 3.41Å; K139-A143 PolarHBondContact O-N 2.85Å |
| 140 | Q | 90.6 | Very high | 92.2 | Very high | 97 Ų | 97 | 91.7 Ų | 91.7 | 45% | 0.453 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.4 | -45.6 | 175.7 | -73.3 | 175.6 | -2.4 | 0 | 0 | 111.9 | V136 A137 Q142 A143 L144 | V136-Q140 HydrophobicContact CG1-CG 4.47Å; V136-Q140 WeakPolarHBondContact O-CB 3.24Å; V136-Q140 WeakPolarHBondContact O-CG 3.36Å; V136-Q140 PolarHBondContact O-N 2.98Å; A137-Q140 PolarHBondContact O-N 3.32Å; Q140-Q142 PolarHBondContact O-N 2.93Å; Q140-A143 PolarHBondContact O-N 3.22Å; Q140-L144 WeakPolarHBondContact O-CB 3.45Å; Q140-L144 PolarHBondContact O-N 2.85Å |
| 141 | I | 93.2 | Very high | 92.3 | Very high | 79 Ų | 79 | 92.6 Ų | 92.6 | 41% | 0.405 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -59 | -47 | 176.9 | -70.1 | 162.6 | 0 | 0 | 0 | 110.7 | A137 Q138 A143 L144 N145 | A137-I141 WeakPolarHBondContact O-CB 3.46Å; A137-I141 WeakPolarHBondContact O-CD1 3.48Å; A137-I141 VanDerWaalsContact O-CG1 3.22Å; A137-I141 WeakPolarHBondContact O-CG1 3.37Å; A137-I141 PolarHBondContact O-N 3.42Å; Q138-I141 PolarHBondContact O-N 3.29Å; I141-A143 PolarHBondContact O-N 3.23Å; I141-L144 PolarHBondContact O-N 3.43Å; I141-N145 VanDerWaalsContact O-CB 3.29Å; I141-N145 WeakPolarHBondContact O-CB 3.29Å; I141-N145 PolarHBondContact O-N 3.07Å; I141-N145 PolarHBondContact O-ND2 3Å |
| 142 | Q | 94.2 | Very high | 92.3 | Very high | 124 Ų | 124 | 89.2 Ų | 89.2 | 58% | 0.579 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -64.1 | -40.8 | 178.4 | -70.1 | 173.2 | 26.3 | 0 | 0 | 112.3 | Q138 Q140 K146 | Q138-Q142 VanDerWaalsContact O-CG 3.29Å; Q138-Q142 WeakPolarHBondContact O-CG 3.47Å; Q138-Q142 PolarHBondContact O-N 3.47Å; Q140-Q142 PolarHBondContact O-N 2.93Å; Q142-K146 WeakPolarHBondContact O-CB 3.29Å; Q142-K146 PolarHBondContact O-N 2.84Å |
| 143 | A | 94.2 | Very high | 92.2 | Very high | 50 Ų | 50 | 92.3 Ų | 92.3 | 41% | 0.413 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.9 | -45.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | K139 Q140 I141 K146 M147 | K139-A143 WeakPolarHBondContact O-CB 3.41Å; K139-A143 PolarHBondContact O-N 2.85Å; Q140-A143 PolarHBondContact O-N 3.22Å; I141-A143 PolarHBondContact O-N 3.23Å; A143-K146 PolarHBondContact O-N 3.43Å; A143-M147 WeakPolarHBondContact O-CG 3.46Å; A143-M147 PolarHBondContact O-N 3.36Å |
| 144 | L | 94.6 | Very high | 92 | Very high | 96 Ų | 96 | 98 Ų | 98 | 50% | 0.503 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.1 | -49.3 | 176.6 | -82.8 | 160.3 | 0 | 0 | 0 | 111.5 | Q140 I141 K146 M147 C148 | Q140-L144 WeakPolarHBondContact O-CB 3.45Å; Q140-L144 PolarHBondContact O-N 2.85Å; I141-L144 PolarHBondContact O-N 3.43Å; L144-K146 VanDerWaalsContact C-N 3.29Å; L144-K146 PolarHBondContact O-N 3.04Å; L144-M147 HydrophobicContact CD2-CE 3.95Å; L144-M147 HydrophobicContact CG-CE 4.25Å; L144-M147 PolarHBondContact O-N 3.33Å; L144-M147 VanDerWaalsContact O-N 3.07Å; L144-C148 PolarHBondContact O-N 3.49Å; L144-C148 PolarHBondContact O-SG 2.99Å; L144-C148 VanDerWaalsContact O-SG 3.36Å |
| 145 | N | 95.5 | Very high | 91.9 | Very high | 97 Ų | 97 | 99.3 Ų | 99.3 | 52% | 0.519 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -58.1 | -41.9 | 177.2 | -73.2 | -14.6 | 0 | 0 | 0 | 111.6 | I141 C148 S149 | I141-N145 VanDerWaalsContact O-CB 3.29Å; I141-N145 WeakPolarHBondContact O-CB 3.29Å; I141-N145 PolarHBondContact O-N 3.07Å; I141-N145 PolarHBondContact O-ND2 3Å; N145-C148 PolarHBondContact O-N 3.05Å; N145-S149 WeakPolarHBondContact O-CB 3.4Å; N145-S149 PolarHBondContact O-N 3.37Å; N145-S149 PolarHBondContact O-OG 3.42Å |
| 146 | K | 96.3 | Very high | 91.4 | Very high | 144 Ų | 144 | 100.4 Ų | 100.4 | 63% | 0.626 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -62.6 | -42.4 | 174.7 | -173.1 | 172.7 | -176.8 | 174.5 | 0 | 112.2 | Q142 A143 L144 N150 | Q142-K146 WeakPolarHBondContact O-CB 3.29Å; Q142-K146 PolarHBondContact O-N 2.84Å; A143-K146 PolarHBondContact O-N 3.43Å; L144-K146 VanDerWaalsContact C-N 3.29Å; L144-K146 PolarHBondContact O-N 3.04Å; K146-N150 WeakPolarHBondContact O-CB 3.35Å; K146-N150 PolarHBondContact O-N 2.98Å; K146-N150 PolarHBondContact O-OD1 3.16Å; K146-N150 VanDerWaalsContact O-OD1 3.08Å |
| 147 | M | 93.8 | Very high | 90.4 | Very high | 106 Ų | 106 | 100.1 Ų | 100.1 | 52% | 0.522 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.7 | -43.2 | 175.7 | -70.2 | -174.6 | -64.5 | 0 | 0 | 112 | A143 L144 N150 L151 | A143-M147 WeakPolarHBondContact O-CG 3.46Å; A143-M147 PolarHBondContact O-N 3.36Å; L144-M147 HydrophobicContact CD2-CE 3.95Å; L144-M147 HydrophobicContact CG-CE 4.25Å; L144-M147 PolarHBondContact O-N 3.33Å; L144-M147 VanDerWaalsContact O-N 3.07Å; M147-N150 PolarHBondContact O-N 3.44Å; M147-L151 WeakPolarHBondContact O-CB 3.29Å; M147-L151 VanDerWaalsContact O-CG 3.29Å; M147-L151 WeakPolarHBondContact O-CG 3.18Å; M147-L151 PolarHBondContact O-N 3.38Å |
| 148 | C | 94.1 | Very high | 89 | Confident | 64 Ų | 64 | 102.2 Ų | 102.2 | 43% | 0.432 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -61.8 | -45.8 | 176.2 | -68.1 | 0 | 0 | 0 | 0 | 112.1 | L144 N145 L151 L152 | L144-C148 PolarHBondContact O-N 3.49Å; L144-C148 PolarHBondContact O-SG 2.99Å; L144-C148 VanDerWaalsContact O-SG 3.36Å; N145-C148 PolarHBondContact O-N 3.05Å; C148-L151 PolarHBondContact O-N 2.87Å; C148-L152 WeakPolarHBondContact O-CB 3.5Å; C148-L152 WeakPolarHBondContact O-CG 3.25Å; C148-L152 PolarHBondContact O-N 3.36Å |
| 149 | S | 92.8 | Very high | 87.3 | Confident | 71 Ų | 71 | 107 Ų | 107 | 50% | 0.497 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -61.1 | -47 | 175.5 | -64.8 | 0 | 0 | 0 | 0 | 112.1 | N145 L151 L152 E153 | N145-S149 WeakPolarHBondContact O-CB 3.4Å; N145-S149 PolarHBondContact O-N 3.37Å; N145-S149 PolarHBondContact O-OG 3.42Å; S149-L151 PolarHBondContact O-N 2.9Å; S149-L152 PolarHBondContact O-N 2.9Å; S149-E153 WeakPolarHBondContact O-CB 3.38Å; S149-E153 PolarHBondContact O-N 3.26Å |
| 150 | N | 92.3 | Very high | 85.5 | Confident | 73 Ų | 73 | 105.6 Ų | 105.6 | 39% | 0.39 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -62.2 | -30.1 | 177.4 | -68.3 | 5.9 | 0 | 0 | 0 | 112.9 | K146 M147 K154 | K146-N150 WeakPolarHBondContact O-CB 3.35Å; K146-N150 PolarHBondContact O-N 2.98Å; K146-N150 PolarHBondContact O-OD1 3.16Å; K146-N150 VanDerWaalsContact O-OD1 3.08Å; M147-N150 PolarHBondContact O-N 3.44Å; N150-K154 WeakPolarHBondContact O-CG 3.39Å; N150-K154 PolarHBondContact O-N 3.04Å |
| 151 | L | 90.9 | Very high | 84 | Confident | 105 Ų | 105 | 105.9 Ų | 105.9 | 55% | 0.55 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -77.8 | -42 | 175.1 | -73.5 | 170.3 | 0 | 0 | 0 | 111.5 | M147 C148 S149 E153 K154 L155 | M147-L151 WeakPolarHBondContact O-CB 3.29Å; M147-L151 VanDerWaalsContact O-CG 3.29Å; M147-L151 WeakPolarHBondContact O-CG 3.18Å; M147-L151 PolarHBondContact O-N 3.38Å; C148-L151 PolarHBondContact O-N 2.87Å; S149-L151 PolarHBondContact O-N 2.9Å; L151-E153 VanDerWaalsContact C-N 3.34Å; L151-K154 PolarHBondContact O-N 2.88Å; L151-L155 WeakPolarHBondContact O-CB 3.34Å; L151-L155 VanDerWaalsContact O-CG 3.25Å; L151-L155 WeakPolarHBondContact O-CG 3.47Å; L151-L155 PolarHBondContact O-N 3.22Å |
| 152 | L | 90.2 | Very high | 82.3 | Confident | 103 Ų | 103 | 110.7 Ų | 110.7 | 54% | 0.539 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -63.4 | -38.8 | 175.2 | -73.9 | 169.3 | 0 | 0 | 0 | 112.1 | C148 S149 L155 N156 | C148-L152 WeakPolarHBondContact O-CB 3.5Å; C148-L152 WeakPolarHBondContact O-CG 3.25Å; C148-L152 PolarHBondContact O-N 3.36Å; S149-L152 PolarHBondContact O-N 2.9Å; L152-L155 PolarHBondContact O-N 3.08Å; L152-N156 VanDerWaalsContact O-CB 3.32Å; L152-N156 WeakPolarHBondContact O-CB 3.32Å; L152-N156 VanDerWaalsContact O-CG 3.25Å; L152-N156 PolarHBondContact O-N 3.44Å; L152-N156 PolarHBondContact O-ND2 2.86Å |
| 153 | E | 88.1 | Confident | 80.5 | Confident | 134 Ų | 134 | 109.9 Ų | 109.9 | 63% | 0.626 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -56.3 | -54.8 | 172.6 | -176.1 | 175.3 | -146.5 | 0 | 0 | 110.6 | S149 L151 L155 N156 N157 | S149-E153 WeakPolarHBondContact O-CB 3.38Å; S149-E153 PolarHBondContact O-N 3.26Å; L151-E153 VanDerWaalsContact C-N 3.34Å; E153-L155 VanDerWaalsContact C-N 3.33Å; E153-L155 PolarHBondContact O-N 3Å; E153-N156 PolarHBondContact O-N 3.29Å; E153-N156 VanDerWaalsContact O-N 3.14Å; E153-N157 WeakPolarHBondContact O-CB 3.36Å; E153-N157 PolarHBondContact O-N 3.45Å |
| 154 | K | 85.6 | Confident | 78.9 | Confident | 155 Ų | 155 | 110.4 Ų | 110.4 | 67% | 0.674 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -61.5 | -36.1 | 177.4 | -69.8 | 177.8 | 179.6 | -168.4 | 0 | 113.8 | N150 L151 N156 N157 | N150-K154 WeakPolarHBondContact O-CG 3.39Å; N150-K154 PolarHBondContact O-N 3.04Å; L151-K154 PolarHBondContact O-N 2.88Å; K154-N156 VanDerWaalsContact C-N 3.34Å; K154-N157 PolarHBondContact O-N 3.04Å |
| 155 | L | 84.1 | Confident | 77 | Confident | 125 Ų | 125 | 113.3 Ų | 113.3 | 65% | 0.654 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -76.3 | -20.6 | 177.9 | -71.8 | 170.4 | 0 | 0 | 0 | 113.2 | L151 L152 E153 P158 | L151-L155 WeakPolarHBondContact O-CB 3.34Å; L151-L155 VanDerWaalsContact O-CG 3.25Å; L151-L155 WeakPolarHBondContact O-CG 3.47Å; L151-L155 PolarHBondContact O-N 3.22Å; L152-L155 PolarHBondContact O-N 3.08Å; E153-L155 VanDerWaalsContact C-N 3.33Å; E153-L155 PolarHBondContact O-N 3Å; L155-P158 WeakPolarHBondContact O-CD 3.49Å |
| 156 | N | 80.3 | Confident | 75.1 | Confident | 136 Ų | 136 | 110.8 Ų | 110.8 | 73% | 0.727 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -88.9 | -16.2 | 171.7 | -73.2 | -37.6 | 0 | 0 | 0 | 113.2 | L152 E153 K154 P158 | L152-N156 VanDerWaalsContact O-CB 3.32Å; L152-N156 WeakPolarHBondContact O-CB 3.32Å; L152-N156 VanDerWaalsContact O-CG 3.25Å; L152-N156 PolarHBondContact O-N 3.44Å; L152-N156 PolarHBondContact O-ND2 2.86Å; E153-N156 PolarHBondContact O-N 3.29Å; E153-N156 VanDerWaalsContact O-N 3.14Å; K154-N156 VanDerWaalsContact C-N 3.34Å; N156-P158 WeakPolarHBondContact O-CD 3.37Å |
| 157 | N | 71.8 | Confident | 73.2 | Confident | 67 Ų | 67 | 106.6 Ų | 106.6 | 36% | 0.358 | 55% | 0.554 | S | S | . | * | trans | -90.5 | 7.2 | 179.4 | -138.8 | 63.7 | 0 | 0 | 0 | 118.5 | E153 K154 R159 D160 D161 | E153-N157 WeakPolarHBondContact O-CB 3.36Å; E153-N157 PolarHBondContact O-N 3.45Å; K154-N157 PolarHBondContact O-N 3.04Å; N157-R159 PolarHBondContact O-N 3.14Å; N157-D160 PolarHBondContact O-N 2.9Å; N157-D161 PolarHBondContact ND2-OD2 3.31Å | ||
| 158 | P | 59.8 | Low | 71.5 | Confident | 72 Ų | 72 | 104.8 Ų | 104.8 | 47% | 0.468 | 56% | 0.556 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -76.8 | 17.4 | -168.3 | 35.6 | -39 | 0 | 0 | 0 | 114.6 | L155 N156 R162 | L155-P158 WeakPolarHBondContact O-CD 3.49Å; N156-P158 WeakPolarHBondContact O-CD 3.37Å; P158-R162 WeakPolarHBondContact O-CB 3.3Å; P158-R162 VanDerWaalsContact O-CD 3.26Å; P158-R162 WeakPolarHBondContact O-CD 3.26Å; P158-R162 VanDerWaalsContact O-CG 3.3Å; P158-R162 WeakPolarHBondContact O-CG 3.44Å |
| 159 | R | 55.7 | Low | 69.6 | Low | 205 Ų | 205 | 106.6 Ų | 106.6 | 77% | 0.774 | 57% | 0.569 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.4 | -61.2 | 167 | -88.2 | -174.6 | 169.2 | 170 | -2.5 | 110.8 | N157 D161 R162 D163 | N157-R159 PolarHBondContact O-N 3.14Å; R159-D161 PolarHBondContact O-N 3.36Å; R159-R162 PolarHBondContact O-N 3.18Å; R159-D163 PolarHBondContact O-N 2.99Å |
| 160 | D | 58.4 | Low | 67.9 | Low | 114 Ų | 114 | 112.7 Ų | 112.7 | 61% | 0.61 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -59.4 | -44 | -175.7 | -67.7 | -76.2 | 0 | 0 | 0 | 112.5 | N157 R162 D163 A164 | N157-D160 PolarHBondContact O-N 2.9Å; D160-R162 PolarHBondContact O-N 3.37Å; D160-D163 PolarHBondContact O-N 3.35Å; D160-A164 WeakPolarHBondContact O-CB 3.12Å; D160-A164 PolarHBondContact O-N 3.45Å |
| 161 | D | 57.2 | Low | 66.3 | Low | 103 Ų | 103 | 116 Ų | 116 | 55% | 0.551 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -64.7 | -37.5 | 175 | -73.1 | -58.5 | 0 | 0 | 0 | 112.4 | N157 R159 E165 | N157-D161 PolarHBondContact ND2-OD2 3.31Å; R159-D161 PolarHBondContact O-N 3.36Å; D161-E165 VanDerWaalsContact O-CB 3.25Å; D161-E165 WeakPolarHBondContact O-CB 3.25Å; D161-E165 PolarHBondContact O-N 3.18Å |
| 162 | R | 58.7 | Low | 64.7 | Low | 181 Ų | 181 | 118 Ų | 118 | 68% | 0.683 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -71.1 | -39.4 | 178.9 | -82 | -170.5 | 65.2 | 169.4 | -1.5 | 112.6 | P158 R159 D160 S166 | P158-R162 WeakPolarHBondContact O-CB 3.3Å; P158-R162 VanDerWaalsContact O-CD 3.26Å; P158-R162 WeakPolarHBondContact O-CD 3.26Å; P158-R162 VanDerWaalsContact O-CG 3.3Å; P158-R162 WeakPolarHBondContact O-CG 3.44Å; R159-R162 PolarHBondContact O-N 3.18Å; D160-R162 PolarHBondContact O-N 3.37Å; R162-S166 WeakPolarHBondContact O-CB 3.08Å; R162-S166 PolarHBondContact O-N 3.02Å; R162-S166 PolarHBondContact O-OG 2.87Å |
| 163 | D | 56.4 | Low | 63.2 | Low | 106 Ų | 106 | 122.7 Ų | 122.7 | 57% | 0.567 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -78.6 | -32.4 | 178.3 | -80.5 | -42.4 | 0 | 0 | 0 | 111.7 | R159 D160 A167 | R159-D163 PolarHBondContact O-N 2.99Å; D160-D163 PolarHBondContact O-N 3.35Å; D163-A167 WeakPolarHBondContact O-CB 3.39Å; D163-A167 PolarHBondContact O-N 2.65Å |
| 164 | A | 60.7 | Low | 62 | Low | 61 Ų | 61 | 120.2 Ų | 120.2 | 50% | 0.504 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -64.4 | -48.6 | 169.8 | 0 | 0 | 0 | 0 | 0 | 112 | D160 A167 A168 | D160-A164 WeakPolarHBondContact O-CB 3.12Å; D160-A164 PolarHBondContact O-N 3.45Å; A164-A167 PolarHBondContact O-N 3.04Å; A164-A168 WeakPolarHBondContact O-CB 3.19Å; A164-A168 PolarHBondContact O-N 2.93Å |
| 165 | E | 55.4 | Low | 61 | Low | 157 Ų | 157 | 119.1 Ų | 119.1 | 73% | 0.734 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -68 | -35.8 | 177.1 | -164.1 | 177.1 | 105.4 | 0 | 0 | 111.4 | D161 A168 S169 | D161-E165 VanDerWaalsContact O-CB 3.25Å; D161-E165 WeakPolarHBondContact O-CB 3.25Å; D161-E165 PolarHBondContact O-N 3.18Å; E165-A168 PolarHBondContact O-N 3.36Å; E165-S169 WeakPolarHBondContact O-CB 3.15Å; E165-S169 PolarHBondContact O-N 2.86Å |
| 166 | S | 53.9 | Low | 60.3 | Low | 45 Ų | 45 | 119 Ų | 119 | 32% | 0.315 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -69.4 | -34 | 173.9 | -64.2 | 0 | 0 | 0 | 0 | 113.2 | R162 R170 | R162-S166 WeakPolarHBondContact O-CB 3.08Å; R162-S166 PolarHBondContact O-N 3.02Å; R162-S166 PolarHBondContact O-OG 2.87Å; S166-R170 VanDerWaalsContact O-CG 3.25Å; S166-R170 WeakPolarHBondContact O-CG 3.25Å; S166-R170 PolarHBondContact O-N 3.46Å; S166-R170 VanDerWaalsContact O-N 3.16Å |
| 167 | A | 57.9 | Low | 60.3 | Low | 56 Ų | 56 | 116.6 Ų | 116.6 | 46% | 0.463 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -70.8 | -43.5 | 174.2 | 0 | 0 | 0 | 0 | 0 | 110.9 | D163 A164 S169 R170 | D163-A167 WeakPolarHBondContact O-CB 3.39Å; D163-A167 PolarHBondContact O-N 2.65Å; A164-A167 PolarHBondContact O-N 3.04Å; A167-S169 PolarHBondContact O-N 2.91Å; A167-R170 PolarHBondContact O-N 2.92Å |
| 168 | A | 57.8 | Low | 60.6 | Low | 67 Ų | 67 | 116.8 Ų | 116.8 | 55% | 0.554 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -60.7 | -43.4 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | A164 E165 R170 L171 | A164-A168 WeakPolarHBondContact O-CB 3.19Å; A164-A168 PolarHBondContact O-N 2.93Å; E165-A168 PolarHBondContact O-N 3.36Å; A168-R170 VanDerWaalsContact C-N 3.26Å; A168-R170 PolarHBondContact O-N 3.35Å; A168-L171 PolarHBondContact O-N 2.85Å |
| 169 | S | 54.8 | Low | 61.7 | Low | 102 Ų | 102 | 115.3 Ų | 115.3 | 71% | 0.713 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -68.3 | -21.4 | 178.9 | -167 | 0 | 0 | 0 | 0 | 113.7 | E165 A167 L171 | E165-S169 WeakPolarHBondContact O-CB 3.15Å; E165-S169 PolarHBondContact O-N 2.86Å; A167-S169 PolarHBondContact O-N 2.91Å; S169-L171 VanDerWaalsContact C-N 3.31Å |
| 170 | R | 56.2 | Low | 63 | Low | 200 Ų | 200 | 110.6 Ų | 110.6 | 76% | 0.755 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -76.7 | -14.5 | 170.2 | -72.6 | 171.2 | -159 | -140.4 | 9.8 | 113.4 | S166 A167 A168 | S166-R170 VanDerWaalsContact O-CG 3.25Å; S166-R170 WeakPolarHBondContact O-CG 3.25Å; S166-R170 PolarHBondContact O-N 3.46Å; S166-R170 VanDerWaalsContact O-N 3.16Å; A167-R170 PolarHBondContact O-N 2.92Å; A168-R170 VanDerWaalsContact C-N 3.26Å; A168-R170 PolarHBondContact O-N 3.35Å |
| 171 | L | 59.3 | Low | 64.3 | Low | 143 Ų | 143 | 108.2 Ų | 108.2 | 75% | 0.749 | 60% | 0.597 | S | S | * | * | S | Bend | trans | -98.7 | 87.3 | 174.8 | -106.5 | 68.8 | 0 | 0 | 0 | 111.5 | A168 S169 | A168-L171 PolarHBondContact O-N 2.85Å; S169-L171 VanDerWaalsContact C-N 3.31Å |
| 172 | N | 57.4 | Low | 65.7 | Low | 147 Ų | 147 | 108.6 Ų | 108.6 | 79% | 0.786 | 60% | 0.599 | S | S | * | * | trans | 43.8 | 83.8 | 157.7 | -72.2 | -10.9 | 0 | 0 | 0 | 117.7 | ||||
| 173 | K | 57.6 | Low | 66.9 | Low | 201 Ų | 201 | 102.7 Ų | 102.7 | 87% | 0.874 | 59% | 0.589 | S | S | * | * | -100.8 | 115.7 | 127.3 | -74.2 | -179.1 | -178.4 | 172.2 | 0 | 108 | S175 | K173-S175 PolarHBondContact O-N 3.47Š| |||
| 174 | P | 63 | Low | 68.2 | Low | 82 Ų | 82 | 103.5 Ų | 103.5 | 53% | 0.532 | 59% | 0.592 | S | S | . | * | trans | -56.3 | 130.8 | 172.5 | -24.9 | 34.9 | 0 | 0 | 0 | 110.4 | F176 | P174-F176 HydrophobicContact CB-CD1 4.03Å; P174-F176 HydrophobicContact CB-CE1 3.82Å; P174-F176 HydrophobicContact CB-CG 4.49Å; P174-F176 HydrophobicContact CB-CZ 4.12Å; P174-F176 PolarHBondContact O-N 2.83Å | ||
| 175 | S | 64.9 | Low | 69.5 | Low | 131 Ų | 131 | 104.5 Ų | 104.5 | 92% | 0.916 | 59% | 0.592 | S | S | * | * | S | Bend | trans | -75.2 | 5.9 | 176 | 50.7 | 0 | 0 | 0 | 0 | 113.5 | K173 | K173-S175 PolarHBondContact O-N 3.47Š|
| 176 | F | 69.9 | Low | 71 | Confident | 124 Ų | 124 | 98 Ų | 98 | 54% | 0.544 | 57% | 0.565 | S | S | . | * | S | Bend | trans | -127.6 | 144.1 | 176.7 | 63.3 | -86.5 | 0 | 0 | 0 | 109.8 | P174 P178 | P174-F176 HydrophobicContact CB-CD1 4.03Å; P174-F176 HydrophobicContact CB-CE1 3.82Å; P174-F176 HydrophobicContact CB-CG 4.49Å; P174-F176 HydrophobicContact CB-CZ 4.12Å; P174-F176 PolarHBondContact O-N 2.83Å; F176-P178 HydrophobicContact CD2-CG 4.33Å; F176-P178 HydrophobicContact CE2-CG 4.07Å; F176-P178 WeakPolarHBondContact O-CD 3.27Å |
| 177 | N | 79.4 | Confident | 72.4 | Confident | 84 Ų | 84 | 96.9 Ų | 96.9 | 45% | 0.449 | 56% | 0.559 | S | S | . | * | trans | -87.8 | 116.6 | 169 | 175.7 | 5.9 | 0 | 0 | 0 | 109.1 | G179 D180 T181 | N177-G179 PolarHBondContact O-N 2.76Å; N177-G179 VanDerWaalsContact O-N 3.15Å; N177-G179 PolarHBondContact OD1-N 3.5Å; N177-D180 HydrophobicContact CB-CB 4.14Å; N177-D180 VanDerWaalsContact CB-OD2 3.27Å; N177-D180 WeakPolarHBondContact CB-OD2 3.46Å; N177-D180 PolarHBondContact ND2-OD1 2.8Å; N177-D180 PolarHBondContact ND2-OD2 3.16Å; N177-D180 PolarHBondContact O-N 2.84Å; N177-D180 VanDerWaalsContact O-N 3.11Å; N177-T181 PolarHBondContact O-N 3.18Å; N177-T181 PolarHBondContact O-OG1 3.5Å | ||
| 178 | P | 78.5 | Confident | 73.6 | Confident | 71 Ų | 71 | 100 Ų | 100 | 46% | 0.461 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -58.7 | -27.6 | 178.7 | -23.8 | 34 | 0 | 0 | 0 | 113.7 | F176 N182 | F176-P178 HydrophobicContact CD2-CG 4.33Å; F176-P178 HydrophobicContact CE2-CG 4.07Å; F176-P178 WeakPolarHBondContact O-CD 3.27Å; P178-N182 WeakPolarHBondContact O-CB 3.44Å; P178-N182 VanDerWaalsContact O-CG 3.29Å; P178-N182 PolarHBondContact O-N 3.13Å; P178-N182 PolarHBondContact O-ND2 3.5Å |
| 179 | G | 83 | Confident | 74.8 | Confident | 41 Ų | 41 | 99.8 Ų | 99.8 | 42% | 0.423 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -64.9 | -49.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | N177 N182 A183 | N177-G179 PolarHBondContact O-N 2.76Å; N177-G179 VanDerWaalsContact O-N 3.15Å; N177-G179 PolarHBondContact OD1-N 3.5Å; G179-N182 PolarHBondContact O-N 3.21Å; G179-A183 WeakPolarHBondContact O-CB 3.37Å; G179-A183 PolarHBondContact O-N 3.34Å |
| 180 | D | 81.9 | Confident | 76.1 | Confident | 106 Ų | 106 | 103.1 Ų | 103.1 | 57% | 0.567 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -69 | -38.3 | -179.3 | -58.8 | -25.8 | 0 | 0 | 0 | 111.3 | N177 A183 L184 | N177-D180 HydrophobicContact CB-CB 4.14Å; N177-D180 VanDerWaalsContact CB-OD2 3.27Å; N177-D180 WeakPolarHBondContact CB-OD2 3.46Å; N177-D180 PolarHBondContact ND2-OD1 2.8Å; N177-D180 PolarHBondContact ND2-OD2 3.16Å; N177-D180 PolarHBondContact O-N 2.84Å; N177-D180 VanDerWaalsContact O-N 3.11Å; D180-A183 PolarHBondContact O-N 3.02Å; D180-L184 WeakPolarHBondContact O-CB 3.45Å; D180-L184 PolarHBondContact O-N 2.86Å |
| 181 | T | 86.3 | Confident | 77.1 | Confident | 64 Ų | 64 | 95.3 Ų | 95.3 | 39% | 0.393 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -59.2 | -47.1 | 172.5 | -52.4 | 0 | 0 | 0 | 0 | 111.3 | N177 L184 V185 | N177-T181 PolarHBondContact O-N 3.18Å; N177-T181 PolarHBondContact O-OG1 3.5Å; T181-L184 PolarHBondContact O-N 3.27Å; T181-V185 WeakPolarHBondContact O-CG2 3.42Å; T181-V185 PolarHBondContact O-N 3.39Å |
| 182 | N | 86.3 | Confident | 77.9 | Confident | 112 Ų | 112 | 96 Ų | 96 | 60% | 0.599 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -67.7 | -35.3 | 177.7 | -76.8 | -33.9 | 0 | 0 | 0 | 112.7 | P178 G179 A186 | P178-N182 WeakPolarHBondContact O-CB 3.44Å; P178-N182 VanDerWaalsContact O-CG 3.29Å; P178-N182 PolarHBondContact O-N 3.13Å; P178-N182 PolarHBondContact O-ND2 3.5Å; G179-N182 PolarHBondContact O-N 3.21Å; N182-A186 VanDerWaalsContact O-CB 3.29Å; N182-A186 WeakPolarHBondContact O-CB 3.44Å; N182-A186 PolarHBondContact O-N 3.22Å |
| 183 | A | 84.5 | Confident | 78.6 | Confident | 57 Ų | 57 | 92.8 Ų | 92.8 | 47% | 0.471 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -64.9 | -44.4 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | G179 D180 A186 A187 | G179-A183 WeakPolarHBondContact O-CB 3.37Å; G179-A183 PolarHBondContact O-N 3.34Å; D180-A183 PolarHBondContact O-N 3.02Å; A183-A186 PolarHBondContact O-N 3.33Å; A183-A187 WeakPolarHBondContact O-CB 3.25Å; A183-A187 PolarHBondContact O-N 2.88Å |
| 184 | L | 84.4 | Confident | 79.4 | Confident | 122 Ų | 122 | 88.9 Ų | 88.9 | 64% | 0.639 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -63 | -46.2 | 176.6 | -167.4 | 75.7 | 0 | 0 | 0 | 111.5 | D180 T181 A186 A187 V188 | D180-L184 WeakPolarHBondContact O-CB 3.45Å; D180-L184 PolarHBondContact O-N 2.86Å; T181-L184 PolarHBondContact O-N 3.27Å; L184-A186 VanDerWaalsContact C-N 3.32Å; L184-A186 PolarHBondContact O-N 2.97Å; L184-A187 PolarHBondContact O-N 3.04Å; L184-V188 WeakPolarHBondContact O-CG2 3.35Å; L184-V188 PolarHBondContact O-N 3.11Å |
| 185 | V | 87.5 | Confident | 79.7 | Confident | 82 Ų | 82 | 89.9 Ų | 89.9 | 50% | 0.497 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -60.7 | -41.4 | 175.3 | 170.1 | 0 | 0 | 0 | 0 | 111.1 | T181 V188 A189 | T181-V185 WeakPolarHBondContact O-CG2 3.42Å; T181-V185 PolarHBondContact O-N 3.39Å; V185-V188 PolarHBondContact O-N 3.32Å; V185-A189 VanDerWaalsContact O-CB 3.25Å; V185-A189 WeakPolarHBondContact O-CB 3.13Å; V185-A189 PolarHBondContact O-N 3.12Å |
| 186 | A | 85.6 | Confident | 79.4 | Confident | 21 Ų | 21 | 93.6 Ų | 93.6 | 17% | 0.174 | 55% | 0.549 | C | S | . | . | H | α-helix | trans | -68.5 | -33.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | N182 A183 L184 F190 G191 K192 | N182-A186 VanDerWaalsContact O-CB 3.29Å; N182-A186 WeakPolarHBondContact O-CB 3.44Å; N182-A186 PolarHBondContact O-N 3.22Å; A183-A186 PolarHBondContact O-N 3.33Å; L184-A186 VanDerWaalsContact C-N 3.32Å; L184-A186 PolarHBondContact O-N 2.97Å; A186-F190 CarbonylContact O-C 3.57Å; A186-F190 WeakPolarHBondContact O-CB 3.35Å; A186-F190 PolarHBondContact O-N 3.32Å; A186-F190 VanDerWaalsContact O-N 3.14Å; A186-G191 PolarHBondContact O-N 3.15Å; A186-K192 HydrophobicContact CB-CB 4.15Å; A186-K192 HydrophobicContact CB-CD 4.18Å; A186-K192 WeakPolarHBondContact O-CB 3.42Å; A186-K192 PolarHBondContact O-N 3.06Å; A186-K192 VanDerWaalsContact O-N 3.14Å |
| 187 | A | 84.6 | Confident | 78.4 | Confident | 22 Ų | 22 | 93.1 Ų | 93.1 | 18% | 0.182 | 56% | 0.559 | C | S | . | * | H | α-helix | trans | -69.2 | -42.9 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | A183 L184 G191 K192 | A183-A187 WeakPolarHBondContact O-CB 3.25Å; A183-A187 PolarHBondContact O-N 2.88Å; L184-A187 PolarHBondContact O-N 3.04Å; A187-G191 WeakPolarHBondContact O-CA 3.32Å; A187-G191 PolarHBondContact O-N 2.87Å; A187-K192 WeakPolarHBondContact CA-O 3.47Å |
| 188 | V | 83.3 | Confident | 77.3 | Confident | 121 Ų | 121 | 99.9 Ų | 99.9 | 73% | 0.733 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -73.5 | -47.3 | -179.3 | 172.6 | 0 | 0 | 0 | 0 | 112.2 | L184 V185 | L184-V188 WeakPolarHBondContact O-CG2 3.35Å; L184-V188 PolarHBondContact O-N 3.11Å; V185-V188 PolarHBondContact O-N 3.32Å |
| 189 | A | 82.3 | Confident | 75.9 | Confident | 62 Ų | 62 | 101.6 Ų | 101.6 | 51% | 0.512 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -81.1 | -28.9 | -174.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | V185 | V185-A189 VanDerWaalsContact O-CB 3.25Å; V185-A189 WeakPolarHBondContact O-CB 3.13Å; V185-A189 PolarHBondContact O-N 3.12Å |
| 190 | F | 82.8 | Confident | 74.3 | Confident | 173 Ų | 173 | 106.1 Ų | 106.1 | 76% | 0.759 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -130.4 | 4.6 | -172.5 | -52.5 | -70.8 | 0 | 0 | 0 | 114.3 | A186 K192 | A186-F190 CarbonylContact O-C 3.57Å; A186-F190 WeakPolarHBondContact O-CB 3.35Å; A186-F190 PolarHBondContact O-N 3.32Å; A186-F190 VanDerWaalsContact O-N 3.14Å; F190-K192 PolarHBondContact O-N 3.07Å |
| 191 | G | 77.3 | Confident | 72.3 | Confident | 36 Ų | 36 | 104 Ų | 104 | 37% | 0.371 | 62% | 0.615 | S | S | . | * | trans | 66.4 | 11.5 | -177.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | A186 A187 G193 L194 | A186-G191 PolarHBondContact O-N 3.15Å; A187-G191 WeakPolarHBondContact O-CA 3.32Å; A187-G191 PolarHBondContact O-N 2.87Å; G191-G193 PolarHBondContact O-N 3.15Å; G191-L194 PolarHBondContact O-N 3.43Å; G191-L194 VanDerWaalsContact O-N 3.12Å | ||
| 192 | K | 76 | Confident | 70.3 | Confident | 158 Ų | 158 | 107.6 Ų | 107.6 | 69% | 0.687 | 64% | 0.639 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.3 | 117.3 | -170.3 | -168.4 | 179.1 | -178.5 | -178.5 | 0 | 110.6 | A186 A187 F190 | A186-K192 HydrophobicContact CB-CB 4.15Å; A186-K192 HydrophobicContact CB-CD 4.18Å; A186-K192 WeakPolarHBondContact O-CB 3.42Å; A186-K192 PolarHBondContact O-N 3.06Å; A186-K192 VanDerWaalsContact O-N 3.14Å; A187-K192 WeakPolarHBondContact CA-O 3.47Å; F190-K192 PolarHBondContact O-N 3.07Å |
| 193 | G | 71.8 | Confident | 68.5 | Low | 78 Ų | 78 | 111.4 Ų | 111.4 | 80% | 0.804 | 66% | 0.656 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 94.8 | -4.6 | -177.7 | 0 | 0 | 0 | 0 | 0 | 115 | G191 | G191-G193 PolarHBondContact O-N 3.15Š|
| 194 | L | 74.7 | Confident | 66.3 | Low | 119 Ų | 119 | 113 Ų | 113 | 62% | 0.623 | 67% | 0.67 | S | S | * | * | trans | -86.9 | 116.8 | 175.3 | -60 | -179.1 | 0 | 0 | 0 | 111 | G191 K196 | G191-L194 PolarHBondContact O-N 3.43Å; G191-L194 VanDerWaalsContact O-N 3.12Å; L194-K196 PolarHBondContact O-N 2.91Å | ||
| 195 | S | 68.9 | Low | 64.2 | Low | 104 Ų | 104 | 113.6 Ų | 113.6 | 73% | 0.727 | 68% | 0.68 | S | S | * | * | trans | -62.7 | 126 | 175 | -62 | 0 | 0 | 0 | 0 | 111.2 | C197 | S195-C197 PolarHBondContact O-N 3.24Š| ||
| 196 | K | 59.4 | Low | 61.6 | Low | 209 Ų | 209 | 112.8 Ų | 112.8 | 91% | 0.909 | 69% | 0.689 | S | S | * | * | trans | -74.8 | 71.8 | 175.4 | -67.5 | -177.2 | 180 | 178.5 | 0 | 111.1 | L194 R198 | L194-K196 PolarHBondContact O-N 2.91Å; K196-R198 VanDerWaalsContact C-N 3.31Å; K196-R198 PolarHBondContact O-N 3.01Å | ||
| 197 | C | 48.2 | Very low | 59.4 | Low | 113 Ų | 113 | 120.9 Ų | 120.9 | 76% | 0.764 | 72% | 0.722 | S | S | * | * | trans | -66.1 | 86.4 | 172.8 | -67.1 | 0 | 0 | 0 | 0 | 110.5 | S195 P199 | S195-C197 PolarHBondContact O-N 3.24Å; C197-P199 WeakPolarHBondContact O-CD 3.29Å | ||
| 198 | R | 56.1 | Low | 57.5 | Low | 226 Ų | 226 | 126 Ų | 126 | 85% | 0.853 | 75% | 0.754 | S | S | * | * | trans | -67.2 | 120.9 | 165.6 | 177.6 | -177.2 | -73.7 | -176.2 | -3.5 | 107.8 | K196 | K196-R198 VanDerWaalsContact C-N 3.31Å; K196-R198 PolarHBondContact O-N 3.01Å | ||
| 199 | P | 49.9 | Very low | 55.2 | Low | 107 Ų | 107 | 123.8 Ų | 123.8 | 70% | 0.695 | 76% | 0.755 | S | S | * | * | trans | -64.4 | 139.8 | 173.8 | 27 | -33.6 | 0 | 0 | 0 | 110.1 | C197 G201 | C197-P199 WeakPolarHBondContact O-CD 3.29Å; P199-G201 PolarHBondContact O-N 2.9Å; P199-G201 VanDerWaalsContact O-N 3.13Å | ||
| 200 | P | 47.6 | Very low | 52.9 | Low | 137 Ų | 137 | 130.6 Ų | 130.6 | 89% | 0.89 | 78% | 0.777 | S | S | * | * | trans | -64.9 | 111.6 | 174.8 | -21.6 | 33.8 | 0 | 0 | 0 | 111.3 | ||||
| 201 | G | 41.5 | Very low | 50.5 | Low | 62 Ų | 62 | 125.9 Ų | 125.9 | 64% | 0.639 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -81.7 | 158.2 | 169.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | P199 | P199-G201 PolarHBondContact O-N 2.9Å; P199-G201 VanDerWaalsContact O-N 3.13Å |
| 202 | P | 44.5 | Very low | 48.9 | Very low | 139 Ų | 139 | 130.5 Ų | 130.5 | 90% | 0.903 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -69.9 | 143.7 | -165.6 | -20.3 | 33.8 | 0 | 0 | 0 | 114.7 | ||
| 203 | M | 47 | Very low | 47 | Very low | 191 Ų | 191 | 131.3 Ų | 131.3 | 94% | 0.941 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -73.8 | 137.6 | 164.5 | -73.9 | 179.7 | 165.8 | 0 | 0 | 110.6 | ||
| 204 | A | 39.7 | Very low | 45.4 | Very low | 92 Ų | 92 | 136 Ų | 136 | 76% | 0.76 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -84.4 | 148.2 | 167 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||
| 205 | P | 39.3 | Very low | 43.4 | Very low | 133 Ų | 133 | 135.6 Ų | 135.6 | 86% | 0.864 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -88.1 | 134.2 | -173.3 | -1.8 | 21.2 | 0 | 0 | 0 | 112.9 | ||
| 206 | G | 34.2 | Very low | 41.7 | Very low | 65 Ų | 65 | 134.1 Ų | 134.1 | 67% | 0.67 | 82% | 0.82 | S | S | * | * | trans | 116.4 | 98.8 | 153.9 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 207 | H | 38.6 | Very low | 40.7 | Very low | 191 Ų | 191 | 127.5 Ų | 127.5 | 88% | 0.884 | 81% | 0.811 | S | S | * | * | -169.3 | 141.7 | 129.1 | -103.9 | 78.7 | 0 | 0 | 0 | 109.2 | |||||
| 208 | P | 44 | Very low | 40.4 | Very low | 130 Ų | 130 | 128.5 Ų | 128.5 | 84% | 0.844 | 82% | 0.816 | S | S | * | * | trans | -83.4 | 129.2 | 173.9 | 32.2 | -31.7 | 0 | 0 | 0 | 111.3 | ||||
| 209 | G | 35.6 | Very low | 39.5 | Very low | 74 Ų | 74 | 123.7 Ų | 123.7 | 76% | 0.763 | 81% | 0.812 | S | S | * | * | trans | -149.2 | 139.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | G211 | G209-G211 PolarHBondContact O-N 2.86Š| ||
| 210 | Q | 34.1 | Very low | 39 | Very low | 206 Ų | 206 | 127.2 Ų | 127.2 | 96% | 0.963 | 82% | 0.824 | S | S | * | * | trans | -90.1 | 105.9 | -161.7 | -66.7 | 167.7 | -35.2 | 0 | 0 | 114.8 | ||||
| 211 | G | 33 | Very low | 38.5 | Very low | 73 Ų | 73 | 129.6 Ų | 129.6 | 75% | 0.753 | 82% | 0.823 | S | S | * | * | trans | 63.3 | -171.1 | 149.2 | 0 | 0 | 0 | 0 | 0 | 119.1 | G209 | G209-G211 PolarHBondContact O-N 2.86Š| ||
| 212 | P | 43.6 | Very low | 38 | Very low | 134 Ų | 134 | 134.7 Ų | 134.7 | 87% | 0.87 | 83% | 0.83 | S | S | * | * | cis | -116.7 | 170.7 | -4.8 | 40.6 | -29.1 | 0 | 0 | 0 | 115.5 | ||||
| 213 | M | 36.2 | Very low | 37.5 | Very low | 175 Ų | 175 | 134.4 Ų | 134.4 | 86% | 0.862 | 83% | 0.826 | S | S | * | * | trans | -39.1 | 126.1 | 175 | -169.9 | -178.6 | -160.3 | 0 | 0 | 118.8 | ||||
| 214 | M | 38.1 | Very low | 36.7 | Very low | 175 Ų | 175 | 131.1 Ų | 131.1 | 86% | 0.862 | 82% | 0.817 | S | S | * | * | trans | -153 | 117.9 | 139 | -76.3 | -53.5 | -114.6 | 0 | 0 | 106.4 | ||||
| 215 | S | 32 | Very low | 36.6 | Very low | 111 Ų | 111 | 134.8 Ų | 134.8 | 78% | 0.776 | 82% | 0.822 | S | S | * | * | 68.8 | 118.5 | 62.3 | -163.8 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 216 | G | 33.6 | Very low | 36.2 | Very low | 74 Ų | 74 | 131.7 Ų | 131.7 | 76% | 0.763 | 81% | 0.814 | S | S | * | * | trans | 104.9 | 75.7 | 168.3 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 217 | G | 38.1 | Very low | 35.9 | Very low | 69 Ų | 69 | 132.8 Ų | 132.8 | 71% | 0.711 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -81.9 | 132.2 | 162.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | T219 | G217-T219 PolarHBondContact O-N 2.96Š|
| 218 | P | 42 | Very low | 35.5 | Very low | 135 Ų | 135 | 127.8 Ų | 127.8 | 88% | 0.877 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -72.3 | 120.1 | 176.6 | -15.3 | 30 | 0 | 0 | 0 | 111.4 | ||
| 219 | T | 37.7 | Very low | 34.7 | Very low | 124 Ų | 124 | 125.4 Ų | 125.4 | 76% | 0.761 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 149.7 | 170.9 | 44 | 0 | 0 | 0 | 0 | 111.4 | G217 Q221 | G217-T219 PolarHBondContact O-N 2.96Å; T219-Q221 PolarHBondContact O-N 3.39Å |
| 220 | L | 39.7 | Very low | 34.4 | Very low | 181 Ų | 181 | 125.6 Ų | 125.6 | 95% | 0.948 | 83% | 0.826 | S | S | * | * | trans | -58.1 | 106.9 | 166.7 | -83.3 | 160.6 | 0 | 0 | 0 | 109.6 | Q222 | L220-Q222 PolarHBondContact O-N 3.43Š| ||
| 221 | Q | 35.1 | Very low | 34.3 | Very low | 187 Ų | 187 | 123.9 Ų | 123.9 | 87% | 0.874 | 82% | 0.818 | S | S | * | * | trans | -90.1 | 96.5 | 178.5 | -152.6 | 165.3 | 31.5 | 0 | 0 | 110.4 | T219 | T219-Q221 PolarHBondContact O-N 3.39Š| ||
| 222 | Q | 33 | Very low | 34.2 | Very low | 169 Ų | 169 | 128.4 Ų | 128.4 | 79% | 0.79 | 82% | 0.82 | S | S | * | * | trans | -59.1 | 142.8 | 176.2 | 178.7 | 176.4 | -26.5 | 0 | 0 | 111.7 | L220 T224 | L220-Q222 PolarHBondContact O-N 3.43Å; Q222-T224 PolarHBondContact O-N 3.3Å | ||
| 223 | V | 32.2 | Very low | 33.6 | Very low | 134 Ų | 134 | 126.1 Ų | 126.1 | 81% | 0.812 | 81% | 0.812 | S | S | * | * | trans | -67 | 113.5 | 179.1 | -175 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 224 | T | 32 | Very low | 33.3 | Very low | 121 Ų | 121 | 121.4 Ų | 121.4 | 74% | 0.742 | 81% | 0.808 | S | S | * | * | trans | -113.1 | 116.1 | 172.1 | -65.5 | 0 | 0 | 0 | 0 | 109.2 | Q222 G226 | Q222-T224 PolarHBondContact O-N 3.3Å; T224-G226 PolarHBondContact O-N 3.17Å | ||
| 225 | I | 35.9 | Very low | 33.1 | Very low | 170 Ų | 170 | 122.5 Ų | 122.5 | 87% | 0.872 | 81% | 0.814 | S | S | * | * | trans | -76.2 | 101.8 | 170.6 | -63.7 | 175.9 | 0 | 0 | 0 | 107.7 | ||||
| 226 | G | 30.6 | Very low | 33 | Very low | 68 Ų | 68 | 121 Ų | 121 | 70% | 0.701 | 82% | 0.815 | S | S | * | * | trans | -110.7 | 119.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | T224 | T224-G226 PolarHBondContact O-N 3.17Š| ||
| 227 | G | 29 | Very low | 32.9 | Very low | 87 Ų | 87 | 121.1 Ų | 121.1 | 90% | 0.897 | 82% | 0.817 | S | S | * | * | trans | -79.7 | 149.6 | 166.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 228 | G | 29.3 | Very low | 33.2 | Very low | 86 Ų | 86 | 123.4 Ų | 123.4 | 89% | 0.887 | 82% | 0.82 | S | S | * | * | trans | -162.5 | 154.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 229 | G | 27.6 | Very low | 32.9 | Very low | 81 Ų | 81 | 124 Ų | 124 | 84% | 0.835 | 82% | 0.82 | S | S | * | * | trans | -155.1 | 158.8 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 230 | G | 28.8 | Very low | 32.8 | Very low | 77 Ų | 77 | 122.9 Ų | 122.9 | 79% | 0.794 | 82% | 0.823 | S | S | * | * | trans | 82.6 | 145.1 | -172.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 231 | Q | 32.2 | Very low | 33.1 | Very low | 170 Ų | 170 | 119.9 Ų | 119.9 | 79% | 0.794 | 82% | 0.815 | S | S | * | * | cis | -140.7 | -172.6 | -2.8 | -53.1 | -176.4 | 9 | 0 | 0 | 107.8 | ||||
| 232 | Q | 32.2 | Very low | 32.9 | Very low | 168 Ų | 168 | 119 Ų | 119 | 79% | 0.785 | 81% | 0.811 | S | S | * | * | cis | -154 | -161.8 | 6 | -145.5 | -179.2 | 83.7 | 0 | 0 | 105.3 | ||||
| 233 | A | 31 | Very low | 32.9 | Very low | 87 Ų | 87 | 117.9 Ų | 117.9 | 72% | 0.719 | 81% | 0.806 | S | S | * | * | cis | -159.3 | 171.8 | -1.1 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 234 | G | 29.9 | Very low | 32.9 | Very low | 75 Ų | 75 | 120.2 Ų | 120.2 | 77% | 0.773 | 81% | 0.807 | S | S | * | * | trans | 169.8 | 125.4 | 170.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 235 | M | 33.1 | Very low | 33 | Very low | 198 Ų | 198 | 118 Ų | 118 | 98% | 0.975 | 81% | 0.808 | S | S | * | * | trans | -83.9 | 153.7 | -167.8 | -56.2 | 104.3 | 70.7 | 0 | 0 | 115.9 | ||||
| 236 | G | 30.9 | Very low | 33.3 | Very low | 79 Ų | 79 | 119.1 Ų | 119.1 | 81% | 0.814 | 81% | 0.81 | S | S | * | * | trans | 128.4 | 129.1 | 130.5 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 237 | G | 31.3 | Very low | 33.8 | Very low | 77 Ų | 77 | 122 Ų | 122 | 79% | 0.794 | 82% | 0.817 | S | S | * | * | trans | 109 | 142.2 | 159.4 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 238 | P | 44.8 | Very low | 34.1 | Very low | 118 Ų | 118 | 121.5 Ų | 121.5 | 77% | 0.766 | 81% | 0.811 | S | S | * | * | trans | -123.1 | 147.4 | -161.8 | 42 | -28.5 | 0 | 0 | 0 | 118.4 | ||||
| 239 | V | 34.3 | Very low | 34.7 | Very low | 146 Ų | 146 | 127.4 Ų | 127.4 | 89% | 0.885 | 81% | 0.812 | S | S | * | * | trans | 56.7 | 116.2 | 148.3 | -57.6 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 240 | A | 37.2 | Very low | 35.2 | Very low | 101 Ų | 101 | 132.4 Ų | 132.4 | 84% | 0.835 | 82% | 0.816 | S | S | * | * | trans | -157.7 | 146.4 | 137.3 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 241 | P | 44.8 | Very low | 35.7 | Very low | 118 Ų | 118 | 134.3 Ų | 134.3 | 77% | 0.766 | 82% | 0.815 | S | S | * | * | trans | -122.6 | 132.3 | -174.1 | 37.3 | -24 | 0 | 0 | 0 | 116 | ||||
| 242 | Q | 31.6 | Very low | 35.9 | Very low | 169 Ų | 169 | 131.6 Ų | 131.6 | 79% | 0.79 | 81% | 0.814 | S | S | * | * | trans | -167.3 | 141.3 | 139.8 | -117.6 | 175.5 | -79.2 | 0 | 0 | 116.4 | ||||
| 243 | Q | 33.5 | Very low | 36.1 | Very low | 146 Ų | 146 | 128.9 Ų | 128.9 | 68% | 0.682 | 81% | 0.814 | S | S | * | * | trans | 49.6 | 108.7 | 143.9 | -79.5 | 170.4 | 0.2 | 0 | 0 | 123.4 | ||||
| 244 | Q | 32.1 | Very low | 36.7 | Very low | 182 Ų | 182 | 131.7 Ų | 131.7 | 85% | 0.85 | 82% | 0.815 | S | S | * | * | 79.7 | 110.2 | 105.1 | -162 | 167.2 | 0.5 | 0 | 0 | 120.3 | |||||
| 245 | G | 33.6 | Very low | 37.5 | Very low | 74 Ų | 74 | 137.4 Ų | 137.4 | 76% | 0.763 | 82% | 0.819 | S | S | * | * | trans | -173.3 | 124.7 | 161.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 246 | Q | 42.3 | Very low | 38.2 | Very low | 195 Ų | 195 | 133.6 Ų | 133.6 | 91% | 0.911 | 81% | 0.807 | S | S | * | * | trans | -104.9 | 135.2 | 170.8 | -75.1 | -169.9 | 3.9 | 0 | 0 | 110.8 | ||||
| 247 | P | 39.9 | Very low | 38.5 | Very low | 129 Ų | 129 | 137.8 Ų | 137.8 | 84% | 0.838 | 81% | 0.811 | S | S | * | * | trans | -91.4 | 104.4 | 169.4 | 33.1 | -29.6 | 0 | 0 | 0 | 111.4 | ||||
| 248 | G | 36.4 | Very low | 39.3 | Very low | 75 Ų | 75 | 141 Ų | 141 | 77% | 0.773 | 81% | 0.808 | S | S | * | * | trans | -78.4 | 136.5 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 249 | K | 40.6 | Very low | 39.4 | Very low | 211 Ų | 211 | 145 Ų | 145 | 92% | 0.917 | 81% | 0.813 | S | S | * | * | trans | -78.6 | 136.6 | 171.2 | -62.6 | 176.9 | -178.6 | 177.1 | 0 | 110 | ||||
| 250 | M | 38.1 | Very low | 40 | Very low | 186 Ų | 186 | 143.1 Ų | 143.1 | 92% | 0.916 | 81% | 0.807 | S | S | * | * | trans | -120.4 | 121.8 | 174.4 | -154.1 | 172.1 | -162.8 | 0 | 0 | 110.5 | ||||
| 251 | P | 40.4 | Very low | 40.1 | Very low | 117 Ų | 117 | 143 Ų | 143 | 76% | 0.76 | 81% | 0.805 | S | S | * | * | trans | -83 | 142.9 | -179.4 | 32.7 | -33.7 | 0 | 0 | 0 | 111.9 | ||||
| 252 | S | 36.8 | Very low | 40.1 | Very low | 113 Ų | 113 | 143.3 Ų | 143.3 | 79% | 0.79 | 81% | 0.811 | S | S | * | * | trans | -85.5 | 139.3 | 173.5 | -174.1 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 253 | S | 35.5 | Very low | 40.7 | Very low | 110 Ų | 110 | 139.6 Ų | 139.6 | 77% | 0.769 | 81% | 0.809 | S | S | * | * | trans | -135.9 | 80.9 | -179.3 | 54.5 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 254 | I | 44.5 | Very low | 41.5 | Very low | 147 Ų | 147 | 137.2 Ų | 137.2 | 75% | 0.754 | 81% | 0.808 | S | S | * | * | trans | -78.6 | 121.4 | 168.9 | -64.2 | 175.4 | 0 | 0 | 0 | 108.9 | ||||
| 255 | K | 46.4 | Very low | 41.9 | Very low | 195 Ų | 195 | 136.8 Ų | 136.8 | 85% | 0.848 | 81% | 0.809 | S | S | * | * | trans | -112.5 | 103.6 | 168.3 | -77.9 | -172.8 | 174.4 | -177.5 | 0 | 110 | N257 | K255-N257 PolarHBondContact O-N 3.14Š| ||
| 256 | T | 47.1 | Very low | 42.3 | Very low | 118 Ų | 118 | 141.4 Ų | 141.4 | 72% | 0.724 | 81% | 0.81 | S | S | * | * | trans | -77 | 114.6 | 171.1 | 14.8 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 257 | N | 38 | Very low | 42.7 | Very low | 167 Ų | 167 | 137.7 Ų | 137.7 | 89% | 0.893 | 80% | 0.803 | S | S | * | * | trans | -94.2 | 94.8 | 169.1 | -98.7 | -31 | 0 | 0 | 0 | 109.5 | K255 | K255-N257 PolarHBondContact O-N 3.14Š| ||
| 258 | I | 46.4 | Very low | 42.7 | Very low | 145 Ų | 145 | 142.3 Ų | 142.3 | 74% | 0.744 | 81% | 0.805 | S | S | * | * | trans | -95.3 | 107.9 | 168.3 | -58.8 | 175.9 | 0 | 0 | 0 | 107.4 | ||||
| 259 | K | 48.8 | Very low | 43.1 | Very low | 201 Ų | 201 | 146.4 Ų | 146.4 | 87% | 0.874 | 81% | 0.809 | S | S | * | * | trans | -107.3 | 91.3 | 176.2 | -166.4 | 178.2 | -175.7 | -176.6 | 0 | 109.9 | A261 | K259-A261 PolarHBondContact O-N 3.41Š| ||
| 260 | S | 45.3 | Very low | 43.3 | Very low | 106 Ų | 106 | 151.3 Ų | 151.3 | 74% | 0.741 | 82% | 0.822 | S | S | * | * | trans | -59.3 | 124.2 | 176 | -52.2 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 261 | A | 39.6 | Very low | 43.6 | Very low | 98 Ų | 98 | 149.6 Ų | 149.6 | 81% | 0.81 | 82% | 0.817 | S | S | * | * | trans | -110.8 | 76.5 | 178.8 | 0 | 0 | 0 | 0 | 0 | 110.6 | K259 A263 | K259-A261 PolarHBondContact O-N 3.41Å; A261-A263 PolarHBondContact O-N 3.14Å | ||
| 262 | S | 45.6 | Very low | 43.7 | Very low | 125 Ų | 125 | 151.3 Ų | 151.3 | 87% | 0.874 | 82% | 0.82 | S | S | * | * | trans | -77.8 | 93 | 170.6 | 54.2 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 263 | A | 42.7 | Very low | 44.1 | Very low | 92 Ų | 92 | 153.4 Ų | 153.4 | 76% | 0.76 | 82% | 0.822 | S | S | * | * | trans | -138 | 119.2 | 174 | 0 | 0 | 0 | 0 | 0 | 110.1 | A261 | A261-A263 PolarHBondContact O-N 3.14Š| ||
| 264 | S | 50.4 | Low | 44.6 | Very low | 95 Ų | 95 | 156 Ų | 156 | 66% | 0.664 | 83% | 0.825 | S | S | * | * | trans | -82.1 | 126.2 | 177.4 | 177.9 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 265 | M | 42.1 | Very low | 44.6 | Very low | 174 Ų | 174 | 156.6 Ų | 156.6 | 86% | 0.857 | 83% | 0.83 | S | S | * | * | trans | -142.1 | 101.8 | 166.1 | -73 | -86.3 | 71.6 | 0 | 0 | 108.9 | ||||
| 266 | H | 41.9 | Very low | 44.5 | Very low | 170 Ų | 170 | 154 Ų | 154 | 79% | 0.787 | 83% | 0.828 | S | S | * | * | trans | -88.9 | 123.7 | 169.7 | -73.6 | -90.7 | 0 | 0 | 0 | 110 | Y268 | H266-Y268 PolarHBondContact O-N 2.93Š| ||
| 267 | P | 49.6 | Very low | 44.3 | Very low | 118 Ų | 118 | 156.6 Ų | 156.6 | 77% | 0.766 | 84% | 0.836 | S | S | * | * | trans | -101.7 | 57.3 | 178.3 | 39.1 | -33.7 | 0 | 0 | 0 | 112.2 | ||||
| 268 | Y | 40.9 | Very low | 44.8 | Very low | 226 Ų | 226 | 155.8 Ų | 155.8 | 89% | 0.886 | 83% | 0.831 | S | S | * | * | trans | -132.7 | 109.6 | 161.9 | -81.1 | -73.1 | 0 | 0 | 0 | 109.4 | H266 | H266-Y268 PolarHBondContact O-N 2.93Š| ||
| 269 | N | 44.9 | Very low | 44.7 | Very low | 160 Ų | 160 | 156.7 Ų | 156.7 | 86% | 0.856 | 84% | 0.839 | S | S | * | * | trans | -129.4 | 154.9 | 161 | -157 | 5.2 | 0 | 0 | 0 | 107.4 | ||||
| 270 | R | 44 | Very low | 44.3 | Very low | 315 Ų | 315 | 152.6 Ų | 152.6 | 100% | 1.189 | 84% | 0.836 | S | S | * | * | trans | -62.6 | 0 | -165 | -66 | 177.6 | 176.7 | 170 | -2.7 | 114.5 |
Retrieved 270 of 270 residues in 177.5 ms
(Link to these results)