| 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 | 45.8 | Very low | 77 | Confident | 242 Ų | 242 | 107.2 Ų | 107.2 | 100% | 1.192 | 60% | 0.598 | S | S | * | * | 0 | 119.4 | 0 | -64.2 | -82 | -170.4 | 0 | 0 | 105.8 | E3 | M1-E3 PolarHBondContact O-N 3.47Š| |||
| 2 | A | 58.3 | Low | 77.7 | Confident | 90 Ų | 90 | 104.7 Ų | 104.7 | 74% | 0.744 | 59% | 0.587 | S | S | * | * | trans | -65.2 | 131.5 | -177.4 | 0 | 0 | 0 | 0 | 0 | 110.1 | Q4 | A2-Q4 PolarHBondContact O-N 3.2Å; A2-Q4 VanDerWaalsContact O-N 3.1Å | ||
| 3 | E | 63 | Low | 78.4 | Confident | 188 Ų | 188 | 98.1 Ų | 98.1 | 88% | 0.879 | 55% | 0.552 | S | S | * | * | trans | -53.1 | 113.4 | 172.6 | -174.7 | 100.4 | 84.7 | 0 | 0 | 108.8 | M1 A5 | M1-E3 PolarHBondContact O-N 3.47Å; E3-A5 PolarHBondContact O-N 3.16Å | ||
| 4 | Q | 66.1 | Low | 78.8 | Confident | 119 Ų | 119 | 100.2 Ų | 100.2 | 56% | 0.556 | 56% | 0.56 | S | S | * | * | trans | -78.4 | 106.5 | 178.9 | -70.2 | -73.4 | 18.6 | 0 | 0 | 108.6 | A2 T6 N39 | A2-Q4 PolarHBondContact O-N 3.2Å; A2-Q4 VanDerWaalsContact O-N 3.1Å; Q4-T6 PolarHBondContact O-N 3.43Å; Q4-N39 PolarHBondContact O-ND2 3.1Å | ||
| 5 | A | 79.1 | Confident | 79 | Confident | 73 Ų | 73 | 96.2 Ų | 96.2 | 60% | 0.603 | 55% | 0.55 | S | S | * | * | P | Polyproline II helix | trans | -52.5 | 137.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | E3 K7 | E3-A5 PolarHBondContact O-N 3.16Å; A5-K7 WeakPolarHBondContact O-CG 3.38Å; A5-K7 PolarHBondContact O-N 2.91Å; A5-K7 VanDerWaalsContact O-N 3.16Å |
| 6 | T | 83.9 | Confident | 79.1 | Confident | 98 Ų | 98 | 93.3 Ų | 93.3 | 60% | 0.601 | 53% | 0.532 | S | S | * | . | P | Polyproline II helix | trans | -57.8 | 116.9 | 179 | -52.6 | 0 | 0 | 0 | 0 | 110.1 | Q4 N39 | Q4-T6 PolarHBondContact O-N 3.43Å; T6-N39 CarbonylContact C-O 3.57Å; T6-N39 VanDerWaalsContact CA-O 3.32Å; T6-N39 WeakPolarHBondContact CA-O 3.48Å |
| 7 | K | 89 | Confident | 79.2 | Confident | 88 Ų | 88 | 96.1 Ų | 96.1 | 38% | 0.383 | 54% | 0.543 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.2 | 143.7 | 178.6 | -62.2 | -174.7 | -177 | 69.3 | 0 | 109.4 | A5 N39 W40 R41 | A5-K7 WeakPolarHBondContact O-CG 3.38Å; A5-K7 PolarHBondContact O-N 2.91Å; A5-K7 VanDerWaalsContact O-N 3.16Å; K7-N39 PolarHBondContact N-O 2.86Å; K7-W40 HydrophobicContact CB-CD2 4.04Å; K7-W40 HydrophobicContact CB-CE3 3.74Å; K7-W40 HydrophobicContact CB-CH2 3.98Å; K7-W40 HydrophobicContact CB-CZ2 4.26Å; K7-W40 HydrophobicContact CB-CZ3 3.7Å; K7-W40 HydrophobicContact CD-CH2 3.76Å; K7-W40 HydrophobicContact CD-CZ2 3.77Å; K7-W40 HydrophobicContact CD-CZ3 4.36Å; K7-W40 HydrophobicContact CG-CH2 4.5Å; K7-W40 CarbonylContact O-C 3.52Å; K7-W40 WeakPolarHBondContact O-CA 3.34Å; K7-R41 PolarHBondContact O-N 2.84Å |
| 8 | S | 91.4 | Very high | 79.3 | Confident | 89 Ų | 89 | 94.7 Ų | 94.7 | 62% | 0.622 | 54% | 0.54 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -118.6 | 136.1 | 177.6 | -59.8 | 0 | 0 | 0 | 0 | 110.1 | R41 | S8-R41 CarbonylContact C-O 3.48Å; S8-R41 VanDerWaalsContact CA-O 3.32Å; S8-R41 WeakPolarHBondContact CA-O 3.43Å |
| 9 | V | 90 | Very high | 79.8 | Confident | 38 Ų | 38 | 100.2 Ų | 100.2 | 23% | 0.23 | 55% | 0.551 | C | S | . | * | E | Extended strand (participates in β ladder) | trans | -129.1 | 135.3 | 175.4 | 65.8 | 0 | 0 | 0 | 0 | 109.9 | F11 F27 W40 R41 V42 D43 | V9-F11 HydrophobicContact CG1-CE2 3.87Å; V9-F11 HydrophobicContact CG1-CZ 4.36Å; V9-F11 HydrophobicContact CG2-CD2 4.48Å; V9-F11 HydrophobicContact CG2-CE1 4.31Å; V9-F11 HydrophobicContact CG2-CE2 3.98Å; V9-F11 HydrophobicContact CG2-CZ 3.88Å; V9-F27 HydrophobicContact CG1-CD1 4Å; V9-F27 HydrophobicContact CG1-CE1 3.74Å; V9-F27 HydrophobicContact CG1-CZ 4.26Å; V9-W40 HydrophobicContact CG1-CE3 4.49Å; V9-R41 PolarHBondContact N-O 2.83Å; V9-V42 HydrophobicContact CG1-CB 4.2Å; V9-V42 HydrophobicContact CG1-CG1 3.86Å; V9-V42 HydrophobicContact CG1-CG2 4.04Å; V9-D43 PolarHBondContact O-N 3.32Å; V9-D43 VanDerWaalsContact O-N 3.09Å |
| 10 | L | 91.4 | Very high | 80.2 | Confident | 105 Ų | 105 | 95.4 Ų | 95.4 | 55% | 0.55 | 53% | 0.525 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.6 | 116.4 | 176.7 | -176.7 | 71.3 | 0 | 0 | 0 | 109.1 | V12 D43 A45 | L10-V12 HydrophobicContact CD2-CG2 3.87Å; L10-V12 HydrophobicContact CG-CG2 3.86Å; L10-D43 WeakPolarHBondContact CA-O 3.32Å; L10-D43 HydrophobicContact CD1-CB 3.7Å; L10-A45 HydrophobicContact CD1-CB 4.08Å; L10-A45 HydrophobicContact CD2-CB 4.46Å |
| 11 | F | 89.3 | Confident | 80.5 | Confident | 49 Ų | 49 | 93 Ų | 93 | 22% | 0.215 | 51% | 0.514 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.9 | 121.3 | 175.1 | -66.1 | -77.1 | 0 | 0 | 0 | 110.4 | V9 S20 A23 E24 F27 V42 D43 S44 A45 | V9-F11 HydrophobicContact CG1-CE2 3.87Å; V9-F11 HydrophobicContact CG1-CZ 4.36Å; V9-F11 HydrophobicContact CG2-CD2 4.48Å; V9-F11 HydrophobicContact CG2-CE1 4.31Å; V9-F11 HydrophobicContact CG2-CE2 3.98Å; V9-F11 HydrophobicContact CG2-CZ 3.88Å; F11-S20 WeakPolarHBondContact O-CB 3.32Å; F11-A23 HydrophobicContact CB-CB 4.31Å; F11-A23 HydrophobicContact CD1-CB 3.59Å; F11-A23 HydrophobicContact CD2-CB 4.41Å; F11-A23 HydrophobicContact CE1-CB 3.95Å; F11-A23 HydrophobicContact CG-CB 3.85Å; F11-A23 HydrophobicContact CZ-CB 4.49Å; F11-E24 HydrophobicContact CD2-CB 4.35Å; F11-F27 HydrophobicContact CE2-CB 3.82Å; F11-F27 HydrophobicContact CE2-CD1 4.37Å; F11-F27 HydrophobicContact CE2-CD2 4.5Å; F11-F27 AromaticContact CE2-CG 3.99Å; F11-F27 HydrophobicContact CE2-CG 3.99Å; F11-F27 HydrophobicContact CZ-CB 3.88Å; F11-F27 AromaticContact CZ-CD2 3.94Å; F11-F27 HydrophobicContact CZ-CD2 3.94Å; F11-F27 AromaticContact CZ-CG 3.87Å; F11-F27 HydrophobicContact CZ-CG 3.87Å; F11-V42 HydrophobicContact CD2-CG1 4.2Å; F11-V42 HydrophobicContact CE2-CG1 3.86Å; F11-D43 PolarHBondContact N-O 3.37Å; F11-S44 CarbonylContact O-C 3.55Å; F11-S44 WeakPolarHBondContact O-CA 3.35Å; F11-S44 WeakPolarHBondContact O-CB 3.19Å; F11-A45 PolarHBondContact O-N 3.04Å |
| 12 | V | 85.1 | Confident | 82.7 | Confident | 77 Ų | 77 | 86.6 Ų | 86.6 | 47% | 0.467 | 48% | 0.484 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119 | 131.1 | -176.8 | -166.7 | 0 | 0 | 0 | 0 | 110.4 | L10 A45 T47 | L10-V12 HydrophobicContact CD2-CG2 3.87Å; L10-V12 HydrophobicContact CG-CG2 3.86Å; V12-A45 WeakPolarHBondContact CA-O 3.45Å; V12-T47 WeakPolarHBondContact CG1-OG1 3.22Å |
| 13 | C | 87.4 | Confident | 84.1 | Confident | 19 Ų | 19 | 84 Ų | 84 | 13% | 0.128 | 46% | 0.462 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.6 | 174.4 | 165.1 | 81.1 | 0 | 0 | 0 | 0 | 110 | G15 N16 R19 S20 A45 A46 T47 | C13-G15 PolarHBondContact O-N 3.13Å; C13-N16 WeakPolarHBondContact SG-CA 3.48Å; C13-N16 PolarHBondContact SG-N 2.98Å; C13-R19 HydrophobicContact CB-CB 4.22Å; C13-S20 PolarHBondContact SG-OG 3.32Å; C13-A45 PolarHBondContact N-O 3.37Å; C13-A46 CarbonylContact O-C 3.45Å; C13-A46 WeakPolarHBondContact O-CA 3.2Å; C13-T47 PolarHBondContact O-N 3.27Å |
| 14 | L | 83.9 | Confident | 85.5 | Confident | 128 Ų | 128 | 76.6 Ų | 76.6 | 67% | 0.67 | 43% | 0.427 | S | S | * | . | S | Bend | trans | -58.9 | -47.9 | -172.5 | -160.4 | 140.5 | 0 | 0 | 0 | 112.6 | S48 | L14-S48 WeakPolarHBondContact CD2-OG 3.46Å; L14-S48 WeakPolarHBondContact CG-OG 3.37Å; L14-S48 PolarHBondContact O-N 2.86Å; L14-S48 PolarHBondContact O-OG 3.18Å |
| 15 | G | 80.9 | Confident | 86.6 | Confident | 40 Ų | 40 | 73.8 Ų | 73.8 | 41% | 0.412 | 42% | 0.424 | S | S | . | . | S | Bend | trans | -113.7 | 6 | -175.4 | 0 | 0 | 0 | 0 | 0 | 116.7 | C13 I17 | C13-G15 PolarHBondContact O-N 3.13Å; G15-I17 WeakPolarHBondContact O-CG2 3.12Å; G15-I17 PolarHBondContact O-N 2.97Å |
| 16 | N | 80.9 | Confident | 87.3 | Confident | 50 Ų | 50 | 74.1 Ų | 74.1 | 27% | 0.267 | 42% | 0.418 | S | S | . | . | S | Bend | trans | 53 | 10.9 | -174.1 | -165.5 | -102.8 | 0 | 0 | 0 | 117.4 | C13 S20 P21 S44 A45 A46 | C13-N16 WeakPolarHBondContact SG-CA 3.48Å; C13-N16 PolarHBondContact SG-N 2.98Å; N16-S20 VanDerWaalsContact CA-OG 3.31Å; N16-S20 WeakPolarHBondContact CA-OG 3.38Å; N16-S20 PolarHBondContact ND2-OG 3.39Å; N16-P21 VanDerWaalsContact O-CD 3.27Å; N16-P21 WeakPolarHBondContact O-CD 3.38Å; N16-P21 WeakPolarHBondContact O-CG 3.14Å; N16-S44 WeakPolarHBondContact ND2-CB 3.39Å; N16-S44 PolarHBondContact ND2-O 3.05Å; N16-S44 PolarHBondContact ND2-OG 3.2Å; N16-A45 VanDerWaalsContact ND2-C 3.25Å; N16-A45 VanDerWaalsContact ND2-CA 3.33Å; N16-A45 WeakPolarHBondContact ND2-CA 3.13Å; N16-A45 PolarHBondContact ND2-N 2.8Å; N16-A45 PolarHBondContact ND2-O 3.21Å; N16-A46 HydrophobicContact CB-CB 3.81Å |
| 17 | I | 80.9 | Confident | 87.7 | Confident | 140 Ų | 140 | 71.7 Ų | 71.7 | 72% | 0.718 | 40% | 0.4 | S | S | * | . | S | Bend | trans | -102.5 | -28.4 | -174.1 | 51.4 | 159.5 | 0 | 0 | 0 | 115.4 | G15 P21 | G15-I17 WeakPolarHBondContact O-CG2 3.12Å; G15-I17 PolarHBondContact O-N 2.97Å; I17-P21 WeakPolarHBondContact O-CG 3.44Å |
| 18 | C | 81.7 | Confident | 87.8 | Confident | 72 Ų | 72 | 73.3 Ų | 73.3 | 49% | 0.486 | 40% | 0.403 | S | S | . | . | S | Bend | trans | -108.1 | -65.1 | -172.6 | -56.2 | 0 | 0 | 0 | 0 | 111.8 | I22 | C18-I22 WeakPolarHBondContact O-CD1 3.33Å; C18-I22 WeakPolarHBondContact O-CG1 3.48Å |
| 19 | R | 88.1 | Confident | 87.9 | Confident | 199 Ų | 199 | 75.9 Ų | 75.9 | 75% | 0.751 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -89.9 | -42.7 | -165.8 | -64.1 | 145.9 | -171.5 | 175.9 | 1.6 | 113.5 | C13 A23 | C13-R19 HydrophobicContact CB-CB 4.22Å; R19-A23 WeakPolarHBondContact O-CB 3.4Å; R19-A23 PolarHBondContact O-N 3.32Å |
| 20 | S | 87.7 | Confident | 88 | Confident | 3 Ų | 3 | 78.4 Ų | 78.4 | 2% | 0.021 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -68.8 | -39.1 | -178.9 | 61 | 0 | 0 | 0 | 0 | 114.2 | F11 C13 N16 I22 A23 E24 | F11-S20 WeakPolarHBondContact O-CB 3.32Å; C13-S20 PolarHBondContact SG-OG 3.32Å; N16-S20 VanDerWaalsContact CA-OG 3.31Å; N16-S20 WeakPolarHBondContact CA-OG 3.38Å; N16-S20 PolarHBondContact ND2-OG 3.39Å; S20-I22 VanDerWaalsContact C-N 3.34Å; S20-A23 PolarHBondContact O-N 2.9Å; S20-E24 WeakPolarHBondContact O-CB 3.41Å; S20-E24 PolarHBondContact O-N 3.09Å |
| 21 | P | 87 | Confident | 88 | Confident | 45 Ų | 45 | 73.8 Ų | 73.8 | 29% | 0.292 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -71.9 | -32.4 | 178.3 | 28.2 | -33.6 | 0 | 0 | 0 | 111.5 | N16 I17 E24 A25 | N16-P21 VanDerWaalsContact O-CD 3.27Å; N16-P21 WeakPolarHBondContact O-CD 3.38Å; N16-P21 WeakPolarHBondContact O-CG 3.14Å; I17-P21 WeakPolarHBondContact O-CG 3.44Å; P21-E24 PolarHBondContact O-N 3.08Å; P21-A25 WeakPolarHBondContact O-CB 3.41Å; P21-A25 PolarHBondContact O-N 3.09Å |
| 22 | I | 91.1 | Very high | 88.1 | Confident | 109 Ų | 109 | 75.6 Ų | 75.6 | 56% | 0.559 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -64.6 | -47.3 | 172.4 | -65.1 | 175.1 | 0 | 0 | 0 | 110.1 | C18 S20 E24 A25 V26 | C18-I22 WeakPolarHBondContact O-CD1 3.33Å; C18-I22 WeakPolarHBondContact O-CG1 3.48Å; S20-I22 VanDerWaalsContact C-N 3.34Å; I22-E24 VanDerWaalsContact C-N 3.32Å; I22-E24 PolarHBondContact O-N 3.22Å; I22-A25 PolarHBondContact O-N 2.87Å; I22-V26 HydrophobicContact CG2-CG2 4.26Å; I22-V26 WeakPolarHBondContact O-CB 3.47Å; I22-V26 VanDerWaalsContact O-CG2 3.28Å; I22-V26 WeakPolarHBondContact O-CG2 3.22Å; I22-V26 PolarHBondContact O-N 2.9Å |
| 23 | A | 89.3 | Confident | 88.4 | Confident | 34 Ų | 34 | 78 Ų | 78 | 28% | 0.281 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -61.1 | -41.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | F11 R19 S20 F27 | F11-A23 HydrophobicContact CB-CB 4.31Å; F11-A23 HydrophobicContact CD1-CB 3.59Å; F11-A23 HydrophobicContact CD2-CB 4.41Å; F11-A23 HydrophobicContact CE1-CB 3.95Å; F11-A23 HydrophobicContact CG-CB 3.85Å; F11-A23 HydrophobicContact CZ-CB 4.49Å; R19-A23 WeakPolarHBondContact O-CB 3.4Å; R19-A23 PolarHBondContact O-N 3.32Å; S20-A23 PolarHBondContact O-N 2.9Å; A23-F27 WeakPolarHBondContact O-CB 3.33Å; A23-F27 PolarHBondContact O-N 3.35Å |
| 24 | E | 91.1 | Very high | 88.6 | Confident | 34 Ų | 34 | 83.1 Ų | 83.1 | 16% | 0.159 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -60.3 | -50 | 174.1 | -180 | 179.7 | 138.2 | 0 | 0 | 111.8 | F11 S20 P21 I22 V26 F27 R28 V42 S44 | F11-E24 HydrophobicContact CD2-CB 4.35Å; S20-E24 WeakPolarHBondContact O-CB 3.41Å; S20-E24 PolarHBondContact O-N 3.09Å; P21-E24 PolarHBondContact O-N 3.08Å; I22-E24 VanDerWaalsContact C-N 3.32Å; I22-E24 PolarHBondContact O-N 3.22Å; E24-V26 PolarHBondContact O-N 3.2Å; E24-F27 PolarHBondContact O-N 2.98Å; E24-R28 HydrophobicContact CG-CG 4.39Å; E24-R28 WeakPolarHBondContact O-CB 3.36Å; E24-R28 WeakPolarHBondContact O-CG 3.28Å; E24-R28 PolarHBondContact O-N 3.48Å; E24-R28 IonicContact OE1-CZ 3.27Å; E24-R28 VanDerWaalsContact OE1-CZ 3.27Å; E24-R28 IonicContact OE1-NE 2.91Å; E24-R28 PolarHBondContact OE1-NE 3.02Å; E24-R28 IonicContact OE1-NH2 2.8Å; E24-R28 PolarHBondContact OE1-NH2 3.01Å; E24-V42 HydrophobicContact CG-CG1 3.88Å; E24-S44 WeakPolarHBondContact OE2-CB 3.06Å; E24-S44 PolarHBondContact OE2-N 2.7Å; E24-S44 PolarHBondContact OE2-OG 2.91Å |
| 25 | A | 90.1 | Very high | 88.8 | Confident | 59 Ų | 59 | 83.9 Ų | 83.9 | 49% | 0.488 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -62.7 | -43.1 | -178.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | P21 I22 K29 | P21-A25 WeakPolarHBondContact O-CB 3.41Å; P21-A25 PolarHBondContact O-N 3.09Å; I22-A25 PolarHBondContact O-N 2.87Å; A25-K29 PolarHBondContact O-N 2.96Å |
| 26 | V | 93.4 | Very high | 89.2 | Confident | 80 Ų | 80 | 84.6 Ų | 84.6 | 49% | 0.485 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -63.9 | -45.7 | 176.1 | 172.7 | 0 | 0 | 0 | 0 | 110.4 | I22 E24 K29 L30 | I22-V26 HydrophobicContact CG2-CG2 4.26Å; I22-V26 WeakPolarHBondContact O-CB 3.47Å; I22-V26 VanDerWaalsContact O-CG2 3.28Å; I22-V26 WeakPolarHBondContact O-CG2 3.22Å; I22-V26 PolarHBondContact O-N 2.9Å; E24-V26 PolarHBondContact O-N 3.2Å; V26-K29 WeakPolarHBondContact O-CB 3.5Å; V26-K29 PolarHBondContact O-N 3.28Å; V26-L30 HydrophobicContact CG1-CD1 4.09Å; V26-L30 HydrophobicContact CG1-CG 4.5Å; V26-L30 WeakPolarHBondContact O-CG 3.21Å; V26-L30 PolarHBondContact O-N 3.47Å |
| 27 | F | 92.1 | Very high | 89.3 | Confident | 48 Ų | 48 | 84.9 Ų | 84.9 | 21% | 0.211 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -65.1 | -42.9 | -179.4 | -164.8 | -93.5 | 0 | 0 | 0 | 111.8 | V9 F11 A23 E24 K29 L30 V31 W40 V42 | V9-F27 HydrophobicContact CG1-CD1 4Å; V9-F27 HydrophobicContact CG1-CE1 3.74Å; V9-F27 HydrophobicContact CG1-CZ 4.26Å; F11-F27 HydrophobicContact CE2-CB 3.82Å; F11-F27 HydrophobicContact CE2-CD1 4.37Å; F11-F27 HydrophobicContact CE2-CD2 4.5Å; F11-F27 AromaticContact CE2-CG 3.99Å; F11-F27 HydrophobicContact CE2-CG 3.99Å; F11-F27 HydrophobicContact CZ-CB 3.88Å; F11-F27 AromaticContact CZ-CD2 3.94Å; F11-F27 HydrophobicContact CZ-CD2 3.94Å; F11-F27 AromaticContact CZ-CG 3.87Å; F11-F27 HydrophobicContact CZ-CG 3.87Å; A23-F27 WeakPolarHBondContact O-CB 3.33Å; A23-F27 PolarHBondContact O-N 3.35Å; E24-F27 PolarHBondContact O-N 2.98Å; F27-K29 VanDerWaalsContact C-N 3.3Å; F27-K29 PolarHBondContact O-N 2.93Å; F27-L30 PolarHBondContact O-N 3.29Å; F27-V31 HydrophobicContact CD1-CG1 3.95Å; F27-V31 HydrophobicContact CE1-CG1 3.58Å; F27-V31 HydrophobicContact CZ-CG1 4.09Å; F27-V31 WeakPolarHBondContact O-CG2 3.45Å; F27-V31 PolarHBondContact O-N 2.91Å; F27-W40 HydrophobicContact CE1-CD2 4.1Å; F27-W40 AromaticContact CE1-CE3 3.73Å; F27-W40 HydrophobicContact CE1-CE3 3.73Å; F27-W40 HydrophobicContact CE1-CZ3 4.17Å; F27-W40 HydrophobicContact CZ-CD2 4.17Å; F27-W40 AromaticContact CZ-CE3 3.73Å; F27-W40 HydrophobicContact CZ-CE3 3.73Å; F27-W40 HydrophobicContact CZ-CH2 4.13Å; F27-W40 AromaticContact CZ-CZ3 3.71Å; F27-W40 HydrophobicContact CZ-CZ3 3.71Å; F27-V42 HydrophobicContact CD1-CB 4.49Å; F27-V42 HydrophobicContact CD1-CG1 3.96Å; F27-V42 HydrophobicContact CD1-CG2 3.63Å; F27-V42 HydrophobicContact CE1-CG2 3.9Å |
| 28 | R | 90.9 | Very high | 89.5 | Confident | 122 Ų | 122 | 86.8 Ų | 86.8 | 46% | 0.46 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -56.4 | -42.9 | 172.7 | -77.1 | 179.5 | -173.1 | -102.4 | 4.3 | 111.9 | E24 V31 T32 V42 | E24-R28 HydrophobicContact CG-CG 4.39Å; E24-R28 WeakPolarHBondContact O-CB 3.36Å; E24-R28 WeakPolarHBondContact O-CG 3.28Å; E24-R28 PolarHBondContact O-N 3.48Å; E24-R28 IonicContact OE1-CZ 3.27Å; E24-R28 VanDerWaalsContact OE1-CZ 3.27Å; E24-R28 IonicContact OE1-NE 2.91Å; E24-R28 PolarHBondContact OE1-NE 3.02Å; E24-R28 IonicContact OE1-NH2 2.8Å; E24-R28 PolarHBondContact OE1-NH2 3.01Å; R28-V31 WeakPolarHBondContact O-CG2 3.49Å; R28-T32 WeakPolarHBondContact O-CB 3.31Å; R28-T32 PolarHBondContact O-N 3.43Å; R28-T32 VanDerWaalsContact O-N 3.08Å; R28-T32 PolarHBondContact O-OG1 3.23Å; R28-V42 HydrophobicContact CG-CB 4.41Å; R28-V42 HydrophobicContact CG-CG1 4.42Å; R28-V42 PolarHBondContact NH2-O 3.38Å |
| 29 | K | 93.5 | Very high | 89.8 | Confident | 143 Ų | 143 | 85.9 Ų | 85.9 | 62% | 0.622 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -62.7 | -47 | 176.6 | -167.7 | -176.8 | 177.3 | 78.2 | 0 | 111.2 | A25 V26 F27 V31 T32 D33 | A25-K29 PolarHBondContact O-N 2.96Å; V26-K29 WeakPolarHBondContact O-CB 3.5Å; V26-K29 PolarHBondContact O-N 3.28Å; F27-K29 VanDerWaalsContact C-N 3.3Å; F27-K29 PolarHBondContact O-N 2.93Å; K29-V31 PolarHBondContact O-N 2.85Å; K29-T32 PolarHBondContact O-N 3.06Å; K29-D33 PolarHBondContact O-N 2.69Å |
| 30 | L | 92.6 | Very high | 89.9 | Confident | 90 Ų | 90 | 80 Ų | 80 | 47% | 0.471 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -62.6 | -42.1 | -180 | -68.8 | 171.9 | 0 | 0 | 0 | 113.3 | V26 F27 T32 Q34 | V26-L30 HydrophobicContact CG1-CD1 4.09Å; V26-L30 HydrophobicContact CG1-CG 4.5Å; V26-L30 WeakPolarHBondContact O-CG 3.21Å; V26-L30 PolarHBondContact O-N 3.47Å; F27-L30 PolarHBondContact O-N 3.29Å; L30-T32 VanDerWaalsContact C-N 3.3Å; L30-Q34 WeakPolarHBondContact O-CB 3.27Å; L30-Q34 WeakPolarHBondContact O-CG 3.42Å; L30-Q34 PolarHBondContact O-N 2.93Å; L30-Q34 VanDerWaalsContact O-N 3.09Å |
| 31 | V | 91.4 | Very high | 89.9 | Confident | 9 Ų | 9 | 87.7 Ų | 87.7 | 6% | 0.055 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -70.8 | -28.5 | 177.4 | -61 | 0 | 0 | 0 | 0 | 112.3 | F27 R28 K29 N35 I36 S37 W40 | F27-V31 HydrophobicContact CD1-CG1 3.95Å; F27-V31 HydrophobicContact CE1-CG1 3.58Å; F27-V31 HydrophobicContact CZ-CG1 4.09Å; F27-V31 WeakPolarHBondContact O-CG2 3.45Å; F27-V31 PolarHBondContact O-N 2.91Å; R28-V31 WeakPolarHBondContact O-CG2 3.49Å; K29-V31 PolarHBondContact O-N 2.85Å; V31-N35 PolarHBondContact O-N 3.5Å; V31-I36 HydrophobicContact CB-CG1 4.05Å; V31-I36 HydrophobicContact CG1-CG1 4.37Å; V31-I36 PolarHBondContact O-N 2.83Å; V31-S37 PolarHBondContact O-N 3.19Å; V31-W40 HydrophobicContact CG1-CB 4.32Å; V31-W40 HydrophobicContact CG1-CG 4.07Å |
| 32 | T | 90.4 | Very high | 90.1 | Very high | 87 Ų | 87 | 86.1 Ų | 86.1 | 53% | 0.534 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -73 | -45.7 | 175.3 | -55.6 | 0 | 0 | 0 | 0 | 110.8 | R28 K29 L30 Q34 N35 | R28-T32 WeakPolarHBondContact O-CB 3.31Å; R28-T32 PolarHBondContact O-N 3.43Å; R28-T32 VanDerWaalsContact O-N 3.08Å; R28-T32 PolarHBondContact O-OG1 3.23Å; K29-T32 PolarHBondContact O-N 3.06Å; L30-T32 VanDerWaalsContact C-N 3.3Å; T32-Q34 PolarHBondContact O-N 3.19Å; T32-N35 PolarHBondContact O-N 2.76Å |
| 33 | D | 93 | Very high | 89.9 | Confident | 127 Ų | 127 | 84.6 Ų | 84.6 | 68% | 0.679 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -58.9 | -35.3 | 174.3 | -105.1 | -96.5 | 0 | 0 | 0 | 112.1 | K29 N35 | K29-D33 PolarHBondContact O-N 2.69Å; D33-N35 VanDerWaalsContact C-N 3.32Å |
| 34 | Q | 90.9 | Very high | 89.8 | Confident | 126 Ų | 126 | 84.2 Ų | 84.2 | 59% | 0.589 | 42% | 0.423 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.7 | 0.7 | 177 | -70.5 | 178.6 | 58.7 | 0 | 0 | 114.1 | L30 T32 I36 | L30-Q34 WeakPolarHBondContact O-CB 3.27Å; L30-Q34 WeakPolarHBondContact O-CG 3.42Å; L30-Q34 PolarHBondContact O-N 2.93Å; L30-Q34 VanDerWaalsContact O-N 3.09Å; T32-Q34 PolarHBondContact O-N 3.19Å; Q34-I36 HydrophobicContact CB-CD1 3.98Å; Q34-I36 HydrophobicContact CB-CG1 3.87Å; Q34-I36 PolarHBondContact O-N 3.29Å |
| 35 | N | 88.5 | Confident | 89.6 | Confident | 145 Ų | 145 | 84.2 Ų | 84.2 | 78% | 0.775 | 43% | 0.429 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.2 | 28.2 | -179.3 | -144.8 | -105.6 | 0 | 0 | 0 | 114.4 | V31 T32 D33 | V31-N35 PolarHBondContact O-N 3.5Å; T32-N35 PolarHBondContact O-N 2.76Å; D33-N35 VanDerWaalsContact C-N 3.32Å |
| 36 | I | 89.3 | Confident | 89.3 | Confident | 55 Ų | 55 | 83.4 Ų | 83.4 | 28% | 0.282 | 42% | 0.423 | S | S | . | . | trans | -111.3 | 13.5 | 179.8 | 58.1 | 179.5 | 0 | 0 | 0 | 112.1 | V31 Q34 E38 N39 W40 | V31-I36 HydrophobicContact CB-CG1 4.05Å; V31-I36 HydrophobicContact CG1-CG1 4.37Å; V31-I36 PolarHBondContact O-N 2.83Å; Q34-I36 HydrophobicContact CB-CD1 3.98Å; Q34-I36 HydrophobicContact CB-CG1 3.87Å; Q34-I36 PolarHBondContact O-N 3.29Å; I36-E38 PolarHBondContact O-N 3.38Å; I36-E38 VanDerWaalsContact O-N 3.13Å; I36-N39 PolarHBondContact O-N 3.06Å; I36-W40 VanDerWaalsContact O-CD1 3.3Å | ||
| 37 | S | 82.8 | Confident | 88.7 | Confident | 55 Ų | 55 | 84.7 Ų | 84.7 | 39% | 0.385 | 43% | 0.431 | S | S | . | . | G | 310 helix | trans | -55 | -32.2 | -177.1 | 50 | 0 | 0 | 0 | 0 | 113.3 | V31 N39 W40 | V31-S37 PolarHBondContact O-N 3.19Å; S37-N39 VanDerWaalsContact C-N 3.27Å; S37-N39 PolarHBondContact O-N 3.44Å; S37-W40 PolarHBondContact O-N 2.99Å |
| 38 | E | 85.6 | Confident | 87.7 | Confident | 181 Ų | 181 | 85.1 Ų | 85.1 | 85% | 0.846 | 44% | 0.44 | S | S | * | . | G | 310 helix | trans | -71.1 | -21.1 | -179.4 | -54.5 | -158 | 104.4 | 0 | 0 | 113.4 | I36 | I36-E38 PolarHBondContact O-N 3.38Å; I36-E38 VanDerWaalsContact O-N 3.13Å |
| 39 | N | 88.1 | Confident | 86.3 | Confident | 52 Ų | 52 | 83 Ų | 83 | 28% | 0.278 | 46% | 0.456 | S | S | . | . | G | 310 helix | trans | -94.4 | 2.2 | 178.4 | -60 | 91.2 | 0 | 0 | 0 | 113.1 | Q4 T6 K7 I36 S37 | Q4-N39 PolarHBondContact O-ND2 3.1Å; T6-N39 CarbonylContact C-O 3.57Å; T6-N39 VanDerWaalsContact CA-O 3.32Å; T6-N39 WeakPolarHBondContact CA-O 3.48Å; K7-N39 PolarHBondContact N-O 2.86Å; I36-N39 PolarHBondContact O-N 3.06Å; S37-N39 VanDerWaalsContact C-N 3.27Å; S37-N39 PolarHBondContact O-N 3.44Å |
| 40 | W | 88.7 | Confident | 84 | Confident | 77 Ų | 77 | 79.2 Ų | 79.2 | 29% | 0.292 | 46% | 0.458 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.6 | 124.1 | -175 | -74.4 | 89.7 | 0 | 0 | 0 | 112.8 | K7 V9 F27 V31 I36 S37 V42 | K7-W40 HydrophobicContact CB-CD2 4.04Å; K7-W40 HydrophobicContact CB-CE3 3.74Å; K7-W40 HydrophobicContact CB-CH2 3.98Å; K7-W40 HydrophobicContact CB-CZ2 4.26Å; K7-W40 HydrophobicContact CB-CZ3 3.7Å; K7-W40 HydrophobicContact CD-CH2 3.76Å; K7-W40 HydrophobicContact CD-CZ2 3.77Å; K7-W40 HydrophobicContact CD-CZ3 4.36Å; K7-W40 HydrophobicContact CG-CH2 4.5Å; K7-W40 CarbonylContact O-C 3.52Å; K7-W40 WeakPolarHBondContact O-CA 3.34Å; V9-W40 HydrophobicContact CG1-CE3 4.49Å; F27-W40 HydrophobicContact CE1-CD2 4.1Å; F27-W40 AromaticContact CE1-CE3 3.73Å; F27-W40 HydrophobicContact CE1-CE3 3.73Å; F27-W40 HydrophobicContact CE1-CZ3 4.17Å; F27-W40 HydrophobicContact CZ-CD2 4.17Å; F27-W40 AromaticContact CZ-CE3 3.73Å; F27-W40 HydrophobicContact CZ-CE3 3.73Å; F27-W40 HydrophobicContact CZ-CH2 4.13Å; F27-W40 AromaticContact CZ-CZ3 3.71Å; F27-W40 HydrophobicContact CZ-CZ3 3.71Å; V31-W40 HydrophobicContact CG1-CB 4.32Å; V31-W40 HydrophobicContact CG1-CG 4.07Å; I36-W40 VanDerWaalsContact O-CD1 3.3Å; S37-W40 PolarHBondContact O-N 2.99Å; W40-V42 HydrophobicContact CB-CG2 4.38Å |
| 41 | R | 89.2 | Confident | 81.5 | Confident | 163 Ų | 163 | 80.1 Ų | 80.1 | 62% | 0.615 | 47% | 0.472 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -98.2 | 122.7 | 167.1 | -171.6 | 174.6 | 178.2 | -172.9 | 1.2 | 109.3 | K7 S8 V9 D43 | K7-R41 PolarHBondContact O-N 2.84Å; S8-R41 CarbonylContact C-O 3.48Å; S8-R41 VanDerWaalsContact CA-O 3.32Å; S8-R41 WeakPolarHBondContact CA-O 3.43Å; V9-R41 PolarHBondContact N-O 2.83Å; R41-D43 IonicContact NE-OD2 3.96Å |
| 42 | V | 89.6 | Confident | 79 | Confident | 13 Ų | 13 | 87.1 Ų | 87.1 | 8% | 0.079 | 51% | 0.508 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.7 | 122.4 | -173.6 | -167.4 | 0 | 0 | 0 | 0 | 108.7 | V9 F11 E24 F27 R28 W40 | V9-V42 HydrophobicContact CG1-CB 4.2Å; V9-V42 HydrophobicContact CG1-CG1 3.86Å; V9-V42 HydrophobicContact CG1-CG2 4.04Å; F11-V42 HydrophobicContact CD2-CG1 4.2Å; F11-V42 HydrophobicContact CE2-CG1 3.86Å; E24-V42 HydrophobicContact CG-CG1 3.88Å; F27-V42 HydrophobicContact CD1-CB 4.49Å; F27-V42 HydrophobicContact CD1-CG1 3.96Å; F27-V42 HydrophobicContact CD1-CG2 3.63Å; F27-V42 HydrophobicContact CE1-CG2 3.9Å; R28-V42 HydrophobicContact CG-CB 4.41Å; R28-V42 HydrophobicContact CG-CG1 4.42Å; R28-V42 PolarHBondContact NH2-O 3.38Å; W40-V42 HydrophobicContact CB-CG2 4.38Å |
| 43 | D | 88.6 | Confident | 76.7 | Confident | 76 Ų | 76 | 90.3 Ų | 90.3 | 41% | 0.406 | 53% | 0.527 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.5 | 163.4 | 177.9 | -99.8 | -78.1 | 0 | 0 | 0 | 110.1 | V9 L10 F11 R41 | V9-D43 PolarHBondContact O-N 3.32Å; V9-D43 VanDerWaalsContact O-N 3.09Å; L10-D43 WeakPolarHBondContact CA-O 3.32Å; L10-D43 HydrophobicContact CD1-CB 3.7Å; F11-D43 PolarHBondContact N-O 3.37Å; R41-D43 IonicContact NE-OD2 3.96Å |
| 44 | S | 86.8 | Confident | 74.2 | Confident | 26 Ų | 26 | 88.5 Ų | 88.5 | 18% | 0.182 | 53% | 0.53 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.5 | 144.6 | 172 | 60.6 | 0 | 0 | 0 | 0 | 112.1 | F11 N16 E24 | F11-S44 CarbonylContact O-C 3.55Å; F11-S44 WeakPolarHBondContact O-CA 3.35Å; F11-S44 WeakPolarHBondContact O-CB 3.19Å; N16-S44 WeakPolarHBondContact ND2-CB 3.39Å; N16-S44 PolarHBondContact ND2-O 3.05Å; N16-S44 PolarHBondContact ND2-OG 3.2Å; E24-S44 WeakPolarHBondContact OE2-CB 3.06Å; E24-S44 PolarHBondContact OE2-N 2.7Å; E24-S44 PolarHBondContact OE2-OG 2.91Å |
| 45 | A | 85.8 | Confident | 71.7 | Confident | 34 Ų | 34 | 87.1 Ų | 87.1 | 28% | 0.281 | 53% | 0.53 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.6 | 167.1 | -178.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | L10 F11 V12 C13 N16 | L10-A45 HydrophobicContact CD1-CB 4.08Å; L10-A45 HydrophobicContact CD2-CB 4.46Å; F11-A45 PolarHBondContact O-N 3.04Å; V12-A45 WeakPolarHBondContact CA-O 3.45Å; C13-A45 PolarHBondContact N-O 3.37Å; N16-A45 VanDerWaalsContact ND2-C 3.25Å; N16-A45 VanDerWaalsContact ND2-CA 3.33Å; N16-A45 WeakPolarHBondContact ND2-CA 3.13Å; N16-A45 PolarHBondContact ND2-N 2.8Å; N16-A45 PolarHBondContact ND2-O 3.21Å |
| 46 | A | 85.3 | Confident | 69.2 | Low | 43 Ų | 43 | 87.6 Ų | 87.6 | 36% | 0.355 | 53% | 0.531 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.9 | 138 | 172.6 | 0 | 0 | 0 | 0 | 0 | 110.5 | C13 N16 | C13-A46 CarbonylContact O-C 3.45Å; C13-A46 WeakPolarHBondContact O-CA 3.2Å; N16-A46 HydrophobicContact CB-CB 3.81Å |
| 47 | T | 80.5 | Confident | 66.6 | Low | 107 Ų | 107 | 92.4 Ų | 92.4 | 66% | 0.656 | 55% | 0.551 | S | S | * | * | S | Bend | trans | -74.3 | -42.4 | 171.1 | -46.8 | 0 | 0 | 0 | 0 | 111.1 | V12 C13 | V12-T47 WeakPolarHBondContact CG1-OG1 3.22Å; C13-T47 PolarHBondContact O-N 3.27Å |
| 48 | S | 69.8 | Low | 64.7 | Low | 57 Ų | 57 | 97.5 Ų | 97.5 | 40% | 0.399 | 57% | 0.573 | S | S | . | * | S | Bend | trans | -94.1 | 101.4 | 173.3 | 56.3 | 0 | 0 | 0 | 0 | 108.6 | L14 G50 | L14-S48 WeakPolarHBondContact CD2-OG 3.46Å; L14-S48 WeakPolarHBondContact CG-OG 3.37Å; L14-S48 PolarHBondContact O-N 2.86Å; L14-S48 PolarHBondContact O-OG 3.18Å; S48-G50 PolarHBondContact O-N 2.93Å |
| 49 | G | 62.4 | Low | 62.6 | Low | 77 Ų | 77 | 93 Ų | 93 | 79% | 0.794 | 56% | 0.557 | S | S | * | * | trans | -66.8 | 80 | 159.5 | 0 | 0 | 0 | 0 | 0 | 108.8 | S51 | G49-S51 PolarHBondContact O-N 2.88Š| ||
| 50 | G | 44.5 | Very low | 60.5 | Low | 64 Ų | 64 | 95 Ų | 95 | 66% | 0.66 | 59% | 0.591 | S | S | * | * | trans | -66.3 | 88.7 | 168.7 | 0 | 0 | 0 | 0 | 0 | 108.7 | S48 L52 | S48-G50 PolarHBondContact O-N 2.93Å; G50-L52 PolarHBondContact O-N 2.89Å | ||
| 51 | S | 40.8 | Very low | 58.4 | Low | 109 Ų | 109 | 96.9 Ų | 96.9 | 76% | 0.762 | 61% | 0.611 | S | S | * | * | S | Bend | trans | 6.9 | 77.2 | 154.8 | -177 | 0 | 0 | 0 | 0 | 116.3 | G49 | G49-S51 PolarHBondContact O-N 2.88Š|
| 52 | L | 39.3 | Very low | 56.2 | Low | 155 Ų | 155 | 100.5 Ų | 100.5 | 81% | 0.812 | 63% | 0.625 | S | S | * | * | trans | -134.1 | -0.6 | 154.2 | -72.7 | 177.8 | 0 | 0 | 0 | 112.5 | G50 A54 | G50-L52 PolarHBondContact O-N 2.89Å; L52-A54 PolarHBondContact O-N 3Å | ||
| 53 | T | 41.9 | Very low | 54 | Low | 155 Ų | 155 | 104.1 Ų | 104.1 | 95% | 0.951 | 66% | 0.656 | S | S | * | * | trans | -83.4 | 47.1 | 171 | -33.9 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 54 | A | 40.3 | Very low | 51.8 | Low | 88 Ų | 88 | 102.3 Ų | 102.3 | 73% | 0.727 | 66% | 0.655 | S | S | * | * | trans | -145.3 | 56.5 | 161.2 | 0 | 0 | 0 | 0 | 0 | 109.6 | L52 | L52-A54 PolarHBondContact O-N 3Š| ||
| 55 | V | 39.1 | Very low | 49.7 | Very low | 97 Ų | 97 | 107.4 Ų | 107.4 | 59% | 0.588 | 69% | 0.688 | S | S | * | * | trans | -124.8 | 90.1 | 145.1 | -166.1 | 0 | 0 | 0 | 0 | 108 | F57 | V55-F57 HydrophobicContact CB-CD2 4.13Å; V55-F57 HydrophobicContact CB-CE2 4.37Å; V55-F57 HydrophobicContact CG1-CD2 3.19Å; V55-F57 HydrophobicContact CG1-CE2 3.36Å; V55-F57 HydrophobicContact CG1-CG 3.94Å; V55-F57 HydrophobicContact CG1-CZ 4.2Å; V55-F57 PolarHBondContact O-N 3.03Å | ||
| 56 | L | 35.3 | Very low | 47.8 | Very low | 155 Ų | 155 | 114.7 Ų | 114.7 | 81% | 0.812 | 72% | 0.716 | S | S | * | * | trans | -65.3 | 87.5 | 159.5 | -155.5 | 95 | 0 | 0 | 0 | 106.6 | L58 | L56-L58 PolarHBondContact O-N 3.09Å; L56-L58 VanDerWaalsContact O-N 3.09Å | ||
| 57 | F | 34.5 | Very low | 45.9 | Very low | 157 Ų | 157 | 118.4 Ų | 118.4 | 69% | 0.689 | 73% | 0.734 | S | S | * | * | trans | -74.6 | 101.1 | 171 | -101.7 | -73.1 | 0 | 0 | 0 | 108.2 | V55 T59 | V55-F57 HydrophobicContact CB-CD2 4.13Å; V55-F57 HydrophobicContact CB-CE2 4.37Å; V55-F57 HydrophobicContact CG1-CD2 3.19Å; V55-F57 HydrophobicContact CG1-CE2 3.36Å; V55-F57 HydrophobicContact CG1-CG 3.94Å; V55-F57 HydrophobicContact CG1-CZ 4.2Å; V55-F57 PolarHBondContact O-N 3.03Å; F57-T59 WeakPolarHBondContact CD1-OG1 3.41Å; F57-T59 PolarHBondContact O-N 2.95Å | ||
| 58 | L | 43.7 | Very low | 44.2 | Very low | 162 Ų | 162 | 121 Ų | 121 | 85% | 0.848 | 74% | 0.739 | S | S | * | * | S | Bend | trans | -61.8 | 3.8 | 168.7 | -94.9 | 155.7 | 0 | 0 | 0 | 114 | L56 | L56-L58 PolarHBondContact O-N 3.09Å; L56-L58 VanDerWaalsContact O-N 3.09Å |
| 59 | T | 41.4 | Very low | 42.5 | Very low | 85 Ų | 85 | 125.8 Ų | 125.8 | 52% | 0.521 | 76% | 0.755 | S | S | . | * | S | Bend | trans | -124.5 | 96.3 | -175.3 | 62.5 | 0 | 0 | 0 | 0 | 108.9 | F57 T61 | F57-T59 WeakPolarHBondContact CD1-OG1 3.41Å; F57-T59 PolarHBondContact O-N 2.95Å; T59-T61 VanDerWaalsContact C-N 3.26Å; T59-T61 PolarHBondContact O-N 3.25Å |
| 60 | G | 43.1 | Very low | 41.2 | Very low | 95 Ų | 95 | 134.2 Ų | 134.2 | 98% | 0.979 | 78% | 0.78 | S | S | * | * | trans | -61.1 | 76.1 | -178.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 61 | T | 45.1 | Very low | 41 | Very low | 117 Ų | 117 | 137.7 Ų | 137.7 | 72% | 0.718 | 79% | 0.786 | S | S | * | * | trans | -124.8 | 118.3 | 166.7 | -171.5 | 0 | 0 | 0 | 0 | 108.9 | T59 A63 | T59-T61 VanDerWaalsContact C-N 3.26Å; T59-T61 PolarHBondContact O-N 3.25Å; T61-A63 PolarHBondContact O-N 3.14Å | ||
| 62 | W | 42.2 | Very low | 41 | Very low | 239 Ų | 239 | 139.2 Ų | 139.2 | 91% | 0.905 | 79% | 0.788 | S | S | * | * | trans | -85.3 | 92.8 | 177.6 | -170.5 | 83.2 | 0 | 0 | 0 | 108.1 | ||||
| 63 | A | 43 | Very low | 41.1 | Very low | 89 Ų | 89 | 138.3 Ų | 138.3 | 74% | 0.736 | 79% | 0.786 | S | S | * | * | trans | -102.3 | 85.4 | 161.1 | 0 | 0 | 0 | 0 | 0 | 107 | T61 | T61-A63 PolarHBondContact O-N 3.14Š| ||
| 64 | G | 43.9 | Very low | 41.1 | Very low | 37 Ų | 37 | 137.4 Ų | 137.4 | 38% | 0.381 | 78% | 0.777 | S | S | . | * | trans | -63.6 | 133.6 | 174.5 | 0 | 0 | 0 | 0 | 0 | 110.4 | Q66 | G64-Q66 PolarHBondContact O-N 2.73Å; G64-Q66 VanDerWaalsContact O-N 3.14Å | ||
| 65 | P | 42.9 | Very low | 41.1 | Very low | 134 Ų | 134 | 140.4 Ų | 140.4 | 87% | 0.87 | 78% | 0.78 | S | S | * | * | trans | -72.2 | 107.8 | 179.3 | 28.1 | -31.8 | 0 | 0 | 0 | 110.2 | ||||
| 66 | Q | 45.4 | Very low | 41.2 | Very low | 187 Ų | 187 | 143.3 Ų | 143.3 | 87% | 0.874 | 79% | 0.793 | S | S | * | * | trans | -71.6 | 124.1 | 148 | -85.7 | -172.8 | -95.2 | 0 | 0 | 107.9 | G64 | G64-Q66 PolarHBondContact O-N 2.73Å; G64-Q66 VanDerWaalsContact O-N 3.14Å | ||
| 67 | T | 44.1 | Very low | 41.7 | Very low | 120 Ų | 120 | 142.5 Ų | 142.5 | 74% | 0.736 | 79% | 0.791 | S | S | * | * | trans | 169 | 95 | 135.6 | -57.7 | 0 | 0 | 0 | 0 | 104.9 | ||||
| 68 | Q | 44.8 | Very low | 42.2 | Very low | 163 Ų | 163 | 141.4 Ų | 141.4 | 76% | 0.762 | 80% | 0.799 | S | S | * | * | 69.3 | 139.3 | 71.1 | -142.3 | -151.7 | -14.4 | 0 | 0 | 113.5 | |||||
| 69 | E | 34.2 | Very low | 42.1 | Very low | 156 Ų | 156 | 139.7 Ų | 139.7 | 73% | 0.729 | 80% | 0.795 | S | S | * | * | trans | 92.8 | 85 | 157.9 | -45.8 | -163.7 | 102.9 | 0 | 0 | 117.3 | ||||
| 70 | L | 35.3 | Very low | 42.2 | Very low | 254 Ų | 254 | 144.6 Ų | 144.6 | 100% | 1.33 | 82% | 0.82 | S | S | * | * | -148.4 | 0 | 101.3 | -84 | 176.2 | 0 | 0 | 0 | 109.8 |
Retrieved 70 of 70 residues in 13.7 ms
(Link to these results)