| 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 | 55 | Low | 78.2 | Confident | 160 Ų | 160 | 97.4 Ų | 97.4 | 79% | 0.788 | 58% | 0.577 | S | S | * | * | 0 | 117.8 | 0 | -72.3 | 171.8 | 174.7 | 0 | 0 | 107.4 | |||||
| 2 | A | 55.3 | Low | 79.6 | Confident | 107 Ų | 107 | 96.3 Ų | 96.3 | 88% | 0.884 | 56% | 0.562 | S | S | * | * | trans | -123.5 | 48.7 | -174.1 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 3 | D | 73.1 | Confident | 80.7 | Confident | 81 Ų | 81 | 92.2 Ų | 92.2 | 43% | 0.433 | 54% | 0.541 | S | S | . | . | P | Polyproline II helix | trans | -90.2 | 164.7 | -178.5 | -43.9 | -71.3 | 0 | 0 | 0 | 111.2 | L7 K9 | D3-L7 HydrophobicContact CB-CD1 3.72Å; D3-K9 HydrophobicContact CB-CD 4.23Å; D3-K9 PolarHBondContact O-NZ 3.32Å |
| 4 | E | 74.1 | Confident | 81.8 | Confident | 158 Ų | 158 | 85.8 Ų | 85.8 | 74% | 0.738 | 50% | 0.503 | S | S | * | . | P | Polyproline II helix | trans | -53.5 | 147.9 | 176 | -72.7 | -172.7 | 143.6 | 0 | 0 | 113 | L7 K9 | E4-L7 HydrophobicContact CB-CD1 3.9Å; E4-L7 HydrophobicContact CB-CG 4.43Å; E4-K9 VanDerWaalsContact C-NZ 3.26Å; E4-K9 PolarHBondContact O-NZ 3.12Å |
| 5 | M | 75 | Confident | 82.7 | Confident | 185 Ų | 185 | 84.8 Ų | 84.8 | 91% | 0.911 | 50% | 0.499 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.8 | 139.8 | 173.1 | -64.8 | -179.2 | 122 | 0 | 0 | 109.9 | ||
| 6 | G | 78.1 | Confident | 83.5 | Confident | 83 Ų | 83 | 85.6 Ų | 85.6 | 86% | 0.856 | 50% | 0.5 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 98.8 | -11.6 | -179.5 | 0 | 0 | 0 | 0 | 0 | 115.9 | G8 | G6-G8 PolarHBondContact O-N 2.64Å; G6-G8 VanDerWaalsContact O-N 3.14Å |
| 7 | L | 84.6 | Confident | 84.2 | Confident | 100 Ų | 100 | 82.8 Ų | 82.8 | 52% | 0.524 | 48% | 0.481 | S | S | . | . | S | Bend | trans | -78.2 | 10.6 | 179.8 | -67 | 170.9 | 0 | 0 | 0 | 115.4 | D3 E4 | D3-L7 HydrophobicContact CB-CD1 3.72Å; E4-L7 HydrophobicContact CB-CD1 3.9Å; E4-L7 HydrophobicContact CB-CG 4.43Å |
| 8 | G | 87.8 | Confident | 84.8 | Confident | 37 Ų | 37 | 81.7 Ų | 81.7 | 38% | 0.381 | 47% | 0.468 | S | S | . | . | trans | 73.5 | 27.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 115.2 | G6 T10 L11 Q12 | G6-G8 PolarHBondContact O-N 2.64Å; G6-G8 VanDerWaalsContact O-N 3.14Å; G8-T10 PolarHBondContact O-N 3.13Å; G8-T10 VanDerWaalsContact O-N 3.15Å; G8-L11 WeakPolarHBondContact O-CB 3.45Å; G8-L11 PolarHBondContact O-N 2.81Å; G8-Q12 PolarHBondContact O-N 2.55Å | ||
| 9 | K | 90.8 | Very high | 85.4 | Confident | 55 Ų | 55 | 80.3 Ų | 80.3 | 24% | 0.239 | 46% | 0.461 | C | S | . | . | H | α-helix | trans | -51.5 | -37.2 | 177.1 | -65.6 | -173.5 | -70.2 | -85.8 | 0 | 113.6 | D3 E4 L11 Q12 C13 | D3-K9 HydrophobicContact CB-CD 4.23Å; D3-K9 PolarHBondContact O-NZ 3.32Å; E4-K9 VanDerWaalsContact C-NZ 3.26Å; E4-K9 PolarHBondContact O-NZ 3.12Å; K9-L11 PolarHBondContact O-N 3.2Å; K9-Q12 PolarHBondContact O-N 3.02Å; K9-C13 PolarHBondContact O-N 3.09Å; K9-C13 PolarHBondContact O-SG 3.28Å |
| 10 | T | 92.3 | Very high | 85.9 | Confident | 47 Ų | 47 | 79.1 Ų | 79.1 | 29% | 0.288 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -59.5 | -46.8 | 175.8 | -48.7 | 0 | 0 | 0 | 0 | 111.4 | G8 C13 I14 W46 E49 | G8-T10 PolarHBondContact O-N 3.13Å; G8-T10 VanDerWaalsContact O-N 3.15Å; T10-C13 PolarHBondContact O-N 3.35Å; T10-I14 HydrophobicContact CG2-CD1 4Å; T10-I14 VanDerWaalsContact O-CG1 3.28Å; T10-I14 WeakPolarHBondContact O-CG1 2.98Å; T10-I14 PolarHBondContact O-N 3.24Å; T10-W46 HydrophobicContact CG2-CD2 4.03Å; T10-W46 HydrophobicContact CG2-CE3 3.8Å; T10-W46 HydrophobicContact CG2-CH2 3.95Å; T10-W46 HydrophobicContact CG2-CZ2 4.15Å; T10-W46 HydrophobicContact CG2-CZ3 3.76Å; T10-E49 HydrophobicContact CG2-CB 3.94Å; T10-E49 HydrophobicContact CG2-CG 4.11Å |
| 11 | L | 94.2 | Very high | 86.4 | Confident | 58 Ų | 58 | 76.9 Ų | 76.9 | 30% | 0.304 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -64.5 | -40.8 | 177 | 175.8 | 58.7 | 0 | 0 | 0 | 111.5 | G8 K9 C13 I14 T15 W53 | G8-L11 WeakPolarHBondContact O-CB 3.45Å; G8-L11 PolarHBondContact O-N 2.81Å; K9-L11 PolarHBondContact O-N 3.2Å; L11-C13 VanDerWaalsContact C-N 3.34Å; L11-C13 PolarHBondContact O-N 3.49Å; L11-I14 PolarHBondContact O-N 3.12Å; L11-T15 WeakPolarHBondContact O-CB 2.96Å; L11-T15 PolarHBondContact O-N 3.38Å; L11-T15 PolarHBondContact O-OG1 3.48Å; L11-W53 HydrophobicContact CD1-CB 4.23Å; L11-W53 HydrophobicContact CD1-CD2 3.61Å; L11-W53 HydrophobicContact CD1-CE3 4.12Å; L11-W53 HydrophobicContact CD1-CG 3.64Å; L11-W53 HydrophobicContact CD1-CZ2 4.47Å; L11-W53 HydrophobicContact CD2-CD2 4.46Å; L11-W53 HydrophobicContact CD2-CH2 4.1Å; L11-W53 HydrophobicContact CD2-CZ2 3.94Å; L11-W53 HydrophobicContact CD2-CZ3 4.43Å |
| 12 | Q | 94.7 | Very high | 88.3 | Confident | 84 Ų | 84 | 76.7 Ų | 76.7 | 39% | 0.393 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -59.3 | -45.5 | 175.7 | -66.3 | 174.8 | -2.9 | 0 | 0 | 111.3 | G8 K9 T15 L16 | G8-Q12 PolarHBondContact O-N 2.55Å; K9-Q12 PolarHBondContact O-N 3.02Å; Q12-T15 PolarHBondContact O-N 3.21Å; Q12-L16 PolarHBondContact O-N 3.37Å |
| 13 | C | 94.9 | Very high | 90.2 | Very high | 44 Ų | 44 | 77.2 Ų | 77.2 | 30% | 0.297 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -63.5 | -44.3 | 174.8 | -71.3 | 0 | 0 | 0 | 0 | 112.5 | K9 T10 L11 T15 L16 M17 W46 | K9-C13 PolarHBondContact O-N 3.09Å; K9-C13 PolarHBondContact O-SG 3.28Å; T10-C13 PolarHBondContact O-N 3.35Å; L11-C13 VanDerWaalsContact C-N 3.34Å; L11-C13 PolarHBondContact O-N 3.49Å; C13-T15 VanDerWaalsContact C-N 3.27Å; C13-T15 PolarHBondContact O-N 2.93Å; C13-L16 PolarHBondContact O-N 2.75Å; C13-M17 WeakPolarHBondContact O-CG 3.42Å; C13-M17 PolarHBondContact O-N 2.99Å; C13-W46 HydrophobicContact CB-CH2 3.73Å; C13-W46 HydrophobicContact CB-CZ3 4.15Å |
| 14 | I | 95.1 | Very high | 91.3 | Very high | 2 Ų | 2 | 74.2 Ų | 74.2 | 1% | 0.01 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -59.9 | -41 | 176.8 | -70.2 | 168.1 | 0 | 0 | 0 | 110.9 | T10 L11 M17 W18 W46 E49 V50 W53 L54 | T10-I14 HydrophobicContact CG2-CD1 4Å; T10-I14 VanDerWaalsContact O-CG1 3.28Å; T10-I14 WeakPolarHBondContact O-CG1 2.98Å; T10-I14 PolarHBondContact O-N 3.24Å; L11-I14 PolarHBondContact O-N 3.12Å; I14-M17 HydrophobicContact CB-CE 4.44Å; I14-M17 HydrophobicContact CG1-CE 4.01Å; I14-M17 PolarHBondContact O-N 3.26Å; I14-W18 WeakPolarHBondContact O-CB 3.4Å; I14-W18 PolarHBondContact O-N 2.93Å; I14-W46 HydrophobicContact CG1-CZ3 4.15Å; I14-E49 HydrophobicContact CD1-CB 3.84Å; I14-V50 HydrophobicContact CD1-CG2 3.99Å; I14-V50 HydrophobicContact CG1-CG2 4.07Å; I14-W53 HydrophobicContact CG2-CB 4.49Å; I14-L54 HydrophobicContact CG2-CD1 3.71Å; I14-L54 HydrophobicContact CG2-CD2 4.27Å; I14-L54 HydrophobicContact CG2-CG 3.8Å |
| 15 | T | 95.4 | Very high | 92.3 | Very high | 71 Ų | 71 | 72.8 Ų | 72.8 | 44% | 0.436 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -64.2 | -46.2 | 178.6 | -55.6 | 0 | 0 | 0 | 0 | 110.7 | L11 Q12 C13 W18 T19 | L11-T15 WeakPolarHBondContact O-CB 2.96Å; L11-T15 PolarHBondContact O-N 3.38Å; L11-T15 PolarHBondContact O-OG1 3.48Å; Q12-T15 PolarHBondContact O-N 3.21Å; C13-T15 VanDerWaalsContact C-N 3.27Å; C13-T15 PolarHBondContact O-N 2.93Å; T15-W18 PolarHBondContact O-N 3.34Å; T15-T19 PolarHBondContact O-N 3.43Å; T15-T19 PolarHBondContact O-OG1 2.9Å |
| 16 | L | 95.6 | Very high | 93.3 | Very high | 98 Ų | 98 | 70.6 Ų | 70.6 | 51% | 0.513 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -60 | -48.4 | 176.1 | 178.5 | 63 | 0 | 0 | 0 | 111.7 | Q12 C13 W18 T19 L20 | Q12-L16 PolarHBondContact O-N 3.37Å; C13-L16 PolarHBondContact O-N 2.75Å; L16-W18 VanDerWaalsContact C-N 3.33Å; L16-W18 PolarHBondContact O-N 2.91Å; L16-T19 PolarHBondContact O-N 3.42Å; L16-L20 HydrophobicContact CD1-CD1 4.11Å; L16-L20 HydrophobicContact CD1-CG 4.25Å; L16-L20 HydrophobicContact CG-CD1 4.08Å; L16-L20 WeakPolarHBondContact O-CG 3.24Å; L16-L20 PolarHBondContact O-N 2.92Å |
| 17 | M | 95.3 | Very high | 94 | Very high | 37 Ų | 37 | 72.8 Ų | 72.8 | 18% | 0.182 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -58.6 | -45.6 | 177.6 | -71.4 | -174.2 | -65.2 | 0 | 0 | 111.5 | C13 I14 T19 L20 L21 A34 V36 W46 | C13-M17 WeakPolarHBondContact O-CG 3.42Å; C13-M17 PolarHBondContact O-N 2.99Å; I14-M17 HydrophobicContact CB-CE 4.44Å; I14-M17 HydrophobicContact CG1-CE 4.01Å; I14-M17 PolarHBondContact O-N 3.26Å; M17-T19 PolarHBondContact O-N 3.29Å; M17-L20 PolarHBondContact O-N 3.01Å; M17-L21 WeakPolarHBondContact O-CB 3.48Å; M17-L21 WeakPolarHBondContact O-CD1 3.47Å; M17-L21 VanDerWaalsContact O-CG 3.24Å; M17-L21 WeakPolarHBondContact O-CG 3.13Å; M17-L21 PolarHBondContact O-N 3.15Å; M17-A34 HydrophobicContact CB-CB 4.49Å; M17-A34 HydrophobicContact CG-CB 4.17Å; M17-A34 HydrophobicContact SD-CB 3.95Å; M17-V36 HydrophobicContact CE-CG2 3.75Å; M17-V36 HydrophobicContact SD-CG2 3.41Å; M17-V36 WeakPolarHBondContact SD-CG2 3.5Å; M17-W46 HydrophobicContact CE-CZ3 4.13Å |
| 18 | W | 95.7 | Very high | 94.5 | Very high | 63 Ų | 63 | 73.2 Ų | 73.2 | 24% | 0.239 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -61.1 | -43.7 | 177.5 | 174.9 | -103.2 | 0 | 0 | 0 | 112.3 | I14 T15 L16 L21 R22 L54 R57 I58 | I14-W18 WeakPolarHBondContact O-CB 3.4Å; I14-W18 PolarHBondContact O-N 2.93Å; T15-W18 PolarHBondContact O-N 3.34Å; L16-W18 VanDerWaalsContact C-N 3.33Å; L16-W18 PolarHBondContact O-N 2.91Å; W18-L21 PolarHBondContact O-N 3.28Å; W18-R22 HydrophobicContact CD2-CG 3.92Å; W18-R22 HydrophobicContact CE3-CG 4Å; W18-R22 HydrophobicContact CH2-CG 3.79Å; W18-R22 HydrophobicContact CZ2-CG 3.73Å; W18-R22 HydrophobicContact CZ3-CG 3.93Å; W18-R22 WeakPolarHBondContact O-CB 3.47Å; W18-R22 VanDerWaalsContact O-CG 3.29Å; W18-R22 WeakPolarHBondContact O-CG 3.34Å; W18-R22 PolarHBondContact O-N 3.4Å; W18-L54 HydrophobicContact CB-CD1 4.32Å; W18-L54 HydrophobicContact CB-CD2 4.14Å; W18-L54 HydrophobicContact CD2-CD2 3.98Å; W18-L54 HydrophobicContact CE3-CD1 4.09Å; W18-L54 HydrophobicContact CE3-CD2 4.12Å; W18-L54 HydrophobicContact CG-CD2 3.98Å; W18-R57 HydrophobicContact CH2-CB 3.72Å; W18-R57 HydrophobicContact CH2-CG 4.31Å; W18-R57 HydrophobicContact CZ3-CB 3.78Å; W18-I58 HydrophobicContact CE3-CD1 3.55Å; W18-I58 HydrophobicContact CE3-CG1 3.77Å; W18-I58 HydrophobicContact CZ3-CD1 3.91Å; W18-I58 HydrophobicContact CZ3-CG1 3.62Å |
| 19 | T | 96.1 | Very high | 94.9 | Very high | 55 Ų | 55 | 74.5 Ų | 74.5 | 34% | 0.337 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -59.8 | -49.9 | 176.4 | -64.5 | 0 | 0 | 0 | 0 | 110.5 | T15 L16 M17 L21 R22 Q23 | T15-T19 PolarHBondContact O-N 3.43Å; T15-T19 PolarHBondContact O-OG1 2.9Å; L16-T19 PolarHBondContact O-N 3.42Å; M17-T19 PolarHBondContact O-N 3.29Å; T19-L21 VanDerWaalsContact C-N 3.32Å; T19-L21 PolarHBondContact O-N 3.43Å; T19-R22 PolarHBondContact O-N 3.32Å; T19-R22 VanDerWaalsContact O-N 3.12Å; T19-Q23 HydrophobicContact CG2-CB 4.32Å; T19-Q23 WeakPolarHBondContact O-CA 3.37Å; T19-Q23 WeakPolarHBondContact O-CB 3.44Å; T19-Q23 PolarHBondContact O-N 3.46Å; T19-Q23 VanDerWaalsContact O-O 3.1Å |
| 20 | L | 96.1 | Very high | 95.2 | Very high | 57 Ų | 57 | 77.1 Ų | 77.1 | 30% | 0.298 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -63.9 | -36.4 | -179.6 | -63.9 | 171.8 | 0 | 0 | 0 | 112.5 | L16 M17 R22 E30 I31 | L16-L20 HydrophobicContact CD1-CD1 4.11Å; L16-L20 HydrophobicContact CD1-CG 4.25Å; L16-L20 HydrophobicContact CG-CD1 4.08Å; L16-L20 WeakPolarHBondContact O-CG 3.24Å; L16-L20 PolarHBondContact O-N 2.92Å; M17-L20 PolarHBondContact O-N 3.01Å; L20-R22 PolarHBondContact O-N 2.93Å; L20-E30 HydrophobicContact CB-CB 4.31Å; L20-E30 HydrophobicContact CD2-CB 3.98Å; L20-E30 HydrophobicContact CD2-CG 3.88Å; L20-E30 WeakPolarHBondContact O-CA 3.36Å; L20-E30 WeakPolarHBondContact O-CB 3.28Å; L20-E30 PolarHBondContact O-N 3.46Å; L20-I31 HydrophobicContact CB-CD1 3.76Å; L20-I31 HydrophobicContact CB-CG1 3.81Å; L20-I31 HydrophobicContact CD1-CD1 4.31Å; L20-I31 PolarHBondContact O-N 3.21Å; L20-I31 VanDerWaalsContact O-N 3.13Å |
| 21 | L | 95.5 | Very high | 95.4 | Very high | 33 Ų | 33 | 77.3 Ų | 77.3 | 17% | 0.173 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -71.2 | -12.4 | 177.8 | -73.9 | 165.4 | 0 | 0 | 0 | 113.8 | M17 W18 T19 P29 I31 D32 I58 | M17-L21 WeakPolarHBondContact O-CB 3.48Å; M17-L21 WeakPolarHBondContact O-CD1 3.47Å; M17-L21 VanDerWaalsContact O-CG 3.24Å; M17-L21 WeakPolarHBondContact O-CG 3.13Å; M17-L21 PolarHBondContact O-N 3.15Å; W18-L21 PolarHBondContact O-N 3.28Å; T19-L21 VanDerWaalsContact C-N 3.32Å; T19-L21 PolarHBondContact O-N 3.43Å; L21-P29 WeakPolarHBondContact O-CB 3.41Å; L21-I31 HydrophobicContact CD2-CD1 4.35Å; L21-I31 HydrophobicContact CD2-CG1 3.85Å; L21-I31 HydrophobicContact CG-CD1 4.29Å; L21-I31 HydrophobicContact CG-CG1 4.04Å; L21-D32 WeakPolarHBondContact CD2-O 3.39Å; L21-I58 HydrophobicContact CD1-CD1 3.49Å; L21-I58 VanDerWaalsContact CD1-CD1 3.49Å |
| 22 | R | 94.8 | Very high | 95.4 | Very high | 155 Ų | 155 | 81.5 Ų | 81.5 | 59% | 0.585 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -129.4 | -23.4 | -170.6 | -62.7 | -60.6 | -59.2 | -179.2 | 0.4 | 114.5 | W18 T19 L20 | W18-R22 HydrophobicContact CD2-CG 3.92Å; W18-R22 HydrophobicContact CE3-CG 4Å; W18-R22 HydrophobicContact CH2-CG 3.79Å; W18-R22 HydrophobicContact CZ2-CG 3.73Å; W18-R22 HydrophobicContact CZ3-CG 3.93Å; W18-R22 WeakPolarHBondContact O-CB 3.47Å; W18-R22 VanDerWaalsContact O-CG 3.29Å; W18-R22 WeakPolarHBondContact O-CG 3.34Å; W18-R22 PolarHBondContact O-N 3.4Å; T19-R22 PolarHBondContact O-N 3.32Å; T19-R22 VanDerWaalsContact O-N 3.12Å; L20-R22 PolarHBondContact O-N 2.93Å |
| 23 | Q | 95.2 | Very high | 95.3 | Very high | 118 Ų | 118 | 86.4 Ų | 86.4 | 55% | 0.551 | 45% | 0.446 | S | S | * | . | trans | -139.9 | 142 | -168.3 | -58.2 | -178.1 | 20.7 | 0 | 0 | 110.3 | T19 K28 | T19-Q23 HydrophobicContact CG2-CB 4.32Å; T19-Q23 WeakPolarHBondContact O-CA 3.37Å; T19-Q23 WeakPolarHBondContact O-CB 3.44Å; T19-Q23 PolarHBondContact O-N 3.46Å; T19-Q23 VanDerWaalsContact O-O 3.1Å; Q23-K28 CarbonylContact C-O 3.34Å | ||
| 24 | S | 96.2 | Very high | 95.2 | Very high | 19 Ų | 19 | 86.5 Ų | 86.5 | 13% | 0.133 | 45% | 0.45 | C | S | . | . | trans | -149.5 | 165.7 | 167.7 | 64.2 | 0 | 0 | 0 | 0 | 107.9 | E26 C27 K28 E30 | S24-E26 PolarHBondContact O-N 3.35Å; S24-E26 VanDerWaalsContact O-N 3.12Å; S24-E26 PolarHBondContact OG-N 2.85Å; S24-C27 PolarHBondContact O-N 2.72Å; S24-C27 VanDerWaalsContact O-N 3.09Å; S24-K28 WeakPolarHBondContact CB-O 3.29Å; S24-K28 PolarHBondContact N-O 3.28Å; S24-K28 WeakPolarHBondContact OG-CG 3.38Å; S24-K28 PolarHBondContact OG-N 2.71Å; S24-K28 PolarHBondContact OG-O 3.05Å; S24-E30 WeakPolarHBondContact CB-OE2 3.38Å | ||
| 25 | P | 95.9 | Very high | 95.2 | Very high | 128 Ų | 128 | 92.6 Ų | 92.6 | 83% | 0.831 | 49% | 0.487 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.3 | -23.8 | 171 | -25.1 | 35.8 | 0 | 0 | 0 | 113.8 | C27 | P25-C27 VanDerWaalsContact C-N 3.32Š|
| 26 | E | 95.9 | Very high | 95.1 | Very high | 138 Ų | 138 | 92.2 Ų | 92.2 | 65% | 0.645 | 48% | 0.484 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.4 | 13.7 | 179.9 | -63.3 | -175.8 | -163.9 | 0 | 0 | 113.3 | S24 K28 | S24-E26 PolarHBondContact O-N 3.35Å; S24-E26 VanDerWaalsContact O-N 3.12Å; S24-E26 PolarHBondContact OG-N 2.85Å; E26-K28 HydrophobicContact CB-CD 4.38Å; E26-K28 HydrophobicContact CB-CG 4.13Å; E26-K28 PolarHBondContact O-N 2.75Å; E26-K28 WeakPolarHBondContact OE2-CE 3.46Å; E26-K28 IonicContact OE2-NZ 2.64Å; E26-K28 PolarHBondContact OE2-NZ 3.49Å |
| 27 | C | 93 | Very high | 94.9 | Very high | 129 Ų | 129 | 94.1 Ų | 94.1 | 87% | 0.872 | 50% | 0.5 | S | S | * | . | S | Bend | trans | 58 | 27.6 | -179.6 | -66.5 | 0 | 0 | 0 | 0 | 114.7 | S24 P25 | S24-C27 PolarHBondContact O-N 2.72Å; S24-C27 VanDerWaalsContact O-N 3.09Å; P25-C27 VanDerWaalsContact C-N 3.32Å |
| 28 | K | 94.9 | Very high | 94.8 | Very high | 110 Ų | 110 | 93.8 Ų | 93.8 | 48% | 0.478 | 50% | 0.501 | S | S | . | . | S | Bend | trans | -127.9 | 167.2 | 172.9 | 62.7 | -178.4 | -179.2 | -166.3 | 0 | 110.9 | Q23 S24 E26 E30 | Q23-K28 CarbonylContact C-O 3.34Å; S24-K28 WeakPolarHBondContact CB-O 3.29Å; S24-K28 PolarHBondContact N-O 3.28Å; S24-K28 WeakPolarHBondContact OG-CG 3.38Å; S24-K28 PolarHBondContact OG-N 2.71Å; S24-K28 PolarHBondContact OG-O 3.05Å; E26-K28 HydrophobicContact CB-CD 4.38Å; E26-K28 HydrophobicContact CB-CG 4.13Å; E26-K28 PolarHBondContact O-N 2.75Å; E26-K28 WeakPolarHBondContact OE2-CE 3.46Å; E26-K28 IonicContact OE2-NZ 2.64Å; E26-K28 PolarHBondContact OE2-NZ 3.49Å; K28-E30 PolarHBondContact O-N 3.4Å |
| 29 | P | 96 | Very high | 94.6 | Very high | 63 Ų | 63 | 94.7 Ų | 94.7 | 41% | 0.409 | 52% | 0.515 | S | S | . | . | trans | -56.3 | 136.9 | 166.8 | -26 | 37 | 0 | 0 | 0 | 111.4 | L21 | L21-P29 WeakPolarHBondContact O-CB 3.41Š| ||
| 30 | E | 97 | Very high | 94.3 | Very high | 111 Ų | 111 | 95.4 Ų | 95.4 | 52% | 0.519 | 52% | 0.522 | S | S | . | . | S | Bend | trans | -75.3 | -36.7 | 172.9 | -168.5 | 68.7 | -149.8 | 0 | 0 | 110.9 | L20 S24 K28 | L20-E30 HydrophobicContact CB-CB 4.31Å; L20-E30 HydrophobicContact CD2-CB 3.98Å; L20-E30 HydrophobicContact CD2-CG 3.88Å; L20-E30 WeakPolarHBondContact O-CA 3.36Å; L20-E30 WeakPolarHBondContact O-CB 3.28Å; L20-E30 PolarHBondContact O-N 3.46Å; S24-E30 WeakPolarHBondContact CB-OE2 3.38Å; K28-E30 PolarHBondContact O-N 3.4Å |
| 31 | I | 96.1 | Very high | 94 | Very high | 51 Ų | 51 | 97.4 Ų | 97.4 | 26% | 0.262 | 54% | 0.541 | S | S | . | . | trans | -132.3 | 153.8 | 176 | 70.3 | -178.6 | 0 | 0 | 0 | 110.5 | L20 L21 A34 | L20-I31 HydrophobicContact CB-CD1 3.76Å; L20-I31 HydrophobicContact CB-CG1 3.81Å; L20-I31 HydrophobicContact CD1-CD1 4.31Å; L20-I31 PolarHBondContact O-N 3.21Å; L20-I31 VanDerWaalsContact O-N 3.13Å; L21-I31 HydrophobicContact CD2-CD1 4.35Å; L21-I31 HydrophobicContact CD2-CG1 3.85Å; L21-I31 HydrophobicContact CG-CD1 4.29Å; L21-I31 HydrophobicContact CG-CG1 4.04Å; I31-A34 HydrophobicContact CD1-CB 4.07Å | ||
| 32 | D | 93.8 | Very high | 93.8 | Very high | 146 Ų | 146 | 99.1 Ų | 99.1 | 78% | 0.781 | 55% | 0.55 | S | S | * | . | S | Bend | trans | -95.3 | -28.7 | 175.8 | -63.3 | -47.2 | 0 | 0 | 0 | 113.2 | L21 | L21-D32 WeakPolarHBondContact CD2-O 3.39Š|
| 33 | K | 92.5 | Very high | 93.7 | Very high | 187 Ų | 187 | 92.8 Ų | 92.8 | 81% | 0.813 | 53% | 0.528 | S | S | * | . | trans | -141.6 | 143.7 | -176 | -62.9 | -175.4 | -176.7 | -179.9 | 0 | 110.5 | ||||
| 34 | A | 93.8 | Very high | 93.5 | Very high | 46 Ų | 46 | 94.2 Ų | 94.2 | 38% | 0.38 | 53% | 0.533 | S | S | . | . | trans | -124.6 | 141 | 174.5 | 0 | 0 | 0 | 0 | 0 | 109.9 | M17 I31 | M17-A34 HydrophobicContact CB-CB 4.49Å; M17-A34 HydrophobicContact CG-CB 4.17Å; M17-A34 HydrophobicContact SD-CB 3.95Å; I31-A34 HydrophobicContact CD1-CB 4.07Å | ||
| 35 | V | 94.1 | Very high | 93.4 | Very high | 130 Ų | 130 | 97.7 Ų | 97.7 | 79% | 0.788 | 55% | 0.55 | S | S | * | . | trans | -122.7 | 127.3 | 176.8 | 179.1 | 0 | 0 | 0 | 0 | 108.7 | V37 | V35-V37 HydrophobicContact CG1-CG2 4.36Š| ||
| 36 | V | 92.8 | Very high | 93.3 | Very high | 62 Ų | 62 | 93.9 Ų | 93.9 | 38% | 0.376 | 52% | 0.519 | S | S | . | . | trans | -108.5 | 116.7 | 174 | -179.3 | 0 | 0 | 0 | 0 | 108.5 | M17 W46 | M17-V36 HydrophobicContact CE-CG2 3.75Å; M17-V36 HydrophobicContact SD-CG2 3.41Å; M17-V36 WeakPolarHBondContact SD-CG2 3.5Å; V36-W46 HydrophobicContact CG1-CD2 3.83Å; V36-W46 HydrophobicContact CG1-CE3 3.95Å; V36-W46 HydrophobicContact CG1-CG 4.42Å; V36-W46 HydrophobicContact CG1-CH2 4.03Å; V36-W46 HydrophobicContact CG1-CZ2 3.93Å; V36-W46 HydrophobicContact CG1-CZ3 4.05Å; V36-W46 HydrophobicContact CG2-CE3 4.4Å; V36-W46 HydrophobicContact CG2-CZ3 4.26Å | ||
| 37 | V | 92.9 | Very high | 93.2 | Very high | 139 Ų | 139 | 92.7 Ų | 92.7 | 84% | 0.842 | 51% | 0.509 | S | S | * | . | trans | -92.9 | 126.6 | 172.8 | -176.8 | 0 | 0 | 0 | 0 | 108.3 | V35 | V35-V37 HydrophobicContact CG1-CG2 4.36Š| ||
| 38 | S | 91.4 | Very high | 93.3 | Very high | 30 Ų | 30 | 91.3 Ų | 91.3 | 21% | 0.21 | 49% | 0.493 | C | S | . | . | trans | -144.3 | 161.1 | 177.6 | 71 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 39 | P | 92.8 | Very high | 93.3 | Very high | 82 Ų | 82 | 88.5 Ų | 88.5 | 53% | 0.532 | 48% | 0.482 | S | S | . | . | trans | -52.4 | 141.9 | 167.1 | -24.7 | 33.4 | 0 | 0 | 0 | 111.3 | S41 L42 V43 | P39-S41 PolarHBondContact O-N 3.46Å; P39-S41 VanDerWaalsContact O-N 3.12Å; P39-L42 HydrophobicContact CG-CD1 4.25Å; P39-L42 PolarHBondContact O-N 3.11Å; P39-V43 PolarHBondContact O-N 3.49Å | ||
| 40 | S | 89.1 | Confident | 93.2 | Very high | 70 Ų | 70 | 86.2 Ų | 86.2 | 49% | 0.49 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -45.4 | -45.8 | 179.8 | 163.5 | 0 | 0 | 0 | 0 | 112.9 | L42 V43 D64 | S40-L42 PolarHBondContact O-N 3.15Å; S40-V43 PolarHBondContact O-N 3.19Å; S40-V43 VanDerWaalsContact O-N 3.12Å; S40-D64 WeakPolarHBondContact CA-OD1 3.43Å; S40-D64 WeakPolarHBondContact CB-OD1 3.32Å; S40-D64 VanDerWaalsContact OG-CG 3.22Å; S40-D64 PolarHBondContact OG-OD1 3.12Å; S40-D64 PolarHBondContact OG-OD2 3.29Å |
| 41 | S | 89.4 | Confident | 93.1 | Very high | 98 Ų | 98 | 82.7 Ų | 82.7 | 69% | 0.685 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -60.5 | -17 | 179.1 | 57.7 | 0 | 0 | 0 | 0 | 115.2 | P39 | P39-S41 PolarHBondContact O-N 3.46Å; P39-S41 VanDerWaalsContact O-N 3.12Å |
| 42 | L | 92.2 | Very high | 93 | Very high | 70 Ų | 70 | 86.6 Ų | 86.6 | 37% | 0.366 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -105.6 | -8.5 | -178.7 | -62.7 | 179.8 | 0 | 0 | 0 | 113.6 | P39 S40 K44 N45 W46 | P39-L42 HydrophobicContact CG-CD1 4.25Å; P39-L42 PolarHBondContact O-N 3.11Å; S40-L42 PolarHBondContact O-N 3.15Å; L42-K44 VanDerWaalsContact C-N 3.33Å; L42-K44 PolarHBondContact O-N 2.97Å; L42-N45 WeakPolarHBondContact O-CB 3.22Å; L42-N45 PolarHBondContact O-N 3.45Å; L42-W46 PolarHBondContact O-N 3.23Å |
| 43 | V | 92.8 | Very high | 93.1 | Very high | 21 Ų | 21 | 85 Ų | 85 | 13% | 0.127 | 46% | 0.458 | C | S | . | . | H | α-helix | trans | -58.2 | -46 | -177.1 | 175.1 | 0 | 0 | 0 | 0 | 111.2 | P39 S40 N45 W46 Y47 A62 D64 | P39-V43 PolarHBondContact O-N 3.49Å; S40-V43 PolarHBondContact O-N 3.19Å; S40-V43 VanDerWaalsContact O-N 3.12Å; V43-N45 VanDerWaalsContact C-N 3.32Å; V43-N45 PolarHBondContact O-N 3.03Å; V43-W46 PolarHBondContact O-N 3.28Å; V43-Y47 PolarHBondContact O-N 3.21Å; V43-A62 HydrophobicContact CG1-CB 3.92Å; V43-D64 HydrophobicContact CB-CB 4.12Å; V43-D64 HydrophobicContact CG1-CB 4.07Å; V43-D64 HydrophobicContact CG2-CB 4.19Å |
| 44 | K | 91.6 | Very high | 93.1 | Very high | 149 Ų | 149 | 76.9 Ų | 76.9 | 65% | 0.648 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -64.4 | -35 | 176.8 | -69.6 | -177.3 | 180 | 176 | 0 | 112.8 | L42 Y47 N48 | L42-K44 VanDerWaalsContact C-N 3.33Å; L42-K44 PolarHBondContact O-N 2.97Å; K44-Y47 PolarHBondContact O-N 3.49Å; K44-N48 VanDerWaalsContact O-CG 3.27Å; K44-N48 PolarHBondContact O-N 3.27Å; K44-N48 PolarHBondContact O-ND2 3.36Å |
| 45 | N | 93.6 | Very high | 93 | Very high | 91 Ų | 91 | 76.4 Ų | 76.4 | 49% | 0.487 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -66.2 | -41.6 | 177.4 | -68.7 | -3.7 | 0 | 0 | 0 | 110.9 | L42 V43 N48 E49 | L42-N45 WeakPolarHBondContact O-CB 3.22Å; L42-N45 PolarHBondContact O-N 3.45Å; V43-N45 VanDerWaalsContact C-N 3.32Å; V43-N45 PolarHBondContact O-N 3.03Å; N45-N48 PolarHBondContact O-N 3.38Å; N45-E49 WeakPolarHBondContact O-CB 3.08Å; N45-E49 WeakPolarHBondContact O-CG 3.46Å; N45-E49 PolarHBondContact O-N 2.95Å |
| 46 | W | 94.5 | Very high | 92.6 | Very high | 49 Ų | 49 | 74 Ų | 74 | 19% | 0.186 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -62.3 | -46 | 173.5 | -85.9 | 96.8 | 0 | 0 | 0 | 112.4 | T10 C13 I14 M17 V36 L42 V43 N48 E49 V50 | T10-W46 HydrophobicContact CG2-CD2 4.03Å; T10-W46 HydrophobicContact CG2-CE3 3.8Å; T10-W46 HydrophobicContact CG2-CH2 3.95Å; T10-W46 HydrophobicContact CG2-CZ2 4.15Å; T10-W46 HydrophobicContact CG2-CZ3 3.76Å; C13-W46 HydrophobicContact CB-CH2 3.73Å; C13-W46 HydrophobicContact CB-CZ3 4.15Å; I14-W46 HydrophobicContact CG1-CZ3 4.15Å; M17-W46 HydrophobicContact CE-CZ3 4.13Å; V36-W46 HydrophobicContact CG1-CD2 3.83Å; V36-W46 HydrophobicContact CG1-CE3 3.95Å; V36-W46 HydrophobicContact CG1-CG 4.42Å; V36-W46 HydrophobicContact CG1-CH2 4.03Å; V36-W46 HydrophobicContact CG1-CZ2 3.93Å; V36-W46 HydrophobicContact CG1-CZ3 4.05Å; V36-W46 HydrophobicContact CG2-CE3 4.4Å; V36-W46 HydrophobicContact CG2-CZ3 4.26Å; L42-W46 PolarHBondContact O-N 3.23Å; V43-W46 PolarHBondContact O-N 3.28Å; W46-N48 VanDerWaalsContact C-N 3.31Å; W46-N48 PolarHBondContact O-N 3.05Å; W46-E49 PolarHBondContact O-N 2.84Å; W46-V50 WeakPolarHBondContact O-CG2 3.2Å; W46-V50 PolarHBondContact O-N 3.12Å |
| 47 | Y | 93.4 | Very high | 92.5 | Very high | 113 Ų | 113 | 79.3 Ų | 79.3 | 44% | 0.443 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -55.6 | -46.7 | 176.3 | -176.8 | -88 | 0 | 0 | 0 | 111.7 | V43 K44 V50 G51 P60 A62 | V43-Y47 PolarHBondContact O-N 3.21Å; K44-Y47 PolarHBondContact O-N 3.49Å; Y47-V50 PolarHBondContact O-N 2.89Å; Y47-G51 PolarHBondContact O-N 2.71Å; Y47-G51 VanDerWaalsContact O-N 3.08Å; Y47-P60 HydrophobicContact CD2-CB 4.15Å; Y47-P60 HydrophobicContact CD2-CG 3.72Å; Y47-P60 HydrophobicContact CE2-CB 4.41Å; Y47-P60 HydrophobicContact CE2-CG 3.74Å; Y47-P60 VanDerWaalsContact CE2-O 3.32Å; Y47-P60 WeakPolarHBondContact CE2-O 3.44Å; Y47-P60 HydrophobicContact CG-CG 4.46Å; Y47-A62 HydrophobicContact CD2-CB 3.68Å; Y47-A62 HydrophobicContact CE2-CB 4.44Å; Y47-A62 HydrophobicContact CG-CB 4.24Å |
| 48 | N | 93.7 | Very high | 92.3 | Very high | 100 Ų | 100 | 74.8 Ų | 74.8 | 54% | 0.535 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -66.7 | -41.2 | 178.9 | -70.2 | -21.7 | 0 | 0 | 0 | 112.8 | K44 N45 W46 G51 K52 | K44-N48 VanDerWaalsContact O-CG 3.27Å; K44-N48 PolarHBondContact O-N 3.27Å; K44-N48 PolarHBondContact O-ND2 3.36Å; N45-N48 PolarHBondContact O-N 3.38Å; W46-N48 VanDerWaalsContact C-N 3.31Å; W46-N48 PolarHBondContact O-N 3.05Å; N48-G51 PolarHBondContact O-N 3.03Å; N48-K52 WeakPolarHBondContact O-CB 3.32Å; N48-K52 PolarHBondContact O-N 3.14Å |
| 49 | E | 95.5 | Very high | 92.1 | Very high | 50 Ų | 50 | 82.1 Ų | 82.1 | 23% | 0.234 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -65.6 | -39.5 | 177.7 | -77.7 | -77.4 | 132.8 | 0 | 0 | 111.5 | T10 I14 N45 W46 K52 W53 | T10-E49 HydrophobicContact CG2-CB 3.94Å; T10-E49 HydrophobicContact CG2-CG 4.11Å; I14-E49 HydrophobicContact CD1-CB 3.84Å; N45-E49 WeakPolarHBondContact O-CB 3.08Å; N45-E49 WeakPolarHBondContact O-CG 3.46Å; N45-E49 PolarHBondContact O-N 2.95Å; W46-E49 PolarHBondContact O-N 2.84Å; E49-K52 PolarHBondContact O-N 2.97Å; E49-K52 IonicContact OE1-NZ 3.02Å; E49-K52 PolarHBondContact OE1-NZ 3.44Å; E49-W53 PolarHBondContact O-N 3.44Å; E49-W53 PolarHBondContact OE2-NE1 3.15Å |
| 50 | V | 94.5 | Very high | 92 | Very high | 16 Ų | 16 | 80.1 Ų | 80.1 | 10% | 0.097 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -60.2 | -49.4 | 173 | 172 | 0 | 0 | 0 | 0 | 110.7 | I14 W46 Y47 K52 W53 L54 P60 | I14-V50 HydrophobicContact CD1-CG2 3.99Å; I14-V50 HydrophobicContact CG1-CG2 4.07Å; W46-V50 WeakPolarHBondContact O-CG2 3.2Å; W46-V50 PolarHBondContact O-N 3.12Å; Y47-V50 PolarHBondContact O-N 2.89Å; V50-K52 VanDerWaalsContact C-N 3.34Å; V50-K52 PolarHBondContact O-N 3.45Å; V50-W53 PolarHBondContact O-N 3.25Å; V50-L54 HydrophobicContact CG1-CD1 4.35Å; V50-L54 WeakPolarHBondContact O-CB 3.37Å; V50-L54 PolarHBondContact O-N 3.32Å; V50-P60 HydrophobicContact CB-CB 4.43Å; V50-P60 HydrophobicContact CB-CG 4.12Å; V50-P60 HydrophobicContact CG1-CB 4Å; V50-P60 HydrophobicContact CG1-CG 3.69Å |
| 51 | G | 94.4 | Very high | 92.1 | Very high | 36 Ų | 36 | 81 Ų | 81 | 37% | 0.371 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -62.4 | -39.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | Y47 N48 G55 | Y47-G51 PolarHBondContact O-N 2.71Å; Y47-G51 VanDerWaalsContact O-N 3.08Å; N48-G51 PolarHBondContact O-N 3.03Å; G51-G55 WeakPolarHBondContact O-CA 3.29Å; G51-G55 PolarHBondContact O-N 3.15Å |
| 52 | K | 94.7 | Very high | 92.1 | Very high | 133 Ų | 133 | 78.1 Ų | 78.1 | 58% | 0.578 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -63.2 | -45.2 | 178.1 | 174 | -177.6 | 167.3 | -170 | 0 | 112.7 | N48 E49 V50 | N48-K52 WeakPolarHBondContact O-CB 3.32Å; N48-K52 PolarHBondContact O-N 3.14Å; E49-K52 PolarHBondContact O-N 2.97Å; E49-K52 IonicContact OE1-NZ 3.02Å; E49-K52 PolarHBondContact OE1-NZ 3.44Å; V50-K52 VanDerWaalsContact C-N 3.34Å; V50-K52 PolarHBondContact O-N 3.45Å |
| 53 | W | 94.9 | Very high | 91.9 | Very high | 112 Ų | 112 | 78.5 Ų | 78.5 | 42% | 0.424 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -90 | -37.9 | -173.8 | -65.9 | 116.4 | 0 | 0 | 0 | 113.7 | L11 I14 E49 V50 | L11-W53 HydrophobicContact CD1-CB 4.23Å; L11-W53 HydrophobicContact CD1-CD2 3.61Å; L11-W53 HydrophobicContact CD1-CE3 4.12Å; L11-W53 HydrophobicContact CD1-CG 3.64Å; L11-W53 HydrophobicContact CD1-CZ2 4.47Å; L11-W53 HydrophobicContact CD2-CD2 4.46Å; L11-W53 HydrophobicContact CD2-CH2 4.1Å; L11-W53 HydrophobicContact CD2-CZ2 3.94Å; L11-W53 HydrophobicContact CD2-CZ3 4.43Å; I14-W53 HydrophobicContact CG2-CB 4.49Å; E49-W53 PolarHBondContact O-N 3.44Å; E49-W53 PolarHBondContact OE2-NE1 3.15Å; V50-W53 PolarHBondContact O-N 3.25Å |
| 54 | L | 93.3 | Very high | 91.4 | Very high | 18 Ų | 18 | 81 Ų | 81 | 9% | 0.094 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -99.5 | -13.5 | -176.4 | -60.3 | -177.9 | 0 | 0 | 0 | 112.9 | I14 W18 V50 R57 I58 | I14-L54 HydrophobicContact CG2-CD1 3.71Å; I14-L54 HydrophobicContact CG2-CD2 4.27Å; I14-L54 HydrophobicContact CG2-CG 3.8Å; W18-L54 HydrophobicContact CB-CD1 4.32Å; W18-L54 HydrophobicContact CB-CD2 4.14Å; W18-L54 HydrophobicContact CD2-CD2 3.98Å; W18-L54 HydrophobicContact CE3-CD1 4.09Å; W18-L54 HydrophobicContact CE3-CD2 4.12Å; W18-L54 HydrophobicContact CG-CD2 3.98Å; V50-L54 HydrophobicContact CG1-CD1 4.35Å; V50-L54 WeakPolarHBondContact O-CB 3.37Å; V50-L54 PolarHBondContact O-N 3.32Å; L54-R57 VanDerWaalsContact O-CB 3.29Å; L54-R57 WeakPolarHBondContact O-CB 3.39Å; L54-R57 VanDerWaalsContact O-CG 3.24Å; L54-R57 WeakPolarHBondContact O-CG 3.24Å; L54-R57 PolarHBondContact O-N 2.58Å; L54-I58 HydrophobicContact CD1-CB 4.39Å; L54-I58 HydrophobicContact CD1-CD1 3.81Å; L54-I58 HydrophobicContact CD1-CG1 4.14Å |
| 55 | G | 90.9 | Very high | 90.6 | Very high | 36 Ų | 36 | 76.6 Ų | 76.6 | 37% | 0.371 | 42% | 0.419 | S | S | . | . | G | 310 helix | trans | 59.2 | -139.7 | -175.8 | 0 | 0 | 0 | 0 | 0 | 111 | G51 R57 | G51-G55 WeakPolarHBondContact O-CA 3.29Å; G51-G55 PolarHBondContact O-N 3.15Å; G55-R57 PolarHBondContact O-N 3Å |
| 56 | G | 87 | Confident | 89.3 | Confident | 79 Ų | 79 | 74.5 Ų | 74.5 | 81% | 0.814 | 42% | 0.419 | S | S | * | . | G | 310 helix | trans | -80.7 | 10.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | I58 | G56-I58 VanDerWaalsContact C-N 3.33Š|
| 57 | R | 90.1 | Very high | 88.1 | Confident | 174 Ų | 174 | 74.8 Ų | 74.8 | 66% | 0.657 | 43% | 0.428 | S | S | * | . | G | 310 helix | trans | -73.3 | -27.1 | -178.5 | -63.2 | -177.8 | -173.2 | 109.3 | -4 | 113.1 | W18 L54 G55 | W18-R57 HydrophobicContact CH2-CB 3.72Å; W18-R57 HydrophobicContact CH2-CG 4.31Å; W18-R57 HydrophobicContact CZ3-CB 3.78Å; L54-R57 VanDerWaalsContact O-CB 3.29Å; L54-R57 WeakPolarHBondContact O-CB 3.39Å; L54-R57 VanDerWaalsContact O-CG 3.24Å; L54-R57 WeakPolarHBondContact O-CG 3.24Å; L54-R57 PolarHBondContact O-N 2.58Å; G55-R57 PolarHBondContact O-N 3Å |
| 58 | I | 87.9 | Confident | 87 | Confident | 43 Ų | 43 | 77.7 Ų | 77.7 | 22% | 0.221 | 44% | 0.443 | C | S | . | . | S | Bend | trans | -129.6 | 136.3 | 171.5 | -64.8 | -165.9 | 0 | 0 | 0 | 107.2 | W18 L21 L54 G56 P60 | W18-I58 HydrophobicContact CE3-CD1 3.55Å; W18-I58 HydrophobicContact CE3-CG1 3.77Å; W18-I58 HydrophobicContact CZ3-CD1 3.91Å; W18-I58 HydrophobicContact CZ3-CG1 3.62Å; L21-I58 HydrophobicContact CD1-CD1 3.49Å; L21-I58 VanDerWaalsContact CD1-CD1 3.49Å; L54-I58 HydrophobicContact CD1-CB 4.39Å; L54-I58 HydrophobicContact CD1-CD1 3.81Å; L54-I58 HydrophobicContact CD1-CG1 4.14Å; G56-I58 VanDerWaalsContact C-N 3.33Å; I58-P60 WeakPolarHBondContact O-CD 3.14Å |
| 59 | Q | 88.4 | Confident | 86.1 | Confident | 185 Ų | 185 | 78.5 Ų | 78.5 | 86% | 0.864 | 45% | 0.447 | S | S | * | . | trans | -99.1 | 97.7 | 168 | -66.8 | -173.6 | 11 | 0 | 0 | 108.4 | ||||
| 60 | P | 90.8 | Very high | 84.9 | Confident | 40 Ų | 40 | 81 Ų | 81 | 26% | 0.26 | 46% | 0.459 | S | S | . | . | P | Polyproline II helix | trans | -69.9 | 144.1 | 176.2 | 28.5 | -33.8 | 0 | 0 | 0 | 110.5 | Y47 V50 I58 | Y47-P60 HydrophobicContact CD2-CB 4.15Å; Y47-P60 HydrophobicContact CD2-CG 3.72Å; Y47-P60 HydrophobicContact CE2-CB 4.41Å; Y47-P60 HydrophobicContact CE2-CG 3.74Å; Y47-P60 VanDerWaalsContact CE2-O 3.32Å; Y47-P60 WeakPolarHBondContact CE2-O 3.44Å; Y47-P60 HydrophobicContact CG-CG 4.46Å; V50-P60 HydrophobicContact CB-CB 4.43Å; V50-P60 HydrophobicContact CB-CG 4.12Å; V50-P60 HydrophobicContact CG1-CB 4Å; V50-P60 HydrophobicContact CG1-CG 3.69Å; I58-P60 WeakPolarHBondContact O-CD 3.14Å |
| 61 | L | 90.8 | Very high | 83.9 | Confident | 87 Ų | 87 | 82.4 Ų | 82.4 | 46% | 0.455 | 47% | 0.465 | S | S | . | . | P | Polyproline II helix | trans | -102.2 | 116.4 | 169 | -179.7 | 61.9 | 0 | 0 | 0 | 109 | I63 K74 L75 | L61-I63 HydrophobicContact CD2-CD1 4.03Å; L61-I63 HydrophobicContact CD2-CG1 4.32Å; L61-I63 HydrophobicContact CG-CD1 4.31Å; L61-I63 HydrophobicContact CG-CG1 4.11Å; L61-K74 HydrophobicContact CD1-CB 4.13Å; L61-K74 VanDerWaalsContact CD1-O 3.22Å; L61-K74 WeakPolarHBondContact CD1-O 3.14Å; L61-L75 HydrophobicContact CD2-CD2 3.76Å; L61-L75 HydrophobicContact CD2-CG 4.06Å |
| 62 | A | 89.6 | Confident | 82.9 | Confident | 38 Ų | 38 | 85.9 Ų | 85.9 | 31% | 0.314 | 48% | 0.476 | S | S | . | . | P | Polyproline II helix | trans | -94.6 | 120.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 110.5 | V43 Y47 | V43-A62 HydrophobicContact CG1-CB 3.92Å; Y47-A62 HydrophobicContact CD2-CB 3.68Å; Y47-A62 HydrophobicContact CE2-CB 4.44Å; Y47-A62 HydrophobicContact CG-CB 4.24Å |
| 63 | I | 87.3 | Confident | 81.7 | Confident | 78 Ų | 78 | 87.9 Ų | 87.9 | 40% | 0.4 | 49% | 0.487 | S | S | . | . | trans | -118.2 | 118.4 | 175.7 | -58.5 | 168.3 | 0 | 0 | 0 | 107.5 | L61 I71 | L61-I63 HydrophobicContact CD2-CD1 4.03Å; L61-I63 HydrophobicContact CD2-CG1 4.32Å; L61-I63 HydrophobicContact CG-CD1 4.31Å; L61-I63 HydrophobicContact CG-CG1 4.11Å; I63-I71 HydrophobicContact CD1-CG2 3.92Å; I63-I71 HydrophobicContact CG2-CD1 3.97Å; I63-I71 HydrophobicContact CG2-CG1 4.01Å; I63-I71 HydrophobicContact CG2-CG2 4.37Å | ||
| 64 | D | 83.2 | Confident | 80.3 | Confident | 73 Ų | 73 | 88.6 Ų | 88.6 | 39% | 0.39 | 49% | 0.493 | S | S | . | . | trans | -144 | 92.9 | 179.6 | -178 | 22.6 | 0 | 0 | 0 | 109.2 | S40 V43 | S40-D64 WeakPolarHBondContact CA-OD1 3.43Å; S40-D64 WeakPolarHBondContact CB-OD1 3.32Å; S40-D64 VanDerWaalsContact OG-CG 3.22Å; S40-D64 PolarHBondContact OG-OD1 3.12Å; S40-D64 PolarHBondContact OG-OD2 3.29Å; V43-D64 HydrophobicContact CB-CB 4.12Å; V43-D64 HydrophobicContact CG1-CB 4.07Å; V43-D64 HydrophobicContact CG2-CB 4.19Å | ||
| 65 | G | 74.5 | Confident | 79 | Confident | 58 Ų | 58 | 95.4 Ų | 95.4 | 60% | 0.598 | 53% | 0.529 | S | S | * | . | S | Bend | trans | 64.4 | 169.2 | -171.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||
| 66 | G | 66.3 | Low | 78.4 | Confident | 47 Ų | 47 | 98.4 Ų | 98.4 | 49% | 0.485 | 54% | 0.537 | S | S | . | . | trans | 128.5 | 158.7 | -179.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | E70 | G66-E70 WeakPolarHBondContact CA-OE2 3.48Š| ||
| 67 | S | 69.6 | Low | 77.9 | Confident | 54 Ų | 54 | 99.4 Ų | 99.4 | 38% | 0.378 | 52% | 0.522 | S | S | . | . | trans | -66.9 | 158.8 | 172 | 95.8 | 0 | 0 | 0 | 0 | 110 | D69 E70 I71 | S67-D69 PolarHBondContact O-N 2.96Å; S67-D69 PolarHBondContact OG-N 3.41Å; S67-D69 PolarHBondContact OG-OD2 3.39Å; S67-E70 PolarHBondContact N-OE2 3Å; S67-E70 PolarHBondContact O-N 3.33Å; S67-E70 VanDerWaalsContact O-N 3.11Å; S67-E70 PolarHBondContact OG-N 3.05Å; S67-I71 WeakPolarHBondContact O-CG1 3.2Å; S67-I71 PolarHBondContact O-N 3.36Å | ||
| 68 | K | 69.1 | Low | 77.3 | Confident | 174 Ų | 174 | 95.3 Ų | 95.3 | 76% | 0.757 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -53 | -38.2 | 174.8 | -78.4 | -176.3 | 173.3 | -175.1 | 0 | 111.9 | E70 I71 D72 | K68-E70 PolarHBondContact O-N 2.83Å; K68-I71 PolarHBondContact O-N 3.35Å; K68-D72 PolarHBondContact O-N 3.01Å |
| 69 | D | 74.4 | Confident | 76.6 | Confident | 118 Ų | 118 | 98.4 Ų | 98.4 | 63% | 0.631 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -66.8 | -36.4 | -178.6 | -45.9 | -51.9 | 0 | 0 | 0 | 112.2 | S67 I71 Q73 | S67-D69 PolarHBondContact O-N 2.96Å; S67-D69 PolarHBondContact OG-N 3.41Å; S67-D69 PolarHBondContact OG-OD2 3.39Å; D69-I71 VanDerWaalsContact C-N 3.3Å; D69-I71 PolarHBondContact O-N 3.41Å; D69-Q73 PolarHBondContact O-N 3.01Å; D69-Q73 VanDerWaalsContact O-N 3.15Å |
| 70 | E | 70.8 | Confident | 75.9 | Confident | 102 Ų | 102 | 92.9 Ų | 92.9 | 48% | 0.477 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -71 | -27.8 | 176.6 | -66.1 | 179.4 | 146.5 | 0 | 0 | 112.6 | G66 S67 K68 K74 | G66-E70 WeakPolarHBondContact CA-OE2 3.48Å; S67-E70 PolarHBondContact N-OE2 3Å; S67-E70 PolarHBondContact O-N 3.33Å; S67-E70 VanDerWaalsContact O-N 3.11Å; S67-E70 PolarHBondContact OG-N 3.05Å; K68-E70 PolarHBondContact O-N 2.83Å; E70-K74 WeakPolarHBondContact O-CD 3.43Å; E70-K74 WeakPolarHBondContact O-CG 3.43Å |
| 71 | I | 73.1 | Confident | 74.9 | Confident | 46 Ų | 46 | 96.5 Ų | 96.5 | 24% | 0.236 | 53% | 0.528 | C | S | . | . | H | α-helix | trans | -77.1 | -44 | 176.2 | -62.4 | 170.7 | 0 | 0 | 0 | 109.6 | I63 S67 K68 D69 Q73 K74 L75 | I63-I71 HydrophobicContact CD1-CG2 3.92Å; I63-I71 HydrophobicContact CG2-CD1 3.97Å; I63-I71 HydrophobicContact CG2-CG1 4.01Å; I63-I71 HydrophobicContact CG2-CG2 4.37Å; S67-I71 WeakPolarHBondContact O-CG1 3.2Å; S67-I71 PolarHBondContact O-N 3.36Å; K68-I71 PolarHBondContact O-N 3.35Å; D69-I71 VanDerWaalsContact C-N 3.3Å; D69-I71 PolarHBondContact O-N 3.41Å; I71-Q73 VanDerWaalsContact C-N 3.29Å; I71-Q73 PolarHBondContact O-N 3.08Å; I71-K74 PolarHBondContact O-N 2.94Å; I71-L75 HydrophobicContact CG2-CD1 4.11Å; I71-L75 PolarHBondContact O-N 3.02Å |
| 72 | D | 73.6 | Confident | 73.8 | Confident | 109 Ų | 109 | 97.1 Ų | 97.1 | 58% | 0.583 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -63.3 | -32.1 | 178.5 | -77 | -13.4 | 0 | 0 | 0 | 112.6 | K68 K74 | K68-D72 PolarHBondContact O-N 3.01Å; D72-K74 VanDerWaalsContact C-N 3.29Å; D72-K74 PolarHBondContact O-N 3.36Å |
| 73 | Q | 70.3 | Confident | 72.6 | Confident | 174 Ų | 174 | 101.7 Ų | 101.7 | 81% | 0.813 | 55% | 0.55 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.4 | -18.9 | 173.8 | -77.2 | -166 | -5.8 | 0 | 0 | 114.7 | D69 I71 | D69-Q73 PolarHBondContact O-N 3.01Å; D69-Q73 VanDerWaalsContact O-N 3.15Å; I71-Q73 VanDerWaalsContact C-N 3.29Å; I71-Q73 PolarHBondContact O-N 3.08Å |
| 74 | K | 66.6 | Low | 71.3 | Confident | 128 Ų | 128 | 103.7 Ų | 103.7 | 56% | 0.557 | 56% | 0.562 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.3 | -9.4 | -178.3 | -69.6 | 175.1 | -177.2 | 170.7 | 0 | 112.9 | L61 E70 I71 D72 | L61-K74 HydrophobicContact CD1-CB 4.13Å; L61-K74 VanDerWaalsContact CD1-O 3.22Å; L61-K74 WeakPolarHBondContact CD1-O 3.14Å; E70-K74 WeakPolarHBondContact O-CD 3.43Å; E70-K74 WeakPolarHBondContact O-CG 3.43Å; I71-K74 PolarHBondContact O-N 2.94Å; D72-K74 VanDerWaalsContact C-N 3.29Å; D72-K74 PolarHBondContact O-N 3.36Å |
| 75 | L | 64.8 | Low | 70.3 | Confident | 161 Ų | 161 | 106.5 Ų | 106.5 | 84% | 0.843 | 58% | 0.578 | S | S | * | * | trans | -82.7 | 0 | 175.3 | -83.9 | 159.4 | 0 | 0 | 0 | 111.5 | L61 I71 | L61-L75 HydrophobicContact CD2-CD2 3.76Å; L61-L75 HydrophobicContact CD2-CG 4.06Å; I71-L75 HydrophobicContact CG2-CD1 4.11Å; I71-L75 PolarHBondContact O-N 3.02Å |
Retrieved 75 of 75 residues in 80.3 ms
(Link to these results)