| 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 | 59.7 | Low | 78.3 | Confident | 194 Ų | 194 | 123.8 Ų | 123.8 | 96% | 0.956 | 65% | 0.646 | S | S | * | * | 0 | -49.5 | 0 | -69.3 | -63.7 | -92.1 | 0 | 0 | 112.4 | Q3 K4 V5 | M1-Q3 PolarHBondContact O-N 3.1Å; M1-K4 PolarHBondContact O-N 3.42Å; M1-V5 PolarHBondContact O-N 3.32Å | |||
| 2 | A | 72.1 | Confident | 79.3 | Confident | 74 Ų | 74 | 119.3 Ų | 119.3 | 61% | 0.612 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -54.8 | -45.5 | -177.6 | 0 | 0 | 0 | 0 | 0 | 115.9 | K4 V5 Q6 | A2-K4 PolarHBondContact O-N 3.28Å; A2-V5 PolarHBondContact O-N 3.27Å; A2-Q6 PolarHBondContact O-N 3.17Å |
| 3 | Q | 73.6 | Confident | 80.2 | Confident | 145 Ų | 145 | 116.9 Ų | 116.9 | 68% | 0.678 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -67.4 | -31.5 | 179.3 | -76.7 | -169.2 | -16.9 | 0 | 0 | 114.2 | M1 K7 | M1-Q3 PolarHBondContact O-N 3.1Å; Q3-K7 WeakPolarHBondContact O-CB 3.4Å; Q3-K7 WeakPolarHBondContact O-CG 3.39Å; Q3-K7 PolarHBondContact O-N 2.88Å |
| 4 | K | 75.1 | Confident | 81.1 | Confident | 169 Ų | 169 | 115.4 Ų | 115.4 | 74% | 0.735 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -70 | -38.7 | 175.6 | -72.5 | -174.1 | 177.2 | -177.2 | 0 | 110.7 | M1 A2 K7 L8 | M1-K4 PolarHBondContact O-N 3.42Å; A2-K4 PolarHBondContact O-N 3.28Å; K4-K7 PolarHBondContact O-N 3.43Å; K4-L8 PolarHBondContact O-N 3.14Å |
| 5 | V | 80.5 | Confident | 81.8 | Confident | 84 Ų | 84 | 115.5 Ų | 115.5 | 51% | 0.509 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -65.7 | -45.6 | 173.4 | 176.9 | 0 | 0 | 0 | 0 | 110.8 | M1 A2 K7 L8 V9 | M1-V5 PolarHBondContact O-N 3.32Å; A2-V5 PolarHBondContact O-N 3.27Å; V5-K7 VanDerWaalsContact C-N 3.34Å; V5-K7 PolarHBondContact O-N 3.47Å; V5-L8 WeakPolarHBondContact O-CB 3.46Å; V5-L8 PolarHBondContact O-N 3.13Å; V5-V9 HydrophobicContact CG1-CG2 4.26Å; V5-V9 WeakPolarHBondContact O-CG2 3.29Å; V5-V9 PolarHBondContact O-N 3.16Å |
| 6 | Q | 78.7 | Confident | 82.5 | Confident | 133 Ų | 133 | 115 Ų | 115 | 62% | 0.621 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -58.9 | -42.1 | 175.3 | -80.4 | 174.6 | -31.6 | 0 | 0 | 112.8 | A2 L8 V9 A10 | A2-Q6 PolarHBondContact O-N 3.17Å; Q6-L8 VanDerWaalsContact C-N 3.3Å; Q6-L8 PolarHBondContact O-N 3.04Å; Q6-V9 PolarHBondContact O-N 3.28Å; Q6-A10 WeakPolarHBondContact O-CB 3.35Å; Q6-A10 PolarHBondContact O-N 3.2Å |
| 7 | K | 81.6 | Confident | 83.1 | Confident | 147 Ų | 147 | 110.4 Ų | 110.4 | 64% | 0.639 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -65.5 | -31.2 | 174.6 | -74.7 | -179.7 | -178.3 | -175.5 | 0 | 113 | Q3 K4 V5 K11 | Q3-K7 WeakPolarHBondContact O-CB 3.4Å; Q3-K7 WeakPolarHBondContact O-CG 3.39Å; Q3-K7 PolarHBondContact O-N 2.88Å; K4-K7 PolarHBondContact O-N 3.43Å; V5-K7 VanDerWaalsContact C-N 3.34Å; V5-K7 PolarHBondContact O-N 3.47Å; K7-K11 WeakPolarHBondContact O-CG 3.48Å |
| 8 | L | 81.3 | Confident | 83.7 | Confident | 118 Ų | 118 | 107.4 Ų | 107.4 | 62% | 0.618 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -73.9 | -45.4 | 176.1 | -165.3 | 73.7 | 0 | 0 | 0 | 111.1 | K4 V5 Q6 A10 K11 V12 | K4-L8 PolarHBondContact O-N 3.14Å; V5-L8 WeakPolarHBondContact O-CB 3.46Å; V5-L8 PolarHBondContact O-N 3.13Å; Q6-L8 VanDerWaalsContact C-N 3.3Å; Q6-L8 PolarHBondContact O-N 3.04Å; L8-A10 VanDerWaalsContact C-N 3.28Å; L8-A10 PolarHBondContact O-N 3.3Å; L8-K11 WeakPolarHBondContact O-CB 3.33Å; L8-K11 PolarHBondContact O-N 2.95Å; L8-V12 PolarHBondContact O-N 3.06Å |
| 9 | V | 84.3 | Confident | 84.3 | Confident | 93 Ų | 93 | 104.4 Ų | 104.4 | 56% | 0.564 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -58.6 | -41.2 | 174.8 | 173.4 | 0 | 0 | 0 | 0 | 110.7 | V5 Q6 K11 V12 P13 | V5-V9 HydrophobicContact CG1-CG2 4.26Å; V5-V9 WeakPolarHBondContact O-CG2 3.29Å; V5-V9 PolarHBondContact O-N 3.16Å; Q6-V9 PolarHBondContact O-N 3.28Å; V9-K11 PolarHBondContact O-N 3.06Å; V9-K11 VanDerWaalsContact O-N 3.17Å; V9-V12 WeakPolarHBondContact O-CB 3.46Å; V9-V12 PolarHBondContact O-N 2.95Å; V9-P13 WeakPolarHBondContact O-CD 3.48Å |
| 10 | A | 85.3 | Confident | 84.8 | Confident | 73 Ų | 73 | 103.9 Ų | 103.9 | 60% | 0.603 | 59% | 0.585 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.7 | -20.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 114 | Q6 L8 | Q6-A10 WeakPolarHBondContact O-CB 3.35Å; Q6-A10 PolarHBondContact O-N 3.2Å; L8-A10 VanDerWaalsContact C-N 3.28Å; L8-A10 PolarHBondContact O-N 3.3Å |
| 11 | K | 89.4 | Confident | 85.4 | Confident | 132 Ų | 132 | 104.1 Ų | 104.1 | 57% | 0.574 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.3 | -7.8 | 175.6 | -69.3 | -176.2 | 177.9 | -168.1 | 0 | 113.6 | K7 L8 V9 T14 L15 | K7-K11 WeakPolarHBondContact O-CG 3.48Å; L8-K11 WeakPolarHBondContact O-CB 3.33Å; L8-K11 PolarHBondContact O-N 2.95Å; V9-K11 PolarHBondContact O-N 3.06Å; V9-K11 VanDerWaalsContact O-N 3.17Å; K11-T14 PolarHBondContact O-N 3.23Å; K11-T14 PolarHBondContact O-OG1 3.24Å; K11-L15 WeakPolarHBondContact O-CG 3.49Å; K11-L15 PolarHBondContact O-N 3.28Å; K11-L15 VanDerWaalsContact O-N 3.08Å |
| 12 | V | 90.3 | Very high | 87 | Confident | 70 Ų | 70 | 101.4 Ų | 101.4 | 42% | 0.424 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -59.8 | -45.4 | 177.3 | 173.5 | 0 | 0 | 0 | 0 | 111.7 | L8 V9 T14 L15 L16 | L8-V12 PolarHBondContact O-N 3.06Å; V9-V12 WeakPolarHBondContact O-CB 3.46Å; V9-V12 PolarHBondContact O-N 2.95Å; V12-T14 VanDerWaalsContact C-N 3.3Å; V12-T14 PolarHBondContact O-N 2.99Å; V12-L15 PolarHBondContact O-N 3.43Å; V12-L16 HydrophobicContact CG1-CD1 3.86Å; V12-L16 HydrophobicContact CG1-CG 4.24Å; V12-L16 WeakPolarHBondContact O-CG 3.44Å; V12-L16 PolarHBondContact O-N 3.15Å |
| 13 | P | 91.4 | Very high | 88.2 | Confident | 88 Ų | 88 | 100.2 Ų | 100.2 | 57% | 0.571 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -61.7 | -36.8 | 178.9 | -24.2 | 35.1 | 0 | 0 | 0 | 113.3 | V9 L16 G17 | V9-P13 WeakPolarHBondContact O-CD 3.48Å; P13-L16 PolarHBondContact O-N 2.82Å; P13-G17 PolarHBondContact O-N 2.89Å |
| 14 | T | 91.8 | Very high | 89.3 | Confident | 95 Ų | 95 | 100.4 Ų | 100.4 | 58% | 0.583 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -71 | -38.6 | 179 | 57.9 | 0 | 0 | 0 | 0 | 111.7 | K11 V12 G17 A18 | K11-T14 PolarHBondContact O-N 3.23Å; K11-T14 PolarHBondContact O-OG1 3.24Å; V12-T14 VanDerWaalsContact C-N 3.3Å; V12-T14 PolarHBondContact O-N 2.99Å; T14-G17 PolarHBondContact O-N 3.44Å; T14-A18 WeakPolarHBondContact O-CB 3.31Å; T14-A18 PolarHBondContact O-N 3.49Å |
| 15 | L | 92.5 | Very high | 90.3 | Very high | 117 Ų | 117 | 95.8 Ų | 95.8 | 61% | 0.613 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -65.9 | -41.1 | 174 | -69.7 | 174.2 | 0 | 0 | 0 | 112.2 | K11 V12 A18 A19 | K11-L15 WeakPolarHBondContact O-CG 3.49Å; K11-L15 PolarHBondContact O-N 3.28Å; K11-L15 VanDerWaalsContact O-N 3.08Å; V12-L15 PolarHBondContact O-N 3.43Å; L15-A18 PolarHBondContact O-N 2.93Å; L15-A19 WeakPolarHBondContact O-CB 3.46Å; L15-A19 PolarHBondContact O-N 2.95Å |
| 16 | L | 92.8 | Very high | 91 | Very high | 108 Ų | 108 | 97.8 Ų | 97.8 | 57% | 0.565 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -62.8 | -44.9 | 174.1 | -70.4 | 172.9 | 0 | 0 | 0 | 111.4 | V12 P13 A18 A19 V20 | V12-L16 HydrophobicContact CG1-CD1 3.86Å; V12-L16 HydrophobicContact CG1-CG 4.24Å; V12-L16 WeakPolarHBondContact O-CG 3.44Å; V12-L16 PolarHBondContact O-N 3.15Å; P13-L16 PolarHBondContact O-N 2.82Å; L16-A18 VanDerWaalsContact C-N 3.33Å; L16-A18 PolarHBondContact O-N 3.32Å; L16-A19 PolarHBondContact O-N 2.91Å; L16-V20 WeakPolarHBondContact O-CG2 3.47Å; L16-V20 PolarHBondContact O-N 3.4Å |
| 17 | G | 93.3 | Very high | 91.8 | Very high | 36 Ų | 36 | 96.7 Ų | 96.7 | 37% | 0.371 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -59.9 | -41.8 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | P13 T14 V20 T21 | P13-G17 PolarHBondContact O-N 2.89Å; T14-G17 PolarHBondContact O-N 3.44Å; G17-V20 PolarHBondContact O-N 2.91Å; G17-T21 WeakPolarHBondContact O-CB 3.42Å; G17-T21 PolarHBondContact O-N 3.47Å; G17-T21 PolarHBondContact O-OG1 3.01Å |
| 18 | A | 94 | Very high | 92.5 | Very high | 58 Ų | 58 | 92.5 Ų | 92.5 | 48% | 0.479 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -64.1 | -44.2 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112 | T14 L15 L16 V20 T21 Y22 | T14-A18 WeakPolarHBondContact O-CB 3.31Å; T14-A18 PolarHBondContact O-N 3.49Å; L15-A18 PolarHBondContact O-N 2.93Å; L16-A18 VanDerWaalsContact C-N 3.33Å; L16-A18 PolarHBondContact O-N 3.32Å; A18-V20 PolarHBondContact O-N 3.42Å; A18-T21 PolarHBondContact O-N 3.41Å; A18-Y22 WeakPolarHBondContact O-CB 3.45Å; A18-Y22 PolarHBondContact O-N 3.44Å |
| 19 | A | 94.6 | Very high | 93.2 | Very high | 50 Ų | 50 | 90.7 Ų | 90.7 | 41% | 0.413 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62 | -42.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | L15 L16 Y22 S23 | L15-A19 WeakPolarHBondContact O-CB 3.46Å; L15-A19 PolarHBondContact O-N 2.95Å; L16-A19 PolarHBondContact O-N 2.91Å; A19-Y22 PolarHBondContact O-N 3.44Å; A19-S23 VanDerWaalsContact O-CB 3.26Å; A19-S23 WeakPolarHBondContact O-CB 3.46Å; A19-S23 PolarHBondContact O-N 2.99Å; A19-S23 PolarHBondContact O-OG 2.78Å |
| 20 | V | 94.8 | Very high | 93.8 | Very high | 94 Ų | 94 | 92.1 Ų | 92.1 | 57% | 0.57 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -63.5 | -46.2 | 175.9 | 171.5 | 0 | 0 | 0 | 0 | 110.8 | L16 G17 A18 Y22 S23 K24 | L16-V20 WeakPolarHBondContact O-CG2 3.47Å; L16-V20 PolarHBondContact O-N 3.4Å; G17-V20 PolarHBondContact O-N 2.91Å; A18-V20 PolarHBondContact O-N 3.42Å; V20-Y22 VanDerWaalsContact C-N 3.27Å; V20-Y22 PolarHBondContact O-N 3.22Å; V20-S23 PolarHBondContact O-N 3.17Å; V20-K24 WeakPolarHBondContact O-CB 3.4Å; V20-K24 PolarHBondContact O-N 3.49Å |
| 21 | T | 95.8 | Very high | 94.3 | Very high | 108 Ų | 108 | 95.5 Ų | 95.5 | 66% | 0.663 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -61.9 | -37.3 | -180 | -56 | 0 | 0 | 0 | 0 | 111.5 | G17 A18 P25 | G17-T21 WeakPolarHBondContact O-CB 3.42Å; G17-T21 PolarHBondContact O-N 3.47Å; G17-T21 PolarHBondContact O-OG1 3.01Å; A18-T21 PolarHBondContact O-N 3.41Å; T21-P25 WeakPolarHBondContact O-CD 3.49Å |
| 22 | Y | 95.1 | Very high | 94.6 | Very high | 137 Ų | 137 | 96.8 Ų | 96.8 | 54% | 0.537 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -72.5 | -44.3 | 176.8 | -180 | -93.1 | 0 | 0 | 0 | 113.1 | A18 A19 V20 R26 | A18-Y22 WeakPolarHBondContact O-CB 3.45Å; A18-Y22 PolarHBondContact O-N 3.44Å; A19-Y22 PolarHBondContact O-N 3.44Å; V20-Y22 VanDerWaalsContact C-N 3.27Å; V20-Y22 PolarHBondContact O-N 3.22Å; Y22-R26 VanDerWaalsContact CD2-NH1 3.28Å; Y22-R26 PolarHBondContact O-NH1 3.35Å; Y22-R26 PolarHBondContact OH-NE 3.01Å; Y22-R26 PolarHBondContact OH-NH2 3.29Å |
| 23 | S | 96.2 | Very high | 94.9 | Very high | 49 Ų | 49 | 99.1 Ų | 99.1 | 34% | 0.343 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -80.5 | -34.4 | -172.4 | -63.1 | 0 | 0 | 0 | 0 | 113 | A19 V20 R26 L27 | A19-S23 VanDerWaalsContact O-CB 3.26Å; A19-S23 WeakPolarHBondContact O-CB 3.46Å; A19-S23 PolarHBondContact O-N 2.99Å; A19-S23 PolarHBondContact O-OG 2.78Å; V20-S23 PolarHBondContact O-N 3.17Å; S23-R26 PolarHBondContact O-N 2.91Å; S23-R26 VanDerWaalsContact O-N 3.16Å; S23-L27 WeakPolarHBondContact O-CG 3.48Å; S23-L27 PolarHBondContact O-N 3.46Å |
| 24 | K | 96.4 | Very high | 94.9 | Very high | 150 Ų | 150 | 95.6 Ų | 95.6 | 65% | 0.652 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -54.1 | -51.7 | -176.1 | -172.7 | 174 | -176.4 | 178.2 | 0 | 114.3 | V20 R26 L27 A28 | V20-K24 WeakPolarHBondContact O-CB 3.4Å; V20-K24 PolarHBondContact O-N 3.49Å; K24-R26 VanDerWaalsContact C-N 3.32Å; K24-R26 PolarHBondContact O-N 3.4Å; K24-L27 PolarHBondContact O-N 3.19Å; K24-A28 WeakPolarHBondContact O-CB 3.4Å; K24-A28 PolarHBondContact O-N 3.19Å |
| 25 | P | 96.8 | Very high | 95 | Very high | 71 Ų | 71 | 98.9 Ų | 98.9 | 46% | 0.461 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -65.6 | -34.5 | 179.2 | 25.2 | -34 | 0 | 0 | 0 | 112.6 | T21 A28 T29 | T21-P25 WeakPolarHBondContact O-CD 3.49Å; P25-A28 WeakPolarHBondContact O-CB 3.36Å; P25-A28 PolarHBondContact O-N 3.05Å; P25-T29 PolarHBondContact O-N 3.48Å; P25-T29 PolarHBondContact O-OG1 3.4Å |
| 26 | R | 95.4 | Very high | 95 | Very high | 127 Ų | 127 | 98.1 Ų | 98.1 | 48% | 0.479 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -68.5 | -43 | 178.8 | -68.6 | 173.4 | 171.4 | 72.2 | 5.1 | 112 | Y22 S23 K24 A28 T29 F30 | Y22-R26 VanDerWaalsContact CD2-NH1 3.28Å; Y22-R26 PolarHBondContact O-NH1 3.35Å; Y22-R26 PolarHBondContact OH-NE 3.01Å; Y22-R26 PolarHBondContact OH-NH2 3.29Å; S23-R26 PolarHBondContact O-N 2.91Å; S23-R26 VanDerWaalsContact O-N 3.16Å; K24-R26 VanDerWaalsContact C-N 3.32Å; K24-R26 PolarHBondContact O-N 3.4Å; R26-A28 VanDerWaalsContact C-N 3.29Å; R26-A28 PolarHBondContact O-N 3.15Å; R26-T29 PolarHBondContact O-N 3.26Å; R26-F30 WeakPolarHBondContact O-CB 3.35Å; R26-F30 PolarHBondContact O-N 2.94Å |
| 27 | L | 95.8 | Very high | 95.1 | Very high | 109 Ų | 109 | 99.9 Ų | 99.9 | 57% | 0.571 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -65.3 | -34.6 | 174.1 | -69.9 | 176 | 0 | 0 | 0 | 111.5 | S23 K24 F30 W31 | S23-L27 WeakPolarHBondContact O-CG 3.48Å; S23-L27 PolarHBondContact O-N 3.46Å; K24-L27 PolarHBondContact O-N 3.19Å; L27-F30 PolarHBondContact O-N 3.43Å; L27-W31 WeakPolarHBondContact O-CB 3.38Å; L27-W31 PolarHBondContact O-N 3.08Å |
| 28 | A | 96.3 | Very high | 95 | Very high | 60 Ų | 60 | 102.7 Ų | 102.7 | 50% | 0.496 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -64.2 | -44.3 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | K24 P25 R26 W31 Y32 | K24-A28 WeakPolarHBondContact O-CB 3.4Å; K24-A28 PolarHBondContact O-N 3.19Å; P25-A28 WeakPolarHBondContact O-CB 3.36Å; P25-A28 PolarHBondContact O-N 3.05Å; R26-A28 VanDerWaalsContact C-N 3.29Å; R26-A28 PolarHBondContact O-N 3.15Å; A28-W31 PolarHBondContact O-N 3.11Å; A28-Y32 PolarHBondContact O-N 3.28Å |
| 29 | T | 96.1 | Very high | 95 | Very high | 80 Ų | 80 | 104 Ų | 104 | 49% | 0.491 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62.9 | -45.7 | 174.3 | -56.4 | 0 | 0 | 0 | 0 | 111.7 | P25 R26 W31 Y32 Y33 | P25-T29 PolarHBondContact O-N 3.48Å; P25-T29 PolarHBondContact O-OG1 3.4Å; R26-T29 PolarHBondContact O-N 3.26Å; T29-W31 VanDerWaalsContact C-N 3.32Å; T29-W31 PolarHBondContact O-N 2.91Å; T29-Y32 WeakPolarHBondContact O-CB 3.43Å; T29-Y32 PolarHBondContact O-N 3.09Å; T29-Y33 HydrophobicContact CG2-CD2 4.09Å; T29-Y33 HydrophobicContact CG2-CE2 3.72Å; T29-Y33 VanDerWaalsContact O-CD2 3.24Å; T29-Y33 WeakPolarHBondContact O-CD2 3.42Å; T29-Y33 PolarHBondContact O-N 2.93Å |
| 30 | F | 95.1 | Very high | 94.8 | Very high | 123 Ų | 123 | 106.8 Ų | 106.8 | 54% | 0.539 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -56.8 | -47.1 | 174.6 | 169.4 | -101.6 | 0 | 0 | 0 | 111.4 | R26 L27 Y32 Y33 A34 | R26-F30 WeakPolarHBondContact O-CB 3.35Å; R26-F30 PolarHBondContact O-N 2.94Å; L27-F30 PolarHBondContact O-N 3.43Å; F30-Y32 VanDerWaalsContact C-N 3.32Å; F30-Y32 PolarHBondContact O-N 3.36Å; F30-Y33 PolarHBondContact O-N 3.21Å; F30-A34 HydrophobicContact CE1-CB 4.19Å; F30-A34 HydrophobicContact CE2-CB 4.41Å; F30-A34 HydrophobicContact CZ-CB 4.11Å; F30-A34 VanDerWaalsContact O-CB 3.22Å; F30-A34 WeakPolarHBondContact O-CB 3.4Å; F30-A34 PolarHBondContact O-N 3.26Å |
| 31 | W | 95.9 | Very high | 94.7 | Very high | 143 Ų | 143 | 106.7 Ų | 106.7 | 54% | 0.542 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -64 | -36.3 | -179 | -173.6 | -107.7 | 0 | 0 | 0 | 113.1 | L27 A28 T29 R35 | L27-W31 WeakPolarHBondContact O-CB 3.38Å; L27-W31 PolarHBondContact O-N 3.08Å; A28-W31 PolarHBondContact O-N 3.11Å; T29-W31 VanDerWaalsContact C-N 3.32Å; T29-W31 PolarHBondContact O-N 2.91Å; W31-R35 HydrophobicContact CD2-CG 4.45Å; W31-R35 VanDerWaalsContact CE2-NE 3.26Å; W31-R35 HydrophobicContact CZ2-CG 4.29Å; W31-R35 VanDerWaalsContact NE1-CZ 3.28Å; W31-R35 WeakPolarHBondContact O-CG 3.45Å; W31-R35 PolarHBondContact O-N 3.27Å; W31-R35 VanDerWaalsContact O-N 3.12Å |
| 32 | Y | 95.8 | Very high | 94.5 | Very high | 159 Ų | 159 | 103.6 Ų | 103.6 | 62% | 0.624 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -58.1 | -49.8 | 175.4 | 174.1 | -98.7 | 0 | 0 | 0 | 111.7 | A28 T29 F30 | A28-Y32 PolarHBondContact O-N 3.28Å; T29-Y32 WeakPolarHBondContact O-CB 3.43Å; T29-Y32 PolarHBondContact O-N 3.09Å; F30-Y32 VanDerWaalsContact C-N 3.32Å; F30-Y32 PolarHBondContact O-N 3.36Å |
| 33 | Y | 96.3 | Very high | 94.4 | Very high | 119 Ų | 119 | 102.2 Ų | 102.2 | 47% | 0.467 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -73.9 | -42.2 | 178.6 | -66.6 | -66.7 | 0 | 0 | 0 | 112.5 | T29 F30 R35 V36 E37 | T29-Y33 HydrophobicContact CG2-CD2 4.09Å; T29-Y33 HydrophobicContact CG2-CE2 3.72Å; T29-Y33 VanDerWaalsContact O-CD2 3.24Å; T29-Y33 WeakPolarHBondContact O-CD2 3.42Å; T29-Y33 PolarHBondContact O-N 2.93Å; F30-Y33 PolarHBondContact O-N 3.21Å; Y33-R35 PolarHBondContact O-N 3.47Å; Y33-R35 VanDerWaalsContact O-N 3.15Å; Y33-V36 WeakPolarHBondContact O-CG2 3.44Å; Y33-V36 PolarHBondContact O-N 3.05Å; Y33-E37 PolarHBondContact O-N 3.39Å |
| 34 | A | 93.3 | Very high | 94.3 | Very high | 15 Ų | 15 | 104.2 Ų | 104.2 | 12% | 0.124 | 54% | 0.539 | C | S | . | . | H | α-helix | trans | -57.7 | -33.8 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | F30 V36 L38 | F30-A34 HydrophobicContact CE1-CB 4.19Å; F30-A34 HydrophobicContact CE2-CB 4.41Å; F30-A34 HydrophobicContact CZ-CB 4.11Å; F30-A34 VanDerWaalsContact O-CB 3.22Å; F30-A34 WeakPolarHBondContact O-CB 3.4Å; F30-A34 PolarHBondContact O-N 3.26Å; A34-V36 VanDerWaalsContact C-N 3.26Å; A34-V36 PolarHBondContact O-N 3.49Å; A34-L38 HydrophobicContact CB-CD1 4.04Å; A34-L38 WeakPolarHBondContact O-CA 3.5Å; A34-L38 WeakPolarHBondContact O-CB 3.35Å; A34-L38 PolarHBondContact O-N 3.15Å |
| 35 | R | 92.8 | Very high | 94.2 | Very high | 163 Ų | 163 | 102.1 Ų | 102.1 | 62% | 0.615 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -66.5 | -23 | 177.7 | -85.9 | -161.9 | 176.5 | -178.7 | 5.4 | 114.9 | W31 Y33 | W31-R35 HydrophobicContact CD2-CG 4.45Å; W31-R35 VanDerWaalsContact CE2-NE 3.26Å; W31-R35 HydrophobicContact CZ2-CG 4.29Å; W31-R35 VanDerWaalsContact NE1-CZ 3.28Å; W31-R35 WeakPolarHBondContact O-CG 3.45Å; W31-R35 PolarHBondContact O-N 3.27Å; W31-R35 VanDerWaalsContact O-N 3.12Å; Y33-R35 PolarHBondContact O-N 3.47Å; Y33-R35 VanDerWaalsContact O-N 3.15Å |
| 36 | V | 93.3 | Very high | 94.1 | Very high | 102 Ų | 102 | 103.1 Ų | 103.1 | 62% | 0.618 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -109.4 | -31 | -178 | -59.4 | 0 | 0 | 0 | 0 | 112.3 | Y33 A34 | Y33-V36 WeakPolarHBondContact O-CG2 3.44Å; Y33-V36 PolarHBondContact O-N 3.05Å; A34-V36 VanDerWaalsContact C-N 3.26Å; A34-V36 PolarHBondContact O-N 3.49Å |
| 37 | E | 93.2 | Very high | 94.1 | Very high | 144 Ų | 144 | 100.7 Ų | 100.7 | 67% | 0.673 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -97.6 | -28.4 | -176.3 | -57.5 | -174.2 | 171.2 | 0 | 0 | 113.7 | Y33 | Y33-E37 PolarHBondContact O-N 3.39Å |
| 38 | L | 92.4 | Very high | 94.1 | Very high | 96 Ų | 96 | 100.4 Ų | 100.4 | 50% | 0.503 | 54% | 0.535 | S | S | . | . | S | Bend | trans | -110 | 10.7 | -175.9 | -57.7 | 178 | 0 | 0 | 0 | 113.1 | A34 W86 | A34-L38 HydrophobicContact CB-CD1 4.04Å; A34-L38 WeakPolarHBondContact O-CA 3.5Å; A34-L38 WeakPolarHBondContact O-CB 3.35Å; A34-L38 PolarHBondContact O-N 3.15Å; L38-W86 HydrophobicContact CD2-CZ2 4.06Å |
| 39 | V | 93.2 | Very high | 94 | Very high | 84 Ų | 84 | 100.5 Ų | 100.5 | 51% | 0.509 | 54% | 0.536 | S | S | . | . | S | Bend | trans | -75.5 | 140.5 | 175.4 | 66.6 | 0 | 0 | 0 | 0 | 109.6 | ||
| 40 | P | 91.5 | Very high | 94 | Very high | 109 Ų | 109 | 100.8 Ų | 100.8 | 71% | 0.708 | 53% | 0.534 | S | S | * | . | P | Polyproline II helix | trans | -53.8 | 135.7 | 169.6 | -25.9 | 34.9 | 0 | 0 | 0 | 110.3 | ||
| 41 | P | 91.6 | Very high | 94.1 | Very high | 93 Ų | 93 | 99.8 Ų | 99.8 | 60% | 0.604 | 53% | 0.531 | S | S | * | . | P | Polyproline II helix | trans | -63 | 152.2 | -179 | 27.6 | -35.2 | 0 | 0 | 0 | 110.8 | E45 | P41-E45 HydrophobicContact CB-CB 4.48Š|
| 42 | S | 93.1 | Very high | 94 | Very high | 43 Ų | 43 | 95.9 Ų | 95.9 | 30% | 0.301 | 53% | 0.529 | S | S | . | . | P | Polyproline II helix | trans | -68.2 | 148.7 | 170.8 | 67.8 | 0 | 0 | 0 | 0 | 110.5 | S44 E45 | S42-S44 PolarHBondContact O-N 3.33Å; S42-S44 VanDerWaalsContact O-N 3.07Å; S42-S44 PolarHBondContact OG-OG 2.97Å; S42-E45 WeakPolarHBondContact CB-OE2 2.85Å; S42-E45 PolarHBondContact N-OE2 2.93Å; S42-E45 PolarHBondContact O-N 3.49Å; S42-E45 WeakPolarHBondContact OG-CG 3.49Å; S42-E45 PolarHBondContact OG-OE2 3.5Å |
| 43 | P | 92.6 | Very high | 94 | Very high | 108 Ų | 108 | 90.9 Ų | 90.9 | 70% | 0.701 | 52% | 0.52 | S | S | * | . | G | 310 helix | trans | -56.1 | -28.5 | 177.7 | -28 | 35.8 | 0 | 0 | 0 | 114.1 | E45 I46 | P43-E45 VanDerWaalsContact C-N 3.27Å; P43-E45 PolarHBondContact O-N 3.28Å; P43-I46 PolarHBondContact O-N 2.96Å |
| 44 | S | 94 | Very high | 93.9 | Very high | 91 Ų | 91 | 89.8 Ų | 89.8 | 64% | 0.636 | 52% | 0.518 | S | S | * | . | G | 310 helix | trans | -67.1 | -21.3 | 176.3 | 37.8 | 0 | 0 | 0 | 0 | 114.6 | S42 P47 | S42-S44 PolarHBondContact O-N 3.33Å; S42-S44 VanDerWaalsContact O-N 3.07Å; S42-S44 PolarHBondContact OG-OG 2.97Å; S44-P47 WeakPolarHBondContact O-CD 3.35Å |
| 45 | E | 93.6 | Very high | 94 | Very high | 105 Ų | 105 | 90.7 Ų | 90.7 | 49% | 0.491 | 53% | 0.529 | S | S | . | . | G | 310 helix | trans | -85.8 | -17 | -179.6 | -70.5 | 162.1 | 135.6 | 0 | 0 | 112.4 | P41 S42 P43 T48 A49 | P41-E45 HydrophobicContact CB-CB 4.48Å; S42-E45 WeakPolarHBondContact CB-OE2 2.85Å; S42-E45 PolarHBondContact N-OE2 2.93Å; S42-E45 PolarHBondContact O-N 3.49Å; S42-E45 WeakPolarHBondContact OG-CG 3.49Å; S42-E45 PolarHBondContact OG-OE2 3.5Å; P43-E45 VanDerWaalsContact C-N 3.27Å; P43-E45 PolarHBondContact O-N 3.28Å; E45-T48 WeakPolarHBondContact O-CB 3.42Å; E45-T48 PolarHBondContact O-N 2.98Å; E45-A49 PolarHBondContact O-N 3.08Å |
| 46 | I | 94.7 | Very high | 93.9 | Very high | 92 Ų | 92 | 89.2 Ų | 89.2 | 47% | 0.472 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -61.1 | -47.1 | -178 | -58.8 | 174.8 | 0 | 0 | 0 | 112.2 | P43 T48 A49 I50 | P43-I46 PolarHBondContact O-N 2.96Å; I46-T48 VanDerWaalsContact C-N 3.27Å; I46-T48 PolarHBondContact O-N 3.38Å; I46-A49 PolarHBondContact O-N 3.23Å; I46-I50 HydrophobicContact CG2-CD1 3.94Å; I46-I50 HydrophobicContact CG2-CG1 4.45Å; I46-I50 WeakPolarHBondContact O-CG1 3.46Å; I46-I50 PolarHBondContact O-N 2.92Å |
| 47 | P | 96.4 | Very high | 93.9 | Very high | 77 Ų | 77 | 88 Ų | 88 | 50% | 0.5 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -58.6 | -39.7 | 177.3 | -24.7 | 35.6 | 0 | 0 | 0 | 112.6 | S44 I50 E51 | S44-P47 WeakPolarHBondContact O-CD 3.35Å; P47-I50 PolarHBondContact O-N 3.15Å; P47-E51 PolarHBondContact O-N 3.47Å |
| 48 | T | 95.6 | Very high | 93.9 | Very high | 102 Ų | 102 | 88.6 Ų | 88.6 | 63% | 0.626 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -63.3 | -42.6 | 177.3 | -52.7 | 0 | 0 | 0 | 0 | 111.4 | E45 I46 I50 E51 A52 | E45-T48 WeakPolarHBondContact O-CB 3.42Å; E45-T48 PolarHBondContact O-N 2.98Å; I46-T48 VanDerWaalsContact C-N 3.27Å; I46-T48 PolarHBondContact O-N 3.38Å; T48-I50 PolarHBondContact O-N 3.39Å; T48-E51 PolarHBondContact O-N 3.28Å; T48-A52 WeakPolarHBondContact O-CB 3.48Å; T48-A52 PolarHBondContact O-N 2.93Å |
| 49 | A | 94.4 | Very high | 93.8 | Very high | 63 Ų | 63 | 85.9 Ų | 85.9 | 52% | 0.521 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.2 | -40.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | E45 I46 A52 A53 | E45-A49 PolarHBondContact O-N 3.08Å; I46-A49 PolarHBondContact O-N 3.23Å; A49-A52 PolarHBondContact O-N 3.41Å; A49-A53 PolarHBondContact O-N 3.04Å |
| 50 | I | 95.8 | Very high | 93.6 | Very high | 85 Ų | 85 | 90.2 Ų | 90.2 | 44% | 0.436 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63.6 | -45.1 | 176.1 | -68.4 | 168.5 | 0 | 0 | 0 | 110.9 | I46 P47 T48 A52 A53 K54 | I46-I50 HydrophobicContact CG2-CD1 3.94Å; I46-I50 HydrophobicContact CG2-CG1 4.45Å; I46-I50 WeakPolarHBondContact O-CG1 3.46Å; I46-I50 PolarHBondContact O-N 2.92Å; P47-I50 PolarHBondContact O-N 3.15Å; T48-I50 PolarHBondContact O-N 3.39Å; I50-A52 VanDerWaalsContact C-N 3.34Å; I50-A52 PolarHBondContact O-N 3.08Å; I50-A53 PolarHBondContact O-N 2.95Å; I50-K54 HydrophobicContact CG2-CD 4.42Å; I50-K54 WeakPolarHBondContact O-CG 3.38Å; I50-K54 PolarHBondContact O-N 3.38Å |
| 51 | E | 96.6 | Very high | 93.5 | Very high | 102 Ų | 102 | 92 Ų | 92 | 48% | 0.477 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64.5 | -38.7 | 177.4 | -72 | -54.5 | 128.6 | 0 | 0 | 112 | P47 T48 A53 K54 G55 | P47-E51 PolarHBondContact O-N 3.47Å; T48-E51 PolarHBondContact O-N 3.28Å; E51-A53 PolarHBondContact O-N 3.47Å; E51-K54 PolarHBondContact O-N 3.09Å; E51-K54 IonicContact OE1-NZ 3.67Å; E51-K54 PolarHBondContact OE1-NZ 3.33Å; E51-G55 PolarHBondContact O-N 3.46Å |
| 52 | A | 94.2 | Very high | 93.6 | Very high | 62 Ų | 62 | 92.7 Ų | 92.7 | 51% | 0.512 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -60.7 | -44.3 | 173 | 0 | 0 | 0 | 0 | 0 | 111.9 | T48 A49 I50 G55 L56 | T48-A52 WeakPolarHBondContact O-CB 3.48Å; T48-A52 PolarHBondContact O-N 2.93Å; A49-A52 PolarHBondContact O-N 3.41Å; I50-A52 VanDerWaalsContact C-N 3.34Å; I50-A52 PolarHBondContact O-N 3.08Å; A52-G55 WeakPolarHBondContact O-CA 3.41Å; A52-G55 PolarHBondContact O-N 2.72Å; A52-G55 VanDerWaalsContact O-N 3.15Å; A52-L56 PolarHBondContact O-N 3.37Å |
| 53 | A | 94.6 | Very high | 93.3 | Very high | 53 Ų | 53 | 93 Ų | 93 | 44% | 0.438 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -62 | -43.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | A49 I50 E51 G55 L56 V57 | A49-A53 PolarHBondContact O-N 3.04Å; I50-A53 PolarHBondContact O-N 2.95Å; E51-A53 PolarHBondContact O-N 3.47Å; A53-G55 VanDerWaalsContact C-N 3.28Å; A53-G55 PolarHBondContact O-N 2.98Å; A53-L56 WeakPolarHBondContact O-CB 3.45Å; A53-L56 PolarHBondContact O-N 3.28Å; A53-V57 PolarHBondContact O-N 3.5Å; A53-V57 VanDerWaalsContact O-N 3.17Å |
| 54 | K | 96.1 | Very high | 92.9 | Very high | 96 Ų | 96 | 95.5 Ų | 95.5 | 42% | 0.417 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -60 | -39.1 | 173.2 | -70.7 | 174.5 | -173.2 | 168.2 | 0 | 111.8 | I50 E51 L56 V57 R58 | I50-K54 HydrophobicContact CG2-CD 4.42Å; I50-K54 WeakPolarHBondContact O-CG 3.38Å; I50-K54 PolarHBondContact O-N 3.38Å; E51-K54 PolarHBondContact O-N 3.09Å; E51-K54 IonicContact OE1-NZ 3.67Å; E51-K54 PolarHBondContact OE1-NZ 3.33Å; K54-L56 VanDerWaalsContact C-N 3.34Å; K54-L56 PolarHBondContact O-N 3.01Å; K54-V57 PolarHBondContact O-N 3.18Å; K54-R58 WeakPolarHBondContact O-CG 3.45Å; K54-R58 PolarHBondContact O-N 3.06Å |
| 55 | G | 94 | Very high | 92.1 | Very high | 35 Ų | 35 | 97.3 Ų | 97.3 | 36% | 0.361 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -59.2 | -42.3 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | E51 A52 A53 R58 S59 | E51-G55 PolarHBondContact O-N 3.46Å; A52-G55 WeakPolarHBondContact O-CA 3.41Å; A52-G55 PolarHBondContact O-N 2.72Å; A52-G55 VanDerWaalsContact O-N 3.15Å; A53-G55 VanDerWaalsContact C-N 3.28Å; A53-G55 PolarHBondContact O-N 2.98Å; G55-R58 PolarHBondContact O-N 3.46Å; G55-S59 WeakPolarHBondContact O-CB 3.39Å; G55-S59 PolarHBondContact O-N 3.19Å |
| 56 | L | 91.7 | Very high | 91.6 | Very high | 131 Ų | 131 | 95.7 Ų | 95.7 | 69% | 0.686 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -61.7 | -44.3 | 175.1 | -67.4 | 173.7 | 0 | 0 | 0 | 111.8 | A52 A53 K54 R58 S59 Y60 | A52-L56 PolarHBondContact O-N 3.37Å; A53-L56 WeakPolarHBondContact O-CB 3.45Å; A53-L56 PolarHBondContact O-N 3.28Å; K54-L56 VanDerWaalsContact C-N 3.34Å; K54-L56 PolarHBondContact O-N 3.01Å; L56-R58 PolarHBondContact O-N 2.82Å; L56-S59 WeakPolarHBondContact O-CB 3.45Å; L56-S59 PolarHBondContact O-N 3.18Å; L56-Y60 PolarHBondContact O-N 3.41Å |
| 57 | V | 93 | Very high | 91.3 | Very high | 78 Ų | 78 | 98.6 Ų | 98.6 | 47% | 0.473 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -60.8 | -44.5 | 176.7 | 176.1 | 0 | 0 | 0 | 0 | 111.3 | A53 K54 S59 Y60 Q61 | A53-V57 PolarHBondContact O-N 3.5Å; A53-V57 VanDerWaalsContact O-N 3.17Å; K54-V57 PolarHBondContact O-N 3.18Å; V57-S59 PolarHBondContact O-N 2.84Å; V57-Y60 WeakPolarHBondContact O-CB 3.4Å; V57-Y60 PolarHBondContact O-N 3.26Å; V57-Q61 HydrophobicContact CG1-CG 4.49Å; V57-Q61 WeakPolarHBondContact O-CG 3.49Å; V57-Q61 PolarHBondContact O-N 3.34Å |
| 58 | R | 93.1 | Very high | 91 | Very high | 155 Ų | 155 | 97.4 Ų | 97.4 | 59% | 0.585 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -63.5 | -40.3 | 175.9 | -70.7 | 176.8 | -178.4 | 164.9 | 1.9 | 112.3 | K54 G55 L56 Y60 Q61 T62 | K54-R58 WeakPolarHBondContact O-CG 3.45Å; K54-R58 PolarHBondContact O-N 3.06Å; G55-R58 PolarHBondContact O-N 3.46Å; L56-R58 PolarHBondContact O-N 2.82Å; R58-Y60 VanDerWaalsContact C-N 3.28Å; R58-Y60 PolarHBondContact O-N 3.32Å; R58-Q61 PolarHBondContact O-N 3.34Å; R58-T62 WeakPolarHBondContact O-CB 3.24Å; R58-T62 WeakPolarHBondContact O-CG2 3.4Å; R58-T62 PolarHBondContact O-N 2.97Å; R58-T62 PolarHBondContact O-OG1 3.23Å |
| 59 | S | 89.4 | Confident | 90.9 | Very high | 39 Ų | 39 | 96.2 Ų | 96.2 | 27% | 0.273 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -61.9 | -38.4 | 176.6 | -172.3 | 0 | 0 | 0 | 0 | 111.7 | G55 L56 V57 T62 R64 | G55-S59 WeakPolarHBondContact O-CB 3.39Å; G55-S59 PolarHBondContact O-N 3.19Å; L56-S59 WeakPolarHBondContact O-CB 3.45Å; L56-S59 PolarHBondContact O-N 3.18Å; V57-S59 PolarHBondContact O-N 2.84Å; S59-T62 PolarHBondContact O-OG1 3.29Å; S59-R64 PolarHBondContact O-N 3.01Å; S59-R64 VanDerWaalsContact O-N 3.15Å |
| 60 | Y | 88.8 | Confident | 91 | Very high | 176 Ų | 176 | 99.2 Ų | 99.2 | 69% | 0.69 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -65.8 | -49.3 | 173.4 | -180 | -100.4 | 0 | 0 | 0 | 111.8 | L56 V57 R58 T62 G63 | L56-Y60 PolarHBondContact O-N 3.41Å; V57-Y60 WeakPolarHBondContact O-CB 3.4Å; V57-Y60 PolarHBondContact O-N 3.26Å; R58-Y60 VanDerWaalsContact C-N 3.28Å; R58-Y60 PolarHBondContact O-N 3.32Å; Y60-T62 VanDerWaalsContact C-N 3.3Å; Y60-T62 PolarHBondContact O-N 3.06Å; Y60-G63 PolarHBondContact O-N 3.38Å; Y60-G63 VanDerWaalsContact O-N 3.1Å |
| 61 | Q | 91.3 | Very high | 91 | Very high | 146 Ų | 146 | 103.7 Ų | 103.7 | 68% | 0.682 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -61.4 | -34.7 | -179.9 | -72.9 | 173.3 | -17.7 | 0 | 0 | 113.6 | V57 R58 G63 | V57-Q61 HydrophobicContact CG1-CG 4.49Å; V57-Q61 WeakPolarHBondContact O-CG 3.49Å; V57-Q61 PolarHBondContact O-N 3.34Å; R58-Q61 PolarHBondContact O-N 3.34Å; Q61-G63 PolarHBondContact O-N 3.07Å |
| 62 | T | 92.3 | Very high | 90.8 | Very high | 108 Ų | 108 | 102.6 Ų | 102.6 | 66% | 0.663 | 55% | 0.553 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82 | 1.1 | 179.5 | 53.5 | 0 | 0 | 0 | 0 | 113.4 | R58 S59 Y60 R64 | R58-T62 WeakPolarHBondContact O-CB 3.24Å; R58-T62 WeakPolarHBondContact O-CG2 3.4Å; R58-T62 PolarHBondContact O-N 2.97Å; R58-T62 PolarHBondContact O-OG1 3.23Å; S59-T62 PolarHBondContact O-OG1 3.29Å; Y60-T62 VanDerWaalsContact C-N 3.3Å; Y60-T62 PolarHBondContact O-N 3.06Å; T62-R64 PolarHBondContact O-N 2.75Å |
| 63 | G | 86.5 | Confident | 90.8 | Very high | 48 Ų | 48 | 101.8 Ų | 101.8 | 50% | 0.495 | 55% | 0.546 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 74.6 | 4.5 | 179.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | Y60 Q61 F65 G66 | Y60-G63 PolarHBondContact O-N 3.38Å; Y60-G63 VanDerWaalsContact O-N 3.1Å; Q61-G63 PolarHBondContact O-N 3.07Å; G63-F65 PolarHBondContact O-N 2.91Å; G63-F65 VanDerWaalsContact O-N 3.16Å; G63-G66 PolarHBondContact O-N 2.84Å; G63-G66 VanDerWaalsContact O-N 3.17Å |
| 64 | R | 84.2 | Confident | 90.9 | Very high | 161 Ų | 161 | 106 Ų | 106 | 61% | 0.608 | 55% | 0.554 | S | S | * | * | G | 310 helix | trans | -64.5 | -19.4 | -179.9 | -171.6 | 175.6 | 176.5 | -179.1 | -2.4 | 112.8 | S59 T62 G66 Q67 | S59-R64 PolarHBondContact O-N 3.01Å; S59-R64 VanDerWaalsContact O-N 3.15Å; T62-R64 PolarHBondContact O-N 2.75Å; R64-G66 PolarHBondContact O-N 3.42Å; R64-Q67 WeakPolarHBondContact O-CB 3.32Å; R64-Q67 PolarHBondContact O-N 2.67Å |
| 65 | F | 78.7 | Confident | 91 | Very high | 129 Ų | 129 | 108.6 Ų | 108.6 | 57% | 0.566 | 56% | 0.562 | S | S | * | * | G | 310 helix | trans | -56.2 | -33.9 | 172.9 | -174.2 | -100.6 | 0 | 0 | 0 | 113.2 | G63 Q67 T68 | G63-F65 PolarHBondContact O-N 2.91Å; G63-F65 VanDerWaalsContact O-N 3.16Å; F65-Q67 PolarHBondContact O-N 3.21Å; F65-Q67 VanDerWaalsContact O-N 3.13Å; F65-T68 WeakPolarHBondContact O-CB 3.43Å; F65-T68 PolarHBondContact O-N 3.36Å; F65-T68 VanDerWaalsContact O-N 3.14Å; F65-T68 PolarHBondContact O-OG1 3.22Å |
| 66 | G | 81.9 | Confident | 91 | Very high | 72 Ų | 72 | 111 Ų | 111 | 74% | 0.742 | 57% | 0.566 | S | S | * | * | G | 310 helix | trans | -67.2 | -10.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | G63 R64 | G63-G66 PolarHBondContact O-N 2.84Å; G63-G66 VanDerWaalsContact O-N 3.17Å; R64-G66 PolarHBondContact O-N 3.42Å |
| 67 | Q | 88.1 | Confident | 91.2 | Very high | 153 Ų | 153 | 106.3 Ų | 106.3 | 72% | 0.715 | 55% | 0.549 | S | S | * | . | G | 310 helix | trans | -93 | -3.8 | 177.5 | -56.3 | 176.1 | 3.9 | 0 | 0 | 112.5 | R64 F65 | R64-Q67 WeakPolarHBondContact O-CB 3.32Å; R64-Q67 PolarHBondContact O-N 2.67Å; F65-Q67 PolarHBondContact O-N 3.21Å; F65-Q67 VanDerWaalsContact O-N 3.13Å |
| 68 | T | 90 | Very high | 91.4 | Very high | 52 Ų | 52 | 107.2 Ų | 107.2 | 32% | 0.319 | 55% | 0.551 | S | S | . | * | trans | -74.4 | 132.3 | 179.9 | -58.4 | 0 | 0 | 0 | 0 | 110.8 | F65 E72 A73 | F65-T68 WeakPolarHBondContact O-CB 3.43Å; F65-T68 PolarHBondContact O-N 3.36Å; F65-T68 VanDerWaalsContact O-N 3.14Å; F65-T68 PolarHBondContact O-OG1 3.22Å; T68-E72 HydrophobicContact CG2-CB 3.59Å; T68-A73 HydrophobicContact CG2-CB 4.29Å | ||
| 69 | T | 94.9 | Very high | 91.6 | Very high | 76 Ų | 76 | 103.4 Ų | 103.4 | 47% | 0.466 | 55% | 0.545 | S | S | . | . | trans | -72.5 | 154.9 | 177.7 | 64.5 | 0 | 0 | 0 | 0 | 111.2 | K71 E72 A73 | T69-K71 PolarHBondContact O-N 3.32Å; T69-E72 PolarHBondContact N-OE2 3.35Å; T69-E72 PolarHBondContact O-N 3.45Å; T69-E72 VanDerWaalsContact OG1-CG 3.31Å; T69-E72 WeakPolarHBondContact OG1-CG 3.2Å; T69-E72 PolarHBondContact OG1-N 3.4Å; T69-E72 PolarHBondContact OG1-OE2 3.4Å; T69-A73 PolarHBondContact O-N 3.12Å | ||
| 70 | V | 95.3 | Very high | 91.9 | Very high | 127 Ų | 127 | 104.4 Ų | 104.4 | 77% | 0.77 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -56.4 | -37.8 | 178.3 | 178.3 | 0 | 0 | 0 | 0 | 111.8 | E72 A73 F74 | V70-E72 PolarHBondContact O-N 3.15Å; V70-A73 PolarHBondContact O-N 3.33Å; V70-F74 VanDerWaalsContact O-CB 3.29Å; V70-F74 WeakPolarHBondContact O-CB 3.41Å; V70-F74 PolarHBondContact O-N 2.85Å |
| 71 | K | 95.8 | Very high | 92.4 | Very high | 178 Ų | 178 | 99.7 Ų | 99.7 | 77% | 0.774 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -60.7 | -44.5 | 177.1 | -178.7 | -179.7 | 177 | -178.1 | 0 | 112 | T69 R75 | T69-K71 PolarHBondContact O-N 3.32Å; K71-R75 WeakPolarHBondContact O-CB 3.5Å; K71-R75 PolarHBondContact O-N 2.92Å |
| 72 | E | 93.8 | Very high | 92.6 | Very high | 80 Ų | 80 | 98.1 Ų | 98.1 | 37% | 0.374 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -69.8 | -43.6 | 179 | -71.4 | 168 | 148 | 0 | 0 | 111.5 | T68 T69 V70 F74 R75 N76 | T68-E72 HydrophobicContact CG2-CB 3.59Å; T69-E72 PolarHBondContact N-OE2 3.35Å; T69-E72 PolarHBondContact O-N 3.45Å; T69-E72 VanDerWaalsContact OG1-CG 3.31Å; T69-E72 WeakPolarHBondContact OG1-CG 3.2Å; T69-E72 PolarHBondContact OG1-N 3.4Å; T69-E72 PolarHBondContact OG1-OE2 3.4Å; V70-E72 PolarHBondContact O-N 3.15Å; E72-F74 VanDerWaalsContact C-N 3.29Å; E72-F74 PolarHBondContact O-N 3.31Å; E72-R75 PolarHBondContact O-N 3.34Å; E72-N76 WeakPolarHBondContact O-CB 3.45Å; E72-N76 PolarHBondContact O-N 2.89Å; E72-N76 PolarHBondContact O-ND2 2.81Å; E72-N76 PolarHBondContact O-OD1 3Å |
| 73 | A | 93.7 | Very high | 92.8 | Very high | 44 Ų | 44 | 97.4 Ų | 97.4 | 36% | 0.364 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -58 | -44.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | T68 T69 V70 N76 G77 | T68-A73 HydrophobicContact CG2-CB 4.29Å; T69-A73 PolarHBondContact O-N 3.12Å; V70-A73 PolarHBondContact O-N 3.33Å; A73-N76 PolarHBondContact O-N 3Å; A73-G77 PolarHBondContact O-N 2.89Å |
| 74 | F | 96.7 | Very high | 93.3 | Very high | 141 Ų | 141 | 99.4 Ų | 99.4 | 62% | 0.618 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -64.7 | -46.7 | 177.9 | -171 | -108.4 | 0 | 0 | 0 | 112.3 | V70 E72 N76 G77 L78 | V70-F74 VanDerWaalsContact O-CB 3.29Å; V70-F74 WeakPolarHBondContact O-CB 3.41Å; V70-F74 PolarHBondContact O-N 2.85Å; E72-F74 VanDerWaalsContact C-N 3.29Å; E72-F74 PolarHBondContact O-N 3.31Å; F74-N76 VanDerWaalsContact C-N 3.34Å; F74-N76 PolarHBondContact O-N 3.48Å; F74-G77 PolarHBondContact O-N 2.89Å; F74-L78 HydrophobicContact CD1-CD1 4.05Å; F74-L78 HydrophobicContact CD1-CG 4.42Å; F74-L78 HydrophobicContact CE1-CD1 3.67Å; F74-L78 HydrophobicContact CE1-CD2 4.43Å; F74-L78 HydrophobicContact CE1-CG 4.13Å; F74-L78 HydrophobicContact CZ-CD1 4.26Å; F74-L78 HydrophobicContact CZ-CD2 4.2Å; F74-L78 HydrophobicContact CZ-CG 4.31Å; F74-L78 WeakPolarHBondContact O-CG 3.22Å; F74-L78 PolarHBondContact O-N 3.49Å |
| 75 | R | 97 | Very high | 93.9 | Very high | 152 Ų | 152 | 96.2 Ų | 96.2 | 57% | 0.574 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -57.2 | -47.5 | 175.6 | -176.9 | -171.7 | 67.9 | -171.8 | -2.9 | 111.6 | K71 E72 G77 L78 V79 | K71-R75 WeakPolarHBondContact O-CB 3.5Å; K71-R75 PolarHBondContact O-N 2.92Å; E72-R75 PolarHBondContact O-N 3.34Å; R75-G77 VanDerWaalsContact C-N 3.3Å; R75-G77 PolarHBondContact O-N 3.46Å; R75-L78 PolarHBondContact O-N 2.91Å; R75-V79 PolarHBondContact O-N 3.16Å; R75-V79 VanDerWaalsContact O-N 3.15Å |
| 76 | N | 94.6 | Very high | 94.7 | Very high | 85 Ų | 85 | 96.3 Ų | 96.3 | 46% | 0.455 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -66.1 | -35.8 | -179.9 | -64.3 | -10.4 | 0 | 0 | 0 | 111.2 | E72 A73 F74 V79 A80 | E72-N76 WeakPolarHBondContact O-CB 3.45Å; E72-N76 PolarHBondContact O-N 2.89Å; E72-N76 PolarHBondContact O-ND2 2.81Å; E72-N76 PolarHBondContact O-OD1 3Å; A73-N76 PolarHBondContact O-N 3Å; F74-N76 VanDerWaalsContact C-N 3.34Å; F74-N76 PolarHBondContact O-N 3.48Å; N76-V79 PolarHBondContact O-N 3.42Å; N76-A80 WeakPolarHBondContact O-CB 3.35Å; N76-A80 PolarHBondContact O-N 3.31Å |
| 77 | G | 96 | Very high | 95.4 | Very high | 32 Ų | 32 | 99.8 Ų | 99.8 | 33% | 0.33 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -63.5 | -39.4 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | A73 F74 R75 A80 T81 | A73-G77 PolarHBondContact O-N 2.89Å; F74-G77 PolarHBondContact O-N 2.89Å; R75-G77 VanDerWaalsContact C-N 3.3Å; R75-G77 PolarHBondContact O-N 3.46Å; G77-A80 PolarHBondContact O-N 3.19Å; G77-T81 WeakPolarHBondContact O-CB 3.39Å; G77-T81 PolarHBondContact O-N 3.02Å; G77-T81 PolarHBondContact O-OG1 3.42Å |
| 78 | L | 98.1 | Very high | 95.8 | Very high | 97 Ų | 97 | 96.8 Ų | 96.8 | 51% | 0.508 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.8 | -46.1 | 174.2 | -70.3 | 176.5 | 0 | 0 | 0 | 111.5 | F74 R75 A80 T81 E82 | F74-L78 HydrophobicContact CD1-CD1 4.05Å; F74-L78 HydrophobicContact CD1-CG 4.42Å; F74-L78 HydrophobicContact CE1-CD1 3.67Å; F74-L78 HydrophobicContact CE1-CD2 4.43Å; F74-L78 HydrophobicContact CE1-CG 4.13Å; F74-L78 HydrophobicContact CZ-CD1 4.26Å; F74-L78 HydrophobicContact CZ-CD2 4.2Å; F74-L78 HydrophobicContact CZ-CG 4.31Å; F74-L78 WeakPolarHBondContact O-CG 3.22Å; F74-L78 PolarHBondContact O-N 3.49Å; R75-L78 PolarHBondContact O-N 2.91Å; L78-A80 PolarHBondContact O-N 3.33Å; L78-T81 WeakPolarHBondContact O-CB 3.34Å; L78-T81 PolarHBondContact O-N 3.35Å; L78-E82 PolarHBondContact O-N 2.9Å |
| 79 | V | 96.6 | Very high | 96 | Very high | 76 Ų | 76 | 98 Ų | 98 | 46% | 0.461 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.6 | -42.6 | 176.4 | 176.6 | 0 | 0 | 0 | 0 | 111 | R75 N76 T81 E82 V83 | R75-V79 PolarHBondContact O-N 3.16Å; R75-V79 VanDerWaalsContact O-N 3.15Å; N76-V79 PolarHBondContact O-N 3.42Å; V79-T81 VanDerWaalsContact C-N 3.3Å; V79-T81 PolarHBondContact O-N 3.3Å; V79-E82 WeakPolarHBondContact O-CB 3.26Å; V79-E82 PolarHBondContact O-N 3.29Å; V79-V83 WeakPolarHBondContact O-CG2 3.46Å; V79-V83 PolarHBondContact O-N 3.48Å |
| 80 | A | 96.4 | Very high | 96.1 | Very high | 60 Ų | 60 | 96.3 Ų | 96.3 | 50% | 0.496 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61.8 | -39.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | N76 G77 L78 V83 L84 | N76-A80 WeakPolarHBondContact O-CB 3.35Å; N76-A80 PolarHBondContact O-N 3.31Å; G77-A80 PolarHBondContact O-N 3.19Å; L78-A80 PolarHBondContact O-N 3.33Å; A80-V83 PolarHBondContact O-N 3.01Å; A80-L84 WeakPolarHBondContact O-CB 3.48Å; A80-L84 PolarHBondContact O-N 3.44Å; A80-L84 VanDerWaalsContact O-N 3.08Å |
| 81 | T | 97.8 | Very high | 96.1 | Very high | 77 Ų | 77 | 93.1 Ų | 93.1 | 47% | 0.472 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -66.2 | -42 | 176.3 | -55.7 | 0 | 0 | 0 | 0 | 111.2 | G77 L78 V79 V83 L84 M85 | G77-T81 WeakPolarHBondContact O-CB 3.39Å; G77-T81 PolarHBondContact O-N 3.02Å; G77-T81 PolarHBondContact O-OG1 3.42Å; L78-T81 WeakPolarHBondContact O-CB 3.34Å; L78-T81 PolarHBondContact O-N 3.35Å; V79-T81 VanDerWaalsContact C-N 3.3Å; V79-T81 PolarHBondContact O-N 3.3Å; T81-V83 PolarHBondContact O-N 2.98Å; T81-L84 PolarHBondContact O-N 3.43Å; T81-M85 WeakPolarHBondContact O-CG 3.34Å; T81-M85 PolarHBondContact O-N 3.05Å |
| 82 | E | 96.9 | Very high | 96.1 | Very high | 112 Ų | 112 | 86.3 Ų | 86.3 | 52% | 0.523 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -57.7 | -48.1 | 175.1 | -176.4 | -171.7 | 180 | 0 | 0 | 111.7 | L78 V79 L84 M85 W86 | L78-E82 PolarHBondContact O-N 2.9Å; V79-E82 WeakPolarHBondContact O-CB 3.26Å; V79-E82 PolarHBondContact O-N 3.29Å; E82-L84 VanDerWaalsContact C-N 3.28Å; E82-L84 PolarHBondContact O-N 2.86Å; E82-M85 WeakPolarHBondContact O-CB 3.37Å; E82-M85 PolarHBondContact O-N 3.38Å; E82-M85 VanDerWaalsContact O-N 3.09Å; E82-W86 PolarHBondContact O-N 3.38Å; E82-W86 VanDerWaalsContact O-N 3.11Å |
| 83 | V | 95.6 | Very high | 96.2 | Very high | 94 Ų | 94 | 88.7 Ų | 88.7 | 57% | 0.57 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -61.2 | -37.6 | 177 | 175.6 | 0 | 0 | 0 | 0 | 111.6 | V79 A80 T81 W86 F87 | V79-V83 WeakPolarHBondContact O-CG2 3.46Å; V79-V83 PolarHBondContact O-N 3.48Å; A80-V83 PolarHBondContact O-N 3.01Å; T81-V83 PolarHBondContact O-N 2.98Å; V83-W86 WeakPolarHBondContact O-CB 3.4Å; V83-W86 PolarHBondContact O-N 2.95Å; V83-F87 PolarHBondContact O-N 2.99Å |
| 84 | L | 96.9 | Very high | 96.3 | Very high | 90 Ų | 90 | 90 Ų | 90 | 47% | 0.471 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -68.2 | -33.5 | 175.5 | 177.5 | 146.4 | 0 | 0 | 0 | 112.2 | A80 T81 E82 W86 F87 F88 | A80-L84 WeakPolarHBondContact O-CB 3.48Å; A80-L84 PolarHBondContact O-N 3.44Å; A80-L84 VanDerWaalsContact O-N 3.08Å; T81-L84 PolarHBondContact O-N 3.43Å; E82-L84 VanDerWaalsContact C-N 3.28Å; E82-L84 PolarHBondContact O-N 2.86Å; L84-W86 VanDerWaalsContact C-N 3.33Å; L84-F87 WeakPolarHBondContact O-CB 3.49Å; L84-F87 PolarHBondContact O-N 3.06Å; L84-F88 HydrophobicContact CD2-CD2 4.05Å; L84-F88 HydrophobicContact CD2-CE2 3.57Å; L84-F88 HydrophobicContact CG-CE2 4.23Å; L84-F88 WeakPolarHBondContact O-CD2 3.36Å |
| 85 | M | 97.4 | Very high | 96.2 | Very high | 93 Ų | 93 | 85.4 Ų | 85.4 | 46% | 0.458 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -66.8 | -33.7 | 172.5 | -66.3 | -70.9 | 112.8 | 0 | 0 | 112.1 | T81 E82 F87 F88 I89 | T81-M85 WeakPolarHBondContact O-CG 3.34Å; T81-M85 PolarHBondContact O-N 3.05Å; E82-M85 WeakPolarHBondContact O-CB 3.37Å; E82-M85 PolarHBondContact O-N 3.38Å; E82-M85 VanDerWaalsContact O-N 3.09Å; M85-F87 VanDerWaalsContact C-N 3.25Å; M85-F87 PolarHBondContact O-N 3.17Å; M85-F88 HydrophobicContact CE-CD2 3.92Å; M85-F88 HydrophobicContact CE-CE2 4.16Å; M85-F88 PolarHBondContact O-N 3.05Å; M85-F88 VanDerWaalsContact O-N 3.09Å; M85-I89 WeakPolarHBondContact O-CG1 3.32Å; M85-I89 PolarHBondContact O-N 3.32Å |
| 86 | W | 95.9 | Very high | 96.1 | Very high | 131 Ų | 131 | 81.6 Ų | 81.6 | 50% | 0.496 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -59.3 | -34.7 | 173 | -81.7 | 107.7 | 0 | 0 | 0 | 113 | L38 E82 V83 L84 I89 G90 | L38-W86 HydrophobicContact CD2-CZ2 4.06Å; E82-W86 PolarHBondContact O-N 3.38Å; E82-W86 VanDerWaalsContact O-N 3.11Å; V83-W86 WeakPolarHBondContact O-CB 3.4Å; V83-W86 PolarHBondContact O-N 2.95Å; L84-W86 VanDerWaalsContact C-N 3.33Å; W86-I89 HydrophobicContact CD2-CD1 4.29Å; W86-I89 HydrophobicContact CE3-CB 4.48Å; W86-I89 HydrophobicContact CE3-CD1 3.94Å; W86-I89 HydrophobicContact CE3-CG2 4.47Å; W86-I89 HydrophobicContact CZ3-CD1 4.23Å; W86-I89 PolarHBondContact O-N 2.94Å; W86-G90 PolarHBondContact O-N 3.33Å |
| 87 | F | 95.7 | Very high | 96 | Very high | 145 Ų | 145 | 78.9 Ų | 78.9 | 64% | 0.636 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -60.6 | -46.1 | 172.1 | 170.5 | -94 | 0 | 0 | 0 | 111.8 | V83 L84 M85 I89 G90 E91 | V83-F87 PolarHBondContact O-N 2.99Å; L84-F87 WeakPolarHBondContact O-CB 3.49Å; L84-F87 PolarHBondContact O-N 3.06Å; M85-F87 VanDerWaalsContact C-N 3.25Å; M85-F87 PolarHBondContact O-N 3.17Å; F87-I89 PolarHBondContact O-N 3.27Å; F87-G90 CarbonylContact O-C 3.57Å; F87-G90 WeakPolarHBondContact O-CA 3.46Å; F87-G90 PolarHBondContact O-N 2.84Å; F87-G90 VanDerWaalsContact O-N 3.08Å; F87-E91 PolarHBondContact O-N 3.34Å |
| 88 | F | 95.8 | Very high | 95.9 | Very high | 91 Ų | 91 | 84.6 Ų | 84.6 | 40% | 0.399 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -69.2 | -30.1 | 178.1 | -69.8 | -65.5 | 0 | 0 | 0 | 113.5 | L84 M85 G90 E91 C92 | L84-F88 HydrophobicContact CD2-CD2 4.05Å; L84-F88 HydrophobicContact CD2-CE2 3.57Å; L84-F88 HydrophobicContact CG-CE2 4.23Å; L84-F88 WeakPolarHBondContact O-CD2 3.36Å; M85-F88 HydrophobicContact CE-CD2 3.92Å; M85-F88 HydrophobicContact CE-CE2 4.16Å; M85-F88 PolarHBondContact O-N 3.05Å; M85-F88 VanDerWaalsContact O-N 3.09Å; F88-G90 VanDerWaalsContact C-N 3.29Å; F88-E91 WeakPolarHBondContact CD1-OE2 3.35Å; F88-E91 WeakPolarHBondContact O-CB 3.5Å; F88-E91 PolarHBondContact O-N 3.08Å; F88-C92 PolarHBondContact O-N 2.88Å; F88-C92 PolarHBondContact O-SG 2.94Å; F88-C92 VanDerWaalsContact O-SG 3.41Å |
| 89 | I | 96.1 | Very high | 95.7 | Very high | 78 Ų | 78 | 87.8 Ų | 87.8 | 40% | 0.4 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61.5 | -43.5 | 168.7 | -66.5 | 169.6 | 0 | 0 | 0 | 109.6 | M85 W86 F87 E91 C92 I93 | M85-I89 WeakPolarHBondContact O-CG1 3.32Å; M85-I89 PolarHBondContact O-N 3.32Å; W86-I89 HydrophobicContact CD2-CD1 4.29Å; W86-I89 HydrophobicContact CE3-CB 4.48Å; W86-I89 HydrophobicContact CE3-CD1 3.94Å; W86-I89 HydrophobicContact CE3-CG2 4.47Å; W86-I89 HydrophobicContact CZ3-CD1 4.23Å; W86-I89 PolarHBondContact O-N 2.94Å; F87-I89 PolarHBondContact O-N 3.27Å; I89-E91 VanDerWaalsContact C-N 3.34Å; I89-E91 PolarHBondContact O-N 3.42Å; I89-C92 WeakPolarHBondContact O-CB 3.47Å; I89-C92 PolarHBondContact O-N 3.37Å; I89-I93 HydrophobicContact CG2-CD1 4.21Å; I89-I93 WeakPolarHBondContact O-CG1 3.42Å; I89-I93 PolarHBondContact O-N 2.98Å |
| 90 | G | 95.8 | Very high | 95.5 | Very high | 40 Ų | 40 | 86.2 Ų | 86.2 | 41% | 0.412 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -58.7 | -42.2 | 172.7 | 0 | 0 | 0 | 0 | 0 | 113 | W86 F87 F88 I93 G94 | W86-G90 PolarHBondContact O-N 3.33Å; F87-G90 CarbonylContact O-C 3.57Å; F87-G90 WeakPolarHBondContact O-CA 3.46Å; F87-G90 PolarHBondContact O-N 2.84Å; F87-G90 VanDerWaalsContact O-N 3.08Å; F88-G90 VanDerWaalsContact C-N 3.29Å; G90-I93 PolarHBondContact O-N 3.48Å; G90-G94 PolarHBondContact O-N 2.9Å |
| 91 | E | 96.2 | Very high | 95.2 | Very high | 59 Ų | 59 | 90.4 Ų | 90.4 | 28% | 0.276 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.3 | -44.5 | 173.8 | -170.2 | -159 | 122 | 0 | 0 | 111.8 | F87 F88 I89 I93 G94 K95 | F87-E91 PolarHBondContact O-N 3.34Å; F88-E91 WeakPolarHBondContact CD1-OE2 3.35Å; F88-E91 WeakPolarHBondContact O-CB 3.5Å; F88-E91 PolarHBondContact O-N 3.08Å; I89-E91 VanDerWaalsContact C-N 3.34Å; I89-E91 PolarHBondContact O-N 3.42Å; E91-I93 VanDerWaalsContact C-N 3.3Å; E91-I93 PolarHBondContact O-N 2.93Å; E91-G94 PolarHBondContact O-N 3.5Å; E91-G94 VanDerWaalsContact O-N 3.15Å; E91-K95 WeakPolarHBondContact O-CB 3.36Å; E91-K95 WeakPolarHBondContact O-CG 3.39Å; E91-K95 PolarHBondContact O-N 3.22Å; E91-K95 IonicContact OE1-NZ 2.72Å |
| 92 | C | 96.1 | Very high | 94.8 | Very high | 36 Ų | 36 | 94.7 Ų | 94.7 | 24% | 0.243 | 53% | 0.527 | C | S | . | . | H | α-helix | trans | -59.8 | -39.4 | 175.8 | -73.8 | 0 | 0 | 0 | 0 | 112.6 | F88 I89 G96 G97 | F88-C92 PolarHBondContact O-N 2.88Å; F88-C92 PolarHBondContact O-SG 2.94Å; F88-C92 VanDerWaalsContact O-SG 3.41Å; I89-C92 WeakPolarHBondContact O-CB 3.47Å; I89-C92 PolarHBondContact O-N 3.37Å; C92-G96 PolarHBondContact O-N 2.75Å; C92-G97 PolarHBondContact O-N 3.35Å |
| 93 | I | 95.1 | Very high | 94.1 | Very high | 130 Ų | 130 | 98.6 Ų | 98.6 | 67% | 0.667 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -66.1 | -47.2 | 173 | -64.9 | 166.8 | 0 | 0 | 0 | 110.1 | I89 G90 E91 K95 G96 | I89-I93 HydrophobicContact CG2-CD1 4.21Å; I89-I93 WeakPolarHBondContact O-CG1 3.42Å; I89-I93 PolarHBondContact O-N 2.98Å; G90-I93 PolarHBondContact O-N 3.48Å; E91-I93 VanDerWaalsContact C-N 3.3Å; E91-I93 PolarHBondContact O-N 2.93Å; I93-K95 PolarHBondContact O-N 3.43Å; I93-G96 PolarHBondContact O-N 2.92Å |
| 94 | G | 94.9 | Very high | 94.1 | Very high | 72 Ų | 72 | 98.9 Ų | 98.9 | 74% | 0.742 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -64.3 | -37.1 | -177.6 | 0 | 0 | 0 | 0 | 0 | 114 | G90 E91 G96 | G90-G94 PolarHBondContact O-N 2.9Å; E91-G94 PolarHBondContact O-N 3.5Å; E91-G94 VanDerWaalsContact O-N 3.15Å; G94-G96 VanDerWaalsContact C-N 3.35Å |
| 95 | K | 94.9 | Very high | 93.9 | Very high | 44 Ų | 44 | 99.3 Ų | 99.3 | 19% | 0.191 | 56% | 0.562 | C | S | . | * | H | α-helix | trans | -81.7 | -13.2 | 175.6 | 78.5 | -165.8 | -173.8 | -169 | 0 | 113.7 | E91 I93 G97 G100 Y101 | E91-K95 WeakPolarHBondContact O-CB 3.36Å; E91-K95 WeakPolarHBondContact O-CG 3.39Å; E91-K95 PolarHBondContact O-N 3.22Å; E91-K95 IonicContact OE1-NZ 2.72Å; I93-K95 PolarHBondContact O-N 3.43Å; K95-G97 WeakPolarHBondContact CE-O 3.19Å; K95-G100 WeakPolarHBondContact CD-O 3.48Å; K95-G100 WeakPolarHBondContact CE-O 3.18Å; K95-Y101 HydrophobicContact CB-CD1 3.67Å; K95-Y101 HydrophobicContact CB-CE1 3.46Å; K95-Y101 VanDerWaalsContact CB-CE1 3.46Å; K95-Y101 HydrophobicContact CD-CE1 4.41Å |
| 96 | G | 94.4 | Very high | 93.7 | Very high | 71 Ų | 71 | 99.7 Ų | 99.7 | 73% | 0.732 | 57% | 0.568 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 73.3 | 25.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | C92 I93 G94 | C92-G96 PolarHBondContact O-N 2.75Å; I93-G96 PolarHBondContact O-N 2.92Å; G94-G96 VanDerWaalsContact C-N 3.35Å |
| 97 | G | 93.1 | Very high | 93.6 | Very high | 28 Ų | 28 | 97.8 Ų | 97.8 | 29% | 0.289 | 57% | 0.572 | S | S | . | * | S | Bend | trans | -163.1 | 157.7 | -176.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | C92 K95 | C92-G97 PolarHBondContact O-N 3.35Å; K95-G97 WeakPolarHBondContact CE-O 3.19Å |
| 98 | L | 93.8 | Very high | 93.5 | Very high | 152 Ų | 152 | 94.9 Ų | 94.9 | 80% | 0.796 | 57% | 0.568 | S | S | * | * | S | Bend | trans | -83.7 | -28.7 | 177.1 | -64.5 | 180 | 0 | 0 | 0 | 112.4 | ||
| 99 | I | 94.4 | Very high | 93.3 | Very high | 164 Ų | 164 | 95.1 Ų | 95.1 | 84% | 0.841 | 58% | 0.58 | S | S | * | * | S | Bend | trans | -125.5 | 119.8 | -171.3 | -55.7 | 174.5 | 0 | 0 | 0 | 109.1 | ||
| 100 | G | 91.9 | Very high | 93.1 | Very high | 44 Ų | 44 | 96.4 Ų | 96.4 | 45% | 0.454 | 59% | 0.592 | S | S | . | * | S | Bend | trans | 60.9 | -176.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | K95 | K95-G100 WeakPolarHBondContact CD-O 3.48Å; K95-G100 WeakPolarHBondContact CE-O 3.18Å |
| 101 | Y | 91.7 | Very high | 92.9 | Very high | 147 Ų | 147 | 100.7 Ų | 100.7 | 58% | 0.576 | 61% | 0.606 | S | S | * | * | trans | -94.8 | 141.6 | 164.4 | -75.4 | -89.3 | 0 | 0 | 0 | 108.4 | K95 V103 | K95-Y101 HydrophobicContact CB-CD1 3.67Å; K95-Y101 HydrophobicContact CB-CE1 3.46Å; K95-Y101 VanDerWaalsContact CB-CE1 3.46Å; K95-Y101 HydrophobicContact CD-CE1 4.41Å; Y101-V103 VanDerWaalsContact C-N 3.32Å; Y101-V103 PolarHBondContact O-N 2.99Å; Y101-V103 VanDerWaalsContact O-N 3.08Å | ||
| 102 | N | 88.2 | Confident | 92.6 | Very high | 168 Ų | 168 | 104.2 Ų | 104.2 | 90% | 0.898 | 63% | 0.634 | S | S | * | * | trans | -80.8 | 84.4 | 171.2 | -170.1 | 26.4 | 0 | 0 | 0 | 108.6 | ||||
| 103 | V | 82.9 | Confident | 92.3 | Very high | 194 Ų | 194 | 110.4 Ų | 110.4 | 100% | 1.176 | 67% | 0.669 | S | S | * | * | trans | -91.7 | 0 | 179.3 | -64.9 | 0 | 0 | 0 | 0 | 112.2 | Y101 | Y101-V103 VanDerWaalsContact C-N 3.32Å; Y101-V103 PolarHBondContact O-N 2.99Å; Y101-V103 VanDerWaalsContact O-N 3.08Å |
Retrieved 103 of 103 residues in 154.6 ms
(Link to these results)