| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 45.1 | Very low | 61 | Low | 240 Ų | 240 | 120.9 Ų | 120.9 | 100% | 1.182 | 65% | 0.648 | S | S | * | * | 0 | 93.4 | 0 | -4.9 | -173.9 | -176.8 | 0 | 0 | 106.5 | N3 | M1-N3 PolarHBondContact O-N 3.43Š| |||
| 2 | A | 42.9 | Very low | 62.1 | Low | 99 Ų | 99 | 116.1 Ų | 116.1 | 82% | 0.818 | 63% | 0.625 | S | S | * | * | trans | -83.4 | 103 | 177.1 | 0 | 0 | 0 | 0 | 0 | 106.9 | V4 | A2-V4 PolarHBondContact O-N 3.33Å; A2-V4 VanDerWaalsContact O-N 3.08Å | ||
| 3 | N | 51.5 | Low | 63.3 | Low | 97 Ų | 97 | 118.8 Ų | 118.8 | 52% | 0.519 | 63% | 0.628 | S | S | . | * | trans | -71.6 | 102.8 | 178.6 | -161.3 | 48.8 | 0 | 0 | 0 | 107.5 | M1 Y5 S6 | M1-N3 PolarHBondContact O-N 3.43Å; N3-Y5 PolarHBondContact O-N 3.42Å; N3-S6 PolarHBondContact ND2-OG 3.13Å; N3-S6 WeakPolarHBondContact O-CB 3.44Å; N3-S6 PolarHBondContact O-N 3.29Å | ||
| 4 | V | 53.5 | Low | 64.4 | Low | 113 Ų | 113 | 112.4 Ų | 112.4 | 69% | 0.685 | 61% | 0.605 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.1 | -17.3 | 178.1 | 156.8 | 0 | 0 | 0 | 0 | 112.5 | A2 | A2-V4 PolarHBondContact O-N 3.33Å; A2-V4 VanDerWaalsContact O-N 3.08Å |
| 5 | Y | 51 | Low | 65 | Low | 214 Ų | 214 | 106.3 Ų | 106.3 | 84% | 0.839 | 57% | 0.572 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.7 | -4 | 175.6 | -65.5 | -81 | 0 | 0 | 0 | 114.8 | N3 | N3-Y5 PolarHBondContact O-N 3.42Š|
| 6 | S | 64.2 | Low | 65.7 | Low | 52 Ų | 52 | 106.6 Ų | 106.6 | 36% | 0.364 | 57% | 0.573 | S | S | . | * | S | Bend | trans | -91.5 | 134.7 | 175 | -65.3 | 0 | 0 | 0 | 0 | 110.2 | N3 D8 G9 L10 | N3-S6 PolarHBondContact ND2-OG 3.13Å; N3-S6 WeakPolarHBondContact O-CB 3.44Å; N3-S6 PolarHBondContact O-N 3.29Å; S6-D8 PolarHBondContact O-N 3.46Å; S6-G9 PolarHBondContact O-N 3.04Å; S6-L10 PolarHBondContact O-N 3.17Å |
| 7 | F | 70.6 | Confident | 66.2 | Low | 174 Ų | 174 | 107.2 Ų | 107.2 | 76% | 0.763 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -47.4 | -36 | -178.9 | -101.3 | -91.9 | 0 | 0 | 0 | 113.3 | G9 L10 L11 | F7-G9 PolarHBondContact O-N 2.97Å; F7-L10 PolarHBondContact O-N 3.23Å; F7-L11 WeakPolarHBondContact O-CB 3.03Å; F7-L11 WeakPolarHBondContact O-CG 3.36Å; F7-L11 PolarHBondContact O-N 2.92Å |
| 8 | D | 70.8 | Confident | 66.6 | Low | 95 Ų | 95 | 104.9 Ų | 104.9 | 51% | 0.508 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -57.8 | -43.3 | 175.1 | -68 | -74.1 | 0 | 0 | 0 | 113.8 | S6 L11 V12 M66 | S6-D8 PolarHBondContact O-N 3.46Å; D8-L11 PolarHBondContact O-N 3.28Å; D8-V12 VanDerWaalsContact O-CG2 3.29Å; D8-V12 WeakPolarHBondContact O-CG2 3.03Å; D8-V12 PolarHBondContact O-N 3.18Å; D8-M66 HydrophobicContact CB-CE 3.59Å; D8-M66 WeakPolarHBondContact OD1-CE 3.36Å |
| 9 | G | 71.9 | Confident | 66.9 | Low | 31 Ų | 31 | 101.5 Ų | 101.5 | 32% | 0.32 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -68.6 | -38.5 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | S6 F7 V12 F13 | S6-G9 PolarHBondContact O-N 3.04Å; F7-G9 PolarHBondContact O-N 2.97Å; G9-V12 PolarHBondContact O-N 3.42Å; G9-F13 WeakPolarHBondContact O-CB 3.49Å; G9-F13 PolarHBondContact O-N 3Å |
| 10 | L | 76.1 | Confident | 67.2 | Low | 120 Ų | 120 | 100.1 Ų | 100.1 | 63% | 0.628 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -67 | -39.9 | 176.5 | -158.6 | 80.9 | 0 | 0 | 0 | 111.3 | S6 F7 F13 G14 | S6-L10 PolarHBondContact O-N 3.17Å; F7-L10 PolarHBondContact O-N 3.23Å; L10-F13 PolarHBondContact O-N 3.23Å; L10-G14 PolarHBondContact O-N 3.4Å |
| 11 | L | 73.8 | Confident | 67.2 | Low | 95 Ų | 95 | 96.4 Ų | 96.4 | 50% | 0.497 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -59 | -54.6 | 172.3 | -78.2 | 168.1 | 0 | 0 | 0 | 110.3 | F7 D8 F13 G14 L15 | F7-L11 WeakPolarHBondContact O-CB 3.03Å; F7-L11 WeakPolarHBondContact O-CG 3.36Å; F7-L11 PolarHBondContact O-N 2.92Å; D8-L11 PolarHBondContact O-N 3.28Å; L11-F13 VanDerWaalsContact C-N 3.29Å; L11-F13 PolarHBondContact O-N 2.85Å; L11-G14 PolarHBondContact O-N 3.27Å; L11-G14 VanDerWaalsContact O-N 3.11Å; L11-L15 VanDerWaalsContact C-CD1 3.49Å; L11-L15 HydrophobicContact CB-CD1 4.22Å; L11-L15 WeakPolarHBondContact O-CD1 3.35Å; L11-L15 PolarHBondContact O-N 2.97Å |
| 12 | V | 74.2 | Confident | 68.2 | Low | 63 Ų | 63 | 85.7 Ų | 85.7 | 38% | 0.382 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -57.2 | -41.6 | -179.9 | 173 | 0 | 0 | 0 | 0 | 111.9 | D8 G9 L15 L16 M66 | D8-V12 VanDerWaalsContact O-CG2 3.29Å; D8-V12 WeakPolarHBondContact O-CG2 3.03Å; D8-V12 PolarHBondContact O-N 3.18Å; G9-V12 PolarHBondContact O-N 3.42Å; V12-L15 PolarHBondContact O-N 3.24Å; V12-L16 WeakPolarHBondContact O-CB 3.32Å; V12-L16 PolarHBondContact O-N 3.23Å; V12-M66 HydrophobicContact CG2-CE 4.3Å; V12-M66 HydrophobicContact CG2-SD 3.84Å |
| 13 | F | 77.1 | Confident | 69.3 | Low | 151 Ų | 151 | 88.7 Ų | 88.7 | 66% | 0.662 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -64 | -44.6 | 177 | -167.9 | -95.8 | 0 | 0 | 0 | 112.2 | G9 L10 L11 L16 F17 | G9-F13 WeakPolarHBondContact O-CB 3.49Å; G9-F13 PolarHBondContact O-N 3Å; L10-F13 PolarHBondContact O-N 3.23Å; L11-F13 VanDerWaalsContact C-N 3.29Å; L11-F13 PolarHBondContact O-N 2.85Å; F13-L16 PolarHBondContact O-N 3.45Å; F13-F17 WeakPolarHBondContact O-CB 3.04Å; F13-F17 PolarHBondContact O-N 2.74Å |
| 14 | G | 79.1 | Confident | 70 | Confident | 29 Ų | 29 | 87.8 Ų | 87.8 | 30% | 0.299 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -62.3 | -42.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | L10 L11 F17 I18 | L10-G14 PolarHBondContact O-N 3.4Å; L11-G14 PolarHBondContact O-N 3.27Å; L11-G14 VanDerWaalsContact O-N 3.11Å; G14-F17 PolarHBondContact O-N 3.14Å; G14-I18 WeakPolarHBondContact O-CD1 3.39Å; G14-I18 VanDerWaalsContact O-CG1 3.25Å; G14-I18 WeakPolarHBondContact O-CG1 3.28Å; G14-I18 PolarHBondContact O-N 2.94Å |
| 15 | L | 73.9 | Confident | 70.4 | Confident | 21 Ų | 21 | 85 Ų | 85 | 11% | 0.11 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -58.7 | -48.5 | 174.3 | -88.6 | 101.8 | 0 | 0 | 0 | 111.9 | L11 V12 F17 I18 C19 V59 C63 | L11-L15 VanDerWaalsContact C-CD1 3.49Å; L11-L15 HydrophobicContact CB-CD1 4.22Å; L11-L15 WeakPolarHBondContact O-CD1 3.35Å; L11-L15 PolarHBondContact O-N 2.97Å; V12-L15 PolarHBondContact O-N 3.24Å; L15-F17 VanDerWaalsContact C-N 3.31Å; L15-F17 PolarHBondContact O-N 2.63Å; L15-I18 PolarHBondContact O-N 3.02Å; L15-C19 WeakPolarHBondContact O-CB 3.21Å; L15-C19 PolarHBondContact O-N 3.47Å; L15-C19 PolarHBondContact O-SG 2.88Å; L15-C19 VanDerWaalsContact O-SG 3.41Å; L15-V59 HydrophobicContact CB-CG1 4.29Å; L15-V59 HydrophobicContact CD2-CB 4.5Å; L15-V59 HydrophobicContact CD2-CG1 3.6Å; L15-V59 WeakPolarHBondContact CD2-O 3.2Å; L15-V59 HydrophobicContact CG-CG1 3.68Å; L15-C63 HydrophobicContact CD2-CB 3.6Å |
| 16 | L | 75.5 | Confident | 70.8 | Confident | 112 Ų | 112 | 83.3 Ų | 83.3 | 59% | 0.586 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -63.6 | -37.9 | 179.4 | -157.7 | 78 | 0 | 0 | 0 | 111.8 | V12 F13 T20 | V12-L16 WeakPolarHBondContact O-CB 3.32Å; V12-L16 PolarHBondContact O-N 3.23Å; F13-L16 PolarHBondContact O-N 3.45Å; L16-T20 WeakPolarHBondContact O-CB 3.44Å; L16-T20 PolarHBondContact O-N 3.01Å; L16-T20 PolarHBondContact O-OG1 3.03Å |
| 17 | F | 74.4 | Confident | 70.7 | Confident | 117 Ų | 117 | 82.7 Ų | 82.7 | 51% | 0.513 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -64.5 | -45.9 | 176.6 | -166.8 | -98 | 0 | 0 | 0 | 111.8 | F13 G14 L15 T20 C21 | F13-F17 WeakPolarHBondContact O-CB 3.04Å; F13-F17 PolarHBondContact O-N 2.74Å; G14-F17 PolarHBondContact O-N 3.14Å; L15-F17 VanDerWaalsContact C-N 3.31Å; L15-F17 PolarHBondContact O-N 2.63Å; F17-T20 WeakPolarHBondContact O-CB 3.31Å; F17-T20 PolarHBondContact O-N 3.25Å; F17-C21 PolarHBondContact O-N 3.34Å; F17-C21 PolarHBondContact O-SG 3.26Å |
| 18 | I | 73.7 | Confident | 69.9 | Low | 66 Ų | 66 | 79 Ų | 79 | 34% | 0.338 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -63.7 | -43.7 | 177.4 | -64.7 | 161.1 | 0 | 0 | 0 | 111.1 | G14 L15 T20 C21 A22 | G14-I18 WeakPolarHBondContact O-CD1 3.39Å; G14-I18 VanDerWaalsContact O-CG1 3.25Å; G14-I18 WeakPolarHBondContact O-CG1 3.28Å; G14-I18 PolarHBondContact O-N 2.94Å; L15-I18 PolarHBondContact O-N 3.02Å; I18-T20 VanDerWaalsContact C-N 3.31Å; I18-T20 PolarHBondContact O-N 3.12Å; I18-C21 WeakPolarHBondContact O-CB 3.45Å; I18-C21 PolarHBondContact O-N 3.45Å; I18-A22 PolarHBondContact O-N 3.49Å |
| 19 | C | 72.4 | Confident | 69 | Low | 39 Ų | 39 | 85.3 Ų | 85.3 | 26% | 0.264 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -60.2 | -40.4 | 175.3 | -76.6 | 0 | 0 | 0 | 0 | 112 | L15 A22 Y23 | L15-C19 WeakPolarHBondContact O-CB 3.21Å; L15-C19 PolarHBondContact O-N 3.47Å; L15-C19 PolarHBondContact O-SG 2.88Å; L15-C19 VanDerWaalsContact O-SG 3.41Å; C19-A22 PolarHBondContact O-N 3.1Å; C19-Y23 WeakPolarHBondContact O-CB 3.17Å; C19-Y23 PolarHBondContact O-N 3.07Å |
| 20 | T | 73.3 | Confident | 68.2 | Low | 74 Ų | 74 | 86.6 Ų | 86.6 | 45% | 0.454 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -63.3 | -43.4 | 175.7 | -57.1 | 0 | 0 | 0 | 0 | 111.1 | L16 F17 I18 A22 Y23 L24 | L16-T20 WeakPolarHBondContact O-CB 3.44Å; L16-T20 PolarHBondContact O-N 3.01Å; L16-T20 PolarHBondContact O-OG1 3.03Å; F17-T20 WeakPolarHBondContact O-CB 3.31Å; F17-T20 PolarHBondContact O-N 3.25Å; I18-T20 VanDerWaalsContact C-N 3.31Å; I18-T20 PolarHBondContact O-N 3.12Å; T20-A22 VanDerWaalsContact C-N 3.31Å; T20-A22 PolarHBondContact O-N 3.28Å; T20-Y23 PolarHBondContact O-N 3.46Å; T20-L24 HydrophobicContact CG2-CD1 4.44Å; T20-L24 VanDerWaalsContact O-CG 3.32Å; T20-L24 WeakPolarHBondContact O-CG 3.32Å; T20-L24 PolarHBondContact O-N 3.03Å |
| 21 | C | 65.7 | Low | 67 | Low | 23 Ų | 23 | 85 Ų | 85 | 16% | 0.155 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -61.7 | -38.5 | 175.6 | -65 | 0 | 0 | 0 | 0 | 112.3 | F17 I18 K25 | F17-C21 PolarHBondContact O-N 3.34Å; F17-C21 PolarHBondContact O-SG 3.26Å; I18-C21 WeakPolarHBondContact O-CB 3.45Å; I18-C21 PolarHBondContact O-N 3.45Å; C21-K25 PolarHBondContact O-N 2.66Å |
| 22 | A | 66.4 | Low | 66 | Low | 15 Ų | 15 | 83.4 Ų | 83.4 | 12% | 0.124 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -71.2 | -37.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | I18 C19 T20 K25 K26 T53 | I18-A22 PolarHBondContact O-N 3.49Å; C19-A22 PolarHBondContact O-N 3.1Å; T20-A22 VanDerWaalsContact C-N 3.31Å; T20-A22 PolarHBondContact O-N 3.28Å; A22-K25 WeakPolarHBondContact O-CB 3.36Å; A22-K25 PolarHBondContact O-N 2.8Å; A22-K26 PolarHBondContact O-N 3.28Å; A22-T53 HydrophobicContact CB-CG2 4.29Å |
| 23 | Y | 67.3 | Low | 65 | Low | 161 Ų | 161 | 91.7 Ų | 91.7 | 63% | 0.631 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -61.8 | -44.6 | 175.8 | -173 | -97.4 | 0 | 0 | 0 | 111.2 | C19 T20 K25 K26 V27 | C19-Y23 WeakPolarHBondContact O-CB 3.17Å; C19-Y23 PolarHBondContact O-N 3.07Å; T20-Y23 PolarHBondContact O-N 3.46Å; Y23-K25 PolarHBondContact O-N 3.18Å; Y23-K26 PolarHBondContact O-N 2.78Å; Y23-V27 HydrophobicContact CD1-CG2 3.99Å; Y23-V27 HydrophobicContact CE1-CG2 3.63Å; Y23-V27 WeakPolarHBondContact O-CG2 3.41Å; Y23-V27 PolarHBondContact O-N 2.98Å |
| 24 | L | 65.9 | Low | 63.8 | Low | 79 Ų | 79 | 87 Ų | 87 | 41% | 0.414 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -58.2 | -32.8 | 175.1 | -70.1 | 168 | 0 | 0 | 0 | 112.8 | T20 | T20-L24 HydrophobicContact CG2-CD1 4.44Å; T20-L24 VanDerWaalsContact O-CG 3.32Å; T20-L24 WeakPolarHBondContact O-CG 3.32Å; T20-L24 PolarHBondContact O-N 3.03Å |
| 25 | K | 60.3 | Low | 62.3 | Low | 53 Ų | 53 | 91.5 Ų | 91.5 | 23% | 0.23 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -71.7 | -33.4 | 174.4 | -173.3 | -176.2 | 176.2 | -158.6 | 0 | 112.8 | C21 A22 Y23 K31 F46 V50 T53 | C21-K25 PolarHBondContact O-N 2.66Å; A22-K25 WeakPolarHBondContact O-CB 3.36Å; A22-K25 PolarHBondContact O-N 2.8Å; Y23-K25 PolarHBondContact O-N 3.18Å; K25-K31 WeakPolarHBondContact O-CE 3.39Å; K25-F46 HydrophobicContact CG-CE2 4.12Å; K25-V50 HydrophobicContact CD-CG2 4.26Å; K25-V50 VanDerWaalsContact CE-CG2 3.4Å; K25-T53 HydrophobicContact CD-CG2 4.34Å; K25-T53 PolarHBondContact NZ-OG1 3.34Å |
| 26 | K | 59.8 | Low | 61.2 | Low | 179 Ų | 179 | 94.3 Ų | 94.3 | 78% | 0.778 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -77.9 | -28.4 | -178.7 | -160.5 | 171.5 | -174.2 | -178.9 | 0 | 112.2 | A22 Y23 P28 | A22-K26 PolarHBondContact O-N 3.28Å; Y23-K26 PolarHBondContact O-N 2.78Å; K26-P28 WeakPolarHBondContact O-CD 3.49Å |
| 27 | V | 62.9 | Low | 60.1 | Low | 39 Ų | 39 | 97.2 Ų | 97.2 | 24% | 0.236 | 49% | 0.49 | C | S | . | . | trans | -75.5 | 102.8 | 173 | -176.4 | 0 | 0 | 0 | 0 | 109.5 | Y23 R29 V30 | Y23-V27 HydrophobicContact CD1-CG2 3.99Å; Y23-V27 HydrophobicContact CE1-CG2 3.63Å; Y23-V27 WeakPolarHBondContact O-CG2 3.41Å; Y23-V27 PolarHBondContact O-N 2.98Å; V27-R29 HydrophobicContact CG1-CB 4.08Å; V27-R29 PolarHBondContact O-N 3.22Å; V27-V30 HydrophobicContact CB-CG2 4.06Å; V27-V30 HydrophobicContact CG1-CG2 3.62Å | ||
| 28 | P | 54.2 | Low | 58.7 | Low | 97 Ų | 97 | 100.4 Ų | 100.4 | 63% | 0.63 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -74.2 | -18.5 | -176.1 | -8.2 | 27.4 | 0 | 0 | 0 | 111.8 | K26 V30 K31 | K26-P28 WeakPolarHBondContact O-CD 3.49Å; P28-V30 VanDerWaalsContact C-N 3.35Å; P28-V30 PolarHBondContact O-N 2.78Å; P28-K31 WeakPolarHBondContact O-CB 3.46Å; P28-K31 PolarHBondContact O-N 3.36Å |
| 29 | R | 50.9 | Low | 57.3 | Low | 228 Ų | 228 | 108.7 Ų | 108.7 | 86% | 0.86 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -65.8 | -30.1 | -177.5 | -87.2 | -100.9 | -82.9 | 175.2 | -6.2 | 113.9 | V27 | V27-R29 HydrophobicContact CG1-CB 4.08Å; V27-R29 PolarHBondContact O-N 3.22Å |
| 30 | V | 55.6 | Low | 56.9 | Low | 58 Ų | 58 | 109.6 Ų | 109.6 | 35% | 0.352 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -82.7 | -22.7 | 179 | -144 | 0 | 0 | 0 | 0 | 111.5 | V27 P28 G32 W33 L34 | V27-V30 HydrophobicContact CB-CG2 4.06Å; V27-V30 HydrophobicContact CG1-CG2 3.62Å; P28-V30 VanDerWaalsContact C-N 3.35Å; P28-V30 PolarHBondContact O-N 2.78Å; V30-G32 VanDerWaalsContact C-N 3.34Å; V30-G32 PolarHBondContact O-N 2.89Å; V30-W33 PolarHBondContact O-N 3.12Å; V30-L34 HydrophobicContact CG1-CD1 4.4Å; V30-L34 WeakPolarHBondContact O-CB 3.39Å; V30-L34 PolarHBondContact O-N 3.32Å; V30-L34 VanDerWaalsContact O-N 3.13Å |
| 31 | K | 51.4 | Low | 56.1 | Low | 86 Ų | 86 | 111.1 Ų | 111.1 | 37% | 0.374 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -63.1 | -38.2 | 178.1 | -65.8 | -174.7 | 178.8 | -179.3 | 0 | 112.6 | K25 P28 L35 | K25-K31 WeakPolarHBondContact O-CE 3.39Å; P28-K31 WeakPolarHBondContact O-CB 3.46Å; P28-K31 PolarHBondContact O-N 3.36Å; K31-L35 WeakPolarHBondContact O-CB 3.39Å; K31-L35 PolarHBondContact O-N 2.97Å |
| 32 | G | 52.2 | Low | 55.7 | Low | 62 Ų | 62 | 116.8 Ų | 116.8 | 64% | 0.639 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -67.8 | -36.2 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | V30 | V30-G32 VanDerWaalsContact C-N 3.34Å; V30-G32 PolarHBondContact O-N 2.89Å |
| 33 | W | 53 | Low | 55.3 | Low | 237 Ų | 237 | 118.1 Ų | 118.1 | 90% | 0.898 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -82.6 | -25.1 | -179.7 | -135.7 | 63.7 | 0 | 0 | 0 | 112.5 | V30 | V30-W33 PolarHBondContact O-N 3.12Å |
| 34 | L | 51.2 | Low | 55.1 | Low | 51 Ų | 51 | 115.1 Ų | 115.1 | 27% | 0.267 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -108.3 | -21.1 | -167.5 | -157.7 | 137.6 | 0 | 0 | 0 | 114 | V30 A36 W42 | V30-L34 HydrophobicContact CG1-CD1 4.4Å; V30-L34 WeakPolarHBondContact O-CB 3.39Å; V30-L34 PolarHBondContact O-N 3.32Å; V30-L34 VanDerWaalsContact O-N 3.13Å; L34-A36 VanDerWaalsContact C-N 3.29Å; L34-W42 HydrophobicContact CD1-CD2 4.09Å; L34-W42 HydrophobicContact CD1-CE3 4.13Å; L34-W42 HydrophobicContact CD1-CH2 3.23Å; L34-W42 HydrophobicContact CD1-CZ2 3.23Å; L34-W42 HydrophobicContact CD1-CZ3 3.7Å; L34-W42 HydrophobicContact CD2-CB 4.02Å; L34-W42 HydrophobicContact CD2-CD2 3.14Å; L34-W42 HydrophobicContact CD2-CE3 3Å; L34-W42 HydrophobicContact CD2-CG 3.62Å; L34-W42 HydrophobicContact CD2-CH2 3.81Å; L34-W42 HydrophobicContact CD2-CZ2 3.99Å; L34-W42 HydrophobicContact CD2-CZ3 3.33Å; L34-W42 HydrophobicContact CG-CD2 4.1Å; L34-W42 HydrophobicContact CG-CE3 4.11Å; L34-W42 HydrophobicContact CG-CH2 4.1Å; L34-W42 HydrophobicContact CG-CZ2 4.15Å; L34-W42 HydrophobicContact CG-CZ3 4.08Å |
| 35 | L | 49 | Very low | 54.8 | Low | 124 Ų | 124 | 116.2 Ų | 116.2 | 65% | 0.649 | 59% | 0.589 | S | S | * | * | S | Bend | trans | -87 | 0.5 | 170.4 | -150.1 | 77.4 | 0 | 0 | 0 | 112.7 | K31 E37 K38 | K31-L35 WeakPolarHBondContact O-CB 3.39Å; K31-L35 PolarHBondContact O-N 2.97Å; L35-E37 VanDerWaalsContact C-N 3.33Å; L35-K38 WeakPolarHBondContact O-CG 3.34Å |
| 36 | A | 51 | Low | 54.9 | Low | 81 Ų | 81 | 118.2 Ų | 118.2 | 67% | 0.669 | 60% | 0.597 | S | S | * | * | S | Bend | trans | -71.3 | -30.9 | 170.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | L34 K38 | L34-A36 VanDerWaalsContact C-N 3.29Å; A36-K38 PolarHBondContact O-N 2.95Å |
| 37 | E | 50.7 | Low | 55.1 | Low | 172 Ų | 172 | 117 Ų | 117 | 80% | 0.804 | 59% | 0.592 | S | S | * | * | S | Bend | trans | -96.7 | 72.1 | 179.4 | -159.8 | 147.3 | 84.7 | 0 | 0 | 110.3 | L35 R39 | L35-E37 VanDerWaalsContact C-N 3.33Å; E37-R39 PolarHBondContact O-N 3.36Å |
| 38 | K | 45.1 | Very low | 55.1 | Low | 184 Ų | 184 | 117.7 Ų | 117.7 | 80% | 0.8 | 60% | 0.602 | S | S | * | * | trans | -64.7 | 38.8 | -171.2 | -66.5 | -163.1 | -176.8 | -168.1 | 0 | 116.4 | L35 A36 | L35-K38 WeakPolarHBondContact O-CG 3.34Å; A36-K38 PolarHBondContact O-N 2.95Å | ||
| 39 | R | 45 | Very low | 55.6 | Low | 240 Ų | 240 | 113.6 Ų | 113.6 | 91% | 0.906 | 58% | 0.576 | S | S | * | * | S | Bend | trans | -148.1 | 121.7 | 169.9 | -66.6 | -166.7 | -175 | -136.4 | 2.4 | 111.9 | E37 | E37-R39 PolarHBondContact O-N 3.36Š|
| 40 | G | 63.8 | Low | 56.4 | Low | 58 Ų | 58 | 105.3 Ų | 105.3 | 60% | 0.598 | 55% | 0.55 | S | S | * | * | S | Bend | trans | 132.6 | -166.5 | 163.3 | 0 | 0 | 0 | 0 | 0 | 117.2 | W42 G43 | G40-W42 PolarHBondContact O-N 2.98Å; G40-G43 PolarHBondContact O-N 3.4Å |
| 41 | V | 57.4 | Low | 57 | Low | 107 Ų | 107 | 108.4 Ų | 108.4 | 65% | 0.648 | 56% | 0.564 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -48.9 | -26.4 | -169.5 | -141.6 | 0 | 0 | 0 | 0 | 114.6 | G43 V44 F45 | V41-G43 VanDerWaalsContact C-N 3.32Å; V41-G43 PolarHBondContact O-N 2.93Å; V41-V44 WeakPolarHBondContact O-CB 3.47Å; V41-V44 PolarHBondContact O-N 3.37Å; V41-V44 VanDerWaalsContact O-N 3.14Å; V41-F45 PolarHBondContact O-N 3.41Å; V41-F45 VanDerWaalsContact O-N 3.13Å |
| 42 | W | 56.3 | Low | 57.5 | Low | 141 Ų | 141 | 105.1 Ų | 105.1 | 53% | 0.534 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -67.1 | -25.2 | 178.9 | -89.4 | 90.1 | 0 | 0 | 0 | 114.9 | L34 G40 V44 F45 F46 | L34-W42 HydrophobicContact CD1-CD2 4.09Å; L34-W42 HydrophobicContact CD1-CE3 4.13Å; L34-W42 HydrophobicContact CD1-CH2 3.23Å; L34-W42 HydrophobicContact CD1-CZ2 3.23Å; L34-W42 HydrophobicContact CD1-CZ3 3.7Å; L34-W42 HydrophobicContact CD2-CB 4.02Å; L34-W42 HydrophobicContact CD2-CD2 3.14Å; L34-W42 HydrophobicContact CD2-CE3 3Å; L34-W42 HydrophobicContact CD2-CG 3.62Å; L34-W42 HydrophobicContact CD2-CH2 3.81Å; L34-W42 HydrophobicContact CD2-CZ2 3.99Å; L34-W42 HydrophobicContact CD2-CZ3 3.33Å; L34-W42 HydrophobicContact CG-CD2 4.1Å; L34-W42 HydrophobicContact CG-CE3 4.11Å; L34-W42 HydrophobicContact CG-CH2 4.1Å; L34-W42 HydrophobicContact CG-CZ2 4.15Å; L34-W42 HydrophobicContact CG-CZ3 4.08Å; G40-W42 PolarHBondContact O-N 2.98Å; W42-V44 VanDerWaalsContact C-N 3.34Å; W42-F45 PolarHBondContact O-N 3.42Å; W42-F46 PolarHBondContact O-N 2.99Å |
| 43 | G | 58.8 | Low | 58 | Low | 43 Ų | 43 | 104.9 Ų | 104.9 | 44% | 0.443 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -67.9 | -34.4 | 170.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | G40 V41 F46 K47 | G40-G43 PolarHBondContact O-N 3.4Å; V41-G43 VanDerWaalsContact C-N 3.32Å; V41-G43 PolarHBondContact O-N 2.93Å; G43-F46 PolarHBondContact O-N 2.97Å; G43-K47 PolarHBondContact O-N 3.33Å; G43-K47 VanDerWaalsContact O-N 3.12Å |
| 44 | V | 62.6 | Low | 58.6 | Low | 99 Ų | 99 | 104.1 Ų | 104.1 | 60% | 0.6 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -71.5 | -42.1 | 174.8 | -177.7 | 0 | 0 | 0 | 0 | 109.9 | V41 W42 F46 K47 A48 | V41-V44 WeakPolarHBondContact O-CB 3.47Å; V41-V44 PolarHBondContact O-N 3.37Å; V41-V44 VanDerWaalsContact O-N 3.14Å; W42-V44 VanDerWaalsContact C-N 3.34Å; V44-F46 VanDerWaalsContact C-N 3.28Å; V44-F46 PolarHBondContact O-N 3.36Å; V44-K47 PolarHBondContact O-N 3.27Å; V44-A48 WeakPolarHBondContact O-CB 3.49Å; V44-A48 PolarHBondContact O-N 3.34Å |
| 45 | F | 60.1 | Low | 59.3 | Low | 101 Ų | 101 | 107.1 Ų | 107.1 | 44% | 0.443 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -59.1 | -37 | 173 | -93.9 | -90.2 | 0 | 0 | 0 | 112.8 | V41 W42 S49 | V41-F45 PolarHBondContact O-N 3.41Å; V41-F45 VanDerWaalsContact O-N 3.13Å; W42-F45 PolarHBondContact O-N 3.42Å; F45-S49 WeakPolarHBondContact O-CB 3.44Å; F45-S49 PolarHBondContact O-N 3.44Å; F45-S49 PolarHBondContact O-OG 3.14Å |
| 46 | F | 63 | Low | 60.1 | Low | 95 Ų | 95 | 103.8 Ų | 103.8 | 42% | 0.417 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -68.6 | -44.6 | 175.7 | -168.4 | -96.5 | 0 | 0 | 0 | 112.3 | K25 W42 G43 V44 S49 V50 | K25-F46 HydrophobicContact CG-CE2 4.12Å; W42-F46 PolarHBondContact O-N 2.99Å; G43-F46 PolarHBondContact O-N 2.97Å; V44-F46 VanDerWaalsContact C-N 3.28Å; V44-F46 PolarHBondContact O-N 3.36Å; F46-S49 WeakPolarHBondContact CA-OG 3.45Å; F46-S49 PolarHBondContact O-N 3.01Å; F46-S49 PolarHBondContact O-OG 3.38Å; F46-V50 HydrophobicContact CD1-CG2 4.25Å; F46-V50 HydrophobicContact CE1-CG2 4.06Å; F46-V50 WeakPolarHBondContact O-CG2 3.46Å; F46-V50 PolarHBondContact O-N 2.96Å |
| 47 | K | 63.9 | Low | 60.8 | Low | 154 Ų | 154 | 106.3 Ų | 106.3 | 67% | 0.67 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -64.2 | -42.1 | 174.4 | -72.9 | -170.1 | -175.4 | -170.6 | 0 | 111.8 | G43 V44 V50 I51 | G43-K47 PolarHBondContact O-N 3.33Å; G43-K47 VanDerWaalsContact O-N 3.12Å; V44-K47 PolarHBondContact O-N 3.27Å; K47-V50 PolarHBondContact O-N 3.13Å; K47-I51 WeakPolarHBondContact O-CG1 3.45Å; K47-I51 PolarHBondContact O-N 3.03Å |
| 48 | A | 63.1 | Low | 61.8 | Low | 53 Ų | 53 | 102.2 Ų | 102.2 | 44% | 0.438 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.9 | -41.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112 | V44 V50 I51 G52 | V44-A48 WeakPolarHBondContact O-CB 3.49Å; V44-A48 PolarHBondContact O-N 3.34Å; A48-V50 VanDerWaalsContact C-N 3.34Å; A48-I51 PolarHBondContact O-N 3.02Å; A48-G52 PolarHBondContact O-N 3.48Å |
| 49 | S | 64.3 | Low | 62.9 | Low | 12 Ų | 12 | 94.4 Ų | 94.4 | 8% | 0.084 | 49% | 0.49 | C | S | . | . | H | α-helix | trans | -72.2 | -25.1 | 175.1 | 46.9 | 0 | 0 | 0 | 0 | 112.8 | F45 F46 T53 | F45-S49 WeakPolarHBondContact O-CB 3.44Å; F45-S49 PolarHBondContact O-N 3.44Å; F45-S49 PolarHBondContact O-OG 3.14Å; F46-S49 WeakPolarHBondContact CA-OG 3.45Å; F46-S49 PolarHBondContact O-N 3.01Å; F46-S49 PolarHBondContact O-OG 3.38Å; S49-T53 VanDerWaalsContact O-CG2 3.31Å; S49-T53 WeakPolarHBondContact O-CG2 3.43Å; S49-T53 PolarHBondContact O-N 3.19Å; S49-T53 PolarHBondContact O-OG1 2.94Å |
| 50 | V | 67.2 | Low | 64 | Low | 54 Ų | 54 | 84.5 Ų | 84.5 | 33% | 0.327 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -69.2 | -44.5 | 168.4 | 176.8 | 0 | 0 | 0 | 0 | 111.9 | K25 F46 K47 A48 G52 T53 | K25-V50 HydrophobicContact CD-CG2 4.26Å; K25-V50 VanDerWaalsContact CE-CG2 3.4Å; F46-V50 HydrophobicContact CD1-CG2 4.25Å; F46-V50 HydrophobicContact CE1-CG2 4.06Å; F46-V50 WeakPolarHBondContact O-CG2 3.46Å; F46-V50 PolarHBondContact O-N 2.96Å; K47-V50 PolarHBondContact O-N 3.13Å; A48-V50 VanDerWaalsContact C-N 3.34Å; V50-G52 VanDerWaalsContact C-N 3.33Å; V50-T53 WeakPolarHBondContact CA-OG1 3.31Å; V50-T53 PolarHBondContact O-N 2.95Å; V50-T53 PolarHBondContact O-OG1 2.96Å |
| 51 | I | 67.7 | Low | 64.5 | Low | 123 Ų | 123 | 87 Ų | 87 | 63% | 0.631 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -63 | -44.7 | 174.4 | -66.7 | 158.7 | 0 | 0 | 0 | 109.7 | K47 A48 T53 R54 L55 | K47-I51 WeakPolarHBondContact O-CG1 3.45Å; K47-I51 PolarHBondContact O-N 3.03Å; A48-I51 PolarHBondContact O-N 3.02Å; I51-T53 VanDerWaalsContact C-N 3.31Å; I51-T53 PolarHBondContact O-N 3.48Å; I51-R54 WeakPolarHBondContact O-CB 3.46Å; I51-R54 PolarHBondContact O-N 3.02Å; I51-L55 PolarHBondContact O-N 3.04Å |
| 52 | G | 62.8 | Low | 65.4 | Low | 17 Ų | 17 | 84.3 Ų | 84.3 | 18% | 0.175 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -55.9 | -41.4 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | A48 V50 R54 L55 H56 | A48-G52 PolarHBondContact O-N 3.48Å; V50-G52 VanDerWaalsContact C-N 3.33Å; G52-R54 PolarHBondContact O-N 3.3Å; G52-L55 CarbonylContact O-C 3.48Å; G52-L55 PolarHBondContact O-N 3.49Å; G52-H56 WeakPolarHBondContact O-CA 3.07Å; G52-H56 VanDerWaalsContact O-CB 3.32Å; G52-H56 WeakPolarHBondContact O-CB 3.25Å; G52-H56 PolarHBondContact O-N 2.83Å |
| 53 | T | 63.1 | Low | 66.1 | Low | 56 Ų | 56 | 79.8 Ų | 79.8 | 34% | 0.344 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -62.7 | -22.2 | 176.6 | 47.6 | 0 | 0 | 0 | 0 | 114.5 | A22 K25 S49 V50 I51 | A22-T53 HydrophobicContact CB-CG2 4.29Å; K25-T53 HydrophobicContact CD-CG2 4.34Å; K25-T53 PolarHBondContact NZ-OG1 3.34Å; S49-T53 VanDerWaalsContact O-CG2 3.31Å; S49-T53 WeakPolarHBondContact O-CG2 3.43Å; S49-T53 PolarHBondContact O-N 3.19Å; S49-T53 PolarHBondContact O-OG1 2.94Å; V50-T53 WeakPolarHBondContact CA-OG1 3.31Å; V50-T53 PolarHBondContact O-N 2.95Å; V50-T53 PolarHBondContact O-OG1 2.96Å; I51-T53 VanDerWaalsContact C-N 3.31Å; I51-T53 PolarHBondContact O-N 3.48Å |
| 54 | R | 63.7 | Low | 67 | Low | 221 Ų | 221 | 81.8 Ų | 81.8 | 83% | 0.834 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -79.2 | -30.9 | 173.8 | -64.5 | -68.6 | 177.4 | 178.1 | -2 | 112.5 | I51 G52 | I51-R54 WeakPolarHBondContact O-CB 3.46Å; I51-R54 PolarHBondContact O-N 3.02Å; G52-R54 PolarHBondContact O-N 3.3Å |
| 55 | L | 65.8 | Low | 67.8 | Low | 114 Ų | 114 | 80.6 Ų | 80.6 | 60% | 0.597 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -93.1 | -6 | 175.1 | -156.4 | 68.5 | 0 | 0 | 0 | 113.1 | I51 G52 L57 T58 V59 | I51-L55 PolarHBondContact O-N 3.04Å; G52-L55 CarbonylContact O-C 3.48Å; G52-L55 PolarHBondContact O-N 3.49Å; L55-L57 VanDerWaalsContact C-N 3.27Å; L55-L57 PolarHBondContact O-N 2.93Å; L55-T58 PolarHBondContact O-N 2.78Å; L55-T58 PolarHBondContact O-OG1 3.5Å; L55-V59 WeakPolarHBondContact O-CG2 3.25Å; L55-V59 PolarHBondContact O-N 2.71Å |
| 56 | H | 67.1 | Low | 68.3 | Low | 54 Ų | 54 | 78.6 Ų | 78.6 | 25% | 0.25 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -66.4 | -25.6 | -174.4 | -169.1 | -78.4 | 0 | 0 | 0 | 113.2 | G52 A60 | G52-H56 WeakPolarHBondContact O-CA 3.07Å; G52-H56 VanDerWaalsContact O-CB 3.32Å; G52-H56 WeakPolarHBondContact O-CB 3.25Å; G52-H56 PolarHBondContact O-N 2.83Å; H56-A60 WeakPolarHBondContact O-CB 3.38Å; H56-A60 PolarHBondContact O-N 3.42Å |
| 57 | L | 65.4 | Low | 68.8 | Low | 134 Ų | 134 | 76.5 Ų | 76.5 | 70% | 0.702 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -68.8 | -44.6 | -178.7 | -166.5 | 67.1 | 0 | 0 | 0 | 111.6 | L55 A60 L61 | L55-L57 VanDerWaalsContact C-N 3.27Å; L55-L57 PolarHBondContact O-N 2.93Å; L57-A60 PolarHBondContact O-N 3.29Å; L57-L61 PolarHBondContact O-N 3.44Å; L57-L61 VanDerWaalsContact O-N 3.1Å |
| 58 | T | 72 | Confident | 69.7 | Low | 87 Ų | 87 | 75 Ų | 75 | 53% | 0.534 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -68.3 | -38.6 | 175.5 | 33.7 | 0 | 0 | 0 | 0 | 111.9 | L55 L61 S62 | L55-T58 PolarHBondContact O-N 2.78Å; L55-T58 PolarHBondContact O-OG1 3.5Å; T58-L61 PolarHBondContact O-N 2.97Å; T58-S62 PolarHBondContact O-N 3.49Å; T58-S62 VanDerWaalsContact O-N 3.07Å; T58-S62 PolarHBondContact O-OG 2.99Å |
| 59 | V | 67.9 | Low | 70.3 | Confident | 20 Ų | 20 | 79.8 Ų | 79.8 | 12% | 0.121 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -65.5 | -41.4 | 175.6 | 167.6 | 0 | 0 | 0 | 0 | 112.1 | L15 L55 S62 C63 | L15-V59 HydrophobicContact CB-CG1 4.29Å; L15-V59 HydrophobicContact CD2-CB 4.5Å; L15-V59 HydrophobicContact CD2-CG1 3.6Å; L15-V59 WeakPolarHBondContact CD2-O 3.2Å; L15-V59 HydrophobicContact CG-CG1 3.68Å; L55-V59 WeakPolarHBondContact O-CG2 3.25Å; L55-V59 PolarHBondContact O-N 2.71Å; V59-S62 PolarHBondContact O-N 3.24Å; V59-S62 PolarHBondContact O-OG 3.07Å; V59-C63 PolarHBondContact O-N 3.42Å |
| 60 | A | 67.2 | Low | 70.7 | Confident | 32 Ų | 32 | 83.4 Ų | 83.4 | 26% | 0.264 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -66.4 | -40.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | H56 L57 S62 C63 V64 | H56-A60 WeakPolarHBondContact O-CB 3.38Å; H56-A60 PolarHBondContact O-N 3.42Å; L57-A60 PolarHBondContact O-N 3.29Å; A60-S62 PolarHBondContact O-N 2.92Å; A60-C63 PolarHBondContact O-N 2.98Å; A60-V64 VanDerWaalsContact O-CG2 3.28Å; A60-V64 WeakPolarHBondContact O-CG2 3.22Å; A60-V64 PolarHBondContact O-N 3.47Å |
| 61 | L | 75.8 | Confident | 71.2 | Confident | 110 Ų | 110 | 87.5 Ų | 87.5 | 58% | 0.576 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -59.9 | -43.7 | 175.5 | -91.5 | 156.3 | 0 | 0 | 0 | 112.3 | L57 T58 V64 T65 | L57-L61 PolarHBondContact O-N 3.44Å; L57-L61 VanDerWaalsContact O-N 3.1Å; T58-L61 PolarHBondContact O-N 2.97Å; L61-V64 PolarHBondContact O-N 2.97Å; L61-T65 PolarHBondContact O-N 3.28Å; L61-T65 PolarHBondContact O-OG1 3.41Å |
| 62 | S | 76.3 | Confident | 71.6 | Confident | 51 Ų | 51 | 89.5 Ų | 89.5 | 36% | 0.357 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -68.8 | -36.3 | 176.9 | 54.2 | 0 | 0 | 0 | 0 | 112.5 | T58 V59 A60 T65 M66 | T58-S62 PolarHBondContact O-N 3.49Å; T58-S62 VanDerWaalsContact O-N 3.07Å; T58-S62 PolarHBondContact O-OG 2.99Å; V59-S62 PolarHBondContact O-N 3.24Å; V59-S62 PolarHBondContact O-OG 3.07Å; A60-S62 PolarHBondContact O-N 2.92Å; S62-T65 VanDerWaalsContact CA-OG1 3.25Å; S62-T65 WeakPolarHBondContact CA-OG1 3.48Å; S62-T65 PolarHBondContact O-OG1 2.92Å; S62-M66 VanDerWaalsContact O-CB 3.31Å; S62-M66 WeakPolarHBondContact O-CB 3.47Å; S62-M66 PolarHBondContact O-N 3.35Å |
| 63 | C | 71.3 | Confident | 71.6 | Confident | 45 Ų | 45 | 95 Ų | 95 | 30% | 0.304 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -65.7 | -41.6 | 175.1 | -138.3 | 0 | 0 | 0 | 0 | 112.4 | L15 V59 A60 M66 A67 | L15-C63 HydrophobicContact CD2-CB 3.6Å; V59-C63 PolarHBondContact O-N 3.42Å; A60-C63 PolarHBondContact O-N 2.98Å; C63-M66 PolarHBondContact O-N 3.11Å; C63-A67 WeakPolarHBondContact O-CB 3.29Å; C63-A67 PolarHBondContact O-N 2.86Å |
| 64 | V | 76.1 | Confident | 71.3 | Confident | 85 Ų | 85 | 102.3 Ų | 102.3 | 52% | 0.515 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -66.9 | -44.2 | 178.2 | 171.7 | 0 | 0 | 0 | 0 | 110.8 | A60 L61 A67 F68 | A60-V64 VanDerWaalsContact O-CG2 3.28Å; A60-V64 WeakPolarHBondContact O-CG2 3.22Å; A60-V64 PolarHBondContact O-N 3.47Å; L61-V64 PolarHBondContact O-N 2.97Å; V64-A67 PolarHBondContact O-N 2.89Å; V64-F68 HydrophobicContact CG1-CD2 4.05Å; V64-F68 HydrophobicContact CG1-CE2 4.28Å; V64-F68 WeakPolarHBondContact O-CD2 3.22Å; V64-F68 PolarHBondContact O-N 3.35Å |
| 65 | T | 79.3 | Confident | 71.7 | Confident | 74 Ų | 74 | 96.4 Ų | 96.4 | 45% | 0.454 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.9 | -48.3 | 175.4 | 31.3 | 0 | 0 | 0 | 0 | 110.7 | L61 S62 A67 F68 Y69 | L61-T65 PolarHBondContact O-N 3.28Å; L61-T65 PolarHBondContact O-OG1 3.41Å; S62-T65 VanDerWaalsContact CA-OG1 3.25Å; S62-T65 WeakPolarHBondContact CA-OG1 3.48Å; S62-T65 PolarHBondContact O-OG1 2.92Å; T65-A67 VanDerWaalsContact C-N 3.33Å; T65-A67 PolarHBondContact O-N 3.47Å; T65-F68 WeakPolarHBondContact O-CB 3.43Å; T65-F68 PolarHBondContact O-N 2.95Å; T65-F68 VanDerWaalsContact O-N 3.12Å; T65-Y69 VanDerWaalsContact O-CD2 3.22Å; T65-Y69 WeakPolarHBondContact O-CD2 2.95Å; T65-Y69 PolarHBondContact O-N 3.42Å |
| 66 | M | 72.4 | Confident | 72 | Confident | 59 Ų | 59 | 95.4 Ų | 95.4 | 29% | 0.291 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.6 | -36.6 | -179.9 | -154.3 | 156.4 | -168 | 0 | 0 | 113.2 | D8 V12 S62 C63 Y69 V70 | D8-M66 HydrophobicContact CB-CE 3.59Å; D8-M66 WeakPolarHBondContact OD1-CE 3.36Å; V12-M66 HydrophobicContact CG2-CE 4.3Å; V12-M66 HydrophobicContact CG2-SD 3.84Å; S62-M66 VanDerWaalsContact O-CB 3.31Å; S62-M66 WeakPolarHBondContact O-CB 3.47Å; S62-M66 PolarHBondContact O-N 3.35Å; C63-M66 PolarHBondContact O-N 3.11Å; M66-Y69 PolarHBondContact O-N 2.87Å; M66-V70 WeakPolarHBondContact O-CG2 3.46Å; M66-V70 PolarHBondContact O-N 3.02Å |
| 67 | A | 73.3 | Confident | 72.3 | Confident | 51 Ų | 51 | 97.7 Ų | 97.7 | 42% | 0.421 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.1 | -42.2 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | C63 V64 T65 V70 L71 | C63-A67 WeakPolarHBondContact O-CB 3.29Å; C63-A67 PolarHBondContact O-N 2.86Å; V64-A67 PolarHBondContact O-N 2.89Å; T65-A67 VanDerWaalsContact C-N 3.33Å; T65-A67 PolarHBondContact O-N 3.47Å; A67-V70 PolarHBondContact O-N 3.43Å; A67-L71 WeakPolarHBondContact O-CB 3.03Å; A67-L71 PolarHBondContact O-N 3.47Å |
| 68 | F | 81.1 | Confident | 72.7 | Confident | 124 Ų | 124 | 95.6 Ų | 95.6 | 54% | 0.544 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62.1 | -42.9 | 173.1 | -99.7 | -91.1 | 0 | 0 | 0 | 111.8 | V64 T65 L71 F72 | V64-F68 HydrophobicContact CG1-CD2 4.05Å; V64-F68 HydrophobicContact CG1-CE2 4.28Å; V64-F68 WeakPolarHBondContact O-CD2 3.22Å; V64-F68 PolarHBondContact O-N 3.35Å; T65-F68 WeakPolarHBondContact O-CB 3.43Å; T65-F68 PolarHBondContact O-N 2.95Å; T65-F68 VanDerWaalsContact O-N 3.12Å; F68-L71 PolarHBondContact O-N 3.35Å; F68-F72 AromaticContact CD1-CD2 3.7Å; F68-F72 HydrophobicContact CD1-CD2 3.7Å; F68-F72 AromaticContact CD1-CE2 3.75Å; F68-F72 HydrophobicContact CD1-CE2 3.75Å; F68-F72 HydrophobicContact CE1-CD2 4.16Å; F68-F72 AromaticContact CE1-CE2 3.71Å; F68-F72 HydrophobicContact CE1-CE2 3.71Å; F68-F72 WeakPolarHBondContact O-CB 3.34Å; F68-F72 PolarHBondContact O-N 3.08Å |
| 69 | Y | 76.3 | Confident | 72.7 | Confident | 153 Ų | 153 | 96.1 Ų | 96.1 | 60% | 0.6 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -60.5 | -44.6 | 175.1 | -89.9 | -82.3 | 0 | 0 | 0 | 111.7 | T65 M66 L71 L73 | T65-Y69 VanDerWaalsContact O-CD2 3.22Å; T65-Y69 WeakPolarHBondContact O-CD2 2.95Å; T65-Y69 PolarHBondContact O-N 3.42Å; M66-Y69 PolarHBondContact O-N 2.87Å; Y69-L71 PolarHBondContact O-N 2.94Å; Y69-L73 HydrophobicContact CD1-CD1 3.25Å; Y69-L73 HydrophobicContact CD1-CG 4.49Å; Y69-L73 HydrophobicContact CE1-CD1 3.41Å; Y69-L73 VanDerWaalsContact CE1-CD1 3.41Å; Y69-L73 HydrophobicContact CG-CD1 4.32Å; Y69-L73 WeakPolarHBondContact O-CA 3.47Å; Y69-L73 WeakPolarHBondContact O-CB 3.49Å; Y69-L73 PolarHBondContact O-N 3.01Å |
| 70 | V | 73.7 | Confident | 73 | Confident | 87 Ų | 87 | 101.2 Ų | 101.2 | 53% | 0.527 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -69.9 | -30.9 | 178.2 | 173.4 | 0 | 0 | 0 | 0 | 112.7 | M66 A67 K74 | M66-V70 WeakPolarHBondContact O-CG2 3.46Å; M66-V70 PolarHBondContact O-N 3.02Å; A67-V70 PolarHBondContact O-N 3.43Å; V70-K74 WeakPolarHBondContact O-CB 3.43Å |
| 71 | L | 76.3 | Confident | 73.4 | Confident | 140 Ų | 140 | 106.1 Ų | 106.1 | 73% | 0.733 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -82.9 | -32.6 | 179.8 | -90.5 | 162.6 | 0 | 0 | 0 | 114.2 | A67 F68 Y69 | A67-L71 WeakPolarHBondContact O-CB 3.03Å; A67-L71 PolarHBondContact O-N 3.47Å; F68-L71 PolarHBondContact O-N 3.35Å; Y69-L71 PolarHBondContact O-N 2.94Å |
| 72 | F | 76 | Confident | 73.3 | Confident | 166 Ų | 166 | 105.8 Ų | 105.8 | 73% | 0.728 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -101.6 | -30.9 | -176.1 | -88.6 | -87.6 | 0 | 0 | 0 | 114.3 | F68 | F68-F72 AromaticContact CD1-CD2 3.7Å; F68-F72 HydrophobicContact CD1-CD2 3.7Å; F68-F72 AromaticContact CD1-CE2 3.75Å; F68-F72 HydrophobicContact CD1-CE2 3.75Å; F68-F72 HydrophobicContact CE1-CD2 4.16Å; F68-F72 AromaticContact CE1-CE2 3.71Å; F68-F72 HydrophobicContact CE1-CE2 3.71Å; F68-F72 WeakPolarHBondContact O-CB 3.34Å; F68-F72 PolarHBondContact O-N 3.08Å |
| 73 | L | 63.9 | Low | 73 | Confident | 133 Ų | 133 | 110.4 Ų | 110.4 | 70% | 0.696 | 56% | 0.56 | S | S | * | * | trans | -102 | -5 | -174.1 | -96 | 145.1 | 0 | 0 | 0 | 113.8 | Y69 | Y69-L73 HydrophobicContact CD1-CD1 3.25Å; Y69-L73 HydrophobicContact CD1-CG 4.49Å; Y69-L73 HydrophobicContact CE1-CD1 3.41Å; Y69-L73 VanDerWaalsContact CE1-CD1 3.41Å; Y69-L73 HydrophobicContact CG-CD1 4.32Å; Y69-L73 WeakPolarHBondContact O-CA 3.47Å; Y69-L73 WeakPolarHBondContact O-CB 3.49Å; Y69-L73 PolarHBondContact O-N 3.01Å | ||
| 74 | K | 56.5 | Low | 73.2 | Confident | 208 Ų | 208 | 116.4 Ų | 116.4 | 90% | 0.904 | 58% | 0.583 | S | S | * | * | trans | -125.1 | 0 | 179.3 | 173.4 | 168 | 167.6 | 51.6 | 0 | 111 | V70 | V70-K74 WeakPolarHBondContact O-CB 3.43Š|
Retrieved 74 of 74 residues in 471.7 ms
(Link to these results)