| 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 | 50.9 | Low | 67.8 | Low | 237 Ų | 237 | 117.8 Ų | 117.8 | 100% | 1.167 | 60% | 0.596 | S | S | * | * | 0 | 101.2 | 0 | -83.4 | 155.5 | 77.1 | 0 | 0 | 107.1 | N3 | M1-N3 PolarHBondContact O-N 3.38Š| |||
| 2 | F | 54.7 | Low | 68.2 | Low | 170 Ų | 170 | 116.3 Ų | 116.3 | 75% | 0.746 | 59% | 0.59 | S | S | * | * | trans | -70.6 | 120.9 | 171.1 | -130.1 | -94 | 0 | 0 | 0 | 106.3 | D4 | F2-D4 PolarHBondContact O-N 3Š| ||
| 3 | N | 66.8 | Low | 68.2 | Low | 105 Ų | 105 | 120.4 Ų | 120.4 | 56% | 0.561 | 59% | 0.594 | S | S | * | * | trans | -69.2 | 120.8 | -170.7 | -136.6 | 28.4 | 0 | 0 | 0 | 108.9 | M1 S5 E6 | M1-N3 PolarHBondContact O-N 3.38Å; N3-S5 VanDerWaalsContact CG-OG 3.31Å; N3-S5 PolarHBondContact ND2-OG 2.97Å; N3-S5 PolarHBondContact O-N 3.46Å; N3-E6 HydrophobicContact CB-CG 4.22Å; N3-E6 WeakPolarHBondContact O-CB 3.4Å; N3-E6 PolarHBondContact O-N 3.31Å | ||
| 4 | D | 73.3 | Confident | 68.1 | Low | 135 Ų | 135 | 122.9 Ų | 122.9 | 72% | 0.722 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -53.3 | -24.3 | 179.2 | -73 | -82.2 | 0 | 0 | 0 | 113.6 | F2 L7 A8 | F2-D4 PolarHBondContact O-N 3Å; D4-L7 PolarHBondContact O-N 2.9Å; D4-A8 WeakPolarHBondContact O-CB 3.06Å; D4-A8 PolarHBondContact O-N 2.94Å |
| 5 | S | 73.9 | Confident | 68 | Low | 63 Ų | 63 | 122.5 Ų | 122.5 | 44% | 0.441 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -65.8 | -34.7 | 174.5 | 43.6 | 0 | 0 | 0 | 0 | 113.9 | N3 T9 | N3-S5 VanDerWaalsContact CG-OG 3.31Å; N3-S5 PolarHBondContact ND2-OG 2.97Å; N3-S5 PolarHBondContact O-N 3.46Å; S5-T9 WeakPolarHBondContact O-CB 3.35Å; S5-T9 PolarHBondContact O-N 2.89Å; S5-T9 PolarHBondContact O-OG1 3.14Å |
| 6 | E | 72.4 | Confident | 68 | Low | 117 Ų | 117 | 126.2 Ų | 126.2 | 55% | 0.547 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -69.6 | -43.5 | 176.2 | -69 | -101.3 | 95.9 | 0 | 0 | 110.4 | N3 A8 T9 L10 | N3-E6 HydrophobicContact CB-CG 4.22Å; N3-E6 WeakPolarHBondContact O-CB 3.4Å; N3-E6 PolarHBondContact O-N 3.31Å; E6-A8 PolarHBondContact O-N 2.84Å; E6-T9 PolarHBondContact O-N 3.26Å; E6-L10 WeakPolarHBondContact O-CG 3.48Å; E6-L10 PolarHBondContact O-N 3.48Å |
| 7 | L | 73 | Confident | 67.5 | Low | 101 Ų | 101 | 124.2 Ų | 124.2 | 53% | 0.529 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -62.6 | -42 | 175.7 | -98 | 164.3 | 0 | 0 | 0 | 112.1 | D4 T9 L10 R11 | D4-L7 PolarHBondContact O-N 2.9Å; L7-T9 VanDerWaalsContact C-N 3.31Å; L7-T9 PolarHBondContact O-N 3.34Å; L7-L10 PolarHBondContact O-N 3.23Å; L7-R11 WeakPolarHBondContact O-CB 3.42Å; L7-R11 PolarHBondContact O-N 3.06Å |
| 8 | A | 71.2 | Confident | 67.1 | Low | 33 Ų | 33 | 119.7 Ų | 119.7 | 27% | 0.273 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -63.4 | -39.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112 | D4 E6 N12 | D4-A8 WeakPolarHBondContact O-CB 3.06Å; D4-A8 PolarHBondContact O-N 2.94Å; E6-A8 PolarHBondContact O-N 2.84Å; A8-N12 PolarHBondContact O-N 3.47Å; A8-N12 VanDerWaalsContact O-N 3.11Å |
| 9 | T | 74.9 | Confident | 67.2 | Low | 73 Ų | 73 | 118.5 Ų | 118.5 | 45% | 0.448 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -68.7 | -42.7 | 179.1 | -55.6 | 0 | 0 | 0 | 0 | 111.5 | S5 E6 L7 N12 R13 | S5-T9 WeakPolarHBondContact O-CB 3.35Å; S5-T9 PolarHBondContact O-N 2.89Å; S5-T9 PolarHBondContact O-OG1 3.14Å; E6-T9 PolarHBondContact O-N 3.26Å; L7-T9 VanDerWaalsContact C-N 3.31Å; L7-T9 PolarHBondContact O-N 3.34Å; T9-N12 PolarHBondContact O-N 3.25Å; T9-R13 PolarHBondContact O-N 3.43Å; T9-R13 VanDerWaalsContact O-N 3.11Å |
| 10 | L | 67.9 | Low | 66.8 | Low | 90 Ų | 90 | 117.1 Ų | 117.1 | 47% | 0.471 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -63.4 | -46.3 | 176 | -74.3 | 169.3 | 0 | 0 | 0 | 111.8 | E6 L7 N12 R13 F14 | E6-L10 WeakPolarHBondContact O-CG 3.48Å; E6-L10 PolarHBondContact O-N 3.48Å; L7-L10 PolarHBondContact O-N 3.23Å; L10-N12 VanDerWaalsContact C-N 3.3Å; L10-N12 PolarHBondContact O-N 3.35Å; L10-R13 PolarHBondContact O-N 3.42Å; L10-R13 VanDerWaalsContact O-N 3.14Å; L10-F14 WeakPolarHBondContact O-CD2 3.25Å; L10-F14 PolarHBondContact O-N 2.87Å |
| 11 | R | 66.2 | Low | 66.2 | Low | 172 Ų | 172 | 117.1 Ų | 117.1 | 65% | 0.649 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -58.9 | -41.3 | 177.1 | 178.6 | 174.1 | 59 | -169.6 | -5.1 | 112.2 | L7 R13 F14 K15 | L7-R11 WeakPolarHBondContact O-CB 3.42Å; L7-R11 PolarHBondContact O-N 3.06Å; R11-R13 VanDerWaalsContact C-N 3.33Å; R11-F14 PolarHBondContact O-N 3.34Å; R11-K15 WeakPolarHBondContact O-CB 3.4Å; R11-K15 PolarHBondContact O-N 2.95Å |
| 12 | N | 73.4 | Confident | 66.2 | Low | 99 Ų | 99 | 112 Ų | 112 | 53% | 0.529 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -67.2 | -34.5 | 178.2 | -76.7 | -11.9 | 0 | 0 | 0 | 112.4 | A8 T9 L10 R16 | A8-N12 PolarHBondContact O-N 3.47Å; A8-N12 VanDerWaalsContact O-N 3.11Å; T9-N12 PolarHBondContact O-N 3.25Å; L10-N12 VanDerWaalsContact C-N 3.3Å; L10-N12 PolarHBondContact O-N 3.35Å; N12-R16 WeakPolarHBondContact O-CB 3.36Å; N12-R16 PolarHBondContact O-N 3.16Å |
| 13 | R | 67.8 | Low | 66.3 | Low | 170 Ų | 170 | 110.4 Ų | 110.4 | 64% | 0.642 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -66.2 | -50.2 | 172.3 | -71.9 | -165.5 | -170.7 | -130.8 | 6.2 | 111.5 | T9 L10 R11 K15 R16 D17 | T9-R13 PolarHBondContact O-N 3.43Å; T9-R13 VanDerWaalsContact O-N 3.11Å; L10-R13 PolarHBondContact O-N 3.42Å; L10-R13 VanDerWaalsContact O-N 3.14Å; R11-R13 VanDerWaalsContact C-N 3.33Å; R13-K15 VanDerWaalsContact C-N 3.25Å; R13-K15 PolarHBondContact O-N 3.49Å; R13-R16 CarbonylContact O-C 3.54Å; R13-R16 WeakPolarHBondContact O-CA 3.14Å; R13-R16 WeakPolarHBondContact O-CB 3.44Å; R13-R16 PolarHBondContact O-N 2.9Å; R13-D17 PolarHBondContact O-N 2.75Å; R13-D17 VanDerWaalsContact O-OD2 3.14Å |
| 14 | F | 67.3 | Low | 65.3 | Low | 155 Ų | 155 | 109.4 Ų | 109.4 | 68% | 0.68 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -56.9 | -40 | 176.2 | -86 | -70.5 | 0 | 0 | 0 | 112.6 | L10 R11 D17 A18 | L10-F14 WeakPolarHBondContact O-CD2 3.25Å; L10-F14 PolarHBondContact O-N 2.87Å; R11-F14 PolarHBondContact O-N 3.34Å; F14-D17 PolarHBondContact O-N 3.42Å; F14-A18 WeakPolarHBondContact O-CB 3.25Å; F14-A18 PolarHBondContact O-N 3.29Å |
| 15 | K | 66.7 | Low | 63.8 | Low | 118 Ų | 118 | 105.1 Ų | 105.1 | 51% | 0.513 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -64.9 | -41.9 | 174.9 | -171.6 | 174.3 | -174 | -70.2 | 0 | 111.6 | R11 R13 A18 E19 | R11-K15 WeakPolarHBondContact O-CB 3.4Å; R11-K15 PolarHBondContact O-N 2.95Å; R13-K15 VanDerWaalsContact C-N 3.25Å; R13-K15 PolarHBondContact O-N 3.49Å; K15-A18 PolarHBondContact O-N 3.1Å; K15-E19 IonicContact NZ-OE1 3.81Å; K15-E19 IonicContact NZ-OE2 2.74Å; K15-E19 PolarHBondContact NZ-OE2 3.15Å; K15-E19 WeakPolarHBondContact O-CB 3.38Å; K15-E19 WeakPolarHBondContact O-CG 3.33Å; K15-E19 PolarHBondContact O-N 3.24Å |
| 16 | R | 66.9 | Low | 62.4 | Low | 181 Ų | 181 | 105.9 Ų | 105.9 | 68% | 0.683 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -64.5 | -45.3 | 174.6 | -102.3 | 179.4 | 65.9 | 116 | -0.6 | 112.5 | N12 R13 A18 E19 L20 | N12-R16 WeakPolarHBondContact O-CB 3.36Å; N12-R16 PolarHBondContact O-N 3.16Å; R13-R16 CarbonylContact O-C 3.54Å; R13-R16 WeakPolarHBondContact O-CA 3.14Å; R13-R16 WeakPolarHBondContact O-CB 3.44Å; R13-R16 PolarHBondContact O-N 2.9Å; R16-A18 VanDerWaalsContact C-N 3.32Å; R16-E19 PolarHBondContact O-N 3.12Å; R16-L20 VanDerWaalsContact O-CB 3.25Å; R16-L20 WeakPolarHBondContact O-CB 3.47Å; R16-L20 PolarHBondContact O-N 3.01Å |
| 17 | D | 60.5 | Low | 61.1 | Low | 93 Ų | 93 | 104.5 Ų | 104.5 | 50% | 0.497 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.4 | -40.9 | 177.1 | -78.5 | -61.8 | 0 | 0 | 0 | 110.5 | R13 F14 L20 L21 | R13-D17 PolarHBondContact O-N 2.75Å; R13-D17 VanDerWaalsContact O-OD2 3.14Å; F14-D17 PolarHBondContact O-N 3.42Å; D17-L20 PolarHBondContact O-N 3.01Å; D17-L21 VanDerWaalsContact O-CB 3.3Å; D17-L21 WeakPolarHBondContact O-CB 2.99Å; D17-L21 WeakPolarHBondContact O-CG 3.11Å; D17-L21 PolarHBondContact O-N 2.84Å |
| 18 | A | 60.7 | Low | 59.6 | Low | 42 Ų | 42 | 102.4 Ų | 102.4 | 35% | 0.347 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.8 | -43.3 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | F14 K15 R16 L21 M22 | F14-A18 WeakPolarHBondContact O-CB 3.25Å; F14-A18 PolarHBondContact O-N 3.29Å; K15-A18 PolarHBondContact O-N 3.1Å; R16-A18 VanDerWaalsContact C-N 3.32Å; A18-L21 PolarHBondContact O-N 3.08Å; A18-M22 WeakPolarHBondContact O-CB 3.49Å; A18-M22 VanDerWaalsContact O-CG 3.23Å; A18-M22 WeakPolarHBondContact O-CG 3.13Å; A18-M22 PolarHBondContact O-N 3.47Å |
| 19 | E | 68.3 | Low | 58.1 | Low | 98 Ų | 98 | 101.5 Ų | 101.5 | 46% | 0.458 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -67.9 | -34.2 | 176.9 | -76.9 | -171.7 | 100.9 | 0 | 0 | 112.3 | K15 R16 M22 Q23 | K15-E19 IonicContact NZ-OE1 3.81Å; K15-E19 IonicContact NZ-OE2 2.74Å; K15-E19 PolarHBondContact NZ-OE2 3.15Å; K15-E19 WeakPolarHBondContact O-CB 3.38Å; K15-E19 WeakPolarHBondContact O-CG 3.33Å; K15-E19 PolarHBondContact O-N 3.24Å; R16-E19 PolarHBondContact O-N 3.12Å; E19-M22 PolarHBondContact O-N 3.46Å; E19-Q23 WeakPolarHBondContact O-CB 3.39Å; E19-Q23 PolarHBondContact O-N 2.92Å |
| 20 | L | 60.1 | Low | 56.4 | Low | 90 Ų | 90 | 102.8 Ų | 102.8 | 47% | 0.471 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -74.8 | -38.8 | 177.4 | -150.9 | 159.5 | 0 | 0 | 0 | 110.9 | R16 D17 M22 Q23 T24 | R16-L20 VanDerWaalsContact O-CB 3.25Å; R16-L20 WeakPolarHBondContact O-CB 3.47Å; R16-L20 PolarHBondContact O-N 3.01Å; D17-L20 PolarHBondContact O-N 3.01Å; L20-M22 VanDerWaalsContact C-N 3.35Å; L20-Q23 PolarHBondContact O-N 3.4Å; L20-T24 VanDerWaalsContact O-CB 3.29Å; L20-T24 WeakPolarHBondContact O-CB 3.44Å; L20-T24 PolarHBondContact O-N 3.44Å; L20-T24 PolarHBondContact O-OG1 3.19Å |
| 21 | L | 53.8 | Low | 55 | Low | 118 Ų | 118 | 100.8 Ų | 100.8 | 62% | 0.618 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -63 | -42.2 | 169.1 | -73 | 172.3 | 0 | 0 | 0 | 110.9 | D17 A18 T25 | D17-L21 VanDerWaalsContact O-CB 3.3Å; D17-L21 WeakPolarHBondContact O-CB 2.99Å; D17-L21 WeakPolarHBondContact O-CG 3.11Å; D17-L21 PolarHBondContact O-N 2.84Å; A18-L21 PolarHBondContact O-N 3.08Å; L21-T25 WeakPolarHBondContact O-CB 3.42Å; L21-T25 PolarHBondContact O-N 2.93Å; L21-T25 PolarHBondContact O-OG1 3.3Å |
| 22 | M | 49.6 | Very low | 53.7 | Low | 128 Ų | 128 | 96.7 Ų | 96.7 | 63% | 0.631 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -64.6 | -39.8 | 173.8 | -75.7 | -174.2 | -164.1 | 0 | 0 | 111.9 | A18 E19 L20 T26 | A18-M22 WeakPolarHBondContact O-CB 3.49Å; A18-M22 VanDerWaalsContact O-CG 3.23Å; A18-M22 WeakPolarHBondContact O-CG 3.13Å; A18-M22 PolarHBondContact O-N 3.47Å; E19-M22 PolarHBondContact O-N 3.46Å; L20-M22 VanDerWaalsContact C-N 3.35Å; M22-T26 WeakPolarHBondContact O-CB 3.49Å; M22-T26 PolarHBondContact O-N 3.24Å; M22-T26 PolarHBondContact O-OG1 2.75Å |
| 23 | Q | 56.8 | Low | 51.9 | Low | 137 Ų | 137 | 96.4 Ų | 96.4 | 64% | 0.64 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -72.9 | -42.6 | 178.7 | -90.1 | -175.7 | -6.9 | 0 | 0 | 113.5 | E19 L20 T25 T26 S27 | E19-Q23 WeakPolarHBondContact O-CB 3.39Å; E19-Q23 PolarHBondContact O-N 2.92Å; L20-Q23 PolarHBondContact O-N 3.4Å; Q23-T25 VanDerWaalsContact C-N 3.31Å; Q23-T26 CarbonylContact O-C 3.56Å; Q23-T26 PolarHBondContact O-N 2.88Å; Q23-S27 WeakPolarHBondContact O-CB 3.17Å; Q23-S27 PolarHBondContact O-N 2.87Å; Q23-S27 PolarHBondContact O-OG 3.34Å |
| 24 | T | 46.1 | Very low | 50.5 | Low | 85 Ų | 85 | 91.4 Ų | 91.4 | 52% | 0.521 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.3 | -43 | 173.9 | -74.6 | 0 | 0 | 0 | 0 | 110.2 | L20 S27 A28 | L20-T24 VanDerWaalsContact O-CB 3.29Å; L20-T24 WeakPolarHBondContact O-CB 3.44Å; L20-T24 PolarHBondContact O-N 3.44Å; L20-T24 PolarHBondContact O-OG1 3.19Å; T24-S27 PolarHBondContact O-N 3.42Å; T24-A28 PolarHBondContact O-N 3.01Å |
| 25 | T | 41.8 | Very low | 49.1 | Very low | 45 Ų | 45 | 90 Ų | 90 | 28% | 0.276 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.8 | -48.9 | 172.1 | -61.7 | 0 | 0 | 0 | 0 | 110.3 | L21 Q23 S27 A28 V29 T123 I127 | L21-T25 WeakPolarHBondContact O-CB 3.42Å; L21-T25 PolarHBondContact O-N 2.93Å; L21-T25 PolarHBondContact O-OG1 3.3Å; Q23-T25 VanDerWaalsContact C-N 3.31Å; T25-S27 VanDerWaalsContact C-N 3.27Å; T25-S27 PolarHBondContact O-N 3.27Å; T25-A28 PolarHBondContact O-N 2.78Å; T25-V29 HydrophobicContact CG2-CG2 4.13Å; T25-V29 WeakPolarHBondContact O-CB 3.38Å; T25-V29 WeakPolarHBondContact O-CG2 3.23Å; T25-V29 PolarHBondContact O-N 2.79Å; T25-T123 HydrophobicContact CG2-CG2 3.98Å; T25-I127 HydrophobicContact CG2-CD1 3.33Å |
| 26 | T | 45.3 | Very low | 48 | Very low | 79 Ų | 79 | 91.3 Ų | 91.3 | 49% | 0.485 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62.1 | -34 | 179.4 | -59.3 | 0 | 0 | 0 | 0 | 112.1 | M22 Q23 V29 D30 | M22-T26 WeakPolarHBondContact O-CB 3.49Å; M22-T26 PolarHBondContact O-N 3.24Å; M22-T26 PolarHBondContact O-OG1 2.75Å; Q23-T26 CarbonylContact O-C 3.56Å; Q23-T26 PolarHBondContact O-N 2.88Å; T26-V29 CarbonylContact O-C 3.59Å; T26-V29 WeakPolarHBondContact O-CB 3.22Å; T26-V29 PolarHBondContact O-N 2.8Å; T26-D30 WeakPolarHBondContact O-CB 3.36Å; T26-D30 PolarHBondContact O-N 3.36Å |
| 27 | S | 45.8 | Very low | 46.7 | Very low | 88 Ų | 88 | 91.3 Ų | 91.3 | 62% | 0.615 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -78.6 | -34.3 | -179.4 | -54.5 | 0 | 0 | 0 | 0 | 112.9 | Q23 T24 T25 V29 | Q23-S27 WeakPolarHBondContact O-CB 3.17Å; Q23-S27 PolarHBondContact O-N 2.87Å; Q23-S27 PolarHBondContact O-OG 3.34Å; T24-S27 PolarHBondContact O-N 3.42Å; T25-S27 VanDerWaalsContact C-N 3.27Å; T25-S27 PolarHBondContact O-N 3.27Å; S27-V29 VanDerWaalsContact C-N 3.31Å |
| 28 | A | 40.7 | Very low | 45.6 | Very low | 57 Ų | 57 | 94.7 Ų | 94.7 | 47% | 0.471 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -67.2 | -37.8 | 168.2 | 0 | 0 | 0 | 0 | 0 | 110.8 | T24 T25 G31 E32 | T24-A28 PolarHBondContact O-N 3.01Å; T25-A28 PolarHBondContact O-N 2.78Å; A28-G31 PolarHBondContact O-N 3.24Å; A28-E32 PolarHBondContact O-N 3.45Å |
| 29 | V | 40.3 | Very low | 44.7 | Very low | 13 Ų | 13 | 98.6 Ų | 98.6 | 8% | 0.079 | 53% | 0.526 | C | S | . | . | H | α-helix | trans | -70 | -35.4 | 177.4 | 168.5 | 0 | 0 | 0 | 0 | 113.6 | T25 T26 S27 G31 E32 K33 T123 | T25-V29 HydrophobicContact CG2-CG2 4.13Å; T25-V29 WeakPolarHBondContact O-CB 3.38Å; T25-V29 WeakPolarHBondContact O-CG2 3.23Å; T25-V29 PolarHBondContact O-N 2.79Å; T26-V29 CarbonylContact O-C 3.59Å; T26-V29 WeakPolarHBondContact O-CB 3.22Å; T26-V29 PolarHBondContact O-N 2.8Å; S27-V29 VanDerWaalsContact C-N 3.31Å; V29-G31 PolarHBondContact O-N 2.63Å; V29-E32 PolarHBondContact O-N 2.79Å; V29-K33 HydrophobicContact CG1-CD 3.69Å; V29-K33 HydrophobicContact CG1-CG 3.88Å; V29-K33 VanDerWaalsContact O-CB 3.23Å; V29-K33 WeakPolarHBondContact O-CB 3.25Å; V29-K33 WeakPolarHBondContact O-CG 3.25Å; V29-K33 PolarHBondContact O-N 2.81Å; V29-T123 HydrophobicContact CG2-CG2 3.08Å; V29-T123 WeakPolarHBondContact CG2-OG1 3.31Å |
| 30 | D | 38.6 | Very low | 43.6 | Very low | 101 Ų | 101 | 102.2 Ų | 102.2 | 54% | 0.54 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -68 | -29.3 | 176.6 | -139.3 | -97.9 | 0 | 0 | 0 | 110.8 | T26 S34 | T26-D30 WeakPolarHBondContact O-CB 3.36Å; T26-D30 PolarHBondContact O-N 3.36Å; D30-S34 WeakPolarHBondContact O-CB 3.23Å; D30-S34 PolarHBondContact O-N 3.43Å |
| 31 | G | 38.6 | Very low | 42.3 | Very low | 48 Ų | 48 | 106.4 Ų | 106.4 | 50% | 0.495 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -66 | -39 | 170.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | A28 V29 | A28-G31 PolarHBondContact O-N 3.24Å; V29-G31 PolarHBondContact O-N 2.63Å |
| 32 | E | 38.8 | Very low | 42.1 | Very low | 86 Ų | 86 | 105.9 Ų | 105.9 | 40% | 0.402 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -87 | -34.3 | 179.1 | -75.2 | 176.6 | 81.4 | 0 | 0 | 113.1 | A28 V29 S34 Q35 E36 | A28-E32 PolarHBondContact O-N 3.45Å; V29-E32 PolarHBondContact O-N 2.79Å; E32-S34 PolarHBondContact O-N 3.49Å; E32-Q35 WeakPolarHBondContact O-CB 3.38Å; E32-Q35 PolarHBondContact O-N 3.3Å; E32-E36 PolarHBondContact O-N 3.26Å |
| 33 | K | 36.5 | Very low | 42.2 | Very low | 93 Ų | 93 | 106.7 Ų | 106.7 | 40% | 0.404 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -66.8 | -32.5 | 175.3 | -84.7 | -176.9 | 175.3 | 177.2 | 0 | 113.5 | V29 Q35 P119 | V29-K33 HydrophobicContact CG1-CD 3.69Å; V29-K33 HydrophobicContact CG1-CG 3.88Å; V29-K33 VanDerWaalsContact O-CB 3.23Å; V29-K33 WeakPolarHBondContact O-CB 3.25Å; V29-K33 WeakPolarHBondContact O-CG 3.25Å; V29-K33 PolarHBondContact O-N 2.81Å; K33-Q35 PolarHBondContact O-N 2.95Å; K33-P119 HydrophobicContact CD-CB 4.27Å; K33-P119 HydrophobicContact CG-CB 4.28Å |
| 34 | S | 37.5 | Very low | 41.5 | Very low | 64 Ų | 64 | 104.3 Ų | 104.3 | 45% | 0.448 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -65.7 | -15.5 | 172.5 | -90.6 | 0 | 0 | 0 | 0 | 112.8 | D30 E32 | D30-S34 WeakPolarHBondContact O-CB 3.23Å; D30-S34 PolarHBondContact O-N 3.43Å; E32-S34 PolarHBondContact O-N 3.49Å |
| 35 | Q | 37.6 | Very low | 41.6 | Very low | 126 Ų | 126 | 110.4 Ų | 110.4 | 59% | 0.589 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -93.2 | -28.7 | -177.4 | -131.2 | 167.3 | -28.4 | 0 | 0 | 112.9 | E32 K33 | E32-Q35 WeakPolarHBondContact O-CB 3.38Å; E32-Q35 PolarHBondContact O-N 3.3Å; K33-Q35 PolarHBondContact O-N 2.95Å |
| 36 | E | 42.7 | Very low | 42.2 | Very low | 146 Ų | 146 | 114.4 Ų | 114.4 | 68% | 0.682 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -87.5 | -23 | -176.8 | -156.5 | 170.2 | 89.2 | 0 | 0 | 114 | E32 | E32-E36 PolarHBondContact O-N 3.26Å |
| 37 | E | 41.1 | Very low | 42.8 | Very low | 181 Ų | 181 | 114.5 Ų | 114.5 | 85% | 0.846 | 60% | 0.597 | S | S | * | * | S | Bend | trans | -106.4 | -0 | -176.2 | -144.1 | -178.7 | 90.4 | 0 | 0 | 115.2 | ||
| 38 | K | 36.2 | Very low | 43.9 | Very low | 163 Ų | 163 | 119.2 Ų | 119.2 | 71% | 0.709 | 61% | 0.607 | S | S | * | * | S | Bend | trans | -120.2 | -5.9 | -175.2 | -68.4 | -171.4 | -178.9 | 176.4 | 0 | 117.4 | ||
| 39 | D | 41.8 | Very low | 45.3 | Very low | 125 Ų | 125 | 122.4 Ų | 122.4 | 67% | 0.668 | 61% | 0.612 | S | S | * | * | trans | -107.5 | 35.6 | -173.9 | -136.2 | -107.8 | 0 | 0 | 0 | 114.9 | K41 | D39-K41 PolarHBondContact O-N 2.89Š| ||
| 40 | L | 45.2 | Very low | 46.8 | Very low | 173 Ų | 173 | 123.2 Ų | 123.2 | 91% | 0.906 | 62% | 0.618 | S | S | * | * | trans | -73.7 | 62.5 | 151.8 | -99.3 | 153.7 | 0 | 0 | 0 | 109.4 | ||||
| 41 | K | 33.3 | Very low | 48.7 | Very low | 179 Ų | 179 | 121.2 Ų | 121.2 | 78% | 0.778 | 61% | 0.609 | S | S | * | * | S | Bend | trans | 175.6 | 151.5 | 155.3 | -101.3 | 163.7 | -174.2 | -168.8 | 0 | 112.6 | D39 | D39-K41 PolarHBondContact O-N 2.89Š|
| 42 | P | 50.4 | Low | 50.9 | Low | 106 Ų | 106 | 125.4 Ų | 125.4 | 69% | 0.688 | 61% | 0.614 | S | S | * | * | -92.7 | 152.6 | -125.3 | 35.6 | -37.6 | 0 | 0 | 0 | 115.7 | |||||
| 43 | L | 51.1 | Low | 52.9 | Low | 146 Ų | 146 | 123.2 Ų | 123.2 | 76% | 0.764 | 60% | 0.602 | S | S | * | * | trans | 76.2 | 136.3 | 153.3 | -107.6 | 71.5 | 0 | 0 | 0 | 117.7 | ||||
| 44 | P | 41.7 | Very low | 55.1 | Low | 86 Ų | 86 | 120.8 Ų | 120.8 | 56% | 0.558 | 59% | 0.593 | S | S | * | * | -141.5 | 123.3 | 66.4 | 33.2 | -13.2 | 0 | 0 | 0 | 115.5 | I46 | P44-I46 PolarHBondContact O-N 3.44Š| |||
| 45 | R | 49 | Very low | 57.4 | Low | 214 Ų | 214 | 122 Ų | 122 | 81% | 0.808 | 60% | 0.597 | S | S | * | * | 32.2 | 66.6 | 126.4 | -157.1 | -172.1 | 90.7 | 173.9 | 8.5 | 116 | N47 | R45-N47 PolarHBondContact O-N 2.88Š| |||
| 46 | I | 54.8 | Low | 59.6 | Low | 129 Ų | 129 | 117 Ų | 117 | 66% | 0.662 | 58% | 0.578 | S | S | * | * | trans | 44.4 | 78 | 160.6 | -45.8 | 160.3 | 0 | 0 | 0 | 112.2 | P44 K48 V51 | P44-I46 PolarHBondContact O-N 3.44Å; I46-K48 PolarHBondContact O-N 2.82Å; I46-V51 HydrophobicContact CG2-CG2 3.36Å | ||
| 47 | N | 56.5 | Low | 61.2 | Low | 80 Ų | 80 | 110.5 Ų | 110.5 | 43% | 0.428 | 55% | 0.549 | S | S | . | . | trans | -67.9 | 130.7 | 174.6 | -67.7 | -37.2 | 0 | 0 | 0 | 109 | R45 H49 S50 V51 | R45-N47 PolarHBondContact O-N 2.88Å; N47-H49 PolarHBondContact O-N 3.32Å; N47-S50 PolarHBondContact O-N 3.11Å; N47-V51 PolarHBondContact O-N 3.14Å | ||
| 48 | K | 69.7 | Low | 63.1 | Low | 188 Ų | 188 | 106.1 Ų | 106.1 | 82% | 0.817 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -50.6 | -27.9 | 175.8 | -66.9 | 175.5 | -178.6 | 168 | 0 | 112.2 | I46 F52 | I46-K48 PolarHBondContact O-N 2.82Å; K48-F52 WeakPolarHBondContact O-CB 3.33Å; K48-F52 PolarHBondContact O-N 3.27Å |
| 49 | H | 70.9 | Confident | 65.2 | Low | 124 Ų | 124 | 100.4 Ų | 100.4 | 57% | 0.574 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -63.2 | -46.5 | 175.1 | -164.9 | -167.5 | 0 | 0 | 0 | 112.6 | N47 F52 W53 | N47-H49 PolarHBondContact O-N 3.32Å; H49-F52 WeakPolarHBondContact O-CB 3.28Å; H49-F52 PolarHBondContact O-N 2.9Å; H49-W53 AromaticContact CD2-CD1 3.36Å; H49-W53 AromaticContact CD2-NE1 3.26Å; H49-W53 PolarHBondContact CD2-NE1 2.86Å; H49-W53 VanDerWaalsContact CD2-NE1 3.26Å; H49-W53 AromaticContact CE1-NE1 3.75Å; H49-W53 AromaticContact NE2-CD1 3.53Å; H49-W53 AromaticContact NE2-NE1 2.89Å; H49-W53 PolarHBondContact NE2-NE1 3Å; H49-W53 PolarHBondContact O-N 3.29Å |
| 50 | S | 71.1 | Confident | 66.7 | Low | 30 Ų | 30 | 96.2 Ų | 96.2 | 21% | 0.21 | 50% | 0.496 | C | S | . | . | H | α-helix | trans | -67.7 | -43.7 | 178.8 | -48.9 | 0 | 0 | 0 | 0 | 111.6 | N47 F52 W53 I54 | N47-S50 PolarHBondContact O-N 3.11Å; S50-F52 VanDerWaalsContact C-N 3.27Å; S50-F52 PolarHBondContact O-N 3.11Å; S50-W53 PolarHBondContact O-N 2.94Å; S50-W53 VanDerWaalsContact O-N 3.16Å; S50-I54 WeakPolarHBondContact O-CG1 3.43Å; S50-I54 PolarHBondContact O-N 2.77Å |
| 51 | V | 79.2 | Confident | 67.9 | Low | 59 Ų | 59 | 90.8 Ų | 90.8 | 36% | 0.358 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -61.5 | -40.8 | 173.9 | -179.6 | 0 | 0 | 0 | 0 | 110.5 | I46 N47 W53 I54 V55 | I46-V51 HydrophobicContact CG2-CG2 3.36Å; N47-V51 PolarHBondContact O-N 3.14Å; V51-W53 PolarHBondContact O-N 2.97Å; V51-I54 PolarHBondContact O-N 3.43Å; V51-V55 HydrophobicContact CG1-CG2 4.25Å; V51-V55 WeakPolarHBondContact O-CB 3.45Å; V51-V55 VanDerWaalsContact O-CG2 3.25Å; V51-V55 WeakPolarHBondContact O-CG2 3.35Å; V51-V55 PolarHBondContact O-N 3.13Å |
| 52 | F | 83.8 | Confident | 69.7 | Low | 135 Ų | 135 | 91.4 Ų | 91.4 | 59% | 0.592 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -60.9 | -42.9 | 174.6 | 175.5 | -93.6 | 0 | 0 | 0 | 111.7 | K48 H49 S50 V55 A56 | K48-F52 WeakPolarHBondContact O-CB 3.33Å; K48-F52 PolarHBondContact O-N 3.27Å; H49-F52 WeakPolarHBondContact O-CB 3.28Å; H49-F52 PolarHBondContact O-N 2.9Å; S50-F52 VanDerWaalsContact C-N 3.27Å; S50-F52 PolarHBondContact O-N 3.11Å; F52-V55 PolarHBondContact O-N 2.8Å; F52-A56 WeakPolarHBondContact O-CB 3.37Å; F52-A56 PolarHBondContact O-N 3.2Å |
| 53 | W | 81.4 | Confident | 70.4 | Confident | 41 Ų | 41 | 95.9 Ų | 95.9 | 16% | 0.155 | 47% | 0.473 | C | S | . | . | H | α-helix | trans | -64.4 | -40.8 | 175.9 | -84.8 | 104.8 | 0 | 0 | 0 | 113.1 | H49 S50 V51 A56 S57 F150 T151 M154 M158 | H49-W53 AromaticContact CD2-CD1 3.36Å; H49-W53 AromaticContact CD2-NE1 3.26Å; H49-W53 PolarHBondContact CD2-NE1 2.86Å; H49-W53 VanDerWaalsContact CD2-NE1 3.26Å; H49-W53 AromaticContact CE1-NE1 3.75Å; H49-W53 AromaticContact NE2-CD1 3.53Å; H49-W53 AromaticContact NE2-NE1 2.89Å; H49-W53 PolarHBondContact NE2-NE1 3Å; H49-W53 PolarHBondContact O-N 3.29Å; S50-W53 PolarHBondContact O-N 2.94Å; S50-W53 VanDerWaalsContact O-N 3.16Å; V51-W53 PolarHBondContact O-N 2.97Å; W53-A56 PolarHBondContact O-N 3.41Å; W53-S57 WeakPolarHBondContact O-CB 3.34Å; W53-S57 PolarHBondContact O-N 3.16Å; W53-F150 HydrophobicContact CH2-CE1 4Å; W53-T151 HydrophobicContact CE3-CG2 4.45Å; W53-T151 HydrophobicContact CZ3-CG2 4.25Å; W53-M154 HydrophobicContact CD2-CB 4.13Å; W53-M154 HydrophobicContact CE3-CB 3.43Å; W53-M154 VanDerWaalsContact CE3-CB 3.43Å; W53-M154 HydrophobicContact CE3-CG 4.36Å; W53-M154 HydrophobicContact CH2-CB 3.95Å; W53-M154 HydrophobicContact CH2-CE 4.32Å; W53-M154 HydrophobicContact CH2-CG 3.98Å; W53-M154 HydrophobicContact CZ2-CE 4.23Å; W53-M154 HydrophobicContact CZ3-CB 3.33Å; W53-M154 HydrophobicContact CZ3-CG 3.84Å; W53-M158 HydrophobicContact CB-CG 4.23Å |
| 54 | I | 82.4 | Confident | 70.8 | Confident | 41 Ų | 41 | 89.4 Ų | 89.4 | 21% | 0.21 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -64.6 | -47 | 175.7 | -64.7 | 165.3 | 0 | 0 | 0 | 110.2 | S50 V51 A56 S57 V58 F159 L162 | S50-I54 WeakPolarHBondContact O-CG1 3.43Å; S50-I54 PolarHBondContact O-N 2.77Å; V51-I54 PolarHBondContact O-N 3.43Å; I54-A56 VanDerWaalsContact C-N 3.35Å; I54-A56 PolarHBondContact O-N 2.87Å; I54-S57 WeakPolarHBondContact O-CB 2.96Å; I54-S57 PolarHBondContact O-N 3.1Å; I54-V58 WeakPolarHBondContact O-CG2 3.39Å; I54-V58 PolarHBondContact O-N 2.75Å; I54-F159 HydrophobicContact CD1-CD2 4.47Å; I54-L162 HydrophobicContact CD1-CD1 4.12Å |
| 55 | V | 85.4 | Confident | 71.6 | Confident | 89 Ų | 89 | 89.5 Ų | 89.5 | 54% | 0.539 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -64.6 | -39.6 | 177.2 | 172.6 | 0 | 0 | 0 | 0 | 111.2 | V51 F52 S57 V58 A59 | V51-V55 HydrophobicContact CG1-CG2 4.25Å; V51-V55 WeakPolarHBondContact O-CB 3.45Å; V51-V55 VanDerWaalsContact O-CG2 3.25Å; V51-V55 WeakPolarHBondContact O-CG2 3.35Å; V51-V55 PolarHBondContact O-N 3.13Å; F52-V55 PolarHBondContact O-N 2.8Å; V55-S57 VanDerWaalsContact C-N 3.33Å; V55-V58 PolarHBondContact O-N 2.75Å; V55-A59 VanDerWaalsContact O-CB 3.25Å; V55-A59 WeakPolarHBondContact O-CB 2.86Å; V55-A59 PolarHBondContact O-N 3.41Å |
| 56 | A | 83.3 | Confident | 71.9 | Confident | 22 Ų | 22 | 82.2 Ų | 82.2 | 18% | 0.182 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -62.7 | -41 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | F52 W53 I54 A59 V60 T151 | F52-A56 WeakPolarHBondContact O-CB 3.37Å; F52-A56 PolarHBondContact O-N 3.2Å; W53-A56 PolarHBondContact O-N 3.41Å; I54-A56 VanDerWaalsContact C-N 3.35Å; I54-A56 PolarHBondContact O-N 2.87Å; A56-A59 PolarHBondContact O-N 3.05Å; A56-V60 VanDerWaalsContact O-CB 3.23Å; A56-V60 WeakPolarHBondContact O-CB 3.37Å; A56-V60 VanDerWaalsContact O-CG2 3.25Å; A56-V60 WeakPolarHBondContact O-CG2 3.27Å; A56-V60 PolarHBondContact O-N 3.49Å; A56-T151 HydrophobicContact CB-CG2 4.16Å |
| 57 | S | 77.9 | Confident | 71.5 | Confident | 10 Ų | 10 | 82.9 Ų | 82.9 | 7% | 0.07 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -62.1 | -45.6 | 173.4 | 170.6 | 0 | 0 | 0 | 0 | 112.1 | W53 I54 V55 V60 T61 Q152 | W53-S57 WeakPolarHBondContact O-CB 3.34Å; W53-S57 PolarHBondContact O-N 3.16Å; I54-S57 WeakPolarHBondContact O-CB 2.96Å; I54-S57 PolarHBondContact O-N 3.1Å; V55-S57 VanDerWaalsContact C-N 3.33Å; S57-V60 PolarHBondContact O-N 3.46Å; S57-T61 WeakPolarHBondContact O-CB 3.37Å; S57-T61 PolarHBondContact O-N 3.21Å; S57-T61 PolarHBondContact O-OG1 3.04Å; S57-Q152 PolarHBondContact O-OE1 3.08Å; S57-Q152 VanDerWaalsContact OG-CD 3.28Å; S57-Q152 PolarHBondContact OG-NE2 2.85Å; S57-Q152 VanDerWaalsContact OG-NE2 3.14Å; S57-Q152 PolarHBondContact OG-OE1 3.26Å; S57-Q152 VanDerWaalsContact OG-OE1 3.11Å |
| 58 | V | 79.4 | Confident | 71.1 | Confident | 89 Ų | 89 | 84.2 Ų | 84.2 | 54% | 0.539 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -64.4 | -44.3 | 176 | 174.3 | 0 | 0 | 0 | 0 | 111.6 | I54 V55 T61 Y62 | I54-V58 WeakPolarHBondContact O-CG2 3.39Å; I54-V58 PolarHBondContact O-N 2.75Å; V55-V58 PolarHBondContact O-N 2.75Å; V58-T61 WeakPolarHBondContact O-CB 3.14Å; V58-T61 PolarHBondContact O-N 3.01Å; V58-Y62 WeakPolarHBondContact O-CB 3.39Å; V58-Y62 PolarHBondContact O-N 3.24Å |
| 59 | A | 80.3 | Confident | 70.2 | Confident | 42 Ų | 42 | 77.4 Ų | 77.4 | 35% | 0.347 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -64.6 | -42.8 | 178 | 0 | 0 | 0 | 0 | 0 | 111.6 | V55 A56 T61 Y62 Y63 | V55-A59 VanDerWaalsContact O-CB 3.25Å; V55-A59 WeakPolarHBondContact O-CB 2.86Å; V55-A59 PolarHBondContact O-N 3.41Å; A56-A59 PolarHBondContact O-N 3.05Å; A59-T61 VanDerWaalsContact C-N 3.34Å; A59-Y62 WeakPolarHBondContact O-CB 2.85Å; A59-Y62 PolarHBondContact O-N 2.78Å; A59-Y63 WeakPolarHBondContact O-CB 3.41Å; A59-Y63 WeakPolarHBondContact O-CD2 3.46Å; A59-Y63 PolarHBondContact O-N 2.95Å |
| 60 | V | 73.1 | Confident | 69.4 | Low | 37 Ų | 37 | 74.4 Ų | 74.4 | 22% | 0.224 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -63 | -41.2 | 174.1 | 162.2 | 0 | 0 | 0 | 0 | 110.8 | A56 S57 Y62 Y63 A64 I148 T151 | A56-V60 VanDerWaalsContact O-CB 3.23Å; A56-V60 WeakPolarHBondContact O-CB 3.37Å; A56-V60 VanDerWaalsContact O-CG2 3.25Å; A56-V60 WeakPolarHBondContact O-CG2 3.27Å; A56-V60 PolarHBondContact O-N 3.49Å; S57-V60 PolarHBondContact O-N 3.46Å; V60-Y62 VanDerWaalsContact C-N 3.26Å; V60-Y62 PolarHBondContact O-N 2.64Å; V60-Y63 PolarHBondContact O-N 2.82Å; V60-A64 WeakPolarHBondContact O-CA 3.38Å; V60-A64 WeakPolarHBondContact O-CB 3.24Å; V60-A64 PolarHBondContact O-N 3.05Å; V60-I148 HydrophobicContact CG1-CB 4.09Å; V60-I148 HydrophobicContact CG1-CG1 3.96Å; V60-I148 HydrophobicContact CG1-CG2 3.67Å; V60-T151 HydrophobicContact CB-CG2 4.49Å; V60-T151 HydrophobicContact CG2-CG2 3.97Å |
| 61 | T | 70.9 | Confident | 68.2 | Low | 60 Ų | 60 | 80.8 Ų | 80.8 | 37% | 0.368 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -60.7 | -38.9 | 174.5 | -57.2 | 0 | 0 | 0 | 0 | 111.4 | S57 V58 A59 Q152 | S57-T61 WeakPolarHBondContact O-CB 3.37Å; S57-T61 PolarHBondContact O-N 3.21Å; S57-T61 PolarHBondContact O-OG1 3.04Å; V58-T61 WeakPolarHBondContact O-CB 3.14Å; V58-T61 PolarHBondContact O-N 3.01Å; A59-T61 VanDerWaalsContact C-N 3.34Å; T61-Q152 PolarHBondContact OG1-OE1 3.3Å |
| 62 | Y | 71.1 | Confident | 67 | Low | 191 Ų | 191 | 84.7 Ų | 84.7 | 75% | 0.749 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -72 | -44 | 179 | -149.6 | -87 | 0 | 0 | 0 | 112.4 | V58 A59 V60 D65 | V58-Y62 WeakPolarHBondContact O-CB 3.39Å; V58-Y62 PolarHBondContact O-N 3.24Å; A59-Y62 WeakPolarHBondContact O-CB 2.85Å; A59-Y62 PolarHBondContact O-N 2.78Å; V60-Y62 VanDerWaalsContact C-N 3.26Å; V60-Y62 PolarHBondContact O-N 2.64Å; Y62-D65 PolarHBondContact O-N 3.33Å |
| 63 | Y | 64.8 | Low | 65.3 | Low | 200 Ų | 200 | 82 Ų | 82 | 78% | 0.784 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -75.1 | -26 | 178.1 | -93.5 | -84.5 | 0 | 0 | 0 | 113.6 | A59 V60 D65 | A59-Y63 WeakPolarHBondContact O-CB 3.41Å; A59-Y63 WeakPolarHBondContact O-CD2 3.46Å; A59-Y63 PolarHBondContact O-N 2.95Å; V60-Y63 PolarHBondContact O-N 2.82Å; Y63-D65 PolarHBondContact O-N 2.79Å |
| 64 | A | 60.2 | Low | 63.8 | Low | 10 Ų | 10 | 85.2 Ų | 85.2 | 8% | 0.083 | 44% | 0.435 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -71.3 | -1.2 | 176 | 0 | 0 | 0 | 0 | 0 | 112.5 | V60 F66 I148 | V60-A64 WeakPolarHBondContact O-CA 3.38Å; V60-A64 WeakPolarHBondContact O-CB 3.24Å; V60-A64 PolarHBondContact O-N 3.05Å; A64-F66 HydrophobicContact CB-CD2 3.73Å; A64-F66 HydrophobicContact CB-CE2 4.28Å; A64-F66 PolarHBondContact O-N 2.82Å; A64-I148 HydrophobicContact CB-CD1 3.83Å |
| 65 | D | 58.4 | Low | 62.2 | Low | 88 Ų | 88 | 90.7 Ų | 90.7 | 47% | 0.471 | 47% | 0.465 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 44.7 | 38 | 175.5 | -116.4 | -51.2 | 0 | 0 | 0 | 112 | Y62 Y63 L67 H68 V69 | Y62-D65 PolarHBondContact O-N 3.33Å; Y63-D65 PolarHBondContact O-N 2.79Å; D65-L67 PolarHBondContact O-N 2.83Å; D65-L67 VanDerWaalsContact O-N 3.16Å; D65-H68 HydrophobicContact CB-CB 4.18Å; D65-H68 PolarHBondContact O-N 3.39Å; D65-H68 WeakPolarHBondContact OD1-CB 3.48Å; D65-H68 IonicContact OD1-CG 3.81Å; D65-V69 WeakPolarHBondContact O-CB 3.19Å; D65-V69 WeakPolarHBondContact O-CG2 3.4Å; D65-V69 PolarHBondContact O-N 3.44Å |
| 66 | F | 55.3 | Low | 60.3 | Low | 62 Ų | 62 | 92.8 Ų | 92.8 | 27% | 0.272 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -55.6 | -41.6 | -170.2 | -119.4 | -92.4 | 0 | 0 | 0 | 110.2 | A64 I70 F81 L137 | A64-F66 HydrophobicContact CB-CD2 3.73Å; A64-F66 HydrophobicContact CB-CE2 4.28Å; A64-F66 PolarHBondContact O-N 2.82Å; F66-I70 HydrophobicContact CD1-CD1 4.31Å; F66-I70 WeakPolarHBondContact O-CB 3.22Å; F66-I70 WeakPolarHBondContact O-CD1 3.39Å; F66-I70 WeakPolarHBondContact O-CG1 3.09Å; F66-I70 PolarHBondContact O-N 3.5Å; F66-F81 HydrophobicContact CD1-CE2 4.46Å; F66-F81 HydrophobicContact CE1-CE2 4.25Å; F66-L137 HydrophobicContact CE1-CD2 4.25Å; F66-L137 HydrophobicContact CE2-CD2 3.92Å; F66-L137 HydrophobicContact CZ-CD1 4.38Å; F66-L137 HydrophobicContact CZ-CD2 3.5Å; F66-L137 VanDerWaalsContact CZ-CD2 3.5Å; F66-L137 HydrophobicContact CZ-CG 4.5Å |
| 67 | L | 46.2 | Very low | 58.8 | Low | 143 Ų | 143 | 94.7 Ų | 94.7 | 75% | 0.749 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -73.6 | -34.3 | -179.7 | -64.2 | 178 | 0 | 0 | 0 | 113.2 | D65 I70 M71 | D65-L67 PolarHBondContact O-N 2.83Å; D65-L67 VanDerWaalsContact O-N 3.16Å; L67-I70 HydrophobicContact CD2-CD1 4.33Å; L67-M71 VanDerWaalsContact O-CB 3.26Å; L67-M71 WeakPolarHBondContact O-CB 3.15Å; L67-M71 PolarHBondContact O-N 2.82Å |
| 68 | H | 48.3 | Very low | 57.7 | Low | 108 Ų | 108 | 96.5 Ų | 96.5 | 50% | 0.5 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -73.4 | -38.6 | 177.7 | -161.5 | 85.4 | 0 | 0 | 0 | 111.2 | D65 M71 E72 | D65-H68 HydrophobicContact CB-CB 4.18Å; D65-H68 PolarHBondContact O-N 3.39Å; D65-H68 WeakPolarHBondContact OD1-CB 3.48Å; D65-H68 IonicContact OD1-CG 3.81Å; H68-M71 PolarHBondContact O-N 2.74Å; H68-E72 IonicContact NE2-OE1 3.88Å; H68-E72 WeakPolarHBondContact O-CB 3.21Å; H68-E72 PolarHBondContact O-N 2.81Å; H68-E72 VanDerWaalsContact O-N 3.15Å |
| 69 | V | 51.6 | Low | 56.8 | Low | 44 Ų | 44 | 101.7 Ų | 101.7 | 27% | 0.267 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -67.1 | -36.5 | 174.2 | 169.8 | 0 | 0 | 0 | 0 | 112.3 | D65 N73 V140 | D65-V69 WeakPolarHBondContact O-CB 3.19Å; D65-V69 WeakPolarHBondContact O-CG2 3.4Å; D65-V69 PolarHBondContact O-N 3.44Å; V69-N73 PolarHBondContact O-ND2 3.19Å; V69-V140 HydrophobicContact CG1-CG1 3.67Å; V69-V140 HydrophobicContact CG1-CG2 4.27Å; V69-V140 HydrophobicContact CG2-CG1 4.45Å |
| 70 | I | 52.4 | Low | 55.8 | Low | 62 Ų | 62 | 107.5 Ų | 107.5 | 32% | 0.318 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -65 | -42.6 | 172.9 | -72.2 | 161.6 | 0 | 0 | 0 | 110.9 | F66 L67 F81 | F66-I70 HydrophobicContact CD1-CD1 4.31Å; F66-I70 WeakPolarHBondContact O-CB 3.22Å; F66-I70 WeakPolarHBondContact O-CD1 3.39Å; F66-I70 WeakPolarHBondContact O-CG1 3.09Å; F66-I70 PolarHBondContact O-N 3.5Å; L67-I70 HydrophobicContact CD2-CD1 4.33Å; I70-F81 HydrophobicContact CD1-CE1 3.73Å; I70-F81 HydrophobicContact CD1-CE2 4Å; I70-F81 HydrophobicContact CD1-CZ 3.22Å; I70-F81 HydrophobicContact CG1-CD1 4.34Å; I70-F81 HydrophobicContact CG1-CD2 4.48Å; I70-F81 HydrophobicContact CG1-CE1 3.6Å; I70-F81 HydrophobicContact CG1-CE2 3.76Å; I70-F81 HydrophobicContact CG1-CZ 3.3Å; I70-F81 HydrophobicContact CG2-CE1 4.36Å |
| 71 | M | 47.1 | Very low | 55 | Low | 163 Ų | 163 | 108.1 Ų | 108.1 | 80% | 0.803 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -78.1 | -21.1 | -172.1 | -165.5 | 174.5 | 174.4 | 0 | 0 | 113.6 | L67 H68 | L67-M71 VanDerWaalsContact O-CB 3.26Å; L67-M71 WeakPolarHBondContact O-CB 3.15Å; L67-M71 PolarHBondContact O-N 2.82Å; H68-M71 PolarHBondContact O-N 2.74Å |
| 72 | E | 52.7 | Low | 54.6 | Low | 142 Ų | 142 | 108.9 Ų | 108.9 | 66% | 0.664 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -100.1 | -6.7 | -173.8 | -164.3 | 140.9 | 77.2 | 0 | 0 | 115 | H68 | H68-E72 IonicContact NE2-OE1 3.88Å; H68-E72 WeakPolarHBondContact O-CB 3.21Å; H68-E72 PolarHBondContact O-N 2.81Å; H68-E72 VanDerWaalsContact O-N 3.15Å |
| 73 | N | 49.3 | Very low | 54.2 | Low | 77 Ų | 77 | 103.1 Ų | 103.1 | 41% | 0.412 | 50% | 0.504 | S | S | . | . | trans | -126.5 | 46.2 | -173.8 | -66.6 | -92.6 | 0 | 0 | 0 | 113.9 | V69 D75 K77 | V69-N73 PolarHBondContact O-ND2 3.19Å; N73-D75 PolarHBondContact O-N 3.41Å; N73-K77 HydrophobicContact CB-CB 4.08Å; N73-K77 HydrophobicContact CB-CD 4Å; N73-K77 WeakPolarHBondContact O-CB 2.97Å | ||
| 74 | D | 49.3 | Very low | 54.1 | Low | 109 Ų | 109 | 93.7 Ų | 93.7 | 58% | 0.583 | 47% | 0.467 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.6 | -31.7 | -161.1 | -147.6 | -115.5 | 0 | 0 | 0 | 115.9 | S78 | D74-S78 VanDerWaalsContact O-CB 3.28Å; D74-S78 WeakPolarHBondContact O-CB 3.29Å |
| 75 | D | 49.7 | Very low | 54.3 | Low | 156 Ų | 156 | 97.4 Ų | 97.4 | 83% | 0.834 | 49% | 0.485 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.3 | -26.6 | -163.2 | -70 | -67.8 | 0 | 0 | 0 | 117.2 | N73 | N73-D75 PolarHBondContact O-N 3.41Š|
| 76 | V | 45.6 | Very low | 54.7 | Low | 134 Ų | 134 | 98.1 Ų | 98.1 | 81% | 0.812 | 49% | 0.488 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -124.1 | -21.3 | -177 | 179.2 | 0 | 0 | 0 | 0 | 112.9 | ||
| 77 | K | 51 | Low | 55.1 | Low | 62 Ų | 62 | 97.7 Ų | 97.7 | 27% | 0.27 | 49% | 0.488 | S | S | . | . | S | Bend | trans | -89.6 | -17.8 | -177.6 | -149.5 | 159.5 | -172.6 | 164.6 | 0 | 113.1 | N73 W79 F81 P139 | N73-K77 HydrophobicContact CB-CB 4.08Å; N73-K77 HydrophobicContact CB-CD 4Å; N73-K77 WeakPolarHBondContact O-CB 2.97Å; K77-W79 PolarHBondContact O-N 2.95Å; K77-F81 VanDerWaalsContact O-CB 3.29Å; K77-F81 WeakPolarHBondContact O-CB 3.25Å; K77-F81 PolarHBondContact O-N 3.38Å; K77-F81 VanDerWaalsContact O-N 3.16Å; K77-P139 PolarHBondContact NZ-O 3.29Å |
| 78 | S | 55.4 | Low | 56 | Low | 48 Ų | 48 | 94.5 Ų | 94.5 | 34% | 0.336 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -59.5 | -35.6 | -179.2 | -179 | 0 | 0 | 0 | 0 | 114 | D74 N82 | D74-S78 VanDerWaalsContact O-CB 3.28Å; D74-S78 WeakPolarHBondContact O-CB 3.29Å; S78-N82 VanDerWaalsContact O-CB 3.25Å; S78-N82 WeakPolarHBondContact O-CB 3.33Å; S78-N82 PolarHBondContact O-N 2.8Å |
| 79 | W | 59.3 | Low | 56.9 | Low | 197 Ų | 197 | 91 Ų | 91 | 75% | 0.746 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -66.7 | -50.7 | -177.4 | -167 | -101 | 0 | 0 | 0 | 113.3 | K77 V83 | K77-W79 PolarHBondContact O-N 2.95Å; W79-V83 VanDerWaalsContact O-CG2 3.24Å; W79-V83 WeakPolarHBondContact O-CG2 3.09Å; W79-V83 PolarHBondContact O-N 2.87Å; W79-V83 VanDerWaalsContact O-N 3.14Å |
| 80 | W | 59 | Low | 57.7 | Low | 164 Ų | 164 | 92.8 Ų | 92.8 | 62% | 0.621 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -71.3 | -33 | 178.5 | -73.1 | 90 | 0 | 0 | 0 | 112.1 | G84 I135 | W80-G84 PolarHBondContact O-N 3.16Å; W80-G84 VanDerWaalsContact O-N 3.08Å; W80-I135 HydrophobicContact CZ3-CG2 4.3Å |
| 81 | F | 58.2 | Low | 58.3 | Low | 51 Ų | 51 | 91 Ų | 91 | 22% | 0.224 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -67.8 | -45.7 | 175.2 | -177.3 | -97.1 | 0 | 0 | 0 | 112.3 | F66 I70 K77 V83 G84 L85 | F66-F81 HydrophobicContact CD1-CE2 4.46Å; F66-F81 HydrophobicContact CE1-CE2 4.25Å; I70-F81 HydrophobicContact CD1-CE1 3.73Å; I70-F81 HydrophobicContact CD1-CE2 4Å; I70-F81 HydrophobicContact CD1-CZ 3.22Å; I70-F81 HydrophobicContact CG1-CD1 4.34Å; I70-F81 HydrophobicContact CG1-CD2 4.48Å; I70-F81 HydrophobicContact CG1-CE1 3.6Å; I70-F81 HydrophobicContact CG1-CE2 3.76Å; I70-F81 HydrophobicContact CG1-CZ 3.3Å; I70-F81 HydrophobicContact CG2-CE1 4.36Å; K77-F81 VanDerWaalsContact O-CB 3.29Å; K77-F81 WeakPolarHBondContact O-CB 3.25Å; K77-F81 PolarHBondContact O-N 3.38Å; K77-F81 VanDerWaalsContact O-N 3.16Å; F81-V83 VanDerWaalsContact C-N 3.31Å; F81-V83 PolarHBondContact O-N 3.43Å; F81-G84 PolarHBondContact O-N 3.45Å; F81-L85 HydrophobicContact CE1-CB 4.44Å; F81-L85 HydrophobicContact CE1-CD2 4.28Å; F81-L85 WeakPolarHBondContact O-CB 3.37Å; F81-L85 PolarHBondContact O-N 2.76Å |
| 82 | N | 61.6 | Low | 59.3 | Low | 75 Ų | 75 | 87.5 Ų | 87.5 | 40% | 0.401 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -60.5 | -41 | 174.6 | -100.9 | -12.3 | 0 | 0 | 0 | 111.5 | S78 G84 L85 I86 | S78-N82 VanDerWaalsContact O-CB 3.25Å; S78-N82 WeakPolarHBondContact O-CB 3.33Å; S78-N82 PolarHBondContact O-N 2.8Å; N82-G84 VanDerWaalsContact C-N 3.32Å; N82-G84 PolarHBondContact O-N 3.39Å; N82-L85 PolarHBondContact O-N 2.89Å; N82-I86 VanDerWaalsContact O-CB 3.3Å; N82-I86 WeakPolarHBondContact O-CB 3.4Å; N82-I86 WeakPolarHBondContact O-CD1 3.48Å; N82-I86 WeakPolarHBondContact O-CG1 3.41Å; N82-I86 PolarHBondContact O-N 3.29Å |
| 83 | V | 63.1 | Low | 60.2 | Low | 71 Ų | 71 | 85 Ų | 85 | 43% | 0.43 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -60.7 | -43.1 | 175.8 | 170.4 | 0 | 0 | 0 | 0 | 111 | W79 F81 L87 | W79-V83 VanDerWaalsContact O-CG2 3.24Å; W79-V83 WeakPolarHBondContact O-CG2 3.09Å; W79-V83 PolarHBondContact O-N 2.87Å; W79-V83 VanDerWaalsContact O-N 3.14Å; F81-V83 VanDerWaalsContact C-N 3.31Å; F81-V83 PolarHBondContact O-N 3.43Å; V83-L87 WeakPolarHBondContact O-CB 3.46Å; V83-L87 PolarHBondContact O-N 3.47Å |
| 84 | G | 62.2 | Low | 61.1 | Low | 2 Ų | 2 | 84 Ų | 84 | 2% | 0.021 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -60.4 | -52.9 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | W80 F81 N82 I86 L87 L88 F133 | W80-G84 PolarHBondContact O-N 3.16Å; W80-G84 VanDerWaalsContact O-N 3.08Å; F81-G84 PolarHBondContact O-N 3.45Å; N82-G84 VanDerWaalsContact C-N 3.32Å; N82-G84 PolarHBondContact O-N 3.39Å; G84-I86 PolarHBondContact O-N 2.85Å; G84-L87 PolarHBondContact O-N 2.77Å; G84-L87 VanDerWaalsContact O-N 3.08Å; G84-L88 PolarHBondContact O-N 3.02Å; G84-F133 WeakPolarHBondContact O-CE2 3.11Å; G84-F133 WeakPolarHBondContact O-CZ 3.39Å |
| 85 | L | 65.6 | Low | 61.8 | Low | 87 Ų | 87 | 79.9 Ų | 79.9 | 46% | 0.455 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -59.5 | -43.6 | -177.8 | -173.8 | 67.1 | 0 | 0 | 0 | 112.8 | F81 N82 L87 L88 G89 | F81-L85 HydrophobicContact CE1-CB 4.44Å; F81-L85 HydrophobicContact CE1-CD2 4.28Å; F81-L85 WeakPolarHBondContact O-CB 3.37Å; F81-L85 PolarHBondContact O-N 2.76Å; N82-L85 PolarHBondContact O-N 2.89Å; L85-L87 VanDerWaalsContact C-N 3.28Å; L85-L87 PolarHBondContact O-N 3.35Å; L85-L88 WeakPolarHBondContact O-CB 3.47Å; L85-L88 PolarHBondContact O-N 2.91Å; L85-G89 PolarHBondContact O-N 3.37Å |
| 86 | I | 65.4 | Low | 62.7 | Low | 104 Ų | 104 | 77.2 Ų | 77.2 | 53% | 0.533 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -59.8 | -43.3 | 175.9 | -71.2 | 164.7 | 0 | 0 | 0 | 109.8 | N82 G84 G89 I90 | N82-I86 VanDerWaalsContact O-CB 3.3Å; N82-I86 WeakPolarHBondContact O-CB 3.4Å; N82-I86 WeakPolarHBondContact O-CD1 3.48Å; N82-I86 WeakPolarHBondContact O-CG1 3.41Å; N82-I86 PolarHBondContact O-N 3.29Å; G84-I86 PolarHBondContact O-N 2.85Å; I86-G89 PolarHBondContact O-N 2.99Å; I86-I90 HydrophobicContact CG2-CD1 3.84Å; I86-I90 VanDerWaalsContact O-CG1 3.26Å; I86-I90 WeakPolarHBondContact O-CG1 3.4Å; I86-I90 PolarHBondContact O-N 2.84Å |
| 87 | L | 64.3 | Low | 63.8 | Low | 53 Ų | 53 | 76.9 Ų | 76.9 | 28% | 0.277 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -72 | -31 | -179.3 | -157.6 | 78 | 0 | 0 | 0 | 113.1 | V83 G84 L85 I90 C91 A129 S132 | V83-L87 WeakPolarHBondContact O-CB 3.46Å; V83-L87 PolarHBondContact O-N 3.47Å; G84-L87 PolarHBondContact O-N 2.77Å; G84-L87 VanDerWaalsContact O-N 3.08Å; L85-L87 VanDerWaalsContact C-N 3.28Å; L85-L87 PolarHBondContact O-N 3.35Å; L87-I90 HydrophobicContact CD1-CD1 4.43Å; L87-I90 PolarHBondContact O-N 2.84Å; L87-C91 WeakPolarHBondContact O-CB 3.34Å; L87-C91 PolarHBondContact O-N 3.41Å; L87-A129 HydrophobicContact CD2-CB 4.42Å; L87-S132 WeakPolarHBondContact CD2-OG 3.02Å |
| 88 | L | 64.6 | Low | 64.3 | Low | 76 Ų | 76 | 74.8 Ų | 74.8 | 40% | 0.398 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -62.8 | -47.9 | 169.5 | -160.2 | 97.7 | 0 | 0 | 0 | 110.4 | G84 L85 I90 C91 L92 F133 | G84-L88 PolarHBondContact O-N 3.02Å; L85-L88 WeakPolarHBondContact O-CB 3.47Å; L85-L88 PolarHBondContact O-N 2.91Å; L88-I90 VanDerWaalsContact C-N 3.25Å; L88-I90 PolarHBondContact O-N 3.39Å; L88-C91 PolarHBondContact O-N 3.06Å; L88-C91 VanDerWaalsContact O-N 3.1Å; L88-L92 WeakPolarHBondContact O-CB 3.4Å; L88-L92 PolarHBondContact O-N 3.02Å; L88-F133 HydrophobicContact CB-CE2 3.44Å; L88-F133 VanDerWaalsContact CB-CE2 3.44Å; L88-F133 HydrophobicContact CB-CZ 3.44Å; L88-F133 VanDerWaalsContact CB-CZ 3.44Å; L88-F133 HydrophobicContact CD1-CD2 4.08Å; L88-F133 HydrophobicContact CD1-CE1 3.97Å; L88-F133 HydrophobicContact CD1-CE2 3.42Å; L88-F133 VanDerWaalsContact CD1-CE2 3.42Å; L88-F133 HydrophobicContact CD1-CZ 3.42Å; L88-F133 VanDerWaalsContact CD1-CZ 3.42Å; L88-F133 HydrophobicContact CG-CE2 4.03Å; L88-F133 HydrophobicContact CG-CZ 4Å |
| 89 | G | 66.9 | Low | 64.8 | Low | 33 Ų | 33 | 73.9 Ų | 73.9 | 34% | 0.34 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -57.6 | -43.9 | 179.6 | 0 | 0 | 0 | 0 | 0 | 110.4 | L85 I86 L92 C93 | L85-G89 PolarHBondContact O-N 3.37Å; I86-G89 PolarHBondContact O-N 2.99Å; G89-L92 PolarHBondContact O-N 3.32Å; G89-C93 WeakPolarHBondContact O-CB 2.97Å; G89-C93 PolarHBondContact O-N 2.9Å; G89-C93 PolarHBondContact O-SG 3.45Å |
| 90 | I | 68.2 | Low | 65.2 | Low | 83 Ų | 83 | 68.3 Ų | 68.3 | 43% | 0.426 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -60.9 | -48 | 174.3 | -67.7 | 163.6 | 0 | 0 | 0 | 110.8 | I86 L87 L88 L92 C93 L94 | I86-I90 HydrophobicContact CG2-CD1 3.84Å; I86-I90 VanDerWaalsContact O-CG1 3.26Å; I86-I90 WeakPolarHBondContact O-CG1 3.4Å; I86-I90 PolarHBondContact O-N 2.84Å; L87-I90 HydrophobicContact CD1-CD1 4.43Å; L87-I90 PolarHBondContact O-N 2.84Å; L88-I90 VanDerWaalsContact C-N 3.25Å; L88-I90 PolarHBondContact O-N 3.39Å; I90-L92 PolarHBondContact O-N 3.07Å; I90-C93 PolarHBondContact O-N 3.36Å; I90-L94 HydrophobicContact CG2-CD1 3.55Å; I90-L94 WeakPolarHBondContact O-CB 3.46Å; I90-L94 VanDerWaalsContact O-CD1 3.3Å; I90-L94 WeakPolarHBondContact O-CD1 3.42Å; I90-L94 PolarHBondContact O-N 2.92Å |
| 91 | C | 65.7 | Low | 65.3 | Low | 25 Ų | 25 | 65.9 Ų | 65.9 | 17% | 0.169 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -62.2 | -43.7 | 179.8 | -172 | 0 | 0 | 0 | 0 | 112.6 | L87 L88 L94 A95 A129 | L87-C91 WeakPolarHBondContact O-CB 3.34Å; L87-C91 PolarHBondContact O-N 3.41Å; L88-C91 PolarHBondContact O-N 3.06Å; L88-C91 VanDerWaalsContact O-N 3.1Å; C91-L94 PolarHBondContact O-N 2.92Å; C91-A95 PolarHBondContact O-N 2.84Å; C91-A129 HydrophobicContact CB-CB 3.84Å |
| 92 | L | 68.9 | Low | 65.4 | Low | 88 Ų | 88 | 66 Ų | 66 | 46% | 0.461 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -67.1 | -41.1 | 178 | -152 | 79.9 | 0 | 0 | 0 | 111.4 | L88 G89 I90 A95 M96 V156 | L88-L92 WeakPolarHBondContact O-CB 3.4Å; L88-L92 PolarHBondContact O-N 3.02Å; G89-L92 PolarHBondContact O-N 3.32Å; I90-L92 PolarHBondContact O-N 3.07Å; L92-A95 PolarHBondContact O-N 3.26Å; L92-M96 WeakPolarHBondContact O-CB 3.43Å; L92-M96 WeakPolarHBondContact O-CG 3.05Å; L92-M96 PolarHBondContact O-N 2.85Å; L92-V156 HydrophobicContact CD1-CG1 4.45Å |
| 93 | C | 70.2 | Confident | 65 | Low | 89 Ų | 89 | 68.7 Ų | 68.7 | 60% | 0.601 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -62.5 | -41.2 | 172.6 | -78.4 | 0 | 0 | 0 | 0 | 111.7 | G89 I90 F97 | G89-C93 WeakPolarHBondContact O-CB 2.97Å; G89-C93 PolarHBondContact O-N 2.9Å; G89-C93 PolarHBondContact O-SG 3.45Å; I90-C93 PolarHBondContact O-N 3.36Å; C93-F97 WeakPolarHBondContact O-CA 3.48Å; C93-F97 WeakPolarHBondContact O-CB 3.35Å; C93-F97 PolarHBondContact O-N 3.45Å |
| 94 | L | 68.1 | Low | 64.6 | Low | 57 Ų | 57 | 75.8 Ų | 75.8 | 30% | 0.298 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -64.4 | -40.3 | 174.9 | -98.2 | 125.4 | 0 | 0 | 0 | 112.3 | I90 C91 F97 C98 | I90-L94 HydrophobicContact CG2-CD1 3.55Å; I90-L94 WeakPolarHBondContact O-CB 3.46Å; I90-L94 VanDerWaalsContact O-CD1 3.3Å; I90-L94 WeakPolarHBondContact O-CD1 3.42Å; I90-L94 PolarHBondContact O-N 2.92Å; C91-L94 PolarHBondContact O-N 2.92Å; L94-F97 PolarHBondContact O-N 3.48Å; L94-C98 PolarHBondContact O-N 2.99Å |
| 95 | A | 65.3 | Low | 64 | Low | 22 Ų | 22 | 83.3 Ų | 83.3 | 18% | 0.182 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -65.9 | -49.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | C91 L92 F97 C98 I99 I160 | C91-A95 PolarHBondContact O-N 2.84Å; L92-A95 PolarHBondContact O-N 3.26Å; A95-F97 VanDerWaalsContact C-N 3.29Å; A95-F97 PolarHBondContact O-N 3.29Å; A95-C98 WeakPolarHBondContact O-CB 3.47Å; A95-C98 PolarHBondContact O-N 2.98Å; A95-C98 VanDerWaalsContact O-N 3.13Å; A95-I99 WeakPolarHBondContact O-CG1 3.43Å; A95-I99 PolarHBondContact O-N 3.14Å; A95-I160 HydrophobicContact CB-CD1 3.97Å |
| 96 | M | 68.3 | Low | 63.2 | Low | 100 Ų | 100 | 83 Ų | 83 | 49% | 0.493 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -61.5 | -39 | 174.8 | -72.8 | -69.3 | -75.5 | 0 | 0 | 111.7 | L92 I99 V100 | L92-M96 WeakPolarHBondContact O-CB 3.43Å; L92-M96 WeakPolarHBondContact O-CG 3.05Å; L92-M96 PolarHBondContact O-N 2.85Å; M96-I99 PolarHBondContact O-N 2.85Å; M96-I99 HydrophobicContact SD-CD1 4.48Å; M96-V100 WeakPolarHBondContact O-CB 3.17Å; M96-V100 VanDerWaalsContact O-CG2 3.28Å; M96-V100 WeakPolarHBondContact O-CG2 3.44Å; M96-V100 PolarHBondContact O-N 3.45Å |
| 97 | F | 69.4 | Low | 62.6 | Low | 127 Ų | 127 | 81.5 Ų | 81.5 | 56% | 0.557 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -65.9 | -39.7 | 174.4 | -173.8 | -95.3 | 0 | 0 | 0 | 111 | C93 L94 A95 Y101 | C93-F97 WeakPolarHBondContact O-CA 3.48Å; C93-F97 WeakPolarHBondContact O-CB 3.35Å; C93-F97 PolarHBondContact O-N 3.45Å; L94-F97 PolarHBondContact O-N 3.48Å; A95-F97 VanDerWaalsContact C-N 3.29Å; A95-F97 PolarHBondContact O-N 3.29Å; F97-Y101 HydrophobicContact CD1-CG 4.48Å; F97-Y101 HydrophobicContact CE1-CD1 4.37Å; F97-Y101 AromaticContact CE1-CD2 3.89Å; F97-Y101 HydrophobicContact CE1-CD2 3.89Å; F97-Y101 AromaticContact CE1-CG 3.82Å; F97-Y101 HydrophobicContact CE1-CG 3.82Å; F97-Y101 HydrophobicContact CE2-CD2 4.15Å; F97-Y101 AromaticContact CZ-CD2 3.49Å; F97-Y101 HydrophobicContact CZ-CD2 3.49Å; F97-Y101 VanDerWaalsContact CZ-CD2 3.49Å; F97-Y101 HydrophobicContact CZ-CE2 4.05Å; F97-Y101 AromaticContact CZ-CG 3.9Å; F97-Y101 HydrophobicContact CZ-CG 3.9Å; F97-Y101 WeakPolarHBondContact O-CA 3.43Å; F97-Y101 WeakPolarHBondContact O-CB 3.46Å; F97-Y101 PolarHBondContact O-N 2.77Å |
| 98 | C | 60.5 | Low | 61.6 | Low | 19 Ų | 19 | 86.4 Ų | 86.4 | 13% | 0.128 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -57.7 | -53.7 | 171.3 | -91.6 | 0 | 0 | 0 | 0 | 110.6 | L94 A95 V100 Y101 L102 | L94-C98 PolarHBondContact O-N 2.99Å; A95-C98 WeakPolarHBondContact O-CB 3.47Å; A95-C98 PolarHBondContact O-N 2.98Å; A95-C98 VanDerWaalsContact O-N 3.13Å; C98-V100 PolarHBondContact O-N 3.17Å; C98-Y101 PolarHBondContact O-N 3.26Å; C98-L102 HydrophobicContact CB-CD1 3.87Å; C98-L102 WeakPolarHBondContact O-CA 3.3Å; C98-L102 WeakPolarHBondContact O-CB 3.19Å; C98-L102 WeakPolarHBondContact O-CD1 3.37Å; C98-L102 WeakPolarHBondContact O-CG 3.21Å; C98-L102 PolarHBondContact O-N 2.91Å |
| 99 | I | 66.1 | Low | 60.8 | Low | 29 Ų | 29 | 91.1 Ų | 91.1 | 15% | 0.149 | 47% | 0.47 | C | S | . | . | H | α-helix | trans | -57.3 | -53.7 | -178.6 | -59.8 | 159.1 | 0 | 0 | 0 | 110.5 | A95 M96 E103 I160 | A95-I99 WeakPolarHBondContact O-CG1 3.43Å; A95-I99 PolarHBondContact O-N 3.14Å; M96-I99 PolarHBondContact O-N 2.85Å; M96-I99 HydrophobicContact SD-CD1 4.48Å; I99-E103 VanDerWaalsContact O-CB 3.25Å; I99-E103 WeakPolarHBondContact O-CB 3.42Å; I99-E103 PolarHBondContact O-N 3.11Å; I99-I160 HydrophobicContact CD1-CB 4.24Å; I99-I160 HydrophobicContact CD1-CG1 4.03Å; I99-I160 HydrophobicContact CD1-CG2 3.55Å; I99-I160 HydrophobicContact CG1-CG2 3.99Å |
| 100 | V | 67.6 | Low | 59.8 | Low | 79 Ų | 79 | 98.2 Ų | 98.2 | 48% | 0.479 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -68.5 | -40.3 | -177.3 | 175.9 | 0 | 0 | 0 | 0 | 112.2 | M96 C98 W104 | M96-V100 WeakPolarHBondContact O-CB 3.17Å; M96-V100 VanDerWaalsContact O-CG2 3.28Å; M96-V100 WeakPolarHBondContact O-CG2 3.44Å; M96-V100 PolarHBondContact O-N 3.45Å; C98-V100 PolarHBondContact O-N 3.17Å; V100-W104 HydrophobicContact CG1-CB 4.5Å; V100-W104 WeakPolarHBondContact O-CA 3.48Å; V100-W104 WeakPolarHBondContact O-CB 3.44Å; V100-W104 PolarHBondContact O-N 3.3Å |
| 101 | Y | 60.3 | Low | 58.8 | Low | 114 Ų | 114 | 98.9 Ų | 98.9 | 45% | 0.447 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -73.9 | -36.3 | -179.7 | -171 | -96.2 | 0 | 0 | 0 | 111.8 | F97 C98 F105 | F97-Y101 HydrophobicContact CD1-CG 4.48Å; F97-Y101 HydrophobicContact CE1-CD1 4.37Å; F97-Y101 AromaticContact CE1-CD2 3.89Å; F97-Y101 HydrophobicContact CE1-CD2 3.89Å; F97-Y101 AromaticContact CE1-CG 3.82Å; F97-Y101 HydrophobicContact CE1-CG 3.82Å; F97-Y101 HydrophobicContact CE2-CD2 4.15Å; F97-Y101 AromaticContact CZ-CD2 3.49Å; F97-Y101 HydrophobicContact CZ-CD2 3.49Å; F97-Y101 VanDerWaalsContact CZ-CD2 3.49Å; F97-Y101 HydrophobicContact CZ-CE2 4.05Å; F97-Y101 AromaticContact CZ-CG 3.9Å; F97-Y101 HydrophobicContact CZ-CG 3.9Å; F97-Y101 WeakPolarHBondContact O-CA 3.43Å; F97-Y101 WeakPolarHBondContact O-CB 3.46Å; F97-Y101 PolarHBondContact O-N 2.77Å; C98-Y101 PolarHBondContact O-N 3.26Å; Y101-F105 VanDerWaalsContact O-CB 3.24Å; Y101-F105 WeakPolarHBondContact O-CB 3.18Å; Y101-F105 PolarHBondContact O-N 3.1Å |
| 102 | L | 60.3 | Low | 57.8 | Low | 52 Ų | 52 | 105.3 Ų | 105.3 | 27% | 0.272 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -71.8 | -46.4 | 173.3 | -80 | 131.9 | 0 | 0 | 0 | 111.2 | C98 K106 | C98-L102 HydrophobicContact CB-CD1 3.87Å; C98-L102 WeakPolarHBondContact O-CA 3.3Å; C98-L102 WeakPolarHBondContact O-CB 3.19Å; C98-L102 WeakPolarHBondContact O-CD1 3.37Å; C98-L102 WeakPolarHBondContact O-CG 3.21Å; C98-L102 PolarHBondContact O-N 2.91Å; L102-K106 HydrophobicContact CD2-CD 3.74Å; L102-K106 HydrophobicContact CG-CD 4.48Å; L102-K106 WeakPolarHBondContact O-CB 3.23Å; L102-K106 PolarHBondContact O-N 2.98Å |
| 103 | E | 54.9 | Low | 56.6 | Low | 132 Ų | 132 | 109.8 Ų | 109.8 | 62% | 0.617 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -68.9 | -48.6 | 178.5 | -85.7 | -166 | 93.1 | 0 | 0 | 112.8 | I99 | I99-E103 VanDerWaalsContact O-CB 3.25Å; I99-E103 WeakPolarHBondContact O-CB 3.42Å; I99-E103 PolarHBondContact O-N 3.11Å |
| 104 | W | 53.4 | Low | 55.6 | Low | 220 Ų | 220 | 113.2 Ų | 113.2 | 83% | 0.833 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -80.2 | -32.3 | -169.5 | -162.2 | -78.8 | 0 | 0 | 0 | 112.9 | V100 | V100-W104 HydrophobicContact CG1-CB 4.5Å; V100-W104 WeakPolarHBondContact O-CA 3.48Å; V100-W104 WeakPolarHBondContact O-CB 3.44Å; V100-W104 PolarHBondContact O-N 3.3Å |
| 105 | F | 49.8 | Very low | 54.6 | Low | 161 Ų | 161 | 117.3 Ų | 117.3 | 71% | 0.706 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -102.1 | -17.2 | -175.1 | -109.7 | -90.2 | 0 | 0 | 0 | 114.2 | Y101 | Y101-F105 VanDerWaalsContact O-CB 3.24Å; Y101-F105 WeakPolarHBondContact O-CB 3.18Å; Y101-F105 PolarHBondContact O-N 3.1Å |
| 106 | K | 49.8 | Very low | 53.8 | Low | 79 Ų | 79 | 121.4 Ų | 121.4 | 34% | 0.343 | 59% | 0.588 | S | S | . | * | trans | -116.5 | 36.9 | -163.8 | -139.4 | -175.7 | -173.3 | 177.2 | 0 | 114.7 | L102 I108 Y111 | L102-K106 HydrophobicContact CD2-CD 3.74Å; L102-K106 HydrophobicContact CG-CD 4.48Å; L102-K106 WeakPolarHBondContact O-CB 3.23Å; L102-K106 PolarHBondContact O-N 2.98Å; K106-I108 PolarHBondContact O-N 2.79Å; K106-I108 VanDerWaalsContact O-N 3.14Å; K106-Y111 HydrophobicContact CD-CD2 4.37Å; K106-Y111 VanDerWaalsContact CE-CE2 3.42Å; K106-Y111 VanDerWaalsContact NZ-CE1 3.25Å | ||
| 107 | G | 52.2 | Low | 53.2 | Low | 74 Ų | 74 | 118.5 Ų | 118.5 | 76% | 0.763 | 58% | 0.58 | S | S | * | * | trans | -67.8 | 2.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 108 | I | 43.8 | Very low | 52.6 | Low | 156 Ų | 156 | 114.8 Ų | 114.8 | 80% | 0.8 | 57% | 0.565 | S | S | * | * | S | Bend | trans | -150.2 | 116.3 | 175.5 | -15.9 | 178.1 | 0 | 0 | 0 | 113.2 | K106 H110 | K106-I108 PolarHBondContact O-N 2.79Å; K106-I108 VanDerWaalsContact O-N 3.14Å; I108-H110 PolarHBondContact O-N 3.38Å |
| 109 | Q | 47 | Very low | 52.5 | Low | 174 Ų | 174 | 116 Ų | 116 | 81% | 0.813 | 57% | 0.573 | S | S | * | * | S | Bend | trans | 2.1 | 98.7 | 148 | -78.6 | -106.8 | -64 | 0 | 0 | 117.4 | ||
| 110 | H | 45.1 | Very low | 52.2 | Low | 182 Ų | 182 | 117.5 Ų | 117.5 | 84% | 0.843 | 59% | 0.585 | S | S | * | * | trans | 170.8 | 78.8 | 134.7 | -96.1 | 75.1 | 0 | 0 | 0 | 107.4 | I108 | I108-H110 PolarHBondContact O-N 3.38Š| ||
| 111 | Y | 47.3 | Very low | 52.1 | Low | 97 Ų | 97 | 118.3 Ų | 118.3 | 38% | 0.38 | 59% | 0.585 | S | S | . | * | trans | -115.2 | 18.9 | -179 | -154.8 | -101.3 | 0 | 0 | 0 | 113 | K106 Q113 Y115 I118 | K106-Y111 HydrophobicContact CD-CD2 4.37Å; K106-Y111 VanDerWaalsContact CE-CE2 3.42Å; K106-Y111 VanDerWaalsContact NZ-CE1 3.25Å; Y111-Q113 VanDerWaalsContact C-N 3.34Å; Y111-Y115 WeakPolarHBondContact OH-CB 3.4Å; Y111-I118 HydrophobicContact CE1-CD1 4.47Å; Y111-I118 WeakPolarHBondContact OH-CD1 3.27Å; Y111-I118 WeakPolarHBondContact OH-CG1 3.38Å | ||
| 112 | D | 44.6 | Very low | 52.3 | Low | 160 Ų | 160 | 115.1 Ų | 115.1 | 86% | 0.856 | 58% | 0.577 | S | S | * | * | S | Bend | trans | -81.8 | -16.7 | -174 | -152.4 | -115.7 | 0 | 0 | 0 | 112.8 | ||
| 113 | Q | 45.4 | Very low | 52.6 | Low | 183 Ų | 183 | 113.9 Ų | 113.9 | 86% | 0.855 | 57% | 0.572 | S | S | * | * | S | Bend | trans | -116.3 | -18.9 | -160.4 | -159.3 | 138.8 | 2.6 | 0 | 0 | 116.8 | Y111 | Y111-Q113 VanDerWaalsContact C-N 3.34Š|
| 114 | E | 47.5 | Very low | 53.2 | Low | 161 Ų | 161 | 110.4 Ų | 110.4 | 75% | 0.752 | 57% | 0.566 | S | S | * | * | S | Bend | trans | -107.9 | -30.6 | -169.2 | -151 | 124.9 | 90.2 | 0 | 0 | 115 | ||
| 115 | Y | 47.2 | Very low | 53.9 | Low | 142 Ų | 142 | 101.4 Ų | 101.4 | 56% | 0.557 | 54% | 0.538 | S | S | * | . | trans | -146.8 | 72.9 | -176 | -84.2 | -85.6 | 0 | 0 | 0 | 114.7 | Y111 A117 | Y111-Y115 WeakPolarHBondContact OH-CB 3.4Å; Y115-A117 PolarHBondContact O-N 3.26Å | ||
| 116 | P | 50.3 | Low | 54.9 | Low | 108 Ų | 108 | 96.1 Ų | 96.1 | 70% | 0.701 | 52% | 0.516 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.5 | -1.9 | 169.1 | 28.1 | -35.1 | 0 | 0 | 0 | 113.8 | ||
| 117 | A | 54.4 | Low | 55.9 | Low | 39 Ų | 39 | 95.1 Ų | 95.1 | 32% | 0.322 | 51% | 0.513 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -91.5 | -10.2 | -176.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | Y115 P120 I121 | Y115-A117 PolarHBondContact O-N 3.26Å; A117-P120 VanDerWaalsContact C-CD 3.41Å; A117-P120 WeakPolarHBondContact O-CD 3.22Å; A117-P120 WeakPolarHBondContact O-CG 3.47Å; A117-I121 HydrophobicContact CB-CD1 3.95Å; A117-I121 WeakPolarHBondContact O-CB 3.48Å; A117-I121 VanDerWaalsContact O-CD1 3.22Å; A117-I121 WeakPolarHBondContact O-CD1 3.01Å; A117-I121 WeakPolarHBondContact O-CG1 2.96Å; A117-I121 PolarHBondContact O-N 2.87Å |
| 118 | I | 57.1 | Low | 56.7 | Low | 50 Ų | 50 | 94.1 Ų | 94.1 | 26% | 0.256 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.4 | -49.6 | -178.1 | -58.2 | -150.9 | 0 | 0 | 0 | 112.5 | Y111 I121 T122 | Y111-I118 HydrophobicContact CE1-CD1 4.47Å; Y111-I118 WeakPolarHBondContact OH-CD1 3.27Å; Y111-I118 WeakPolarHBondContact OH-CG1 3.38Å; I118-I121 PolarHBondContact O-N 3.36Å; I118-T122 PolarHBondContact O-N 3.48Å; I118-T122 PolarHBondContact O-OG1 2.96Å |
| 119 | P | 58.8 | Low | 57.7 | Low | 45 Ų | 45 | 86.9 Ų | 86.9 | 29% | 0.292 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -59.9 | -44.9 | 178.2 | -22.4 | 32.8 | 0 | 0 | 0 | 114.3 | K33 I121 T123 | K33-P119 HydrophobicContact CD-CB 4.27Å; K33-P119 HydrophobicContact CG-CB 4.28Å; P119-I121 VanDerWaalsContact C-N 3.33Å; P119-I121 PolarHBondContact O-N 3.48Å; P119-T123 WeakPolarHBondContact O-CB 3.35Å; P119-T123 PolarHBondContact O-N 3.46Å; P119-T123 PolarHBondContact O-OG1 2.93Å |
| 120 | P | 59.7 | Low | 58.8 | Low | 60 Ų | 60 | 80.6 Ų | 80.6 | 39% | 0.39 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -69.1 | -27.8 | 176.9 | 25 | -32.6 | 0 | 0 | 0 | 113.3 | A117 A124 | A117-P120 VanDerWaalsContact C-CD 3.41Å; A117-P120 WeakPolarHBondContact O-CD 3.22Å; A117-P120 WeakPolarHBondContact O-CG 3.47Å; P120-A124 WeakPolarHBondContact O-CB 3.4Å; P120-A124 PolarHBondContact O-N 2.94Å |
| 121 | I | 64.9 | Low | 59.9 | Low | 96 Ų | 96 | 75.3 Ų | 75.3 | 49% | 0.492 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -67.3 | -48.8 | 174.8 | -70.6 | 162.5 | 0 | 0 | 0 | 110.7 | A117 I118 P119 T123 A124 A125 | A117-I121 HydrophobicContact CB-CD1 3.95Å; A117-I121 WeakPolarHBondContact O-CB 3.48Å; A117-I121 VanDerWaalsContact O-CD1 3.22Å; A117-I121 WeakPolarHBondContact O-CD1 3.01Å; A117-I121 WeakPolarHBondContact O-CG1 2.96Å; A117-I121 PolarHBondContact O-N 2.87Å; I118-I121 PolarHBondContact O-N 3.36Å; P119-I121 VanDerWaalsContact C-N 3.33Å; P119-I121 PolarHBondContact O-N 3.48Å; I121-T123 VanDerWaalsContact C-N 3.29Å; I121-T123 PolarHBondContact O-N 2.92Å; I121-A124 PolarHBondContact O-N 2.68Å; I121-A125 WeakPolarHBondContact O-CB 3.49Å; I121-A125 PolarHBondContact O-N 3.06Å |
| 122 | T | 63.8 | Low | 60.7 | Low | 46 Ų | 46 | 72.1 Ų | 72.1 | 28% | 0.282 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -61.7 | -41.1 | 178.2 | -56.6 | 0 | 0 | 0 | 0 | 110.9 | I118 A125 F126 | I118-T122 PolarHBondContact O-N 3.48Å; I118-T122 PolarHBondContact O-OG1 2.96Å; T122-A125 PolarHBondContact O-N 3.33Å; T122-F126 WeakPolarHBondContact O-CB 3.47Å; T122-F126 PolarHBondContact O-N 3.44Å |
| 123 | T | 68 | Low | 61.7 | Low | 26 Ų | 26 | 65.5 Ų | 65.5 | 16% | 0.16 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -64.9 | -46.7 | 175.2 | -49.9 | 0 | 0 | 0 | 0 | 111.9 | T25 V29 P119 I121 A125 F126 I127 | T25-T123 HydrophobicContact CG2-CG2 3.98Å; V29-T123 HydrophobicContact CG2-CG2 3.08Å; V29-T123 WeakPolarHBondContact CG2-OG1 3.31Å; P119-T123 WeakPolarHBondContact O-CB 3.35Å; P119-T123 PolarHBondContact O-N 3.46Å; P119-T123 PolarHBondContact O-OG1 2.93Å; I121-T123 VanDerWaalsContact C-N 3.29Å; I121-T123 PolarHBondContact O-N 2.92Å; T123-A125 VanDerWaalsContact C-N 3.26Å; T123-A125 PolarHBondContact O-N 2.96Å; T123-F126 WeakPolarHBondContact O-CB 3.47Å; T123-F126 PolarHBondContact O-N 2.96Å; T123-I127 HydrophobicContact CG2-CD1 3.71Å; T123-I127 HydrophobicContact CG2-CG1 4.23Å; T123-I127 WeakPolarHBondContact O-CG1 3.48Å; T123-I127 PolarHBondContact O-N 3.1Å |
| 124 | A | 67.6 | Low | 62.9 | Low | 60 Ų | 60 | 58.9 Ų | 58.9 | 50% | 0.496 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -60.9 | -40.3 | 179.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | P120 I121 A128 | P120-A124 WeakPolarHBondContact O-CB 3.4Å; P120-A124 PolarHBondContact O-N 2.94Å; I121-A124 PolarHBondContact O-N 2.68Å; A124-A128 WeakPolarHBondContact O-CB 3.3Å; A124-A128 PolarHBondContact O-N 3.38Å |
| 125 | A | 67.3 | Low | 63.8 | Low | 30 Ų | 30 | 56.1 Ų | 56.1 | 25% | 0.248 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -63.2 | -42.3 | 173 | 0 | 0 | 0 | 0 | 0 | 111.6 | I121 T122 T123 A128 A129 | I121-A125 WeakPolarHBondContact O-CB 3.49Å; I121-A125 PolarHBondContact O-N 3.06Å; T122-A125 PolarHBondContact O-N 3.33Å; T123-A125 VanDerWaalsContact C-N 3.26Å; T123-A125 PolarHBondContact O-N 2.96Å; A125-A128 PolarHBondContact O-N 2.87Å; A125-A129 VanDerWaalsContact O-CB 3.31Å; A125-A129 WeakPolarHBondContact O-CB 3.41Å; A125-A129 PolarHBondContact O-N 3.22Å |
| 126 | F | 69.9 | Low | 64.5 | Low | 51 Ų | 51 | 50 Ų | 50 | 22% | 0.224 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -64.3 | -45.9 | 178.3 | -175.8 | -97.3 | 0 | 0 | 0 | 112.7 | T122 T123 A129 S130 F153 | T122-F126 WeakPolarHBondContact O-CB 3.47Å; T122-F126 PolarHBondContact O-N 3.44Å; T123-F126 WeakPolarHBondContact O-CB 3.47Å; T123-F126 PolarHBondContact O-N 2.96Å; F126-A129 WeakPolarHBondContact O-CB 3.33Å; F126-A129 PolarHBondContact O-N 3.45Å; F126-S130 WeakPolarHBondContact O-CB 3.4Å; F126-S130 PolarHBondContact O-N 3.12Å; F126-F153 HydrophobicContact CD1-CD2 4.45Å; F126-F153 HydrophobicContact CD1-CE1 4.25Å; F126-F153 AromaticContact CD1-CE2 3.69Å; F126-F153 HydrophobicContact CD1-CE2 3.69Å; F126-F153 AromaticContact CD1-CZ 3.56Å; F126-F153 HydrophobicContact CD1-CZ 3.56Å; F126-F153 HydrophobicContact CD2-CD2 4.02Å; F126-F153 AromaticContact CD2-CE2 3.51Å; F126-F153 HydrophobicContact CD2-CE2 3.51Å; F126-F153 HydrophobicContact CD2-CZ 4.24Å; F126-F153 AromaticContact CE1-CD1 3.81Å; F126-F153 HydrophobicContact CE1-CD1 3.81Å; F126-F153 AromaticContact CE1-CD2 3.57Å; F126-F153 HydrophobicContact CE1-CD2 3.57Å; F126-F153 AromaticContact CE1-CE1 3.44Å; F126-F153 HydrophobicContact CE1-CE1 3.44Å; F126-F153 VanDerWaalsContact CE1-CE1 3.44Å; F126-F153 AromaticContact CE1-CE2 3.18Å; F126-F153 HydrophobicContact CE1-CE2 3.18Å; F126-F153 AromaticContact CE1-CG 3.85Å; F126-F153 HydrophobicContact CE1-CG 3.85Å; F126-F153 AromaticContact CE1-CZ 3.09Å; F126-F153 HydrophobicContact CE1-CZ 3.09Å; F126-F153 AromaticContact CE2-CD2 3.04Å; F126-F153 HydrophobicContact CE2-CD2 3.04Å; F126-F153 AromaticContact CE2-CE2 3Å; F126-F153 HydrophobicContact CE2-CE2 3Å; F126-F153 AromaticContact CE2-CG 3.94Å; F126-F153 HydrophobicContact CE2-CG 3.94Å; F126-F153 AromaticContact CE2-CZ 3.88Å; F126-F153 HydrophobicContact CE2-CZ 3.88Å; F126-F153 AromaticContact CG-CE2 3.89Å; F126-F153 HydrophobicContact CG-CE2 3.89Å; F126-F153 HydrophobicContact CG-CZ 4.16Å; F126-F153 HydrophobicContact CZ-CB 4.08Å; F126-F153 AromaticContact CZ-CD1 3.72Å; F126-F153 HydrophobicContact CZ-CD1 3.72Å; F126-F153 AromaticContact CZ-CD2 2.81Å; F126-F153 HydrophobicContact CZ-CD2 2.81Å; F126-F153 AromaticContact CZ-CE1 3.77Å; F126-F153 HydrophobicContact CZ-CE1 3.77Å; F126-F153 AromaticContact CZ-CE2 2.87Å; F126-F153 HydrophobicContact CZ-CE2 2.87Å; F126-F153 AromaticContact CZ-CG 3.25Å; F126-F153 HydrophobicContact CZ-CG 3.25Å; F126-F153 AromaticContact CZ-CZ 3.37Å; F126-F153 HydrophobicContact CZ-CZ 3.37Å |
| 127 | I | 72.1 | Confident | 65 | Low | 57 Ų | 57 | 45.6 Ų | 45.6 | 29% | 0.292 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -67.1 | -41.6 | 177.3 | -66.1 | 171.1 | 0 | 0 | 0 | 110.8 | T25 T123 A129 S130 C131 | T25-I127 HydrophobicContact CG2-CD1 3.33Å; T123-I127 HydrophobicContact CG2-CD1 3.71Å; T123-I127 HydrophobicContact CG2-CG1 4.23Å; T123-I127 WeakPolarHBondContact O-CG1 3.48Å; T123-I127 PolarHBondContact O-N 3.1Å; I127-A129 VanDerWaalsContact C-N 3.3Å; I127-A129 PolarHBondContact O-N 3.45Å; I127-S130 PolarHBondContact O-N 2.74Å; I127-C131 WeakPolarHBondContact O-CB 3.31Å; I127-C131 PolarHBondContact O-N 3.48Å; I127-C131 PolarHBondContact O-SG 3.42Å; I127-C131 VanDerWaalsContact O-SG 3.39Å |
| 128 | A | 68.6 | Low | 65.3 | Low | 53 Ų | 53 | 50.2 Ų | 50.2 | 44% | 0.438 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -61.3 | -41.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | A124 A125 S132 | A124-A128 WeakPolarHBondContact O-CB 3.3Å; A124-A128 PolarHBondContact O-N 3.38Å; A125-A128 PolarHBondContact O-N 2.87Å; A128-S132 WeakPolarHBondContact O-CB 3.34Å; A128-S132 PolarHBondContact O-N 2.95Å; A128-S132 VanDerWaalsContact O-N 3.12Å; A128-S132 PolarHBondContact O-OG 2.84Å |
| 129 | A | 64.3 | Low | 65.3 | Low | 5 Ų | 5 | 51.8 Ų | 51.8 | 4% | 0.041 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -61.2 | -49.9 | 171.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | L87 C91 A125 F126 I127 C131 S132 F133 | L87-A129 HydrophobicContact CD2-CB 4.42Å; C91-A129 HydrophobicContact CB-CB 3.84Å; A125-A129 VanDerWaalsContact O-CB 3.31Å; A125-A129 WeakPolarHBondContact O-CB 3.41Å; A125-A129 PolarHBondContact O-N 3.22Å; F126-A129 WeakPolarHBondContact O-CB 3.33Å; F126-A129 PolarHBondContact O-N 3.45Å; I127-A129 VanDerWaalsContact C-N 3.3Å; I127-A129 PolarHBondContact O-N 3.45Å; A129-C131 PolarHBondContact O-N 3.39Å; A129-S132 PolarHBondContact O-N 3.36Å; A129-S132 PolarHBondContact O-OG 2.88Å; A129-F133 WeakPolarHBondContact O-CB 3.43Å; A129-F133 VanDerWaalsContact O-CD2 3.27Å; A129-F133 WeakPolarHBondContact O-CD2 3.48Å; A129-F133 PolarHBondContact O-N 3.4Å |
| 130 | S | 69.9 | Low | 65.2 | Low | 42 Ų | 42 | 52 Ų | 52 | 29% | 0.294 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -59.5 | -47.4 | -179.6 | -170 | 0 | 0 | 0 | 0 | 113 | F126 I127 F133 N134 | F126-S130 WeakPolarHBondContact O-CB 3.4Å; F126-S130 PolarHBondContact O-N 3.12Å; I127-S130 PolarHBondContact O-N 2.74Å; S130-F133 PolarHBondContact O-N 3.11Å; S130-N134 WeakPolarHBondContact O-CB 3Å; S130-N134 PolarHBondContact O-N 2.99Å |
| 131 | C | 68.3 | Low | 65 | Low | 71 Ų | 71 | 54.2 Ų | 54.2 | 48% | 0.48 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -64.5 | -45.3 | -179.5 | -73.4 | 0 | 0 | 0 | 0 | 112.6 | I127 A129 N134 I135 | I127-C131 WeakPolarHBondContact O-CB 3.31Å; I127-C131 PolarHBondContact O-N 3.48Å; I127-C131 PolarHBondContact O-SG 3.42Å; I127-C131 VanDerWaalsContact O-SG 3.39Å; A129-C131 PolarHBondContact O-N 3.39Å; C131-N134 WeakPolarHBondContact O-CB 3.48Å; C131-N134 PolarHBondContact O-N 3.47Å; C131-I135 WeakPolarHBondContact O-CD1 3.44Å; C131-I135 VanDerWaalsContact O-CG1 3.31Å; C131-I135 WeakPolarHBondContact O-CG1 3.41Å; C131-I135 PolarHBondContact O-N 3.42Å; C131-I135 VanDerWaalsContact O-N 3.1Å |
| 132 | S | 65.3 | Low | 64.9 | Low | 30 Ų | 30 | 52.4 Ų | 52.4 | 21% | 0.21 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -68.1 | -36.8 | 178.8 | 56.7 | 0 | 0 | 0 | 0 | 112.4 | L87 A128 A129 I135 A136 | L87-S132 WeakPolarHBondContact CD2-OG 3.02Å; A128-S132 WeakPolarHBondContact O-CB 3.34Å; A128-S132 PolarHBondContact O-N 2.95Å; A128-S132 VanDerWaalsContact O-N 3.12Å; A128-S132 PolarHBondContact O-OG 2.84Å; A129-S132 PolarHBondContact O-N 3.36Å; A129-S132 PolarHBondContact O-OG 2.88Å; S132-I135 PolarHBondContact O-N 2.91Å; S132-A136 VanDerWaalsContact O-CB 3.3Å; S132-A136 WeakPolarHBondContact O-CB 3.26Å; S132-A136 PolarHBondContact O-N 3.48Å |
| 133 | F | 64.9 | Low | 65 | Low | 21 Ų | 21 | 58.8 Ų | 58.8 | 9% | 0.092 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -63 | -42.1 | 171.6 | -98.2 | -80 | 0 | 0 | 0 | 112.2 | G84 L88 A129 S130 I135 A136 L137 L149 | G84-F133 WeakPolarHBondContact O-CE2 3.11Å; G84-F133 WeakPolarHBondContact O-CZ 3.39Å; L88-F133 HydrophobicContact CB-CE2 3.44Å; L88-F133 VanDerWaalsContact CB-CE2 3.44Å; L88-F133 HydrophobicContact CB-CZ 3.44Å; L88-F133 VanDerWaalsContact CB-CZ 3.44Å; L88-F133 HydrophobicContact CD1-CD2 4.08Å; L88-F133 HydrophobicContact CD1-CE1 3.97Å; L88-F133 HydrophobicContact CD1-CE2 3.42Å; L88-F133 VanDerWaalsContact CD1-CE2 3.42Å; L88-F133 HydrophobicContact CD1-CZ 3.42Å; L88-F133 VanDerWaalsContact CD1-CZ 3.42Å; L88-F133 HydrophobicContact CG-CE2 4.03Å; L88-F133 HydrophobicContact CG-CZ 4Å; A129-F133 WeakPolarHBondContact O-CB 3.43Å; A129-F133 VanDerWaalsContact O-CD2 3.27Å; A129-F133 WeakPolarHBondContact O-CD2 3.48Å; A129-F133 PolarHBondContact O-N 3.4Å; S130-F133 PolarHBondContact O-N 3.11Å; F133-I135 VanDerWaalsContact C-N 3.29Å; F133-I135 PolarHBondContact O-N 2.7Å; F133-A136 PolarHBondContact O-N 3.22Å; F133-L137 HydrophobicContact CD1-CD1 3.44Å; F133-L137 VanDerWaalsContact CD1-CD1 3.44Å; F133-L137 HydrophobicContact CE1-CD1 3.99Å; F133-L137 HydrophobicContact CG-CD1 4.46Å; F133-L137 WeakPolarHBondContact O-CB 3.46Å; F133-L137 VanDerWaalsContact O-CD1 3.29Å; F133-L137 WeakPolarHBondContact O-CD1 3.46Å; F133-L137 PolarHBondContact O-N 3.05Å; F133-L149 HydrophobicContact CB-CD1 4.16Å; F133-L149 HydrophobicContact CB-CD2 3.51Å; F133-L149 HydrophobicContact CB-CG 4.26Å |
| 134 | N | 70.3 | Confident | 64.9 | Low | 43 Ų | 43 | 62.4 Ų | 62.4 | 23% | 0.23 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -58.9 | -44.2 | 176.7 | -137.4 | -80.7 | 0 | 0 | 0 | 110.6 | S130 C131 W138 | S130-N134 WeakPolarHBondContact O-CB 3Å; S130-N134 PolarHBondContact O-N 2.99Å; C131-N134 WeakPolarHBondContact O-CB 3.48Å; C131-N134 PolarHBondContact O-N 3.47Å; N134-W138 VanDerWaalsContact O-CB 3.32Å; N134-W138 WeakPolarHBondContact O-CB 3.36Å; N134-W138 PolarHBondContact O-N 3.49Å |
| 135 | I | 66.1 | Low | 64.9 | Low | 104 Ų | 104 | 59.5 Ų | 59.5 | 53% | 0.533 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -69 | -42 | 178.5 | -65.1 | 162.7 | 0 | 0 | 0 | 111.8 | W80 C131 S132 F133 P139 | W80-I135 HydrophobicContact CZ3-CG2 4.3Å; C131-I135 WeakPolarHBondContact O-CD1 3.44Å; C131-I135 VanDerWaalsContact O-CG1 3.31Å; C131-I135 WeakPolarHBondContact O-CG1 3.41Å; C131-I135 PolarHBondContact O-N 3.42Å; C131-I135 VanDerWaalsContact O-N 3.1Å; S132-I135 PolarHBondContact O-N 2.91Å; F133-I135 VanDerWaalsContact C-N 3.29Å; F133-I135 PolarHBondContact O-N 2.7Å; I135-P139 WeakPolarHBondContact O-CD 3.43Å |
| 136 | A | 62.4 | Low | 65 | Low | 14 Ų | 14 | 60.8 Ų | 60.8 | 12% | 0.116 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -69 | -35 | -178.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | S132 F133 P139 | S132-A136 VanDerWaalsContact O-CB 3.3Å; S132-A136 WeakPolarHBondContact O-CB 3.26Å; S132-A136 PolarHBondContact O-N 3.48Å; F133-A136 PolarHBondContact O-N 3.22Å; A136-P139 WeakPolarHBondContact O-CD 3.29Å; A136-P139 WeakPolarHBondContact O-CG 3.47Å |
| 137 | L | 61.7 | Low | 65.2 | Low | 14 Ų | 14 | 63.2 Ų | 63.2 | 7% | 0.073 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -93.8 | -11.4 | 178.1 | -81.1 | 102.4 | 0 | 0 | 0 | 114.5 | F66 F133 P139 V140 W141 T145 L149 | F66-L137 HydrophobicContact CE1-CD2 4.25Å; F66-L137 HydrophobicContact CE2-CD2 3.92Å; F66-L137 HydrophobicContact CZ-CD1 4.38Å; F66-L137 HydrophobicContact CZ-CD2 3.5Å; F66-L137 VanDerWaalsContact CZ-CD2 3.5Å; F66-L137 HydrophobicContact CZ-CG 4.5Å; F133-L137 HydrophobicContact CD1-CD1 3.44Å; F133-L137 VanDerWaalsContact CD1-CD1 3.44Å; F133-L137 HydrophobicContact CE1-CD1 3.99Å; F133-L137 HydrophobicContact CG-CD1 4.46Å; F133-L137 WeakPolarHBondContact O-CB 3.46Å; F133-L137 VanDerWaalsContact O-CD1 3.29Å; F133-L137 WeakPolarHBondContact O-CD1 3.46Å; F133-L137 PolarHBondContact O-N 3.05Å; L137-P139 VanDerWaalsContact C-CD 3.41Å; L137-P139 VanDerWaalsContact C-N 3.31Å; L137-V140 WeakPolarHBondContact O-CB 3.33Å; L137-V140 PolarHBondContact O-N 2.99Å; L137-W141 PolarHBondContact O-N 3.16Å; L137-T145 HydrophobicContact CB-CG2 3.43Å; L137-T145 VanDerWaalsContact CB-CG2 3.43Å; L137-T145 PolarHBondContact O-OG1 3.29Å; L137-T145 VanDerWaalsContact O-OG1 3.06Å; L137-L149 HydrophobicContact CD1-CD1 4.42Å |
| 138 | W | 60.2 | Low | 65.2 | Low | 137 Ų | 137 | 61.2 Ų | 61.2 | 52% | 0.519 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -48.1 | -44.5 | 172 | -160.9 | -95.3 | 0 | 0 | 0 | 114 | N134 V140 S142 | N134-W138 VanDerWaalsContact O-CB 3.32Å; N134-W138 WeakPolarHBondContact O-CB 3.36Å; N134-W138 PolarHBondContact O-N 3.49Å; W138-V140 PolarHBondContact O-N 3.04Å; W138-S142 WeakPolarHBondContact O-CA 3.32Å; W138-S142 PolarHBondContact O-N 2.91Å |
| 139 | P | 56.3 | Low | 65.4 | Low | 82 Ų | 82 | 59.9 Ų | 59.9 | 53% | 0.532 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -75.6 | 1.5 | 178.1 | 31.6 | -38.4 | 0 | 0 | 0 | 114.7 | K77 I135 A136 L137 | K77-P139 PolarHBondContact NZ-O 3.29Å; I135-P139 WeakPolarHBondContact O-CD 3.43Å; A136-P139 WeakPolarHBondContact O-CD 3.29Å; A136-P139 WeakPolarHBondContact O-CG 3.47Å; L137-P139 VanDerWaalsContact C-CD 3.41Å; L137-P139 VanDerWaalsContact C-N 3.31Å |
| 140 | V | 57.8 | Low | 65.9 | Low | 49 Ų | 49 | 65.1 Ų | 65.1 | 30% | 0.297 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -103.2 | -53.5 | 179.9 | 177.6 | 0 | 0 | 0 | 0 | 110.7 | V69 L137 W138 | V69-V140 HydrophobicContact CG1-CG1 3.67Å; V69-V140 HydrophobicContact CG1-CG2 4.27Å; V69-V140 HydrophobicContact CG2-CG1 4.45Å; L137-V140 WeakPolarHBondContact O-CB 3.33Å; L137-V140 PolarHBondContact O-N 2.99Å; W138-V140 PolarHBondContact O-N 3.04Å |
| 141 | W | 56 | Low | 66.4 | Low | 107 Ų | 107 | 64.1 Ų | 64.1 | 41% | 0.405 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -129 | 2.1 | -167.5 | -111 | 50.1 | 0 | 0 | 0 | 114.1 | L137 F143 F144 T145 I148 | L137-W141 PolarHBondContact O-N 3.16Å; W141-F143 VanDerWaalsContact C-N 3.31Å; W141-F143 PolarHBondContact O-N 2.89Å; W141-F144 HydrophobicContact CD2-CB 3.94Å; W141-F144 HydrophobicContact CE3-CB 2.92Å; W141-F144 HydrophobicContact CE3-CD1 4.17Å; W141-F144 HydrophobicContact CE3-CD2 4.37Å; W141-F144 AromaticContact CE3-CG 3.67Å; W141-F144 HydrophobicContact CE3-CG 3.67Å; W141-F144 HydrophobicContact CH2-CB 4.27Å; W141-F144 HydrophobicContact CH2-CD1 4.17Å; W141-F144 HydrophobicContact CH2-CD2 4.46Å; W141-F144 HydrophobicContact CH2-CG 4.11Å; W141-F144 HydrophobicContact CZ3-CB 3.12Å; W141-F144 AromaticContact CZ3-CD1 3.4Å; W141-F144 HydrophobicContact CZ3-CD1 3.4Å; W141-F144 AromaticContact CZ3-CD2 3.99Å; W141-F144 HydrophobicContact CZ3-CD2 3.99Å; W141-F144 HydrophobicContact CZ3-CE1 4.19Å; W141-F144 AromaticContact CZ3-CG 3.28Å; W141-F144 HydrophobicContact CZ3-CG 3.28Å; W141-F144 PolarHBondContact O-N 3.04Å; W141-T145 WeakPolarHBondContact CB-OG1 3.38Å; W141-I148 HydrophobicContact CD2-CD1 4.03Å; W141-I148 HydrophobicContact CE3-CD1 3.2Å; W141-I148 HydrophobicContact CE3-CG1 4.14Å; W141-I148 HydrophobicContact CZ3-CD1 3.55Å; W141-I148 HydrophobicContact CZ3-CG1 4.22Å |
| 142 | S | 62.9 | Low | 66.5 | Low | 59 Ų | 59 | 63.7 Ų | 63.7 | 41% | 0.413 | 32% | 0.318 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 30.7 | -72.7 | 177.2 | -160.5 | 0 | 0 | 0 | 0 | 116.4 | W138 T145 | W138-S142 WeakPolarHBondContact O-CA 3.32Å; W138-S142 PolarHBondContact O-N 2.91Å; S142-T145 PolarHBondContact N-OG1 3.28Å |
| 143 | F | 64.8 | Low | 66.8 | Low | 180 Ų | 180 | 64.6 Ų | 64.6 | 79% | 0.789 | 32% | 0.319 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.4 | -36.2 | -179.7 | -172.6 | -106.2 | 0 | 0 | 0 | 114.6 | W141 | W141-F143 VanDerWaalsContact C-N 3.31Å; W141-F143 PolarHBondContact O-N 2.89Å |
| 144 | F | 65.3 | Low | 67.3 | Low | 101 Ų | 101 | 66.3 Ų | 66.3 | 44% | 0.443 | 33% | 0.327 | S | S | . | . | S | Bend | trans | -94.7 | -12.3 | -175.3 | -93.1 | -93.8 | 0 | 0 | 0 | 113.6 | W141 L147 I148 | W141-F144 HydrophobicContact CD2-CB 3.94Å; W141-F144 HydrophobicContact CE3-CB 2.92Å; W141-F144 HydrophobicContact CE3-CD1 4.17Å; W141-F144 HydrophobicContact CE3-CD2 4.37Å; W141-F144 AromaticContact CE3-CG 3.67Å; W141-F144 HydrophobicContact CE3-CG 3.67Å; W141-F144 HydrophobicContact CH2-CB 4.27Å; W141-F144 HydrophobicContact CH2-CD1 4.17Å; W141-F144 HydrophobicContact CH2-CD2 4.46Å; W141-F144 HydrophobicContact CH2-CG 4.11Å; W141-F144 HydrophobicContact CZ3-CB 3.12Å; W141-F144 AromaticContact CZ3-CD1 3.4Å; W141-F144 HydrophobicContact CZ3-CD1 3.4Å; W141-F144 AromaticContact CZ3-CD2 3.99Å; W141-F144 HydrophobicContact CZ3-CD2 3.99Å; W141-F144 HydrophobicContact CZ3-CE1 4.19Å; W141-F144 AromaticContact CZ3-CG 3.28Å; W141-F144 HydrophobicContact CZ3-CG 3.28Å; W141-F144 PolarHBondContact O-N 3.04Å; F144-L147 HydrophobicContact CD1-CD2 3.68Å; F144-L147 HydrophobicContact CE1-CD2 3.87Å; F144-L147 WeakPolarHBondContact O-CB 3.3Å; F144-L147 PolarHBondContact O-N 2.84Å; F144-I148 PolarHBondContact O-N 3.22Å |
| 145 | T | 69.2 | Low | 67.5 | Low | 0 Ų | 0 | 64.4 Ų | 64.4 | 0% | 0 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -47.7 | -50.1 | 175.6 | -60.6 | 0 | 0 | 0 | 0 | 113.8 | L137 W141 S142 L147 I148 L149 | L137-T145 HydrophobicContact CB-CG2 3.43Å; L137-T145 VanDerWaalsContact CB-CG2 3.43Å; L137-T145 PolarHBondContact O-OG1 3.29Å; L137-T145 VanDerWaalsContact O-OG1 3.06Å; W141-T145 WeakPolarHBondContact CB-OG1 3.38Å; S142-T145 PolarHBondContact N-OG1 3.28Å; T145-L147 VanDerWaalsContact C-N 3.3Å; T145-L147 PolarHBondContact O-N 3.39Å; T145-I148 PolarHBondContact O-N 2.97Å; T145-L149 HydrophobicContact CG2-CD1 4.19Å; T145-L149 PolarHBondContact O-N 3.43Å |
| 146 | P | 69.9 | Low | 67.7 | Low | 57 Ų | 57 | 61.5 Ų | 61.5 | 37% | 0.37 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -65.6 | -31.3 | 178 | 24.5 | -34.5 | 0 | 0 | 0 | 113.3 | F150 | P146-F150 WeakPolarHBondContact O-CB 2.87Å; P146-F150 PolarHBondContact O-N 2.84Å |
| 147 | L | 72.9 | Confident | 68.1 | Low | 102 Ų | 102 | 62.6 Ų | 62.6 | 53% | 0.534 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -69 | -42.1 | 178.7 | -165.5 | 86 | 0 | 0 | 0 | 111.6 | F144 T145 T151 | F144-L147 HydrophobicContact CD1-CD2 3.68Å; F144-L147 HydrophobicContact CE1-CD2 3.87Å; F144-L147 WeakPolarHBondContact O-CB 3.3Å; F144-L147 PolarHBondContact O-N 2.84Å; T145-L147 VanDerWaalsContact C-N 3.3Å; T145-L147 PolarHBondContact O-N 3.39Å; L147-T151 PolarHBondContact O-N 3.08Å; L147-T151 VanDerWaalsContact O-N 3.1Å; L147-T151 PolarHBondContact O-OG1 3.19Å |
| 148 | I | 72.9 | Confident | 68.7 | Low | 15 Ų | 15 | 64.1 Ų | 64.1 | 8% | 0.077 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -63.9 | -51.4 | 176.1 | -68.6 | 178.9 | 0 | 0 | 0 | 110 | V60 A64 W141 F144 T145 F150 T151 Q152 | V60-I148 HydrophobicContact CG1-CB 4.09Å; V60-I148 HydrophobicContact CG1-CG1 3.96Å; V60-I148 HydrophobicContact CG1-CG2 3.67Å; A64-I148 HydrophobicContact CB-CD1 3.83Å; W141-I148 HydrophobicContact CD2-CD1 4.03Å; W141-I148 HydrophobicContact CE3-CD1 3.2Å; W141-I148 HydrophobicContact CE3-CG1 4.14Å; W141-I148 HydrophobicContact CZ3-CD1 3.55Å; W141-I148 HydrophobicContact CZ3-CG1 4.22Å; F144-I148 PolarHBondContact O-N 3.22Å; T145-I148 PolarHBondContact O-N 2.97Å; I148-F150 VanDerWaalsContact C-N 3.3Å; I148-F150 PolarHBondContact O-N 3.31Å; I148-T151 PolarHBondContact O-N 3.46Å; I148-T151 VanDerWaalsContact O-N 3.16Å; I148-Q152 WeakPolarHBondContact O-CB 3.38Å; I148-Q152 PolarHBondContact O-N 2.95Å |
| 149 | L | 72.1 | Confident | 69.3 | Low | 25 Ų | 25 | 62.5 Ų | 62.5 | 13% | 0.131 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -59.8 | -42 | -179.4 | -110.6 | 91.4 | 0 | 0 | 0 | 112.2 | F133 L137 T145 T151 Q152 F153 | F133-L149 HydrophobicContact CB-CD1 4.16Å; F133-L149 HydrophobicContact CB-CD2 3.51Å; F133-L149 HydrophobicContact CB-CG 4.26Å; L137-L149 HydrophobicContact CD1-CD1 4.42Å; T145-L149 HydrophobicContact CG2-CD1 4.19Å; T145-L149 PolarHBondContact O-N 3.43Å; L149-T151 VanDerWaalsContact C-N 3.33Å; L149-T151 PolarHBondContact O-N 3.08Å; L149-Q152 PolarHBondContact O-N 2.95Å; L149-F153 WeakPolarHBondContact O-CB 3.44Å; L149-F153 PolarHBondContact O-N 3.34Å |
| 150 | F | 75.8 | Confident | 69.8 | Low | 115 Ų | 115 | 61 Ų | 61 | 50% | 0.504 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -60.7 | -44.8 | 176.9 | 179.1 | -102.9 | 0 | 0 | 0 | 111.6 | W53 P146 I148 Q152 M154 | W53-F150 HydrophobicContact CH2-CE1 4Å; P146-F150 WeakPolarHBondContact O-CB 2.87Å; P146-F150 PolarHBondContact O-N 2.84Å; I148-F150 VanDerWaalsContact C-N 3.3Å; I148-F150 PolarHBondContact O-N 3.31Å; F150-Q152 VanDerWaalsContact C-N 3.34Å; F150-M154 HydrophobicContact CE1-CG 4.42Å; F150-M154 HydrophobicContact CE2-CG 4.32Å; F150-M154 HydrophobicContact CZ-CE 4.25Å; F150-M154 HydrophobicContact CZ-CG 4.19Å; F150-M154 WeakPolarHBondContact O-CB 3.25Å; F150-M154 WeakPolarHBondContact O-CG 3.38Å; F150-M154 PolarHBondContact O-N 3.17Å; F150-M154 VanDerWaalsContact O-N 3.08Å |
| 151 | T | 78.6 | Confident | 70.2 | Confident | 21 Ų | 21 | 61.9 Ų | 61.9 | 13% | 0.129 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -67.3 | -37.7 | 178.3 | -51.8 | 0 | 0 | 0 | 0 | 111.9 | W53 A56 V60 L147 I148 L149 G155 | W53-T151 HydrophobicContact CE3-CG2 4.45Å; W53-T151 HydrophobicContact CZ3-CG2 4.25Å; A56-T151 HydrophobicContact CB-CG2 4.16Å; V60-T151 HydrophobicContact CB-CG2 4.49Å; V60-T151 HydrophobicContact CG2-CG2 3.97Å; L147-T151 PolarHBondContact O-N 3.08Å; L147-T151 VanDerWaalsContact O-N 3.1Å; L147-T151 PolarHBondContact O-OG1 3.19Å; I148-T151 PolarHBondContact O-N 3.46Å; I148-T151 VanDerWaalsContact O-N 3.16Å; L149-T151 VanDerWaalsContact C-N 3.33Å; L149-T151 PolarHBondContact O-N 3.08Å; T151-G155 PolarHBondContact O-N 3.17Å |
| 152 | Q | 71.4 | Confident | 70.6 | Confident | 61 Ų | 61 | 61.4 Ų | 61.4 | 29% | 0.285 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -67.9 | -45.6 | 177.7 | -161.3 | 66.7 | 23 | 0 | 0 | 111.7 | S57 T61 I148 L149 F150 G155 V156 | S57-Q152 PolarHBondContact O-OE1 3.08Å; S57-Q152 VanDerWaalsContact OG-CD 3.28Å; S57-Q152 PolarHBondContact OG-NE2 2.85Å; S57-Q152 VanDerWaalsContact OG-NE2 3.14Å; S57-Q152 PolarHBondContact OG-OE1 3.26Å; S57-Q152 VanDerWaalsContact OG-OE1 3.11Å; T61-Q152 PolarHBondContact OG1-OE1 3.3Å; I148-Q152 WeakPolarHBondContact O-CB 3.38Å; I148-Q152 PolarHBondContact O-N 2.95Å; L149-Q152 PolarHBondContact O-N 2.95Å; F150-Q152 VanDerWaalsContact C-N 3.34Å; Q152-G155 PolarHBondContact O-N 2.86Å; Q152-V156 WeakPolarHBondContact O-CG2 3.46Å; Q152-V156 PolarHBondContact O-N 3.33Å |
| 153 | F | 72.4 | Confident | 70.4 | Confident | 50 Ų | 50 | 63 Ų | 63 | 22% | 0.219 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -62.4 | -49.2 | 179.2 | 176.3 | -129.3 | 0 | 0 | 0 | 111.5 | F126 L149 G155 V156 V157 | F126-F153 HydrophobicContact CD1-CD2 4.45Å; F126-F153 HydrophobicContact CD1-CE1 4.25Å; F126-F153 AromaticContact CD1-CE2 3.69Å; F126-F153 HydrophobicContact CD1-CE2 3.69Å; F126-F153 AromaticContact CD1-CZ 3.56Å; F126-F153 HydrophobicContact CD1-CZ 3.56Å; F126-F153 HydrophobicContact CD2-CD2 4.02Å; F126-F153 AromaticContact CD2-CE2 3.51Å; F126-F153 HydrophobicContact CD2-CE2 3.51Å; F126-F153 HydrophobicContact CD2-CZ 4.24Å; F126-F153 AromaticContact CE1-CD1 3.81Å; F126-F153 HydrophobicContact CE1-CD1 3.81Å; F126-F153 AromaticContact CE1-CD2 3.57Å; F126-F153 HydrophobicContact CE1-CD2 3.57Å; F126-F153 AromaticContact CE1-CE1 3.44Å; F126-F153 HydrophobicContact CE1-CE1 3.44Å; F126-F153 VanDerWaalsContact CE1-CE1 3.44Å; F126-F153 AromaticContact CE1-CE2 3.18Å; F126-F153 HydrophobicContact CE1-CE2 3.18Å; F126-F153 AromaticContact CE1-CG 3.85Å; F126-F153 HydrophobicContact CE1-CG 3.85Å; F126-F153 AromaticContact CE1-CZ 3.09Å; F126-F153 HydrophobicContact CE1-CZ 3.09Å; F126-F153 AromaticContact CE2-CD2 3.04Å; F126-F153 HydrophobicContact CE2-CD2 3.04Å; F126-F153 AromaticContact CE2-CE2 3Å; F126-F153 HydrophobicContact CE2-CE2 3Å; F126-F153 AromaticContact CE2-CG 3.94Å; F126-F153 HydrophobicContact CE2-CG 3.94Å; F126-F153 AromaticContact CE2-CZ 3.88Å; F126-F153 HydrophobicContact CE2-CZ 3.88Å; F126-F153 AromaticContact CG-CE2 3.89Å; F126-F153 HydrophobicContact CG-CE2 3.89Å; F126-F153 HydrophobicContact CG-CZ 4.16Å; F126-F153 HydrophobicContact CZ-CB 4.08Å; F126-F153 AromaticContact CZ-CD1 3.72Å; F126-F153 HydrophobicContact CZ-CD1 3.72Å; F126-F153 AromaticContact CZ-CD2 2.81Å; F126-F153 HydrophobicContact CZ-CD2 2.81Å; F126-F153 AromaticContact CZ-CE1 3.77Å; F126-F153 HydrophobicContact CZ-CE1 3.77Å; F126-F153 AromaticContact CZ-CE2 2.87Å; F126-F153 HydrophobicContact CZ-CE2 2.87Å; F126-F153 AromaticContact CZ-CG 3.25Å; F126-F153 HydrophobicContact CZ-CG 3.25Å; F126-F153 AromaticContact CZ-CZ 3.37Å; F126-F153 HydrophobicContact CZ-CZ 3.37Å; L149-F153 WeakPolarHBondContact O-CB 3.44Å; L149-F153 PolarHBondContact O-N 3.34Å; F153-G155 PolarHBondContact O-N 3.41Å; F153-V156 PolarHBondContact O-N 3.49Å; F153-V156 VanDerWaalsContact O-N 3.11Å; F153-V157 HydrophobicContact CD2-CG2 3.79Å; F153-V157 HydrophobicContact CE1-CG2 4.21Å; F153-V157 HydrophobicContact CE2-CG2 3.32Å; F153-V157 HydrophobicContact CG-CG2 4.44Å; F153-V157 HydrophobicContact CZ-CG2 3.59Å; F153-V157 WeakPolarHBondContact O-CG2 3.26Å; F153-V157 PolarHBondContact O-N 2.91Å |
| 154 | M | 74.8 | Confident | 69.7 | Low | 56 Ų | 56 | 58.6 Ų | 58.6 | 28% | 0.276 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -58.6 | -37.3 | 175 | -74.5 | -68.3 | -114 | 0 | 0 | 111.9 | W53 F150 M158 | W53-M154 HydrophobicContact CD2-CB 4.13Å; W53-M154 HydrophobicContact CE3-CB 3.43Å; W53-M154 VanDerWaalsContact CE3-CB 3.43Å; W53-M154 HydrophobicContact CE3-CG 4.36Å; W53-M154 HydrophobicContact CH2-CB 3.95Å; W53-M154 HydrophobicContact CH2-CE 4.32Å; W53-M154 HydrophobicContact CH2-CG 3.98Å; W53-M154 HydrophobicContact CZ2-CE 4.23Å; W53-M154 HydrophobicContact CZ3-CB 3.33Å; W53-M154 HydrophobicContact CZ3-CG 3.84Å; F150-M154 HydrophobicContact CE1-CG 4.42Å; F150-M154 HydrophobicContact CE2-CG 4.32Å; F150-M154 HydrophobicContact CZ-CE 4.25Å; F150-M154 HydrophobicContact CZ-CG 4.19Å; F150-M154 WeakPolarHBondContact O-CB 3.25Å; F150-M154 WeakPolarHBondContact O-CG 3.38Å; F150-M154 PolarHBondContact O-N 3.17Å; F150-M154 VanDerWaalsContact O-N 3.08Å; M154-M158 WeakPolarHBondContact O-CB 3.14Å; M154-M158 WeakPolarHBondContact O-CG 3.29Å; M154-M158 PolarHBondContact O-N 2.9Å; M154-M158 VanDerWaalsContact O-N 3.08Å |
| 155 | G | 73.7 | Confident | 69.9 | Low | 3 Ų | 3 | 56.5 Ų | 56.5 | 3% | 0.031 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -63.9 | -43.6 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | T151 Q152 F153 M158 F159 | T151-G155 PolarHBondContact O-N 3.17Å; Q152-G155 PolarHBondContact O-N 2.86Å; F153-G155 PolarHBondContact O-N 3.41Å; G155-M158 PolarHBondContact O-N 2.97Å; G155-F159 WeakPolarHBondContact O-CB 3.24Å; G155-F159 PolarHBondContact O-N 3.15Å |
| 156 | V | 71.1 | Confident | 70 | Confident | 44 Ų | 44 | 59.5 Ų | 59.5 | 27% | 0.267 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -67.3 | -43.5 | 179.1 | 172.6 | 0 | 0 | 0 | 0 | 111.2 | L92 Q152 F153 M158 F159 I160 | L92-V156 HydrophobicContact CD1-CG1 4.45Å; Q152-V156 WeakPolarHBondContact O-CG2 3.46Å; Q152-V156 PolarHBondContact O-N 3.33Å; F153-V156 PolarHBondContact O-N 3.49Å; F153-V156 VanDerWaalsContact O-N 3.11Å; V156-M158 VanDerWaalsContact C-N 3.35Å; V156-M158 PolarHBondContact O-N 3.34Å; V156-F159 PolarHBondContact O-N 3.32Å; V156-I160 HydrophobicContact CG1-CD1 3.69Å; V156-I160 HydrophobicContact CG1-CG1 4.34Å; V156-I160 VanDerWaalsContact O-CG1 3.27Å; V156-I160 WeakPolarHBondContact O-CG1 3.3Å; V156-I160 PolarHBondContact O-N 2.87Å |
| 157 | V | 69.8 | Low | 70 | Confident | 37 Ų | 37 | 59.6 Ų | 59.6 | 22% | 0.224 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -59.7 | -45.4 | 175.7 | 173.6 | 0 | 0 | 0 | 0 | 111 | F153 F159 I160 S161 | F153-V157 HydrophobicContact CD2-CG2 3.79Å; F153-V157 HydrophobicContact CE1-CG2 4.21Å; F153-V157 HydrophobicContact CE2-CG2 3.32Å; F153-V157 HydrophobicContact CG-CG2 4.44Å; F153-V157 HydrophobicContact CZ-CG2 3.59Å; F153-V157 WeakPolarHBondContact O-CG2 3.26Å; F153-V157 PolarHBondContact O-N 2.91Å; V157-F159 VanDerWaalsContact C-N 3.32Å; V157-F159 PolarHBondContact O-N 3.06Å; V157-I160 PolarHBondContact O-N 3.36Å; V157-S161 WeakPolarHBondContact O-CB 3.28Å; V157-S161 PolarHBondContact O-N 3.16Å |
| 158 | M | 74.8 | Confident | 69.8 | Low | 46 Ų | 46 | 57.1 Ų | 57.1 | 23% | 0.227 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -67.8 | -30.9 | 177.7 | -68.8 | -71.9 | 161.4 | 0 | 0 | 112.8 | W53 M154 G155 V156 L162 | W53-M158 HydrophobicContact CB-CG 4.23Å; M154-M158 WeakPolarHBondContact O-CB 3.14Å; M154-M158 WeakPolarHBondContact O-CG 3.29Å; M154-M158 PolarHBondContact O-N 2.9Å; M154-M158 VanDerWaalsContact O-N 3.08Å; G155-M158 PolarHBondContact O-N 2.97Å; V156-M158 VanDerWaalsContact C-N 3.35Å; V156-M158 PolarHBondContact O-N 3.34Å; M158-L162 PolarHBondContact O-N 2.81Å |
| 159 | F | 73.3 | Confident | 69.6 | Low | 102 Ų | 102 | 59.8 Ų | 59.8 | 45% | 0.447 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -71.8 | -43.1 | 175.1 | -176.6 | -102.5 | 0 | 0 | 0 | 111.9 | I54 G155 V156 V157 L162 L163 | I54-F159 HydrophobicContact CD1-CD2 4.47Å; G155-F159 WeakPolarHBondContact O-CB 3.24Å; G155-F159 PolarHBondContact O-N 3.15Å; V156-F159 PolarHBondContact O-N 3.32Å; V157-F159 VanDerWaalsContact C-N 3.32Å; V157-F159 PolarHBondContact O-N 3.06Å; F159-L162 WeakPolarHBondContact O-CB 3.38Å; F159-L162 PolarHBondContact O-N 3.42Å; F159-L162 VanDerWaalsContact O-N 3.1Å; F159-L163 HydrophobicContact CD1-CD1 3.76Å; F159-L163 HydrophobicContact CE1-CD1 3.24Å; F159-L163 HydrophobicContact CE1-CG 4.23Å; F159-L163 HydrophobicContact CZ-CD1 3.71Å; F159-L163 HydrophobicContact CZ-CG 4.36Å; F159-L163 PolarHBondContact O-N 3.26Å; F159-L163 VanDerWaalsContact O-N 3.15Å |
| 160 | I | 67.4 | Low | 69.5 | Low | 50 Ų | 50 | 62.1 Ų | 62.1 | 26% | 0.256 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -61.5 | -46.3 | 174.4 | -69.1 | 165.4 | 0 | 0 | 0 | 110.3 | A95 I99 V156 V157 L162 L163 G164 | A95-I160 HydrophobicContact CB-CD1 3.97Å; I99-I160 HydrophobicContact CD1-CB 4.24Å; I99-I160 HydrophobicContact CD1-CG1 4.03Å; I99-I160 HydrophobicContact CD1-CG2 3.55Å; I99-I160 HydrophobicContact CG1-CG2 3.99Å; V156-I160 HydrophobicContact CG1-CD1 3.69Å; V156-I160 HydrophobicContact CG1-CG1 4.34Å; V156-I160 VanDerWaalsContact O-CG1 3.27Å; V156-I160 WeakPolarHBondContact O-CG1 3.3Å; V156-I160 PolarHBondContact O-N 2.87Å; V157-I160 PolarHBondContact O-N 3.36Å; I160-L162 PolarHBondContact O-N 3.14Å; I160-L162 VanDerWaalsContact O-N 3.12Å; I160-L163 PolarHBondContact O-N 3.42Å; I160-G164 PolarHBondContact O-N 3.45Å |
| 161 | S | 64.6 | Low | 69 | Low | 69 Ų | 69 | 58.3 Ų | 58.3 | 48% | 0.483 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -63.6 | -13.5 | 175 | -178.9 | 0 | 0 | 0 | 0 | 114.1 | V157 | V157-S161 WeakPolarHBondContact O-CB 3.28Å; V157-S161 PolarHBondContact O-N 3.16Å |
| 162 | L | 64.8 | Low | 68.3 | Low | 96 Ų | 96 | 61.2 Ų | 61.2 | 50% | 0.503 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -92.3 | -25.8 | 173.7 | -166.1 | 147.2 | 0 | 0 | 0 | 111.7 | I54 M158 F159 I160 | I54-L162 HydrophobicContact CD1-CD1 4.12Å; M158-L162 PolarHBondContact O-N 2.81Å; F159-L162 WeakPolarHBondContact O-CB 3.38Å; F159-L162 PolarHBondContact O-N 3.42Å; F159-L162 VanDerWaalsContact O-N 3.1Å; I160-L162 PolarHBondContact O-N 3.14Å; I160-L162 VanDerWaalsContact O-N 3.12Å |
| 163 | L | 58.7 | Low | 68 | Low | 92 Ų | 92 | 61.2 Ų | 61.2 | 48% | 0.482 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -88.6 | -34.7 | -178.6 | -78 | 173.6 | 0 | 0 | 0 | 113.9 | F159 I160 | F159-L163 HydrophobicContact CD1-CD1 3.76Å; F159-L163 HydrophobicContact CE1-CD1 3.24Å; F159-L163 HydrophobicContact CE1-CG 4.23Å; F159-L163 HydrophobicContact CZ-CD1 3.71Å; F159-L163 HydrophobicContact CZ-CG 4.36Å; F159-L163 PolarHBondContact O-N 3.26Å; F159-L163 VanDerWaalsContact O-N 3.15Å; I160-L163 PolarHBondContact O-N 3.42Å |
| 164 | G | 51 | Low | 67.6 | Low | 89 Ų | 89 | 62.2 Ų | 62.2 | 92% | 0.918 | 37% | 0.374 | S | S | * | . | trans | -93.4 | 0 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | I160 | I160-G164 PolarHBondContact O-N 3.45Š|
Retrieved 164 of 164 residues in 67 ms
(Link to these results)