| 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 | 37.9 | Very low | 36.6 | Very low | 229 Ų | 229 | 151.5 Ų | 151.5 | 100% | 1.128 | 78% | 0.779 | S | S | * | * | 0 | 69.3 | 0 | -75.9 | -178.6 | 179.3 | 0 | 0 | 108.5 | |||||
| 2 | D | 33.8 | Very low | 36.7 | Very low | 151 Ų | 151 | 150.4 Ų | 150.4 | 81% | 0.807 | 77% | 0.773 | S | S | * | * | trans | 39.7 | 94.9 | 131.2 | -47.9 | -19.5 | 0 | 0 | 0 | 118.3 | Q4 | D2-Q4 PolarHBondContact O-N 3.13Š| ||
| 3 | Y | 37.7 | Very low | 36.6 | Very low | 231 Ų | 231 | 149.3 Ų | 149.3 | 91% | 0.906 | 77% | 0.77 | S | S | * | * | trans | -67.5 | 109.2 | 154.3 | -75.6 | -92 | 0 | 0 | 0 | 109.1 | V5 | Y3-V5 PolarHBondContact O-N 3.31Š| ||
| 4 | Q | 34.3 | Very low | 36.6 | Very low | 180 Ų | 180 | 151.6 Ų | 151.6 | 84% | 0.841 | 77% | 0.766 | S | S | * | * | trans | -84.1 | 92.2 | 166.7 | -84.5 | 175.6 | -46.9 | 0 | 0 | 109.7 | D2 | D2-Q4 PolarHBondContact O-N 3.13Š| ||
| 5 | V | 43.3 | Very low | 36.9 | Very low | 140 Ų | 140 | 157.3 Ų | 157.3 | 85% | 0.848 | 78% | 0.777 | S | S | * | * | trans | -86.1 | 101.9 | 151.6 | 177.5 | 0 | 0 | 0 | 0 | 106.1 | Y3 | Y3-V5 PolarHBondContact O-N 3.31Š| ||
| 6 | S | 36.8 | Very low | 37.2 | Very low | 103 Ų | 103 | 153.1 Ų | 153.1 | 72% | 0.72 | 76% | 0.763 | S | S | * | * | trans | -119.3 | 93.6 | 174.2 | 64.3 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 7 | S | 37.6 | Very low | 37.7 | Very low | 81 Ų | 81 | 150.8 Ų | 150.8 | 57% | 0.566 | 77% | 0.765 | S | S | * | * | trans | -160 | 120.6 | 147.9 | -174.2 | 0 | 0 | 0 | 0 | 108.6 | I9 | S7-I9 PolarHBondContact OG-N 3.45Å; S7-I9 VanDerWaalsContact OG-N 3.17Å | ||
| 8 | P | 38.5 | Very low | 38.2 | Very low | 99 Ų | 99 | 152.7 Ų | 152.7 | 64% | 0.643 | 77% | 0.77 | S | S | * | * | trans | -112.4 | 70.8 | 148.3 | 35.5 | -22.3 | 0 | 0 | 0 | 106.9 | Y10 | P8-Y10 HydrophobicContact CB-CD2 4.38Å; P8-Y10 HydrophobicContact CB-CE2 4.05Å; P8-Y10 PolarHBondContact O-N 3.39Å; P8-Y10 VanDerWaalsContact O-N 3.15Å | ||
| 9 | I | 35.1 | Very low | 39.4 | Very low | 133 Ų | 133 | 150.7 Ų | 150.7 | 68% | 0.682 | 77% | 0.769 | S | S | * | * | trans | -66.7 | 103.8 | 143.9 | -65.1 | 173.7 | 0 | 0 | 0 | 103.4 | S7 D11 | S7-I9 PolarHBondContact OG-N 3.45Å; S7-I9 VanDerWaalsContact OG-N 3.17Å; I9-D11 PolarHBondContact O-N 3.05Å | ||
| 10 | Y | 35.4 | Very low | 40.7 | Very low | 196 Ų | 196 | 145.3 Ų | 145.3 | 77% | 0.769 | 75% | 0.745 | S | S | * | * | trans | -63.8 | 89.6 | 170.2 | -72.2 | -88.8 | 0 | 0 | 0 | 107.1 | P8 I12 | P8-Y10 HydrophobicContact CB-CD2 4.38Å; P8-Y10 HydrophobicContact CB-CE2 4.05Å; P8-Y10 PolarHBondContact O-N 3.39Å; P8-Y10 VanDerWaalsContact O-N 3.15Å; Y10-I12 VanDerWaalsContact C-N 3.26Å; Y10-I12 PolarHBondContact O-N 3.26Å | ||
| 11 | D | 31.8 | Very low | 41.6 | Very low | 123 Ų | 123 | 145.9 Ų | 145.9 | 66% | 0.658 | 74% | 0.744 | S | S | * | * | trans | -61.6 | 99.2 | 159.1 | -86.2 | -28.5 | 0 | 0 | 0 | 106 | I9 N13 | I9-D11 PolarHBondContact O-N 3.05Å; D11-N13 PolarHBondContact O-N 3.45Å | ||
| 12 | I | 38.2 | Very low | 42.9 | Very low | 139 Ų | 139 | 138.8 Ų | 138.8 | 71% | 0.713 | 71% | 0.707 | S | S | * | * | trans | -67.2 | 82.9 | 162.6 | -56.6 | 178.3 | 0 | 0 | 0 | 105.3 | Y10 Y14 | Y10-I12 VanDerWaalsContact C-N 3.26Å; Y10-I12 PolarHBondContact O-N 3.26Å; I12-Y14 HydrophobicContact CG2-CD2 3.61Å; I12-Y14 HydrophobicContact CG2-CE2 3.92Å; I12-Y14 PolarHBondContact O-N 3.31Å | ||
| 13 | N | 35.8 | Very low | 44.2 | Very low | 136 Ų | 136 | 136 Ų | 136 | 73% | 0.727 | 69% | 0.691 | S | S | * | * | trans | -67.2 | 81.2 | 169.6 | -86.1 | -47.5 | 0 | 0 | 0 | 108.6 | D11 | D11-N13 PolarHBondContact O-N 3.45Š| ||
| 14 | Y | 35.7 | Very low | 45.2 | Very low | 182 Ų | 182 | 130.7 Ų | 130.7 | 71% | 0.714 | 68% | 0.679 | S | S | * | * | trans | -78.6 | 113.9 | 149.3 | -90.2 | -87.1 | 0 | 0 | 0 | 107.1 | I12 T16 | I12-Y14 HydrophobicContact CG2-CD2 3.61Å; I12-Y14 HydrophobicContact CG2-CE2 3.92Å; I12-Y14 PolarHBondContact O-N 3.31Å; Y14-T16 WeakPolarHBondContact CB-OG1 3.41Å; Y14-T16 HydrophobicContact CD1-CG2 4.46Å; Y14-T16 PolarHBondContact O-N 3.08Å | ||
| 15 | Y | 41.1 | Very low | 46.7 | Very low | 237 Ų | 237 | 123 Ų | 123 | 93% | 0.929 | 64% | 0.644 | S | S | * | * | trans | -58.1 | 77.7 | 157.3 | -107.3 | -95.9 | 0 | 0 | 0 | 108.7 | ||||
| 16 | T | 41.9 | Very low | 47.7 | Very low | 90 Ų | 90 | 123.7 Ų | 123.7 | 55% | 0.552 | 64% | 0.636 | S | S | * | * | S | Bend | trans | -150.8 | 118.1 | 176.3 | 47.6 | 0 | 0 | 0 | 0 | 108.1 | Y14 E18 | Y14-T16 WeakPolarHBondContact CB-OG1 3.41Å; Y14-T16 HydrophobicContact CD1-CG2 4.46Å; Y14-T16 PolarHBondContact O-N 3.08Å; T16-E18 PolarHBondContact O-N 3.4Å |
| 17 | S | 45.5 | Very low | 49.1 | Very low | 114 Ų | 114 | 125.3 Ų | 125.3 | 80% | 0.797 | 63% | 0.632 | S | S | * | * | trans | -9.2 | 109.4 | 158.4 | 38.6 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 18 | E | 47.8 | Very low | 50.5 | Low | 184 Ų | 184 | 127.3 Ų | 127.3 | 86% | 0.86 | 64% | 0.635 | S | S | * | * | trans | -48.9 | 131.8 | 173.4 | -70.3 | -177.2 | 163.2 | 0 | 0 | 109.8 | T16 C20 | T16-E18 PolarHBondContact O-N 3.4Å; E18-C20 PolarHBondContact O-N 3.01Å; E18-C20 VanDerWaalsContact O-N 3.09Å | ||
| 19 | P | 60.1 | Low | 51.9 | Low | 115 Ų | 115 | 123.1 Ų | 123.1 | 75% | 0.747 | 61% | 0.608 | S | S | * | * | trans | -59.8 | 119.4 | 175.5 | 21.7 | -29.7 | 0 | 0 | 0 | 109.3 | Q21 | P19-Q21 PolarHBondContact O-N 3.11Š| ||
| 20 | C | 65.1 | Low | 53.5 | Low | 43 Ų | 43 | 118.3 Ų | 118.3 | 29% | 0.291 | 59% | 0.589 | S | S | . | * | trans | -51.4 | 108.2 | -177.9 | -172.2 | 0 | 0 | 0 | 0 | 110.5 | E18 K22 C269 | E18-C20 PolarHBondContact O-N 3.01Å; E18-C20 VanDerWaalsContact O-N 3.09Å; C20-K22 PolarHBondContact O-N 3.33Å; C20-C269 HydrophobicContact CB-CB 4.05Å; C20-C269 WeakPolarHBondContact CB-SG 3.43Å; C20-C269 WeakPolarHBondContact SG-CB 3.25Å; C20-C269 PolarHBondContact SG-O 2.9Å; C20-C269 CovalentContact SG-SG 2.06Å; C20-C269 PolarHBondContact SG-SG 2.78Å | ||
| 21 | Q | 60.6 | Low | 55.3 | Low | 157 Ų | 157 | 111.6 Ų | 111.6 | 73% | 0.734 | 58% | 0.579 | S | S | * | * | trans | -75.1 | 119.4 | -173.8 | -71 | -163.6 | -16 | 0 | 0 | 111.8 | P19 I23 | P19-Q21 PolarHBondContact O-N 3.11Å; Q21-I23 HydrophobicContact CB-CD1 4.36Å; Q21-I23 HydrophobicContact CB-CG1 4.41Å | ||
| 22 | K | 65.3 | Low | 57.5 | Low | 80 Ų | 80 | 111.3 Ų | 111.3 | 35% | 0.348 | 58% | 0.577 | S | S | . | * | trans | -105.4 | 34 | -175.4 | -56.6 | -178.8 | -169.1 | 176.5 | 0 | 114 | C20 N24 V25 D276 | C20-K22 PolarHBondContact O-N 3.33Å; K22-N24 PolarHBondContact O-N 2.92Å; K22-V25 PolarHBondContact O-N 3.39Å; K22-D276 WeakPolarHBondContact CE-OD2 3.23Å; K22-D276 VanDerWaalsContact NZ-CG 3.29Å; K22-D276 IonicContact NZ-OD1 3.27Å; K22-D276 IonicContact NZ-OD2 3.9Å; K22-D276 PolarHBondContact NZ-OD2 2.83Å | ||
| 23 | I | 60.2 | Low | 59.4 | Low | 92 Ų | 92 | 105.2 Ų | 105.2 | 47% | 0.472 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -63.4 | -44 | -165.6 | -60.3 | 170.6 | 0 | 0 | 0 | 112.8 | Q21 V25 | Q21-I23 HydrophobicContact CB-CD1 4.36Å; Q21-I23 HydrophobicContact CB-CG1 4.41Å; I23-V25 VanDerWaalsContact C-N 3.31Å; I23-V25 PolarHBondContact O-N 2.83Å |
| 24 | N | 60.3 | Low | 61.6 | Low | 120 Ų | 120 | 99.9 Ų | 99.9 | 64% | 0.642 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -68 | -26.3 | -174.9 | -68 | -10.7 | 0 | 0 | 0 | 114.1 | K22 | K22-N24 PolarHBondContact O-N 2.92Å |
| 25 | V | 64.3 | Low | 64 | Low | 19 Ų | 19 | 95 Ų | 95 | 12% | 0.115 | 51% | 0.509 | C | S | . | . | H | α-helix | trans | -75.9 | -42.7 | -176.3 | -176.1 | 0 | 0 | 0 | 0 | 111 | K22 I23 Q27 I28 A29 Q277 | K22-V25 PolarHBondContact O-N 3.39Å; I23-V25 VanDerWaalsContact C-N 3.31Å; I23-V25 PolarHBondContact O-N 2.83Å; V25-Q27 VanDerWaalsContact C-N 3.31Å; V25-Q27 PolarHBondContact O-N 3.16Å; V25-I28 PolarHBondContact O-N 3.46Å; V25-A29 WeakPolarHBondContact O-CB 3.34Å; V25-A29 PolarHBondContact O-N 3.01Å; V25-Q277 HydrophobicContact CB-CG 4.25Å; V25-Q277 HydrophobicContact CG1-CG 3.77Å; V25-Q277 HydrophobicContact CG2-CG 3.4Å |
| 26 | K | 64.7 | Low | 66.1 | Low | 155 Ų | 155 | 86.3 Ų | 86.3 | 67% | 0.674 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -62.1 | -38.3 | -179 | -70.1 | -171.9 | 175.6 | -173.5 | 0 | 112.1 | A30 | K26-A30 VanDerWaalsContact O-CB 3.25Å; K26-A30 WeakPolarHBondContact O-CB 3.5Å; K26-A30 PolarHBondContact O-N 3.46Å |
| 27 | Q | 67.1 | Low | 68.3 | Low | 136 Ų | 136 | 82.6 Ų | 82.6 | 64% | 0.636 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -70.1 | -44.3 | -178.8 | -71.6 | 178.6 | -19.4 | 0 | 0 | 113 | V25 A30 G31 | V25-Q27 VanDerWaalsContact C-N 3.31Å; V25-Q27 PolarHBondContact O-N 3.16Å; Q27-A30 PolarHBondContact O-N 3.23Å; Q27-G31 PolarHBondContact O-N 3.09Å |
| 28 | I | 66.4 | Low | 70.3 | Confident | 124 Ų | 124 | 79.8 Ų | 79.8 | 64% | 0.636 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -65.6 | -43.2 | 177 | -63.9 | 172.4 | 0 | 0 | 0 | 110.3 | V25 A30 G31 L32 | V25-I28 PolarHBondContact O-N 3.46Å; I28-A30 VanDerWaalsContact C-N 3.35Å; I28-A30 PolarHBondContact O-N 3.34Å; I28-G31 PolarHBondContact O-N 2.84Å; I28-L32 PolarHBondContact O-N 3.45Å; I28-L32 VanDerWaalsContact O-N 3.15Å |
| 29 | A | 68.6 | Low | 72.3 | Confident | 10 Ų | 10 | 75.5 Ų | 75.5 | 8% | 0.083 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -59.2 | -43.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | V25 G31 L32 L33 Q280 | V25-A29 WeakPolarHBondContact O-CB 3.34Å; V25-A29 PolarHBondContact O-N 3.01Å; A29-G31 VanDerWaalsContact C-N 3.29Å; A29-G31 PolarHBondContact O-N 2.84Å; A29-L32 PolarHBondContact O-N 3.09Å; A29-L33 HydrophobicContact CB-CD1 3.63Å; A29-L33 HydrophobicContact CB-CG 4.46Å; A29-L33 WeakPolarHBondContact O-CB 3.47Å; A29-L33 WeakPolarHBondContact O-CD1 3.44Å; A29-L33 WeakPolarHBondContact O-CG 3.28Å; A29-L33 PolarHBondContact O-N 2.83Å; A29-Q280 VanDerWaalsContact CB-NE2 3.33Å |
| 30 | A | 68.3 | Low | 73.8 | Confident | 33 Ų | 33 | 70.3 Ų | 70.3 | 27% | 0.273 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -64.9 | -28.1 | 179 | 0 | 0 | 0 | 0 | 0 | 113.6 | K26 Q27 I28 P34 | K26-A30 VanDerWaalsContact O-CB 3.25Å; K26-A30 WeakPolarHBondContact O-CB 3.5Å; K26-A30 PolarHBondContact O-N 3.46Å; Q27-A30 PolarHBondContact O-N 3.23Å; I28-A30 VanDerWaalsContact C-N 3.35Å; I28-A30 PolarHBondContact O-N 3.34Å; A30-P34 WeakPolarHBondContact O-CD 3.47Å; A30-P34 VanDerWaalsContact O-CG 3.26Å; A30-P34 WeakPolarHBondContact O-CG 3.48Å |
| 31 | G | 72.4 | Confident | 75.1 | Confident | 55 Ų | 55 | 71.2 Ų | 71.2 | 57% | 0.567 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -80 | -39.7 | 175.2 | 0 | 0 | 0 | 0 | 0 | 114 | Q27 I28 A29 P35 | Q27-G31 PolarHBondContact O-N 3.09Å; I28-G31 PolarHBondContact O-N 2.84Å; A29-G31 VanDerWaalsContact C-N 3.29Å; A29-G31 PolarHBondContact O-N 2.84Å; G31-P35 WeakPolarHBondContact O-CD 3.15Å |
| 32 | L | 77.9 | Confident | 76.6 | Confident | 116 Ų | 116 | 68.6 Ų | 68.6 | 61% | 0.607 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -92.6 | -36.1 | -171.4 | -175.6 | 64.7 | 0 | 0 | 0 | 114.1 | I28 A29 P35 L36 | I28-L32 PolarHBondContact O-N 3.45Å; I28-L32 VanDerWaalsContact O-N 3.15Å; A29-L32 PolarHBondContact O-N 3.09Å; L32-P35 WeakPolarHBondContact O-CD 3.43Å; L32-P35 WeakPolarHBondContact O-CG 3.34Å; L32-L36 WeakPolarHBondContact O-CB 3.32Å; L32-L36 PolarHBondContact O-N 3.17Å |
| 33 | L | 78.6 | Confident | 77.8 | Confident | 11 Ų | 11 | 70.8 Ų | 70.8 | 6% | 0.058 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -66.9 | -45 | -174.2 | -67.8 | 164.1 | 0 | 0 | 0 | 113.1 | A29 L36 Y37 P90 Q280 T284 | A29-L33 HydrophobicContact CB-CD1 3.63Å; A29-L33 HydrophobicContact CB-CG 4.46Å; A29-L33 WeakPolarHBondContact O-CB 3.47Å; A29-L33 WeakPolarHBondContact O-CD1 3.44Å; A29-L33 WeakPolarHBondContact O-CG 3.28Å; A29-L33 PolarHBondContact O-N 2.83Å; L33-L36 PolarHBondContact O-N 3.3Å; L33-Y37 HydrophobicContact CB-CE2 4.49Å; L33-Y37 HydrophobicContact CD2-CE1 4.07Å; L33-Y37 HydrophobicContact CD2-CE2 4.21Å; L33-Y37 WeakPolarHBondContact O-CB 3.42Å; L33-Y37 PolarHBondContact O-N 3.12Å; L33-P90 HydrophobicContact CD1-CG 4.19Å; L33-Q280 HydrophobicContact CD1-CG 4.48Å; L33-T284 HydrophobicContact CD2-CG2 3.68Å; L33-T284 WeakPolarHBondContact CD2-OG1 3.36Å |
| 34 | P | 82.3 | Confident | 79.4 | Confident | 25 Ų | 25 | 66.4 Ų | 66.4 | 16% | 0.162 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -57.4 | -51.2 | -178.2 | -27.3 | 37.7 | 0 | 0 | 0 | 115.5 | A30 L36 S38 V87 | A30-P34 WeakPolarHBondContact O-CD 3.47Å; A30-P34 VanDerWaalsContact O-CG 3.26Å; A30-P34 WeakPolarHBondContact O-CG 3.48Å; P34-L36 VanDerWaalsContact C-N 3.34Å; P34-L36 PolarHBondContact O-N 2.86Å; P34-S38 WeakPolarHBondContact O-CB 3.27Å; P34-S38 PolarHBondContact O-N 3.1Å; P34-S38 PolarHBondContact O-OG 2.87Å; P34-V87 HydrophobicContact CB-CG1 3.61Å; P34-V87 HydrophobicContact CG-CG1 4.2Å |
| 35 | P | 85.2 | Confident | 81.1 | Confident | 78 Ų | 78 | 64.5 Ų | 64.5 | 51% | 0.506 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -66.2 | -37.9 | 178.8 | 25.8 | -33.9 | 0 | 0 | 0 | 111.8 | G31 L32 S38 L39 | G31-P35 WeakPolarHBondContact O-CD 3.15Å; L32-P35 WeakPolarHBondContact O-CD 3.43Å; L32-P35 WeakPolarHBondContact O-CG 3.34Å; P35-S38 PolarHBondContact O-N 3.26Å; P35-L39 WeakPolarHBondContact O-CB 3.34Å; P35-L39 PolarHBondContact O-N 2.91Å |
| 36 | L | 86.3 | Confident | 82.4 | Confident | 55 Ų | 55 | 67.3 Ų | 67.3 | 29% | 0.288 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -64.3 | -50.2 | 179.6 | 178.9 | 62.8 | 0 | 0 | 0 | 111.9 | L32 L33 P34 S38 L39 V40 T284 | L32-L36 WeakPolarHBondContact O-CB 3.32Å; L32-L36 PolarHBondContact O-N 3.17Å; L33-L36 PolarHBondContact O-N 3.3Å; P34-L36 VanDerWaalsContact C-N 3.34Å; P34-L36 PolarHBondContact O-N 2.86Å; L36-S38 VanDerWaalsContact C-N 3.32Å; L36-S38 PolarHBondContact O-N 3.38Å; L36-L39 VanDerWaalsContact O-CB 3.32Å; L36-L39 WeakPolarHBondContact O-CB 3.22Å; L36-L39 PolarHBondContact O-N 3.4Å; L36-V40 WeakPolarHBondContact O-CG2 3.35Å; L36-V40 PolarHBondContact O-N 3.3Å; L36-T284 HydrophobicContact CD2-CG2 3.48Å; L36-T284 VanDerWaalsContact CD2-CG2 3.48Å |
| 37 | Y | 86.7 | Confident | 83.8 | Confident | 13 Ų | 13 | 60.5 Ų | 60.5 | 5% | 0.051 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -66.9 | -33 | 178.6 | -77.4 | -0.5 | 0 | 0 | 0 | 112.6 | L33 L39 V40 F41 V83 V87 T284 M287 | L33-Y37 HydrophobicContact CB-CE2 4.49Å; L33-Y37 HydrophobicContact CD2-CE1 4.07Å; L33-Y37 HydrophobicContact CD2-CE2 4.21Å; L33-Y37 WeakPolarHBondContact O-CB 3.42Å; L33-Y37 PolarHBondContact O-N 3.12Å; Y37-L39 VanDerWaalsContact C-N 3.33Å; Y37-V40 PolarHBondContact O-N 3.08Å; Y37-F41 WeakPolarHBondContact O-CB 3.21Å; Y37-F41 PolarHBondContact O-N 3.32Å; Y37-V83 HydrophobicContact CD2-CG1 4.42Å; Y37-V83 HydrophobicContact CG-CG1 4Å; Y37-V83 WeakPolarHBondContact O-CG1 3.18Å; Y37-V87 HydrophobicContact CD2-CG2 3.73Å; Y37-V87 HydrophobicContact CG-CG2 3.96Å; Y37-T284 HydrophobicContact CE1-CG2 3.73Å; Y37-T284 PolarHBondContact OH-OG1 3.09Å; Y37-M287 HydrophobicContact CE1-CB 4.25Å; Y37-M287 HydrophobicContact CE1-SD 3.84Å; Y37-M287 HydrophobicContact CE2-SD 3.89Å; Y37-M287 PolarHBondContact OH-SD 3.38Å |
| 38 | S | 87.8 | Confident | 85.1 | Confident | 54 Ų | 54 | 54 Ų | 54 | 38% | 0.378 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -61.4 | -43.7 | 171.1 | -60.1 | 0 | 0 | 0 | 0 | 111.2 | P34 P35 L36 F41 I42 | P34-S38 WeakPolarHBondContact O-CB 3.27Å; P34-S38 PolarHBondContact O-N 3.1Å; P34-S38 PolarHBondContact O-OG 2.87Å; P35-S38 PolarHBondContact O-N 3.26Å; L36-S38 VanDerWaalsContact C-N 3.32Å; L36-S38 PolarHBondContact O-N 3.38Å; S38-F41 PolarHBondContact O-N 3.14Å; S38-I42 VanDerWaalsContact O-CG1 3.3Å; S38-I42 WeakPolarHBondContact O-CG1 3.37Å; S38-I42 PolarHBondContact O-N 3.46Å |
| 39 | L | 90.1 | Very high | 86.4 | Confident | 95 Ų | 95 | 51.2 Ų | 51.2 | 50% | 0.497 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -63 | -45.6 | 175.5 | -163.9 | 99.8 | 0 | 0 | 0 | 111.8 | P35 L36 Y37 F41 I42 F43 | P35-L39 WeakPolarHBondContact O-CB 3.34Å; P35-L39 PolarHBondContact O-N 2.91Å; L36-L39 VanDerWaalsContact O-CB 3.32Å; L36-L39 WeakPolarHBondContact O-CB 3.22Å; L36-L39 PolarHBondContact O-N 3.4Å; Y37-L39 VanDerWaalsContact C-N 3.33Å; L39-F41 VanDerWaalsContact C-N 3.33Å; L39-F41 PolarHBondContact O-N 2.7Å; L39-I42 PolarHBondContact O-N 2.86Å; L39-F43 HydrophobicContact CD1-CD2 4.27Å; L39-F43 HydrophobicContact CD1-CE2 3.64Å; L39-F43 HydrophobicContact CD2-CD2 3.97Å; L39-F43 HydrophobicContact CD2-CE2 3.85Å; L39-F43 HydrophobicContact CG-CD2 3.62Å; L39-F43 HydrophobicContact CG-CE2 3.48Å; L39-F43 VanDerWaalsContact CG-CE2 3.48Å; L39-F43 WeakPolarHBondContact O-CD2 3.43Å; L39-F43 PolarHBondContact O-N 3.43Å |
| 40 | V | 91.5 | Very high | 87.5 | Confident | 5 Ų | 5 | 52 Ų | 52 | 3% | 0.03 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -60 | -44 | 176 | 171.1 | 0 | 0 | 0 | 0 | 110.7 | L36 Y37 G44 L80 T288 | L36-V40 WeakPolarHBondContact O-CG2 3.35Å; L36-V40 PolarHBondContact O-N 3.3Å; Y37-V40 PolarHBondContact O-N 3.08Å; V40-G44 VanDerWaalsContact O-CA 3.28Å; V40-G44 WeakPolarHBondContact O-CA 3.49Å; V40-G44 PolarHBondContact O-N 3.49Å; V40-L80 HydrophobicContact CG1-CD2 4.32Å; V40-T288 HydrophobicContact CG2-CG2 3.68Å |
| 41 | F | 91.8 | Very high | 88.6 | Confident | 63 Ų | 63 | 50.6 Ų | 50.6 | 28% | 0.276 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -61.5 | -50 | 177.9 | -179.6 | -102.3 | 0 | 0 | 0 | 111.6 | Y37 S38 L39 F45 L80 V83 P84 | Y37-F41 WeakPolarHBondContact O-CB 3.21Å; Y37-F41 PolarHBondContact O-N 3.32Å; S38-F41 PolarHBondContact O-N 3.14Å; L39-F41 VanDerWaalsContact C-N 3.33Å; L39-F41 PolarHBondContact O-N 2.7Å; F41-F45 HydrophobicContact CZ-CD2 4.48Å; F41-F45 WeakPolarHBondContact O-CB 3.33Å; F41-F45 PolarHBondContact O-N 3.17Å; F41-L80 WeakPolarHBondContact CD2-O 3.41Å; F41-V83 HydrophobicContact CB-CG1 4.34Å; F41-P84 HydrophobicContact CD1-CG 4.42Å; F41-P84 HydrophobicContact CD2-CG 3.56Å; F41-P84 HydrophobicContact CE1-CG 4.48Å; F41-P84 HydrophobicContact CE2-CG 3.62Å; F41-P84 HydrophobicContact CG-CG 3.98Å; F41-P84 HydrophobicContact CZ-CG 4.09Å |
| 42 | I | 92.3 | Very high | 89.5 | Confident | 102 Ų | 102 | 50.8 Ų | 50.8 | 52% | 0.523 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -62.2 | -54.4 | -178.5 | -67 | 165.7 | 0 | 0 | 0 | 111 | S38 L39 V46 | S38-I42 VanDerWaalsContact O-CG1 3.3Å; S38-I42 WeakPolarHBondContact O-CG1 3.37Å; S38-I42 PolarHBondContact O-N 3.46Å; L39-I42 PolarHBondContact O-N 2.86Å; I42-V46 WeakPolarHBondContact O-CB 3.31Å; I42-V46 VanDerWaalsContact O-CG2 3.3Å; I42-V46 WeakPolarHBondContact O-CG2 3.31Å; I42-V46 PolarHBondContact O-N 2.96Å; I42-V46 VanDerWaalsContact O-N 3.1Å |
| 43 | F | 92.2 | Very high | 90.1 | Very high | 126 Ų | 126 | 48.6 Ų | 48.6 | 55% | 0.553 | 26% | 0.256 | S | S | * | . | H | α-helix | trans | -68.8 | -39.2 | -178 | -72.3 | -53.2 | 0 | 0 | 0 | 112.4 | L39 G47 C291 | L39-F43 HydrophobicContact CD1-CD2 4.27Å; L39-F43 HydrophobicContact CD1-CE2 3.64Å; L39-F43 HydrophobicContact CD2-CD2 3.97Å; L39-F43 HydrophobicContact CD2-CE2 3.85Å; L39-F43 HydrophobicContact CG-CD2 3.62Å; L39-F43 HydrophobicContact CG-CE2 3.48Å; L39-F43 VanDerWaalsContact CG-CE2 3.48Å; L39-F43 WeakPolarHBondContact O-CD2 3.43Å; L39-F43 PolarHBondContact O-N 3.43Å; F43-G47 WeakPolarHBondContact O-CA 3.16Å; F43-G47 PolarHBondContact O-N 3.07Å; F43-C291 HydrophobicContact CB-CB 4.49Å |
| 44 | G | 93.6 | Very high | 90.5 | Very high | 0 Ų | 0 | 48.9 Ų | 48.9 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -63.6 | -47.9 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | V40 N48 L80 | V40-G44 VanDerWaalsContact O-CA 3.28Å; V40-G44 WeakPolarHBondContact O-CA 3.49Å; V40-G44 PolarHBondContact O-N 3.49Å; G44-N48 VanDerWaalsContact O-CB 3.26Å; G44-N48 WeakPolarHBondContact O-CB 3.35Å; G44-N48 PolarHBondContact O-N 2.89Å; G44-N48 PolarHBondContact O-ND2 3.38Å; G44-L80 WeakPolarHBondContact O-CD1 3.31Å |
| 45 | F | 94.3 | Very high | 90.7 | Very high | 79 Ų | 79 | 47.9 Ų | 47.9 | 35% | 0.346 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -65.2 | -51.5 | -178.4 | -172.6 | -91.8 | 0 | 0 | 0 | 111.2 | F41 G47 M49 L77 | F41-F45 HydrophobicContact CZ-CD2 4.48Å; F41-F45 WeakPolarHBondContact O-CB 3.33Å; F41-F45 PolarHBondContact O-N 3.17Å; F45-G47 PolarHBondContact O-N 2.77Å; F45-M49 HydrophobicContact CD1-CG 4.24Å; F45-M49 HydrophobicContact CE1-CE 4.33Å; F45-M49 HydrophobicContact CE1-CG 4.01Å; F45-M49 HydrophobicContact CE2-CE 3.7Å; F45-M49 HydrophobicContact CZ-CE 3.6Å; F45-M49 HydrophobicContact CZ-CG 4.2Å; F45-M49 VanDerWaalsContact O-CB 3.27Å; F45-M49 WeakPolarHBondContact O-CB 3.48Å; F45-M49 WeakPolarHBondContact O-CG 3.23Å; F45-M49 PolarHBondContact O-N 3.32Å; F45-L77 HydrophobicContact CD2-CD2 3.76Å; F45-L77 HydrophobicContact CE2-CD2 4.1Å; F45-L77 HydrophobicContact CG-CD2 4.47Å |
| 46 | V | 93.3 | Very high | 90.8 | Very high | 79 Ų | 79 | 47.3 Ų | 47.3 | 48% | 0.479 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -62.3 | -46.3 | 179.3 | 175.8 | 0 | 0 | 0 | 0 | 110.8 | I42 L50 | I42-V46 WeakPolarHBondContact O-CB 3.31Å; I42-V46 VanDerWaalsContact O-CG2 3.3Å; I42-V46 WeakPolarHBondContact O-CG2 3.31Å; I42-V46 PolarHBondContact O-N 2.96Å; I42-V46 VanDerWaalsContact O-N 3.1Å; V46-L50 HydrophobicContact CG1-CD1 4Å; V46-L50 HydrophobicContact CG1-CG 4.48Å; V46-L50 WeakPolarHBondContact O-CB 3.4Å; V46-L50 VanDerWaalsContact O-CG 3.27Å; V46-L50 WeakPolarHBondContact O-CG 3.4Å; V46-L50 PolarHBondContact O-N 3.38Å |
| 47 | G | 92.8 | Very high | 90.6 | Very high | 12 Ų | 12 | 49.2 Ų | 49.2 | 12% | 0.124 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -61.8 | -50.5 | -179.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | F43 F45 L50 V51 | F43-G47 WeakPolarHBondContact O-CA 3.16Å; F43-G47 PolarHBondContact O-N 3.07Å; F45-G47 PolarHBondContact O-N 2.77Å; G47-L50 PolarHBondContact O-N 2.89Å; G47-V51 WeakPolarHBondContact O-CG2 3.45Å; G47-V51 PolarHBondContact O-N 3.03Å |
| 48 | N | 94.9 | Very high | 90.3 | Very high | 0 Ų | 0 | 51.7 Ų | 51.7 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -68 | -36.3 | -179 | -75 | -62 | 0 | 0 | 0 | 112.1 | G44 V51 F52 P73 D76 L77 C290 | G44-N48 VanDerWaalsContact O-CB 3.26Å; G44-N48 WeakPolarHBondContact O-CB 3.35Å; G44-N48 PolarHBondContact O-N 2.89Å; G44-N48 PolarHBondContact O-ND2 3.38Å; N48-V51 PolarHBondContact O-N 3.2Å; N48-F52 WeakPolarHBondContact O-CB 3.49Å; N48-F52 PolarHBondContact O-N 3.38Å; N48-P73 HydrophobicContact CB-CB 3.9Å; N48-D76 PolarHBondContact OD1-OD2 2.92Å; N48-L77 HydrophobicContact CB-CD2 4.2Å; N48-L77 HydrophobicContact CB-CG 4.11Å; N48-C290 PolarHBondContact ND2-O 2.78Å |
| 49 | M | 93.8 | Very high | 89.8 | Confident | 64 Ų | 64 | 51.6 Ų | 51.6 | 32% | 0.315 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -63 | -41.9 | 172.5 | -74.6 | -62.9 | -179.8 | 0 | 0 | 112.2 | F45 V51 F52 L53 L77 | F45-M49 HydrophobicContact CD1-CG 4.24Å; F45-M49 HydrophobicContact CE1-CE 4.33Å; F45-M49 HydrophobicContact CE1-CG 4.01Å; F45-M49 HydrophobicContact CE2-CE 3.7Å; F45-M49 HydrophobicContact CZ-CE 3.6Å; F45-M49 HydrophobicContact CZ-CG 4.2Å; F45-M49 VanDerWaalsContact O-CB 3.27Å; F45-M49 WeakPolarHBondContact O-CB 3.48Å; F45-M49 WeakPolarHBondContact O-CG 3.23Å; F45-M49 PolarHBondContact O-N 3.32Å; M49-V51 PolarHBondContact O-N 2.93Å; M49-F52 PolarHBondContact O-N 3.28Å; M49-L53 WeakPolarHBondContact O-CB 3.21Å; M49-L53 VanDerWaalsContact O-CG 3.27Å; M49-L53 WeakPolarHBondContact O-CG 3.42Å; M49-L53 PolarHBondContact O-N 3.49Å; M49-L77 HydrophobicContact CE-CD1 3.57Å; M49-L77 HydrophobicContact CE-CD2 3.81Å; M49-L77 HydrophobicContact CE-CG 4.33Å; M49-L77 HydrophobicContact CG-CD2 4.32Å; M49-L77 HydrophobicContact SD-CD1 3.86Å |
| 50 | L | 91.4 | Very high | 89.3 | Confident | 27 Ų | 27 | 55.8 Ų | 55.8 | 14% | 0.141 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -62.9 | -41.3 | 175.5 | -74.4 | 171.9 | 0 | 0 | 0 | 112.2 | V46 G47 F54 L308 F311 | V46-L50 HydrophobicContact CG1-CD1 4Å; V46-L50 HydrophobicContact CG1-CG 4.48Å; V46-L50 WeakPolarHBondContact O-CB 3.4Å; V46-L50 VanDerWaalsContact O-CG 3.27Å; V46-L50 WeakPolarHBondContact O-CG 3.4Å; V46-L50 PolarHBondContact O-N 3.38Å; G47-L50 PolarHBondContact O-N 2.89Å; L50-F54 VanDerWaalsContact O-CB 3.3Å; L50-F54 WeakPolarHBondContact O-CB 3.38Å; L50-F54 PolarHBondContact O-N 3.13Å; L50-L308 HydrophobicContact CD1-CD2 4.21Å; L50-F311 HydrophobicContact CD2-CD1 4.01Å; L50-F311 HydrophobicContact CD2-CE1 3.58Å; L50-F311 HydrophobicContact CD2-CZ 3.86Å |
| 51 | V | 91.4 | Very high | 89 | Confident | 4 Ų | 4 | 57.8 Ų | 57.8 | 2% | 0.024 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -63.4 | -46 | 175.6 | 174.8 | 0 | 0 | 0 | 0 | 110.7 | G47 N48 M49 F54 L55 P73 P294 Y297 F304 | G47-V51 WeakPolarHBondContact O-CG2 3.45Å; G47-V51 PolarHBondContact O-N 3.03Å; N48-V51 PolarHBondContact O-N 3.2Å; M49-V51 PolarHBondContact O-N 2.93Å; V51-F54 WeakPolarHBondContact O-CB 3.39Å; V51-F54 PolarHBondContact O-N 3.48Å; V51-L55 HydrophobicContact CG1-CD1 3.94Å; V51-L55 HydrophobicContact CG1-CG 4.47Å; V51-L55 VanDerWaalsContact O-CG 3.31Å; V51-L55 WeakPolarHBondContact O-CG 3.49Å; V51-L55 PolarHBondContact O-N 3.27Å; V51-P73 HydrophobicContact CG1-CB 4.48Å; V51-P73 HydrophobicContact CG1-CG 4.15Å; V51-P294 HydrophobicContact CG2-CB 3.97Å; V51-P294 HydrophobicContact CG2-CG 4.18Å; V51-Y297 HydrophobicContact CG1-CD2 3.91Å; V51-Y297 HydrophobicContact CG1-CE2 3.99Å; V51-Y297 HydrophobicContact CG2-CD2 3.78Å; V51-Y297 HydrophobicContact CG2-CE2 4.46Å; V51-F304 HydrophobicContact CG2-CE1 4.16Å; V51-F304 HydrophobicContact CG2-CE2 3.95Å; V51-F304 HydrophobicContact CG2-CZ 3.54Å |
| 52 | F | 92.3 | Very high | 88.5 | Confident | 59 Ų | 59 | 62.3 Ų | 62.3 | 26% | 0.259 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -57.9 | -50.4 | 176.9 | 179.5 | -94.9 | 0 | 0 | 0 | 111.7 | N48 M49 F54 L55 I56 L70 P73 I74 | N48-F52 WeakPolarHBondContact O-CB 3.49Å; N48-F52 PolarHBondContact O-N 3.38Å; M49-F52 PolarHBondContact O-N 3.28Å; F52-F54 PolarHBondContact O-N 2.7Å; F52-L55 PolarHBondContact O-N 2.66Å; F52-I56 HydrophobicContact CD1-CD1 3.94Å; F52-I56 HydrophobicContact CD2-CD1 4.38Å; F52-I56 HydrophobicContact CE1-CD1 3.35Å; F52-I56 HydrophobicContact CE2-CD1 3.84Å; F52-I56 HydrophobicContact CG-CD1 4.43Å; F52-I56 HydrophobicContact CZ-CD1 3.3Å; F52-I56 PolarHBondContact O-N 3.46Å; F52-I56 VanDerWaalsContact O-N 3.13Å; F52-L70 HydrophobicContact CD2-CD1 3.51Å; F52-L70 HydrophobicContact CD2-CG 4.21Å; F52-L70 HydrophobicContact CE2-CD1 3.81Å; F52-L70 HydrophobicContact CE2-CG 4.24Å; F52-L70 HydrophobicContact CG-CD1 4.24Å; F52-P73 HydrophobicContact CB-CG 4.48Å; F52-I74 HydrophobicContact CD2-CD1 4.42Å; F52-I74 HydrophobicContact CD2-CG1 4.01Å; F52-I74 HydrophobicContact CE2-CD1 3.93Å; F52-I74 HydrophobicContact CE2-CG1 3.92Å |
| 53 | L | 89 | Confident | 88.2 | Confident | 70 Ų | 70 | 59.3 Ų | 59.3 | 37% | 0.366 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -62.5 | -40.3 | 177.9 | -71 | 172.4 | 0 | 0 | 0 | 112.4 | M49 N57 | M49-L53 WeakPolarHBondContact O-CB 3.21Å; M49-L53 VanDerWaalsContact O-CG 3.27Å; M49-L53 WeakPolarHBondContact O-CG 3.42Å; M49-L53 PolarHBondContact O-N 3.49Å; L53-N57 VanDerWaalsContact O-CB 3.23Å; L53-N57 WeakPolarHBondContact O-CB 3.3Å; L53-N57 PolarHBondContact O-N 3.04Å; L53-N57 PolarHBondContact O-ND2 3.11Å; L53-N57 VanDerWaalsContact O-ND2 3.16Å |
| 54 | F | 87.8 | Confident | 88.1 | Confident | 16 Ų | 16 | 54.2 Ų | 54.2 | 7% | 0.07 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -59.6 | -46.3 | 175.2 | 166.6 | -114.1 | 0 | 0 | 0 | 112 | L50 V51 F52 C58 K59 K303 F304 Y307 | L50-F54 VanDerWaalsContact O-CB 3.3Å; L50-F54 WeakPolarHBondContact O-CB 3.38Å; L50-F54 PolarHBondContact O-N 3.13Å; V51-F54 WeakPolarHBondContact O-CB 3.39Å; V51-F54 PolarHBondContact O-N 3.48Å; F52-F54 PolarHBondContact O-N 2.7Å; F54-C58 HydrophobicContact CD2-CB 3.71Å; F54-C58 HydrophobicContact CE2-CB 3.85Å; F54-C58 WeakPolarHBondContact O-CA 3.25Å; F54-C58 VanDerWaalsContact O-CB 3.3Å; F54-C58 WeakPolarHBondContact O-CB 3.46Å; F54-C58 PolarHBondContact O-N 3Å; F54-K59 HydrophobicContact CD1-CG 4.45Å; F54-K59 HydrophobicContact CE1-CD 4.45Å; F54-K59 HydrophobicContact CE1-CG 3.83Å; F54-K59 HydrophobicContact CE2-CG 4.37Å; F54-K59 HydrophobicContact CZ-CD 4.06Å; F54-K59 HydrophobicContact CZ-CG 3.8Å; F54-K59 PolarHBondContact O-N 3.11Å; F54-K303 HydrophobicContact CZ-CB 4.29Å; F54-F304 HydrophobicContact CB-CD2 3.95Å; F54-F304 HydrophobicContact CB-CE2 3.93Å; F54-F304 HydrophobicContact CD1-CB 4.37Å; F54-F304 AromaticContact CD1-CD2 3.43Å; F54-F304 HydrophobicContact CD1-CD2 3.43Å; F54-F304 VanDerWaalsContact CD1-CD2 3.43Å; F54-F304 HydrophobicContact CD1-CE2 4.17Å; F54-F304 HydrophobicContact CD1-CG 4.31Å; F54-F304 HydrophobicContact CD2-CD2 4.23Å; F54-F304 HydrophobicContact CE1-CB 3.93Å; F54-F304 AromaticContact CE1-CD2 3.88Å; F54-F304 HydrophobicContact CE1-CD2 3.88Å; F54-F304 HydrophobicContact CE1-CG 4.36Å; F54-F304 AromaticContact CG-CD2 3.6Å; F54-F304 HydrophobicContact CG-CD2 3.6Å; F54-F304 HydrophobicContact CG-CE2 4.12Å; F54-F304 HydrophobicContact CZ-CB 4.18Å; F54-F304 HydrophobicContact CZ-CD2 4.44Å; F54-Y307 HydrophobicContact CB-CD1 3.63Å; F54-Y307 HydrophobicContact CB-CE1 3.55Å; F54-Y307 HydrophobicContact CB-CG 4.36Å; F54-Y307 VanDerWaalsContact CD2-CB 3.43Å; F54-Y307 AromaticContact CD2-CD1 3.39Å; F54-Y307 HydrophobicContact CD2-CD1 3.39Å; F54-Y307 AromaticContact CD2-CD2 3.82Å; F54-Y307 HydrophobicContact CD2-CD2 3.82Å; F54-Y307 HydrophobicContact CD2-CE1 4.02Å; F54-Y307 HydrophobicContact CD2-CE2 4.4Å; F54-Y307 AromaticContact CD2-CG 3.24Å; F54-Y307 HydrophobicContact CD2-CG 3.24Å; F54-Y307 VanDerWaalsContact CE2-CB 3.46Å; F54-Y307 HydrophobicContact CE2-CD1 4.31Å; F54-Y307 HydrophobicContact CE2-CD2 4.41Å; F54-Y307 AromaticContact CE2-CG 3.83Å; F54-Y307 HydrophobicContact CE2-CG 3.83Å; F54-Y307 AromaticContact CG-CD1 3.82Å; F54-Y307 HydrophobicContact CG-CD1 3.82Å; F54-Y307 HydrophobicContact CG-CE1 4.22Å; F54-Y307 HydrophobicContact CG-CG 4.14Å |
| 55 | L | 87.1 | Confident | 87.9 | Confident | 5 Ų | 5 | 54.9 Ų | 54.9 | 3% | 0.026 | 27% | 0.273 | C | S | . | . | I | π-helix | trans | -65.9 | -40.9 | -176.6 | -72.5 | 170.9 | 0 | 0 | 0 | 111.8 | V51 F52 K59 R60 L61 L69 L70 | V51-L55 HydrophobicContact CG1-CD1 3.94Å; V51-L55 HydrophobicContact CG1-CG 4.47Å; V51-L55 VanDerWaalsContact O-CG 3.31Å; V51-L55 WeakPolarHBondContact O-CG 3.49Å; V51-L55 PolarHBondContact O-N 3.27Å; F52-L55 PolarHBondContact O-N 2.66Å; L55-K59 HydrophobicContact CD2-CB 4.4Å; L55-K59 HydrophobicContact CD2-CG 4.15Å; L55-K59 WeakPolarHBondContact O-CB 3.43Å; L55-K59 PolarHBondContact O-N 2.93Å; L55-R60 PolarHBondContact O-N 3.45Å; L55-L61 HydrophobicContact CB-CD2 4.19Å; L55-L69 HydrophobicContact CD1-CB 4.12Å; L55-L69 VanDerWaalsContact CD1-O 3.29Å; L55-L69 WeakPolarHBondContact CD1-O 3.38Å; L55-L69 HydrophobicContact CD2-CB 4.41Å; L55-L70 HydrophobicContact CB-CD1 3.81Å; L55-L70 HydrophobicContact CD1-CB 4.14Å; L55-L70 HydrophobicContact CD1-CD1 4.16Å |
| 56 | I | 86.6 | Confident | 87.7 | Confident | 65 Ų | 65 | 51.8 Ų | 51.8 | 33% | 0.333 | 26% | 0.26 | S | S | . | . | I | π-helix | trans | -71.8 | -54.1 | 177.8 | -65.9 | 178.4 | 0 | 0 | 0 | 111 | F52 R60 L70 | F52-I56 HydrophobicContact CD1-CD1 3.94Å; F52-I56 HydrophobicContact CD2-CD1 4.38Å; F52-I56 HydrophobicContact CE1-CD1 3.35Å; F52-I56 HydrophobicContact CE2-CD1 3.84Å; F52-I56 HydrophobicContact CG-CD1 4.43Å; F52-I56 HydrophobicContact CZ-CD1 3.3Å; F52-I56 PolarHBondContact O-N 3.46Å; F52-I56 VanDerWaalsContact O-N 3.13Å; I56-R60 WeakPolarHBondContact O-CA 3.38Å; I56-R60 PolarHBondContact O-N 3.41Å; I56-L70 HydrophobicContact CD1-CD1 4.24Å; I56-L70 HydrophobicContact CG1-CD1 3.85Å |
| 57 | N | 82.6 | Confident | 87.7 | Confident | 96 Ų | 96 | 48.6 Ų | 48.6 | 51% | 0.513 | 24% | 0.24 | S | C | . | . | I | π-helix | trans | -79.5 | -35.5 | -168.1 | -63.6 | -37.3 | 0 | 0 | 0 | 113.2 | L53 | L53-N57 VanDerWaalsContact O-CB 3.23Å; L53-N57 WeakPolarHBondContact O-CB 3.3Å; L53-N57 PolarHBondContact O-N 3.04Å; L53-N57 PolarHBondContact O-ND2 3.11Å; L53-N57 VanDerWaalsContact O-ND2 3.16Å |
| 58 | C | 79.9 | Confident | 87.8 | Confident | 64 Ų | 64 | 48.2 Ų | 48.2 | 43% | 0.432 | 24% | 0.235 | S | C | . | . | I | π-helix | trans | -105.1 | -43.4 | -173.8 | -64 | 0 | 0 | 0 | 0 | 113.4 | F54 Y307 | F54-C58 HydrophobicContact CD2-CB 3.71Å; F54-C58 HydrophobicContact CE2-CB 3.85Å; F54-C58 WeakPolarHBondContact O-CA 3.25Å; F54-C58 VanDerWaalsContact O-CB 3.3Å; F54-C58 WeakPolarHBondContact O-CB 3.46Å; F54-C58 PolarHBondContact O-N 3Å; C58-Y307 HydrophobicContact CB-CD2 4.28Å; C58-Y307 HydrophobicContact CB-CE2 4.48Å; C58-Y307 WeakPolarHBondContact SG-CD2 3.16Å; C58-Y307 WeakPolarHBondContact SG-CE2 3.21Å |
| 59 | K | 77.8 | Confident | 87.6 | Confident | 52 Ų | 52 | 49.2 Ų | 49.2 | 23% | 0.226 | 24% | 0.24 | C | C | . | . | I | π-helix | trans | -81.4 | -24.3 | 178.9 | -67.2 | -63.5 | -136.9 | 77 | 0 | 113 | F54 L55 L61 D66 | F54-K59 HydrophobicContact CD1-CG 4.45Å; F54-K59 HydrophobicContact CE1-CD 4.45Å; F54-K59 HydrophobicContact CE1-CG 3.83Å; F54-K59 HydrophobicContact CE2-CG 4.37Å; F54-K59 HydrophobicContact CZ-CD 4.06Å; F54-K59 HydrophobicContact CZ-CG 3.8Å; F54-K59 PolarHBondContact O-N 3.11Å; L55-K59 HydrophobicContact CD2-CB 4.4Å; L55-K59 HydrophobicContact CD2-CG 4.15Å; L55-K59 WeakPolarHBondContact O-CB 3.43Å; L55-K59 PolarHBondContact O-N 2.93Å; K59-L61 PolarHBondContact O-N 3.08Å; K59-L61 VanDerWaalsContact O-N 3.12Å; K59-D66 IonicContact NZ-OD1 3.65Å; K59-D66 PolarHBondContact NZ-OD1 3.31Å |
| 60 | R | 80.2 | Confident | 87.6 | Confident | 183 Ų | 183 | 47.1 Ų | 47.1 | 69% | 0.691 | 23% | 0.23 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 52.1 | 29.3 | -179.3 | -56.2 | -173.5 | -178.4 | -179.3 | 0.6 | 113.4 | L55 I56 K62 | L55-R60 PolarHBondContact O-N 3.45Å; I56-R60 WeakPolarHBondContact O-CA 3.38Å; I56-R60 PolarHBondContact O-N 3.41Å; R60-K62 HydrophobicContact CB-CG 4.39Å; R60-K62 PolarHBondContact O-N 3.48Å |
| 61 | L | 83.8 | Confident | 87.8 | Confident | 48 Ų | 48 | 46.6 Ų | 46.6 | 25% | 0.251 | 23% | 0.228 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 46.4 | 40.9 | 172.6 | -51.2 | 175.3 | 0 | 0 | 0 | 115.1 | L55 K59 S63 D66 L70 | L55-L61 HydrophobicContact CB-CD2 4.19Å; K59-L61 PolarHBondContact O-N 3.08Å; K59-L61 VanDerWaalsContact O-N 3.12Å; L61-S63 PolarHBondContact O-N 3.36Å; L61-D66 HydrophobicContact CD2-CB 4.32Å; L61-L70 HydrophobicContact CD1-CD2 3.68Å; L61-L70 HydrophobicContact CD2-CB 4.06Å; L61-L70 HydrophobicContact CD2-CD1 4.32Å; L61-L70 HydrophobicContact CD2-CD2 3.94Å; L61-L70 HydrophobicContact CD2-CG 4.34Å; L61-L70 HydrophobicContact CG-CD2 4.47Å |
| 62 | K | 82.1 | Confident | 87.9 | Confident | 158 Ų | 158 | 46.5 Ų | 46.5 | 69% | 0.687 | 23% | 0.227 | S | C | * | . | trans | -74.1 | -5.7 | -173 | -64.9 | -175.1 | 178.6 | -173 | 0 | 114.7 | R60 | R60-K62 HydrophobicContact CB-CG 4.39Å; R60-K62 PolarHBondContact O-N 3.48Å | ||
| 63 | S | 86.6 | Confident | 88 | Confident | 38 Ų | 38 | 43.7 Ų | 43.7 | 27% | 0.266 | 21% | 0.214 | S | C | . | . | S | Bend | trans | -138.3 | 152.6 | -177.3 | 73.7 | 0 | 0 | 0 | 0 | 111.8 | L61 T65 D66 I67 | L61-S63 PolarHBondContact O-N 3.36Å; S63-T65 PolarHBondContact O-N 3.22Å; S63-D66 PolarHBondContact N-OD2 3Å; S63-D66 WeakPolarHBondContact O-CB 2.9Å; S63-D66 PolarHBondContact O-N 2.91Å; S63-D66 PolarHBondContact OG-N 3.4Å; S63-D66 PolarHBondContact OG-OD2 3.35Å; S63-I67 PolarHBondContact O-N 3Å |
| 64 | M | 89.7 | Confident | 88.4 | Confident | 20 Ų | 20 | 42.5 Ų | 42.5 | 10% | 0.099 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -51.7 | -38.3 | 174.3 | -175.7 | 173.7 | -176 | 0 | 0 | 112.5 | I67 Y68 R140 | M64-I67 WeakPolarHBondContact O-CB 3.23Å; M64-I67 PolarHBondContact O-N 2.83Å; M64-Y68 HydrophobicContact CE-CE2 3.85Å; M64-Y68 WeakPolarHBondContact CE-OH 3.41Å; M64-Y68 HydrophobicContact CG-CD2 4.49Å; M64-Y68 HydrophobicContact CG-CE2 3.89Å; M64-Y68 PolarHBondContact O-N 2.91Å; M64-Y68 VanDerWaalsContact O-N 3.13Å; M64-R140 VanDerWaalsContact SD-CA 3.59Å; M64-R140 HydrophobicContact SD-CB 3.96Å; M64-R140 HydrophobicContact SD-CG 4.09Å |
| 65 | T | 89.8 | Confident | 88.8 | Confident | 14 Ų | 14 | 41.8 Ų | 41.8 | 9% | 0.086 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -65.3 | -40.1 | 176.3 | -41 | 0 | 0 | 0 | 0 | 112.5 | S63 I67 Y68 L69 L122 D125 R126 R140 | S63-T65 PolarHBondContact O-N 3.22Å; T65-I67 PolarHBondContact O-N 2.91Å; T65-Y68 PolarHBondContact O-N 3.42Å; T65-L69 HydrophobicContact CG2-CD1 4.2Å; T65-L69 HydrophobicContact CG2-CG 4.47Å; T65-L69 WeakPolarHBondContact O-CB 3.36Å; T65-L69 VanDerWaalsContact O-CG 3.25Å; T65-L69 WeakPolarHBondContact O-CG 3.23Å; T65-L69 PolarHBondContact O-N 3Å; T65-L122 HydrophobicContact CG2-CD2 3.73Å; T65-D125 PolarHBondContact OG1-OD2 3.1Å; T65-R126 PolarHBondContact OG1-NH2 3.3Å; T65-R140 PolarHBondContact OG1-NH2 2.84Å; T65-R140 VanDerWaalsContact OG1-NH2 3.13Å |
| 66 | D | 89.6 | Confident | 89.2 | Confident | 13 Ų | 13 | 42 Ų | 42 | 7% | 0.07 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -65.5 | -30.2 | 177 | -63.1 | -55.9 | 0 | 0 | 0 | 110.8 | K59 L61 S63 L70 | K59-D66 IonicContact NZ-OD1 3.65Å; K59-D66 PolarHBondContact NZ-OD1 3.31Å; L61-D66 HydrophobicContact CD2-CB 4.32Å; S63-D66 PolarHBondContact N-OD2 3Å; S63-D66 WeakPolarHBondContact O-CB 2.9Å; S63-D66 PolarHBondContact O-N 2.91Å; S63-D66 PolarHBondContact OG-N 3.4Å; S63-D66 PolarHBondContact OG-OD2 3.35Å; D66-L70 WeakPolarHBondContact O-CB 3.39Å; D66-L70 PolarHBondContact O-N 3.47Å |
| 67 | I | 93.6 | Very high | 89.6 | Confident | 13 Ų | 13 | 40 Ų | 40 | 7% | 0.067 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -67.3 | -49 | 173.6 | -58.3 | 169.4 | 0 | 0 | 0 | 110.8 | S63 M64 T65 L69 L70 N71 V142 V146 | S63-I67 PolarHBondContact O-N 3Å; M64-I67 WeakPolarHBondContact O-CB 3.23Å; M64-I67 PolarHBondContact O-N 2.83Å; T65-I67 PolarHBondContact O-N 2.91Å; I67-L69 VanDerWaalsContact C-N 3.34Å; I67-L69 PolarHBondContact O-N 3.34Å; I67-L70 WeakPolarHBondContact O-CB 3.42Å; I67-L70 PolarHBondContact O-N 3.46Å; I67-L70 VanDerWaalsContact O-N 3.08Å; I67-N71 PolarHBondContact O-N 3.4Å; I67-N71 VanDerWaalsContact O-N 3.07Å; I67-N71 PolarHBondContact O-ND2 2.83Å; I67-V142 HydrophobicContact CD1-CB 4.2Å; I67-V142 HydrophobicContact CD1-CG1 3.75Å; I67-V142 VanDerWaalsContact CD1-O 3.25Å; I67-V142 WeakPolarHBondContact CD1-O 3.28Å; I67-V146 HydrophobicContact CD1-CG2 3.99Å |
| 68 | Y | 93.8 | Very high | 90.2 | Very high | 4 Ų | 4 | 38.4 Ų | 38.4 | 2% | 0.016 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -64.5 | -39.9 | 177.9 | -62 | -25.5 | 0 | 0 | 0 | 112.2 | M64 T65 L70 N71 L72 F118 L121 L122 D125 T148 | M64-Y68 HydrophobicContact CE-CE2 3.85Å; M64-Y68 WeakPolarHBondContact CE-OH 3.41Å; M64-Y68 HydrophobicContact CG-CD2 4.49Å; M64-Y68 HydrophobicContact CG-CE2 3.89Å; M64-Y68 PolarHBondContact O-N 2.91Å; M64-Y68 VanDerWaalsContact O-N 3.13Å; T65-Y68 PolarHBondContact O-N 3.42Å; Y68-L70 PolarHBondContact O-N 3.06Å; Y68-N71 PolarHBondContact O-N 3Å; Y68-N71 VanDerWaalsContact O-N 3.17Å; Y68-L72 PolarHBondContact O-N 3.41Å; Y68-F118 HydrophobicContact CD1-CD1 4.1Å; Y68-F118 HydrophobicContact CD1-CE1 4.23Å; Y68-L121 HydrophobicContact CD1-CD1 4.41Å; Y68-L121 HydrophobicContact CD2-CB 4Å; Y68-L121 HydrophobicContact CE1-CB 4.45Å; Y68-L121 HydrophobicContact CE1-CD1 3.97Å; Y68-L121 HydrophobicContact CE2-CB 3.82Å; Y68-L121 HydrophobicContact CG-CB 4.36Å; Y68-L122 HydrophobicContact CD2-CD2 4.34Å; Y68-D125 HydrophobicContact CD2-CB 4.3Å; Y68-D125 HydrophobicContact CE2-CB 4.12Å; Y68-T148 WeakPolarHBondContact CE1-OG1 3.23Å; Y68-T148 WeakPolarHBondContact OH-CB 3.38Å; Y68-T148 PolarHBondContact OH-OG1 3.07Å |
| 69 | L | 91.1 | Very high | 90.8 | Very high | 21 Ų | 21 | 35.7 Ų | 35.7 | 11% | 0.11 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -62.8 | -26.1 | 172.4 | -72.7 | 173.3 | 0 | 0 | 0 | 112.9 | L55 T65 I67 L72 P73 L122 Y297 | L55-L69 HydrophobicContact CD1-CB 4.12Å; L55-L69 VanDerWaalsContact CD1-O 3.29Å; L55-L69 WeakPolarHBondContact CD1-O 3.38Å; L55-L69 HydrophobicContact CD2-CB 4.41Å; T65-L69 HydrophobicContact CG2-CD1 4.2Å; T65-L69 HydrophobicContact CG2-CG 4.47Å; T65-L69 WeakPolarHBondContact O-CB 3.36Å; T65-L69 VanDerWaalsContact O-CG 3.25Å; T65-L69 WeakPolarHBondContact O-CG 3.23Å; T65-L69 PolarHBondContact O-N 3Å; I67-L69 VanDerWaalsContact C-N 3.34Å; I67-L69 PolarHBondContact O-N 3.34Å; L69-L72 HydrophobicContact CD2-CD1 4.43Å; L69-P73 WeakPolarHBondContact O-CD 3.5Å; L69-L122 HydrophobicContact CD2-CD1 3.87Å; L69-L122 HydrophobicContact CD2-CD2 4.14Å; L69-L122 HydrophobicContact CG-CD1 4.48Å; L69-L122 HydrophobicContact CG-CD2 3.98Å; L69-Y297 HydrophobicContact CD2-CE1 3.89Å; L69-Y297 WeakPolarHBondContact CD2-OH 3.34Å |
| 70 | L | 93.7 | Very high | 91.5 | Very high | 20 Ų | 20 | 33.2 Ų | 33.2 | 11% | 0.105 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -77.1 | -35.5 | 174.2 | -175.4 | 76.8 | 0 | 0 | 0 | 111.9 | F52 L55 I56 L61 D66 I67 Y68 L72 P73 I74 | F52-L70 HydrophobicContact CD2-CD1 3.51Å; F52-L70 HydrophobicContact CD2-CG 4.21Å; F52-L70 HydrophobicContact CE2-CD1 3.81Å; F52-L70 HydrophobicContact CE2-CG 4.24Å; F52-L70 HydrophobicContact CG-CD1 4.24Å; L55-L70 HydrophobicContact CB-CD1 3.81Å; L55-L70 HydrophobicContact CD1-CB 4.14Å; L55-L70 HydrophobicContact CD1-CD1 4.16Å; I56-L70 HydrophobicContact CD1-CD1 4.24Å; I56-L70 HydrophobicContact CG1-CD1 3.85Å; L61-L70 HydrophobicContact CD1-CD2 3.68Å; L61-L70 HydrophobicContact CD2-CB 4.06Å; L61-L70 HydrophobicContact CD2-CD1 4.32Å; L61-L70 HydrophobicContact CD2-CD2 3.94Å; L61-L70 HydrophobicContact CD2-CG 4.34Å; L61-L70 HydrophobicContact CG-CD2 4.47Å; D66-L70 WeakPolarHBondContact O-CB 3.39Å; D66-L70 PolarHBondContact O-N 3.47Å; I67-L70 WeakPolarHBondContact O-CB 3.42Å; I67-L70 PolarHBondContact O-N 3.46Å; I67-L70 VanDerWaalsContact O-N 3.08Å; Y68-L70 PolarHBondContact O-N 3.06Å; L70-L72 VanDerWaalsContact C-N 3.31Å; L70-L72 PolarHBondContact O-N 3.42Å; L70-P73 WeakPolarHBondContact O-CD 3.26Å; L70-P73 VanDerWaalsContact O-CG 3.23Å; L70-P73 WeakPolarHBondContact O-CG 3.13Å; L70-I74 HydrophobicContact CG-CD1 4.44Å; L70-I74 WeakPolarHBondContact O-CG1 3.07Å |
| 71 | N | 96.3 | Very high | 92 | Very high | 16 Ų | 16 | 28 Ų | 28 | 9% | 0.086 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -73.7 | -23.6 | 180 | -73.9 | -83.8 | 0 | 0 | 0 | 113 | I67 Y68 I74 S75 F118 S149 W153 | I67-N71 PolarHBondContact O-N 3.4Å; I67-N71 VanDerWaalsContact O-N 3.07Å; I67-N71 PolarHBondContact O-ND2 2.83Å; Y68-N71 PolarHBondContact O-N 3Å; Y68-N71 VanDerWaalsContact O-N 3.17Å; N71-I74 PolarHBondContact O-N 3.35Å; N71-S75 PolarHBondContact O-N 3.49Å; N71-S75 PolarHBondContact O-OG 2.85Å; N71-F118 HydrophobicContact CB-CD1 3.73Å; N71-F118 HydrophobicContact CB-CD2 3.62Å; N71-F118 HydrophobicContact CB-CE1 3.49Å; N71-F118 VanDerWaalsContact CB-CE1 3.49Å; N71-F118 HydrophobicContact CB-CE2 3.4Å; N71-F118 VanDerWaalsContact CB-CE2 3.4Å; N71-F118 HydrophobicContact CB-CG 3.82Å; N71-F118 HydrophobicContact CB-CZ 3.34Å; N71-S149 PolarHBondContact ND2-OG 2.7Å; N71-W153 PolarHBondContact OD1-NE1 3.17Å |
| 72 | L | 93.5 | Very high | 92.3 | Very high | 1 Ų | 1 | 26.4 Ų | 26.4 | 1% | 0.005 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -59.1 | -57.7 | 173.1 | -85.2 | 172.1 | 0 | 0 | 0 | 114 | Y68 L69 L70 I74 S75 D76 G115 F118 I119 L122 Y297 | Y68-L72 PolarHBondContact O-N 3.41Å; L69-L72 HydrophobicContact CD2-CD1 4.43Å; L70-L72 VanDerWaalsContact C-N 3.31Å; L70-L72 PolarHBondContact O-N 3.42Å; L72-I74 PolarHBondContact O-N 3.38Å; L72-S75 WeakPolarHBondContact O-CA 3.36Å; L72-S75 VanDerWaalsContact O-CB 3.29Å; L72-S75 WeakPolarHBondContact O-CB 3.43Å; L72-S75 PolarHBondContact O-N 2.72Å; L72-D76 PolarHBondContact O-N 2.97Å; L72-G115 WeakPolarHBondContact CD2-O 3.36Å; L72-F118 HydrophobicContact CD2-CB 4Å; L72-F118 HydrophobicContact CG-CB 4.01Å; L72-I119 HydrophobicContact CD1-CG1 4.43Å; L72-I119 HydrophobicContact CD2-CD1 4.38Å; L72-I119 HydrophobicContact CD2-CG1 3.78Å; L72-L122 HydrophobicContact CD1-CD1 3.38Å; L72-L122 HydrophobicContact CG-CD1 4.38Å; L72-Y297 WeakPolarHBondContact CD1-OH 3.26Å |
| 73 | P | 94.6 | Very high | 92.5 | Very high | 0 Ų | 0 | 19 Ų | 19 | 0% | 0 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -62.8 | -27.9 | 177.9 | 25 | -34.4 | 0 | 0 | 0 | 112.1 | N48 V51 F52 L69 L70 L77 | N48-P73 HydrophobicContact CB-CB 3.9Å; V51-P73 HydrophobicContact CG1-CB 4.48Å; V51-P73 HydrophobicContact CG1-CG 4.15Å; F52-P73 HydrophobicContact CB-CG 4.48Å; L69-P73 WeakPolarHBondContact O-CD 3.5Å; L70-P73 WeakPolarHBondContact O-CD 3.26Å; L70-P73 VanDerWaalsContact O-CG 3.23Å; L70-P73 WeakPolarHBondContact O-CG 3.13Å; P73-L77 VanDerWaalsContact O-CB 3.3Å; P73-L77 WeakPolarHBondContact O-CB 3.31Å; P73-L77 WeakPolarHBondContact O-CD1 3.33Å; P73-L77 WeakPolarHBondContact O-CG 3.06Å; P73-L77 PolarHBondContact O-N 2.89Å |
| 74 | I | 96 | Very high | 92.3 | Very high | 46 Ų | 46 | 19.1 Ų | 19.1 | 24% | 0.236 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -65.3 | -42.7 | 172.1 | -60.3 | 172 | 0 | 0 | 0 | 110.6 | F52 L70 N71 L72 L77 F78 W153 | F52-I74 HydrophobicContact CD2-CD1 4.42Å; F52-I74 HydrophobicContact CD2-CG1 4.01Å; F52-I74 HydrophobicContact CE2-CD1 3.93Å; F52-I74 HydrophobicContact CE2-CG1 3.92Å; L70-I74 HydrophobicContact CG-CD1 4.44Å; L70-I74 WeakPolarHBondContact O-CG1 3.07Å; N71-I74 PolarHBondContact O-N 3.35Å; L72-I74 PolarHBondContact O-N 3.38Å; I74-L77 PolarHBondContact O-N 2.82Å; I74-F78 HydrophobicContact CG2-CD2 4.19Å; I74-F78 HydrophobicContact CG2-CE2 3.8Å; I74-F78 VanDerWaalsContact O-CD2 3.32Å; I74-F78 WeakPolarHBondContact O-CD2 3.4Å; I74-F78 PolarHBondContact O-N 3.13Å; I74-W153 HydrophobicContact CB-CH2 4.48Å; I74-W153 HydrophobicContact CB-CZ2 4.14Å; I74-W153 HydrophobicContact CG2-CH2 3.82Å; I74-W153 HydrophobicContact CG2-CZ2 3.68Å |
| 75 | S | 96.6 | Very high | 91.7 | Very high | 0 Ų | 0 | 20.6 Ų | 20.6 | 0% | 0 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -62.9 | -46.3 | 175.4 | -55.6 | 0 | 0 | 0 | 0 | 111.5 | N71 L72 L77 F78 F79 G111 S114 | N71-S75 PolarHBondContact O-N 3.49Å; N71-S75 PolarHBondContact O-OG 2.85Å; L72-S75 WeakPolarHBondContact O-CA 3.36Å; L72-S75 VanDerWaalsContact O-CB 3.29Å; L72-S75 WeakPolarHBondContact O-CB 3.43Å; L72-S75 PolarHBondContact O-N 2.72Å; S75-L77 VanDerWaalsContact C-N 3.29Å; S75-L77 PolarHBondContact O-N 2.64Å; S75-F78 PolarHBondContact O-N 3.26Å; S75-F79 PolarHBondContact O-N 3.13Å; S75-F79 VanDerWaalsContact O-N 3.14Å; S75-G111 WeakPolarHBondContact O-CA 3.49Å; S75-S114 WeakPolarHBondContact CB-OG 3.37Å; S75-S114 WeakPolarHBondContact OG-CB 3.48Å; S75-S114 PolarHBondContact OG-OG 3.04Å |
| 76 | D | 95.4 | Very high | 90.6 | Very high | 9 Ų | 9 | 21.1 Ų | 21.1 | 5% | 0.048 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -63.3 | -35.6 | 176.6 | -67.4 | -36 | 0 | 0 | 0 | 111.4 | N48 L72 F79 L80 C290 N293 | N48-D76 PolarHBondContact OD1-OD2 2.92Å; L72-D76 PolarHBondContact O-N 2.97Å; D76-F79 WeakPolarHBondContact O-CB 3.39Å; D76-F79 PolarHBondContact O-N 3.26Å; D76-L80 WeakPolarHBondContact O-CB 3.46Å; D76-L80 WeakPolarHBondContact O-CD1 3.43Å; D76-L80 WeakPolarHBondContact O-CG 3.26Å; D76-L80 PolarHBondContact O-N 3.46Å; D76-C290 HydrophobicContact CB-CB 4.26Å; D76-N293 PolarHBondContact OD2-ND2 3.29Å |
| 77 | L | 95.1 | Very high | 89.1 | Confident | 23 Ų | 23 | 21.3 Ų | 21.3 | 12% | 0.12 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -66.6 | -42.6 | 175.4 | -76.6 | 169.8 | 0 | 0 | 0 | 112.4 | F45 N48 M49 P73 I74 S75 F79 L80 L81 | F45-L77 HydrophobicContact CD2-CD2 3.76Å; F45-L77 HydrophobicContact CE2-CD2 4.1Å; F45-L77 HydrophobicContact CG-CD2 4.47Å; N48-L77 HydrophobicContact CB-CD2 4.2Å; N48-L77 HydrophobicContact CB-CG 4.11Å; M49-L77 HydrophobicContact CE-CD1 3.57Å; M49-L77 HydrophobicContact CE-CD2 3.81Å; M49-L77 HydrophobicContact CE-CG 4.33Å; M49-L77 HydrophobicContact CG-CD2 4.32Å; M49-L77 HydrophobicContact SD-CD1 3.86Å; P73-L77 VanDerWaalsContact O-CB 3.3Å; P73-L77 WeakPolarHBondContact O-CB 3.31Å; P73-L77 WeakPolarHBondContact O-CD1 3.33Å; P73-L77 WeakPolarHBondContact O-CG 3.06Å; P73-L77 PolarHBondContact O-N 2.89Å; I74-L77 PolarHBondContact O-N 2.82Å; S75-L77 VanDerWaalsContact C-N 3.29Å; S75-L77 PolarHBondContact O-N 2.64Å; L77-F79 VanDerWaalsContact C-N 3.26Å; L77-F79 PolarHBondContact O-N 3.45Å; L77-L80 HydrophobicContact CD2-CD1 4.3Å; L77-L80 PolarHBondContact O-N 3.37Å; L77-L81 WeakPolarHBondContact O-CG 3.27Å; L77-L81 PolarHBondContact O-N 3.45Å |
| 78 | F | 94.4 | Very high | 87.2 | Confident | 64 Ų | 64 | 26.2 Ų | 26.2 | 28% | 0.281 | 14% | 0.138 | S | C | . | . | H | α-helix | trans | -57.6 | -43 | 172.5 | -78.7 | -57.5 | 0 | 0 | 0 | 111.5 | I74 S75 L81 F107 W153 | I74-F78 HydrophobicContact CG2-CD2 4.19Å; I74-F78 HydrophobicContact CG2-CE2 3.8Å; I74-F78 VanDerWaalsContact O-CD2 3.32Å; I74-F78 WeakPolarHBondContact O-CD2 3.4Å; I74-F78 PolarHBondContact O-N 3.13Å; S75-F78 PolarHBondContact O-N 3.26Å; F78-L81 PolarHBondContact O-N 2.91Å; F78-F107 AromaticContact CD1-CD1 3.91Å; F78-F107 HydrophobicContact CD1-CD1 3.91Å; F78-F107 HydrophobicContact CD1-CE1 4.14Å; F78-F107 HydrophobicContact CD1-CG 4.34Å; F78-F107 HydrophobicContact CE1-CD1 4.36Å; F78-F107 HydrophobicContact CE1-CE1 4.17Å; F78-W153 AromaticContact CD2-CH2 3.58Å; F78-W153 HydrophobicContact CD2-CH2 3.58Å; F78-W153 AromaticContact CD2-CZ3 3.68Å; F78-W153 HydrophobicContact CD2-CZ3 3.68Å; F78-W153 AromaticContact CE2-CH2 3.52Å; F78-W153 HydrophobicContact CE2-CH2 3.52Å; F78-W153 HydrophobicContact CE2-CZ2 4.44Å; F78-W153 AromaticContact CE2-CZ3 3.56Å; F78-W153 HydrophobicContact CE2-CZ3 3.56Å |
| 79 | F | 92.3 | Very high | 85.5 | Confident | 6 Ų | 6 | 30.1 Ų | 30.1 | 3% | 0.026 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -64.8 | -42.8 | 175.9 | -165.9 | -89.9 | 0 | 0 | 0 | 112.2 | S75 D76 L77 L81 T82 Y108 W248 M287 C290 | S75-F79 PolarHBondContact O-N 3.13Å; S75-F79 VanDerWaalsContact O-N 3.14Å; D76-F79 WeakPolarHBondContact O-CB 3.39Å; D76-F79 PolarHBondContact O-N 3.26Å; L77-F79 VanDerWaalsContact C-N 3.26Å; L77-F79 PolarHBondContact O-N 3.45Å; F79-L81 VanDerWaalsContact C-N 3.29Å; F79-L81 PolarHBondContact O-N 3.01Å; F79-T82 PolarHBondContact O-N 3.37Å; F79-T82 VanDerWaalsContact O-N 3.1Å; F79-T82 PolarHBondContact O-OG1 3.15Å; F79-Y108 HydrophobicContact CD2-CD2 4.05Å; F79-Y108 HydrophobicContact CD2-CE2 4.4Å; F79-Y108 AromaticContact CE2-CD2 3.39Å; F79-Y108 HydrophobicContact CE2-CD2 3.39Å; F79-Y108 AromaticContact CE2-CE2 3.34Å; F79-Y108 HydrophobicContact CE2-CE2 3.34Å; F79-Y108 HydrophobicContact CE2-CG 4.16Å; F79-Y108 AromaticContact CZ-CD2 3.88Å; F79-Y108 HydrophobicContact CZ-CD2 3.88Å; F79-Y108 AromaticContact CZ-CE2 3.55Å; F79-Y108 HydrophobicContact CZ-CE2 3.55Å; F79-W248 AromaticContact CE2-CH2 3.95Å; F79-W248 HydrophobicContact CE2-CH2 3.95Å; F79-W248 HydrophobicContact CE2-CZ2 4.12Å; F79-W248 AromaticContact CZ-CH2 3.8Å; F79-W248 HydrophobicContact CZ-CH2 3.8Å; F79-W248 AromaticContact CZ-CZ2 3.92Å; F79-W248 HydrophobicContact CZ-CZ2 3.92Å; F79-M287 HydrophobicContact CE1-CB 4Å; F79-M287 HydrophobicContact CE1-CG 3.89Å; F79-M287 HydrophobicContact CZ-CB 4.3Å; F79-M287 HydrophobicContact CZ-CG 3.78Å; F79-C290 HydrophobicContact CD1-CB 3.99Å |
| 80 | L | 93.3 | Very high | 83.7 | Confident | 0 Ų | 0 | 31.2 Ų | 31.2 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -63.6 | -31.9 | 178.7 | -78.9 | 160.6 | 0 | 0 | 0 | 113 | V40 F41 G44 D76 L77 T82 V83 P84 C290 | V40-L80 HydrophobicContact CG1-CD2 4.32Å; F41-L80 WeakPolarHBondContact CD2-O 3.41Å; G44-L80 WeakPolarHBondContact O-CD1 3.31Å; D76-L80 WeakPolarHBondContact O-CB 3.46Å; D76-L80 WeakPolarHBondContact O-CD1 3.43Å; D76-L80 WeakPolarHBondContact O-CG 3.26Å; D76-L80 PolarHBondContact O-N 3.46Å; L77-L80 HydrophobicContact CD2-CD1 4.3Å; L77-L80 PolarHBondContact O-N 3.37Å; L80-T82 PolarHBondContact O-N 2.89Å; L80-V83 PolarHBondContact O-N 2.94Å; L80-P84 VanDerWaalsContact O-CD 3.23Å; L80-P84 WeakPolarHBondContact O-CD 3.41Å; L80-C290 WeakPolarHBondContact CD2-SG 3.12Å; L80-C290 HydrophobicContact CG-CB 4.28Å |
| 81 | L | 91.8 | Very high | 81.6 | Confident | 74 Ų | 74 | 33.5 Ų | 33.5 | 39% | 0.387 | 18% | 0.184 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -61.6 | -22.4 | 175.8 | -70.8 | 173 | 0 | 0 | 0 | 112.6 | L77 F78 F79 F85 | L77-L81 WeakPolarHBondContact O-CG 3.27Å; L77-L81 PolarHBondContact O-N 3.45Å; F78-L81 PolarHBondContact O-N 2.91Å; F79-L81 VanDerWaalsContact C-N 3.29Å; F79-L81 PolarHBondContact O-N 3.01Å; L81-F85 VanDerWaalsContact O-CD2 3.31Å; L81-F85 WeakPolarHBondContact O-CD2 3.19Å; L81-F85 WeakPolarHBondContact O-CE2 3.33Å |
| 82 | T | 89.5 | Confident | 79.9 | Confident | 14 Ų | 14 | 35.5 Ų | 35.5 | 9% | 0.086 | 20% | 0.202 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -87.9 | -21.2 | 178.9 | 74.3 | 0 | 0 | 0 | 0 | 113.2 | F79 L80 F85 G86 L104 F107 | F79-T82 PolarHBondContact O-N 3.37Å; F79-T82 VanDerWaalsContact O-N 3.1Å; F79-T82 PolarHBondContact O-OG1 3.15Å; L80-T82 PolarHBondContact O-N 2.89Å; T82-F85 PolarHBondContact O-N 2.7Å; T82-G86 PolarHBondContact O-N 3.36Å; T82-G86 VanDerWaalsContact O-N 3.1Å; T82-L104 HydrophobicContact CG2-CB 4.45Å; T82-L104 HydrophobicContact CG2-CD2 4.23Å; T82-L104 VanDerWaalsContact CG2-O 3.23Å; T82-L104 WeakPolarHBondContact CG2-O 3.28Å; T82-F107 HydrophobicContact CG2-CB 3.59Å |
| 83 | V | 86.1 | Confident | 78.8 | Confident | 2 Ų | 2 | 39 Ų | 39 | 1% | 0.012 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -60.4 | -45.7 | -174.4 | 175.9 | 0 | 0 | 0 | 0 | 113.1 | Y37 F41 L80 F85 G86 V87 | Y37-V83 HydrophobicContact CD2-CG1 4.42Å; Y37-V83 HydrophobicContact CG-CG1 4Å; Y37-V83 WeakPolarHBondContact O-CG1 3.18Å; F41-V83 HydrophobicContact CB-CG1 4.34Å; L80-V83 PolarHBondContact O-N 2.94Å; V83-F85 VanDerWaalsContact C-N 3.25Å; V83-F85 PolarHBondContact O-N 3.23Å; V83-G86 WeakPolarHBondContact O-CA 3.33Å; V83-G86 PolarHBondContact O-N 3.46Å; V83-G86 VanDerWaalsContact O-N 3.08Å; V83-V87 PolarHBondContact O-N 3.48Å; V83-V87 VanDerWaalsContact O-N 3.11Å |
| 84 | P | 81.7 | Confident | 78 | Confident | 41 Ų | 41 | 39.9 Ų | 39.9 | 27% | 0.266 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -59.6 | -34.8 | 178.2 | -25 | 34.8 | 0 | 0 | 0 | 113.4 | F41 L80 V87 H88 | F41-P84 HydrophobicContact CD1-CG 4.42Å; F41-P84 HydrophobicContact CD2-CG 3.56Å; F41-P84 HydrophobicContact CE1-CG 4.48Å; F41-P84 HydrophobicContact CE2-CG 3.62Å; F41-P84 HydrophobicContact CG-CG 3.98Å; F41-P84 HydrophobicContact CZ-CG 4.09Å; L80-P84 VanDerWaalsContact O-CD 3.23Å; L80-P84 WeakPolarHBondContact O-CD 3.41Å; P84-V87 WeakPolarHBondContact O-CB 3.12Å; P84-V87 PolarHBondContact O-N 3.03Å; P84-H88 PolarHBondContact O-CD2 3.49Å; P84-H88 VanDerWaalsContact O-CD2 3.28Å; P84-H88 PolarHBondContact O-N 3.26Å |
| 85 | F | 76.8 | Confident | 77.2 | Confident | 51 Ų | 51 | 43.1 Ų | 43.1 | 22% | 0.224 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -74.5 | -32.4 | 177.9 | -60.5 | -89.8 | 0 | 0 | 0 | 111.6 | L81 T82 V83 V87 H88 Y89 F96 M100 L104 | L81-F85 VanDerWaalsContact O-CD2 3.31Å; L81-F85 WeakPolarHBondContact O-CD2 3.19Å; L81-F85 WeakPolarHBondContact O-CE2 3.33Å; T82-F85 PolarHBondContact O-N 2.7Å; V83-F85 VanDerWaalsContact C-N 3.25Å; V83-F85 PolarHBondContact O-N 3.23Å; F85-V87 PolarHBondContact O-N 3.06Å; F85-H88 PolarHBondContact O-N 3.25Å; F85-Y89 PolarHBondContact O-N 2.96Å; F85-F96 HydrophobicContact CD1-CD2 4.08Å; F85-F96 HydrophobicContact CD1-CE1 4.15Å; F85-F96 AromaticContact CD1-CE2 3.56Å; F85-F96 HydrophobicContact CD1-CE2 3.56Å; F85-F96 AromaticContact CD1-CZ 3.6Å; F85-F96 HydrophobicContact CD1-CZ 3.6Å; F85-F96 HydrophobicContact CE1-CD1 4.34Å; F85-F96 AromaticContact CE1-CE1 3.75Å; F85-F96 HydrophobicContact CE1-CE1 3.75Å; F85-F96 HydrophobicContact CE1-CE2 4.02Å; F85-F96 AromaticContact CE1-CZ 3.57Å; F85-F96 HydrophobicContact CE1-CZ 3.57Å; F85-M100 HydrophobicContact CE1-CE 4.26Å; F85-M100 HydrophobicContact CZ-CE 4.34Å; F85-L104 HydrophobicContact CB-CD1 3.6Å; F85-L104 HydrophobicContact CD1-CD1 3.63Å; F85-L104 HydrophobicContact CD2-CD1 3.82Å; F85-L104 HydrophobicContact CD2-CD2 3.58Å; F85-L104 HydrophobicContact CD2-CG 4.38Å; F85-L104 HydrophobicContact CE1-CD1 4.23Å; F85-L104 HydrophobicContact CE2-CD1 4.4Å; F85-L104 HydrophobicContact CE2-CD2 3.84Å; F85-L104 HydrophobicContact CG-CD1 3.39Å; F85-L104 HydrophobicContact CG-CD2 4.07Å; F85-L104 HydrophobicContact CG-CG 4.4Å |
| 86 | G | 67.4 | Low | 76.4 | Confident | 25 Ų | 25 | 46.8 Ų | 46.8 | 26% | 0.258 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -66.4 | -20.2 | 169.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | T82 V83 P90 | T82-G86 PolarHBondContact O-N 3.36Å; T82-G86 VanDerWaalsContact O-N 3.1Å; V83-G86 WeakPolarHBondContact O-CA 3.33Å; V83-G86 PolarHBondContact O-N 3.46Å; V83-G86 VanDerWaalsContact O-N 3.08Å; G86-P90 WeakPolarHBondContact O-CD 3.47Å |
| 87 | V | 58.4 | Low | 75.8 | Confident | 18 Ų | 18 | 53.5 Ų | 53.5 | 11% | 0.109 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -76.1 | -38.4 | 173.5 | 170.7 | 0 | 0 | 0 | 0 | 112.5 | P34 Y37 V83 P84 F85 P90 | P34-V87 HydrophobicContact CB-CG1 3.61Å; P34-V87 HydrophobicContact CG-CG1 4.2Å; Y37-V87 HydrophobicContact CD2-CG2 3.73Å; Y37-V87 HydrophobicContact CG-CG2 3.96Å; V83-V87 PolarHBondContact O-N 3.48Å; V83-V87 VanDerWaalsContact O-N 3.11Å; P84-V87 WeakPolarHBondContact O-CB 3.12Å; P84-V87 PolarHBondContact O-N 3.03Å; F85-V87 PolarHBondContact O-N 3.06Å; V87-P90 WeakPolarHBondContact O-CD 3.42Å |
| 88 | H | 54.4 | Low | 75.4 | Confident | 115 Ų | 115 | 55 Ų | 55 | 53% | 0.532 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -74.6 | -29.4 | -178 | -77.6 | -71.2 | 0 | 0 | 0 | 112.5 | P84 F85 A91 A92 | P84-H88 PolarHBondContact O-CD2 3.49Å; P84-H88 VanDerWaalsContact O-CD2 3.28Å; P84-H88 PolarHBondContact O-N 3.26Å; F85-H88 PolarHBondContact O-N 3.25Å; H88-A91 PolarHBondContact O-N 2.95Å; H88-A92 PolarHBondContact O-N 3.45Å |
| 89 | Y | 56.8 | Low | 75.2 | Confident | 87 Ų | 87 | 56.6 Ų | 56.6 | 34% | 0.341 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -64.8 | -39.9 | -174.5 | -178.6 | -114.4 | 0 | 0 | 0 | 115.8 | F85 A92 W94 T177 | F85-Y89 PolarHBondContact O-N 2.96Å; Y89-A92 VanDerWaalsContact O-O 3.11Å; Y89-W94 HydrophobicContact CD2-CB 4.34Å; Y89-W94 HydrophobicContact CD2-CE3 4.02Å; Y89-W94 HydrophobicContact CE2-CB 4.39Å; Y89-T177 HydrophobicContact CE2-CG2 4.36Å; Y89-T177 WeakPolarHBondContact OH-CB 3.28Å; Y89-T177 WeakPolarHBondContact OH-CG2 3.31Å |
| 90 | P | 53.8 | Low | 75 | Confident | 44 Ų | 44 | 59.4 Ų | 59.4 | 29% | 0.286 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -79.9 | -22.6 | 177.1 | -14.5 | 30.2 | 0 | 0 | 0 | 113.8 | L33 G86 V87 | L33-P90 HydrophobicContact CD1-CG 4.19Å; G86-P90 WeakPolarHBondContact O-CD 3.47Å; V87-P90 WeakPolarHBondContact O-CD 3.42Å |
| 91 | A | 49.5 | Very low | 74.8 | Confident | 67 Ų | 67 | 59.4 Ų | 59.4 | 55% | 0.554 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -91.5 | -18.8 | -176.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | H88 | H88-A91 PolarHBondContact O-N 2.95Å |
| 92 | A | 61 | Low | 74.8 | Confident | 58 Ų | 58 | 58.4 Ų | 58.4 | 48% | 0.479 | 32% | 0.318 | S | S | . | . | S | Bend | trans | -144.6 | -150.4 | -178.2 | 0 | 0 | 0 | 0 | 0 | 110.8 | H88 Y89 | H88-A92 PolarHBondContact O-N 3.45Å; Y89-A92 VanDerWaalsContact O-O 3.11Å |
| 93 | Q | 70.4 | Confident | 75 | Confident | 74 Ų | 74 | 61.7 Ų | 61.7 | 35% | 0.346 | 33% | 0.334 | S | S | . | . | trans | -106.6 | 168.4 | 172.7 | 67.1 | -169.9 | -8.9 | 0 | 0 | 110.1 | D95 H175 | Q93-D95 WeakPolarHBondContact CG-OD1 3.38Å; Q93-D95 PolarHBondContact NE2-OD1 2.99Å; Q93-D95 PolarHBondContact O-N 3.2Å; Q93-H175 HydrophobicContact CB-CB 4.17Å | ||
| 94 | W | 77.5 | Confident | 75.2 | Confident | 20 Ų | 20 | 62.3 Ų | 62.3 | 8% | 0.076 | 34% | 0.337 | C | S | . | . | trans | -72.8 | 92.8 | 170.8 | -173.2 | -92.1 | 0 | 0 | 0 | 110.5 | Y89 F96 C101 L104 Y176 C178 | Y89-W94 HydrophobicContact CD2-CB 4.34Å; Y89-W94 HydrophobicContact CD2-CE3 4.02Å; Y89-W94 HydrophobicContact CE2-CB 4.39Å; W94-F96 VanDerWaalsContact C-N 3.32Å; W94-F96 HydrophobicContact CZ2-CB 3.86Å; W94-F96 HydrophobicContact CZ2-CD2 4.34Å; W94-F96 HydrophobicContact CZ2-CG 4.49Å; W94-F96 PolarHBondContact NE1-O 3.12Å; W94-C101 HydrophobicContact CH2-CB 4.39Å; W94-C101 HydrophobicContact CZ2-CB 3.54Å; W94-L104 HydrophobicContact CH2-CD1 3.71Å; W94-L104 HydrophobicContact CZ2-CD1 4.33Å; W94-Y176 WeakPolarHBondContact CB-O 3.5Å; W94-Y176 PolarHBondContact N-O 3.48Å; W94-Y176 VanDerWaalsContact O-CB 3.29Å; W94-Y176 WeakPolarHBondContact O-CB 3.21Å; W94-C178 HydrophobicContact CD2-CB 3.5Å; W94-C178 HydrophobicContact CE3-CB 3.64Å; W94-C178 HydrophobicContact CG-CB 3.98Å; W94-C178 HydrophobicContact CH2-CB 4.26Å; W94-C178 HydrophobicContact CZ2-CB 4.2Å; W94-C178 HydrophobicContact CZ3-CB 4.01Å | ||
| 95 | D | 78.5 | Confident | 75.7 | Confident | 113 Ų | 113 | 61.2 Ų | 61.2 | 60% | 0.604 | 33% | 0.33 | S | S | * | . | trans | -81.1 | -9.2 | -178.9 | -65.1 | -48.5 | 0 | 0 | 0 | 113.7 | Q93 | Q93-D95 WeakPolarHBondContact CG-OD1 3.38Å; Q93-D95 PolarHBondContact NE2-OD1 2.99Å; Q93-D95 PolarHBondContact O-N 3.2Å | ||
| 96 | F | 79.6 | Confident | 76.6 | Confident | 77 Ų | 77 | 59 Ų | 59 | 34% | 0.338 | 32% | 0.322 | S | S | . | . | S | Bend | trans | -87.4 | 156.2 | -178.9 | -58.1 | -82.4 | 0 | 0 | 0 | 112.1 | F85 W94 M100 | F85-F96 HydrophobicContact CD1-CD2 4.08Å; F85-F96 HydrophobicContact CD1-CE1 4.15Å; F85-F96 AromaticContact CD1-CE2 3.56Å; F85-F96 HydrophobicContact CD1-CE2 3.56Å; F85-F96 AromaticContact CD1-CZ 3.6Å; F85-F96 HydrophobicContact CD1-CZ 3.6Å; F85-F96 HydrophobicContact CE1-CD1 4.34Å; F85-F96 AromaticContact CE1-CE1 3.75Å; F85-F96 HydrophobicContact CE1-CE1 3.75Å; F85-F96 HydrophobicContact CE1-CE2 4.02Å; F85-F96 AromaticContact CE1-CZ 3.57Å; F85-F96 HydrophobicContact CE1-CZ 3.57Å; W94-F96 VanDerWaalsContact C-N 3.32Å; W94-F96 HydrophobicContact CZ2-CB 3.86Å; W94-F96 HydrophobicContact CZ2-CD2 4.34Å; W94-F96 HydrophobicContact CZ2-CG 4.49Å; W94-F96 PolarHBondContact NE1-O 3.12Å; F96-M100 HydrophobicContact CB-CB 3.9Å; F96-M100 HydrophobicContact CB-CG 3.99Å; F96-M100 HydrophobicContact CD1-CG 4.25Å; F96-M100 HydrophobicContact CG-CG 4.19Å |
| 97 | E | 84.3 | Confident | 77.9 | Confident | 151 Ų | 151 | 60.3 Ų | 60.3 | 71% | 0.706 | 32% | 0.32 | S | S | * | . | trans | -68.1 | 164.5 | 175.8 | -67.1 | -175.1 | 173.6 | 0 | 0 | 112.9 | T99 M100 C101 | E97-T99 PolarHBondContact O-N 3.29Å; E97-M100 PolarHBondContact O-N 3.13Å; E97-M100 VanDerWaalsContact O-N 3.09Å; E97-C101 PolarHBondContact O-N 3.22Å | ||
| 98 | N | 86.6 | Confident | 79.6 | Confident | 54 Ų | 54 | 60.8 Ų | 60.8 | 29% | 0.289 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -54.6 | -36.7 | 176.2 | -179 | 71.6 | 0 | 0 | 0 | 113 | M100 C101 Q102 R168 S169 | N98-M100 VanDerWaalsContact C-N 3.3Å; N98-M100 PolarHBondContact O-N 3.03Å; N98-C101 WeakPolarHBondContact O-CB 3.28Å; N98-C101 PolarHBondContact O-N 3.48Å; N98-Q102 PolarHBondContact O-N 3.4Å; N98-R168 VanDerWaalsContact OD1-CA 3.27Å; N98-R168 WeakPolarHBondContact OD1-CA 3.39Å; N98-S169 PolarHBondContact OD1-N 2.78Å |
| 99 | T | 88.6 | Confident | 81.5 | Confident | 98 Ų | 98 | 56.3 Ų | 56.3 | 60% | 0.601 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -59.2 | -42.1 | 178.2 | -48.6 | 0 | 0 | 0 | 0 | 111.7 | E97 Q102 L103 | E97-T99 PolarHBondContact O-N 3.29Å; T99-Q102 PolarHBondContact O-N 2.88Å; T99-L103 WeakPolarHBondContact O-CB 3.37Å; T99-L103 PolarHBondContact O-N 3.04Å |
| 100 | M | 88.9 | Confident | 83.4 | Confident | 64 Ų | 64 | 53.2 Ų | 53.2 | 32% | 0.315 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -69.9 | -37.8 | 178.3 | -170.9 | 62.7 | 104.4 | 0 | 0 | 111.2 | F85 F96 E97 N98 Q102 L103 L104 | F85-M100 HydrophobicContact CE1-CE 4.26Å; F85-M100 HydrophobicContact CZ-CE 4.34Å; F96-M100 HydrophobicContact CB-CB 3.9Å; F96-M100 HydrophobicContact CB-CG 3.99Å; F96-M100 HydrophobicContact CD1-CG 4.25Å; F96-M100 HydrophobicContact CG-CG 4.19Å; E97-M100 PolarHBondContact O-N 3.13Å; E97-M100 VanDerWaalsContact O-N 3.09Å; N98-M100 VanDerWaalsContact C-N 3.3Å; N98-M100 PolarHBondContact O-N 3.03Å; M100-Q102 PolarHBondContact O-N 3.21Å; M100-L103 PolarHBondContact O-N 3.19Å; M100-L103 HydrophobicContact SD-CD2 4.31Å; M100-L104 HydrophobicContact CG-CD1 3.68Å; M100-L104 HydrophobicContact CG-CG 4.19Å; M100-L104 WeakPolarHBondContact O-CB 3.43Å; M100-L104 VanDerWaalsContact O-CG 3.25Å; M100-L104 WeakPolarHBondContact O-CG 3.39Å; M100-L104 PolarHBondContact O-N 3.34Å; M100-L104 HydrophobicContact SD-CD1 4.12Å; M100-L104 HydrophobicContact SD-CG 4.09Å |
| 101 | C | 89.2 | Confident | 85.4 | Confident | 0 Ų | 0 | 51.3 Ų | 51.3 | 0% | 0 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -58.5 | -46.8 | 174.8 | 169.5 | 0 | 0 | 0 | 0 | 111.4 | W94 E97 N98 T105 T167 C178 | W94-C101 HydrophobicContact CH2-CB 4.39Å; W94-C101 HydrophobicContact CZ2-CB 3.54Å; E97-C101 PolarHBondContact O-N 3.22Å; N98-C101 WeakPolarHBondContact O-CB 3.28Å; N98-C101 PolarHBondContact O-N 3.48Å; C101-T105 VanDerWaalsContact O-CB 3.27Å; C101-T105 WeakPolarHBondContact O-CB 3.42Å; C101-T105 PolarHBondContact O-N 3.19Å; C101-T105 PolarHBondContact O-OG1 2.99Å; C101-T167 VanDerWaalsContact SG-CG2 3.57Å; C101-C178 VanDerWaalsContact CA-SG 3.58Å; C101-C178 HydrophobicContact CB-CB 3.9Å; C101-C178 WeakPolarHBondContact CB-SG 3.39Å; C101-C178 WeakPolarHBondContact SG-CB 3.31Å; C101-C178 CovalentContact SG-SG 2.02Å; C101-C178 PolarHBondContact SG-SG 3.39Å |
| 102 | Q | 91.9 | Very high | 87.6 | Confident | 53 Ų | 53 | 48.6 Ų | 48.6 | 25% | 0.248 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -66.5 | -42.6 | 177 | -70.6 | -178.1 | -28.7 | 0 | 0 | 112.5 | N98 T99 M100 T105 G106 I164 T167 | N98-Q102 PolarHBondContact O-N 3.4Å; T99-Q102 PolarHBondContact O-N 2.88Å; M100-Q102 PolarHBondContact O-N 3.21Å; Q102-T105 PolarHBondContact O-N 3.49Å; Q102-G106 PolarHBondContact O-N 3.4Å; Q102-I164 HydrophobicContact CB-CG2 4.14Å; Q102-T167 WeakPolarHBondContact CG-O 3.4Å; Q102-T167 PolarHBondContact NE2-O 2.97Å |
| 103 | L | 92.6 | Very high | 89.3 | Confident | 84 Ų | 84 | 45.8 Ų | 45.8 | 44% | 0.44 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -63 | -48.3 | 179.1 | -176.5 | 66.6 | 0 | 0 | 0 | 111.9 | T99 M100 G106 F107 | T99-L103 WeakPolarHBondContact O-CB 3.37Å; T99-L103 PolarHBondContact O-N 3.04Å; M100-L103 PolarHBondContact O-N 3.19Å; M100-L103 HydrophobicContact SD-CD2 4.31Å; L103-G106 CarbonylContact O-C 3.59Å; L103-G106 WeakPolarHBondContact O-CA 3.35Å; L103-G106 PolarHBondContact O-N 2.91Å; L103-G106 VanDerWaalsContact O-N 3.09Å; L103-F107 HydrophobicContact CD1-CE1 4.08Å; L103-F107 HydrophobicContact CD1-CE2 4.25Å; L103-F107 HydrophobicContact CD1-CZ 3.82Å; L103-F107 HydrophobicContact CD2-CE2 4.25Å; L103-F107 HydrophobicContact CD2-CZ 4.43Å; L103-F107 HydrophobicContact CG-CD2 4.45Å; L103-F107 HydrophobicContact CG-CE2 3.98Å; L103-F107 HydrophobicContact CG-CZ 4.07Å; L103-F107 PolarHBondContact O-N 3.45Å |
| 104 | L | 92 | Very high | 90.6 | Very high | 14 Ų | 14 | 42.3 Ų | 42.3 | 7% | 0.073 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -66.7 | -39 | 179.5 | -68.3 | 169.7 | 0 | 0 | 0 | 111.5 | T82 F85 W94 M100 G106 F107 Y108 | T82-L104 HydrophobicContact CG2-CB 4.45Å; T82-L104 HydrophobicContact CG2-CD2 4.23Å; T82-L104 VanDerWaalsContact CG2-O 3.23Å; T82-L104 WeakPolarHBondContact CG2-O 3.28Å; F85-L104 HydrophobicContact CB-CD1 3.6Å; F85-L104 HydrophobicContact CD1-CD1 3.63Å; F85-L104 HydrophobicContact CD2-CD1 3.82Å; F85-L104 HydrophobicContact CD2-CD2 3.58Å; F85-L104 HydrophobicContact CD2-CG 4.38Å; F85-L104 HydrophobicContact CE1-CD1 4.23Å; F85-L104 HydrophobicContact CE2-CD1 4.4Å; F85-L104 HydrophobicContact CE2-CD2 3.84Å; F85-L104 HydrophobicContact CG-CD1 3.39Å; F85-L104 HydrophobicContact CG-CD2 4.07Å; F85-L104 HydrophobicContact CG-CG 4.4Å; W94-L104 HydrophobicContact CH2-CD1 3.71Å; W94-L104 HydrophobicContact CZ2-CD1 4.33Å; M100-L104 HydrophobicContact CG-CD1 3.68Å; M100-L104 HydrophobicContact CG-CG 4.19Å; M100-L104 WeakPolarHBondContact O-CB 3.43Å; M100-L104 VanDerWaalsContact O-CG 3.25Å; M100-L104 WeakPolarHBondContact O-CG 3.39Å; M100-L104 PolarHBondContact O-N 3.34Å; M100-L104 HydrophobicContact SD-CD1 4.12Å; M100-L104 HydrophobicContact SD-CG 4.09Å; L104-G106 PolarHBondContact O-N 3.11Å; L104-F107 PolarHBondContact O-N 2.84Å; L104-Y108 WeakPolarHBondContact O-CB 3.5Å; L104-Y108 PolarHBondContact O-N 3.15Å |
| 105 | T | 91.8 | Very high | 91.4 | Very high | 19 Ų | 19 | 41.7 Ų | 41.7 | 12% | 0.117 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -58.4 | -40.8 | 170.4 | -61.6 | 0 | 0 | 0 | 0 | 111.1 | C101 Q102 Y108 F109 T167 | C101-T105 VanDerWaalsContact O-CB 3.27Å; C101-T105 WeakPolarHBondContact O-CB 3.42Å; C101-T105 PolarHBondContact O-N 3.19Å; C101-T105 PolarHBondContact O-OG1 2.99Å; Q102-T105 PolarHBondContact O-N 3.49Å; T105-Y108 PolarHBondContact O-N 3.04Å; T105-F109 HydrophobicContact CG2-CD2 3.69Å; T105-F109 HydrophobicContact CG2-CE2 3.62Å; T105-F109 VanDerWaalsContact O-CD2 3.28Å; T105-F109 WeakPolarHBondContact O-CD2 3.18Å; T105-F109 PolarHBondContact O-N 3.42Å; T105-T167 HydrophobicContact CG2-CG2 4.35Å; T105-T167 WeakPolarHBondContact OG1-CG2 3.25Å |
| 106 | G | 94.7 | Very high | 92.3 | Very high | 4 Ų | 4 | 36.3 Ų | 36.3 | 4% | 0.041 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -60.8 | -52 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q102 L103 L104 Y108 F109 I110 | Q102-G106 PolarHBondContact O-N 3.4Å; L103-G106 CarbonylContact O-C 3.59Å; L103-G106 WeakPolarHBondContact O-CA 3.35Å; L103-G106 PolarHBondContact O-N 2.91Å; L103-G106 VanDerWaalsContact O-N 3.09Å; L104-G106 PolarHBondContact O-N 3.11Å; G106-Y108 VanDerWaalsContact C-N 3.29Å; G106-Y108 PolarHBondContact O-N 2.78Å; G106-F109 PolarHBondContact O-N 2.91Å; G106-I110 WeakPolarHBondContact O-CB 3.32Å; G106-I110 WeakPolarHBondContact O-CD1 3.41Å; G106-I110 WeakPolarHBondContact O-CG1 3.25Å; G106-I110 PolarHBondContact O-N 3.21Å |
| 107 | F | 95.6 | Very high | 93.1 | Very high | 53 Ų | 53 | 33.7 Ų | 33.7 | 23% | 0.232 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -60.4 | -37.6 | 177.6 | -69.7 | -18.8 | 0 | 0 | 0 | 113 | F78 T82 L103 L104 G111 | F78-F107 AromaticContact CD1-CD1 3.91Å; F78-F107 HydrophobicContact CD1-CD1 3.91Å; F78-F107 HydrophobicContact CD1-CE1 4.14Å; F78-F107 HydrophobicContact CD1-CG 4.34Å; F78-F107 HydrophobicContact CE1-CD1 4.36Å; F78-F107 HydrophobicContact CE1-CE1 4.17Å; T82-F107 HydrophobicContact CG2-CB 3.59Å; L103-F107 HydrophobicContact CD1-CE1 4.08Å; L103-F107 HydrophobicContact CD1-CE2 4.25Å; L103-F107 HydrophobicContact CD1-CZ 3.82Å; L103-F107 HydrophobicContact CD2-CE2 4.25Å; L103-F107 HydrophobicContact CD2-CZ 4.43Å; L103-F107 HydrophobicContact CG-CD2 4.45Å; L103-F107 HydrophobicContact CG-CE2 3.98Å; L103-F107 HydrophobicContact CG-CZ 4.07Å; L103-F107 PolarHBondContact O-N 3.45Å; L104-F107 PolarHBondContact O-N 2.84Å; F107-G111 PolarHBondContact O-N 2.89Å |
| 108 | Y | 93.5 | Very high | 93.7 | Very high | 27 Ų | 27 | 26.5 Ų | 26.5 | 11% | 0.106 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -60.4 | -54.8 | 175.5 | 176.1 | -89.5 | 0 | 0 | 0 | 111.1 | F79 L104 T105 G106 F112 E283 M287 | F79-Y108 HydrophobicContact CD2-CD2 4.05Å; F79-Y108 HydrophobicContact CD2-CE2 4.4Å; F79-Y108 AromaticContact CE2-CD2 3.39Å; F79-Y108 HydrophobicContact CE2-CD2 3.39Å; F79-Y108 AromaticContact CE2-CE2 3.34Å; F79-Y108 HydrophobicContact CE2-CE2 3.34Å; F79-Y108 HydrophobicContact CE2-CG 4.16Å; F79-Y108 AromaticContact CZ-CD2 3.88Å; F79-Y108 HydrophobicContact CZ-CD2 3.88Å; F79-Y108 AromaticContact CZ-CE2 3.55Å; F79-Y108 HydrophobicContact CZ-CE2 3.55Å; L104-Y108 WeakPolarHBondContact O-CB 3.5Å; L104-Y108 PolarHBondContact O-N 3.15Å; T105-Y108 PolarHBondContact O-N 3.04Å; G106-Y108 VanDerWaalsContact C-N 3.29Å; G106-Y108 PolarHBondContact O-N 2.78Å; Y108-F112 VanDerWaalsContact O-CB 3.31Å; Y108-F112 WeakPolarHBondContact O-CB 3.49Å; Y108-F112 PolarHBondContact O-N 3.27Å; Y108-E283 PolarHBondContact OH-OE1 3.18Å; Y108-M287 HydrophobicContact CE2-CE 3.85Å |
| 109 | F | 94.9 | Very high | 94.1 | Very high | 21 Ų | 21 | 24 Ų | 24 | 9% | 0.092 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -70.4 | -39.2 | -178.3 | -77.2 | -61.3 | 0 | 0 | 0 | 112.8 | T105 G106 F112 F113 S160 I198 | T105-F109 HydrophobicContact CG2-CD2 3.69Å; T105-F109 HydrophobicContact CG2-CE2 3.62Å; T105-F109 VanDerWaalsContact O-CD2 3.28Å; T105-F109 WeakPolarHBondContact O-CD2 3.18Å; T105-F109 PolarHBondContact O-N 3.42Å; G106-F109 PolarHBondContact O-N 2.91Å; F109-F112 PolarHBondContact O-N 2.66Å; F109-F113 HydrophobicContact CB-CD2 4.2Å; F109-F113 HydrophobicContact CB-CE2 4.12Å; F109-F113 AromaticContact CD1-CE2 3.84Å; F109-F113 HydrophobicContact CD1-CE2 3.84Å; F109-F113 HydrophobicContact CD1-CZ 4.45Å; F109-F113 HydrophobicContact CG-CE2 4.34Å; F109-F113 WeakPolarHBondContact O-CB 3.2Å; F109-F113 WeakPolarHBondContact O-CD2 3.27Å; F109-F113 PolarHBondContact O-N 3.4Å; F109-S160 WeakPolarHBondContact CB-OG 3.28Å; F109-S160 PolarHBondContact O-OG 2.79Å; F109-I198 HydrophobicContact CE1-CD1 4.01Å |
| 110 | I | 96.7 | Very high | 94.5 | Very high | 23 Ų | 23 | 20 Ų | 20 | 12% | 0.118 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -60.1 | -50.8 | 177 | -72.2 | 167.3 | 0 | 0 | 0 | 108.9 | G106 F112 F113 S114 W153 V157 S160 | G106-I110 WeakPolarHBondContact O-CB 3.32Å; G106-I110 WeakPolarHBondContact O-CD1 3.41Å; G106-I110 WeakPolarHBondContact O-CG1 3.25Å; G106-I110 PolarHBondContact O-N 3.21Å; I110-F112 PolarHBondContact O-N 2.79Å; I110-F113 PolarHBondContact O-N 2.95Å; I110-S114 VanDerWaalsContact O-CB 3.22Å; I110-S114 WeakPolarHBondContact O-CB 3.36Å; I110-S114 PolarHBondContact O-N 3.31Å; I110-S114 PolarHBondContact O-OG 2.97Å; I110-W153 HydrophobicContact CG2-CE3 4.12Å; I110-W153 HydrophobicContact CG2-CZ3 3.69Å; I110-V157 HydrophobicContact CD1-CG2 3.99Å; I110-V157 HydrophobicContact CG1-CG2 4.21Å; I110-S160 WeakPolarHBondContact CA-OG 3.5Å; I110-S160 WeakPolarHBondContact CG1-OG 3.27Å; I110-S160 PolarHBondContact N-OG 2.91Å; I110-S160 VanDerWaalsContact N-OG 3.15Å |
| 111 | G | 95.9 | Very high | 94.8 | Very high | 3 Ų | 3 | 18.5 Ų | 18.5 | 3% | 0.031 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -61 | -41.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | S75 F107 S114 G115 | S75-G111 WeakPolarHBondContact O-CA 3.49Å; F107-G111 PolarHBondContact O-N 2.89Å; G111-S114 PolarHBondContact O-OG 3.25Å; G111-G115 PolarHBondContact O-N 2.92Å |
| 112 | F | 94.9 | Very high | 95 | Very high | 10 Ų | 10 | 18.6 Ų | 18.6 | 4% | 0.044 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -61.7 | -53.6 | 176 | 174.9 | -100.2 | 0 | 0 | 0 | 112.4 | Y108 F109 I110 I116 I198 W248 | Y108-F112 VanDerWaalsContact O-CB 3.31Å; Y108-F112 WeakPolarHBondContact O-CB 3.49Å; Y108-F112 PolarHBondContact O-N 3.27Å; F109-F112 PolarHBondContact O-N 2.66Å; I110-F112 PolarHBondContact O-N 2.79Å; F112-I116 PolarHBondContact O-N 3.49Å; F112-I198 HydrophobicContact CE1-CG2 4.2Å; F112-I198 HydrophobicContact CZ-CG2 4.28Å; F112-W248 HydrophobicContact CD2-CD2 4.14Å; F112-W248 AromaticContact CD2-CE3 3.99Å; F112-W248 HydrophobicContact CD2-CE3 3.99Å; F112-W248 AromaticContact CD2-CH2 3.61Å; F112-W248 HydrophobicContact CD2-CH2 3.61Å; F112-W248 AromaticContact CD2-CZ2 3.79Å; F112-W248 HydrophobicContact CD2-CZ2 3.79Å; F112-W248 AromaticContact CD2-CZ3 3.72Å; F112-W248 HydrophobicContact CD2-CZ3 3.72Å; F112-W248 AromaticContact CE2-CD2 3.68Å; F112-W248 HydrophobicContact CE2-CD2 3.68Å; F112-W248 AromaticContact CE2-CE3 3.45Å; F112-W248 HydrophobicContact CE2-CE3 3.45Å; F112-W248 VanDerWaalsContact CE2-CE3 3.45Å; F112-W248 HydrophobicContact CE2-CG 4.35Å; F112-W248 AromaticContact CE2-CH2 3.98Å; F112-W248 HydrophobicContact CE2-CH2 3.98Å; F112-W248 HydrophobicContact CE2-CZ2 4.2Å; F112-W248 AromaticContact CE2-CZ3 3.61Å; F112-W248 HydrophobicContact CE2-CZ3 3.61Å; F112-W248 HydrophobicContact CZ-CE3 4.49Å |
| 113 | F | 96.8 | Very high | 95 | Very high | 0 Ų | 0 | 16 Ų | 16 | 0% | 0 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -70.1 | -44.3 | -177.4 | -73 | -57.9 | 0 | 0 | 0 | 112.2 | F109 I110 G115 I116 F117 A156 A159 K197 I198 L201 | F109-F113 HydrophobicContact CB-CD2 4.2Å; F109-F113 HydrophobicContact CB-CE2 4.12Å; F109-F113 AromaticContact CD1-CE2 3.84Å; F109-F113 HydrophobicContact CD1-CE2 3.84Å; F109-F113 HydrophobicContact CD1-CZ 4.45Å; F109-F113 HydrophobicContact CG-CE2 4.34Å; F109-F113 WeakPolarHBondContact O-CB 3.2Å; F109-F113 WeakPolarHBondContact O-CD2 3.27Å; F109-F113 PolarHBondContact O-N 3.4Å; I110-F113 PolarHBondContact O-N 2.95Å; F113-G115 VanDerWaalsContact C-N 3.3Å; F113-G115 PolarHBondContact O-N 3.16Å; F113-I116 VanDerWaalsContact O-CG2 3.28Å; F113-I116 WeakPolarHBondContact O-CG2 3.4Å; F113-I116 PolarHBondContact O-N 3.32Å; F113-F117 HydrophobicContact CB-CD2 4.41Å; F113-F117 HydrophobicContact CB-CE2 3.97Å; F113-F117 HydrophobicContact CB-CZ 4.39Å; F113-F117 HydrophobicContact CD1-CZ 4.35Å; F113-F117 WeakPolarHBondContact O-CB 3.41Å; F113-F117 WeakPolarHBondContact O-CD2 3.45Å; F113-F117 WeakPolarHBondContact O-CG 3.35Å; F113-F117 PolarHBondContact O-N 3.43Å; F113-A156 HydrophobicContact CB-CB 4.11Å; F113-A159 HydrophobicContact CD1-CB 4.41Å; F113-A159 HydrophobicContact CD2-CB 3.83Å; F113-A159 HydrophobicContact CE2-CB 4.14Å; F113-A159 HydrophobicContact CG-CB 4.02Å; F113-K197 HydrophobicContact CZ-CD 4.47Å; F113-I198 HydrophobicContact CZ-CG1 4.23Å; F113-L201 HydrophobicContact CD1-CB 4.26Å; F113-L201 HydrophobicContact CD1-CD1 4.33Å; F113-L201 HydrophobicContact CE1-CB 4Å; F113-L201 HydrophobicContact CE1-CD1 4.03Å |
| 114 | S | 97.4 | Very high | 95.1 | Very high | 0 Ų | 0 | 15 Ų | 15 | 0% | 0 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -63.5 | -39.8 | 177.8 | 69.1 | 0 | 0 | 0 | 0 | 110.9 | S75 I110 G111 I116 F117 F118 | S75-S114 WeakPolarHBondContact CB-OG 3.37Å; S75-S114 WeakPolarHBondContact OG-CB 3.48Å; S75-S114 PolarHBondContact OG-OG 3.04Å; I110-S114 VanDerWaalsContact O-CB 3.22Å; I110-S114 WeakPolarHBondContact O-CB 3.36Å; I110-S114 PolarHBondContact O-N 3.31Å; I110-S114 PolarHBondContact O-OG 2.97Å; G111-S114 PolarHBondContact O-OG 3.25Å; S114-I116 PolarHBondContact O-N 3.02Å; S114-F117 PolarHBondContact O-N 3.47Å; S114-F118 WeakPolarHBondContact O-CD2 3.34Å; S114-F118 PolarHBondContact O-N 3.37Å |
| 115 | G | 95.9 | Very high | 95 | Very high | 7 Ų | 7 | 14.5 Ų | 14.5 | 7% | 0.072 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -54.1 | -54.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | L72 G111 F113 F118 I119 | L72-G115 WeakPolarHBondContact CD2-O 3.36Å; G111-G115 PolarHBondContact O-N 2.92Å; F113-G115 VanDerWaalsContact C-N 3.3Å; F113-G115 PolarHBondContact O-N 3.16Å; G115-F118 PolarHBondContact O-N 2.72Å; G115-I119 WeakPolarHBondContact O-CG1 3.47Å; G115-I119 PolarHBondContact O-N 2.92Å; G115-I119 VanDerWaalsContact O-N 3.15Å |
| 116 | I | 96.1 | Very high | 94.9 | Very high | 0 Ų | 0 | 15.3 Ų | 15.3 | 0% | 0 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -68.3 | -37.7 | 179.9 | -170.6 | 50 | 0 | 0 | 0 | 112.8 | F112 F113 S114 F118 I119 I120 P206 Y244 | F112-I116 PolarHBondContact O-N 3.49Å; F113-I116 VanDerWaalsContact O-CG2 3.28Å; F113-I116 WeakPolarHBondContact O-CG2 3.4Å; F113-I116 PolarHBondContact O-N 3.32Å; S114-I116 PolarHBondContact O-N 3.02Å; I116-F118 PolarHBondContact O-N 3.44Å; I116-I119 HydrophobicContact CD1-CB 4.34Å; I116-I119 PolarHBondContact O-N 3.5Å; I116-I120 HydrophobicContact CG1-CD1 4.21Å; I116-I120 WeakPolarHBondContact O-CG1 3.48Å; I116-I120 PolarHBondContact O-N 2.97Å; I116-P206 HydrophobicContact CD1-CB 3.56Å; I116-P206 HydrophobicContact CD1-CG 3.83Å; I116-P206 HydrophobicContact CG1-CB 3.98Å; I116-P206 HydrophobicContact CG1-CG 3.84Å; I116-Y244 HydrophobicContact CB-CE2 4.07Å; I116-Y244 HydrophobicContact CD1-CD1 3.62Å; I116-Y244 HydrophobicContact CD1-CD2 4.22Å; I116-Y244 HydrophobicContact CD1-CE1 3.28Å; I116-Y244 HydrophobicContact CD1-CE2 3.92Å; I116-Y244 HydrophobicContact CD1-CG 4.08Å; I116-Y244 VanDerWaalsContact CD1-CZ 3.45Å; I116-Y244 HydrophobicContact CG1-CE1 3.89Å; I116-Y244 HydrophobicContact CG1-CE2 4.31Å |
| 117 | F | 97.6 | Very high | 94.7 | Very high | 22 Ų | 22 | 17.5 Ų | 17.5 | 10% | 0.096 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -64.3 | -39.1 | 177.1 | -64.3 | -24.7 | 0 | 0 | 0 | 112.3 | F113 S114 I120 L121 T152 V155 A156 L201 L205 | F113-F117 HydrophobicContact CB-CD2 4.41Å; F113-F117 HydrophobicContact CB-CE2 3.97Å; F113-F117 HydrophobicContact CB-CZ 4.39Å; F113-F117 HydrophobicContact CD1-CZ 4.35Å; F113-F117 WeakPolarHBondContact O-CB 3.41Å; F113-F117 WeakPolarHBondContact O-CD2 3.45Å; F113-F117 WeakPolarHBondContact O-CG 3.35Å; F113-F117 PolarHBondContact O-N 3.43Å; S114-F117 PolarHBondContact O-N 3.47Å; F117-I120 HydrophobicContact CD1-CD1 4.32Å; F117-I120 WeakPolarHBondContact O-CB 3.39Å; F117-I120 PolarHBondContact O-N 3.15Å; F117-L121 WeakPolarHBondContact O-CG 3.05Å; F117-L121 PolarHBondContact O-N 2.7Å; F117-T152 HydrophobicContact CB-CG2 3.48Å; F117-T152 VanDerWaalsContact CB-CG2 3.48Å; F117-T152 HydrophobicContact CD2-CG2 4.17Å; F117-T152 HydrophobicContact CG-CG2 4.31Å; F117-V155 HydrophobicContact CD2-CG1 4.48Å; F117-V155 HydrophobicContact CE2-CG1 3.83Å; F117-V155 HydrophobicContact CZ-CG1 4.36Å; F117-A156 HydrophobicContact CD2-CB 4.35Å; F117-A156 HydrophobicContact CE2-CB 4.46Å; F117-L201 HydrophobicContact CE1-CB 4.36Å; F117-L201 HydrophobicContact CE1-CD2 4.47Å; F117-L201 HydrophobicContact CZ-CB 4.5Å; F117-L201 HydrophobicContact CZ-CD1 4.31Å; F117-L201 HydrophobicContact CZ-CD2 4.49Å; F117-L205 HydrophobicContact CE1-CD2 4.39Å |
| 118 | F | 96.7 | Very high | 94.4 | Very high | 0 Ų | 0 | 16.9 Ų | 16.9 | 0% | 0 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -68.3 | -33.3 | 174.4 | -76.3 | -61.1 | 0 | 0 | 0 | 112.8 | Y68 N71 L72 S114 G115 I116 L121 L122 S149 T152 W153 | Y68-F118 HydrophobicContact CD1-CD1 4.1Å; Y68-F118 HydrophobicContact CD1-CE1 4.23Å; N71-F118 HydrophobicContact CB-CD1 3.73Å; N71-F118 HydrophobicContact CB-CD2 3.62Å; N71-F118 HydrophobicContact CB-CE1 3.49Å; N71-F118 VanDerWaalsContact CB-CE1 3.49Å; N71-F118 HydrophobicContact CB-CE2 3.4Å; N71-F118 VanDerWaalsContact CB-CE2 3.4Å; N71-F118 HydrophobicContact CB-CG 3.82Å; N71-F118 HydrophobicContact CB-CZ 3.34Å; L72-F118 HydrophobicContact CD2-CB 4Å; L72-F118 HydrophobicContact CG-CB 4.01Å; S114-F118 WeakPolarHBondContact O-CD2 3.34Å; S114-F118 PolarHBondContact O-N 3.37Å; G115-F118 PolarHBondContact O-N 2.72Å; I116-F118 PolarHBondContact O-N 3.44Å; F118-L121 HydrophobicContact CD1-CD1 4.08Å; F118-L121 HydrophobicContact CE1-CD1 4.24Å; F118-L121 PolarHBondContact O-N 3.27Å; F118-L122 WeakPolarHBondContact O-CB 3.22Å; F118-L122 VanDerWaalsContact O-CG 3.28Å; F118-L122 WeakPolarHBondContact O-CG 3.17Å; F118-L122 PolarHBondContact O-N 3.44Å; F118-S149 WeakPolarHBondContact CE1-OG 3.25Å; F118-T152 HydrophobicContact CD2-CG2 4.47Å; F118-T152 HydrophobicContact CE1-CG2 4.14Å; F118-T152 HydrophobicContact CE2-CG2 4.06Å; F118-T152 HydrophobicContact CZ-CG2 3.88Å; F118-W153 HydrophobicContact CE2-CD2 4.46Å; F118-W153 AromaticContact CE2-CE2 3.84Å; F118-W153 HydrophobicContact CE2-CZ2 4.04Å; F118-W153 AromaticContact CE2-NE1 3.78Å; F118-W153 AromaticContact CZ-CD1 3.96Å; F118-W153 AromaticContact CZ-NE1 3.63Å |
| 119 | I | 94.9 | Very high | 94.1 | Very high | 2 Ų | 2 | 16.8 Ų | 16.8 | 1% | 0.01 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -65 | -41.4 | 171.7 | -67.4 | 170.5 | 0 | 0 | 0 | 111.1 | L72 G115 I116 L122 T123 I240 M241 Y244 | L72-I119 HydrophobicContact CD1-CG1 4.43Å; L72-I119 HydrophobicContact CD2-CD1 4.38Å; L72-I119 HydrophobicContact CD2-CG1 3.78Å; G115-I119 WeakPolarHBondContact O-CG1 3.47Å; G115-I119 PolarHBondContact O-N 2.92Å; G115-I119 VanDerWaalsContact O-N 3.15Å; I116-I119 HydrophobicContact CD1-CB 4.34Å; I116-I119 PolarHBondContact O-N 3.5Å; I119-L122 PolarHBondContact O-N 3.43Å; I119-T123 PolarHBondContact O-N 3.06Å; I119-T123 PolarHBondContact O-OG1 2.96Å; I119-I240 HydrophobicContact CD1-CG2 4.02Å; I119-I240 HydrophobicContact CG1-CG2 3.97Å; I119-I240 HydrophobicContact CG2-CG2 4.49Å; I119-M241 HydrophobicContact CG2-CB 4.43Å; I119-M241 HydrophobicContact CG2-CE 3.49Å; I119-M241 VanDerWaalsContact CG2-CE 3.49Å; I119-M241 HydrophobicContact CG2-SD 3.63Å; I119-Y244 HydrophobicContact CD1-CD2 3.94Å; I119-Y244 HydrophobicContact CD1-CG 4.17Å |
| 120 | I | 96 | Very high | 93.6 | Very high | 14 Ų | 14 | 16.3 Ų | 16.3 | 7% | 0.072 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -60.6 | -49.5 | 173.6 | -73.3 | 165.2 | 0 | 0 | 0 | 110.4 | I116 F117 L122 T123 I124 L205 P206 V209 | I116-I120 HydrophobicContact CG1-CD1 4.21Å; I116-I120 WeakPolarHBondContact O-CG1 3.48Å; I116-I120 PolarHBondContact O-N 2.97Å; F117-I120 HydrophobicContact CD1-CD1 4.32Å; F117-I120 WeakPolarHBondContact O-CB 3.39Å; F117-I120 PolarHBondContact O-N 3.15Å; I120-L122 VanDerWaalsContact C-N 3.33Å; I120-L122 PolarHBondContact O-N 3.32Å; I120-T123 WeakPolarHBondContact O-CA 3.13Å; I120-T123 WeakPolarHBondContact O-CB 3.28Å; I120-T123 PolarHBondContact O-N 3.37Å; I120-I124 HydrophobicContact CG2-CD1 3.77Å; I120-I124 HydrophobicContact CG2-CG1 4.47Å; I120-I124 WeakPolarHBondContact O-CG1 3.23Å; I120-I124 PolarHBondContact O-N 3.4Å; I120-L205 HydrophobicContact CD1-CD2 3.97Å; I120-L205 HydrophobicContact CD1-CG 4Å; I120-P206 HydrophobicContact CD1-CB 3.97Å; I120-P206 HydrophobicContact CG1-CB 3.95Å; I120-V209 HydrophobicContact CG2-CG1 4.22Å; I120-V209 HydrophobicContact CG2-CG2 4.05Å |
| 121 | L | 95.8 | Very high | 93.1 | Very high | 33 Ų | 33 | 17.1 Ų | 17.1 | 17% | 0.173 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -61.5 | -39 | 178.5 | -74 | 177.7 | 0 | 0 | 0 | 112.5 | Y68 F117 F118 T123 I124 D125 T152 | Y68-L121 HydrophobicContact CD1-CD1 4.41Å; Y68-L121 HydrophobicContact CD2-CB 4Å; Y68-L121 HydrophobicContact CE1-CB 4.45Å; Y68-L121 HydrophobicContact CE1-CD1 3.97Å; Y68-L121 HydrophobicContact CE2-CB 3.82Å; Y68-L121 HydrophobicContact CG-CB 4.36Å; F117-L121 WeakPolarHBondContact O-CG 3.05Å; F117-L121 PolarHBondContact O-N 2.7Å; F118-L121 HydrophobicContact CD1-CD1 4.08Å; F118-L121 HydrophobicContact CE1-CD1 4.24Å; F118-L121 PolarHBondContact O-N 3.27Å; L121-T123 VanDerWaalsContact C-N 3.31Å; L121-T123 PolarHBondContact O-N 2.82Å; L121-I124 PolarHBondContact O-N 3.11Å; L121-D125 VanDerWaalsContact O-CB 3.23Å; L121-D125 WeakPolarHBondContact O-CB 3.36Å; L121-D125 PolarHBondContact O-N 2.86Å; L121-T152 HydrophobicContact CD1-CG2 4.29Å; L121-T152 VanDerWaalsContact CD1-OG1 3.27Å; L121-T152 WeakPolarHBondContact CD1-OG1 3.37Å |
| 122 | L | 93.1 | Very high | 92.6 | Very high | 1 Ų | 1 | 21.1 Ų | 21.1 | 1% | 0.005 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -61.3 | -40.7 | 172.5 | -78.6 | 168 | 0 | 0 | 0 | 111.9 | T65 Y68 L69 L72 F118 I119 I120 D125 R126 I237 | T65-L122 HydrophobicContact CG2-CD2 3.73Å; Y68-L122 HydrophobicContact CD2-CD2 4.34Å; L69-L122 HydrophobicContact CD2-CD1 3.87Å; L69-L122 HydrophobicContact CD2-CD2 4.14Å; L69-L122 HydrophobicContact CG-CD1 4.48Å; L69-L122 HydrophobicContact CG-CD2 3.98Å; L72-L122 HydrophobicContact CD1-CD1 3.38Å; L72-L122 HydrophobicContact CG-CD1 4.38Å; F118-L122 WeakPolarHBondContact O-CB 3.22Å; F118-L122 VanDerWaalsContact O-CG 3.28Å; F118-L122 WeakPolarHBondContact O-CG 3.17Å; F118-L122 PolarHBondContact O-N 3.44Å; I119-L122 PolarHBondContact O-N 3.43Å; I120-L122 VanDerWaalsContact C-N 3.33Å; I120-L122 PolarHBondContact O-N 3.32Å; L122-D125 PolarHBondContact O-N 3.26Å; L122-R126 WeakPolarHBondContact O-CG 3.08Å; L122-R126 PolarHBondContact O-N 3.38Å; L122-I237 HydrophobicContact CB-CD1 4.23Å; L122-I237 HydrophobicContact CB-CG2 4.3Å; L122-I237 HydrophobicContact CD2-CD1 4.26Å |
| 123 | T | 92.9 | Very high | 91.9 | Very high | 0 Ų | 0 | 23.3 Ų | 23.3 | 0% | 0 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -66.1 | -44.4 | 178.7 | -56.7 | 0 | 0 | 0 | 0 | 111.2 | I119 I120 L121 R126 Y127 V209 C213 Y214 M241 | I119-T123 PolarHBondContact O-N 3.06Å; I119-T123 PolarHBondContact O-OG1 2.96Å; I120-T123 WeakPolarHBondContact O-CA 3.13Å; I120-T123 WeakPolarHBondContact O-CB 3.28Å; I120-T123 PolarHBondContact O-N 3.37Å; L121-T123 VanDerWaalsContact C-N 3.31Å; L121-T123 PolarHBondContact O-N 2.82Å; T123-R126 PolarHBondContact O-N 3.45Å; T123-Y127 WeakPolarHBondContact O-CB 3.36Å; T123-Y127 PolarHBondContact O-N 3.09Å; T123-V209 HydrophobicContact CG2-CG1 4.09Å; T123-C213 HydrophobicContact CG2-CB 3.73Å; T123-Y214 HydrophobicContact CG2-CD2 4.42Å; T123-Y214 HydrophobicContact CG2-CE2 3.79Å; T123-M241 HydrophobicContact CG2-CE 4.27Å; T123-M241 WeakPolarHBondContact OG1-CE 3.44Å |
| 124 | I | 93.3 | Very high | 91.1 | Very high | 62 Ų | 62 | 29.3 Ų | 29.3 | 32% | 0.318 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -65.3 | -44.6 | 175.9 | -64.7 | 169.5 | 0 | 0 | 0 | 110.9 | I120 L121 R126 Y127 L128 V209 | I120-I124 HydrophobicContact CG2-CD1 3.77Å; I120-I124 HydrophobicContact CG2-CG1 4.47Å; I120-I124 WeakPolarHBondContact O-CG1 3.23Å; I120-I124 PolarHBondContact O-N 3.4Å; L121-I124 PolarHBondContact O-N 3.11Å; I124-R126 VanDerWaalsContact C-N 3.28Å; I124-R126 PolarHBondContact O-N 2.93Å; I124-Y127 WeakPolarHBondContact O-CB 3.22Å; I124-Y127 PolarHBondContact O-N 3.44Å; I124-Y127 VanDerWaalsContact O-N 3.14Å; I124-L128 HydrophobicContact CG2-CD1 4.06Å; I124-L128 HydrophobicContact CG2-CG 4.29Å; I124-L128 WeakPolarHBondContact O-CG 3.41Å; I124-L128 PolarHBondContact O-N 2.68Å; I124-V209 HydrophobicContact CG1-CG1 4.09Å |
| 125 | D | 91.3 | Very high | 90.2 | Very high | 3 Ų | 3 | 35.3 Ų | 35.3 | 2% | 0.016 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -56.9 | -41.4 | 175.9 | 168 | 75.3 | 0 | 0 | 0 | 111.7 | T65 Y68 L121 L122 A129 R140 | T65-D125 PolarHBondContact OG1-OD2 3.1Å; Y68-D125 HydrophobicContact CD2-CB 4.3Å; Y68-D125 HydrophobicContact CE2-CB 4.12Å; L121-D125 VanDerWaalsContact O-CB 3.23Å; L121-D125 WeakPolarHBondContact O-CB 3.36Å; L121-D125 PolarHBondContact O-N 2.86Å; L122-D125 PolarHBondContact O-N 3.26Å; D125-A129 WeakPolarHBondContact O-CB 3.21Å; D125-A129 PolarHBondContact O-N 2.87Å; D125-A129 VanDerWaalsContact O-N 3.1Å; D125-R140 PolarHBondContact O-NE 3Å; D125-R140 IonicContact OD1-CZ 3.19Å; D125-R140 IonicContact OD1-NE 2.7Å; D125-R140 PolarHBondContact OD1-NE 3.37Å; D125-R140 IonicContact OD1-NH2 2.82Å; D125-R140 PolarHBondContact OD1-NH2 3.43Å; D125-R140 IonicContact OD2-NH2 3.38Å; D125-R140 PolarHBondContact OD2-NH2 3Å |
| 126 | R | 89.8 | Confident | 89.3 | Confident | 37 Ų | 37 | 35.3 Ų | 35.3 | 14% | 0.14 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -68.1 | -44.2 | 173.8 | -71.9 | -56.1 | 94.1 | -166.2 | -0.4 | 112.9 | T65 L122 T123 I124 A129 V130 I237 | T65-R126 PolarHBondContact OG1-NH2 3.3Å; L122-R126 WeakPolarHBondContact O-CG 3.08Å; L122-R126 PolarHBondContact O-N 3.38Å; T123-R126 PolarHBondContact O-N 3.45Å; I124-R126 VanDerWaalsContact C-N 3.28Å; I124-R126 PolarHBondContact O-N 2.93Å; R126-A129 PolarHBondContact O-N 2.83Å; R126-V130 WeakPolarHBondContact O-CG2 3.47Å; R126-V130 PolarHBondContact O-N 2.87Å; R126-I237 HydrophobicContact CG-CB 4.25Å; R126-I237 HydrophobicContact CG-CD1 3.13Å; R126-I237 HydrophobicContact CG-CG1 4.22Å; R126-I237 HydrophobicContact CG-CG2 4.32Å |
| 127 | Y | 90.3 | Very high | 88.3 | Confident | 49 Ų | 49 | 42.5 Ų | 42.5 | 19% | 0.192 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -56.5 | -51.3 | 178 | 173.3 | -99.6 | 0 | 0 | 0 | 111 | T123 I124 A129 V130 V131 H132 C213 I217 | T123-Y127 WeakPolarHBondContact O-CB 3.36Å; T123-Y127 PolarHBondContact O-N 3.09Å; I124-Y127 WeakPolarHBondContact O-CB 3.22Å; I124-Y127 PolarHBondContact O-N 3.44Å; I124-Y127 VanDerWaalsContact O-N 3.14Å; Y127-A129 VanDerWaalsContact C-N 3.33Å; Y127-A129 PolarHBondContact O-N 2.81Å; Y127-V130 PolarHBondContact O-N 2.93Å; Y127-V130 VanDerWaalsContact O-N 3.16Å; Y127-V131 HydrophobicContact CD2-CB 4.32Å; Y127-V131 HydrophobicContact CD2-CG2 3.7Å; Y127-V131 HydrophobicContact CE2-CB 4.03Å; Y127-V131 HydrophobicContact CE2-CG1 4.23Å; Y127-V131 HydrophobicContact CE2-CG2 3.59Å; Y127-V131 HydrophobicContact CG-CG2 4.45Å; Y127-V131 WeakPolarHBondContact O-CB 3.37Å; Y127-V131 PolarHBondContact O-N 3.4Å; Y127-H132 AromaticContact CE1-CD2 3.69Å; Y127-H132 AromaticContact CE1-NE2 3.81Å; Y127-C213 HydrophobicContact CD2-CB 3.94Å; Y127-C213 WeakPolarHBondContact CD2-O 3.45Å; Y127-C213 HydrophobicContact CG-CB 4.14Å; Y127-I217 HydrophobicContact CD2-CG1 4.19Å |
| 128 | L | 89.3 | Confident | 87.4 | Confident | 40 Ų | 40 | 49.9 Ų | 49.9 | 21% | 0.209 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -59.5 | -43.4 | 177.6 | -67.8 | 175.9 | 0 | 0 | 0 | 111.5 | I124 V130 H132 F135 | I124-L128 HydrophobicContact CG2-CD1 4.06Å; I124-L128 HydrophobicContact CG2-CG 4.29Å; I124-L128 WeakPolarHBondContact O-CG 3.41Å; I124-L128 PolarHBondContact O-N 2.68Å; L128-V130 VanDerWaalsContact C-N 3.28Å; L128-V130 PolarHBondContact O-N 3.24Å; L128-H132 HydrophobicContact CD2-CB 4.44Å; L128-H132 CarbonylContact O-C 3.06Å; L128-H132 WeakPolarHBondContact O-CA 3.45Å; L128-H132 PolarHBondContact O-N 3.4Å; L128-F135 HydrophobicContact CD2-CD1 4.32Å; L128-F135 HydrophobicContact CD2-CE1 4.49Å |
| 129 | A | 86.8 | Confident | 86.5 | Confident | 25 Ų | 25 | 51 Ų | 51 | 21% | 0.207 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -63.4 | -30.5 | 178.8 | 0 | 0 | 0 | 0 | 0 | 114 | D125 R126 Y127 | D125-A129 WeakPolarHBondContact O-CB 3.21Å; D125-A129 PolarHBondContact O-N 2.87Å; D125-A129 VanDerWaalsContact O-N 3.1Å; R126-A129 PolarHBondContact O-N 2.83Å; Y127-A129 VanDerWaalsContact C-N 3.33Å; Y127-A129 PolarHBondContact O-N 2.81Å |
| 130 | V | 84.8 | Confident | 86.1 | Confident | 12 Ų | 12 | 54 Ų | 54 | 7% | 0.073 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -93.6 | -47.7 | -176.5 | 175.5 | 0 | 0 | 0 | 0 | 111.9 | R126 Y127 L128 I217 T220 R230 V234 | R126-V130 WeakPolarHBondContact O-CG2 3.47Å; R126-V130 PolarHBondContact O-N 2.87Å; Y127-V130 PolarHBondContact O-N 2.93Å; Y127-V130 VanDerWaalsContact O-N 3.16Å; L128-V130 VanDerWaalsContact C-N 3.28Å; L128-V130 PolarHBondContact O-N 3.24Å; V130-I217 HydrophobicContact CB-CG1 4.37Å; V130-I217 HydrophobicContact CG1-CG1 4.48Å; V130-I217 HydrophobicContact CG1-CG2 4.35Å; V130-T220 HydrophobicContact CG1-CG2 4.11Å; V130-R230 HydrophobicContact CG2-CG 3.99Å; V130-V234 HydrophobicContact CG2-CG2 4.08Å |
| 131 | V | 86.6 | Confident | 85.7 | Confident | 40 Ų | 40 | 55.9 Ų | 55.9 | 24% | 0.242 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -89.2 | -35.4 | -171.6 | -176.8 | 0 | 0 | 0 | 0 | 111.5 | Y127 I217 | Y127-V131 HydrophobicContact CD2-CB 4.32Å; Y127-V131 HydrophobicContact CD2-CG2 3.7Å; Y127-V131 HydrophobicContact CE2-CB 4.03Å; Y127-V131 HydrophobicContact CE2-CG1 4.23Å; Y127-V131 HydrophobicContact CE2-CG2 3.59Å; Y127-V131 HydrophobicContact CG-CG2 4.45Å; Y127-V131 WeakPolarHBondContact O-CB 3.37Å; Y127-V131 PolarHBondContact O-N 3.4Å; V131-I217 HydrophobicContact CG2-CG1 4.36Å |
| 132 | H | 85.1 | Confident | 85.4 | Confident | 86 Ų | 86 | 57.4 Ų | 57.4 | 40% | 0.398 | 30% | 0.303 | S | S | . | . | trans | -121.7 | 51.7 | -175.5 | -61.6 | -70.6 | 0 | 0 | 0 | 112.1 | Y127 L128 V134 F135 A136 | Y127-H132 AromaticContact CE1-CD2 3.69Å; Y127-H132 AromaticContact CE1-NE2 3.81Å; L128-H132 HydrophobicContact CD2-CB 4.44Å; L128-H132 CarbonylContact O-C 3.06Å; L128-H132 WeakPolarHBondContact O-CA 3.45Å; L128-H132 PolarHBondContact O-N 3.4Å; H132-V134 VanDerWaalsContact C-N 3.27Å; H132-V134 PolarHBondContact O-N 2.93Å; H132-V134 VanDerWaalsContact O-N 3.13Å; H132-F135 HydrophobicContact CB-CB 4.26Å; H132-F135 PolarHBondContact O-N 2.85Å; H132-F135 VanDerWaalsContact O-N 3.11Å; H132-A136 WeakPolarHBondContact O-CB 3.37Å; H132-A136 PolarHBondContact O-N 3.11Å | ||
| 133 | A | 80.4 | Confident | 85.4 | Confident | 57 Ų | 57 | 62.2 Ų | 62.2 | 47% | 0.471 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -54 | -35.9 | -172 | 0 | 0 | 0 | 0 | 0 | 114.8 | A136 L137 | A133-A136 WeakPolarHBondContact O-CB 3.37Å; A133-L137 PolarHBondContact O-N 3.46Å |
| 134 | V | 78.3 | Confident | 85.3 | Confident | 126 Ų | 126 | 67.8 Ų | 67.8 | 76% | 0.764 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -69.7 | -44.9 | 178.8 | -178.8 | 0 | 0 | 0 | 0 | 111.7 | H132 A136 L137 | H132-V134 VanDerWaalsContact C-N 3.27Å; H132-V134 PolarHBondContact O-N 2.93Å; H132-V134 VanDerWaalsContact O-N 3.13Å; V134-A136 VanDerWaalsContact C-N 3.33Å; V134-L137 PolarHBondContact O-N 3.46Å |
| 135 | F | 78.3 | Confident | 85.3 | Confident | 125 Ų | 125 | 64.9 Ų | 64.9 | 55% | 0.548 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -66 | -38.9 | 175.4 | 178.7 | -100.4 | 0 | 0 | 0 | 111.5 | L128 H132 L137 K138 A139 | L128-F135 HydrophobicContact CD2-CD1 4.32Å; L128-F135 HydrophobicContact CD2-CE1 4.49Å; H132-F135 HydrophobicContact CB-CB 4.26Å; H132-F135 PolarHBondContact O-N 2.85Å; H132-F135 VanDerWaalsContact O-N 3.11Å; F135-L137 VanDerWaalsContact C-N 3.25Å; F135-L137 PolarHBondContact O-N 2.89Å; F135-K138 PolarHBondContact O-N 3.37Å; F135-K138 VanDerWaalsContact O-N 3.08Å; F135-A139 HydrophobicContact CD1-CB 4.07Å; F135-A139 HydrophobicContact CE1-CB 3.63Å; F135-A139 HydrophobicContact CZ-CB 3.92Å; F135-A139 PolarHBondContact O-N 3.12Å |
| 136 | A | 77.2 | Confident | 85.4 | Confident | 7 Ų | 7 | 68.2 Ų | 68.2 | 6% | 0.058 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -58.2 | -32.8 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | H132 A133 V134 K138 R140 | H132-A136 WeakPolarHBondContact O-CB 3.37Å; H132-A136 PolarHBondContact O-N 3.11Å; A133-A136 WeakPolarHBondContact O-CB 3.37Å; V134-A136 VanDerWaalsContact C-N 3.33Å; A136-K138 VanDerWaalsContact C-N 3.28Å; A136-K138 PolarHBondContact O-N 3.31Å; A136-R140 HydrophobicContact CB-CG 4.26Å; A136-R140 VanDerWaalsContact O-CB 3.22Å; A136-R140 WeakPolarHBondContact O-CB 3.43Å; A136-R140 VanDerWaalsContact O-CG 3.32Å; A136-R140 WeakPolarHBondContact O-CG 3.49Å; A136-R140 PolarHBondContact O-N 3.2Å; A136-R140 VanDerWaalsContact O-N 3.08Å |
| 137 | L | 76.8 | Confident | 85.8 | Confident | 152 Ų | 152 | 70 Ų | 70 | 80% | 0.796 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -61.4 | -35.3 | 175.9 | -80.4 | 154.3 | 0 | 0 | 0 | 112.7 | A133 V134 F135 | A133-L137 PolarHBondContact O-N 3.46Å; V134-L137 PolarHBondContact O-N 3.46Å; F135-L137 VanDerWaalsContact C-N 3.25Å; F135-L137 PolarHBondContact O-N 2.89Å |
| 138 | K | 77.5 | Confident | 86 | Confident | 176 Ų | 176 | 69.5 Ų | 69.5 | 77% | 0.765 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -88.5 | -36.8 | -179.1 | -169.9 | 176.1 | 179.9 | 179.3 | 0 | 112.6 | F135 A136 | F135-K138 PolarHBondContact O-N 3.37Å; F135-K138 VanDerWaalsContact O-N 3.08Å; A136-K138 VanDerWaalsContact C-N 3.28Å; A136-K138 PolarHBondContact O-N 3.31Å |
| 139 | A | 78 | Confident | 86.4 | Confident | 25 Ų | 25 | 67.9 Ų | 67.9 | 21% | 0.207 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -87.9 | -25.1 | -172.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | F135 T141 F144 | F135-A139 HydrophobicContact CD1-CB 4.07Å; F135-A139 HydrophobicContact CE1-CB 3.63Å; F135-A139 HydrophobicContact CZ-CB 3.92Å; F135-A139 PolarHBondContact O-N 3.12Å; A139-T141 VanDerWaalsContact C-N 3.29Å; A139-T141 PolarHBondContact O-N 3.43Å; A139-T141 VanDerWaalsContact O-N 3.12Å; A139-F144 WeakPolarHBondContact O-CD2 3.42Å |
| 140 | R | 86.1 | Confident | 86.9 | Confident | 64 Ų | 64 | 70.7 Ų | 70.7 | 24% | 0.242 | 39% | 0.386 | C | S | . | . | trans | -91.8 | 48.7 | -171.3 | -60.3 | 173.9 | 68.8 | -115 | -26.2 | 113.5 | M64 T65 D125 A136 | M64-R140 VanDerWaalsContact SD-CA 3.59Å; M64-R140 HydrophobicContact SD-CB 3.96Å; M64-R140 HydrophobicContact SD-CG 4.09Å; T65-R140 PolarHBondContact OG1-NH2 2.84Å; T65-R140 VanDerWaalsContact OG1-NH2 3.13Å; D125-R140 PolarHBondContact O-NE 3Å; D125-R140 IonicContact OD1-CZ 3.19Å; D125-R140 IonicContact OD1-NE 2.7Å; D125-R140 PolarHBondContact OD1-NE 3.37Å; D125-R140 IonicContact OD1-NH2 2.82Å; D125-R140 PolarHBondContact OD1-NH2 3.43Å; D125-R140 IonicContact OD2-NH2 3.38Å; D125-R140 PolarHBondContact OD2-NH2 3Å; A136-R140 HydrophobicContact CB-CG 4.26Å; A136-R140 VanDerWaalsContact O-CB 3.22Å; A136-R140 WeakPolarHBondContact O-CB 3.43Å; A136-R140 VanDerWaalsContact O-CG 3.32Å; A136-R140 WeakPolarHBondContact O-CG 3.49Å; A136-R140 PolarHBondContact O-N 3.2Å; A136-R140 VanDerWaalsContact O-N 3.08Å | ||
| 141 | T | 88.3 | Confident | 87.6 | Confident | 54 Ų | 54 | 74.6 Ų | 74.6 | 33% | 0.331 | 41% | 0.406 | S | S | . | . | trans | -83.9 | 156.6 | 175.7 | 73.6 | 0 | 0 | 0 | 0 | 111.4 | A139 T143 F144 G145 | A139-T141 VanDerWaalsContact C-N 3.29Å; A139-T141 PolarHBondContact O-N 3.43Å; A139-T141 VanDerWaalsContact O-N 3.12Å; T141-T143 VanDerWaalsContact C-N 3.26Å; T141-T143 PolarHBondContact O-N 2.97Å; T141-F144 HydrophobicContact CG2-CD2 4.35Å; T141-F144 PolarHBondContact O-N 3.48Å; T141-F144 WeakPolarHBondContact OG1-CD2 3.29Å; T141-F144 PolarHBondContact OG1-N 3.44Å; T141-G145 PolarHBondContact O-N 3.34Å; T141-G145 VanDerWaalsContact O-N 3.08Å | ||
| 142 | V | 89.9 | Confident | 88.1 | Confident | 64 Ų | 64 | 73.4 Ų | 73.4 | 39% | 0.388 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -58.2 | -41.4 | 175.2 | 170.1 | 0 | 0 | 0 | 0 | 110.5 | I67 F144 G145 V146 | I67-V142 HydrophobicContact CD1-CB 4.2Å; I67-V142 HydrophobicContact CD1-CG1 3.75Å; I67-V142 VanDerWaalsContact CD1-O 3.25Å; I67-V142 WeakPolarHBondContact CD1-O 3.28Å; V142-F144 PolarHBondContact O-N 2.91Å; V142-G145 WeakPolarHBondContact O-CA 3.48Å; V142-G145 PolarHBondContact O-N 2.82Å; V142-G145 VanDerWaalsContact O-N 3.11Å; V142-V146 WeakPolarHBondContact O-CG2 3.37Å; V142-V146 PolarHBondContact O-N 2.87Å |
| 143 | T | 91.4 | Very high | 88.7 | Confident | 102 Ų | 102 | 71.7 Ų | 71.7 | 63% | 0.626 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -59.5 | -47.7 | 179 | -45.4 | 0 | 0 | 0 | 0 | 112.2 | T141 G145 V146 V147 | T141-T143 VanDerWaalsContact C-N 3.26Å; T141-T143 PolarHBondContact O-N 2.97Å; T143-G145 VanDerWaalsContact C-N 3.29Å; T143-G145 PolarHBondContact O-N 2.79Å; T143-V146 PolarHBondContact O-N 2.71Å; T143-V147 WeakPolarHBondContact O-CG2 2.91Å; T143-V147 PolarHBondContact O-N 2.85Å |
| 144 | F | 91.8 | Very high | 89.6 | Confident | 118 Ų | 118 | 72.4 Ų | 72.4 | 52% | 0.518 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -62.9 | -37.5 | 175.1 | -79 | -62.2 | 0 | 0 | 0 | 111.7 | A139 T141 V142 V147 T148 | A139-F144 WeakPolarHBondContact O-CD2 3.42Å; T141-F144 HydrophobicContact CG2-CD2 4.35Å; T141-F144 PolarHBondContact O-N 3.48Å; T141-F144 WeakPolarHBondContact OG1-CD2 3.29Å; T141-F144 PolarHBondContact OG1-N 3.44Å; V142-F144 PolarHBondContact O-N 2.91Å; F144-V147 PolarHBondContact O-N 3.48Å; F144-T148 WeakPolarHBondContact O-CB 3.31Å; F144-T148 VanDerWaalsContact O-CG2 3.3Å; F144-T148 WeakPolarHBondContact O-CG2 3.46Å; F144-T148 PolarHBondContact O-N 3.41Å; F144-T148 PolarHBondContact O-OG1 3.49Å |
| 145 | G | 92.9 | Very high | 90.5 | Very high | 0 Ų | 0 | 69.7 Ų | 69.7 | 0% | 0 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -58.4 | -45.5 | 172.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | T141 V142 T143 T148 S149 | T141-G145 PolarHBondContact O-N 3.34Å; T141-G145 VanDerWaalsContact O-N 3.08Å; V142-G145 WeakPolarHBondContact O-CA 3.48Å; V142-G145 PolarHBondContact O-N 2.82Å; V142-G145 VanDerWaalsContact O-N 3.11Å; T143-G145 VanDerWaalsContact C-N 3.29Å; T143-G145 PolarHBondContact O-N 2.79Å; G145-T148 WeakPolarHBondContact CA-OG1 3.41Å; G145-T148 PolarHBondContact O-OG1 3.08Å; G145-S149 WeakPolarHBondContact O-CB 3.43Å; G145-S149 PolarHBondContact O-N 3.47Å; G145-S149 PolarHBondContact O-OG 2.95Å; G145-S149 VanDerWaalsContact O-OG 3.12Å |
| 146 | V | 94.9 | Very high | 91.4 | Very high | 73 Ų | 73 | 63.8 Ų | 63.8 | 44% | 0.442 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -64.5 | -48.6 | 177.1 | 176.7 | 0 | 0 | 0 | 0 | 111.3 | I67 V142 T143 T148 S149 V150 | I67-V146 HydrophobicContact CD1-CG2 3.99Å; V142-V146 WeakPolarHBondContact O-CG2 3.37Å; V142-V146 PolarHBondContact O-N 2.87Å; T143-V146 PolarHBondContact O-N 2.71Å; V146-T148 PolarHBondContact O-N 3.17Å; V146-S149 WeakPolarHBondContact O-CB 3.49Å; V146-S149 PolarHBondContact O-N 3.12Å; V146-V150 HydrophobicContact CG1-CG2 4.49Å; V146-V150 WeakPolarHBondContact O-CG2 3.5Å; V146-V150 PolarHBondContact O-N 2.94Å |
| 147 | V | 96.1 | Very high | 92.4 | Very high | 74 Ų | 74 | 66.3 Ų | 66.3 | 45% | 0.448 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -60.3 | -47.1 | -178.9 | 172.4 | 0 | 0 | 0 | 0 | 111 | T143 F144 S149 V150 I151 | T143-V147 WeakPolarHBondContact O-CG2 2.91Å; T143-V147 PolarHBondContact O-N 2.85Å; F144-V147 PolarHBondContact O-N 3.48Å; V147-S149 VanDerWaalsContact C-N 3.34Å; V147-S149 PolarHBondContact O-N 3.45Å; V147-V150 PolarHBondContact O-N 3.48Å; V147-I151 HydrophobicContact CG1-CD1 3.95Å; V147-I151 WeakPolarHBondContact O-CG1 3.43Å; V147-I151 PolarHBondContact O-N 3.3Å |
| 148 | T | 96.3 | Very high | 93.3 | Very high | 40 Ų | 40 | 65.7 Ų | 65.7 | 25% | 0.245 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -64.6 | -36.5 | 177.5 | 51.1 | 0 | 0 | 0 | 0 | 112.4 | Y68 F144 G145 V146 I151 T152 | Y68-T148 WeakPolarHBondContact CE1-OG1 3.23Å; Y68-T148 WeakPolarHBondContact OH-CB 3.38Å; Y68-T148 PolarHBondContact OH-OG1 3.07Å; F144-T148 WeakPolarHBondContact O-CB 3.31Å; F144-T148 VanDerWaalsContact O-CG2 3.3Å; F144-T148 WeakPolarHBondContact O-CG2 3.46Å; F144-T148 PolarHBondContact O-N 3.41Å; F144-T148 PolarHBondContact O-OG1 3.49Å; G145-T148 WeakPolarHBondContact CA-OG1 3.41Å; G145-T148 PolarHBondContact O-OG1 3.08Å; V146-T148 PolarHBondContact O-N 3.17Å; T148-I151 PolarHBondContact O-N 3.01Å; T148-T152 WeakPolarHBondContact O-CB 3.43Å; T148-T152 PolarHBondContact O-N 3.21Å; T148-T152 PolarHBondContact O-OG1 3.33Å |
| 149 | S | 97.1 | Very high | 94.2 | Very high | 5 Ų | 5 | 58 Ų | 58 | 4% | 0.035 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -61.9 | -45.6 | 172 | -73.4 | 0 | 0 | 0 | 0 | 112.4 | N71 F118 G145 V146 V147 I151 T152 W153 | N71-S149 PolarHBondContact ND2-OG 2.7Å; F118-S149 WeakPolarHBondContact CE1-OG 3.25Å; G145-S149 WeakPolarHBondContact O-CB 3.43Å; G145-S149 PolarHBondContact O-N 3.47Å; G145-S149 PolarHBondContact O-OG 2.95Å; G145-S149 VanDerWaalsContact O-OG 3.12Å; V146-S149 WeakPolarHBondContact O-CB 3.49Å; V146-S149 PolarHBondContact O-N 3.12Å; V147-S149 VanDerWaalsContact C-N 3.34Å; V147-S149 PolarHBondContact O-N 3.45Å; S149-I151 PolarHBondContact O-N 3.06Å; S149-T152 WeakPolarHBondContact O-CB 3.48Å; S149-T152 PolarHBondContact O-N 3.42Å; S149-T152 VanDerWaalsContact O-N 3.15Å; S149-W153 PolarHBondContact O-N 3.01Å |
| 150 | V | 97.9 | Very high | 95 | Very high | 85 Ų | 85 | 56.8 Ų | 56.8 | 52% | 0.515 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -60.3 | -46.7 | 178.1 | 171.8 | 0 | 0 | 0 | 0 | 110.8 | V146 V147 T152 W153 V154 | V146-V150 HydrophobicContact CG1-CG2 4.49Å; V146-V150 WeakPolarHBondContact O-CG2 3.5Å; V146-V150 PolarHBondContact O-N 2.94Å; V147-V150 PolarHBondContact O-N 3.48Å; V150-T152 VanDerWaalsContact C-N 3.26Å; V150-T152 PolarHBondContact O-N 3.04Å; V150-W153 PolarHBondContact O-N 3.27Å; V150-V154 WeakPolarHBondContact O-CG2 3Å; V150-V154 PolarHBondContact O-N 3.22Å |
| 151 | I | 98 | Very high | 95.3 | Very high | 94 Ų | 94 | 57 Ų | 57 | 48% | 0.482 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -58.6 | -42.4 | 175.7 | -66.2 | 166.5 | 0 | 0 | 0 | 110.4 | V147 T148 S149 W153 V154 V155 | V147-I151 HydrophobicContact CG1-CD1 3.95Å; V147-I151 WeakPolarHBondContact O-CG1 3.43Å; V147-I151 PolarHBondContact O-N 3.3Å; T148-I151 PolarHBondContact O-N 3.01Å; S149-I151 PolarHBondContact O-N 3.06Å; I151-W153 PolarHBondContact O-N 3.45Å; I151-V154 PolarHBondContact O-N 3.21Å; I151-V155 HydrophobicContact CG2-CG2 4.27Å; I151-V155 VanDerWaalsContact O-CG2 3.31Å; I151-V155 WeakPolarHBondContact O-CG2 3.19Å; I151-V155 PolarHBondContact O-N 3.3Å |
| 152 | T | 98 | Very high | 95.5 | Very high | 15 Ų | 15 | 55.6 Ų | 55.6 | 9% | 0.092 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -62.9 | -41.7 | 179.9 | -58.5 | 0 | 0 | 0 | 0 | 112.3 | F117 F118 L121 T148 S149 V150 V155 A156 | F117-T152 HydrophobicContact CB-CG2 3.48Å; F117-T152 VanDerWaalsContact CB-CG2 3.48Å; F117-T152 HydrophobicContact CD2-CG2 4.17Å; F117-T152 HydrophobicContact CG-CG2 4.31Å; F118-T152 HydrophobicContact CD2-CG2 4.47Å; F118-T152 HydrophobicContact CE1-CG2 4.14Å; F118-T152 HydrophobicContact CE2-CG2 4.06Å; F118-T152 HydrophobicContact CZ-CG2 3.88Å; L121-T152 HydrophobicContact CD1-CG2 4.29Å; L121-T152 VanDerWaalsContact CD1-OG1 3.27Å; L121-T152 WeakPolarHBondContact CD1-OG1 3.37Å; T148-T152 WeakPolarHBondContact O-CB 3.43Å; T148-T152 PolarHBondContact O-N 3.21Å; T148-T152 PolarHBondContact O-OG1 3.33Å; S149-T152 WeakPolarHBondContact O-CB 3.48Å; S149-T152 PolarHBondContact O-N 3.42Å; S149-T152 VanDerWaalsContact O-N 3.15Å; V150-T152 VanDerWaalsContact C-N 3.26Å; V150-T152 PolarHBondContact O-N 3.04Å; T152-V155 PolarHBondContact O-N 2.82Å; T152-A156 WeakPolarHBondContact O-CB 3.36Å; T152-A156 PolarHBondContact O-N 3.26Å |
| 153 | W | 98.1 | Very high | 95.4 | Very high | 49 Ų | 49 | 52.6 Ų | 52.6 | 19% | 0.186 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -61.6 | -45.4 | 174 | -79.9 | 109.8 | 0 | 0 | 0 | 111.9 | N71 I74 F78 I110 F118 S149 V150 I151 V155 A156 V157 | N71-W153 PolarHBondContact OD1-NE1 3.17Å; I74-W153 HydrophobicContact CB-CH2 4.48Å; I74-W153 HydrophobicContact CB-CZ2 4.14Å; I74-W153 HydrophobicContact CG2-CH2 3.82Å; I74-W153 HydrophobicContact CG2-CZ2 3.68Å; F78-W153 AromaticContact CD2-CH2 3.58Å; F78-W153 HydrophobicContact CD2-CH2 3.58Å; F78-W153 AromaticContact CD2-CZ3 3.68Å; F78-W153 HydrophobicContact CD2-CZ3 3.68Å; F78-W153 AromaticContact CE2-CH2 3.52Å; F78-W153 HydrophobicContact CE2-CH2 3.52Å; F78-W153 HydrophobicContact CE2-CZ2 4.44Å; F78-W153 AromaticContact CE2-CZ3 3.56Å; F78-W153 HydrophobicContact CE2-CZ3 3.56Å; I110-W153 HydrophobicContact CG2-CE3 4.12Å; I110-W153 HydrophobicContact CG2-CZ3 3.69Å; F118-W153 HydrophobicContact CE2-CD2 4.46Å; F118-W153 AromaticContact CE2-CE2 3.84Å; F118-W153 HydrophobicContact CE2-CZ2 4.04Å; F118-W153 AromaticContact CE2-NE1 3.78Å; F118-W153 AromaticContact CZ-CD1 3.96Å; F118-W153 AromaticContact CZ-NE1 3.63Å; S149-W153 PolarHBondContact O-N 3.01Å; V150-W153 PolarHBondContact O-N 3.27Å; I151-W153 PolarHBondContact O-N 3.45Å; W153-V155 VanDerWaalsContact C-N 3.35Å; W153-V155 PolarHBondContact O-N 3.17Å; W153-A156 PolarHBondContact O-N 3Å; W153-V157 WeakPolarHBondContact O-CG2 3.03Å; W153-V157 PolarHBondContact O-N 3.23Å |
| 154 | V | 98.1 | Very high | 95.4 | Very high | 72 Ų | 72 | 49.5 Ų | 49.5 | 44% | 0.436 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -59 | -47.6 | 176.6 | 172.6 | 0 | 0 | 0 | 0 | 110.5 | V150 I151 A156 V157 F158 | V150-V154 WeakPolarHBondContact O-CG2 3Å; V150-V154 PolarHBondContact O-N 3.22Å; I151-V154 PolarHBondContact O-N 3.21Å; V154-A156 PolarHBondContact O-N 3.49Å; V154-V157 PolarHBondContact O-N 3.14Å; V154-F158 HydrophobicContact CG1-CD2 3.62Å; V154-F158 HydrophobicContact CG1-CE2 3.5Å; V154-F158 VanDerWaalsContact CG1-CE2 3.5Å; V154-F158 WeakPolarHBondContact O-CD2 3.38Å; V154-F158 PolarHBondContact O-N 3.43Å |
| 155 | V | 97.9 | Very high | 95.4 | Very high | 70 Ų | 70 | 48.6 Ų | 48.6 | 42% | 0.424 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -61.7 | -41.4 | 177.2 | 174.1 | 0 | 0 | 0 | 0 | 111.7 | F117 I151 T152 W153 F158 A159 | F117-V155 HydrophobicContact CD2-CG1 4.48Å; F117-V155 HydrophobicContact CE2-CG1 3.83Å; F117-V155 HydrophobicContact CZ-CG1 4.36Å; I151-V155 HydrophobicContact CG2-CG2 4.27Å; I151-V155 VanDerWaalsContact O-CG2 3.31Å; I151-V155 WeakPolarHBondContact O-CG2 3.19Å; I151-V155 PolarHBondContact O-N 3.3Å; T152-V155 PolarHBondContact O-N 2.82Å; W153-V155 VanDerWaalsContact C-N 3.35Å; W153-V155 PolarHBondContact O-N 3.17Å; V155-F158 PolarHBondContact O-N 3.26Å; V155-A159 WeakPolarHBondContact O-CB 3.43Å; V155-A159 PolarHBondContact O-N 3.46Å |
| 156 | A | 97.6 | Very high | 95.3 | Very high | 0 Ų | 0 | 49.8 Ų | 49.8 | 0% | 0 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -63 | -41.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | F113 F117 T152 W153 V154 A159 S160 | F113-A156 HydrophobicContact CB-CB 4.11Å; F117-A156 HydrophobicContact CD2-CB 4.35Å; F117-A156 HydrophobicContact CE2-CB 4.46Å; T152-A156 WeakPolarHBondContact O-CB 3.36Å; T152-A156 PolarHBondContact O-N 3.26Å; W153-A156 PolarHBondContact O-N 3Å; V154-A156 PolarHBondContact O-N 3.49Å; A156-A159 PolarHBondContact O-N 2.94Å; A156-S160 WeakPolarHBondContact O-CB 3.43Å; A156-S160 PolarHBondContact O-N 3.4Å; A156-S160 VanDerWaalsContact O-N 3.1Å; A156-S160 PolarHBondContact O-OG 3.41Å |
| 157 | V | 97.2 | Very high | 95 | Very high | 61 Ų | 61 | 46.6 Ų | 46.6 | 37% | 0.37 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -61.3 | -50 | 173.5 | 172.3 | 0 | 0 | 0 | 0 | 110.4 | I110 W153 V154 A159 S160 L161 | I110-V157 HydrophobicContact CD1-CG2 3.99Å; I110-V157 HydrophobicContact CG1-CG2 4.21Å; W153-V157 WeakPolarHBondContact O-CG2 3.03Å; W153-V157 PolarHBondContact O-N 3.23Å; V154-V157 PolarHBondContact O-N 3.14Å; V157-A159 VanDerWaalsContact C-N 3.35Å; V157-A159 PolarHBondContact O-N 3.36Å; V157-S160 WeakPolarHBondContact O-CA 3.24Å; V157-S160 WeakPolarHBondContact O-CB 3.25Å; V157-S160 PolarHBondContact O-N 3.23Å; V157-L161 WeakPolarHBondContact O-CG 2.98Å; V157-L161 PolarHBondContact O-N 3.12Å; V157-L161 VanDerWaalsContact O-N 3.09Å |
| 158 | F | 96.7 | Very high | 94.6 | Very high | 138 Ų | 138 | 50 Ų | 50 | 61% | 0.605 | 26% | 0.259 | S | S | * | . | H | α-helix | trans | -59.5 | -42.1 | 177.9 | -83.9 | -70.1 | 0 | 0 | 0 | 112.9 | V154 V155 S160 L161 | V154-F158 HydrophobicContact CG1-CD2 3.62Å; V154-F158 HydrophobicContact CG1-CE2 3.5Å; V154-F158 VanDerWaalsContact CG1-CE2 3.5Å; V154-F158 WeakPolarHBondContact O-CD2 3.38Å; V154-F158 PolarHBondContact O-N 3.43Å; V155-F158 PolarHBondContact O-N 3.26Å; F158-S160 PolarHBondContact O-N 3.09Å; F158-L161 HydrophobicContact CD1-CD1 3.62Å; F158-L161 HydrophobicContact CE1-CD1 4.07Å; F158-L161 HydrophobicContact CG-CD1 4.45Å; F158-L161 PolarHBondContact O-N 2.99Å |
| 159 | A | 95.3 | Very high | 94.1 | Very high | 15 Ų | 15 | 49.3 Ų | 49.3 | 12% | 0.124 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -62.9 | -26.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | F113 V155 A156 V157 K197 L201 | F113-A159 HydrophobicContact CD1-CB 4.41Å; F113-A159 HydrophobicContact CD2-CB 3.83Å; F113-A159 HydrophobicContact CE2-CB 4.14Å; F113-A159 HydrophobicContact CG-CB 4.02Å; V155-A159 WeakPolarHBondContact O-CB 3.43Å; V155-A159 PolarHBondContact O-N 3.46Å; A156-A159 PolarHBondContact O-N 2.94Å; V157-A159 VanDerWaalsContact C-N 3.35Å; V157-A159 PolarHBondContact O-N 3.36Å; A159-K197 PolarHBondContact O-NZ 2.89Å; A159-L201 HydrophobicContact CB-CD1 4.34Å |
| 160 | S | 95.2 | Very high | 93.3 | Very high | 0 Ų | 0 | 52.7 Ų | 52.7 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -85.3 | -25.8 | -179.4 | -55.9 | 0 | 0 | 0 | 0 | 113.1 | F109 I110 A156 V157 F158 G163 I164 | F109-S160 WeakPolarHBondContact CB-OG 3.28Å; F109-S160 PolarHBondContact O-OG 2.79Å; I110-S160 WeakPolarHBondContact CA-OG 3.5Å; I110-S160 WeakPolarHBondContact CG1-OG 3.27Å; I110-S160 PolarHBondContact N-OG 2.91Å; I110-S160 VanDerWaalsContact N-OG 3.15Å; A156-S160 WeakPolarHBondContact O-CB 3.43Å; A156-S160 PolarHBondContact O-N 3.4Å; A156-S160 VanDerWaalsContact O-N 3.1Å; A156-S160 PolarHBondContact O-OG 3.41Å; V157-S160 WeakPolarHBondContact O-CA 3.24Å; V157-S160 WeakPolarHBondContact O-CB 3.25Å; V157-S160 PolarHBondContact O-N 3.23Å; F158-S160 PolarHBondContact O-N 3.09Å; S160-G163 WeakPolarHBondContact O-CA 3.5Å; S160-G163 PolarHBondContact O-N 3.27Å; S160-I164 WeakPolarHBondContact O-CG1 3.33Å; S160-I164 PolarHBondContact O-N 3.34Å; S160-I164 VanDerWaalsContact O-N 3.14Å |
| 161 | L | 93.8 | Very high | 92.4 | Very high | 67 Ų | 67 | 54.8 Ų | 54.8 | 35% | 0.351 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -51 | -47.2 | -175.6 | -71.4 | 176.8 | 0 | 0 | 0 | 114.6 | V157 F158 G163 I164 I165 | V157-L161 WeakPolarHBondContact O-CG 2.98Å; V157-L161 PolarHBondContact O-N 3.12Å; V157-L161 VanDerWaalsContact O-N 3.09Å; F158-L161 HydrophobicContact CD1-CD1 3.62Å; F158-L161 HydrophobicContact CE1-CD1 4.07Å; F158-L161 HydrophobicContact CG-CD1 4.45Å; F158-L161 PolarHBondContact O-N 2.99Å; L161-G163 VanDerWaalsContact C-N 3.26Å; L161-G163 PolarHBondContact O-N 3.28Å; L161-I164 PolarHBondContact O-N 2.87Å; L161-I164 VanDerWaalsContact O-N 3.11Å; L161-I165 HydrophobicContact CB-CD1 4.48Å; L161-I165 VanDerWaalsContact O-CG1 3.28Å; L161-I165 WeakPolarHBondContact O-CG1 3.34Å; L161-I165 PolarHBondContact O-N 3.46Å |
| 162 | P | 90.9 | Very high | 91.2 | Very high | 25 Ų | 25 | 54.3 Ų | 54.3 | 16% | 0.162 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -59 | -39.9 | 178.7 | -23.8 | 34.5 | 0 | 0 | 0 | 112.1 | I164 I165 F166 F193 | P162-I164 VanDerWaalsContact C-N 3.35Å; P162-I164 PolarHBondContact O-N 3.26Å; P162-I165 PolarHBondContact O-N 3.15Å; P162-F166 HydrophobicContact CB-CD2 4.39Å; P162-F166 HydrophobicContact CB-CE2 4.29Å; P162-F166 WeakPolarHBondContact O-CD2 3.47Å; P162-F166 PolarHBondContact O-N 3.26Å; P162-F166 VanDerWaalsContact O-N 3.09Å; P162-F193 HydrophobicContact CB-CE1 4.41Å; P162-F193 HydrophobicContact CG-CE1 4.22Å |
| 163 | G | 88.8 | Confident | 90.1 | Very high | 1 Ų | 1 | 56.9 Ų | 56.9 | 1% | 0.01 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -62.3 | -42.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | S160 L161 T167 | S160-G163 WeakPolarHBondContact O-CA 3.5Å; S160-G163 PolarHBondContact O-N 3.27Å; L161-G163 VanDerWaalsContact C-N 3.26Å; L161-G163 PolarHBondContact O-N 3.28Å; G163-T167 WeakPolarHBondContact O-CB 3.5Å; G163-T167 PolarHBondContact O-N 2.95Å; G163-T167 VanDerWaalsContact O-N 3.07Å; G163-T167 PolarHBondContact O-OG1 3.41Å |
| 164 | I | 91.6 | Very high | 88.9 | Confident | 38 Ų | 38 | 61.5 Ų | 61.5 | 20% | 0.195 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -66.6 | -42 | 179.4 | -59.3 | 167.7 | 0 | 0 | 0 | 111.3 | Q102 S160 L161 P162 | Q102-I164 HydrophobicContact CB-CG2 4.14Å; S160-I164 WeakPolarHBondContact O-CG1 3.33Å; S160-I164 PolarHBondContact O-N 3.34Å; S160-I164 VanDerWaalsContact O-N 3.14Å; L161-I164 PolarHBondContact O-N 2.87Å; L161-I164 VanDerWaalsContact O-N 3.11Å; P162-I164 VanDerWaalsContact C-N 3.35Å; P162-I164 PolarHBondContact O-N 3.26Å |
| 165 | I | 91.6 | Very high | 87.8 | Confident | 99 Ų | 99 | 63.1 Ų | 63.1 | 51% | 0.508 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -68.6 | -41 | -176.7 | -66.8 | 164.4 | 0 | 0 | 0 | 111.4 | L161 P162 | L161-I165 HydrophobicContact CB-CD1 4.48Å; L161-I165 VanDerWaalsContact O-CG1 3.28Å; L161-I165 WeakPolarHBondContact O-CG1 3.34Å; L161-I165 PolarHBondContact O-N 3.46Å; P162-I165 PolarHBondContact O-N 3.15Å |
| 166 | F | 90.2 | Very high | 86.9 | Confident | 24 Ų | 24 | 65 Ų | 65 | 11% | 0.105 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -83.3 | -20.5 | -177.8 | -66.1 | -58 | 0 | 0 | 0 | 113.4 | P162 H181 F182 P183 W190 | P162-F166 HydrophobicContact CB-CD2 4.39Å; P162-F166 HydrophobicContact CB-CE2 4.29Å; P162-F166 WeakPolarHBondContact O-CD2 3.47Å; P162-F166 PolarHBondContact O-N 3.26Å; P162-F166 VanDerWaalsContact O-N 3.09Å; F166-H181 PolarHBondContact O-N 3.43Å; F166-F182 HydrophobicContact CB-CD1 3.92Å; F166-F182 HydrophobicContact CB-CE1 3.83Å; F166-F182 AromaticContact CD1-CD1 3.98Å; F166-F182 HydrophobicContact CD1-CD1 3.98Å; F166-F182 AromaticContact CD2-CD1 3.94Å; F166-F182 HydrophobicContact CD2-CD1 3.94Å; F166-F182 AromaticContact CD2-CE1 3.83Å; F166-F182 HydrophobicContact CD2-CE1 3.83Å; F166-F182 AromaticContact CG-CD1 3.67Å; F166-F182 HydrophobicContact CG-CD1 3.67Å; F166-F182 AromaticContact CG-CE1 3.84Å; F166-F182 HydrophobicContact CG-CE1 3.84Å; F166-P183 HydrophobicContact CE1-CG 4.14Å; F166-W190 HydrophobicContact CD2-CE3 4.34Å; F166-W190 HydrophobicContact CE1-CD2 4.27Å; F166-W190 AromaticContact CE2-CD2 3.73Å; F166-W190 HydrophobicContact CE2-CD2 3.73Å; F166-W190 AromaticContact CE2-CE3 3.24Å; F166-W190 HydrophobicContact CE2-CE3 3.24Å; F166-W190 HydrophobicContact CE2-CG 4.42Å; F166-W190 HydrophobicContact CE2-CH2 4.14Å; F166-W190 AromaticContact CE2-CZ3 3.48Å; F166-W190 HydrophobicContact CE2-CZ3 3.48Å; F166-W190 VanDerWaalsContact CE2-CZ3 3.48Å; F166-W190 AromaticContact CZ-CD2 3.4Å; F166-W190 HydrophobicContact CZ-CD2 3.4Å; F166-W190 VanDerWaalsContact CZ-CD2 3.4Å; F166-W190 AromaticContact CZ-CE2 3.64Å; F166-W190 AromaticContact CZ-CE3 3.4Å; F166-W190 HydrophobicContact CZ-CE3 3.4Å; F166-W190 HydrophobicContact CZ-CG 4.04Å; F166-W190 AromaticContact CZ-CH2 3.83Å; F166-W190 HydrophobicContact CZ-CH2 3.83Å; F166-W190 AromaticContact CZ-CZ2 3.85Å; F166-W190 HydrophobicContact CZ-CZ2 3.85Å; F166-W190 AromaticContact CZ-CZ3 3.62Å; F166-W190 HydrophobicContact CZ-CZ3 3.62Å |
| 167 | T | 88.4 | Confident | 86.1 | Confident | 6 Ų | 6 | 65.8 Ų | 65.8 | 4% | 0.037 | 33% | 0.333 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.3 | 128.7 | 175.6 | -57.7 | 0 | 0 | 0 | 0 | 111.3 | C101 Q102 T105 G163 S179 S180 | C101-T167 VanDerWaalsContact SG-CG2 3.57Å; Q102-T167 WeakPolarHBondContact CG-O 3.4Å; Q102-T167 PolarHBondContact NE2-O 2.97Å; T105-T167 HydrophobicContact CG2-CG2 4.35Å; T105-T167 WeakPolarHBondContact OG1-CG2 3.25Å; G163-T167 WeakPolarHBondContact O-CB 3.5Å; G163-T167 PolarHBondContact O-N 2.95Å; G163-T167 VanDerWaalsContact O-N 3.07Å; G163-T167 PolarHBondContact O-OG1 3.41Å; T167-S179 WeakPolarHBondContact CA-O 3.5Å; T167-S180 PolarHBondContact OG1-OG 3.18Å |
| 168 | R | 87.4 | Confident | 85.5 | Confident | 145 Ų | 145 | 64.2 Ų | 64.2 | 55% | 0.547 | 32% | 0.324 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -137.9 | 154.2 | 176.3 | -62.6 | -171.6 | 179.8 | -162.5 | -1 | 110.7 | N98 S179 | N98-R168 VanDerWaalsContact OD1-CA 3.27Å; N98-R168 WeakPolarHBondContact OD1-CA 3.39Å; R168-S179 PolarHBondContact N-O 3.16Å; R168-S179 PolarHBondContact O-N 3.43Å; R168-S179 VanDerWaalsContact O-N 3.11Å |
| 169 | S | 85.5 | Confident | 84.8 | Confident | 26 Ų | 26 | 59.1 Ų | 59.1 | 18% | 0.182 | 31% | 0.306 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.6 | 122.7 | 165.6 | -177.4 | 0 | 0 | 0 | 0 | 109.3 | N98 T177 | N98-S169 PolarHBondContact OD1-N 2.78Å; S169-T177 CarbonylContact C-O 3.34Å; S169-T177 VanDerWaalsContact CA-O 3.24Å; S169-T177 WeakPolarHBondContact CA-O 3.41Å |
| 170 | Q | 81.1 | Confident | 84.3 | Confident | 76 Ų | 76 | 61 Ų | 61 | 36% | 0.355 | 32% | 0.318 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.2 | 158.7 | 175.9 | 63.5 | 170.3 | 32 | 0 | 0 | 111.5 | E172 Y176 T177 H181 | Q170-E172 HydrophobicContact CG-CG 4.24Å; Q170-E172 PolarHBondContact NE2-OE1 3.47Å; Q170-E172 PolarHBondContact O-N 3.32Å; Q170-Y176 WeakPolarHBondContact O-CA 3.46Å; Q170-T177 PolarHBondContact N-O 3.07Å; Q170-T177 PolarHBondContact O-N 2.98Å; Q170-H181 WeakPolarHBondContact CG-NE2 3.32Å; Q170-H181 PolarHBondContact NE2-CE1 3.34Å; Q170-H181 PolarHBondContact NE2-ND1 3.41Å; Q170-H181 PolarHBondContact NE2-NE2 3.04Å |
| 171 | K | 78.9 | Confident | 83.9 | Confident | 129 Ų | 129 | 63.4 Ų | 63.4 | 56% | 0.561 | 33% | 0.329 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -83.4 | 114 | 176.9 | -169.7 | 177.4 | 179.4 | -178.8 | 0 | 109.7 | G173 Y176 | K171-G173 WeakPolarHBondContact CE-O 3.15Å; K171-Y176 HydrophobicContact CB-CD1 4.1Å; K171-Y176 HydrophobicContact CB-CE1 3.88Å; K171-Y176 HydrophobicContact CD-CE2 4.39Å; K171-Y176 HydrophobicContact CG-CE2 4.49Å |
| 172 | E | 73.2 | Confident | 83.6 | Confident | 85 Ų | 85 | 61.7 Ų | 61.7 | 40% | 0.397 | 32% | 0.319 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.6 | 101.5 | 175 | -74.2 | 179.6 | 168.6 | 0 | 0 | 109.5 | Q170 L174 H175 T177 H181 | Q170-E172 HydrophobicContact CG-CG 4.24Å; Q170-E172 PolarHBondContact NE2-OE1 3.47Å; Q170-E172 PolarHBondContact O-N 3.32Å; E172-L174 PolarHBondContact O-N 2.85Å; E172-H175 PolarHBondContact N-O 2.94Å; E172-H175 PolarHBondContact O-N 3.42Å; E172-T177 HydrophobicContact CB-CG2 4.27Å; E172-T177 PolarHBondContact OE2-OG1 3.42Å; E172-H181 IonicContact OE1-CE1 3.57Å; E172-H181 PolarHBondContact OE1-CE1 2.93Å; E172-H181 VanDerWaalsContact OE1-CE1 3.27Å; E172-H181 IonicContact OE1-NE2 2.79Å |
| 173 | G | 74.4 | Confident | 83.4 | Confident | 68 Ų | 68 | 63 Ų | 63 | 70% | 0.701 | 33% | 0.328 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 68.1 | -118.4 | -173.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | K171 | K171-G173 WeakPolarHBondContact CE-O 3.15Š|
| 174 | L | 72.4 | Confident | 83.3 | Confident | 147 Ų | 147 | 73.6 Ų | 73.6 | 77% | 0.77 | 37% | 0.369 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.5 | -11.4 | -178 | -72.9 | 163.2 | 0 | 0 | 0 | 113.8 | E172 | E172-L174 PolarHBondContact O-N 2.85Š|
| 175 | H | 75.3 | Confident | 83.2 | Confident | 105 Ų | 105 | 77.2 Ų | 77.2 | 49% | 0.486 | 40% | 0.397 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.3 | 150.3 | -171 | -59.4 | -63.6 | 0 | 0 | 0 | 112.2 | Q93 E172 | Q93-H175 HydrophobicContact CB-CB 4.17Å; E172-H175 PolarHBondContact N-O 2.94Å; E172-H175 PolarHBondContact O-N 3.42Å |
| 176 | Y | 79.4 | Confident | 83.1 | Confident | 110 Ų | 110 | 77.3 Ų | 77.3 | 43% | 0.431 | 40% | 0.396 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -80 | 134.2 | 167.5 | -75.6 | -90 | 0 | 0 | 0 | 110 | W94 Q170 K171 | W94-Y176 WeakPolarHBondContact CB-O 3.5Å; W94-Y176 PolarHBondContact N-O 3.48Å; W94-Y176 VanDerWaalsContact O-CB 3.29Å; W94-Y176 WeakPolarHBondContact O-CB 3.21Å; Q170-Y176 WeakPolarHBondContact O-CA 3.46Å; K171-Y176 HydrophobicContact CB-CD1 4.1Å; K171-Y176 HydrophobicContact CB-CE1 3.88Å; K171-Y176 HydrophobicContact CD-CE2 4.39Å; K171-Y176 HydrophobicContact CG-CE2 4.49Å |
| 177 | T | 80.4 | Confident | 83 | Confident | 17 Ų | 17 | 81.1 Ų | 81.1 | 10% | 0.104 | 41% | 0.41 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123 | 149.2 | 176.2 | 60.3 | 0 | 0 | 0 | 0 | 110.8 | Y89 S169 Q170 E172 | Y89-T177 HydrophobicContact CE2-CG2 4.36Å; Y89-T177 WeakPolarHBondContact OH-CB 3.28Å; Y89-T177 WeakPolarHBondContact OH-CG2 3.31Å; S169-T177 CarbonylContact C-O 3.34Å; S169-T177 VanDerWaalsContact CA-O 3.24Å; S169-T177 WeakPolarHBondContact CA-O 3.41Å; Q170-T177 PolarHBondContact N-O 3.07Å; Q170-T177 PolarHBondContact O-N 2.98Å; E172-T177 HydrophobicContact CB-CG2 4.27Å; E172-T177 PolarHBondContact OE2-OG1 3.42Å |
| 178 | C | 84.9 | Confident | 83.1 | Confident | 27 Ų | 27 | 85 Ų | 85 | 18% | 0.182 | 43% | 0.428 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109 | 101.6 | 171.1 | 172.6 | 0 | 0 | 0 | 0 | 107.1 | W94 C101 | W94-C178 HydrophobicContact CD2-CB 3.5Å; W94-C178 HydrophobicContact CE3-CB 3.64Å; W94-C178 HydrophobicContact CG-CB 3.98Å; W94-C178 HydrophobicContact CH2-CB 4.26Å; W94-C178 HydrophobicContact CZ2-CB 4.2Å; W94-C178 HydrophobicContact CZ3-CB 4.01Å; C101-C178 VanDerWaalsContact CA-SG 3.58Å; C101-C178 HydrophobicContact CB-CB 3.9Å; C101-C178 WeakPolarHBondContact CB-SG 3.39Å; C101-C178 WeakPolarHBondContact SG-CB 3.31Å; C101-C178 CovalentContact SG-SG 2.02Å; C101-C178 PolarHBondContact SG-SG 3.39Å |
| 179 | S | 82.9 | Confident | 83.3 | Confident | 32 Ų | 32 | 84.1 Ų | 84.1 | 22% | 0.224 | 43% | 0.428 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -144.8 | 162.6 | -172.8 | 96.3 | 0 | 0 | 0 | 0 | 112.5 | T167 R168 H181 | T167-S179 WeakPolarHBondContact CA-O 3.5Å; R168-S179 PolarHBondContact N-O 3.16Å; R168-S179 PolarHBondContact O-N 3.43Å; R168-S179 VanDerWaalsContact O-N 3.11Å; S179-H181 PolarHBondContact O-CD2 2.92Å; S179-H181 PolarHBondContact O-NE2 3.45Å; S179-H181 PolarHBondContact OG-CE1 3.23Å; S179-H181 PolarHBondContact OG-NE2 3.49Å |
| 180 | S | 84.8 | Confident | 83.6 | Confident | 53 Ų | 53 | 85.8 Ų | 85.8 | 37% | 0.371 | 43% | 0.431 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -81.6 | 119.8 | -179 | -60.2 | 0 | 0 | 0 | 0 | 111.2 | T167 | T167-S180 PolarHBondContact OG1-OG 3.18Å |
| 181 | H | 85.5 | Confident | 84 | Confident | 51 Ų | 51 | 84.2 Ų | 84.2 | 24% | 0.236 | 42% | 0.423 | C | S | . | . | trans | -111.5 | 110.7 | 178.2 | -64.2 | -67.1 | 0 | 0 | 0 | 110.5 | F166 Q170 E172 S179 | F166-H181 PolarHBondContact O-N 3.43Å; Q170-H181 WeakPolarHBondContact CG-NE2 3.32Å; Q170-H181 PolarHBondContact NE2-CE1 3.34Å; Q170-H181 PolarHBondContact NE2-ND1 3.41Å; Q170-H181 PolarHBondContact NE2-NE2 3.04Å; E172-H181 IonicContact OE1-CE1 3.57Å; E172-H181 PolarHBondContact OE1-CE1 2.93Å; E172-H181 VanDerWaalsContact OE1-CE1 3.27Å; E172-H181 IonicContact OE1-NE2 2.79Å; S179-H181 PolarHBondContact O-CD2 2.92Å; S179-H181 PolarHBondContact O-NE2 3.45Å; S179-H181 PolarHBondContact OG-CE1 3.23Å; S179-H181 PolarHBondContact OG-NE2 3.49Å | ||
| 182 | F | 88.1 | Confident | 84.7 | Confident | 31 Ų | 31 | 80 Ų | 80 | 14% | 0.136 | 41% | 0.406 | C | S | . | . | trans | -91.8 | 148.2 | 176.2 | -55.7 | -59.3 | 0 | 0 | 0 | 111.2 | F166 Y184 Y187 W190 K191 Q194 | F166-F182 HydrophobicContact CB-CD1 3.92Å; F166-F182 HydrophobicContact CB-CE1 3.83Å; F166-F182 AromaticContact CD1-CD1 3.98Å; F166-F182 HydrophobicContact CD1-CD1 3.98Å; F166-F182 AromaticContact CD2-CD1 3.94Å; F166-F182 HydrophobicContact CD2-CD1 3.94Å; F166-F182 AromaticContact CD2-CE1 3.83Å; F166-F182 HydrophobicContact CD2-CE1 3.83Å; F166-F182 AromaticContact CG-CD1 3.67Å; F166-F182 HydrophobicContact CG-CD1 3.67Å; F166-F182 AromaticContact CG-CE1 3.84Å; F166-F182 HydrophobicContact CG-CE1 3.84Å; F182-Y184 PolarHBondContact O-N 3.02Å; F182-Y187 HydrophobicContact CB-CD2 3.91Å; F182-Y187 HydrophobicContact CB-CE2 4.42Å; F182-Y187 HydrophobicContact CD2-CD2 4.35Å; F182-Y187 HydrophobicContact CD2-CE2 4.11Å; F182-W190 HydrophobicContact CB-CB 3.97Å; F182-W190 HydrophobicContact CD1-CB 3.53Å; F182-W190 HydrophobicContact CD1-CG 4.44Å; F182-W190 HydrophobicContact CE1-CB 4.19Å; F182-W190 HydrophobicContact CG-CB 3.81Å; F182-K191 HydrophobicContact CD2-CB 4.17Å; F182-K191 HydrophobicContact CE2-CB 4.13Å; F182-K191 HydrophobicContact CE2-CG 4.47Å; F182-Q194 HydrophobicContact CZ-CB 4.2Å; F182-Q194 HydrophobicContact CZ-CG 4.41Å | ||
| 183 | P | 87.4 | Confident | 85.7 | Confident | 53 Ų | 53 | 80.1 Ų | 80.1 | 34% | 0.344 | 41% | 0.405 | S | S | . | . | trans | -58.7 | 129.9 | 176.1 | -20.4 | 30.8 | 0 | 0 | 0 | 111.5 | F166 S185 Q186 Y187 | F166-P183 HydrophobicContact CE1-CG 4.14Å; P183-S185 VanDerWaalsContact C-N 3.26Å; P183-S185 PolarHBondContact O-N 3.2Å; P183-Q186 CarbonylContact O-C 3.59Å; P183-Q186 PolarHBondContact O-N 2.9Å; P183-Y187 WeakPolarHBondContact O-CA 3.29Å; P183-Y187 PolarHBondContact O-N 3.21Å | ||
| 184 | Y | 85.8 | Confident | 86.6 | Confident | 224 Ų | 224 | 77.5 Ų | 77.5 | 88% | 0.878 | 38% | 0.375 | S | S | * | . | G | 310 helix | trans | -55.1 | -38.9 | -177.3 | -68.5 | -76.7 | 0 | 0 | 0 | 113.5 | F182 Q186 Y187 | F182-Y184 PolarHBondContact O-N 3.02Å; Y184-Q186 PolarHBondContact O-N 2.95Å; Y184-Y187 PolarHBondContact O-N 3.11Å |
| 185 | S | 89 | Confident | 87.6 | Confident | 113 Ų | 113 | 70.9 Ų | 70.9 | 79% | 0.79 | 34% | 0.341 | S | S | * | . | G | 310 helix | trans | -62.8 | -23.7 | 179.6 | 55.8 | 0 | 0 | 0 | 0 | 114.1 | P183 | P183-S185 VanDerWaalsContact C-N 3.26Å; P183-S185 PolarHBondContact O-N 3.2Å |
| 186 | Q | 90.6 | Very high | 88.5 | Confident | 101 Ų | 101 | 69.3 Ų | 69.3 | 47% | 0.472 | 34% | 0.336 | S | S | . | . | G | 310 helix | trans | -134.2 | 26.8 | -176.1 | -66.5 | -178.4 | -20.2 | 0 | 0 | 111.5 | P183 Y184 Q188 F189 W190 | P183-Q186 CarbonylContact O-C 3.59Å; P183-Q186 PolarHBondContact O-N 2.9Å; Y184-Q186 PolarHBondContact O-N 2.95Å; Q186-Q188 PolarHBondContact O-N 3.29Å; Q186-F189 HydrophobicContact CB-CB 4.41Å; Q186-F189 WeakPolarHBondContact O-CB 3.42Å; Q186-F189 PolarHBondContact O-N 3.49Å; Q186-F189 VanDerWaalsContact O-N 3.11Å; Q186-W190 VanDerWaalsContact O-CD1 3.32Å; Q186-W190 PolarHBondContact O-N 3.15Å; Q186-W190 VanDerWaalsContact OE1-NE1 3.1Å |
| 187 | Y | 88.6 | Confident | 89.3 | Confident | 105 Ų | 105 | 65.1 Ų | 65.1 | 41% | 0.412 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -55.6 | -50.2 | -170.8 | 176 | -93.5 | 0 | 0 | 0 | 111.8 | F182 P183 Y184 F189 W190 K191 | F182-Y187 HydrophobicContact CB-CD2 3.91Å; F182-Y187 HydrophobicContact CB-CE2 4.42Å; F182-Y187 HydrophobicContact CD2-CD2 4.35Å; F182-Y187 HydrophobicContact CD2-CE2 4.11Å; P183-Y187 WeakPolarHBondContact O-CA 3.29Å; P183-Y187 PolarHBondContact O-N 3.21Å; Y184-Y187 PolarHBondContact O-N 3.11Å; Y187-F189 VanDerWaalsContact C-N 3.32Å; Y187-F189 PolarHBondContact O-N 2.96Å; Y187-W190 PolarHBondContact O-N 3.48Å; Y187-K191 HydrophobicContact CE1-CD 3.86Å; Y187-K191 VanDerWaalsContact O-CB 3.27Å; Y187-K191 WeakPolarHBondContact O-CB 3.44Å; Y187-K191 PolarHBondContact O-N 3.45Å |
| 188 | Q | 88.9 | Confident | 90 | Very high | 88 Ų | 88 | 64.7 Ų | 64.7 | 41% | 0.411 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -64.4 | -37.4 | -179.2 | -167.2 | 63.1 | 41.3 | 0 | 0 | 112.3 | Q186 N192 | Q186-Q188 PolarHBondContact O-N 3.29Å; Q188-N192 PolarHBondContact NE2-OD1 3.32Å; Q188-N192 VanDerWaalsContact O-CB 3.22Å; Q188-N192 WeakPolarHBondContact O-CB 3.11Å; Q188-N192 PolarHBondContact O-N 2.96Å; Q188-N192 PolarHBondContact O-ND2 2.93Å; Q188-N192 PolarHBondContact O-OD1 3.14Å |
| 189 | F | 91.9 | Very high | 90.5 | Very high | 125 Ų | 125 | 64 Ų | 64 | 55% | 0.548 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -63.1 | -51.4 | 178.7 | 175 | -94 | 0 | 0 | 0 | 111.1 | Q186 Y187 N192 F193 | Q186-F189 HydrophobicContact CB-CB 4.41Å; Q186-F189 WeakPolarHBondContact O-CB 3.42Å; Q186-F189 PolarHBondContact O-N 3.49Å; Q186-F189 VanDerWaalsContact O-N 3.11Å; Y187-F189 VanDerWaalsContact C-N 3.32Å; Y187-F189 PolarHBondContact O-N 2.96Å; F189-N192 PolarHBondContact O-N 3Å; F189-F193 VanDerWaalsContact O-CB 3.27Å; F189-F193 WeakPolarHBondContact O-CB 3.28Å; F189-F193 PolarHBondContact O-N 3.46Å |
| 190 | W | 92.2 | Very high | 91.2 | Very high | 61 Ų | 61 | 66.6 Ų | 66.6 | 23% | 0.231 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -69 | -37.7 | -178.7 | -73.3 | 108 | 0 | 0 | 0 | 112.8 | F166 F182 Q186 Y187 F193 Q194 | F166-W190 HydrophobicContact CD2-CE3 4.34Å; F166-W190 HydrophobicContact CE1-CD2 4.27Å; F166-W190 AromaticContact CE2-CD2 3.73Å; F166-W190 HydrophobicContact CE2-CD2 3.73Å; F166-W190 AromaticContact CE2-CE3 3.24Å; F166-W190 HydrophobicContact CE2-CE3 3.24Å; F166-W190 HydrophobicContact CE2-CG 4.42Å; F166-W190 HydrophobicContact CE2-CH2 4.14Å; F166-W190 AromaticContact CE2-CZ3 3.48Å; F166-W190 HydrophobicContact CE2-CZ3 3.48Å; F166-W190 VanDerWaalsContact CE2-CZ3 3.48Å; F166-W190 AromaticContact CZ-CD2 3.4Å; F166-W190 HydrophobicContact CZ-CD2 3.4Å; F166-W190 VanDerWaalsContact CZ-CD2 3.4Å; F166-W190 AromaticContact CZ-CE2 3.64Å; F166-W190 AromaticContact CZ-CE3 3.4Å; F166-W190 HydrophobicContact CZ-CE3 3.4Å; F166-W190 HydrophobicContact CZ-CG 4.04Å; F166-W190 AromaticContact CZ-CH2 3.83Å; F166-W190 HydrophobicContact CZ-CH2 3.83Å; F166-W190 AromaticContact CZ-CZ2 3.85Å; F166-W190 HydrophobicContact CZ-CZ2 3.85Å; F166-W190 AromaticContact CZ-CZ3 3.62Å; F166-W190 HydrophobicContact CZ-CZ3 3.62Å; F182-W190 HydrophobicContact CB-CB 3.97Å; F182-W190 HydrophobicContact CD1-CB 3.53Å; F182-W190 HydrophobicContact CD1-CG 4.44Å; F182-W190 HydrophobicContact CE1-CB 4.19Å; F182-W190 HydrophobicContact CG-CB 3.81Å; Q186-W190 VanDerWaalsContact O-CD1 3.32Å; Q186-W190 PolarHBondContact O-N 3.15Å; Q186-W190 VanDerWaalsContact OE1-NE1 3.1Å; Y187-W190 PolarHBondContact O-N 3.48Å; W190-F193 HydrophobicContact CE3-CD1 4.13Å; W190-F193 HydrophobicContact CZ3-CD1 4.16Å; W190-F193 HydrophobicContact CZ3-CE1 4.4Å; W190-F193 PolarHBondContact O-N 3.14Å; W190-Q194 WeakPolarHBondContact O-CB 3.5Å; W190-Q194 PolarHBondContact O-N 3.06Å |
| 191 | K | 90.1 | Very high | 91.7 | Very high | 44 Ų | 44 | 66.1 Ų | 66.1 | 19% | 0.191 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -59.3 | -50 | 172.2 | -173 | -177.4 | 176.4 | -175.9 | 0 | 111 | F182 Y187 Q194 T195 T259 | F182-K191 HydrophobicContact CD2-CB 4.17Å; F182-K191 HydrophobicContact CE2-CB 4.13Å; F182-K191 HydrophobicContact CE2-CG 4.47Å; Y187-K191 HydrophobicContact CE1-CD 3.86Å; Y187-K191 VanDerWaalsContact O-CB 3.27Å; Y187-K191 WeakPolarHBondContact O-CB 3.44Å; Y187-K191 PolarHBondContact O-N 3.45Å; K191-Q194 PolarHBondContact O-N 3.41Å; K191-T195 PolarHBondContact O-N 3.06Å; K191-T195 VanDerWaalsContact O-N 3.11Å; K191-T195 PolarHBondContact O-OG1 3.33Å; K191-T259 HydrophobicContact CG-CG2 4.2Å |
| 192 | N | 92.9 | Very high | 92.1 | Very high | 39 Ų | 39 | 63.7 Ų | 63.7 | 21% | 0.209 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -62.8 | -45.8 | 177.6 | -71.6 | -6.3 | 0 | 0 | 0 | 111.8 | Q188 F189 Q194 T195 L196 T259 | Q188-N192 PolarHBondContact NE2-OD1 3.32Å; Q188-N192 VanDerWaalsContact O-CB 3.22Å; Q188-N192 WeakPolarHBondContact O-CB 3.11Å; Q188-N192 PolarHBondContact O-N 2.96Å; Q188-N192 PolarHBondContact O-ND2 2.93Å; Q188-N192 PolarHBondContact O-OD1 3.14Å; F189-N192 PolarHBondContact O-N 3Å; N192-Q194 PolarHBondContact O-N 2.99Å; N192-T195 PolarHBondContact O-N 3.33Å; N192-L196 VanDerWaalsContact O-CB 3.31Å; N192-L196 WeakPolarHBondContact O-CB 3.31Å; N192-L196 VanDerWaalsContact O-CG 3.26Å; N192-L196 WeakPolarHBondContact O-CG 3.49Å; N192-L196 PolarHBondContact O-N 3.48Å; N192-T259 WeakPolarHBondContact OD1-CG2 3.35Å |
| 193 | F | 94.3 | Very high | 92.4 | Very high | 88 Ų | 88 | 63.5 Ų | 63.5 | 39% | 0.386 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -58.6 | -47.4 | 179.3 | 176.1 | -97.9 | 0 | 0 | 0 | 111.5 | P162 F189 W190 K197 | P162-F193 HydrophobicContact CB-CE1 4.41Å; P162-F193 HydrophobicContact CG-CE1 4.22Å; F189-F193 VanDerWaalsContact O-CB 3.27Å; F189-F193 WeakPolarHBondContact O-CB 3.28Å; F189-F193 PolarHBondContact O-N 3.46Å; W190-F193 HydrophobicContact CE3-CD1 4.13Å; W190-F193 HydrophobicContact CZ3-CD1 4.16Å; W190-F193 HydrophobicContact CZ3-CE1 4.4Å; W190-F193 PolarHBondContact O-N 3.14Å; F193-K197 WeakPolarHBondContact O-CB 3.48Å; F193-K197 PolarHBondContact O-N 3.29Å |
| 194 | Q | 92.4 | Very high | 92.8 | Very high | 14 Ų | 14 | 64.7 Ų | 64.7 | 7% | 0.065 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -63.2 | -45.1 | -180 | -175.5 | 70 | -9.3 | 0 | 0 | 111.5 | F182 W190 K191 N192 I198 | F182-Q194 HydrophobicContact CZ-CB 4.2Å; F182-Q194 HydrophobicContact CZ-CG 4.41Å; W190-Q194 WeakPolarHBondContact O-CB 3.5Å; W190-Q194 PolarHBondContact O-N 3.06Å; K191-Q194 PolarHBondContact O-N 3.41Å; N192-Q194 PolarHBondContact O-N 2.99Å; Q194-I198 HydrophobicContact CG-CD1 4.2Å; Q194-I198 WeakPolarHBondContact O-CG1 3.06Å; Q194-I198 PolarHBondContact O-N 2.86Å; Q194-I198 VanDerWaalsContact O-N 3.12Å |
| 195 | T | 93.4 | Very high | 93.3 | Very high | 8 Ų | 8 | 57.1 Ų | 57.1 | 5% | 0.049 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -64.7 | -49.6 | 177.8 | -66.1 | 0 | 0 | 0 | 0 | 112 | K191 N192 K197 I198 V199 L255 L256 T259 | K191-T195 PolarHBondContact O-N 3.06Å; K191-T195 VanDerWaalsContact O-N 3.11Å; K191-T195 PolarHBondContact O-OG1 3.33Å; N192-T195 PolarHBondContact O-N 3.33Å; T195-K197 VanDerWaalsContact C-N 3.3Å; T195-K197 PolarHBondContact O-N 2.77Å; T195-I198 PolarHBondContact O-N 3.34Å; T195-V199 HydrophobicContact CG2-CG2 4.27Å; T195-V199 WeakPolarHBondContact O-CG2 3.23Å; T195-V199 PolarHBondContact O-N 3.22Å; T195-L255 HydrophobicContact CG2-CD2 4.33Å; T195-L255 HydrophobicContact CG2-CG 3.93Å; T195-L256 HydrophobicContact CG2-CD1 4.36Å; T195-T259 WeakPolarHBondContact CB-OG1 3.3Å; T195-T259 HydrophobicContact CG2-CG2 4.16Å; T195-T259 WeakPolarHBondContact CG2-OG1 3.44Å; T195-T259 PolarHBondContact OG1-OG1 2.87Å |
| 196 | L | 95.5 | Very high | 93.5 | Very high | 72 Ų | 72 | 51.7 Ų | 51.7 | 38% | 0.377 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -61.3 | -40.3 | 179.3 | -71.1 | 175.1 | 0 | 0 | 0 | 111.3 | N192 I198 V199 I200 F260 | N192-L196 VanDerWaalsContact O-CB 3.31Å; N192-L196 WeakPolarHBondContact O-CB 3.31Å; N192-L196 VanDerWaalsContact O-CG 3.26Å; N192-L196 WeakPolarHBondContact O-CG 3.49Å; N192-L196 PolarHBondContact O-N 3.48Å; L196-I198 PolarHBondContact O-N 3.19Å; L196-V199 PolarHBondContact O-N 3.01Å; L196-I200 HydrophobicContact CB-CD1 4.22Å; L196-I200 WeakPolarHBondContact O-CB 3.33Å; L196-I200 WeakPolarHBondContact O-CD1 3.11Å; L196-I200 WeakPolarHBondContact O-CG1 3.3Å; L196-I200 PolarHBondContact O-N 3.48Å; L196-F260 HydrophobicContact CD2-CE2 4.35Å; L196-F260 HydrophobicContact CD2-CZ 4.42Å |
| 197 | K | 95.9 | Very high | 93.7 | Very high | 22 Ų | 22 | 51 Ų | 51 | 10% | 0.096 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -57.7 | -49.1 | 174.9 | -178.4 | -157.3 | 73.9 | 178.1 | 0 | 111.6 | F113 A159 F193 T195 L201 | F113-K197 HydrophobicContact CZ-CD 4.47Å; A159-K197 PolarHBondContact O-NZ 2.89Å; F193-K197 WeakPolarHBondContact O-CB 3.48Å; F193-K197 PolarHBondContact O-N 3.29Å; T195-K197 VanDerWaalsContact C-N 3.3Å; T195-K197 PolarHBondContact O-N 2.77Å; K197-L201 HydrophobicContact CG-CD1 3.87Å; K197-L201 WeakPolarHBondContact O-CB 3.28Å; K197-L201 WeakPolarHBondContact O-CG 3.46Å; K197-L201 PolarHBondContact O-N 3.42Å |
| 198 | I | 94.8 | Very high | 94.1 | Very high | 8 Ų | 8 | 50.7 Ų | 50.7 | 4% | 0.041 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -62.6 | -47.9 | 179.6 | -68 | 165.2 | 0 | 0 | 0 | 110.3 | F109 F112 F113 Q194 T195 L196 G202 N252 L255 | F109-I198 HydrophobicContact CE1-CD1 4.01Å; F112-I198 HydrophobicContact CE1-CG2 4.2Å; F112-I198 HydrophobicContact CZ-CG2 4.28Å; F113-I198 HydrophobicContact CZ-CG1 4.23Å; Q194-I198 HydrophobicContact CG-CD1 4.2Å; Q194-I198 WeakPolarHBondContact O-CG1 3.06Å; Q194-I198 PolarHBondContact O-N 2.86Å; Q194-I198 VanDerWaalsContact O-N 3.12Å; T195-I198 PolarHBondContact O-N 3.34Å; L196-I198 PolarHBondContact O-N 3.19Å; I198-G202 VanDerWaalsContact O-CA 3.28Å; I198-G202 WeakPolarHBondContact O-CA 3.49Å; I198-G202 PolarHBondContact O-N 3Å; I198-N252 WeakPolarHBondContact CG2-OD1 3.38Å; I198-N252 PolarHBondContact O-OD1 3.3Å; I198-L255 HydrophobicContact CB-CD2 4.06Å; I198-L255 HydrophobicContact CD1-CD2 3.98Å; I198-L255 HydrophobicContact CG2-CD2 3.8Å |
| 199 | V | 95.9 | Very high | 94.4 | Very high | 13 Ų | 13 | 47.4 Ų | 47.4 | 8% | 0.079 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -67.2 | -42.8 | -178.6 | 173.7 | 0 | 0 | 0 | 0 | 111.9 | T195 L196 L203 V204 N252 L256 | T195-V199 HydrophobicContact CG2-CG2 4.27Å; T195-V199 WeakPolarHBondContact O-CG2 3.23Å; T195-V199 PolarHBondContact O-N 3.22Å; L196-V199 PolarHBondContact O-N 3.01Å; V199-L203 WeakPolarHBondContact O-CA 3.24Å; V199-L203 VanDerWaalsContact O-CB 3.28Å; V199-L203 WeakPolarHBondContact O-CB 3.46Å; V199-L203 PolarHBondContact O-N 2.89Å; V199-V204 HydrophobicContact CG1-CG2 4.26Å; V199-V204 PolarHBondContact O-N 3.13Å; V199-N252 HydrophobicContact CG2-CB 4.42Å; V199-L256 HydrophobicContact CG2-CB 4.44Å; V199-L256 HydrophobicContact CG2-CD1 4.43Å |
| 200 | I | 96.6 | Very high | 94.3 | Very high | 85 Ų | 85 | 43 Ų | 43 | 44% | 0.436 | 22% | 0.218 | S | C | . | . | I | π-helix | trans | -66 | -50.2 | -179.3 | -69.7 | 166.7 | 0 | 0 | 0 | 110.1 | L196 V204 L205 | L196-I200 HydrophobicContact CB-CD1 4.22Å; L196-I200 WeakPolarHBondContact O-CB 3.33Å; L196-I200 WeakPolarHBondContact O-CD1 3.11Å; L196-I200 WeakPolarHBondContact O-CG1 3.3Å; L196-I200 PolarHBondContact O-N 3.48Å; I200-V204 PolarHBondContact O-N 3.25Å; I200-L205 VanDerWaalsContact O-CB 3.23Å; I200-L205 WeakPolarHBondContact O-CB 3.41Å; I200-L205 PolarHBondContact O-N 2.92Å |
| 201 | L | 96.4 | Very high | 94.4 | Very high | 43 Ų | 43 | 44.3 Ų | 44.3 | 23% | 0.225 | 23% | 0.233 | C | C | . | . | I | π-helix | trans | -77.8 | -33.6 | -175.7 | -61.6 | 178 | 0 | 0 | 0 | 112.8 | F113 F117 A159 K197 L205 P206 | F113-L201 HydrophobicContact CD1-CB 4.26Å; F113-L201 HydrophobicContact CD1-CD1 4.33Å; F113-L201 HydrophobicContact CE1-CB 4Å; F113-L201 HydrophobicContact CE1-CD1 4.03Å; F117-L201 HydrophobicContact CE1-CB 4.36Å; F117-L201 HydrophobicContact CE1-CD2 4.47Å; F117-L201 HydrophobicContact CZ-CB 4.5Å; F117-L201 HydrophobicContact CZ-CD1 4.31Å; F117-L201 HydrophobicContact CZ-CD2 4.49Å; A159-L201 HydrophobicContact CB-CD1 4.34Å; K197-L201 HydrophobicContact CG-CD1 3.87Å; K197-L201 WeakPolarHBondContact O-CB 3.28Å; K197-L201 WeakPolarHBondContact O-CG 3.46Å; K197-L201 PolarHBondContact O-N 3.42Å; L201-L205 HydrophobicContact CD2-CD2 4.25Å; L201-P206 WeakPolarHBondContact O-CD 3.31Å |
| 202 | G | 93.1 | Very high | 94.6 | Very high | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 25% | 0.246 | C | C | . | . | I | π-helix | trans | -92.6 | -19.9 | -175.9 | 0 | 0 | 0 | 0 | 0 | 115 | I198 P206 Y244 | I198-G202 VanDerWaalsContact O-CA 3.28Å; I198-G202 WeakPolarHBondContact O-CA 3.49Å; I198-G202 PolarHBondContact O-N 3Å; G202-P206 WeakPolarHBondContact O-CG 3.32Å; G202-Y244 VanDerWaalsContact O-CE1 3.31Å; G202-Y244 WeakPolarHBondContact O-CE1 3.23Å; G202-Y244 PolarHBondContact O-OH 3.32Å; G202-Y244 VanDerWaalsContact O-OH 3.11Å |
| 203 | L | 94.6 | Very high | 94.5 | Very high | 28 Ų | 28 | 45.1 Ų | 45.1 | 15% | 0.147 | 24% | 0.239 | C | C | . | . | I | π-helix | trans | -127.9 | -56 | -178.4 | -176.8 | 63.7 | 0 | 0 | 0 | 112.7 | V199 P206 L207 F245 A249 N252 I253 | V199-L203 WeakPolarHBondContact O-CA 3.24Å; V199-L203 VanDerWaalsContact O-CB 3.28Å; V199-L203 WeakPolarHBondContact O-CB 3.46Å; V199-L203 PolarHBondContact O-N 2.89Å; L203-P206 WeakPolarHBondContact O-CD 3.25Å; L203-P206 WeakPolarHBondContact O-CG 3.26Å; L203-L207 WeakPolarHBondContact O-CB 3.43Å; L203-L207 PolarHBondContact O-N 3.22Å; L203-L207 VanDerWaalsContact O-N 3.13Å; L203-F245 HydrophobicContact CD1-CD1 3.79Å; L203-F245 HydrophobicContact CD1-CE1 3.89Å; L203-A249 HydrophobicContact CD1-CB 3.75Å; L203-N252 HydrophobicContact CB-CB 4.2Å; L203-N252 HydrophobicContact CD2-CB 3.97Å; L203-I253 HydrophobicContact CD2-CG1 4.45Å |
| 204 | V | 96.4 | Very high | 94.2 | Very high | 78 Ų | 78 | 42.3 Ų | 42.3 | 47% | 0.473 | 23% | 0.226 | S | C | . | . | I | π-helix | trans | -68.2 | -49.8 | -171.8 | -179.1 | 0 | 0 | 0 | 0 | 111.7 | V199 I200 L207 L208 | V199-V204 HydrophobicContact CG1-CG2 4.26Å; V199-V204 PolarHBondContact O-N 3.13Å; I200-V204 PolarHBondContact O-N 3.25Å; V204-L207 PolarHBondContact O-N 2.94Å; V204-L208 WeakPolarHBondContact O-CB 3.3Å; V204-L208 PolarHBondContact O-N 3.44Å |
| 205 | L | 96 | Very high | 94.1 | Very high | 64 Ų | 64 | 45 Ų | 45 | 34% | 0.335 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -59.1 | -53.9 | 179.3 | 178.5 | 66.6 | 0 | 0 | 0 | 112.7 | F117 I120 I200 L201 L207 L208 V209 | F117-L205 HydrophobicContact CE1-CD2 4.39Å; I120-L205 HydrophobicContact CD1-CD2 3.97Å; I120-L205 HydrophobicContact CD1-CG 4Å; I200-L205 VanDerWaalsContact O-CB 3.23Å; I200-L205 WeakPolarHBondContact O-CB 3.41Å; I200-L205 PolarHBondContact O-N 2.92Å; L201-L205 HydrophobicContact CD2-CD2 4.25Å; L205-L207 VanDerWaalsContact C-N 3.26Å; L205-L207 PolarHBondContact O-N 3.16Å; L205-L208 PolarHBondContact O-N 2.91Å; L205-V209 HydrophobicContact CD1-CG2 4.49Å; L205-V209 WeakPolarHBondContact O-CG2 3.47Å; L205-V209 PolarHBondContact O-N 2.9Å |
| 206 | P | 93.8 | Very high | 93.8 | Very high | 0 Ų | 0 | 45.3 Ų | 45.3 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -63.7 | -32.9 | 178.9 | 23.8 | -33.7 | 0 | 0 | 0 | 112.3 | I116 I120 L201 G202 L203 V209 M210 M241 F245 | I116-P206 HydrophobicContact CD1-CB 3.56Å; I116-P206 HydrophobicContact CD1-CG 3.83Å; I116-P206 HydrophobicContact CG1-CB 3.98Å; I116-P206 HydrophobicContact CG1-CG 3.84Å; I120-P206 HydrophobicContact CD1-CB 3.97Å; I120-P206 HydrophobicContact CG1-CB 3.95Å; L201-P206 WeakPolarHBondContact O-CD 3.31Å; G202-P206 WeakPolarHBondContact O-CG 3.32Å; L203-P206 WeakPolarHBondContact O-CD 3.25Å; L203-P206 WeakPolarHBondContact O-CG 3.26Å; P206-V209 PolarHBondContact O-N 2.81Å; P206-M210 VanDerWaalsContact O-CB 3.26Å; P206-M210 WeakPolarHBondContact O-CB 3.49Å; P206-M210 PolarHBondContact O-N 3.22Å; P206-M241 HydrophobicContact CB-SD 4.36Å; P206-F245 HydrophobicContact CB-CE1 4.26Å; P206-F245 HydrophobicContact CB-CZ 3.82Å; P206-F245 HydrophobicContact CG-CE1 4.01Å; P206-F245 HydrophobicContact CG-CZ 4.07Å |
| 207 | L | 94.6 | Very high | 93.4 | Very high | 87 Ų | 87 | 42 Ų | 42 | 46% | 0.455 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -69 | -41.4 | 178.1 | -172.2 | 142.4 | 0 | 0 | 0 | 111.3 | L203 V204 L205 M210 V211 F245 | L203-L207 WeakPolarHBondContact O-CB 3.43Å; L203-L207 PolarHBondContact O-N 3.22Å; L203-L207 VanDerWaalsContact O-N 3.13Å; V204-L207 PolarHBondContact O-N 2.94Å; L205-L207 VanDerWaalsContact C-N 3.26Å; L205-L207 PolarHBondContact O-N 3.16Å; L207-M210 WeakPolarHBondContact O-CB 3.31Å; L207-M210 PolarHBondContact O-N 3.45Å; L207-V211 HydrophobicContact CD2-CG2 4.4Å; L207-V211 WeakPolarHBondContact O-CG2 3.23Å; L207-V211 PolarHBondContact O-N 2.9Å; L207-F245 HydrophobicContact CB-CE1 4.18Å; L207-F245 HydrophobicContact CB-CZ 3.96Å |
| 208 | L | 96.1 | Very high | 92.9 | Very high | 97 Ų | 97 | 46 Ų | 46 | 51% | 0.508 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -60.2 | -48.5 | 173.1 | -179.8 | 64.2 | 0 | 0 | 0 | 111.4 | V204 L205 M210 V211 I212 | V204-L208 WeakPolarHBondContact O-CB 3.3Å; V204-L208 PolarHBondContact O-N 3.44Å; L205-L208 PolarHBondContact O-N 2.91Å; L208-M210 VanDerWaalsContact C-N 3.27Å; L208-M210 PolarHBondContact O-N 3.08Å; L208-V211 PolarHBondContact O-N 3.1Å; L208-I212 HydrophobicContact CD1-CD1 3.8Å; L208-I212 HydrophobicContact CD1-CG1 4.35Å; L208-I212 HydrophobicContact CG-CD1 3.88Å; L208-I212 WeakPolarHBondContact O-CG1 3.4Å; L208-I212 PolarHBondContact O-N 3.17Å; L208-I212 VanDerWaalsContact O-N 3.07Å |
| 209 | V | 94.8 | Very high | 92.5 | Very high | 19 Ų | 19 | 53.5 Ų | 53.5 | 12% | 0.115 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -58.6 | -42.8 | 176.4 | 171.3 | 0 | 0 | 0 | 0 | 110.4 | I120 T123 I124 L205 P206 C213 | I120-V209 HydrophobicContact CG2-CG1 4.22Å; I120-V209 HydrophobicContact CG2-CG2 4.05Å; T123-V209 HydrophobicContact CG2-CG1 4.09Å; I124-V209 HydrophobicContact CG1-CG1 4.09Å; L205-V209 HydrophobicContact CD1-CG2 4.49Å; L205-V209 WeakPolarHBondContact O-CG2 3.47Å; L205-V209 PolarHBondContact O-N 2.9Å; P206-V209 PolarHBondContact O-N 2.81Å; V209-C213 WeakPolarHBondContact O-CB 3.45Å; V209-C213 PolarHBondContact O-N 3.09Å; V209-C213 PolarHBondContact O-SG 2.81Å |
| 210 | M | 91.3 | Very high | 91.8 | Very high | 32 Ų | 32 | 54.4 Ų | 54.4 | 16% | 0.158 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -60.2 | -51.4 | 178.6 | -175.6 | -171 | 176.9 | 0 | 0 | 111.3 | P206 L207 L208 I212 C213 Y214 F238 M241 I242 F245 | P206-M210 VanDerWaalsContact O-CB 3.26Å; P206-M210 WeakPolarHBondContact O-CB 3.49Å; P206-M210 PolarHBondContact O-N 3.22Å; L207-M210 WeakPolarHBondContact O-CB 3.31Å; L207-M210 PolarHBondContact O-N 3.45Å; L208-M210 VanDerWaalsContact C-N 3.27Å; L208-M210 PolarHBondContact O-N 3.08Å; M210-I212 PolarHBondContact O-N 3.35Å; M210-C213 PolarHBondContact O-N 2.95Å; M210-Y214 HydrophobicContact CB-CD2 4.35Å; M210-Y214 HydrophobicContact CG-CD2 3.58Å; M210-Y214 HydrophobicContact CG-CE2 4.01Å; M210-Y214 VanDerWaalsContact O-CB 3.31Å; M210-Y214 WeakPolarHBondContact O-CB 3.42Å; M210-Y214 VanDerWaalsContact O-CD2 3.31Å; M210-Y214 WeakPolarHBondContact O-CD2 3.38Å; M210-Y214 PolarHBondContact O-N 2.69Å; M210-F238 HydrophobicContact CE-CD2 4.24Å; M210-F238 HydrophobicContact CE-CE2 3.56Å; M210-F238 HydrophobicContact CE-CZ 4.28Å; M210-M241 HydrophobicContact CB-CG 4.49Å; M210-M241 HydrophobicContact CG-CG 4.2Å; M210-M241 HydrophobicContact SD-CG 4.03Å; M210-I242 HydrophobicContact CE-CD1 3.3Å; M210-I242 HydrophobicContact CE-CG1 4.22Å; M210-I242 HydrophobicContact SD-CD1 4.49Å; M210-F245 HydrophobicContact SD-CD2 4.07Å; M210-F245 HydrophobicContact SD-CE2 3.58Å; M210-F245 VanDerWaalsContact SD-CE2 3.58Å |
| 211 | V | 93.3 | Very high | 90.8 | Very high | 89 Ų | 89 | 51.5 Ų | 51.5 | 54% | 0.539 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -59.7 | -47.1 | -179.2 | 171.8 | 0 | 0 | 0 | 0 | 111.2 | L207 L208 S215 | L207-V211 HydrophobicContact CD2-CG2 4.4Å; L207-V211 WeakPolarHBondContact O-CG2 3.23Å; L207-V211 PolarHBondContact O-N 2.9Å; L208-V211 PolarHBondContact O-N 3.1Å; V211-S215 WeakPolarHBondContact O-CB 3.38Å; V211-S215 PolarHBondContact O-N 3.44Å; V211-S215 VanDerWaalsContact O-N 3.17Å; V211-S215 PolarHBondContact O-OG 3.08Å |
| 212 | I | 93.8 | Very high | 90 | Very high | 93 Ų | 93 | 56 Ų | 56 | 48% | 0.477 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -66.6 | -48.9 | -179.2 | -63.8 | 169.6 | 0 | 0 | 0 | 111 | L208 M210 S215 G216 | L208-I212 HydrophobicContact CD1-CD1 3.8Å; L208-I212 HydrophobicContact CD1-CG1 4.35Å; L208-I212 HydrophobicContact CG-CD1 3.88Å; L208-I212 WeakPolarHBondContact O-CG1 3.4Å; L208-I212 PolarHBondContact O-N 3.17Å; L208-I212 VanDerWaalsContact O-N 3.07Å; M210-I212 PolarHBondContact O-N 3.35Å; I212-S215 PolarHBondContact O-OG 3.17Å; I212-G216 PolarHBondContact O-N 3.45Å |
| 213 | C | 92.1 | Very high | 89.3 | Confident | 8 Ų | 8 | 66.7 Ų | 66.7 | 5% | 0.054 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -69.7 | -46.9 | -174.8 | -68.5 | 0 | 0 | 0 | 0 | 111.7 | T123 Y127 V209 M210 G216 I217 | T123-C213 HydrophobicContact CG2-CB 3.73Å; Y127-C213 HydrophobicContact CD2-CB 3.94Å; Y127-C213 WeakPolarHBondContact CD2-O 3.45Å; Y127-C213 HydrophobicContact CG-CB 4.14Å; V209-C213 WeakPolarHBondContact O-CB 3.45Å; V209-C213 PolarHBondContact O-N 3.09Å; V209-C213 PolarHBondContact O-SG 2.81Å; M210-C213 PolarHBondContact O-N 2.95Å; C213-G216 PolarHBondContact O-N 3.03Å; C213-I217 WeakPolarHBondContact O-CB 3.27Å; C213-I217 WeakPolarHBondContact O-CD1 3.47Å; C213-I217 VanDerWaalsContact O-CG1 3.23Å; C213-I217 WeakPolarHBondContact O-CG1 3.39Å; C213-I217 PolarHBondContact O-N 3.21Å |
| 214 | Y | 88 | Confident | 87.9 | Confident | 28 Ų | 28 | 68.3 Ų | 68.3 | 11% | 0.11 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -73.2 | -30.4 | -175.7 | -77.4 | -77.1 | 0 | 0 | 0 | 113.2 | T123 M210 I217 L218 V234 I237 F238 | T123-Y214 HydrophobicContact CG2-CD2 4.42Å; T123-Y214 HydrophobicContact CG2-CE2 3.79Å; M210-Y214 HydrophobicContact CB-CD2 4.35Å; M210-Y214 HydrophobicContact CG-CD2 3.58Å; M210-Y214 HydrophobicContact CG-CE2 4.01Å; M210-Y214 VanDerWaalsContact O-CB 3.31Å; M210-Y214 WeakPolarHBondContact O-CB 3.42Å; M210-Y214 VanDerWaalsContact O-CD2 3.31Å; M210-Y214 WeakPolarHBondContact O-CD2 3.38Å; M210-Y214 PolarHBondContact O-N 2.69Å; Y214-I217 HydrophobicContact CD1-CD1 4.24Å; Y214-I217 HydrophobicContact CE1-CD1 4.32Å; Y214-I217 PolarHBondContact O-N 3.29Å; Y214-L218 WeakPolarHBondContact O-CB 3.42Å; Y214-L218 PolarHBondContact O-N 3.02Å; Y214-V234 HydrophobicContact CE1-CG1 4.12Å; Y214-I237 VanDerWaalsContact OH-C 3.3Å; Y214-F238 AromaticContact CD1-CD2 3.73Å; Y214-F238 HydrophobicContact CD1-CD2 3.73Å; Y214-F238 HydrophobicContact CD1-CE2 4.37Å; Y214-F238 HydrophobicContact CD2-CD2 4.24Å; Y214-F238 HydrophobicContact CE1-CB 3.69Å; Y214-F238 AromaticContact CE1-CD2 3.46Å; Y214-F238 HydrophobicContact CE1-CD2 3.46Å; Y214-F238 VanDerWaalsContact CE1-CD2 3.46Å; Y214-F238 HydrophobicContact CE1-CE2 4.49Å; Y214-F238 AromaticContact CE1-CG 4Å; Y214-F238 HydrophobicContact CE1-CG 4Å; Y214-F238 AromaticContact CE2-CD2 3.99Å; Y214-F238 HydrophobicContact CE2-CD2 3.99Å; Y214-F238 HydrophobicContact CG-CD2 4.13Å; Y214-F238 HydrophobicContact CG-CE2 4.48Å; Y214-F238 AromaticContact CZ-CD2 3.61Å; Y214-F238 WeakPolarHBondContact OH-CA 3.2Å; Y214-F238 PolarHBondContact OH-N 2.91Å |
| 215 | S | 89.2 | Confident | 86.3 | Confident | 71 Ų | 71 | 75.3 Ų | 75.3 | 50% | 0.497 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -61.9 | -45.5 | 171.6 | 59.2 | 0 | 0 | 0 | 0 | 111.7 | V211 I212 L218 K219 | V211-S215 WeakPolarHBondContact O-CB 3.38Å; V211-S215 PolarHBondContact O-N 3.44Å; V211-S215 VanDerWaalsContact O-N 3.17Å; V211-S215 PolarHBondContact O-OG 3.08Å; I212-S215 PolarHBondContact O-OG 3.17Å; S215-L218 PolarHBondContact O-N 2.96Å; S215-K219 WeakPolarHBondContact O-CB 3.4Å; S215-K219 PolarHBondContact O-N 2.83Å |
| 216 | G | 87.6 | Confident | 84.4 | Confident | 15 Ų | 15 | 79.1 Ų | 79.1 | 16% | 0.155 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -67.6 | -39.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | I212 C213 T220 | I212-G216 PolarHBondContact O-N 3.45Å; C213-G216 PolarHBondContact O-N 3.03Å; G216-T220 WeakPolarHBondContact O-CB 3.23Å; G216-T220 PolarHBondContact O-N 3.05Å; G216-T220 VanDerWaalsContact O-N 3.09Å; G216-T220 PolarHBondContact O-OG1 3.1Å |
| 217 | I | 86.2 | Confident | 83.1 | Confident | 3 Ų | 3 | 84.6 Ų | 84.6 | 2% | 0.015 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -61.4 | -49.6 | 174 | -70.6 | 164.5 | 0 | 0 | 0 | 110 | Y127 V130 V131 C213 Y214 K219 T220 L221 V234 | Y127-I217 HydrophobicContact CD2-CG1 4.19Å; V130-I217 HydrophobicContact CB-CG1 4.37Å; V130-I217 HydrophobicContact CG1-CG1 4.48Å; V130-I217 HydrophobicContact CG1-CG2 4.35Å; V131-I217 HydrophobicContact CG2-CG1 4.36Å; C213-I217 WeakPolarHBondContact O-CB 3.27Å; C213-I217 WeakPolarHBondContact O-CD1 3.47Å; C213-I217 VanDerWaalsContact O-CG1 3.23Å; C213-I217 WeakPolarHBondContact O-CG1 3.39Å; C213-I217 PolarHBondContact O-N 3.21Å; Y214-I217 HydrophobicContact CD1-CD1 4.24Å; Y214-I217 HydrophobicContact CE1-CD1 4.32Å; Y214-I217 PolarHBondContact O-N 3.29Å; I217-K219 PolarHBondContact O-N 2.98Å; I217-T220 PolarHBondContact O-N 3.1Å; I217-L221 HydrophobicContact CG2-CD1 3.66Å; I217-L221 HydrophobicContact CG2-CG 4.03Å; I217-L221 WeakPolarHBondContact O-CB 3.35Å; I217-L221 VanDerWaalsContact O-CG 3.28Å; I217-L221 WeakPolarHBondContact O-CG 3.3Å; I217-L221 PolarHBondContact O-N 3.41Å; I217-V234 HydrophobicContact CG2-CG1 3.81Å; I217-V234 HydrophobicContact CG2-CG2 4.12Å |
| 218 | L | 85.3 | Confident | 81.6 | Confident | 104 Ų | 104 | 89.6 Ų | 89.6 | 55% | 0.545 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -61.4 | -45.7 | -178.3 | -174.2 | 62.1 | 0 | 0 | 0 | 111.2 | Y214 S215 T220 L221 L222 | Y214-L218 WeakPolarHBondContact O-CB 3.42Å; Y214-L218 PolarHBondContact O-N 3.02Å; S215-L218 PolarHBondContact O-N 2.96Å; L218-T220 VanDerWaalsContact C-N 3.27Å; L218-T220 PolarHBondContact O-N 3.38Å; L218-L221 PolarHBondContact O-N 3.08Å; L218-L222 HydrophobicContact CD1-CD1 4.47Å; L218-L222 HydrophobicContact CD1-CG 4.39Å; L218-L222 HydrophobicContact CG-CD1 4.12Å; L218-L222 HydrophobicContact CG-CG 4.48Å; L218-L222 WeakPolarHBondContact O-CB 3.46Å; L218-L222 VanDerWaalsContact O-CG 3.27Å; L218-L222 WeakPolarHBondContact O-CG 3.46Å; L218-L222 PolarHBondContact O-N 3.27Å |
| 219 | K | 86.5 | Confident | 80 | Confident | 166 Ų | 166 | 93.3 Ų | 93.3 | 72% | 0.722 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -56.2 | -41.7 | 175.4 | -172.5 | 175.6 | -178.1 | 176.2 | 0 | 112.1 | S215 I217 R223 | S215-K219 WeakPolarHBondContact O-CB 3.4Å; S215-K219 PolarHBondContact O-N 2.83Å; I217-K219 PolarHBondContact O-N 2.98Å; K219-R223 PolarHBondContact O-N 3.44Å |
| 220 | T | 81.3 | Confident | 78.7 | Confident | 33 Ų | 33 | 95.1 Ų | 95.1 | 20% | 0.202 | 46% | 0.455 | C | S | . | . | H | α-helix | trans | -74.9 | -36.8 | -179.8 | -53.2 | 0 | 0 | 0 | 0 | 112.4 | V130 G216 I217 L218 R223 C224 | V130-T220 HydrophobicContact CG1-CG2 4.11Å; G216-T220 WeakPolarHBondContact O-CB 3.23Å; G216-T220 PolarHBondContact O-N 3.05Å; G216-T220 VanDerWaalsContact O-N 3.09Å; G216-T220 PolarHBondContact O-OG1 3.1Å; I217-T220 PolarHBondContact O-N 3.1Å; L218-T220 VanDerWaalsContact C-N 3.27Å; L218-T220 PolarHBondContact O-N 3.38Å; T220-R223 PolarHBondContact O-N 2.79Å; T220-C224 PolarHBondContact O-N 3.22Å; T220-C224 VanDerWaalsContact O-N 3.09Å |
| 221 | L | 77.4 | Confident | 77.8 | Confident | 24 Ų | 24 | 97.2 Ų | 97.2 | 13% | 0.126 | 46% | 0.464 | C | S | . | . | H | α-helix | trans | -67.4 | -38.8 | 176.2 | -72.1 | -179.7 | 0 | 0 | 0 | 112 | I217 L218 R223 C224 R230 V234 | I217-L221 HydrophobicContact CG2-CD1 3.66Å; I217-L221 HydrophobicContact CG2-CG 4.03Å; I217-L221 WeakPolarHBondContact O-CB 3.35Å; I217-L221 VanDerWaalsContact O-CG 3.28Å; I217-L221 WeakPolarHBondContact O-CG 3.3Å; I217-L221 PolarHBondContact O-N 3.41Å; L218-L221 PolarHBondContact O-N 3.08Å; L221-R223 VanDerWaalsContact C-N 3.28Å; L221-R223 PolarHBondContact O-N 3.44Å; L221-C224 CarbonylContact O-C 3.5Å; L221-C224 PolarHBondContact O-N 3.23Å; L221-R230 HydrophobicContact CD2-CG 4.37Å; L221-V234 HydrophobicContact CD1-CG1 4.45Å |
| 222 | L | 78.4 | Confident | 76.8 | Confident | 137 Ų | 137 | 96.3 Ų | 96.3 | 72% | 0.717 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -64.4 | -33.7 | 174.9 | -70.2 | 171.2 | 0 | 0 | 0 | 112 | L218 | L218-L222 HydrophobicContact CD1-CD1 4.47Å; L218-L222 HydrophobicContact CD1-CG 4.39Å; L218-L222 HydrophobicContact CG-CD1 4.12Å; L218-L222 HydrophobicContact CG-CG 4.48Å; L218-L222 WeakPolarHBondContact O-CB 3.46Å; L218-L222 VanDerWaalsContact O-CG 3.27Å; L218-L222 WeakPolarHBondContact O-CG 3.46Å; L218-L222 PolarHBondContact O-N 3.27Å |
| 223 | R | 77.8 | Confident | 75.8 | Confident | 225 Ų | 225 | 93.4 Ų | 93.4 | 85% | 0.849 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -77.8 | -27.9 | 178.4 | -166.4 | 173.3 | -178.4 | -178.1 | 1 | 113.6 | K219 T220 L221 | K219-R223 PolarHBondContact O-N 3.44Å; T220-R223 PolarHBondContact O-N 2.79Å; L221-R223 VanDerWaalsContact C-N 3.28Å; L221-R223 PolarHBondContact O-N 3.44Å |
| 224 | C | 66.5 | Low | 75.2 | Confident | 61 Ų | 61 | 93.7 Ų | 93.7 | 41% | 0.412 | 44% | 0.442 | S | S | . | . | trans | -125.5 | 92.7 | -173.9 | -66.9 | 0 | 0 | 0 | 0 | 111 | T220 L221 N226 R230 | T220-C224 PolarHBondContact O-N 3.22Å; T220-C224 VanDerWaalsContact O-N 3.09Å; L221-C224 CarbonylContact O-C 3.5Å; L221-C224 PolarHBondContact O-N 3.23Å; C224-N226 PolarHBondContact O-N 3.45Å; C224-R230 PolarHBondContact O-NH2 3.01Å | ||
| 225 | R | 62.6 | Low | 74.9 | Confident | 226 Ų | 226 | 99.1 Ų | 99.1 | 85% | 0.853 | 46% | 0.462 | S | S | * | . | trans | -78.1 | -7.1 | -167.5 | -171.8 | 155.7 | 129.1 | 162.3 | -5.2 | 116.7 | ||||
| 226 | N | 56.2 | Low | 74.6 | Confident | 143 Ų | 143 | 97.2 Ų | 97.2 | 77% | 0.765 | 45% | 0.446 | S | S | * | . | trans | -107.5 | 10.8 | -157.6 | -73.8 | -5.1 | 0 | 0 | 0 | 118.6 | C224 | C224-N226 PolarHBondContact O-N 3.45Š| ||
| 227 | E | 65.6 | Low | 74.4 | Confident | 116 Ų | 116 | 96.8 Ų | 96.8 | 54% | 0.542 | 44% | 0.44 | S | S | . | . | trans | -121.1 | 83.6 | -173.7 | -72 | -63.8 | 162.2 | 0 | 0 | 114.8 | K229 R230 H231 | E227-K229 PolarHBondContact O-N 3.08Å; E227-K229 VanDerWaalsContact O-N 3.13Å; E227-R230 HydrophobicContact CB-CB 4.02Å; E227-R230 WeakPolarHBondContact O-CB 3.22Å; E227-R230 PolarHBondContact O-N 3.37Å; E227-H231 PolarHBondContact O-CD2 2.9Å; E227-H231 PolarHBondContact O-N 3.07Å | ||
| 228 | K | 64.4 | Low | 74.5 | Confident | 192 Ų | 192 | 100.7 Ų | 100.7 | 84% | 0.835 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -51.8 | -36.1 | 179.8 | -70 | -178.2 | -179.7 | 177 | 0 | 113.8 | R230 | K228-R230 PolarHBondContact O-N 3.09Å |
| 229 | K | 61.9 | Low | 74.7 | Confident | 174 Ų | 174 | 97.7 Ų | 97.7 | 76% | 0.757 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -69.6 | -31.6 | -178.8 | -166 | 176.4 | 178.9 | -177.5 | 0 | 112.7 | E227 | E227-K229 PolarHBondContact O-N 3.08Å; E227-K229 VanDerWaalsContact O-N 3.13Å |
| 230 | R | 67.8 | Low | 74.8 | Confident | 58 Ų | 58 | 89.9 Ų | 89.9 | 22% | 0.219 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -69.3 | -43 | 177.6 | -172.3 | 173.8 | 65.4 | 174 | 0.3 | 111.4 | V130 L221 C224 E227 K228 R232 A233 V234 | V130-R230 HydrophobicContact CG2-CG 3.99Å; L221-R230 HydrophobicContact CD2-CG 4.37Å; C224-R230 PolarHBondContact O-NH2 3.01Å; E227-R230 HydrophobicContact CB-CB 4.02Å; E227-R230 WeakPolarHBondContact O-CB 3.22Å; E227-R230 PolarHBondContact O-N 3.37Å; K228-R230 PolarHBondContact O-N 3.09Å; R230-R232 PolarHBondContact O-N 3.4Å; R230-A233 PolarHBondContact O-N 2.79Å; R230-V234 WeakPolarHBondContact O-CG2 3.37Å; R230-V234 PolarHBondContact O-N 2.93Å |
| 231 | H | 71.3 | Confident | 75.3 | Confident | 75 Ų | 75 | 88.3 Ų | 88.3 | 35% | 0.347 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -58.6 | -36.8 | 177.3 | -68 | -75.4 | 0 | 0 | 0 | 112.7 | E227 R235 | E227-H231 PolarHBondContact O-CD2 2.9Å; E227-H231 PolarHBondContact O-N 3.07Å; H231-R235 WeakPolarHBondContact O-CB 3.26Å; H231-R235 PolarHBondContact O-N 3.29Å |
| 232 | R | 72.9 | Confident | 76 | Confident | 71 Ų | 71 | 89.9 Ų | 89.9 | 27% | 0.268 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -66.7 | -45.6 | -178.8 | -169.9 | -168.3 | -175.9 | 138.8 | 26 | 113.5 | R230 V234 R235 L236 V300 E302 | R230-R232 PolarHBondContact O-N 3.4Å; R232-V234 VanDerWaalsContact C-N 3.34Å; R232-R235 PolarHBondContact O-N 3.36Å; R232-L236 PolarHBondContact O-N 3.38Å; R232-V300 PolarHBondContact NH2-O 3.21Å; R232-V300 VanDerWaalsContact NH2-O 3.15Å; R232-E302 IonicContact CZ-OE1 2.92Å; R232-E302 IonicContact CZ-OE2 2.7Å; R232-E302 IonicContact NH1-OE1 3.56Å; R232-E302 PolarHBondContact NH1-OE1 3.26Å; R232-E302 IonicContact NH1-OE2 2.72Å; R232-E302 PolarHBondContact NH1-OE2 2.97Å; R232-E302 IonicContact NH2-OE1 2.61Å; R232-E302 PolarHBondContact NH2-OE1 3.28Å; R232-E302 IonicContact NH2-OE2 3.12Å |
| 233 | A | 72.2 | Confident | 76.7 | Confident | 32 Ų | 32 | 84.5 Ų | 84.5 | 26% | 0.264 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -67 | -38.6 | -179.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | R230 L236 I237 | R230-A233 PolarHBondContact O-N 2.79Å; A233-L236 PolarHBondContact O-N 3.09Å; A233-I237 PolarHBondContact O-N 2.72Å |
| 234 | V | 79.6 | Confident | 77.5 | Confident | 14 Ų | 14 | 74 Ų | 74 | 9% | 0.085 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -61.8 | -45 | 172.4 | 174.1 | 0 | 0 | 0 | 0 | 110.6 | V130 Y214 I217 L221 R230 R232 L236 I237 F238 | V130-V234 HydrophobicContact CG2-CG2 4.08Å; Y214-V234 HydrophobicContact CE1-CG1 4.12Å; I217-V234 HydrophobicContact CG2-CG1 3.81Å; I217-V234 HydrophobicContact CG2-CG2 4.12Å; L221-V234 HydrophobicContact CD1-CG1 4.45Å; R230-V234 WeakPolarHBondContact O-CG2 3.37Å; R230-V234 PolarHBondContact O-N 2.93Å; R232-V234 VanDerWaalsContact C-N 3.34Å; V234-L236 PolarHBondContact O-N 3.47Å; V234-I237 PolarHBondContact O-N 3Å; V234-F238 VanDerWaalsContact O-CB 3.26Å; V234-F238 WeakPolarHBondContact O-CB 3.27Å; V234-F238 PolarHBondContact O-N 2.91Å |
| 235 | R | 82.4 | Confident | 78.8 | Confident | 141 Ų | 141 | 72.2 Ų | 72.2 | 53% | 0.532 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -59.3 | -44.9 | 177.8 | -171.9 | 175.5 | 70.3 | -171.4 | 4.7 | 112.1 | H231 R232 I237 F238 T239 | H231-R235 WeakPolarHBondContact O-CB 3.26Å; H231-R235 PolarHBondContact O-N 3.29Å; R232-R235 PolarHBondContact O-N 3.36Å; R235-I237 PolarHBondContact O-N 3.33Å; R235-F238 PolarHBondContact O-N 3.45Å; R235-T239 WeakPolarHBondContact O-CB 3.27Å; R235-T239 PolarHBondContact O-N 3.39Å; R235-T239 PolarHBondContact O-OG1 2.81Å |
| 236 | L | 83.3 | Confident | 80.4 | Confident | 31 Ų | 31 | 66.8 Ų | 66.8 | 16% | 0.162 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -57.7 | -51.5 | 178.1 | 176.4 | 65.4 | 0 | 0 | 0 | 111.8 | R232 A233 V234 F238 T239 I240 I296 Y297 V300 | R232-L236 PolarHBondContact O-N 3.38Å; A233-L236 PolarHBondContact O-N 3.09Å; V234-L236 PolarHBondContact O-N 3.47Å; L236-F238 VanDerWaalsContact C-N 3.33Å; L236-F238 PolarHBondContact O-N 2.91Å; L236-T239 PolarHBondContact O-N 3.34Å; L236-I240 HydrophobicContact CD1-CD1 4.23Å; L236-I240 HydrophobicContact CG-CD1 4.1Å; L236-I240 WeakPolarHBondContact O-CG1 3.47Å; L236-I240 PolarHBondContact O-N 3Å; L236-I296 HydrophobicContact CD1-CG2 3.9Å; L236-Y297 HydrophobicContact CD1-CD1 4.1Å; L236-Y297 HydrophobicContact CD1-CE1 4.44Å; L236-Y297 HydrophobicContact CD2-CD1 4.5Å; L236-V300 HydrophobicContact CB-CG1 4.04Å; L236-V300 HydrophobicContact CD1-CB 3.79Å; L236-V300 HydrophobicContact CD1-CG1 3.73Å |
| 237 | I | 83.9 | Confident | 82.2 | Confident | 6 Ų | 6 | 61.9 Ų | 61.9 | 3% | 0.031 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -72.2 | -32.6 | -175 | -70.8 | 168.6 | 0 | 0 | 0 | 111.1 | L122 R126 Y214 A233 V234 R235 I240 M241 | L122-I237 HydrophobicContact CB-CD1 4.23Å; L122-I237 HydrophobicContact CB-CG2 4.3Å; L122-I237 HydrophobicContact CD2-CD1 4.26Å; R126-I237 HydrophobicContact CG-CB 4.25Å; R126-I237 HydrophobicContact CG-CD1 3.13Å; R126-I237 HydrophobicContact CG-CG1 4.22Å; R126-I237 HydrophobicContact CG-CG2 4.32Å; Y214-I237 VanDerWaalsContact OH-C 3.3Å; A233-I237 PolarHBondContact O-N 2.72Å; V234-I237 PolarHBondContact O-N 3Å; R235-I237 PolarHBondContact O-N 3.33Å; I237-I240 PolarHBondContact O-N 3.2Å; I237-M241 PolarHBondContact O-N 2.85Å |
| 238 | F | 86.8 | Confident | 83.6 | Confident | 86 Ų | 86 | 56.8 Ų | 56.8 | 38% | 0.377 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -62.6 | -44.7 | 171.1 | -175.7 | -105.1 | 0 | 0 | 0 | 111.7 | M210 Y214 V234 R235 L236 I240 M241 I242 | M210-F238 HydrophobicContact CE-CD2 4.24Å; M210-F238 HydrophobicContact CE-CE2 3.56Å; M210-F238 HydrophobicContact CE-CZ 4.28Å; Y214-F238 AromaticContact CD1-CD2 3.73Å; Y214-F238 HydrophobicContact CD1-CD2 3.73Å; Y214-F238 HydrophobicContact CD1-CE2 4.37Å; Y214-F238 HydrophobicContact CD2-CD2 4.24Å; Y214-F238 HydrophobicContact CE1-CB 3.69Å; Y214-F238 AromaticContact CE1-CD2 3.46Å; Y214-F238 HydrophobicContact CE1-CD2 3.46Å; Y214-F238 VanDerWaalsContact CE1-CD2 3.46Å; Y214-F238 HydrophobicContact CE1-CE2 4.49Å; Y214-F238 AromaticContact CE1-CG 4Å; Y214-F238 HydrophobicContact CE1-CG 4Å; Y214-F238 AromaticContact CE2-CD2 3.99Å; Y214-F238 HydrophobicContact CE2-CD2 3.99Å; Y214-F238 HydrophobicContact CG-CD2 4.13Å; Y214-F238 HydrophobicContact CG-CE2 4.48Å; Y214-F238 AromaticContact CZ-CD2 3.61Å; Y214-F238 WeakPolarHBondContact OH-CA 3.2Å; Y214-F238 PolarHBondContact OH-N 2.91Å; V234-F238 VanDerWaalsContact O-CB 3.26Å; V234-F238 WeakPolarHBondContact O-CB 3.27Å; V234-F238 PolarHBondContact O-N 2.91Å; R235-F238 PolarHBondContact O-N 3.45Å; L236-F238 VanDerWaalsContact C-N 3.33Å; L236-F238 PolarHBondContact O-N 2.91Å; F238-I240 PolarHBondContact O-N 3.46Å; F238-M241 PolarHBondContact O-N 3.33Å; F238-I242 HydrophobicContact CD1-CG1 4.12Å; F238-I242 HydrophobicContact CD2-CG1 4.38Å; F238-I242 HydrophobicContact CE1-CD1 4.32Å; F238-I242 HydrophobicContact CE1-CG1 3.76Å; F238-I242 HydrophobicContact CE2-CD1 4.09Å; F238-I242 HydrophobicContact CE2-CG1 4.07Å; F238-I242 HydrophobicContact CG-CG1 4.43Å; F238-I242 HydrophobicContact CZ-CD1 3.82Å; F238-I242 HydrophobicContact CZ-CG1 3.74Å; F238-I242 WeakPolarHBondContact O-CG1 3.15Å; F238-I242 PolarHBondContact O-N 3.49Å |
| 239 | T | 89.5 | Confident | 85.1 | Confident | 41 Ų | 41 | 48.5 Ų | 48.5 | 25% | 0.252 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -59.6 | -45.8 | 175.5 | -60.3 | 0 | 0 | 0 | 0 | 111.6 | R235 L236 M241 I242 V243 I296 V300 | R235-T239 WeakPolarHBondContact O-CB 3.27Å; R235-T239 PolarHBondContact O-N 3.39Å; R235-T239 PolarHBondContact O-OG1 2.81Å; L236-T239 PolarHBondContact O-N 3.34Å; T239-M241 VanDerWaalsContact C-N 3.33Å; T239-M241 PolarHBondContact O-N 2.81Å; T239-I242 PolarHBondContact O-N 3.33Å; T239-V243 HydrophobicContact CG2-CG2 4.27Å; T239-V243 WeakPolarHBondContact O-CB 3.42Å; T239-V243 VanDerWaalsContact O-CG2 3.25Å; T239-V243 WeakPolarHBondContact O-CG2 3.06Å; T239-V243 PolarHBondContact O-N 3.43Å; T239-I296 HydrophobicContact CG2-CG1 4.5Å; T239-I296 HydrophobicContact CG2-CG2 3.97Å; T239-V300 HydrophobicContact CG2-CG2 4.49Å |
| 240 | I | 89.8 | Confident | 86.7 | Confident | 2 Ų | 2 | 42.1 Ų | 42.1 | 1% | 0.01 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -58.7 | -46.3 | 177.9 | -65 | 165.3 | 0 | 0 | 0 | 110.8 | I119 L236 I237 F238 V243 Y244 I296 Y297 | I119-I240 HydrophobicContact CD1-CG2 4.02Å; I119-I240 HydrophobicContact CG1-CG2 3.97Å; I119-I240 HydrophobicContact CG2-CG2 4.49Å; L236-I240 HydrophobicContact CD1-CD1 4.23Å; L236-I240 HydrophobicContact CG-CD1 4.1Å; L236-I240 WeakPolarHBondContact O-CG1 3.47Å; L236-I240 PolarHBondContact O-N 3Å; I237-I240 PolarHBondContact O-N 3.2Å; F238-I240 PolarHBondContact O-N 3.46Å; I240-V243 PolarHBondContact O-N 2.61Å; I240-Y244 PolarHBondContact O-N 2.9Å; I240-I296 HydrophobicContact CG1-CD1 4.28Å; I240-I296 HydrophobicContact CG1-CG2 3.95Å; I240-Y297 HydrophobicContact CD1-CE1 3.63Å |
| 241 | M | 90.1 | Very high | 88 | Confident | 0 Ų | 0 | 40.5 Ų | 40.5 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -64.1 | -45.9 | 179.8 | -175 | 68.4 | 80.5 | 0 | 0 | 112.7 | I119 T123 P206 M210 I237 F238 T239 Y244 F245 | I119-M241 HydrophobicContact CG2-CB 4.43Å; I119-M241 HydrophobicContact CG2-CE 3.49Å; I119-M241 VanDerWaalsContact CG2-CE 3.49Å; I119-M241 HydrophobicContact CG2-SD 3.63Å; T123-M241 HydrophobicContact CG2-CE 4.27Å; T123-M241 WeakPolarHBondContact OG1-CE 3.44Å; P206-M241 HydrophobicContact CB-SD 4.36Å; M210-M241 HydrophobicContact CB-CG 4.49Å; M210-M241 HydrophobicContact CG-CG 4.2Å; M210-M241 HydrophobicContact SD-CG 4.03Å; I237-M241 PolarHBondContact O-N 2.85Å; F238-M241 PolarHBondContact O-N 3.33Å; T239-M241 VanDerWaalsContact C-N 3.33Å; T239-M241 PolarHBondContact O-N 2.81Å; M241-Y244 WeakPolarHBondContact O-CB 3.41Å; M241-Y244 PolarHBondContact O-N 3.48Å; M241-F245 HydrophobicContact CG-CD2 4.08Å; M241-F245 HydrophobicContact CG-CE2 3.59Å; M241-F245 WeakPolarHBondContact O-CD2 3.35Å; M241-F245 PolarHBondContact O-N 2.99Å; M241-F245 VanDerWaalsContact O-N 3.16Å; M241-F245 HydrophobicContact SD-CD2 4.37Å; M241-F245 HydrophobicContact SD-CE2 3.59Å; M241-F245 VanDerWaalsContact SD-CE2 3.59Å; M241-F245 HydrophobicContact SD-CZ 4.04Å |
| 242 | I | 92.8 | Very high | 89.1 | Confident | 57 Ų | 57 | 37 Ų | 37 | 29% | 0.292 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -63 | -44.8 | 178.7 | -67 | -66.9 | 0 | 0 | 0 | 110.8 | M210 F238 T239 Y244 F245 L246 | M210-I242 HydrophobicContact CE-CD1 3.3Å; M210-I242 HydrophobicContact CE-CG1 4.22Å; M210-I242 HydrophobicContact SD-CD1 4.49Å; F238-I242 HydrophobicContact CD1-CG1 4.12Å; F238-I242 HydrophobicContact CD2-CG1 4.38Å; F238-I242 HydrophobicContact CE1-CD1 4.32Å; F238-I242 HydrophobicContact CE1-CG1 3.76Å; F238-I242 HydrophobicContact CE2-CD1 4.09Å; F238-I242 HydrophobicContact CE2-CG1 4.07Å; F238-I242 HydrophobicContact CG-CG1 4.43Å; F238-I242 HydrophobicContact CZ-CD1 3.82Å; F238-I242 HydrophobicContact CZ-CG1 3.74Å; F238-I242 WeakPolarHBondContact O-CG1 3.15Å; F238-I242 PolarHBondContact O-N 3.49Å; T239-I242 PolarHBondContact O-N 3.33Å; I242-Y244 VanDerWaalsContact C-N 3.3Å; I242-Y244 PolarHBondContact O-N 3.44Å; I242-F245 PolarHBondContact O-N 3.3Å; I242-L246 HydrophobicContact CG2-CD1 3.99Å; I242-L246 HydrophobicContact CG2-CG 4.28Å; I242-L246 WeakPolarHBondContact O-CG 3.32Å; I242-L246 PolarHBondContact O-N 3.36Å |
| 243 | V | 94.2 | Very high | 90.1 | Very high | 23 Ų | 23 | 37.9 Ų | 37.9 | 14% | 0.139 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -62.4 | -39.7 | 178.4 | 172 | 0 | 0 | 0 | 0 | 110.9 | T239 I240 F245 L246 F247 I292 I296 | T239-V243 HydrophobicContact CG2-CG2 4.27Å; T239-V243 WeakPolarHBondContact O-CB 3.42Å; T239-V243 VanDerWaalsContact O-CG2 3.25Å; T239-V243 WeakPolarHBondContact O-CG2 3.06Å; T239-V243 PolarHBondContact O-N 3.43Å; I240-V243 PolarHBondContact O-N 2.61Å; V243-F245 VanDerWaalsContact C-N 3.35Å; V243-F245 PolarHBondContact O-N 2.78Å; V243-L246 PolarHBondContact O-N 2.98Å; V243-F247 HydrophobicContact CG1-CD2 3.87Å; V243-F247 HydrophobicContact CG1-CE2 3.85Å; V243-F247 WeakPolarHBondContact O-CD2 3.36Å; V243-F247 PolarHBondContact O-N 3.29Å; V243-F247 VanDerWaalsContact O-N 3.15Å; V243-I292 HydrophobicContact CG1-CB 4.42Å; V243-I292 HydrophobicContact CG1-CG2 3.7Å; V243-I296 HydrophobicContact CB-CD1 3.95Å; V243-I296 HydrophobicContact CG1-CD1 4Å; V243-I296 HydrophobicContact CG2-CD1 3.98Å |
| 244 | Y | 93.5 | Very high | 91.1 | Very high | 4 Ų | 4 | 37.1 Ų | 37.1 | 2% | 0.016 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -55 | -49.7 | 172.7 | 175.5 | -91.4 | 0 | 0 | 0 | 111.8 | I116 I119 G202 I240 M241 I242 L246 F247 W248 H289 | I116-Y244 HydrophobicContact CB-CE2 4.07Å; I116-Y244 HydrophobicContact CD1-CD1 3.62Å; I116-Y244 HydrophobicContact CD1-CD2 4.22Å; I116-Y244 HydrophobicContact CD1-CE1 3.28Å; I116-Y244 HydrophobicContact CD1-CE2 3.92Å; I116-Y244 HydrophobicContact CD1-CG 4.08Å; I116-Y244 VanDerWaalsContact CD1-CZ 3.45Å; I116-Y244 HydrophobicContact CG1-CE1 3.89Å; I116-Y244 HydrophobicContact CG1-CE2 4.31Å; I119-Y244 HydrophobicContact CD1-CD2 3.94Å; I119-Y244 HydrophobicContact CD1-CG 4.17Å; G202-Y244 VanDerWaalsContact O-CE1 3.31Å; G202-Y244 WeakPolarHBondContact O-CE1 3.23Å; G202-Y244 PolarHBondContact O-OH 3.32Å; G202-Y244 VanDerWaalsContact O-OH 3.11Å; I240-Y244 PolarHBondContact O-N 2.9Å; M241-Y244 WeakPolarHBondContact O-CB 3.41Å; M241-Y244 PolarHBondContact O-N 3.48Å; I242-Y244 VanDerWaalsContact C-N 3.3Å; I242-Y244 PolarHBondContact O-N 3.44Å; Y244-L246 PolarHBondContact O-N 3.14Å; Y244-F247 PolarHBondContact O-N 3.41Å; Y244-W248 AromaticContact CD2-CD1 3.48Å; Y244-W248 VanDerWaalsContact CD2-CD1 3.48Å; Y244-W248 HydrophobicContact CD2-CG 4.28Å; Y244-W248 HydrophobicContact CE1-CB 4.21Å; Y244-W248 HydrophobicContact CE2-CB 4.19Å; Y244-W248 AromaticContact CE2-CD1 3.33Å; Y244-W248 AromaticContact CE2-CG 3.82Å; Y244-W248 HydrophobicContact CE2-CG 3.82Å; Y244-W248 AromaticContact CE2-NE1 3.91Å; Y244-W248 AromaticContact CZ-CD1 3.99Å; Y244-W248 WeakPolarHBondContact O-CB 3.27Å; Y244-W248 PolarHBondContact O-N 2.67Å; Y244-H289 AromaticContact CD2-CE1 3.84Å; Y244-H289 AromaticContact CD2-NE2 3.91Å |
| 245 | F | 94.6 | Very high | 91.7 | Very high | 25 Ų | 25 | 37.2 Ų | 37.2 | 11% | 0.11 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -64.5 | -39.4 | 178.8 | -71.8 | -59.4 | 0 | 0 | 0 | 113.2 | L203 P206 L207 M210 M241 I242 V243 F247 A249 | L203-F245 HydrophobicContact CD1-CD1 3.79Å; L203-F245 HydrophobicContact CD1-CE1 3.89Å; P206-F245 HydrophobicContact CB-CE1 4.26Å; P206-F245 HydrophobicContact CB-CZ 3.82Å; P206-F245 HydrophobicContact CG-CE1 4.01Å; P206-F245 HydrophobicContact CG-CZ 4.07Å; L207-F245 HydrophobicContact CB-CE1 4.18Å; L207-F245 HydrophobicContact CB-CZ 3.96Å; M210-F245 HydrophobicContact SD-CD2 4.07Å; M210-F245 HydrophobicContact SD-CE2 3.58Å; M210-F245 VanDerWaalsContact SD-CE2 3.58Å; M241-F245 HydrophobicContact CG-CD2 4.08Å; M241-F245 HydrophobicContact CG-CE2 3.59Å; M241-F245 WeakPolarHBondContact O-CD2 3.35Å; M241-F245 PolarHBondContact O-N 2.99Å; M241-F245 VanDerWaalsContact O-N 3.16Å; M241-F245 HydrophobicContact SD-CD2 4.37Å; M241-F245 HydrophobicContact SD-CE2 3.59Å; M241-F245 VanDerWaalsContact SD-CE2 3.59Å; M241-F245 HydrophobicContact SD-CZ 4.04Å; I242-F245 PolarHBondContact O-N 3.3Å; V243-F245 VanDerWaalsContact C-N 3.35Å; V243-F245 PolarHBondContact O-N 2.78Å; F245-F247 PolarHBondContact O-N 2.85Å; F245-A249 WeakPolarHBondContact O-CA 3.28Å; F245-A249 WeakPolarHBondContact O-CB 3.29Å; F245-A249 PolarHBondContact O-N 3.26Å |
| 246 | L | 95.6 | Very high | 92.2 | Very high | 112 Ų | 112 | 33.1 Ų | 33.1 | 59% | 0.586 | 17% | 0.172 | S | C | * | . | H | α-helix | trans | -59.8 | -34.3 | 177.8 | -71.3 | 173.6 | 0 | 0 | 0 | 112.3 | I242 V243 Y244 | I242-L246 HydrophobicContact CG2-CD1 3.99Å; I242-L246 HydrophobicContact CG2-CG 4.28Å; I242-L246 WeakPolarHBondContact O-CG 3.32Å; I242-L246 PolarHBondContact O-N 3.36Å; V243-L246 PolarHBondContact O-N 2.98Å; Y244-L246 PolarHBondContact O-N 3.14Å |
| 247 | F | 94.8 | Very high | 92.6 | Very high | 40 Ų | 40 | 34 Ų | 34 | 18% | 0.175 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -90.5 | -39.3 | -177.2 | -77.5 | -114.7 | 0 | 0 | 0 | 112.5 | V243 Y244 F245 L285 T288 H289 I292 | V243-F247 HydrophobicContact CG1-CD2 3.87Å; V243-F247 HydrophobicContact CG1-CE2 3.85Å; V243-F247 WeakPolarHBondContact O-CD2 3.36Å; V243-F247 PolarHBondContact O-N 3.29Å; V243-F247 VanDerWaalsContact O-N 3.15Å; Y244-F247 PolarHBondContact O-N 3.41Å; F245-F247 PolarHBondContact O-N 2.85Å; F247-L285 HydrophobicContact CD1-CD1 3.96Å; F247-L285 HydrophobicContact CD1-CG 4.29Å; F247-L285 VanDerWaalsContact CD1-O 3.31Å; F247-L285 WeakPolarHBondContact CD1-O 3.28Å; F247-L285 HydrophobicContact CE1-CD1 4.05Å; F247-L285 HydrophobicContact CG-CD1 4.49Å; F247-T288 WeakPolarHBondContact CD1-OG1 3.42Å; F247-T288 VanDerWaalsContact CE1-OG1 3.25Å; F247-T288 WeakPolarHBondContact CE1-OG1 3.47Å; F247-H289 HydrophobicContact CB-CB 3.91Å; F247-H289 HydrophobicContact CD1-CB 3.98Å; F247-H289 HydrophobicContact CG-CB 4.16Å; F247-I292 HydrophobicContact CD1-CG1 4.48Å; F247-I292 HydrophobicContact CE1-CD1 4.17Å; F247-I292 HydrophobicContact CE1-CG1 3.76Å; F247-I292 HydrophobicContact CZ-CD1 4.06Å; F247-I292 HydrophobicContact CZ-CG1 3.8Å |
| 248 | W | 95.1 | Very high | 92.8 | Very high | 9 Ų | 9 | 34.9 Ų | 34.9 | 3% | 0.034 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -100.5 | -27.4 | -172.7 | -75.7 | 103.6 | 0 | 0 | 0 | 115.1 | F79 F112 Y244 P250 Y251 N252 G286 H289 | F79-W248 AromaticContact CE2-CH2 3.95Å; F79-W248 HydrophobicContact CE2-CH2 3.95Å; F79-W248 HydrophobicContact CE2-CZ2 4.12Å; F79-W248 AromaticContact CZ-CH2 3.8Å; F79-W248 HydrophobicContact CZ-CH2 3.8Å; F79-W248 AromaticContact CZ-CZ2 3.92Å; F79-W248 HydrophobicContact CZ-CZ2 3.92Å; F112-W248 HydrophobicContact CD2-CD2 4.14Å; F112-W248 AromaticContact CD2-CE3 3.99Å; F112-W248 HydrophobicContact CD2-CE3 3.99Å; F112-W248 AromaticContact CD2-CH2 3.61Å; F112-W248 HydrophobicContact CD2-CH2 3.61Å; F112-W248 AromaticContact CD2-CZ2 3.79Å; F112-W248 HydrophobicContact CD2-CZ2 3.79Å; F112-W248 AromaticContact CD2-CZ3 3.72Å; F112-W248 HydrophobicContact CD2-CZ3 3.72Å; F112-W248 AromaticContact CE2-CD2 3.68Å; F112-W248 HydrophobicContact CE2-CD2 3.68Å; F112-W248 AromaticContact CE2-CE3 3.45Å; F112-W248 HydrophobicContact CE2-CE3 3.45Å; F112-W248 VanDerWaalsContact CE2-CE3 3.45Å; F112-W248 HydrophobicContact CE2-CG 4.35Å; F112-W248 AromaticContact CE2-CH2 3.98Å; F112-W248 HydrophobicContact CE2-CH2 3.98Å; F112-W248 HydrophobicContact CE2-CZ2 4.2Å; F112-W248 AromaticContact CE2-CZ3 3.61Å; F112-W248 HydrophobicContact CE2-CZ3 3.61Å; F112-W248 HydrophobicContact CZ-CE3 4.49Å; Y244-W248 AromaticContact CD2-CD1 3.48Å; Y244-W248 VanDerWaalsContact CD2-CD1 3.48Å; Y244-W248 HydrophobicContact CD2-CG 4.28Å; Y244-W248 HydrophobicContact CE1-CB 4.21Å; Y244-W248 HydrophobicContact CE2-CB 4.19Å; Y244-W248 AromaticContact CE2-CD1 3.33Å; Y244-W248 AromaticContact CE2-CG 3.82Å; Y244-W248 HydrophobicContact CE2-CG 3.82Å; Y244-W248 AromaticContact CE2-NE1 3.91Å; Y244-W248 AromaticContact CZ-CD1 3.99Å; Y244-W248 WeakPolarHBondContact O-CB 3.27Å; Y244-W248 PolarHBondContact O-N 2.67Å; W248-P250 VanDerWaalsContact C-CD 3.48Å; W248-Y251 HydrophobicContact CE3-CD1 4.11Å; W248-Y251 HydrophobicContact CZ3-CD1 4.11Å; W248-Y251 PolarHBondContact O-N 2.99Å; W248-N252 PolarHBondContact O-N 3.16Å; W248-N252 VanDerWaalsContact O-N 3.09Å; W248-N252 PolarHBondContact O-ND2 2.8Å; W248-G286 VanDerWaalsContact CZ2-O 3.24Å; W248-G286 WeakPolarHBondContact CZ2-O 3.32Å; W248-H289 AromaticContact CD1-CG 3.86Å; W248-H289 AromaticContact NE1-CG 3.51Å; W248-H289 AromaticContact NE1-ND1 3.55Å |
| 249 | A | 94.5 | Very high | 92.9 | Very high | 18 Ų | 18 | 31.2 Ų | 31.2 | 15% | 0.149 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -60.6 | -40.4 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | L203 F245 Y251 N252 I253 | L203-A249 HydrophobicContact CD1-CB 3.75Å; F245-A249 WeakPolarHBondContact O-CA 3.28Å; F245-A249 WeakPolarHBondContact O-CB 3.29Å; F245-A249 PolarHBondContact O-N 3.26Å; A249-Y251 VanDerWaalsContact C-N 3.31Å; A249-Y251 PolarHBondContact O-N 3.46Å; A249-N252 PolarHBondContact O-N 3.25Å; A249-I253 WeakPolarHBondContact O-CD1 3.31Å; A249-I253 VanDerWaalsContact O-CG1 3.25Å; A249-I253 WeakPolarHBondContact O-CG1 3.38Å; A249-I253 PolarHBondContact O-N 3.1Å |
| 250 | P | 96.1 | Very high | 92.9 | Very high | 40 Ų | 40 | 31.9 Ų | 31.9 | 26% | 0.26 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -55.3 | -45.8 | 176 | -26.7 | 36 | 0 | 0 | 0 | 112.4 | W248 I253 V254 T282 L285 | W248-P250 VanDerWaalsContact C-CD 3.48Å; P250-I253 PolarHBondContact O-N 3.37Å; P250-V254 VanDerWaalsContact O-CG2 3.32Å; P250-V254 WeakPolarHBondContact O-CG2 3.38Å; P250-V254 PolarHBondContact O-N 3.08Å; P250-T282 HydrophobicContact CB-CG2 3.6Å; P250-L285 HydrophobicContact CG-CD2 4.25Å |
| 251 | Y | 94.1 | Very high | 92.6 | Very high | 24 Ų | 24 | 33.3 Ų | 33.3 | 9% | 0.094 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -63.4 | -46.7 | 178 | 174.1 | -103.3 | 0 | 0 | 0 | 112.1 | W248 A249 I253 V254 L255 M279 E283 | W248-Y251 HydrophobicContact CE3-CD1 4.11Å; W248-Y251 HydrophobicContact CZ3-CD1 4.11Å; W248-Y251 PolarHBondContact O-N 2.99Å; A249-Y251 VanDerWaalsContact C-N 3.31Å; A249-Y251 PolarHBondContact O-N 3.46Å; Y251-I253 VanDerWaalsContact C-N 3.3Å; Y251-I253 PolarHBondContact O-N 3.39Å; Y251-V254 PolarHBondContact O-N 3.25Å; Y251-L255 HydrophobicContact CE1-CD2 4.22Å; Y251-L255 VanDerWaalsContact O-CB 3.28Å; Y251-L255 WeakPolarHBondContact O-CB 3.44Å; Y251-L255 PolarHBondContact O-N 2.87Å; Y251-M279 HydrophobicContact CE2-CG 4.27Å; Y251-E283 HydrophobicContact CD2-CB 3.67Å; Y251-E283 HydrophobicContact CD2-CG 4.35Å; Y251-E283 HydrophobicContact CE2-CB 3.7Å; Y251-E283 HydrophobicContact CE2-CG 4.03Å |
| 252 | N | 94.6 | Very high | 92.3 | Very high | 1 Ų | 1 | 41.1 Ų | 41.1 | 1% | 0.005 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -61.3 | -38.6 | 179.4 | -78 | -86.7 | 0 | 0 | 0 | 112.3 | I198 V199 L203 W248 A249 L256 | I198-N252 WeakPolarHBondContact CG2-OD1 3.38Å; I198-N252 PolarHBondContact O-OD1 3.3Å; V199-N252 HydrophobicContact CG2-CB 4.42Å; L203-N252 HydrophobicContact CB-CB 4.2Å; L203-N252 HydrophobicContact CD2-CB 3.97Å; W248-N252 PolarHBondContact O-N 3.16Å; W248-N252 VanDerWaalsContact O-N 3.09Å; W248-N252 PolarHBondContact O-ND2 2.8Å; A249-N252 PolarHBondContact O-N 3.25Å; N252-L256 PolarHBondContact O-N 2.91Å; N252-L256 VanDerWaalsContact O-N 3.12Å |
| 253 | I | 94.6 | Very high | 91.9 | Very high | 90 Ų | 90 | 46.5 Ų | 46.5 | 46% | 0.462 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -67.1 | -47.6 | 176.6 | -66.7 | 164.1 | 0 | 0 | 0 | 110.3 | L203 A249 P250 Y251 L255 L256 L257 | L203-I253 HydrophobicContact CD2-CG1 4.45Å; A249-I253 WeakPolarHBondContact O-CD1 3.31Å; A249-I253 VanDerWaalsContact O-CG1 3.25Å; A249-I253 WeakPolarHBondContact O-CG1 3.38Å; A249-I253 PolarHBondContact O-N 3.1Å; P250-I253 PolarHBondContact O-N 3.37Å; Y251-I253 VanDerWaalsContact C-N 3.3Å; Y251-I253 PolarHBondContact O-N 3.39Å; I253-L255 VanDerWaalsContact C-N 3.33Å; I253-L255 PolarHBondContact O-N 3.09Å; I253-L256 WeakPolarHBondContact O-CB 3.08Å; I253-L256 PolarHBondContact O-N 2.87Å; I253-L257 HydrophobicContact CG2-CD1 4.24Å; I253-L257 WeakPolarHBondContact O-CG 3.39Å; I253-L257 PolarHBondContact O-N 2.95Å |
| 254 | V | 93.6 | Very high | 91.4 | Very high | 16 Ų | 16 | 50.1 Ų | 50.1 | 10% | 0.097 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -64.9 | -38.1 | 179 | 175.7 | 0 | 0 | 0 | 0 | 111.4 | P250 Y251 L256 L257 N258 A278 M279 T282 | P250-V254 VanDerWaalsContact O-CG2 3.32Å; P250-V254 WeakPolarHBondContact O-CG2 3.38Å; P250-V254 PolarHBondContact O-N 3.08Å; Y251-V254 PolarHBondContact O-N 3.25Å; V254-L256 VanDerWaalsContact C-N 3.31Å; V254-L256 PolarHBondContact O-N 3.28Å; V254-L257 PolarHBondContact O-N 3.46Å; V254-N258 VanDerWaalsContact O-CB 3.28Å; V254-N258 WeakPolarHBondContact O-CB 3.23Å; V254-N258 PolarHBondContact O-N 2.85Å; V254-A278 HydrophobicContact CG1-CB 4.08Å; V254-A278 HydrophobicContact CG2-CB 4.2Å; V254-M279 HydrophobicContact CG1-CB 3.87Å; V254-T282 HydrophobicContact CG2-CG2 4.09Å |
| 255 | L | 92.3 | Very high | 90.7 | Very high | 16 Ų | 16 | 52.1 Ų | 52.1 | 8% | 0.084 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -60.5 | -40.7 | 174.9 | -179.3 | 64.9 | 0 | 0 | 0 | 111.9 | T195 I198 Y251 I253 N258 T259 | T195-L255 HydrophobicContact CG2-CD2 4.33Å; T195-L255 HydrophobicContact CG2-CG 3.93Å; I198-L255 HydrophobicContact CB-CD2 4.06Å; I198-L255 HydrophobicContact CD1-CD2 3.98Å; I198-L255 HydrophobicContact CG2-CD2 3.8Å; Y251-L255 HydrophobicContact CE1-CD2 4.22Å; Y251-L255 VanDerWaalsContact O-CB 3.28Å; Y251-L255 WeakPolarHBondContact O-CB 3.44Å; Y251-L255 PolarHBondContact O-N 2.87Å; I253-L255 VanDerWaalsContact C-N 3.33Å; I253-L255 PolarHBondContact O-N 3.09Å; L255-N258 PolarHBondContact O-N 2.84Å; L255-T259 WeakPolarHBondContact O-CB 3.27Å; L255-T259 PolarHBondContact O-N 3.04Å; L255-T259 PolarHBondContact O-OG1 2.92Å |
| 256 | L | 93.3 | Very high | 90 | Very high | 54 Ų | 54 | 53.2 Ų | 53.2 | 28% | 0.283 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -63.8 | -48.8 | 174.8 | -169.8 | 74.8 | 0 | 0 | 0 | 111 | T195 V199 N252 I253 V254 N258 T259 F260 | T195-L256 HydrophobicContact CG2-CD1 4.36Å; V199-L256 HydrophobicContact CG2-CB 4.44Å; V199-L256 HydrophobicContact CG2-CD1 4.43Å; N252-L256 PolarHBondContact O-N 2.91Å; N252-L256 VanDerWaalsContact O-N 3.12Å; I253-L256 WeakPolarHBondContact O-CB 3.08Å; I253-L256 PolarHBondContact O-N 2.87Å; V254-L256 VanDerWaalsContact C-N 3.31Å; V254-L256 PolarHBondContact O-N 3.28Å; L256-N258 VanDerWaalsContact C-N 3.31Å; L256-N258 PolarHBondContact O-N 2.98Å; L256-T259 PolarHBondContact O-N 3.18Å; L256-F260 HydrophobicContact CD1-CD2 3.71Å; L256-F260 HydrophobicContact CD1-CE2 3.61Å; L256-F260 HydrophobicContact CG-CD2 4.11Å; L256-F260 HydrophobicContact CG-CE2 4.5Å; L256-F260 WeakPolarHBondContact O-CD2 3.37Å; L256-F260 PolarHBondContact O-N 2.93Å |
| 257 | L | 91.3 | Very high | 89.1 | Confident | 49 Ų | 49 | 52.9 Ų | 52.9 | 26% | 0.257 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -60.2 | -40.5 | 176.9 | -68.2 | 173.7 | 0 | 0 | 0 | 112 | I253 V254 T259 F260 Q261 F264 L275 | I253-L257 HydrophobicContact CG2-CD1 4.24Å; I253-L257 WeakPolarHBondContact O-CG 3.39Å; I253-L257 PolarHBondContact O-N 2.95Å; V254-L257 PolarHBondContact O-N 3.46Å; L257-T259 VanDerWaalsContact C-N 3.32Å; L257-T259 PolarHBondContact O-N 3.21Å; L257-F260 CarbonylContact O-C 3.59Å; L257-Q261 WeakPolarHBondContact O-CA 3.36Å; L257-Q261 VanDerWaalsContact O-CG 3.31Å; L257-Q261 WeakPolarHBondContact O-CG 3.36Å; L257-Q261 PolarHBondContact O-N 3.46Å; L257-F264 HydrophobicContact CD2-CD1 4.41Å; L257-F264 HydrophobicContact CD2-CD2 3.72Å; L257-F264 HydrophobicContact CD2-CE2 3.84Å; L257-F264 HydrophobicContact CD2-CG 4.03Å; L257-F264 HydrophobicContact CD2-CZ 4.24Å; L257-L275 HydrophobicContact CB-CD2 3.99Å; L257-L275 HydrophobicContact CD1-CD2 4.49Å |
| 258 | N | 88.5 | Confident | 88.5 | Confident | 25 Ų | 25 | 55.5 Ų | 55.5 | 13% | 0.134 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -68.1 | -30.8 | 178.1 | -172 | 52.4 | 0 | 0 | 0 | 112.8 | V254 L255 L256 Q261 M279 | V254-N258 VanDerWaalsContact O-CB 3.28Å; V254-N258 WeakPolarHBondContact O-CB 3.23Å; V254-N258 PolarHBondContact O-N 2.85Å; L255-N258 PolarHBondContact O-N 2.84Å; L256-N258 VanDerWaalsContact C-N 3.31Å; L256-N258 PolarHBondContact O-N 2.98Å; N258-Q261 WeakPolarHBondContact O-CG 3.4Å; N258-Q261 PolarHBondContact OD1-NE2 2.97Å; N258-Q261 VanDerWaalsContact OD1-NE2 3.08Å; N258-M279 HydrophobicContact CB-SD 4.48Å |
| 259 | T | 88.3 | Confident | 87.7 | Confident | 9 Ų | 9 | 58.6 Ų | 58.6 | 6% | 0.055 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -79.4 | -37.8 | 178.6 | -59.5 | 0 | 0 | 0 | 0 | 111.9 | K191 N192 T195 L255 L256 L257 | K191-T259 HydrophobicContact CG-CG2 4.2Å; N192-T259 WeakPolarHBondContact OD1-CG2 3.35Å; T195-T259 WeakPolarHBondContact CB-OG1 3.3Å; T195-T259 HydrophobicContact CG2-CG2 4.16Å; T195-T259 WeakPolarHBondContact CG2-OG1 3.44Å; T195-T259 PolarHBondContact OG1-OG1 2.87Å; L255-T259 WeakPolarHBondContact O-CB 3.27Å; L255-T259 PolarHBondContact O-N 3.04Å; L255-T259 PolarHBondContact O-OG1 2.92Å; L256-T259 PolarHBondContact O-N 3.18Å; L257-T259 VanDerWaalsContact C-N 3.32Å; L257-T259 PolarHBondContact O-N 3.21Å |
| 260 | F | 88.9 | Confident | 87 | Confident | 55 Ų | 55 | 61.5 Ų | 61.5 | 24% | 0.241 | 33% | 0.329 | C | S | . | . | S | Bend | trans | -107.2 | 37.9 | -176.7 | -61.7 | -73.3 | 0 | 0 | 0 | 112.5 | L196 L256 L257 E262 F263 F264 | L196-F260 HydrophobicContact CD2-CE2 4.35Å; L196-F260 HydrophobicContact CD2-CZ 4.42Å; L256-F260 HydrophobicContact CD1-CD2 3.71Å; L256-F260 HydrophobicContact CD1-CE2 3.61Å; L256-F260 HydrophobicContact CG-CD2 4.11Å; L256-F260 HydrophobicContact CG-CE2 4.5Å; L256-F260 WeakPolarHBondContact O-CD2 3.37Å; L256-F260 PolarHBondContact O-N 2.93Å; L257-F260 CarbonylContact O-C 3.59Å; F260-E262 VanDerWaalsContact C-N 3.3Å; F260-E262 PolarHBondContact O-N 3.09Å; F260-F263 HydrophobicContact CB-CB 4.23Å; F260-F263 WeakPolarHBondContact O-CB 3.06Å; F260-F263 PolarHBondContact O-N 3.46Å; F260-F263 VanDerWaalsContact O-N 3.14Å; F260-F264 HydrophobicContact CB-CD2 4.07Å; F260-F264 HydrophobicContact CB-CE2 3.95Å; F260-F264 VanDerWaalsContact O-CD2 3.23Å; F260-F264 WeakPolarHBondContact O-CD2 3.43Å; F260-F264 PolarHBondContact O-N 3.08Å |
| 261 | Q | 85 | Confident | 86.3 | Confident | 33 Ų | 33 | 61 Ų | 61 | 15% | 0.154 | 33% | 0.327 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -55.5 | -42.4 | -178.1 | -75 | 175.6 | -24.2 | 0 | 0 | 112.9 | L257 N258 F263 F264 G265 L266 L275 | L257-Q261 WeakPolarHBondContact O-CA 3.36Å; L257-Q261 VanDerWaalsContact O-CG 3.31Å; L257-Q261 WeakPolarHBondContact O-CG 3.36Å; L257-Q261 PolarHBondContact O-N 3.46Å; N258-Q261 WeakPolarHBondContact O-CG 3.4Å; N258-Q261 PolarHBondContact OD1-NE2 2.97Å; N258-Q261 VanDerWaalsContact OD1-NE2 3.08Å; Q261-F263 VanDerWaalsContact C-N 3.35Å; Q261-F263 PolarHBondContact O-N 2.63Å; Q261-F264 CarbonylContact O-C 3.55Å; Q261-F264 PolarHBondContact O-N 2.91Å; Q261-G265 PolarHBondContact O-N 3.49Å; Q261-L266 HydrophobicContact CB-CB 4.36Å; Q261-L266 HydrophobicContact CG-CB 4.46Å; Q261-L266 PolarHBondContact O-N 3.28Å; Q261-L275 HydrophobicContact CG-CD1 3.75Å |
| 262 | E | 81.8 | Confident | 85.6 | Confident | 164 Ų | 164 | 61 Ų | 61 | 77% | 0.766 | 33% | 0.33 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.5 | -42.1 | 178.9 | -67.5 | 178.1 | -177.7 | 0 | 0 | 111.9 | F260 F264 G265 | F260-E262 VanDerWaalsContact C-N 3.3Å; F260-E262 PolarHBondContact O-N 3.09Å; E262-F264 VanDerWaalsContact C-N 3.31Å; E262-F264 PolarHBondContact O-N 2.87Å; E262-G265 PolarHBondContact O-N 2.93Å |
| 263 | F | 84.9 | Confident | 84.9 | Confident | 170 Ų | 170 | 62.8 Ų | 62.8 | 75% | 0.746 | 34% | 0.34 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.9 | -36 | 179.1 | -175.5 | -95.8 | 0 | 0 | 0 | 112.3 | F260 Q261 | F260-F263 HydrophobicContact CB-CB 4.23Å; F260-F263 WeakPolarHBondContact O-CB 3.06Å; F260-F263 PolarHBondContact O-N 3.46Å; F260-F263 VanDerWaalsContact O-N 3.14Å; Q261-F263 VanDerWaalsContact C-N 3.35Å; Q261-F263 PolarHBondContact O-N 2.63Å |
| 264 | F | 83.6 | Confident | 84.4 | Confident | 98 Ų | 98 | 67.2 Ų | 67.2 | 43% | 0.43 | 35% | 0.351 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.6 | 2.4 | 177.9 | -67.3 | -67.3 | 0 | 0 | 0 | 114 | L257 F260 Q261 E262 L266 | L257-F264 HydrophobicContact CD2-CD1 4.41Å; L257-F264 HydrophobicContact CD2-CD2 3.72Å; L257-F264 HydrophobicContact CD2-CE2 3.84Å; L257-F264 HydrophobicContact CD2-CG 4.03Å; L257-F264 HydrophobicContact CD2-CZ 4.24Å; F260-F264 HydrophobicContact CB-CD2 4.07Å; F260-F264 HydrophobicContact CB-CE2 3.95Å; F260-F264 VanDerWaalsContact O-CD2 3.23Å; F260-F264 WeakPolarHBondContact O-CD2 3.43Å; F260-F264 PolarHBondContact O-N 3.08Å; Q261-F264 CarbonylContact O-C 3.55Å; Q261-F264 PolarHBondContact O-N 2.91Å; E262-F264 VanDerWaalsContact C-N 3.31Å; E262-F264 PolarHBondContact O-N 2.87Å; F264-L266 VanDerWaalsContact C-N 3.32Å; F264-L266 HydrophobicContact CB-CD1 3.98Å; F264-L266 HydrophobicContact CB-CG 4.07Å; F264-L266 PolarHBondContact O-N 3.41Å |
| 265 | G | 79.7 | Confident | 83.9 | Confident | 47 Ų | 47 | 67.3 Ų | 67.3 | 49% | 0.485 | 35% | 0.351 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 67 | 28.7 | -178.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | Q261 E262 | Q261-G265 PolarHBondContact O-N 3.49Å; E262-G265 PolarHBondContact O-N 2.93Å |
| 266 | L | 80.4 | Confident | 83.4 | Confident | 47 Ų | 47 | 68 Ų | 68 | 25% | 0.246 | 35% | 0.354 | C | S | . | . | trans | -102.4 | 17.6 | -177 | -61.8 | 174.6 | 0 | 0 | 0 | 113.3 | Q261 F264 N268 S271 L275 | Q261-L266 HydrophobicContact CB-CB 4.36Å; Q261-L266 HydrophobicContact CG-CB 4.46Å; Q261-L266 PolarHBondContact O-N 3.28Å; F264-L266 VanDerWaalsContact C-N 3.32Å; F264-L266 HydrophobicContact CB-CD1 3.98Å; F264-L266 HydrophobicContact CB-CG 4.07Å; F264-L266 PolarHBondContact O-N 3.41Å; L266-N268 PolarHBondContact O-N 3.49Å; L266-S271 WeakPolarHBondContact O-CB 3.07Å; L266-L275 HydrophobicContact CB-CD1 4Å; L266-L275 HydrophobicContact CD1-CD1 3.94Å; L266-L275 HydrophobicContact CD1-CD2 4.48Å | ||
| 267 | N | 75.9 | Confident | 82.8 | Confident | 105 Ų | 105 | 69.2 Ų | 69.2 | 56% | 0.561 | 36% | 0.359 | S | S | * | . | trans | -75.5 | 2.5 | -176.1 | 63.9 | -22.9 | 0 | 0 | 0 | 115 | ||||
| 268 | N | 82.1 | Confident | 82.6 | Confident | 95 Ų | 95 | 68.5 Ų | 68.5 | 51% | 0.508 | 36% | 0.36 | S | S | . | . | S | Bend | trans | -75.5 | 143.2 | 174.5 | -63 | -34.4 | 0 | 0 | 0 | 111.2 | L266 S270 S271 S272 | L266-N268 PolarHBondContact O-N 3.49Å; N268-S270 VanDerWaalsContact C-N 3.27Å; N268-S270 PolarHBondContact O-N 3.15Å; N268-S271 PolarHBondContact O-N 2.91Å; N268-S272 PolarHBondContact O-N 3.12Å |
| 269 | C | 78.1 | Confident | 82.5 | Confident | 74 Ų | 74 | 69.3 Ų | 69.3 | 50% | 0.5 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -57.5 | -35.9 | -179 | 165.5 | 0 | 0 | 0 | 0 | 113 | C20 N273 | C20-C269 HydrophobicContact CB-CB 4.05Å; C20-C269 WeakPolarHBondContact CB-SG 3.43Å; C20-C269 WeakPolarHBondContact SG-CB 3.25Å; C20-C269 PolarHBondContact SG-O 2.9Å; C20-C269 CovalentContact SG-SG 2.06Å; C20-C269 PolarHBondContact SG-SG 2.78Å; C269-N273 VanDerWaalsContact O-CB 3.31Å; C269-N273 WeakPolarHBondContact O-CB 3.36Å; C269-N273 PolarHBondContact O-N 3.43Å |
| 270 | S | 79.8 | Confident | 82.3 | Confident | 79 Ų | 79 | 71.7 Ų | 71.7 | 55% | 0.552 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -64.9 | -42.3 | 175 | 58.3 | 0 | 0 | 0 | 0 | 112.8 | N268 R274 | N268-S270 VanDerWaalsContact C-N 3.27Å; N268-S270 PolarHBondContact O-N 3.15Å; S270-R274 WeakPolarHBondContact O-CG 3.31Å; S270-R274 PolarHBondContact O-N 3.36Å |
| 271 | S | 81.1 | Confident | 82.1 | Confident | 29 Ų | 29 | 74 Ų | 74 | 20% | 0.203 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -69.6 | -43.4 | 176.8 | -63.5 | 0 | 0 | 0 | 0 | 111.8 | L266 N268 N273 R274 L275 | L266-S271 WeakPolarHBondContact O-CB 3.07Å; N268-S271 PolarHBondContact O-N 2.91Å; S271-N273 VanDerWaalsContact C-N 3.35Å; S271-N273 PolarHBondContact O-N 2.82Å; S271-R274 PolarHBondContact O-N 2.97Å; S271-L275 WeakPolarHBondContact O-CG 3.09Å; S271-L275 PolarHBondContact O-N 3.01Å |
| 272 | S | 79.4 | Confident | 82.4 | Confident | 24 Ų | 24 | 73.2 Ų | 73.2 | 17% | 0.168 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -59.6 | -44.8 | 174.8 | -176.3 | 0 | 0 | 0 | 0 | 111.3 | N268 R274 L275 D276 | N268-S272 PolarHBondContact O-N 3.12Å; S272-R274 VanDerWaalsContact C-N 3.33Å; S272-R274 PolarHBondContact O-N 3.45Å; S272-L275 WeakPolarHBondContact O-CB 3.33Å; S272-L275 PolarHBondContact O-N 2.96Å; S272-L275 VanDerWaalsContact O-N 3.14Å; S272-D276 PolarHBondContact O-N 3.41Å |
| 273 | N | 79.9 | Confident | 82.8 | Confident | 39 Ų | 39 | 68 Ų | 68 | 21% | 0.209 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -63.3 | -39.1 | 179.1 | -168.7 | 29.4 | 0 | 0 | 0 | 112 | C269 S271 D276 Q277 | C269-N273 VanDerWaalsContact O-CB 3.31Å; C269-N273 WeakPolarHBondContact O-CB 3.36Å; C269-N273 PolarHBondContact O-N 3.43Å; S271-N273 VanDerWaalsContact C-N 3.35Å; S271-N273 PolarHBondContact O-N 2.82Å; N273-D276 PolarHBondContact O-N 2.94Å; N273-Q277 WeakPolarHBondContact O-CG 3.23Å; N273-Q277 PolarHBondContact O-N 3.44Å; N273-Q277 VanDerWaalsContact O-N 3.09Å |
| 274 | R | 83.7 | Confident | 82.9 | Confident | 184 Ų | 184 | 60.7 Ų | 60.7 | 69% | 0.694 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -65.4 | -38.3 | 173.2 | -71.6 | 177.5 | -174.1 | -135.2 | 3 | 112.3 | S270 S271 S272 Q277 A278 | S270-R274 WeakPolarHBondContact O-CG 3.31Å; S270-R274 PolarHBondContact O-N 3.36Å; S271-R274 PolarHBondContact O-N 2.97Å; S272-R274 VanDerWaalsContact C-N 3.33Å; S272-R274 PolarHBondContact O-N 3.45Å; R274-Q277 PolarHBondContact O-N 3.47Å; R274-A278 WeakPolarHBondContact O-CB 3.46Å; R274-A278 PolarHBondContact O-N 3.38Å |
| 275 | L | 84.6 | Confident | 83.3 | Confident | 17 Ų | 17 | 59.1 Ų | 59.1 | 9% | 0.089 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -65.8 | -40.8 | 175.8 | -78.5 | 171.7 | 0 | 0 | 0 | 111.9 | L257 Q261 L266 S271 S272 A278 M279 | L257-L275 HydrophobicContact CB-CD2 3.99Å; L257-L275 HydrophobicContact CD1-CD2 4.49Å; Q261-L275 HydrophobicContact CG-CD1 3.75Å; L266-L275 HydrophobicContact CB-CD1 4Å; L266-L275 HydrophobicContact CD1-CD1 3.94Å; L266-L275 HydrophobicContact CD1-CD2 4.48Å; S271-L275 WeakPolarHBondContact O-CG 3.09Å; S271-L275 PolarHBondContact O-N 3.01Å; S272-L275 WeakPolarHBondContact O-CB 3.33Å; S272-L275 PolarHBondContact O-N 2.96Å; S272-L275 VanDerWaalsContact O-N 3.14Å; L275-A278 PolarHBondContact O-N 3.19Å; L275-M279 VanDerWaalsContact O-CB 3.32Å; L275-M279 WeakPolarHBondContact O-CB 3.19Å; L275-M279 PolarHBondContact O-N 3.08Å |
| 276 | D | 80.4 | Confident | 83.8 | Confident | 30 Ų | 30 | 56.9 Ų | 56.9 | 16% | 0.16 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -63.8 | -41.8 | 176.1 | -67.7 | -55.1 | 0 | 0 | 0 | 111.8 | K22 S272 N273 M279 Q280 | K22-D276 WeakPolarHBondContact CE-OD2 3.23Å; K22-D276 VanDerWaalsContact NZ-CG 3.29Å; K22-D276 IonicContact NZ-OD1 3.27Å; K22-D276 IonicContact NZ-OD2 3.9Å; K22-D276 PolarHBondContact NZ-OD2 2.83Å; S272-D276 PolarHBondContact O-N 3.41Å; N273-D276 PolarHBondContact O-N 2.94Å; D276-M279 PolarHBondContact O-N 3.27Å; D276-Q280 PolarHBondContact O-N 3.27Å |
| 277 | Q | 81.3 | Confident | 84.2 | Confident | 80 Ų | 80 | 55.6 Ų | 55.6 | 37% | 0.374 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -59.7 | -49.8 | 172.5 | -71.8 | 173.4 | 6.2 | 0 | 0 | 111.1 | V25 N273 R274 M279 Q280 V281 | V25-Q277 HydrophobicContact CB-CG 4.25Å; V25-Q277 HydrophobicContact CG1-CG 3.77Å; V25-Q277 HydrophobicContact CG2-CG 3.4Å; N273-Q277 WeakPolarHBondContact O-CG 3.23Å; N273-Q277 PolarHBondContact O-N 3.44Å; N273-Q277 VanDerWaalsContact O-N 3.09Å; R274-Q277 PolarHBondContact O-N 3.47Å; Q277-M279 VanDerWaalsContact C-N 3.26Å; Q277-M279 PolarHBondContact O-N 3.15Å; Q277-Q280 PolarHBondContact O-N 3.11Å; Q277-V281 WeakPolarHBondContact O-CG2 3.12Å; Q277-V281 PolarHBondContact O-N 2.87Å |
| 278 | A | 87.3 | Confident | 84.9 | Confident | 34 Ų | 34 | 51.6 Ų | 51.6 | 28% | 0.281 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -59.8 | -39 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | V254 R274 L275 V281 T282 | V254-A278 HydrophobicContact CG1-CB 4.08Å; V254-A278 HydrophobicContact CG2-CB 4.2Å; R274-A278 WeakPolarHBondContact O-CB 3.46Å; R274-A278 PolarHBondContact O-N 3.38Å; L275-A278 PolarHBondContact O-N 3.19Å; A278-V281 PolarHBondContact O-N 3.47Å; A278-T282 VanDerWaalsContact O-CB 3.31Å; A278-T282 WeakPolarHBondContact O-CB 3.35Å; A278-T282 VanDerWaalsContact O-CG2 3.26Å; A278-T282 WeakPolarHBondContact O-CG2 3.3Å; A278-T282 PolarHBondContact O-N 2.9Å; A278-T282 PolarHBondContact O-OG1 3.19Å |
| 279 | M | 86.3 | Confident | 85.5 | Confident | 43 Ų | 43 | 47.5 Ų | 47.5 | 21% | 0.212 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -63.6 | -46.5 | 178.3 | -170.5 | 168 | 66 | 0 | 0 | 110.5 | Y251 V254 N258 L275 D276 Q277 T282 E283 | Y251-M279 HydrophobicContact CE2-CG 4.27Å; V254-M279 HydrophobicContact CG1-CB 3.87Å; N258-M279 HydrophobicContact CB-SD 4.48Å; L275-M279 VanDerWaalsContact O-CB 3.32Å; L275-M279 WeakPolarHBondContact O-CB 3.19Å; L275-M279 PolarHBondContact O-N 3.08Å; D276-M279 PolarHBondContact O-N 3.27Å; Q277-M279 VanDerWaalsContact C-N 3.26Å; Q277-M279 PolarHBondContact O-N 3.15Å; M279-T282 PolarHBondContact O-N 3.01Å; M279-T282 PolarHBondContact O-OG1 3.26Å; M279-E283 WeakPolarHBondContact O-CB 3.44Å; M279-E283 PolarHBondContact O-N 3.11Å |
| 280 | Q | 83.2 | Confident | 86.1 | Confident | 59 Ų | 59 | 44.1 Ų | 44.1 | 28% | 0.276 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -63.1 | -45.2 | 177.6 | -171.6 | 166.5 | 35.9 | 0 | 0 | 112.3 | A29 L33 D276 Q277 T284 | A29-Q280 VanDerWaalsContact CB-NE2 3.33Å; L33-Q280 HydrophobicContact CD1-CG 4.48Å; D276-Q280 PolarHBondContact O-N 3.27Å; Q277-Q280 PolarHBondContact O-N 3.11Å; Q280-T284 WeakPolarHBondContact O-CB 3.21Å; Q280-T284 PolarHBondContact O-N 2.02Å; Q280-T284 PolarHBondContact O-OG1 3.33Å |
| 281 | V | 86.8 | Confident | 86.6 | Confident | 102 Ų | 102 | 41.1 Ų | 41.1 | 62% | 0.618 | 21% | 0.213 | S | C | * | . | H | α-helix | trans | -65 | -45.7 | 178.5 | 174.4 | 0 | 0 | 0 | 0 | 111.5 | Q277 A278 T284 L285 | Q277-V281 WeakPolarHBondContact O-CG2 3.12Å; Q277-V281 PolarHBondContact O-N 2.87Å; A278-V281 PolarHBondContact O-N 3.47Å; V281-T284 WeakPolarHBondContact O-CB 3.41Å; V281-T284 PolarHBondContact O-N 3.25Å; V281-L285 PolarHBondContact O-N 3.23Å |
| 282 | T | 91.3 | Very high | 87.1 | Confident | 18 Ų | 18 | 41.4 Ų | 41.4 | 11% | 0.11 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -71.8 | -32.8 | -178.4 | 55 | 0 | 0 | 0 | 0 | 112.6 | P250 V254 A278 M279 L285 G286 | P250-T282 HydrophobicContact CB-CG2 3.6Å; V254-T282 HydrophobicContact CG2-CG2 4.09Å; A278-T282 VanDerWaalsContact O-CB 3.31Å; A278-T282 WeakPolarHBondContact O-CB 3.35Å; A278-T282 VanDerWaalsContact O-CG2 3.26Å; A278-T282 WeakPolarHBondContact O-CG2 3.3Å; A278-T282 PolarHBondContact O-N 2.9Å; A278-T282 PolarHBondContact O-OG1 3.19Å; M279-T282 PolarHBondContact O-N 3.01Å; M279-T282 PolarHBondContact O-OG1 3.26Å; T282-L285 WeakPolarHBondContact O-CB 3.34Å; T282-L285 PolarHBondContact O-N 3.1Å; T282-G286 PolarHBondContact O-N 2.06Å |
| 283 | E | 88.9 | Confident | 87.5 | Confident | 53 Ų | 53 | 40.2 Ų | 40.2 | 25% | 0.248 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -64.4 | -46.2 | 170.8 | -177.4 | 171.9 | -156.3 | 0 | 0 | 111 | Y108 Y251 M279 L285 G286 M287 | Y108-E283 PolarHBondContact OH-OE1 3.18Å; Y251-E283 HydrophobicContact CD2-CB 3.67Å; Y251-E283 HydrophobicContact CD2-CG 4.35Å; Y251-E283 HydrophobicContact CE2-CB 3.7Å; Y251-E283 HydrophobicContact CE2-CG 4.03Å; M279-E283 WeakPolarHBondContact O-CB 3.44Å; M279-E283 PolarHBondContact O-N 3.11Å; E283-L285 VanDerWaalsContact C-N 3.29Å; E283-L285 PolarHBondContact O-N 3.08Å; E283-G286 CarbonylContact O-C 3.5Å; E283-G286 WeakPolarHBondContact O-CA 3.34Å; E283-G286 PolarHBondContact O-N 3.47Å; E283-G286 VanDerWaalsContact O-N 3.1Å; E283-M287 HydrophobicContact CG-CE 4Å; E283-M287 WeakPolarHBondContact O-CG 3.32Å; E283-M287 PolarHBondContact O-N 2.88Å |
| 284 | T | 87.2 | Confident | 87.9 | Confident | 17 Ų | 17 | 38.9 Ų | 38.9 | 10% | 0.104 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -57.1 | -44.9 | 175.2 | -57.4 | 0 | 0 | 0 | 0 | 110.8 | L33 L36 Y37 Q280 V281 M287 T288 | L33-T284 HydrophobicContact CD2-CG2 3.68Å; L33-T284 WeakPolarHBondContact CD2-OG1 3.36Å; L36-T284 HydrophobicContact CD2-CG2 3.48Å; L36-T284 VanDerWaalsContact CD2-CG2 3.48Å; Y37-T284 HydrophobicContact CE1-CG2 3.73Å; Y37-T284 PolarHBondContact OH-OG1 3.09Å; Q280-T284 WeakPolarHBondContact O-CB 3.21Å; Q280-T284 PolarHBondContact O-N 2.02Å; Q280-T284 PolarHBondContact O-OG1 3.33Å; V281-T284 WeakPolarHBondContact O-CB 3.41Å; V281-T284 PolarHBondContact O-N 3.25Å; T284-M287 PolarHBondContact O-N 3.01Å; T284-T288 WeakPolarHBondContact O-CG2 3.45Å; T284-T288 PolarHBondContact O-N 3.1Å; T284-T288 VanDerWaalsContact O-N 3.1Å |
| 285 | L | 91.6 | Very high | 88.2 | Confident | 65 Ų | 65 | 33.9 Ų | 33.9 | 34% | 0.34 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -58.6 | -50.7 | 173.7 | -179.9 | 65.7 | 0 | 0 | 0 | 110.5 | F247 P250 V281 T282 E283 M287 T288 | F247-L285 HydrophobicContact CD1-CD1 3.96Å; F247-L285 HydrophobicContact CD1-CG 4.29Å; F247-L285 VanDerWaalsContact CD1-O 3.31Å; F247-L285 WeakPolarHBondContact CD1-O 3.28Å; F247-L285 HydrophobicContact CE1-CD1 4.05Å; F247-L285 HydrophobicContact CG-CD1 4.49Å; P250-L285 HydrophobicContact CG-CD2 4.25Å; V281-L285 PolarHBondContact O-N 3.23Å; T282-L285 WeakPolarHBondContact O-CB 3.34Å; T282-L285 PolarHBondContact O-N 3.1Å; E283-L285 VanDerWaalsContact C-N 3.29Å; E283-L285 PolarHBondContact O-N 3.08Å; L285-M287 VanDerWaalsContact C-N 3.28Å; L285-M287 PolarHBondContact O-N 3.4Å; L285-T288 PolarHBondContact O-N 3.48Å; L285-T288 VanDerWaalsContact O-N 3.09Å; L285-T288 PolarHBondContact O-OG1 2.78Å |
| 286 | G | 91.8 | Very high | 88.3 | Confident | 0 Ų | 0 | 33.6 Ų | 33.6 | 0% | 0 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -54.3 | -43 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | W248 T282 E283 T288 H289 | W248-G286 VanDerWaalsContact CZ2-O 3.24Å; W248-G286 WeakPolarHBondContact CZ2-O 3.32Å; T282-G286 PolarHBondContact O-N 2.06Å; E283-G286 CarbonylContact O-C 3.5Å; E283-G286 WeakPolarHBondContact O-CA 3.34Å; E283-G286 PolarHBondContact O-N 3.47Å; E283-G286 VanDerWaalsContact O-N 3.1Å; G286-T288 VanDerWaalsContact C-N 3.31Å; G286-T288 PolarHBondContact O-N 3.36Å; G286-H289 WeakPolarHBondContact O-CB 3.37Å; G286-H289 PolarHBondContact O-N 3.36Å; G286-H289 VanDerWaalsContact O-N 3.08Å |
| 287 | M | 87.9 | Confident | 88.5 | Confident | 21 Ų | 21 | 32.9 Ų | 32.9 | 10% | 0.103 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -61.5 | -37.9 | 177.9 | -71.8 | -168.6 | -178.1 | 0 | 0 | 112.7 | Y37 F79 Y108 E283 T284 L285 H289 C290 | Y37-M287 HydrophobicContact CE1-CB 4.25Å; Y37-M287 HydrophobicContact CE1-SD 3.84Å; Y37-M287 HydrophobicContact CE2-SD 3.89Å; Y37-M287 PolarHBondContact OH-SD 3.38Å; F79-M287 HydrophobicContact CE1-CB 4Å; F79-M287 HydrophobicContact CE1-CG 3.89Å; F79-M287 HydrophobicContact CZ-CB 4.3Å; F79-M287 HydrophobicContact CZ-CG 3.78Å; Y108-M287 HydrophobicContact CE2-CE 3.85Å; E283-M287 HydrophobicContact CG-CE 4Å; E283-M287 WeakPolarHBondContact O-CG 3.32Å; E283-M287 PolarHBondContact O-N 2.88Å; T284-M287 PolarHBondContact O-N 3.01Å; L285-M287 VanDerWaalsContact C-N 3.28Å; L285-M287 PolarHBondContact O-N 3.4Å; M287-H289 PolarHBondContact O-N 3.1Å; M287-C290 PolarHBondContact O-N 3.18Å; M287-C290 PolarHBondContact O-SG 2.82Å |
| 288 | T | 91.2 | Very high | 88.5 | Confident | 21 Ų | 21 | 30.1 Ų | 30.1 | 13% | 0.129 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -64.5 | -19.1 | 178 | 65.5 | 0 | 0 | 0 | 0 | 113.1 | V40 F247 T284 L285 G286 C290 C291 | V40-T288 HydrophobicContact CG2-CG2 3.68Å; F247-T288 WeakPolarHBondContact CD1-OG1 3.42Å; F247-T288 VanDerWaalsContact CE1-OG1 3.25Å; F247-T288 WeakPolarHBondContact CE1-OG1 3.47Å; T284-T288 WeakPolarHBondContact O-CG2 3.45Å; T284-T288 PolarHBondContact O-N 3.1Å; T284-T288 VanDerWaalsContact O-N 3.1Å; L285-T288 PolarHBondContact O-N 3.48Å; L285-T288 VanDerWaalsContact O-N 3.09Å; L285-T288 PolarHBondContact O-OG1 2.78Å; G286-T288 VanDerWaalsContact C-N 3.31Å; G286-T288 PolarHBondContact O-N 3.36Å; T288-C290 PolarHBondContact O-N 2.89Å; T288-C290 VanDerWaalsContact O-N 3.17Å; T288-C291 PolarHBondContact O-N 2.94Å; T288-C291 PolarHBondContact O-SG 3.48Å |
| 289 | H | 93.1 | Very high | 88 | Confident | 9 Ų | 9 | 36.4 Ų | 36.4 | 4% | 0.042 | 19% | 0.19 | C | C | . | . | G | 310 helix | trans | -54.7 | -36 | 178.5 | 176.5 | -97.1 | 0 | 0 | 0 | 113.3 | Y244 F247 W248 G286 M287 C291 I292 | Y244-H289 AromaticContact CD2-CE1 3.84Å; Y244-H289 AromaticContact CD2-NE2 3.91Å; F247-H289 HydrophobicContact CB-CB 3.91Å; F247-H289 HydrophobicContact CD1-CB 3.98Å; F247-H289 HydrophobicContact CG-CB 4.16Å; W248-H289 AromaticContact CD1-CG 3.86Å; W248-H289 AromaticContact NE1-CG 3.51Å; W248-H289 AromaticContact NE1-ND1 3.55Å; G286-H289 WeakPolarHBondContact O-CB 3.37Å; G286-H289 PolarHBondContact O-N 3.36Å; G286-H289 VanDerWaalsContact O-N 3.08Å; M287-H289 PolarHBondContact O-N 3.1Å; H289-C291 PolarHBondContact O-N 2.82Å; H289-C291 VanDerWaalsContact O-N 3.09Å; H289-I292 WeakPolarHBondContact O-CB 3.35Å; H289-I292 PolarHBondContact O-N 3Å |
| 290 | C | 90.9 | Very high | 87.3 | Confident | 3 Ų | 3 | 35.6 Ų | 35.6 | 2% | 0.02 | 19% | 0.187 | C | C | . | . | G | 310 helix | trans | -61.2 | -21.8 | -175.3 | 66.3 | 0 | 0 | 0 | 0 | 113.8 | N48 D76 F79 L80 M287 T288 | N48-C290 PolarHBondContact ND2-O 2.78Å; D76-C290 HydrophobicContact CB-CB 4.26Å; F79-C290 HydrophobicContact CD1-CB 3.99Å; L80-C290 WeakPolarHBondContact CD2-SG 3.12Å; L80-C290 HydrophobicContact CG-CB 4.28Å; M287-C290 PolarHBondContact O-N 3.18Å; M287-C290 PolarHBondContact O-SG 2.82Å; T288-C290 PolarHBondContact O-N 2.89Å; T288-C290 VanDerWaalsContact O-N 3.17Å |
| 291 | C | 90.9 | Very high | 86.8 | Confident | 15 Ų | 15 | 33.5 Ų | 33.5 | 10% | 0.101 | 18% | 0.181 | C | C | . | . | G | 310 helix | trans | -94.8 | -7.4 | 175.7 | 73.1 | 0 | 0 | 0 | 0 | 113.9 | F43 T288 H289 | F43-C291 HydrophobicContact CB-CB 4.49Å; T288-C291 PolarHBondContact O-N 2.94Å; T288-C291 PolarHBondContact O-SG 3.48Å; H289-C291 PolarHBondContact O-N 2.82Å; H289-C291 VanDerWaalsContact O-N 3.09Å |
| 292 | I | 91.5 | Very high | 86.2 | Confident | 35 Ų | 35 | 33 Ų | 33 | 18% | 0.179 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -81.8 | -30.5 | -176.6 | -52.4 | -59.8 | 0 | 0 | 0 | 112 | V243 F247 H289 I295 I296 | V243-I292 HydrophobicContact CG1-CB 4.42Å; V243-I292 HydrophobicContact CG1-CG2 3.7Å; F247-I292 HydrophobicContact CD1-CG1 4.48Å; F247-I292 HydrophobicContact CE1-CD1 4.17Å; F247-I292 HydrophobicContact CE1-CG1 3.76Å; F247-I292 HydrophobicContact CZ-CD1 4.06Å; F247-I292 HydrophobicContact CZ-CG1 3.8Å; H289-I292 WeakPolarHBondContact O-CB 3.35Å; H289-I292 PolarHBondContact O-N 3Å; I292-I295 HydrophobicContact CD1-CD1 4.24Å; I292-I295 WeakPolarHBondContact O-CA 3.45Å; I292-I295 VanDerWaalsContact O-CB 3.3Å; I292-I295 WeakPolarHBondContact O-CB 3.36Å; I292-I295 PolarHBondContact O-N 2.93Å; I292-I296 HydrophobicContact CG2-CD1 4.04Å; I292-I296 HydrophobicContact CG2-CG1 4.05Å; I292-I296 WeakPolarHBondContact O-CG1 3.34Å; I292-I296 PolarHBondContact O-N 3.09Å |
| 293 | N | 88.3 | Confident | 85.5 | Confident | 0 Ų | 0 | 38.7 Ų | 38.7 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -54.6 | -51.2 | 179.7 | -77.2 | -27.3 | 0 | 0 | 0 | 113.3 | D76 I295 I296 Y297 | D76-N293 PolarHBondContact OD2-ND2 3.29Å; N293-I295 VanDerWaalsContact C-N 3.27Å; N293-I295 PolarHBondContact O-N 3.34Å; N293-I296 PolarHBondContact O-N 3.22Å; N293-Y297 HydrophobicContact CB-CE2 4.11Å; N293-Y297 WeakPolarHBondContact O-CD2 3.45Å; N293-Y297 WeakPolarHBondContact O-CE2 3.32Å; N293-Y297 PolarHBondContact O-N 2.86Å |
| 294 | P | 88.7 | Confident | 84.9 | Confident | 11 Ų | 11 | 36.8 Ų | 36.8 | 7% | 0.071 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -55.3 | -38.5 | 172.7 | -26.7 | 34.7 | 0 | 0 | 0 | 114.2 | V51 Y297 A298 | V51-P294 HydrophobicContact CG2-CB 3.97Å; V51-P294 HydrophobicContact CG2-CG 4.18Å; P294-Y297 PolarHBondContact O-N 2.78Å; P294-A298 WeakPolarHBondContact O-CB 3.21Å; P294-A298 PolarHBondContact O-N 2.86Å |
| 295 | I | 88.6 | Confident | 84.6 | Confident | 78 Ų | 78 | 41.7 Ų | 41.7 | 40% | 0.4 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -64.4 | -47.7 | 178.6 | -61.5 | 176.3 | 0 | 0 | 0 | 109.8 | I292 N293 Y297 A298 F299 | I292-I295 HydrophobicContact CD1-CD1 4.24Å; I292-I295 WeakPolarHBondContact O-CA 3.45Å; I292-I295 VanDerWaalsContact O-CB 3.3Å; I292-I295 WeakPolarHBondContact O-CB 3.36Å; I292-I295 PolarHBondContact O-N 2.93Å; N293-I295 VanDerWaalsContact C-N 3.27Å; N293-I295 PolarHBondContact O-N 3.34Å; I295-Y297 VanDerWaalsContact C-N 3.28Å; I295-Y297 PolarHBondContact O-N 2.85Å; I295-A298 PolarHBondContact O-N 3.23Å; I295-A298 VanDerWaalsContact O-N 3.1Å; I295-F299 HydrophobicContact CG2-CD2 3.64Å; I295-F299 HydrophobicContact CG2-CE2 3.65Å; I295-F299 VanDerWaalsContact O-CD2 3.23Å; I295-F299 WeakPolarHBondContact O-CD2 3.37Å; I295-F299 PolarHBondContact O-N 3.32Å |
| 296 | I | 87.3 | Confident | 84.1 | Confident | 11 Ų | 11 | 42.8 Ų | 42.8 | 6% | 0.056 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -56.6 | -45.5 | 175.5 | -63.8 | 168.8 | 0 | 0 | 0 | 110.3 | L236 T239 I240 V243 I292 N293 A298 F299 V300 | L236-I296 HydrophobicContact CD1-CG2 3.9Å; T239-I296 HydrophobicContact CG2-CG1 4.5Å; T239-I296 HydrophobicContact CG2-CG2 3.97Å; I240-I296 HydrophobicContact CG1-CD1 4.28Å; I240-I296 HydrophobicContact CG1-CG2 3.95Å; V243-I296 HydrophobicContact CB-CD1 3.95Å; V243-I296 HydrophobicContact CG1-CD1 4Å; V243-I296 HydrophobicContact CG2-CD1 3.98Å; I292-I296 HydrophobicContact CG2-CD1 4.04Å; I292-I296 HydrophobicContact CG2-CG1 4.05Å; I292-I296 WeakPolarHBondContact O-CG1 3.34Å; I292-I296 PolarHBondContact O-N 3.09Å; N293-I296 PolarHBondContact O-N 3.22Å; I296-A298 VanDerWaalsContact C-N 3.32Å; I296-A298 PolarHBondContact O-N 2.86Å; I296-F299 PolarHBondContact O-N 3.48Å; I296-V300 HydrophobicContact CG2-CB 4.46Å; I296-V300 HydrophobicContact CG2-CG2 4.06Å; I296-V300 VanDerWaalsContact O-CB 3.25Å; I296-V300 WeakPolarHBondContact O-CB 3.24Å; I296-V300 WeakPolarHBondContact O-CG2 3.49Å; I296-V300 PolarHBondContact O-N 2.98Å |
| 297 | Y | 83.8 | Confident | 83.5 | Confident | 15 Ų | 15 | 44.5 Ų | 44.5 | 6% | 0.059 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -63 | -38.7 | 178.4 | -60.1 | -46.4 | 0 | 0 | 0 | 112.4 | V51 L69 L72 L236 I240 N293 P294 I295 G301 F304 | V51-Y297 HydrophobicContact CG1-CD2 3.91Å; V51-Y297 HydrophobicContact CG1-CE2 3.99Å; V51-Y297 HydrophobicContact CG2-CD2 3.78Å; V51-Y297 HydrophobicContact CG2-CE2 4.46Å; L69-Y297 HydrophobicContact CD2-CE1 3.89Å; L69-Y297 WeakPolarHBondContact CD2-OH 3.34Å; L72-Y297 WeakPolarHBondContact CD1-OH 3.26Å; L236-Y297 HydrophobicContact CD1-CD1 4.1Å; L236-Y297 HydrophobicContact CD1-CE1 4.44Å; L236-Y297 HydrophobicContact CD2-CD1 4.5Å; I240-Y297 HydrophobicContact CD1-CE1 3.63Å; N293-Y297 HydrophobicContact CB-CE2 4.11Å; N293-Y297 WeakPolarHBondContact O-CD2 3.45Å; N293-Y297 WeakPolarHBondContact O-CE2 3.32Å; N293-Y297 PolarHBondContact O-N 2.86Å; P294-Y297 PolarHBondContact O-N 2.78Å; I295-Y297 VanDerWaalsContact C-N 3.28Å; I295-Y297 PolarHBondContact O-N 2.85Å; Y297-G301 VanDerWaalsContact O-CA 3.24Å; Y297-G301 WeakPolarHBondContact O-CA 3.4Å; Y297-G301 PolarHBondContact O-N 2.75Å; Y297-F304 VanDerWaalsContact C-CD1 3.46Å |
| 298 | A | 82 | Confident | 83.1 | Confident | 23 Ų | 23 | 44.7 Ų | 44.7 | 19% | 0.19 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -65.9 | -40.4 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | P294 I295 I296 F304 L308 | P294-A298 WeakPolarHBondContact O-CB 3.21Å; P294-A298 PolarHBondContact O-N 2.86Å; I295-A298 PolarHBondContact O-N 3.23Å; I295-A298 VanDerWaalsContact O-N 3.1Å; I296-A298 VanDerWaalsContact C-N 3.32Å; I296-A298 PolarHBondContact O-N 2.86Å; A298-F304 HydrophobicContact CB-CD1 4.26Å; A298-F304 HydrophobicContact CB-CE1 4.13Å; A298-L308 HydrophobicContact CB-CD1 3.97Å |
| 299 | F | 76.4 | Confident | 82.6 | Confident | 166 Ų | 166 | 48.3 Ų | 48.3 | 73% | 0.728 | 24% | 0.235 | S | C | * | . | H | α-helix | trans | -85.7 | -38.9 | -178.1 | -73.5 | -71.7 | 0 | 0 | 0 | 113.3 | I295 I296 | I295-F299 HydrophobicContact CG2-CD2 3.64Å; I295-F299 HydrophobicContact CG2-CE2 3.65Å; I295-F299 VanDerWaalsContact O-CD2 3.23Å; I295-F299 WeakPolarHBondContact O-CD2 3.37Å; I295-F299 PolarHBondContact O-N 3.32Å; I296-F299 PolarHBondContact O-N 3.48Å |
| 300 | V | 73 | Confident | 82.1 | Confident | 25 Ų | 25 | 51.8 Ų | 51.8 | 15% | 0.152 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -93.4 | -28.7 | -173.1 | -173.5 | 0 | 0 | 0 | 0 | 112 | R232 L236 T239 I296 | R232-V300 PolarHBondContact NH2-O 3.21Å; R232-V300 VanDerWaalsContact NH2-O 3.15Å; L236-V300 HydrophobicContact CB-CG1 4.04Å; L236-V300 HydrophobicContact CD1-CB 3.79Å; L236-V300 HydrophobicContact CD1-CG1 3.73Å; T239-V300 HydrophobicContact CG2-CG2 4.49Å; I296-V300 HydrophobicContact CG2-CB 4.46Å; I296-V300 HydrophobicContact CG2-CG2 4.06Å; I296-V300 VanDerWaalsContact O-CB 3.25Å; I296-V300 WeakPolarHBondContact O-CB 3.24Å; I296-V300 WeakPolarHBondContact O-CG2 3.49Å; I296-V300 PolarHBondContact O-N 2.98Å |
| 301 | G | 71.8 | Confident | 81.6 | Confident | 15 Ų | 15 | 53.9 Ų | 53.9 | 16% | 0.155 | 27% | 0.266 | C | S | . | . | trans | -98.7 | 97.3 | -176.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | Y297 K303 F304 R305 | Y297-G301 VanDerWaalsContact O-CA 3.24Å; Y297-G301 WeakPolarHBondContact O-CA 3.4Å; Y297-G301 PolarHBondContact O-N 2.75Å; G301-K303 PolarHBondContact O-N 3.42Å; G301-K303 VanDerWaalsContact O-N 3.16Å; G301-F304 PolarHBondContact O-N 3.46Å; G301-F304 VanDerWaalsContact O-N 3.07Å; G301-R305 PolarHBondContact O-N 3.38Å | ||
| 302 | E | 74.9 | Confident | 81.1 | Confident | 93 Ų | 93 | 57.7 Ų | 57.7 | 44% | 0.435 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -55.2 | -37.3 | 176.4 | -91.2 | 156.6 | -124.6 | 0 | 0 | 113 | R232 F304 R305 N306 | R232-E302 IonicContact CZ-OE1 2.92Å; R232-E302 IonicContact CZ-OE2 2.7Å; R232-E302 IonicContact NH1-OE1 3.56Å; R232-E302 PolarHBondContact NH1-OE1 3.26Å; R232-E302 IonicContact NH1-OE2 2.72Å; R232-E302 PolarHBondContact NH1-OE2 2.97Å; R232-E302 IonicContact NH2-OE1 2.61Å; R232-E302 PolarHBondContact NH2-OE1 3.28Å; R232-E302 IonicContact NH2-OE2 3.12Å; E302-F304 VanDerWaalsContact C-N 3.34Å; E302-F304 PolarHBondContact O-N 2.92Å; E302-R305 PolarHBondContact O-N 3.37Å; E302-N306 WeakPolarHBondContact O-CB 3.09Å; E302-N306 VanDerWaalsContact O-CG 3.23Å; E302-N306 PolarHBondContact O-N 3.49Å; E302-N306 PolarHBondContact O-OD1 3.38Å |
| 303 | K | 75.6 | Confident | 80.5 | Confident | 137 Ų | 137 | 62 Ų | 62 | 60% | 0.596 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -64.8 | -40 | 180 | -67.2 | -171.1 | 177.2 | -172.3 | 0 | 112.1 | F54 G301 Y307 | F54-K303 HydrophobicContact CZ-CB 4.29Å; G301-K303 PolarHBondContact O-N 3.42Å; G301-K303 VanDerWaalsContact O-N 3.16Å; K303-Y307 PolarHBondContact O-N 3.45Å |
| 304 | F | 76.1 | Confident | 79.9 | Confident | 12 Ų | 12 | 68.7 Ų | 68.7 | 5% | 0.053 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -74.1 | -41.7 | 177.7 | 179.4 | -116 | 0 | 0 | 0 | 110.7 | V51 F54 Y297 A298 G301 E302 N306 Y307 L308 | V51-F304 HydrophobicContact CG2-CE1 4.16Å; V51-F304 HydrophobicContact CG2-CE2 3.95Å; V51-F304 HydrophobicContact CG2-CZ 3.54Å; F54-F304 HydrophobicContact CB-CD2 3.95Å; F54-F304 HydrophobicContact CB-CE2 3.93Å; F54-F304 HydrophobicContact CD1-CB 4.37Å; F54-F304 AromaticContact CD1-CD2 3.43Å; F54-F304 HydrophobicContact CD1-CD2 3.43Å; F54-F304 VanDerWaalsContact CD1-CD2 3.43Å; F54-F304 HydrophobicContact CD1-CE2 4.17Å; F54-F304 HydrophobicContact CD1-CG 4.31Å; F54-F304 HydrophobicContact CD2-CD2 4.23Å; F54-F304 HydrophobicContact CE1-CB 3.93Å; F54-F304 AromaticContact CE1-CD2 3.88Å; F54-F304 HydrophobicContact CE1-CD2 3.88Å; F54-F304 HydrophobicContact CE1-CG 4.36Å; F54-F304 AromaticContact CG-CD2 3.6Å; F54-F304 HydrophobicContact CG-CD2 3.6Å; F54-F304 HydrophobicContact CG-CE2 4.12Å; F54-F304 HydrophobicContact CZ-CB 4.18Å; F54-F304 HydrophobicContact CZ-CD2 4.44Å; Y297-F304 VanDerWaalsContact C-CD1 3.46Å; A298-F304 HydrophobicContact CB-CD1 4.26Å; A298-F304 HydrophobicContact CB-CE1 4.13Å; G301-F304 PolarHBondContact O-N 3.46Å; G301-F304 VanDerWaalsContact O-N 3.07Å; E302-F304 VanDerWaalsContact C-N 3.34Å; E302-F304 PolarHBondContact O-N 2.92Å; F304-N306 VanDerWaalsContact C-N 3.35Å; F304-N306 PolarHBondContact O-N 3.32Å; F304-Y307 HydrophobicContact CD2-CD1 4.44Å; F304-Y307 HydrophobicContact CE2-CD1 4.46Å; F304-Y307 WeakPolarHBondContact O-CB 3.25Å; F304-Y307 PolarHBondContact O-N 2.74Å; F304-Y307 VanDerWaalsContact O-N 3.1Å; F304-L308 HydrophobicContact CD1-CD1 3.9Å; F304-L308 HydrophobicContact CD1-CG 4.26Å; F304-L308 HydrophobicContact CD2-CG 4.48Å; F304-L308 HydrophobicContact CE1-CD1 3.46Å; F304-L308 VanDerWaalsContact CE1-CD1 3.46Å; F304-L308 HydrophobicContact CE1-CD2 4.3Å; F304-L308 HydrophobicContact CE1-CG 3.91Å; F304-L308 HydrophobicContact CE2-CD2 4.11Å; F304-L308 HydrophobicContact CE2-CG 4.14Å; F304-L308 HydrophobicContact CZ-CD1 3.85Å; F304-L308 HydrophobicContact CZ-CD2 3.79Å; F304-L308 HydrophobicContact CZ-CG 3.85Å; F304-L308 PolarHBondContact O-N 3.3Å |
| 305 | R | 81.9 | Confident | 79.2 | Confident | 120 Ų | 120 | 72.7 Ų | 72.7 | 45% | 0.453 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -55.6 | -46.9 | 174.1 | -169 | 178.6 | 69.6 | -175.7 | 3.3 | 112.7 | G301 E302 Y307 L308 L309 | G301-R305 PolarHBondContact O-N 3.38Å; E302-R305 PolarHBondContact O-N 3.37Å; R305-Y307 VanDerWaalsContact C-N 3.31Å; R305-Y307 PolarHBondContact O-N 3.02Å; R305-L308 PolarHBondContact O-N 3.47Å; R305-L309 WeakPolarHBondContact O-CG 3.37Å; R305-L309 PolarHBondContact O-N 3.46Å |
| 306 | N | 80.9 | Confident | 78.2 | Confident | 88 Ų | 88 | 72 Ų | 72 | 47% | 0.471 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -64.4 | -37.4 | 177.6 | -70.1 | -2.2 | 0 | 0 | 0 | 111.7 | E302 F304 L309 V310 | E302-N306 WeakPolarHBondContact O-CB 3.09Å; E302-N306 VanDerWaalsContact O-CG 3.23Å; E302-N306 PolarHBondContact O-N 3.49Å; E302-N306 PolarHBondContact O-OD1 3.38Å; F304-N306 VanDerWaalsContact C-N 3.35Å; F304-N306 PolarHBondContact O-N 3.32Å; N306-L309 PolarHBondContact O-N 3.46Å; N306-V310 WeakPolarHBondContact O-CG2 3.37Å; N306-V310 PolarHBondContact O-N 3.48Å; N306-V310 VanDerWaalsContact O-N 3.08Å |
| 307 | Y | 78.8 | Confident | 77 | Confident | 36 Ų | 36 | 73.7 Ų | 73.7 | 14% | 0.141 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -64.3 | -45.5 | 173.3 | 172.2 | -103.3 | 0 | 0 | 0 | 112.3 | F54 C58 K303 F304 R305 L309 V310 F311 | F54-Y307 HydrophobicContact CB-CD1 3.63Å; F54-Y307 HydrophobicContact CB-CE1 3.55Å; F54-Y307 HydrophobicContact CB-CG 4.36Å; F54-Y307 VanDerWaalsContact CD2-CB 3.43Å; F54-Y307 AromaticContact CD2-CD1 3.39Å; F54-Y307 HydrophobicContact CD2-CD1 3.39Å; F54-Y307 AromaticContact CD2-CD2 3.82Å; F54-Y307 HydrophobicContact CD2-CD2 3.82Å; F54-Y307 HydrophobicContact CD2-CE1 4.02Å; F54-Y307 HydrophobicContact CD2-CE2 4.4Å; F54-Y307 AromaticContact CD2-CG 3.24Å; F54-Y307 HydrophobicContact CD2-CG 3.24Å; F54-Y307 VanDerWaalsContact CE2-CB 3.46Å; F54-Y307 HydrophobicContact CE2-CD1 4.31Å; F54-Y307 HydrophobicContact CE2-CD2 4.41Å; F54-Y307 AromaticContact CE2-CG 3.83Å; F54-Y307 HydrophobicContact CE2-CG 3.83Å; F54-Y307 AromaticContact CG-CD1 3.82Å; F54-Y307 HydrophobicContact CG-CD1 3.82Å; F54-Y307 HydrophobicContact CG-CE1 4.22Å; F54-Y307 HydrophobicContact CG-CG 4.14Å; C58-Y307 HydrophobicContact CB-CD2 4.28Å; C58-Y307 HydrophobicContact CB-CE2 4.48Å; C58-Y307 WeakPolarHBondContact SG-CD2 3.16Å; C58-Y307 WeakPolarHBondContact SG-CE2 3.21Å; K303-Y307 PolarHBondContact O-N 3.45Å; F304-Y307 HydrophobicContact CD2-CD1 4.44Å; F304-Y307 HydrophobicContact CE2-CD1 4.46Å; F304-Y307 WeakPolarHBondContact O-CB 3.25Å; F304-Y307 PolarHBondContact O-N 2.74Å; F304-Y307 VanDerWaalsContact O-N 3.1Å; R305-Y307 VanDerWaalsContact C-N 3.31Å; R305-Y307 PolarHBondContact O-N 3.02Å; Y307-L309 VanDerWaalsContact C-N 3.3Å; Y307-L309 PolarHBondContact O-N 3.48Å; Y307-V310 PolarHBondContact O-N 3.38Å; Y307-F311 HydrophobicContact CE1-CB 4.35Å; Y307-F311 VanDerWaalsContact O-CB 3.28Å; Y307-F311 WeakPolarHBondContact O-CB 3.49Å; Y307-F311 PolarHBondContact O-N 3.03Å |
| 308 | L | 80.3 | Confident | 75.7 | Confident | 26 Ų | 26 | 80 Ų | 80 | 14% | 0.136 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -55.4 | -48.9 | 175.2 | -74.2 | 178.9 | 0 | 0 | 0 | 110 | L50 A298 F304 R305 V310 F311 F312 | L50-L308 HydrophobicContact CD1-CD2 4.21Å; A298-L308 HydrophobicContact CB-CD1 3.97Å; F304-L308 HydrophobicContact CD1-CD1 3.9Å; F304-L308 HydrophobicContact CD1-CG 4.26Å; F304-L308 HydrophobicContact CD2-CG 4.48Å; F304-L308 HydrophobicContact CE1-CD1 3.46Å; F304-L308 VanDerWaalsContact CE1-CD1 3.46Å; F304-L308 HydrophobicContact CE1-CD2 4.3Å; F304-L308 HydrophobicContact CE1-CG 3.91Å; F304-L308 HydrophobicContact CE2-CD2 4.11Å; F304-L308 HydrophobicContact CE2-CG 4.14Å; F304-L308 HydrophobicContact CZ-CD1 3.85Å; F304-L308 HydrophobicContact CZ-CD2 3.79Å; F304-L308 HydrophobicContact CZ-CG 3.85Å; F304-L308 PolarHBondContact O-N 3.3Å; R305-L308 PolarHBondContact O-N 3.47Å; L308-V310 PolarHBondContact O-N 3.36Å; L308-F311 PolarHBondContact O-N 2.94Å; L308-F311 VanDerWaalsContact O-N 3.15Å; L308-F312 HydrophobicContact CB-CD2 4.17Å; L308-F312 HydrophobicContact CB-CE2 4.21Å; L308-F312 HydrophobicContact CD2-CE2 4.25Å; L308-F312 WeakPolarHBondContact O-CB 3.17Å; L308-F312 WeakPolarHBondContact O-CD2 3.36Å; L308-F312 PolarHBondContact O-N 3.15Å |
| 309 | L | 80.9 | Confident | 74.3 | Confident | 96 Ų | 96 | 88.4 Ų | 88.4 | 50% | 0.503 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -55.8 | -47.1 | 177.8 | -70.6 | 171.4 | 0 | 0 | 0 | 112.5 | R305 N306 Y307 F312 Q313 | R305-L309 WeakPolarHBondContact O-CG 3.37Å; R305-L309 PolarHBondContact O-N 3.46Å; N306-L309 PolarHBondContact O-N 3.46Å; Y307-L309 VanDerWaalsContact C-N 3.3Å; Y307-L309 PolarHBondContact O-N 3.48Å; L309-F312 PolarHBondContact O-N 3.44Å; L309-Q313 WeakPolarHBondContact O-CB 3.34Å; L309-Q313 VanDerWaalsContact O-CG 3.23Å; L309-Q313 WeakPolarHBondContact O-CG 3.3Å; L309-Q313 PolarHBondContact O-N 2.83Å |
| 310 | V | 81.5 | Confident | 73.1 | Confident | 83 Ų | 83 | 87.7 Ų | 87.7 | 50% | 0.503 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -66 | -40.1 | 177.6 | 173.2 | 0 | 0 | 0 | 0 | 111.7 | N306 Y307 L308 Q313 K314 | N306-V310 WeakPolarHBondContact O-CG2 3.37Å; N306-V310 PolarHBondContact O-N 3.48Å; N306-V310 VanDerWaalsContact O-N 3.08Å; Y307-V310 PolarHBondContact O-N 3.38Å; L308-V310 PolarHBondContact O-N 3.36Å; V310-Q313 PolarHBondContact O-N 3.5Å; V310-K314 VanDerWaalsContact O-CB 3.29Å; V310-K314 WeakPolarHBondContact O-CB 3.41Å; V310-K314 PolarHBondContact O-N 3.35Å |
| 311 | F | 80.3 | Confident | 71.9 | Confident | 46 Ų | 46 | 89.8 Ų | 89.8 | 20% | 0.202 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -64.2 | -47.5 | 177.7 | -178.2 | -92 | 0 | 0 | 0 | 111.2 | L50 Y307 L308 Q313 K314 H315 | L50-F311 HydrophobicContact CD2-CD1 4.01Å; L50-F311 HydrophobicContact CD2-CE1 3.58Å; L50-F311 HydrophobicContact CD2-CZ 3.86Å; Y307-F311 HydrophobicContact CE1-CB 4.35Å; Y307-F311 VanDerWaalsContact O-CB 3.28Å; Y307-F311 WeakPolarHBondContact O-CB 3.49Å; Y307-F311 PolarHBondContact O-N 3.03Å; L308-F311 PolarHBondContact O-N 2.94Å; L308-F311 VanDerWaalsContact O-N 3.15Å; F311-Q313 PolarHBondContact O-N 3.05Å; F311-K314 PolarHBondContact O-N 3.41Å; F311-H315 AromaticContact CD2-CD2 3.7Å; F311-H315 AromaticContact CE2-CD2 3.7Å; F311-H315 HydrophobicContact CZ-CB 4.48Å; F311-H315 WeakPolarHBondContact O-CB 3.39Å; F311-H315 PolarHBondContact O-N 3.27Å |
| 312 | F | 81.1 | Confident | 70.6 | Confident | 95 Ų | 95 | 98 Ų | 98 | 42% | 0.417 | 46% | 0.456 | S | S | . | . | I | π-helix | trans | -58.7 | -46.4 | 174.1 | -83.2 | -73.3 | 0 | 0 | 0 | 110.7 | L308 L309 K314 I316 A317 | L308-F312 HydrophobicContact CB-CD2 4.17Å; L308-F312 HydrophobicContact CB-CE2 4.21Å; L308-F312 HydrophobicContact CD2-CE2 4.25Å; L308-F312 WeakPolarHBondContact O-CB 3.17Å; L308-F312 WeakPolarHBondContact O-CD2 3.36Å; L308-F312 PolarHBondContact O-N 3.15Å; L309-F312 PolarHBondContact O-N 3.44Å; F312-K314 PolarHBondContact O-N 3.02Å; F312-I316 HydrophobicContact CD1-CB 4.12Å; F312-I316 HydrophobicContact CD1-CD1 3.23Å; F312-I316 HydrophobicContact CD1-CG1 4.2Å; F312-I316 HydrophobicContact CD1-CG2 4.31Å; F312-I316 HydrophobicContact CE1-CD1 3.34Å; F312-I316 HydrophobicContact CG-CD1 4.25Å; F312-I316 HydrophobicContact CZ-CD1 4.42Å; F312-I316 CarbonylContact O-C 3.53Å; F312-I316 WeakPolarHBondContact O-CA 3.49Å; F312-I316 WeakPolarHBondContact O-CB 3.29Å; F312-I316 PolarHBondContact O-N 3.48Å; F312-A317 PolarHBondContact O-N 3.43Å |
| 313 | Q | 78.3 | Confident | 69.2 | Low | 125 Ų | 125 | 99 Ų | 99 | 58% | 0.584 | 47% | 0.473 | S | S | * | . | I | π-helix | trans | -60.9 | -46.1 | 177.3 | -75.5 | 171.5 | -6.7 | 0 | 0 | 112.6 | L309 V310 F311 K318 | L309-Q313 WeakPolarHBondContact O-CB 3.34Å; L309-Q313 VanDerWaalsContact O-CG 3.23Å; L309-Q313 WeakPolarHBondContact O-CG 3.3Å; L309-Q313 PolarHBondContact O-N 2.83Å; V310-Q313 PolarHBondContact O-N 3.5Å; F311-Q313 PolarHBondContact O-N 3.05Å; Q313-K318 PolarHBondContact O-N 2.74Å |
| 314 | K | 75.6 | Confident | 67.4 | Low | 142 Ų | 142 | 96.1 Ų | 96.1 | 62% | 0.617 | 47% | 0.469 | S | S | * | . | I | π-helix | trans | -74.7 | -39.2 | -174 | -171.1 | 178.1 | 179 | -176.7 | 0 | 113.5 | V310 F311 F312 K318 | V310-K314 VanDerWaalsContact O-CB 3.29Å; V310-K314 WeakPolarHBondContact O-CB 3.41Å; V310-K314 PolarHBondContact O-N 3.35Å; F311-K314 PolarHBondContact O-N 3.41Å; F312-K314 PolarHBondContact O-N 3.02Å; K314-K318 WeakPolarHBondContact O-CB 3.42Å |
| 315 | H | 74.3 | Confident | 65.4 | Low | 94 Ų | 94 | 101.1 Ų | 101.1 | 44% | 0.435 | 51% | 0.506 | S | S | . | . | I | π-helix | trans | -107.6 | -30.3 | -170.4 | -69.9 | -79 | 0 | 0 | 0 | 114.2 | F311 R319 | F311-H315 AromaticContact CD2-CD2 3.7Å; F311-H315 AromaticContact CE2-CD2 3.7Å; F311-H315 HydrophobicContact CZ-CB 4.48Å; F311-H315 WeakPolarHBondContact O-CB 3.39Å; F311-H315 PolarHBondContact O-N 3.27Å; H315-R319 WeakPolarHBondContact O-CB 3.12Å |
| 316 | I | 68.4 | Low | 63.6 | Low | 65 Ų | 65 | 102.4 Ų | 102.4 | 33% | 0.333 | 52% | 0.52 | S | S | . | . | I | π-helix | trans | -103.7 | -56 | -175.2 | -66.5 | 168.3 | 0 | 0 | 0 | 109.5 | F312 K318 R319 F320 | F312-I316 HydrophobicContact CD1-CB 4.12Å; F312-I316 HydrophobicContact CD1-CD1 3.23Å; F312-I316 HydrophobicContact CD1-CG1 4.2Å; F312-I316 HydrophobicContact CD1-CG2 4.31Å; F312-I316 HydrophobicContact CE1-CD1 3.34Å; F312-I316 HydrophobicContact CG-CD1 4.25Å; F312-I316 HydrophobicContact CZ-CD1 4.42Å; F312-I316 CarbonylContact O-C 3.53Å; F312-I316 WeakPolarHBondContact O-CA 3.49Å; F312-I316 WeakPolarHBondContact O-CB 3.29Å; F312-I316 PolarHBondContact O-N 3.48Å; I316-K318 VanDerWaalsContact C-N 3.32Å; I316-K318 PolarHBondContact O-N 3.31Å; I316-R319 PolarHBondContact O-N 3.34Å; I316-F320 HydrophobicContact CG2-CD2 3.71Å; I316-F320 HydrophobicContact CG2-CE2 3.93Å; I316-F320 WeakPolarHBondContact O-CD2 3.05Å; I316-F320 PolarHBondContact O-N 3.44Å |
| 317 | A | 61.9 | Low | 61.4 | Low | 45 Ų | 45 | 106.3 Ų | 106.3 | 37% | 0.372 | 53% | 0.533 | S | S | . | . | I | π-helix | trans | -62.3 | -37 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | F312 R319 F320 C321 | F312-A317 PolarHBondContact O-N 3.43Å; A317-R319 VanDerWaalsContact C-N 3.35Å; A317-R319 PolarHBondContact O-N 3.32Å; A317-F320 PolarHBondContact O-N 2.92Å; A317-C321 WeakPolarHBondContact O-CA 3.26Å; A317-C321 WeakPolarHBondContact O-CB 3.45Å; A317-C321 PolarHBondContact O-N 2.99Å; A317-C321 PolarHBondContact O-SG 3.06Å |
| 318 | K | 55.2 | Low | 59.6 | Low | 149 Ų | 149 | 113.8 Ų | 113.8 | 65% | 0.648 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -70.4 | -26.1 | 174.8 | -155.2 | 174.1 | -175.1 | 176.4 | 0 | 113.9 | Q313 K314 I316 K322 | Q313-K318 PolarHBondContact O-N 2.74Å; K314-K318 WeakPolarHBondContact O-CB 3.42Å; I316-K318 VanDerWaalsContact C-N 3.32Å; I316-K318 PolarHBondContact O-N 3.31Å; K318-K322 PolarHBondContact O-N 2.78Å |
| 319 | R | 53.4 | Low | 57.5 | Low | 199 Ų | 199 | 120.8 Ų | 120.8 | 75% | 0.751 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -80 | -41.1 | 172.8 | -96.3 | -178 | 170.1 | 178.7 | -3.1 | 111.7 | H315 I316 A317 K322 C323 | H315-R319 WeakPolarHBondContact O-CB 3.12Å; I316-R319 PolarHBondContact O-N 3.34Å; A317-R319 VanDerWaalsContact C-N 3.35Å; A317-R319 PolarHBondContact O-N 3.32Å; R319-K322 WeakPolarHBondContact O-CB 3.44Å; R319-K322 PolarHBondContact O-N 3.4Å; R319-C323 PolarHBondContact O-N 3.5Å |
| 320 | F | 51.8 | Low | 55.4 | Low | 151 Ų | 151 | 124.8 Ų | 124.8 | 66% | 0.662 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -72.4 | -35.1 | 175.3 | -83.9 | -84.1 | 0 | 0 | 0 | 112.5 | I316 A317 K322 C323 C324 | I316-F320 HydrophobicContact CG2-CD2 3.71Å; I316-F320 HydrophobicContact CG2-CE2 3.93Å; I316-F320 WeakPolarHBondContact O-CD2 3.05Å; I316-F320 PolarHBondContact O-N 3.44Å; A317-F320 PolarHBondContact O-N 2.92Å; F320-K322 VanDerWaalsContact C-N 3.27Å; F320-K322 PolarHBondContact O-N 3.25Å; F320-C323 CarbonylContact O-C 3.47Å; F320-C323 WeakPolarHBondContact O-CA 3.35Å; F320-C323 PolarHBondContact O-N 2.99Å; F320-C324 PolarHBondContact O-N 3.29Å; F320-C324 VanDerWaalsContact O-N 3.07Å |
| 321 | C | 46.9 | Very low | 53.1 | Low | 69 Ų | 69 | 124.9 Ų | 124.9 | 47% | 0.466 | 63% | 0.627 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -69.4 | -19.8 | 169.4 | -80.6 | 0 | 0 | 0 | 0 | 113.2 | A317 C323 C324 | A317-C321 WeakPolarHBondContact O-CA 3.26Å; A317-C321 WeakPolarHBondContact O-CB 3.45Å; A317-C321 PolarHBondContact O-N 2.99Å; A317-C321 PolarHBondContact O-SG 3.06Å; C321-C323 VanDerWaalsContact C-N 3.25Å; C321-C324 PolarHBondContact O-N 3.41Å; C321-C324 VanDerWaalsContact O-O 3.05Å |
| 322 | K | 44.3 | Very low | 51 | Low | 186 Ų | 186 | 128.9 Ų | 128.9 | 81% | 0.809 | 66% | 0.657 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.6 | -20.2 | 166.6 | -93.9 | -171.6 | 173.6 | -168.1 | 0 | 112.6 | K318 R319 F320 | K318-K322 PolarHBondContact O-N 2.78Å; R319-K322 WeakPolarHBondContact O-CB 3.44Å; R319-K322 PolarHBondContact O-N 3.4Å; F320-K322 VanDerWaalsContact C-N 3.27Å; F320-K322 PolarHBondContact O-N 3.25Å |
| 323 | C | 45 | Very low | 48.9 | Very low | 115 Ų | 115 | 133.2 Ų | 133.2 | 78% | 0.777 | 68% | 0.679 | S | S | * | * | S | Bend | trans | -97.4 | -4.4 | 173.1 | -72.9 | 0 | 0 | 0 | 0 | 113.6 | R319 F320 C321 | R319-C323 PolarHBondContact O-N 3.5Å; F320-C323 CarbonylContact O-C 3.47Å; F320-C323 WeakPolarHBondContact O-CA 3.35Å; F320-C323 PolarHBondContact O-N 2.99Å; C321-C323 VanDerWaalsContact C-N 3.25Å |
| 324 | C | 38.2 | Very low | 47.1 | Very low | 77 Ų | 77 | 138.9 Ų | 138.9 | 52% | 0.52 | 70% | 0.695 | S | S | . | * | trans | -122.9 | 99.1 | 173.8 | -71.9 | 0 | 0 | 0 | 0 | 110 | F320 C321 I326 | F320-C324 PolarHBondContact O-N 3.29Å; F320-C324 VanDerWaalsContact O-N 3.07Å; C321-C324 PolarHBondContact O-N 3.41Å; C321-C324 VanDerWaalsContact O-O 3.05Å; C324-I326 PolarHBondContact O-N 3.49Å | ||
| 325 | S | 34 | Very low | 45.2 | Very low | 117 Ų | 117 | 136.7 Ų | 136.7 | 82% | 0.818 | 70% | 0.704 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.6 | 36.4 | 174.5 | 61.5 | 0 | 0 | 0 | 0 | 113.7 | ||
| 326 | I | 43.7 | Very low | 43.6 | Very low | 147 Ų | 147 | 137.4 Ų | 137.4 | 75% | 0.754 | 72% | 0.719 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -120.9 | -11.3 | -176.6 | -67.6 | -176.5 | 0 | 0 | 0 | 112.7 | C324 | C324-I326 PolarHBondContact O-N 3.49Š|
| 327 | F | 36.2 | Very low | 42.1 | Very low | 170 Ų | 170 | 139.7 Ų | 139.7 | 75% | 0.746 | 74% | 0.741 | S | S | * | * | trans | -119.1 | 37 | 178 | -109.7 | -84.9 | 0 | 0 | 0 | 113.9 | Q329 | F327-Q329 PolarHBondContact O-N 3.07Š| ||
| 328 | Q | 39.4 | Very low | 41 | Very low | 192 Ų | 192 | 143.4 Ų | 143.4 | 90% | 0.897 | 76% | 0.758 | S | S | * | * | trans | -90.2 | 66.1 | 161.8 | -159.4 | 169.4 | -11.9 | 0 | 0 | 108 | ||||
| 329 | Q | 36.8 | Very low | 40 | Very low | 174 Ų | 174 | 146.9 Ų | 146.9 | 81% | 0.813 | 77% | 0.769 | S | S | * | * | trans | -104.3 | 129.2 | 164.2 | -154.1 | 161.5 | 6.8 | 0 | 0 | 108.2 | F327 | F327-Q329 PolarHBondContact O-N 3.07Š| ||
| 330 | E | 36.8 | Very low | 39 | Very low | 179 Ų | 179 | 143 Ų | 143 | 84% | 0.836 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -50.1 | 138.5 | -161.1 | -68.8 | 154.7 | 152.8 | 0 | 0 | 114.4 | ||
| 331 | A | 34.3 | Very low | 38.1 | Very low | 86 Ų | 86 | 147.3 Ų | 147.3 | 71% | 0.711 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -64.2 | 134.9 | 159.1 | 0 | 0 | 0 | 0 | 0 | 108.2 | E333 | A331-E333 PolarHBondContact O-N 2.94Å; A331-E333 VanDerWaalsContact O-N 3.12Å |
| 332 | P | 36.1 | Very low | 37.4 | Very low | 129 Ų | 129 | 149 Ų | 149 | 84% | 0.838 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 117.2 | 173.4 | -6.6 | 20.8 | 0 | 0 | 0 | 108.3 | R334 | P332-R334 PolarHBondContact O-N 2.87Š|
| 333 | E | 35.7 | Very low | 37.2 | Very low | 187 Ų | 187 | 146.7 Ų | 146.7 | 87% | 0.874 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 133.4 | 169.1 | -70.7 | -174.6 | 152.2 | 0 | 0 | 109.6 | A331 A335 | A331-E333 PolarHBondContact O-N 2.94Å; A331-E333 VanDerWaalsContact O-N 3.12Å; E333-A335 PolarHBondContact O-N 2.88Å |
| 334 | R | 40.5 | Very low | 36.5 | Very low | 244 Ų | 244 | 144.9 Ų | 144.9 | 92% | 0.921 | 79% | 0.794 | S | S | * | * | trans | -62 | 99.9 | 166.4 | -82.9 | 176.3 | 171.8 | 167.7 | -3.8 | 108.2 | P332 S336 | P332-R334 PolarHBondContact O-N 2.87Å; R334-S336 PolarHBondContact O-N 3.15Å; R334-S336 VanDerWaalsContact O-N 3.08Å | ||
| 335 | A | 35.6 | Very low | 36.4 | Very low | 96 Ų | 96 | 150.2 Ų | 150.2 | 79% | 0.793 | 81% | 0.812 | S | S | * | * | trans | -72.4 | 97.3 | 161.7 | 0 | 0 | 0 | 0 | 0 | 108.6 | E333 S337 | E333-A335 PolarHBondContact O-N 2.88Å; A335-S337 PolarHBondContact O-N 2.8Å | ||
| 336 | S | 40.4 | Very low | 36.4 | Very low | 108 Ų | 108 | 154.1 Ų | 154.1 | 76% | 0.755 | 82% | 0.817 | S | S | * | * | trans | -65 | 101.6 | 157 | 47.4 | 0 | 0 | 0 | 0 | 108.7 | R334 V338 | R334-S336 PolarHBondContact O-N 3.15Å; R334-S336 VanDerWaalsContact O-N 3.08Å; S336-V338 PolarHBondContact O-N 3.17Å | ||
| 337 | S | 38 | Very low | 36.1 | Very low | 113 Ų | 113 | 155.6 Ų | 155.6 | 79% | 0.79 | 82% | 0.821 | S | S | * | * | trans | -86.3 | 105.5 | 164.8 | 53.1 | 0 | 0 | 0 | 0 | 109.4 | A335 Y339 | A335-S337 PolarHBondContact O-N 2.8Å; S337-Y339 PolarHBondContact O-N 3.27Å | ||
| 338 | V | 38.2 | Very low | 36 | Very low | 123 Ų | 123 | 155 Ų | 155 | 75% | 0.745 | 82% | 0.824 | S | S | * | * | trans | -61.6 | 120 | 164 | 172.2 | 0 | 0 | 0 | 0 | 107.8 | S336 T340 | S336-V338 PolarHBondContact O-N 3.17Å; V338-T340 PolarHBondContact O-N 3.35Å | ||
| 339 | Y | 34.3 | Very low | 35.8 | Very low | 223 Ų | 223 | 151 Ų | 151 | 88% | 0.875 | 82% | 0.817 | S | S | * | * | trans | -89.2 | 102.1 | 169.1 | -143.6 | -86.2 | 0 | 0 | 0 | 108.4 | S337 | S337-Y339 PolarHBondContact O-N 3.27Š| ||
| 340 | T | 33.5 | Very low | 35.7 | Very low | 117 Ų | 117 | 149.6 Ų | 149.6 | 72% | 0.718 | 82% | 0.82 | S | S | * | * | trans | -75.5 | 118.1 | 172.3 | -43.2 | 0 | 0 | 0 | 0 | 108.7 | V338 | V338-T340 PolarHBondContact O-N 3.35Š| ||
| 341 | R | 32.2 | Very low | 35.7 | Very low | 242 Ų | 242 | 144.1 Ų | 144.1 | 91% | 0.913 | 81% | 0.811 | S | S | * | * | trans | -98.1 | 99.1 | 169 | -166.2 | 175.8 | -174.3 | 167.7 | 0.8 | 108.3 | ||||
| 342 | S | 33.2 | Very low | 35.7 | Very low | 103 Ų | 103 | 152.3 Ų | 152.3 | 72% | 0.72 | 84% | 0.842 | S | S | * | * | trans | -85.8 | 137.1 | 168.5 | -177.8 | 0 | 0 | 0 | 0 | 110 | ||||
| 343 | T | 38.4 | Very low | 35.7 | Very low | 138 Ų | 138 | 153.5 Ų | 153.5 | 85% | 0.847 | 84% | 0.842 | S | S | * | * | trans | -58.3 | 148.8 | 170.6 | 37.2 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 344 | G | 31.9 | Very low | 35.7 | Very low | 77 Ų | 77 | 151.7 Ų | 151.7 | 79% | 0.794 | 84% | 0.84 | S | S | * | * | trans | -178.6 | 96.1 | 169 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 345 | E | 36 | Very low | 35.4 | Very low | 190 Ų | 190 | 146.6 Ų | 146.6 | 89% | 0.888 | 84% | 0.836 | S | S | * | * | trans | -62.9 | 148.7 | 177.3 | -67.7 | 161.5 | 134.9 | 0 | 0 | 112.6 | ||||
| 346 | Q | 34.3 | Very low | 35.4 | Very low | 199 Ų | 199 | 149.6 Ų | 149.6 | 93% | 0.93 | 84% | 0.838 | S | S | * | * | trans | -159.8 | 129.2 | 133.9 | -111.8 | 170.9 | -4 | 0 | 0 | 110.9 | ||||
| 347 | E | 36.1 | Very low | 35.1 | Very low | 177 Ų | 177 | 152.2 Ų | 152.2 | 83% | 0.827 | 84% | 0.843 | S | S | * | * | trans | -63.6 | 160.3 | 178.3 | -61.3 | 172.7 | 133.8 | 0 | 0 | 113.3 | ||||
| 348 | I | 34.8 | Very low | 34.9 | Very low | 159 Ų | 159 | 154.8 Ų | 154.8 | 82% | 0.815 | 85% | 0.847 | S | S | * | * | 167.8 | 104.9 | 119.3 | -79.4 | 155.7 | 0 | 0 | 0 | 109.9 | |||||
| 349 | S | 34.5 | Very low | 34.6 | Very low | 107 Ų | 107 | 157.1 Ų | 157.1 | 75% | 0.748 | 85% | 0.854 | S | S | * | * | 49.2 | 147.5 | 123.1 | -135.3 | 0 | 0 | 0 | 0 | 124.5 | |||||
| 350 | V | 35.5 | Very low | 34.7 | Very low | 145 Ų | 145 | 152 Ų | 152 | 88% | 0.879 | 85% | 0.853 | S | S | * | * | trans | 80.1 | 129.1 | 161 | -156.1 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 351 | G | 35.9 | Very low | 34.8 | Very low | 63 Ų | 63 | 154.9 Ų | 154.9 | 65% | 0.649 | 86% | 0.864 | S | S | * | * | cis | 169.7 | 158.9 | 2.4 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 352 | L | 34.4 | Very low | 35 | Very low | 259 Ų | 259 | 147 Ų | 147 | 100% | 1.356 | 86% | 0.859 | S | S | * | * | trans | 69.3 | 0 | 177.1 | -85.3 | 113.3 | 0 | 0 | 0 | 118.9 |
Retrieved 352 of 352 residues in 612.5 ms
(Link to these results)