| 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 | 37.7 | Very low | 43.8 | Very low | 256 Ų | 256 | 139.3 Ų | 139.3 | 100% | 1.261 | 74% | 0.743 | S | S | * | * | 0 | 88.3 | 0 | -88.4 | 171.9 | 166.5 | 0 | 0 | 108.6 | |||||
| 2 | G | 36.7 | Very low | 45.5 | Very low | 77 Ų | 77 | 131.8 Ų | 131.8 | 79% | 0.794 | 70% | 0.702 | S | S | * | * | trans | -167.9 | 67.1 | -173.7 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 3 | L | 35.3 | Very low | 46.7 | Very low | 165 Ų | 165 | 124.8 Ų | 124.8 | 86% | 0.864 | 68% | 0.681 | S | S | * | * | trans | -100.2 | 101.3 | 171.9 | -108.4 | 138.4 | 0 | 0 | 0 | 107.1 | R5 | L3-R5 PolarHBondContact O-N 2.86Š| ||
| 4 | C | 33 | Very low | 48.1 | Very low | 113 Ų | 113 | 118.7 Ų | 118.7 | 76% | 0.764 | 66% | 0.656 | S | S | * | * | trans | -6 | 115.6 | 166.4 | -79.1 | 0 | 0 | 0 | 0 | 114.3 | A6 | C4-A6 PolarHBondContact O-N 3.41Š| ||
| 5 | R | 40.8 | Very low | 49.5 | Very low | 244 Ų | 244 | 117.1 Ų | 117.1 | 92% | 0.921 | 64% | 0.64 | S | S | * | * | trans | -64.9 | 74.5 | 153.7 | -156 | -177.9 | -155.8 | -177.8 | 8.5 | 106.6 | L3 K7 | L3-R5 PolarHBondContact O-N 2.86Å; R5-K7 PolarHBondContact O-N 2.92Å | ||
| 6 | A | 36.7 | Very low | 51 | Low | 75 Ų | 75 | 118 Ų | 118 | 62% | 0.62 | 64% | 0.638 | S | S | * | * | trans | -55.3 | 113.9 | 171.7 | 0 | 0 | 0 | 0 | 0 | 106 | C4 V8 | C4-A6 PolarHBondContact O-N 3.41Å; A6-V8 PolarHBondContact O-N 3Å | ||
| 7 | K | 45.1 | Very low | 52.1 | Low | 204 Ų | 204 | 114.5 Ų | 114.5 | 89% | 0.887 | 61% | 0.614 | S | S | * | * | trans | -62.6 | 91 | 168.6 | -85.1 | 178.5 | 176.6 | 174.2 | 0 | 105.7 | R5 T9 | R5-K7 PolarHBondContact O-N 2.92Å; K7-T9 PolarHBondContact O-N 3.29Å; K7-T9 VanDerWaalsContact O-N 3.13Å | ||
| 8 | V | 50.4 | Low | 52.2 | Low | 46 Ų | 46 | 112.2 Ų | 112.2 | 28% | 0.279 | 61% | 0.608 | S | S | . | * | trans | -56.6 | 121.1 | 166.5 | 179.1 | 0 | 0 | 0 | 0 | 105.5 | A6 Q10 F90 F94 | A6-V8 PolarHBondContact O-N 3Å; V8-Q10 PolarHBondContact O-N 3.41Å; V8-F90 HydrophobicContact CG2-CD1 4.03Å; V8-F94 HydrophobicContact CG1-CB 4.17Å; V8-F94 HydrophobicContact CG1-CD2 3.95Å; V8-F94 HydrophobicContact CG1-CE2 4.46Å; V8-F94 HydrophobicContact CG1-CG 3.97Å | ||
| 9 | T | 48 | Very low | 53.2 | Low | 118 Ų | 118 | 115.3 Ų | 115.3 | 72% | 0.724 | 62% | 0.615 | S | S | * | * | trans | -55.9 | 106.3 | 178.7 | 20.6 | 0 | 0 | 0 | 0 | 108.6 | K7 F11 | K7-T9 PolarHBondContact O-N 3.29Å; K7-T9 VanDerWaalsContact O-N 3.13Å; T9-F11 PolarHBondContact O-N 3.32Å | ||
| 10 | Q | 57.3 | Low | 54.3 | Low | 108 Ų | 108 | 110.7 Ų | 110.7 | 51% | 0.505 | 59% | 0.594 | S | S | . | * | trans | -72 | 119.4 | 172.2 | -75.5 | 179 | -12.7 | 0 | 0 | 108.2 | V8 L12 | V8-Q10 PolarHBondContact O-N 3.41Å; Q10-L12 VanDerWaalsContact C-N 3.34Å | ||
| 11 | F | 60.4 | Low | 55.3 | Low | 126 Ų | 126 | 107.3 Ų | 107.3 | 55% | 0.553 | 58% | 0.578 | S | S | * | * | S | Bend | trans | -65.7 | -38.1 | 179.1 | -77 | -87.6 | 0 | 0 | 0 | 111.8 | T9 M97 V200 | T9-F11 PolarHBondContact O-N 3.32Å; F11-M97 HydrophobicContact CD2-SD 4.05Å; F11-M97 HydrophobicContact CE2-CE 3.86Å; F11-M97 HydrophobicContact CE2-SD 3.92Å; F11-M97 HydrophobicContact CZ-CE 4.17Å; F11-V200 HydrophobicContact CB-CG1 4.36Å |
| 12 | L | 64.3 | Low | 57.2 | Low | 49 Ų | 49 | 97.4 Ų | 97.4 | 26% | 0.257 | 53% | 0.53 | S | S | . | . | S | Bend | trans | -117.8 | 117.4 | 169.6 | -63.3 | 172.5 | 0 | 0 | 0 | 109.1 | Q10 W25 V200 R203 | Q10-L12 VanDerWaalsContact C-N 3.34Å; L12-W25 HydrophobicContact CD1-CZ2 4.07Å; L12-V200 WeakPolarHBondContact CD1-O 3.39Å; L12-R203 HydrophobicContact CB-CB 4.28Å; L12-R203 HydrophobicContact CB-CG 4Å; L12-R203 HydrophobicContact CD1-CB 4.16Å |
| 13 | G | 61.9 | Low | 59.4 | Low | 41 Ų | 41 | 94.4 Ų | 94.4 | 42% | 0.423 | 50% | 0.499 | S | S | . | . | P | Polyproline II helix | trans | -60.7 | 140.2 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | K15 R203 | G13-K15 PolarHBondContact O-N 3.39Å; G13-R203 PolarHBondContact O-NE 2.96Å; G13-R203 PolarHBondContact O-NH2 2.71Å |
| 14 | A | 66.1 | Low | 61.9 | Low | 40 Ų | 40 | 89.5 Ų | 89.5 | 33% | 0.331 | 49% | 0.489 | S | S | . | . | P | Polyproline II helix | trans | -56.9 | 133.2 | -177.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | P204 I206 | A14-P204 VanDerWaalsContact CA-O 3.31Å; A14-P204 WeakPolarHBondContact CA-O 3.46Å; A14-P204 HydrophobicContact CB-CG 4.15Å; A14-I206 HydrophobicContact CB-CD1 4.05Å; A14-I206 HydrophobicContact CB-CG1 4.3Å |
| 15 | K | 69.3 | Low | 64.4 | Low | 95 Ų | 95 | 88.4 Ų | 88.4 | 41% | 0.413 | 47% | 0.468 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.5 | 133.7 | 172.3 | -106.1 | 179.8 | -177.6 | -176.4 | 0 | 110 | G13 Y17 P204 I205 I206 | G13-K15 PolarHBondContact O-N 3.39Å; K15-Y17 HydrophobicContact CB-CD2 4.38Å; K15-Y17 HydrophobicContact CB-CE2 3.7Å; K15-P204 PolarHBondContact N-O 3.48Å; K15-I205 WeakPolarHBondContact O-CA 3.32Å; K15-I206 PolarHBondContact O-N 2.88Å |
| 16 | Q | 72.7 | Confident | 66.6 | Low | 131 Ų | 131 | 76.8 Ų | 76.8 | 61% | 0.612 | 43% | 0.425 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -90 | 129.8 | 177.8 | -168.6 | 176.9 | -20.2 | 0 | 0 | 109.7 | I206 | Q16-I206 WeakPolarHBondContact CA-O 2.93Å |
| 17 | Y | 70.2 | Confident | 69.2 | Low | 58 Ų | 58 | 78.7 Ų | 78.7 | 23% | 0.227 | 42% | 0.416 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.5 | 148.9 | 174.6 | -66.3 | -85.4 | 0 | 0 | 0 | 110.1 | K15 K19 P21 I205 I206 I207 K208 | K15-Y17 HydrophobicContact CB-CD2 4.38Å; K15-Y17 HydrophobicContact CB-CE2 3.7Å; Y17-K19 WeakPolarHBondContact CB-O 3.49Å; Y17-P21 HydrophobicContact CD1-CB 4.11Å; Y17-P21 HydrophobicContact CE1-CB 3.98Å; Y17-P21 HydrophobicContact CE1-CG 4.48Å; Y17-I205 HydrophobicContact CD2-CB 4.14Å; Y17-I205 HydrophobicContact CD2-CG2 3.8Å; Y17-I205 HydrophobicContact CE2-CB 4.42Å; Y17-I205 HydrophobicContact CE2-CG2 3.58Å; Y17-I206 PolarHBondContact N-O 3.26Å; Y17-I206 VanDerWaalsContact N-O 3.08Å; Y17-I207 WeakPolarHBondContact O-CA 3.38Å; Y17-K208 PolarHBondContact O-N 3.05Å; Y17-K208 VanDerWaalsContact O-N 3.1Å |
| 18 | S | 53.8 | Low | 71.5 | Confident | 73 Ų | 73 | 71.2 Ų | 71.2 | 51% | 0.51 | 39% | 0.387 | S | S | . | . | S | Bend | trans | -85.1 | -25.6 | 177.3 | 55 | 0 | 0 | 0 | 0 | 113.3 | K208 | S18-K208 WeakPolarHBondContact CA-O 3.28Š|
| 19 | K | 70.3 | Confident | 73.5 | Confident | 171 Ų | 171 | 69 Ų | 69 | 74% | 0.743 | 37% | 0.374 | S | S | * | . | S | Bend | trans | -144.1 | 166.2 | 173.4 | -69.5 | -173.4 | 178.4 | -178.4 | 0 | 108.9 | Y17 | Y17-K19 WeakPolarHBondContact CB-O 3.49Š|
| 20 | A | 75.8 | Confident | 75.6 | Confident | 24 Ų | 24 | 63.8 Ų | 63.8 | 20% | 0.198 | 34% | 0.343 | C | S | . | . | trans | -55.6 | 130.8 | 173.1 | 0 | 0 | 0 | 0 | 0 | 109.6 | D22 | A20-D22 VanDerWaalsContact C-N 3.28Å; A20-D22 PolarHBondContact O-N 3.04Å | ||
| 21 | P | 75.3 | Confident | 77.4 | Confident | 39 Ų | 39 | 62.8 Ų | 62.8 | 25% | 0.253 | 34% | 0.344 | S | S | . | . | trans | -70.3 | -22.9 | -172.7 | 25.2 | -33.5 | 0 | 0 | 0 | 113.5 | Y17 G23 Y145 | Y17-P21 HydrophobicContact CD1-CB 4.11Å; Y17-P21 HydrophobicContact CE1-CB 3.98Å; Y17-P21 HydrophobicContact CE1-CG 4.48Å; P21-G23 PolarHBondContact O-N 3.33Å; P21-Y145 WeakPolarHBondContact CD-O 3.3Å; P21-Y145 HydrophobicContact CG-CD1 3.64Å; P21-Y145 HydrophobicContact CG-CE1 4.24Å; P21-Y145 HydrophobicContact CG-CG 4.46Å | ||
| 22 | D | 78.8 | Confident | 79 | Confident | 48 Ų | 48 | 56.9 Ų | 56.9 | 26% | 0.257 | 32% | 0.318 | S | S | . | . | S | Bend | trans | 47.9 | 34.2 | 178.5 | -79.8 | -59.8 | 0 | 0 | 0 | 113.1 | A20 Y145 F146 S147 H148 | A20-D22 VanDerWaalsContact C-N 3.28Å; A20-D22 PolarHBondContact O-N 3.04Å; D22-Y145 PolarHBondContact N-O 3.35Å; D22-F146 VanDerWaalsContact OD1-CA 3.25Å; D22-F146 WeakPolarHBondContact OD1-CA 3.44Å; D22-S147 PolarHBondContact OD1-N 2.94Å; D22-S147 PolarHBondContact OD2-N 3.25Å; D22-S147 PolarHBondContact OD2-OG 2.96Å; D22-H148 PolarHBondContact OD1-N 3.1Å |
| 23 | G | 81.6 | Confident | 80.4 | Confident | 14 Ų | 14 | 54.6 Ų | 54.6 | 14% | 0.144 | 31% | 0.306 | C | S | . | . | S | Bend | trans | 165.6 | -165.6 | -174.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | P21 W25 G26 | P21-G23 PolarHBondContact O-N 3.33Å; G23-W25 PolarHBondContact O-N 3.04Å; G23-G26 PolarHBondContact O-N 2.99Å; G23-G26 VanDerWaalsContact O-N 3.12Å |
| 24 | G | 87.2 | Confident | 82 | Confident | 62 Ų | 62 | 54.9 Ų | 54.9 | 64% | 0.639 | 30% | 0.296 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 61.6 | -125 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | G26 W27 | G24-G26 PolarHBondContact O-N 3.06Å; G24-G26 VanDerWaalsContact O-N 3.09Å; G24-W27 PolarHBondContact O-N 3.33Å; G24-W27 VanDerWaalsContact O-N 3.11Å |
| 25 | W | 87.5 | Confident | 83.4 | Confident | 90 Ų | 90 | 55.1 Ų | 55.1 | 34% | 0.341 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -61.4 | -17.1 | 177.4 | -159.1 | -91.9 | 0 | 0 | 0 | 113.2 | L12 G23 W27 V28 V29 Y145 L201 | L12-W25 HydrophobicContact CD1-CZ2 4.07Å; G23-W25 PolarHBondContact O-N 3.04Å; W25-W27 PolarHBondContact O-N 3.34Å; W25-V28 HydrophobicContact CD2-CB 4.28Å; W25-V28 HydrophobicContact CD2-CG2 4.2Å; W25-V28 HydrophobicContact CE3-CG2 4.2Å; W25-V28 HydrophobicContact CG-CB 4.45Å; W25-V28 HydrophobicContact CZ2-CG1 4.17Å; W25-V28 WeakPolarHBondContact O-CB 3.39Å; W25-V28 PolarHBondContact O-N 3.42Å; W25-V28 VanDerWaalsContact O-N 3.1Å; W25-V29 PolarHBondContact O-N 3.32Å; W25-V29 VanDerWaalsContact O-N 3.12Å; W25-Y145 HydrophobicContact CB-CE1 4.16Å; W25-L201 PolarHBondContact NE1-O 2.74Å; W25-L201 VanDerWaalsContact NE1-O 3.08Å |
| 26 | G | 86.8 | Confident | 84.6 | Confident | 0 Ų | 0 | 50.6 Ų | 50.6 | 0% | 0 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -57.1 | -34.7 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | G23 G24 V29 A30 F146 | G23-G26 PolarHBondContact O-N 2.99Å; G23-G26 VanDerWaalsContact O-N 3.12Å; G24-G26 PolarHBondContact O-N 3.06Å; G24-G26 VanDerWaalsContact O-N 3.09Å; G26-V29 WeakPolarHBondContact O-CB 3.38Å; G26-V29 PolarHBondContact O-N 2.78Å; G26-A30 PolarHBondContact O-N 2.69Å; G26-F146 WeakPolarHBondContact O-CE2 3.23Å |
| 27 | W | 91.4 | Very high | 85.6 | Confident | 115 Ų | 115 | 44.6 Ų | 44.6 | 44% | 0.436 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -69.3 | -33.5 | 176.2 | -70.5 | 110.9 | 0 | 0 | 0 | 112.8 | G24 W25 V29 A30 V31 F146 V153 L156 | G24-W27 PolarHBondContact O-N 3.33Å; G24-W27 VanDerWaalsContact O-N 3.11Å; W25-W27 PolarHBondContact O-N 3.34Å; W27-V29 VanDerWaalsContact C-N 3.32Å; W27-A30 HydrophobicContact CE3-CB 4.4Å; W27-A30 WeakPolarHBondContact O-CB 3.33Å; W27-A30 PolarHBondContact O-N 3.19Å; W27-V31 WeakPolarHBondContact O-CG2 3.27Å; W27-V31 PolarHBondContact O-N 3.15Å; W27-F146 HydrophobicContact CD2-CZ 4.31Å; W27-V153 HydrophobicContact CH2-CG2 4.38Å; W27-L156 HydrophobicContact CZ3-CD2 4.31Å |
| 28 | V | 92.9 | Very high | 86.8 | Confident | 47 Ų | 47 | 43 Ų | 43 | 29% | 0.285 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -64.1 | -41.9 | 172.4 | -178 | 0 | 0 | 0 | 0 | 110.1 | W25 A30 V31 A32 L201 | W25-V28 HydrophobicContact CD2-CB 4.28Å; W25-V28 HydrophobicContact CD2-CG2 4.2Å; W25-V28 HydrophobicContact CE3-CG2 4.2Å; W25-V28 HydrophobicContact CG-CB 4.45Å; W25-V28 HydrophobicContact CZ2-CG1 4.17Å; W25-V28 WeakPolarHBondContact O-CB 3.39Å; W25-V28 PolarHBondContact O-N 3.42Å; W25-V28 VanDerWaalsContact O-N 3.1Å; V28-A30 VanDerWaalsContact C-N 3.32Å; V28-A30 PolarHBondContact O-N 2.95Å; V28-V31 PolarHBondContact O-N 2.64Å; V28-A32 WeakPolarHBondContact O-CB 3.41Å; V28-A32 PolarHBondContact O-N 2.91Å; V28-L201 HydrophobicContact CG1-CB 4.28Å; V28-L201 HydrophobicContact CG1-CD1 4.42Å; V28-L201 HydrophobicContact CG1-CD2 4.27Å |
| 29 | V | 91.4 | Very high | 88.8 | Confident | 0 Ų | 0 | 40.3 Ų | 40.3 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -65.3 | -35.8 | 174.5 | 176.6 | 0 | 0 | 0 | 0 | 111.7 | W25 G26 W27 A32 F33 I141 L142 Y145 L202 | W25-V29 PolarHBondContact O-N 3.32Å; W25-V29 VanDerWaalsContact O-N 3.12Å; G26-V29 WeakPolarHBondContact O-CB 3.38Å; G26-V29 PolarHBondContact O-N 2.78Å; W27-V29 VanDerWaalsContact C-N 3.32Å; V29-A32 PolarHBondContact O-N 2.92Å; V29-F33 PolarHBondContact O-N 3.22Å; V29-I141 HydrophobicContact CG1-CG2 3.81Å; V29-L142 HydrophobicContact CG1-CB 4.31Å; V29-L142 HydrophobicContact CG1-CD1 4.16Å; V29-Y145 HydrophobicContact CB-CD2 4.46Å; V29-Y145 HydrophobicContact CG1-CD2 4.4Å; V29-Y145 HydrophobicContact CG2-CD2 4.13Å; V29-Y145 HydrophobicContact CG2-CE2 3.79Å; V29-L202 HydrophobicContact CG1-CD2 4.05Å |
| 30 | A | 92.1 | Very high | 89.9 | Confident | 8 Ų | 8 | 32.1 Ų | 32.1 | 7% | 0.066 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -65.3 | -42.6 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | G26 W27 V28 F33 F34 L142 V153 A157 | G26-A30 PolarHBondContact O-N 2.69Å; W27-A30 HydrophobicContact CE3-CB 4.4Å; W27-A30 WeakPolarHBondContact O-CB 3.33Å; W27-A30 PolarHBondContact O-N 3.19Å; V28-A30 VanDerWaalsContact C-N 3.32Å; V28-A30 PolarHBondContact O-N 2.95Å; A30-F33 PolarHBondContact O-N 3.25Å; A30-F34 WeakPolarHBondContact O-CB 3.25Å; A30-F34 PolarHBondContact O-N 2.84Å; A30-L142 HydrophobicContact CB-CD1 3.88Å; A30-V153 HydrophobicContact CB-CG1 3.78Å; A30-A157 WeakPolarHBondContact O-CB 3.38Å |
| 31 | V | 95 | Very high | 90.6 | Very high | 88 Ų | 88 | 33.8 Ų | 33.8 | 53% | 0.533 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -64.6 | -40.6 | 173.7 | 173.3 | 0 | 0 | 0 | 0 | 111.2 | W27 V28 F33 F34 L35 | W27-V31 WeakPolarHBondContact O-CG2 3.27Å; W27-V31 PolarHBondContact O-N 3.15Å; V28-V31 PolarHBondContact O-N 2.64Å; V31-F33 VanDerWaalsContact C-N 3.34Å; V31-F33 PolarHBondContact O-N 2.97Å; V31-F34 WeakPolarHBondContact O-CB 3.27Å; V31-F34 PolarHBondContact O-N 3.23Å; V31-L35 HydrophobicContact CG1-CD1 4.43Å; V31-L35 WeakPolarHBondContact O-CG 3.39Å; V31-L35 PolarHBondContact O-N 3.35Å |
| 32 | A | 94.7 | Very high | 91.4 | Very high | 1 Ų | 1 | 32 Ų | 32 | 1% | 0.008 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -61.4 | -42.9 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | V28 V29 L35 V36 C198 L202 | V28-A32 WeakPolarHBondContact O-CB 3.41Å; V28-A32 PolarHBondContact O-N 2.91Å; V29-A32 PolarHBondContact O-N 2.92Å; A32-L35 PolarHBondContact O-N 3.03Å; A32-V36 VanDerWaalsContact O-CG2 3.3Å; A32-V36 WeakPolarHBondContact O-CG2 3.29Å; A32-V36 PolarHBondContact O-N 3.03Å; A32-C198 HydrophobicContact CB-CB 4.12Å; A32-L202 HydrophobicContact CB-CD2 3.94Å |
| 33 | F | 93.8 | Very high | 92 | Very high | 1 Ų | 1 | 29.9 Ų | 29.9 | 0% | 0.004 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -63.6 | -40.7 | 175 | -173.6 | -123.7 | 0 | 0 | 0 | 112.1 | V29 A30 V31 L35 V36 E37 F135 T138 V139 L142 T154 A157 S158 | V29-F33 PolarHBondContact O-N 3.22Å; A30-F33 PolarHBondContact O-N 3.25Å; V31-F33 VanDerWaalsContact C-N 3.34Å; V31-F33 PolarHBondContact O-N 2.97Å; F33-L35 PolarHBondContact O-N 3.3Å; F33-V36 PolarHBondContact O-N 3.31Å; F33-E37 HydrophobicContact CD1-CG 4.38Å; F33-E37 HydrophobicContact CD2-CG 4.27Å; F33-E37 HydrophobicContact CE1-CG 4.04Å; F33-E37 HydrophobicContact CE2-CG 3.96Å; F33-E37 HydrophobicContact CG-CG 4.49Å; F33-E37 HydrophobicContact CZ-CG 3.83Å; F33-E37 WeakPolarHBondContact CZ-OE1 3.18Å; F33-E37 VanDerWaalsContact O-CG 3.32Å; F33-E37 WeakPolarHBondContact O-CG 3.35Å; F33-E37 PolarHBondContact O-N 2.63Å; F33-F135 HydrophobicContact CE2-CD2 4.19Å; F33-F135 HydrophobicContact CE2-CE2 4.17Å; F33-F135 HydrophobicContact CZ-CE2 4.15Å; F33-T138 HydrophobicContact CB-CG2 3.71Å; F33-T138 HydrophobicContact CD2-CG2 3.5Å; F33-T138 HydrophobicContact CG-CG2 4.04Å; F33-V139 HydrophobicContact CE2-CB 3.78Å; F33-V139 HydrophobicContact CE2-CG2 4.41Å; F33-V139 HydrophobicContact CZ-CB 3.92Å; F33-V139 HydrophobicContact CZ-CG2 4.04Å; F33-L142 HydrophobicContact CB-CD2 4.1Å; F33-L142 HydrophobicContact CD1-CD2 3.35Å; F33-L142 HydrophobicContact CE1-CD2 3.99Å; F33-L142 HydrophobicContact CG-CD2 3.9Å; F33-T154 HydrophobicContact CE1-CG2 4.36Å; F33-A157 HydrophobicContact CB-CB 4.3Å; F33-A157 HydrophobicContact CD1-CB 3.48Å; F33-A157 VanDerWaalsContact CD1-CB 3.48Å; F33-A157 HydrophobicContact CE1-CB 4.27Å; F33-A157 HydrophobicContact CG-CB 4.35Å; F33-S158 WeakPolarHBondContact CE1-OG 3.47Å |
| 34 | F | 95.2 | Very high | 92.5 | Very high | 48 Ų | 48 | 30 Ų | 30 | 21% | 0.211 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -57.6 | -45.9 | 174.4 | 176.5 | -84.9 | 0 | 0 | 0 | 112.7 | A30 V31 E37 M38 A157 T159 G160 L163 | A30-F34 WeakPolarHBondContact O-CB 3.25Å; A30-F34 PolarHBondContact O-N 2.84Å; V31-F34 WeakPolarHBondContact O-CB 3.27Å; V31-F34 PolarHBondContact O-N 3.23Å; F34-E37 PolarHBondContact O-N 3.1Å; F34-M38 HydrophobicContact CE1-SD 4.29Å; F34-M38 WeakPolarHBondContact O-CB 3.4Å; F34-M38 PolarHBondContact O-N 3.12Å; F34-A157 VanDerWaalsContact CA-O 3.27Å; F34-A157 WeakPolarHBondContact CA-O 3.43Å; F34-A157 HydrophobicContact CB-CB 4.37Å; F34-A157 WeakPolarHBondContact CD2-O 3.29Å; F34-T159 WeakPolarHBondContact CE2-OG1 3.29Å; F34-G160 VanDerWaalsContact CE2-N 3.3Å; F34-L163 HydrophobicContact CE1-CD2 4.19Å; F34-L163 HydrophobicContact CZ-CB 4.26Å; F34-L163 HydrophobicContact CZ-CD2 3.6Å |
| 35 | L | 95.9 | Very high | 92.6 | Very high | 45 Ų | 45 | 28.8 Ų | 28.8 | 24% | 0.236 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -67.7 | -37 | 177.2 | -68 | 175.4 | 0 | 0 | 0 | 112.4 | V31 A32 F33 M38 F39 V194 | V31-L35 HydrophobicContact CG1-CD1 4.43Å; V31-L35 WeakPolarHBondContact O-CG 3.39Å; V31-L35 PolarHBondContact O-N 3.35Å; A32-L35 PolarHBondContact O-N 3.03Å; F33-L35 PolarHBondContact O-N 3.3Å; L35-M38 HydrophobicContact CD2-CE 3.6Å; L35-M38 PolarHBondContact O-N 2.8Å; L35-F39 VanDerWaalsContact O-CD2 3.3Å; L35-F39 WeakPolarHBondContact O-CD2 3.23Å; L35-F39 PolarHBondContact O-N 3.22Å; L35-V194 HydrophobicContact CD1-CG1 4.4Å |
| 36 | V | 95.4 | Very high | 92.7 | Very high | 0 Ų | 0 | 24.6 Ų | 24.6 | 0% | 0 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -61.5 | -48.2 | 173.4 | 170.1 | 0 | 0 | 0 | 0 | 110.3 | A32 F33 M38 F39 T40 T138 I195 C198 | A32-V36 VanDerWaalsContact O-CG2 3.3Å; A32-V36 WeakPolarHBondContact O-CG2 3.29Å; A32-V36 PolarHBondContact O-N 3.03Å; F33-V36 PolarHBondContact O-N 3.31Å; V36-M38 VanDerWaalsContact C-N 3.34Å; V36-M38 PolarHBondContact O-N 2.96Å; V36-F39 PolarHBondContact O-N 3.3Å; V36-T40 HydrophobicContact CG1-CG2 4.19Å; V36-T40 WeakPolarHBondContact O-CB 3.48Å; V36-T40 VanDerWaalsContact O-CG2 3.22Å; V36-T40 WeakPolarHBondContact O-CG2 3.23Å; V36-T40 PolarHBondContact O-N 3.05Å; V36-T40 PolarHBondContact O-OG1 3.19Å; V36-T138 HydrophobicContact CG2-CG2 4.36Å; V36-I195 HydrophobicContact CG2-CG2 4.2Å; V36-C198 HydrophobicContact CG2-CB 4.13Å |
| 37 | E | 93.5 | Very high | 92.8 | Very high | 5 Ų | 5 | 24.7 Ų | 24.7 | 2% | 0.023 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -60.2 | -43.1 | 177.7 | -71.4 | -84.3 | -150 | 0 | 0 | 112.1 | F33 F34 F39 T40 Y41 G42 F135 S158 | F33-E37 HydrophobicContact CD1-CG 4.38Å; F33-E37 HydrophobicContact CD2-CG 4.27Å; F33-E37 HydrophobicContact CE1-CG 4.04Å; F33-E37 HydrophobicContact CE2-CG 3.96Å; F33-E37 HydrophobicContact CG-CG 4.49Å; F33-E37 HydrophobicContact CZ-CG 3.83Å; F33-E37 WeakPolarHBondContact CZ-OE1 3.18Å; F33-E37 VanDerWaalsContact O-CG 3.32Å; F33-E37 WeakPolarHBondContact O-CG 3.35Å; F33-E37 PolarHBondContact O-N 2.63Å; F34-E37 PolarHBondContact O-N 3.1Å; E37-F39 PolarHBondContact O-N 2.95Å; E37-T40 PolarHBondContact O-N 2.8Å; E37-Y41 PolarHBondContact O-N 2.86Å; E37-Y41 WeakPolarHBondContact OE2-CD2 3.31Å; E37-G42 PolarHBondContact O-N 3.38Å; E37-F135 WeakPolarHBondContact OE1-CE2 3.29Å; E37-S158 PolarHBondContact OE1-OG 3.23Å |
| 38 | M | 94.8 | Very high | 92.6 | Very high | 23 Ų | 23 | 19.2 Ų | 19.2 | 11% | 0.113 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -58.4 | -46.2 | 176.7 | -169.2 | 178.3 | 73.1 | 0 | 0 | 112.2 | F34 L35 V36 G42 G160 A164 L168 | F34-M38 HydrophobicContact CE1-SD 4.29Å; F34-M38 WeakPolarHBondContact O-CB 3.4Å; F34-M38 PolarHBondContact O-N 3.12Å; L35-M38 HydrophobicContact CD2-CE 3.6Å; L35-M38 PolarHBondContact O-N 2.8Å; V36-M38 VanDerWaalsContact C-N 3.34Å; V36-M38 PolarHBondContact O-N 2.96Å; M38-G42 WeakPolarHBondContact O-CA 3.49Å; M38-G160 WeakPolarHBondContact CA-O 3.41Å; M38-G160 WeakPolarHBondContact CB-O 3.25Å; M38-A164 HydrophobicContact CB-CB 4.35Å; M38-A164 HydrophobicContact CG-CB 3.56Å; M38-A164 WeakPolarHBondContact O-CB 3.24Å; M38-L168 HydrophobicContact CG-CD1 4.18Å; M38-L168 HydrophobicContact SD-CD1 4.47Å |
| 39 | F | 95.3 | Very high | 92.6 | Very high | 17 Ų | 17 | 17 Ų | 17 | 8% | 0.075 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -91.4 | 0 | -176.3 | -73.5 | -59 | 0 | 0 | 0 | 115.1 | L35 V36 E37 I43 L168 L191 Q192 V194 I195 | L35-F39 VanDerWaalsContact O-CD2 3.3Å; L35-F39 WeakPolarHBondContact O-CD2 3.23Å; L35-F39 PolarHBondContact O-N 3.22Å; V36-F39 PolarHBondContact O-N 3.3Å; E37-F39 PolarHBondContact O-N 2.95Å; F39-I43 WeakPolarHBondContact O-CG1 3.4Å; F39-L168 HydrophobicContact CE1-CD1 4.28Å; F39-L191 HydrophobicContact CE1-CB 3.83Å; F39-L191 HydrophobicContact CZ-CB 4.37Å; F39-Q192 HydrophobicContact CB-CG 4.18Å; F39-Q192 HydrophobicContact CD1-CG 4.32Å; F39-Q192 PolarHBondContact O-NE2 3.49Å; F39-V194 HydrophobicContact CD2-CB 4.42Å; F39-V194 HydrophobicContact CE2-CB 4.06Å; F39-V194 HydrophobicContact CE2-CG1 4.12Å; F39-V194 HydrophobicContact CE2-CG2 4.46Å; F39-I195 HydrophobicContact CB-CD1 3.83Å; F39-I195 HydrophobicContact CB-CG1 4.06Å |
| 40 | T | 93.4 | Very high | 92.7 | Very high | 0 Ų | 0 | 17.2 Ų | 17.2 | 0% | 0 | 9% | 0.086 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -111.3 | -87.3 | 174.8 | 58.9 | 0 | 0 | 0 | 0 | 110.4 | V36 E37 G42 I43 I44 I103 Y131 I195 | V36-T40 HydrophobicContact CG1-CG2 4.19Å; V36-T40 WeakPolarHBondContact O-CB 3.48Å; V36-T40 VanDerWaalsContact O-CG2 3.22Å; V36-T40 WeakPolarHBondContact O-CG2 3.23Å; V36-T40 PolarHBondContact O-N 3.05Å; V36-T40 PolarHBondContact O-OG1 3.19Å; E37-T40 PolarHBondContact O-N 2.8Å; T40-G42 VanDerWaalsContact C-N 3.26Å; T40-G42 PolarHBondContact O-N 3.27Å; T40-I43 PolarHBondContact O-N 2.99Å; T40-I44 WeakPolarHBondContact O-CG1 3.39Å; T40-I44 PolarHBondContact O-N 3.17Å; T40-I103 HydrophobicContact CG2-CD1 4.08Å; T40-Y131 HydrophobicContact CG2-CD1 3.39Å; T40-Y131 HydrophobicContact CG2-CE1 3.71Å; T40-Y131 HydrophobicContact CG2-CG 4.46Å; T40-I195 HydrophobicContact CG2-CD1 3.91Å |
| 41 | Y | 90.6 | Very high | 92.6 | Very high | 59 Ų | 59 | 16.8 Ų | 16.8 | 23% | 0.231 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -57.2 | -36.7 | 179.8 | -81.1 | -82 | 0 | 0 | 0 | 113.4 | E37 I43 I44 K45 M76 F135 | E37-Y41 PolarHBondContact O-N 2.86Å; E37-Y41 WeakPolarHBondContact OE2-CD2 3.31Å; Y41-I43 VanDerWaalsContact C-N 3.31Å; Y41-I43 PolarHBondContact O-N 3.35Å; Y41-I44 PolarHBondContact O-N 3.26Å; Y41-K45 WeakPolarHBondContact O-CB 3.36Å; Y41-K45 PolarHBondContact O-N 3.46Å; Y41-M76 HydrophobicContact CE1-CE 3.61Å; Y41-M76 HydrophobicContact CE1-SD 4.17Å; Y41-M76 HydrophobicContact CE2-CE 4.42Å; Y41-M76 HydrophobicContact CE2-SD 4.17Å; Y41-M76 VanDerWaalsContact CZ-CE 3.48Å; Y41-M76 WeakPolarHBondContact OH-CE 3.35Å; Y41-F135 HydrophobicContact CD2-CD2 4.31Å; Y41-F135 HydrophobicContact CD2-CE2 4.4Å; Y41-F135 AromaticContact CE2-CD2 3.7Å; Y41-F135 HydrophobicContact CE2-CD2 3.7Å; Y41-F135 AromaticContact CE2-CE2 3.7Å; Y41-F135 HydrophobicContact CE2-CE2 3.7Å; Y41-F135 HydrophobicContact CE2-CG 4.15Å; Y41-F135 HydrophobicContact CE2-CZ 4.15Å |
| 42 | G | 91.4 | Very high | 92.5 | Very high | 0 Ų | 0 | 14.8 Ų | 14.8 | 0% | 0 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -58.6 | -41 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | E37 M38 T40 S46 | E37-G42 PolarHBondContact O-N 3.38Å; M38-G42 WeakPolarHBondContact O-CA 3.49Å; T40-G42 VanDerWaalsContact C-N 3.26Å; T40-G42 PolarHBondContact O-N 3.27Å; G42-S46 WeakPolarHBondContact O-CB 3.26Å; G42-S46 PolarHBondContact O-N 3.25Å; G42-S46 PolarHBondContact O-OG 3.2Å |
| 43 | I | 92.6 | Very high | 92.4 | Very high | 5 Ų | 5 | 16.4 Ų | 16.4 | 3% | 0.026 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -72.6 | -41.9 | 177 | -56.7 | -56.8 | 0 | 0 | 0 | 111 | F39 T40 Y41 K45 S46 F47 F172 I188 | F39-I43 WeakPolarHBondContact O-CG1 3.4Å; T40-I43 PolarHBondContact O-N 2.99Å; Y41-I43 VanDerWaalsContact C-N 3.31Å; Y41-I43 PolarHBondContact O-N 3.35Å; I43-K45 PolarHBondContact O-N 3.45Å; I43-S46 PolarHBondContact O-N 2.92Å; I43-S46 VanDerWaalsContact O-N 3.14Å; I43-F47 PolarHBondContact O-N 3.42Å; I43-F172 HydrophobicContact CD1-CE2 3.43Å; I43-F172 VanDerWaalsContact CD1-CE2 3.43Å; I43-F172 HydrophobicContact CD1-CZ 3.89Å; I43-I188 HydrophobicContact CD1-CG2 4.02Å; I43-I188 HydrophobicContact CG1-CG2 4.3Å; I43-I188 HydrophobicContact CG2-CG2 3.87Å |
| 44 | I | 91.4 | Very high | 92.4 | Very high | 16 Ų | 16 | 16.4 Ų | 16.4 | 8% | 0.082 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -57.9 | -48 | 176.1 | -64.4 | 171.6 | 0 | 0 | 0 | 110.6 | T40 Y41 S46 F47 I69 V73 M76 Y131 | T40-I44 WeakPolarHBondContact O-CG1 3.39Å; T40-I44 PolarHBondContact O-N 3.17Å; Y41-I44 PolarHBondContact O-N 3.26Å; I44-S46 VanDerWaalsContact C-N 3.26Å; I44-S46 PolarHBondContact O-N 2.81Å; I44-F47 VanDerWaalsContact O-CB 3.31Å; I44-F47 WeakPolarHBondContact O-CB 3.43Å; I44-F47 PolarHBondContact O-N 2.67Å; I44-I69 HydrophobicContact CG2-CD1 4.03Å; I44-V73 HydrophobicContact CG2-CG2 4.01Å; I44-M76 HydrophobicContact CD1-SD 4.06Å; I44-Y131 HydrophobicContact CD1-CD2 3.72Å; I44-Y131 HydrophobicContact CD1-CE2 3.68Å; I44-Y131 HydrophobicContact CD1-CG 4.46Å; I44-Y131 HydrophobicContact CG1-CD2 4.25Å; I44-Y131 HydrophobicContact CG1-CE2 3.67Å |
| 45 | K | 88.9 | Confident | 92.3 | Very high | 37 Ų | 37 | 15.6 Ų | 15.6 | 16% | 0.161 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -66.2 | -26.4 | 178.3 | -78 | -177.4 | 169.2 | 176.5 | 0 | 113.1 | Y41 I43 F47 E161 M165 P311 E339 | Y41-K45 WeakPolarHBondContact O-CB 3.36Å; Y41-K45 PolarHBondContact O-N 3.46Å; I43-K45 PolarHBondContact O-N 3.45Å; K45-F47 VanDerWaalsContact C-N 3.33Å; K45-E161 IonicContact NZ-OE1 2.71Å; K45-E161 PolarHBondContact NZ-OE1 3.26Å; K45-M165 HydrophobicContact CB-CE 4.25Å; K45-M165 HydrophobicContact CB-SD 3.96Å; K45-M165 HydrophobicContact CD-SD 3.98Å; K45-P311 HydrophobicContact CB-CB 4.43Å; K45-P311 HydrophobicContact CG-CB 4.46Å; K45-E339 VanDerWaalsContact NZ-CD 3.31Å; K45-E339 IonicContact NZ-OE1 2.96Å; K45-E339 PolarHBondContact NZ-OE1 3.49Å; K45-E339 IonicContact NZ-OE2 3.18Å; K45-E339 PolarHBondContact NZ-OE2 2.93Å |
| 46 | S | 90.6 | Very high | 92.2 | Very high | 2 Ų | 2 | 19.7 Ų | 19.7 | 1% | 0.014 | 9% | 0.092 | C | C | . | . | G | 310 helix | trans | -86.8 | -1.8 | 179.3 | -55 | 0 | 0 | 0 | 0 | 113.4 | G42 I43 I44 G48 I49 | G42-S46 WeakPolarHBondContact O-CB 3.26Å; G42-S46 PolarHBondContact O-N 3.25Å; G42-S46 PolarHBondContact O-OG 3.2Å; I43-S46 PolarHBondContact O-N 2.92Å; I43-S46 VanDerWaalsContact O-N 3.14Å; I44-S46 VanDerWaalsContact C-N 3.26Å; I44-S46 PolarHBondContact O-N 2.81Å; S46-G48 PolarHBondContact O-N 3.35Å; S46-I49 WeakPolarHBondContact O-CB 3.49Å; S46-I49 WeakPolarHBondContact O-CD1 3.27Å; S46-I49 VanDerWaalsContact O-CG1 3.3Å; S46-I49 WeakPolarHBondContact O-CG1 3.5Å; S46-I49 PolarHBondContact O-N 3.07Å |
| 47 | F | 89.4 | Confident | 92.1 | Very high | 1 Ų | 1 | 23.9 Ų | 23.9 | 0% | 0.004 | 11% | 0.111 | C | C | . | . | G | 310 helix | trans | -62.9 | -24.7 | -176.6 | -171 | -92.7 | 0 | 0 | 0 | 113.7 | I43 I44 K45 I49 F50 M54 I68 I69 Y123 M185 L312 | I43-F47 PolarHBondContact O-N 3.42Å; I44-F47 VanDerWaalsContact O-CB 3.31Å; I44-F47 WeakPolarHBondContact O-CB 3.43Å; I44-F47 PolarHBondContact O-N 2.67Å; K45-F47 VanDerWaalsContact C-N 3.33Å; F47-I49 PolarHBondContact O-N 3.41Å; F47-F50 PolarHBondContact O-N 2.95Å; F47-M54 HydrophobicContact CE1-SD 4.41Å; F47-M54 HydrophobicContact CE2-CE 4.04Å; F47-M54 HydrophobicContact CE2-SD 4.46Å; F47-M54 HydrophobicContact CZ-CE 3.87Å; F47-M54 HydrophobicContact CZ-SD 3.7Å; F47-I68 HydrophobicContact CE2-CG2 4.12Å; F47-I68 HydrophobicContact CZ-CB 4.14Å; F47-I68 HydrophobicContact CZ-CD1 4.06Å; F47-I68 HydrophobicContact CZ-CG2 3.75Å; F47-I69 HydrophobicContact CB-CD1 3.35Å; F47-I69 HydrophobicContact CB-CG1 3.96Å; F47-I69 HydrophobicContact CD1-CD1 3.72Å; F47-I69 HydrophobicContact CD1-CG1 3.33Å; F47-I69 HydrophobicContact CD2-CD1 3.96Å; F47-I69 HydrophobicContact CD2-CG1 4.32Å; F47-I69 HydrophobicContact CE1-CD1 4.49Å; F47-I69 HydrophobicContact CE1-CG1 3.82Å; F47-I69 HydrophobicContact CG-CD1 3.41Å; F47-I69 VanDerWaalsContact CG-CD1 3.41Å; F47-I69 HydrophobicContact CG-CG1 3.62Å; F47-I69 HydrophobicContact CZ-CG1 4.48Å; F47-Y123 AromaticContact CD2-CE1 3.91Å; F47-Y123 HydrophobicContact CD2-CE1 3.91Å; F47-Y123 AromaticContact CD2-CZ 3.87Å; F47-Y123 HydrophobicContact CE2-CD1 4.25Å; F47-Y123 AromaticContact CE2-CE1 3.89Å; F47-Y123 HydrophobicContact CE2-CE1 3.89Å; F47-M185 HydrophobicContact CD2-CE 4.13Å; F47-M185 HydrophobicContact CE2-CE 3.87Å; F47-L312 HydrophobicContact CD1-CD1 4.36Å |
| 48 | G | 87 | Confident | 92.2 | Very high | 1 Ų | 1 | 25.5 Ų | 25.5 | 1% | 0.01 | 12% | 0.119 | C | C | . | . | G | 310 helix | trans | -53.7 | -23 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | S46 F50 L51 L312 | S46-G48 PolarHBondContact O-N 3.35Å; G48-F50 VanDerWaalsContact C-N 3.28Å; G48-F50 PolarHBondContact O-N 2.96Å; G48-L51 PolarHBondContact O-N 3.19Å; G48-L312 WeakPolarHBondContact CA-O 3.44Å |
| 49 | I | 92.5 | Very high | 92.1 | Very high | 0 Ų | 0 | 27.7 Ų | 27.7 | 0% | 0 | 15% | 0.147 | C | C | . | . | G | 310 helix | trans | -60 | -36.5 | 174 | -64 | 169.9 | 0 | 0 | 0 | 112 | S46 F47 A169 F172 R176 I315 L332 | S46-I49 WeakPolarHBondContact O-CB 3.49Å; S46-I49 WeakPolarHBondContact O-CD1 3.27Å; S46-I49 VanDerWaalsContact O-CG1 3.3Å; S46-I49 WeakPolarHBondContact O-CG1 3.5Å; S46-I49 PolarHBondContact O-N 3.07Å; F47-I49 PolarHBondContact O-N 3.41Å; I49-A169 HydrophobicContact CD1-CB 3.88Å; I49-A169 VanDerWaalsContact CD1-O 3.22Å; I49-A169 WeakPolarHBondContact CD1-O 3.46Å; I49-F172 HydrophobicContact CD1-CB 4.38Å; I49-R176 PolarHBondContact O-NH1 3.5Å; I49-I315 HydrophobicContact CG1-CD1 3.78Å; I49-L332 HydrophobicContact CG1-CD1 4.23Å |
| 50 | F | 93.3 | Very high | 92.1 | Very high | 4 Ų | 4 | 29.4 Ų | 29.4 | 2% | 0.018 | 16% | 0.155 | C | C | . | . | G | 310 helix | trans | -97 | -1.3 | -172.6 | -52.7 | -71.2 | 0 | 0 | 0 | 113.4 | F47 G48 D53 M54 F172 R176 W181 T184 M185 I188 | F47-F50 PolarHBondContact O-N 2.95Å; G48-F50 VanDerWaalsContact C-N 3.28Å; G48-F50 PolarHBondContact O-N 2.96Å; F50-D53 PolarHBondContact O-N 3.34Å; F50-M54 HydrophobicContact CB-CE 4.16Å; F50-M54 WeakPolarHBondContact O-CG 3.3Å; F50-M54 PolarHBondContact O-N 3.18Å; F50-M54 VanDerWaalsContact O-N 3.15Å; F50-F172 HydrophobicContact CZ-CB 4.37Å; F50-R176 HydrophobicContact CD1-CG 4.37Å; F50-R176 HydrophobicContact CE1-CB 4.21Å; F50-R176 HydrophobicContact CE1-CG 4.31Å; F50-W181 HydrophobicContact CD1-CB 3.78Å; F50-W181 HydrophobicContact CE1-CB 4.4Å; F50-T184 HydrophobicContact CE1-CG2 3.67Å; F50-T184 HydrophobicContact CZ-CG2 3.71Å; F50-M185 HydrophobicContact CB-CE 4.06Å; F50-M185 HydrophobicContact CD1-CE 4.24Å; F50-M185 HydrophobicContact CD2-CE 3.29Å; F50-M185 HydrophobicContact CD2-SD 4.46Å; F50-M185 HydrophobicContact CE2-CE 3.71Å; F50-M185 HydrophobicContact CE2-SD 4.32Å; F50-M185 HydrophobicContact CG-CE 3.59Å; F50-M185 HydrophobicContact CZ-CE 4.33Å; F50-I188 HydrophobicContact CE2-CD1 3.91Å; F50-I188 HydrophobicContact CZ-CD1 3.63Å |
| 51 | L | 90.8 | Very high | 92.1 | Very high | 0 Ų | 0 | 32.5 Ų | 32.5 | 0% | 0 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -61.8 | -52.6 | -169.7 | -171.3 | 81.3 | 0 | 0 | 0 | 111.4 | G48 D53 M54 M55 V65 L312 Y313 E316 | G48-L51 PolarHBondContact O-N 3.19Å; L51-D53 PolarHBondContact O-N 2.9Å; L51-M54 PolarHBondContact O-N 3Å; L51-M55 HydrophobicContact CD2-SD 4.43Å; L51-M55 HydrophobicContact CG-SD 4.16Å; L51-M55 VanDerWaalsContact O-CG 3.32Å; L51-M55 WeakPolarHBondContact O-CG 3.2Å; L51-M55 PolarHBondContact O-N 2.83Å; L51-M55 VanDerWaalsContact O-N 3.1Å; L51-V65 HydrophobicContact CD1-CB 4.23Å; L51-V65 HydrophobicContact CD1-CG1 3.69Å; L51-L312 HydrophobicContact CD1-CD1 4.45Å; L51-Y313 HydrophobicContact CD2-CD1 3.67Å; L51-Y313 HydrophobicContact CD2-CE1 3.51Å; L51-E316 HydrophobicContact CD2-CG 4.31Å |
| 52 | Q | 91.4 | Very high | 92.1 | Very high | 45 Ų | 45 | 30.2 Ų | 30.2 | 21% | 0.21 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -64.2 | -41.6 | -179 | -172 | 178.9 | 1.8 | 0 | 0 | 112 | M54 M55 E56 E316 | Q52-M54 VanDerWaalsContact C-N 3.29Å; Q52-M54 PolarHBondContact O-N 3.43Å; Q52-M55 PolarHBondContact O-N 3.46Å; Q52-M55 VanDerWaalsContact O-N 3.14Å; Q52-E56 HydrophobicContact CG-CG 4.35Å; Q52-E56 WeakPolarHBondContact CG-OE1 3.29Å; Q52-E56 PolarHBondContact NE2-OE1 3.42Å; Q52-E56 WeakPolarHBondContact O-CG 3.36Å; Q52-E56 PolarHBondContact O-N 3.28Å; Q52-E316 PolarHBondContact OE1-OE2 2.91Å |
| 53 | D | 93.2 | Very high | 92.2 | Very high | 36 Ų | 36 | 30.8 Ų | 30.8 | 19% | 0.193 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -59.9 | -41.4 | -179.9 | -52.6 | -74.9 | 0 | 0 | 0 | 111.6 | F50 L51 E57 R176 W181 | F50-D53 PolarHBondContact O-N 3.34Å; L51-D53 PolarHBondContact O-N 2.9Å; D53-E57 WeakPolarHBondContact O-CB 3.2Å; D53-E57 PolarHBondContact O-N 3.21Å; D53-R176 WeakPolarHBondContact OD2-CD 3.31Å; D53-R176 IonicContact OD2-NH1 3.85Å; D53-W181 HydrophobicContact CB-CB 4.2Å; D53-W181 HydrophobicContact CB-CG 4.02Å |
| 54 | M | 94.1 | Very high | 92.3 | Very high | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -69.3 | -37.3 | 177.2 | -69.7 | -175 | -177.5 | 0 | 0 | 112.1 | F47 F50 L51 Q52 F58 V65 I68 W181 M185 | F47-M54 HydrophobicContact CE1-SD 4.41Å; F47-M54 HydrophobicContact CE2-CE 4.04Å; F47-M54 HydrophobicContact CE2-SD 4.46Å; F47-M54 HydrophobicContact CZ-CE 3.87Å; F47-M54 HydrophobicContact CZ-SD 3.7Å; F50-M54 HydrophobicContact CB-CE 4.16Å; F50-M54 WeakPolarHBondContact O-CG 3.3Å; F50-M54 PolarHBondContact O-N 3.18Å; F50-M54 VanDerWaalsContact O-N 3.15Å; L51-M54 PolarHBondContact O-N 3Å; Q52-M54 VanDerWaalsContact C-N 3.29Å; Q52-M54 PolarHBondContact O-N 3.43Å; M54-F58 HydrophobicContact CB-CD2 4.34Å; M54-F58 WeakPolarHBondContact O-CB 3.37Å; M54-F58 VanDerWaalsContact O-CD2 3.23Å; M54-F58 WeakPolarHBondContact O-CD2 3.32Å; M54-F58 PolarHBondContact O-N 2.79Å; M54-F58 VanDerWaalsContact O-N 3.13Å; M54-V65 HydrophobicContact CB-CG1 3.85Å; M54-V65 HydrophobicContact CB-CG2 4.4Å; M54-V65 HydrophobicContact SD-CG1 4.22Å; M54-I68 HydrophobicContact SD-CD1 3.77Å; M54-W181 HydrophobicContact CE-CE3 3.8Å; M54-W181 HydrophobicContact CE-CZ3 3.77Å; M54-W181 HydrophobicContact CG-CE3 4.49Å; M54-M185 HydrophobicContact CE-CE 3.73Å |
| 55 | M | 93.9 | Very high | 92.5 | Very high | 31 Ų | 31 | 34.2 Ų | 34.2 | 15% | 0.153 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -63.8 | -44.7 | 176.5 | -70.5 | 168.3 | 56.2 | 0 | 0 | 111.5 | L51 Q52 G59 E60 N62 V65 | L51-M55 HydrophobicContact CD2-SD 4.43Å; L51-M55 HydrophobicContact CG-SD 4.16Å; L51-M55 VanDerWaalsContact O-CG 3.32Å; L51-M55 WeakPolarHBondContact O-CG 3.2Å; L51-M55 PolarHBondContact O-N 2.83Å; L51-M55 VanDerWaalsContact O-N 3.1Å; Q52-M55 PolarHBondContact O-N 3.46Å; Q52-M55 VanDerWaalsContact O-N 3.14Å; M55-G59 WeakPolarHBondContact O-CA 3.31Å; M55-G59 PolarHBondContact O-N 3.08Å; M55-E60 PolarHBondContact O-N 3.27Å; M55-N62 HydrophobicContact CE-CB 4.35Å; M55-N62 VanDerWaalsContact CE-ND2 3.29Å; M55-N62 WeakPolarHBondContact CE-ND2 3.43Å; M55-N62 VanDerWaalsContact CE-OD1 3.29Å; M55-N62 WeakPolarHBondContact CE-OD1 3.36Å; M55-N62 HydrophobicContact SD-CB 4.35Å; M55-N62 PolarHBondContact SD-OD1 3.16Å; M55-V65 HydrophobicContact CB-CG2 4.45Å; M55-V65 HydrophobicContact CG-CB 4.16Å; M55-V65 HydrophobicContact CG-CG2 3.57Å |
| 56 | E | 93.4 | Very high | 92.8 | Very high | 131 Ų | 131 | 32.4 Ų | 32.4 | 61% | 0.612 | 17% | 0.174 | S | C | * | . | H | α-helix | trans | -68.5 | -45.3 | -179.3 | -71.5 | 178.4 | -172.6 | 0 | 0 | 112 | Q52 | Q52-E56 HydrophobicContact CG-CG 4.35Å; Q52-E56 WeakPolarHBondContact CG-OE1 3.29Å; Q52-E56 PolarHBondContact NE2-OE1 3.42Å; Q52-E56 WeakPolarHBondContact O-CG 3.36Å; Q52-E56 PolarHBondContact O-N 3.28Å |
| 57 | E | 93.8 | Very high | 93 | Very high | 89 Ų | 89 | 36.9 Ų | 36.9 | 42% | 0.416 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -69.1 | -40.3 | -177.7 | -175 | 170.4 | 147.9 | 0 | 0 | 112.8 | D53 W181 R182 | D53-E57 WeakPolarHBondContact O-CB 3.2Å; D53-E57 PolarHBondContact O-N 3.21Å; E57-W181 WeakPolarHBondContact OE2-CZ2 3.34Å; E57-W181 PolarHBondContact OE2-NE1 2.9Å; E57-R182 IonicContact OE1-CZ 2.67Å; E57-R182 IonicContact OE1-NE 3.59Å; E57-R182 PolarHBondContact OE1-NE 3.39Å; E57-R182 IonicContact OE1-NH2 3.95Å; E57-R182 PolarHBondContact OE1-NH2 3.37Å; E57-R182 IonicContact OE2-NE 3.52Å |
| 58 | F | 94.1 | Very high | 93.3 | Very high | 39 Ų | 39 | 36.8 Ų | 36.8 | 17% | 0.171 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -89.7 | -11.7 | -179.4 | -64.1 | -65 | 0 | 0 | 0 | 113.5 | M54 E60 L116 I119 W181 | M54-F58 HydrophobicContact CB-CD2 4.34Å; M54-F58 WeakPolarHBondContact O-CB 3.37Å; M54-F58 VanDerWaalsContact O-CD2 3.23Å; M54-F58 WeakPolarHBondContact O-CD2 3.32Å; M54-F58 PolarHBondContact O-N 2.79Å; M54-F58 VanDerWaalsContact O-N 3.13Å; F58-E60 VanDerWaalsContact C-N 3.33Å; F58-E60 HydrophobicContact CB-CB 4.38Å; F58-E60 HydrophobicContact CB-CG 3.92Å; F58-E60 WeakPolarHBondContact O-CG 3.23Å; F58-L116 HydrophobicContact CB-CD2 4.32Å; F58-L116 HydrophobicContact CB-CG 4.01Å; F58-L116 HydrophobicContact CD2-CD2 3.51Å; F58-L116 HydrophobicContact CD2-CG 4.04Å; F58-L116 HydrophobicContact CE2-CD2 4.06Å; F58-L116 HydrophobicContact CG-CD2 3.99Å; F58-L116 HydrophobicContact CG-CG 3.99Å; F58-I119 HydrophobicContact CE2-CD1 3.54Å; F58-I119 HydrophobicContact CZ-CD1 3.8Å; F58-W181 AromaticContact CE2-CH2 3.95Å; F58-W181 HydrophobicContact CE2-CH2 3.95Å; F58-W181 AromaticContact CE2-CZ2 3.92Å; F58-W181 HydrophobicContact CE2-CZ2 3.92Å; F58-W181 HydrophobicContact CZ-CH2 4.07Å; F58-W181 HydrophobicContact CZ-CZ2 4.1Å |
| 59 | G | 92.9 | Very high | 93.6 | Very high | 69 Ų | 69 | 37.4 Ų | 37.4 | 71% | 0.711 | 19% | 0.193 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 66.2 | 34.5 | -177.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | M55 | M55-G59 WeakPolarHBondContact O-CA 3.31Å; M55-G59 PolarHBondContact O-N 3.08Å |
| 60 | E | 94.8 | Very high | 93.8 | Very high | 53 Ų | 53 | 37.4 Ų | 37.4 | 25% | 0.248 | 19% | 0.193 | C | C | . | . | trans | -118.2 | 157.4 | -168.6 | -68.8 | -85.4 | -155.9 | 0 | 0 | 111.7 | M55 F58 R64 L116 | M55-E60 PolarHBondContact O-N 3.27Å; F58-E60 VanDerWaalsContact C-N 3.33Å; F58-E60 HydrophobicContact CB-CB 4.38Å; F58-E60 HydrophobicContact CB-CG 3.92Å; F58-E60 WeakPolarHBondContact O-CG 3.23Å; E60-R64 HydrophobicContact CB-CB 4.44Å; E60-R64 IonicContact OE1-CZ 2.74Å; E60-R64 IonicContact OE1-NE 3.1Å; E60-R64 IonicContact OE1-NH1 2.78Å; E60-R64 PolarHBondContact OE1-NH1 3.11Å; E60-R64 IonicContact OE1-NH2 2.87Å; E60-R64 WeakPolarHBondContact OE2-CD 3.48Å; E60-R64 IonicContact OE2-CZ 3.54Å; E60-R64 IonicContact OE2-NE 3.39Å; E60-R64 PolarHBondContact OE2-NE 3.41Å; E60-R64 IonicContact OE2-NH1 3.95Å; E60-R64 PolarHBondContact OE2-NH1 2.97Å; E60-L116 HydrophobicContact CB-CD1 3.45Å; E60-L116 VanDerWaalsContact CB-CD1 3.45Å; E60-L116 HydrophobicContact CG-CD1 3.45Å; E60-L116 VanDerWaalsContact CG-CD1 3.45Å; E60-L116 HydrophobicContact CG-CG 4.2Å | ||
| 61 | T | 94.4 | Very high | 93.9 | Very high | 65 Ų | 65 | 38.9 Ų | 38.9 | 40% | 0.399 | 20% | 0.201 | S | C | . | . | trans | -76.7 | 162.9 | -174.3 | 85.8 | 0 | 0 | 0 | 0 | 112.8 | S63 R64 V65 D446 | T61-S63 PolarHBondContact O-N 2.83Å; T61-R64 PolarHBondContact O-N 2.97Å; T61-R64 VanDerWaalsContact O-N 3.13Å; T61-V65 PolarHBondContact O-N 3.47Å; T61-V65 VanDerWaalsContact O-N 3.15Å; T61-D446 WeakPolarHBondContact CB-OD2 3.5Å; T61-D446 PolarHBondContact OG1-OD2 3.03Å | ||
| 62 | N | 90.9 | Very high | 94.1 | Very high | 11 Ų | 11 | 38.9 Ų | 38.9 | 6% | 0.059 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -55.6 | -43 | 178.2 | -72.5 | -87.1 | 0 | 0 | 0 | 111.2 | M55 R64 V65 S66 D446 | M55-N62 HydrophobicContact CE-CB 4.35Å; M55-N62 VanDerWaalsContact CE-ND2 3.29Å; M55-N62 WeakPolarHBondContact CE-ND2 3.43Å; M55-N62 VanDerWaalsContact CE-OD1 3.29Å; M55-N62 WeakPolarHBondContact CE-OD1 3.36Å; M55-N62 HydrophobicContact SD-CB 4.35Å; M55-N62 PolarHBondContact SD-OD1 3.16Å; N62-R64 VanDerWaalsContact C-N 3.34Å; N62-R64 PolarHBondContact O-N 2.76Å; N62-V65 PolarHBondContact O-N 3.3Å; N62-S66 VanDerWaalsContact O-CB 3.25Å; N62-S66 WeakPolarHBondContact O-CB 3.33Å; N62-S66 PolarHBondContact O-N 2.93Å; N62-S66 PolarHBondContact O-OG 2.82Å; N62-D446 VanDerWaalsContact CB-OD1 3.24Å; N62-D446 WeakPolarHBondContact CB-OD1 3.49Å; N62-D446 PolarHBondContact N-OD1 3.12Å; N62-D446 PolarHBondContact N-OD2 3.18Å; N62-D446 PolarHBondContact ND2-OD1 3.34Å |
| 63 | S | 93.6 | Very high | 94.2 | Very high | 12 Ų | 12 | 38.2 Ų | 38.2 | 8% | 0.084 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -57.6 | -46.3 | 179.3 | -173.4 | 0 | 0 | 0 | 0 | 111.9 | T61 S66 W67 P439 V443 D446 | T61-S63 PolarHBondContact O-N 2.83Å; S63-S66 PolarHBondContact O-N 3.06Å; S63-W67 PolarHBondContact O-N 2.99Å; S63-P439 PolarHBondContact OG-O 3.4Å; S63-P439 VanDerWaalsContact OG-O 3.05Å; S63-V443 VanDerWaalsContact OG-CG2 3.23Å; S63-V443 WeakPolarHBondContact OG-CG2 3.41Å; S63-D446 WeakPolarHBondContact CB-OD2 3.45Å; S63-D446 PolarHBondContact N-OD2 2.74Å |
| 64 | R | 95 | Very high | 94.2 | Very high | 92 Ų | 92 | 38.1 Ų | 38.1 | 35% | 0.347 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -64.6 | -45 | 180 | -69.8 | -163 | 66.4 | -167.9 | 0.9 | 111.8 | E60 T61 N62 S66 W67 L116 Y120 | E60-R64 HydrophobicContact CB-CB 4.44Å; E60-R64 IonicContact OE1-CZ 2.74Å; E60-R64 IonicContact OE1-NE 3.1Å; E60-R64 IonicContact OE1-NH1 2.78Å; E60-R64 PolarHBondContact OE1-NH1 3.11Å; E60-R64 IonicContact OE1-NH2 2.87Å; E60-R64 WeakPolarHBondContact OE2-CD 3.48Å; E60-R64 IonicContact OE2-CZ 3.54Å; E60-R64 IonicContact OE2-NE 3.39Å; E60-R64 PolarHBondContact OE2-NE 3.41Å; E60-R64 IonicContact OE2-NH1 3.95Å; E60-R64 PolarHBondContact OE2-NH1 2.97Å; T61-R64 PolarHBondContact O-N 2.97Å; T61-R64 VanDerWaalsContact O-N 3.13Å; N62-R64 VanDerWaalsContact C-N 3.34Å; N62-R64 PolarHBondContact O-N 2.76Å; R64-S66 VanDerWaalsContact C-N 3.31Å; R64-S66 PolarHBondContact O-N 3.45Å; R64-W67 WeakPolarHBondContact O-CB 3.49Å; R64-W67 PolarHBondContact O-N 2.86Å; R64-L116 HydrophobicContact CB-CD1 4.14Å; R64-Y120 PolarHBondContact O-OH 3.47Å |
| 65 | V | 95.3 | Very high | 94.3 | Very high | 0 Ų | 0 | 39 Ų | 39 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -64.8 | -36.9 | 175.6 | -176.7 | 0 | 0 | 0 | 0 | 111.5 | L51 M54 M55 T61 N62 W67 I68 L116 | L51-V65 HydrophobicContact CD1-CB 4.23Å; L51-V65 HydrophobicContact CD1-CG1 3.69Å; M54-V65 HydrophobicContact CB-CG1 3.85Å; M54-V65 HydrophobicContact CB-CG2 4.4Å; M54-V65 HydrophobicContact SD-CG1 4.22Å; M55-V65 HydrophobicContact CB-CG2 4.45Å; M55-V65 HydrophobicContact CG-CB 4.16Å; M55-V65 HydrophobicContact CG-CG2 3.57Å; T61-V65 PolarHBondContact O-N 3.47Å; T61-V65 VanDerWaalsContact O-N 3.15Å; N62-V65 PolarHBondContact O-N 3.3Å; V65-W67 PolarHBondContact O-N 3.43Å; V65-I68 HydrophobicContact CG1-CD1 4.03Å; V65-I68 VanDerWaalsContact O-CB 3.31Å; V65-I68 WeakPolarHBondContact O-CB 3.39Å; V65-I68 WeakPolarHBondContact O-CD1 3.42Å; V65-I68 VanDerWaalsContact O-CG1 3.23Å; V65-I68 WeakPolarHBondContact O-CG1 3.42Å; V65-I68 PolarHBondContact O-N 3.42Å; V65-I68 VanDerWaalsContact O-N 3.08Å; V65-L116 HydrophobicContact CG2-CD1 4.17Å; V65-L116 HydrophobicContact CG2-CD2 4.3Å |
| 66 | S | 94.5 | Very high | 94.2 | Very high | 0 Ų | 0 | 37.8 Ų | 37.8 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -67.9 | -18.8 | -179.3 | -57.3 | 0 | 0 | 0 | 0 | 114.1 | N62 S63 R64 I68 S70 Y313 | N62-S66 VanDerWaalsContact O-CB 3.25Å; N62-S66 WeakPolarHBondContact O-CB 3.33Å; N62-S66 PolarHBondContact O-N 2.93Å; N62-S66 PolarHBondContact O-OG 2.82Å; S63-S66 PolarHBondContact O-N 3.06Å; R64-S66 VanDerWaalsContact C-N 3.31Å; R64-S66 PolarHBondContact O-N 3.45Å; S66-I68 PolarHBondContact O-N 3.47Å; S66-S70 PolarHBondContact O-N 3.23Å; S66-S70 PolarHBondContact O-OG 3.33Å; S66-Y313 PolarHBondContact OG-OH 3.22Å |
| 67 | W | 95.6 | Very high | 93.9 | Very high | 95 Ų | 95 | 32.3 Ų | 32.3 | 36% | 0.36 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -61.3 | -26.6 | 170.5 | -83.1 | 100.8 | 0 | 0 | 0 | 112.8 | S63 R64 V65 S70 I71 Y120 L435 P439 | S63-W67 PolarHBondContact O-N 2.99Å; R64-W67 WeakPolarHBondContact O-CB 3.49Å; R64-W67 PolarHBondContact O-N 2.86Å; V65-W67 PolarHBondContact O-N 3.43Å; W67-S70 PolarHBondContact O-N 2.92Å; W67-I71 HydrophobicContact CB-CD1 4.38Å; W67-I71 HydrophobicContact CE3-CG1 4.22Å; W67-I71 WeakPolarHBondContact O-CB 3.48Å; W67-I71 WeakPolarHBondContact O-CD1 3.29Å; W67-I71 WeakPolarHBondContact O-CG1 3.39Å; W67-I71 PolarHBondContact O-N 2.82Å; W67-Y120 HydrophobicContact CB-CE1 3.74Å; W67-L435 HydrophobicContact CE3-CD1 4.31Å; W67-L435 HydrophobicContact CZ3-CD1 3.76Å; W67-L435 HydrophobicContact CZ3-CG 4.04Å; W67-P439 HydrophobicContact CD2-CB 4.03Å; W67-P439 HydrophobicContact CD2-CG 3.39Å; W67-P439 VanDerWaalsContact CE2-CG 3.43Å; W67-P439 HydrophobicContact CE3-CG 3.77Å; W67-P439 HydrophobicContact CG-CB 4.33Å; W67-P439 HydrophobicContact CG-CG 3.74Å; W67-P439 HydrophobicContact CH2-CG 4.19Å; W67-P439 HydrophobicContact CZ2-CB 3.8Å; W67-P439 HydrophobicContact CZ2-CG 3.86Å; W67-P439 HydrophobicContact CZ3-CG 4.15Å |
| 68 | I | 95.5 | Very high | 93.8 | Very high | 0 Ų | 0 | 31.5 Ų | 31.5 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -56.9 | -55.3 | 178.6 | -62.3 | 166.1 | 0 | 0 | 0 | 110.7 | F47 M54 V65 S66 S70 C72 L116 I119 Y120 Y123 | F47-I68 HydrophobicContact CE2-CG2 4.12Å; F47-I68 HydrophobicContact CZ-CB 4.14Å; F47-I68 HydrophobicContact CZ-CD1 4.06Å; F47-I68 HydrophobicContact CZ-CG2 3.75Å; M54-I68 HydrophobicContact SD-CD1 3.77Å; V65-I68 HydrophobicContact CG1-CD1 4.03Å; V65-I68 VanDerWaalsContact O-CB 3.31Å; V65-I68 WeakPolarHBondContact O-CB 3.39Å; V65-I68 WeakPolarHBondContact O-CD1 3.42Å; V65-I68 VanDerWaalsContact O-CG1 3.23Å; V65-I68 WeakPolarHBondContact O-CG1 3.42Å; V65-I68 PolarHBondContact O-N 3.42Å; V65-I68 VanDerWaalsContact O-N 3.08Å; S66-I68 PolarHBondContact O-N 3.47Å; I68-S70 VanDerWaalsContact C-N 3.29Å; I68-S70 PolarHBondContact O-N 3.19Å; I68-C72 WeakPolarHBondContact O-CB 3.35Å; I68-C72 PolarHBondContact O-N 3.29Å; I68-C72 VanDerWaalsContact O-N 3.1Å; I68-L116 HydrophobicContact CD1-CD2 4.17Å; I68-I119 HydrophobicContact CD1-CB 4.3Å; I68-I119 HydrophobicContact CD1-CG2 3.59Å; I68-I119 HydrophobicContact CG1-CG2 3.84Å; I68-I119 HydrophobicContact CG2-CG2 3.87Å; I68-Y120 HydrophobicContact CG1-CD1 3.71Å; I68-Y120 HydrophobicContact CG1-CE1 3.68Å; I68-Y123 HydrophobicContact CG2-CD1 3.43Å; I68-Y123 VanDerWaalsContact CG2-CD1 3.43Å; I68-Y123 HydrophobicContact CG2-CE1 4.23Å; I68-Y123 HydrophobicContact CG2-CG 4.05Å |
| 69 | I | 93.4 | Very high | 93.5 | Very high | 13 Ų | 13 | 31 Ų | 31 | 7% | 0.067 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -64.7 | -37.1 | 179.4 | -73.8 | -79.5 | 0 | 0 | 0 | 111 | I44 F47 C72 V73 Y123 P438 | I44-I69 HydrophobicContact CG2-CD1 4.03Å; F47-I69 HydrophobicContact CB-CD1 3.35Å; F47-I69 HydrophobicContact CB-CG1 3.96Å; F47-I69 HydrophobicContact CD1-CD1 3.72Å; F47-I69 HydrophobicContact CD1-CG1 3.33Å; F47-I69 HydrophobicContact CD2-CD1 3.96Å; F47-I69 HydrophobicContact CD2-CG1 4.32Å; F47-I69 HydrophobicContact CE1-CD1 4.49Å; F47-I69 HydrophobicContact CE1-CG1 3.82Å; F47-I69 HydrophobicContact CG-CD1 3.41Å; F47-I69 VanDerWaalsContact CG-CD1 3.41Å; F47-I69 HydrophobicContact CG-CG1 3.62Å; F47-I69 HydrophobicContact CZ-CG1 4.48Å; I69-C72 WeakPolarHBondContact O-CB 3.33Å; I69-C72 PolarHBondContact O-N 3.5Å; I69-V73 HydrophobicContact CG2-CG2 4.21Å; I69-V73 WeakPolarHBondContact O-CG2 3.22Å; I69-V73 PolarHBondContact O-N 3.05Å; I69-Y123 HydrophobicContact CD1-CE1 4.42Å; I69-P438 HydrophobicContact CG2-CG 4.38Å |
| 70 | S | 94.9 | Very high | 93.1 | Very high | 0 Ų | 0 | 28.7 Ų | 28.7 | 0% | 0 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -70.2 | -43.6 | -175 | -54.9 | 0 | 0 | 0 | 0 | 112.7 | S66 W67 I68 C72 F74 G434 L435 P438 P439 | S66-S70 PolarHBondContact O-N 3.23Å; S66-S70 PolarHBondContact O-OG 3.33Å; W67-S70 PolarHBondContact O-N 2.92Å; I68-S70 VanDerWaalsContact C-N 3.29Å; I68-S70 PolarHBondContact O-N 3.19Å; S70-C72 VanDerWaalsContact C-N 3.29Å; S70-F74 WeakPolarHBondContact O-CB 3.36Å; S70-F74 PolarHBondContact O-N 3.39Å; S70-G434 WeakPolarHBondContact CA-O 3.42Å; S70-G434 WeakPolarHBondContact CB-O 3.36Å; S70-L435 VanDerWaalsContact CB-O 3.27Å; S70-L435 WeakPolarHBondContact CB-O 3.48Å; S70-P438 VanDerWaalsContact OG-CB 3.23Å; S70-P438 WeakPolarHBondContact OG-CB 3.42Å; S70-P438 VanDerWaalsContact OG-CD 3.25Å; S70-P438 WeakPolarHBondContact OG-CD 3.41Å; S70-P438 WeakPolarHBondContact OG-CG 3.41Å; S70-P439 WeakPolarHBondContact OG-CD 3.5Å |
| 71 | I | 96.3 | Very high | 92.5 | Very high | 36 Ų | 36 | 27.5 Ų | 27.5 | 19% | 0.185 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -61.6 | -43.9 | 171.5 | -65.1 | 165.8 | 0 | 0 | 0 | 109 | W67 F74 I75 Y120 L435 | W67-I71 HydrophobicContact CB-CD1 4.38Å; W67-I71 HydrophobicContact CE3-CG1 4.22Å; W67-I71 WeakPolarHBondContact O-CB 3.48Å; W67-I71 WeakPolarHBondContact O-CD1 3.29Å; W67-I71 WeakPolarHBondContact O-CG1 3.39Å; W67-I71 PolarHBondContact O-N 2.82Å; I71-F74 PolarHBondContact O-N 3.47Å; I71-I75 HydrophobicContact CG2-CG1 4.15Å; I71-I75 WeakPolarHBondContact O-CB 3.25Å; I71-I75 WeakPolarHBondContact O-CG1 3.31Å; I71-I75 PolarHBondContact O-N 3.14Å; I71-Y120 HydrophobicContact CD1-CD1 4.02Å; I71-Y120 HydrophobicContact CD1-CD2 4.37Å; I71-Y120 HydrophobicContact CD1-CG 3.87Å; I71-L435 HydrophobicContact CG1-CD1 4.4Å |
| 72 | C | 95.3 | Very high | 92.2 | Very high | 0 Ų | 0 | 28.3 Ų | 28.3 | 0% | 0 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -58.6 | -52.6 | 179.3 | -164.2 | 0 | 0 | 0 | 0 | 112.9 | I68 I69 S70 I75 M76 G124 Y131 | I68-C72 WeakPolarHBondContact O-CB 3.35Å; I68-C72 PolarHBondContact O-N 3.29Å; I68-C72 VanDerWaalsContact O-N 3.1Å; I69-C72 WeakPolarHBondContact O-CB 3.33Å; I69-C72 PolarHBondContact O-N 3.5Å; S70-C72 VanDerWaalsContact C-N 3.29Å; C72-I75 PolarHBondContact O-N 3.46Å; C72-M76 WeakPolarHBondContact O-CB 3.37Å; C72-M76 PolarHBondContact O-N 3.05Å; C72-G124 WeakPolarHBondContact CA-O 3.47Å; C72-Y131 VanDerWaalsContact SG-CD2 3.59Å; C72-Y131 VanDerWaalsContact SG-CE2 3.51Å |
| 73 | V | 92.3 | Very high | 92 | Very high | 31 Ų | 31 | 27.8 Ų | 27.8 | 19% | 0.188 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -66.8 | -39.2 | 180 | 172.8 | 0 | 0 | 0 | 0 | 111.4 | I44 I69 M76 T77 | I44-V73 HydrophobicContact CG2-CG2 4.01Å; I69-V73 HydrophobicContact CG2-CG2 4.21Å; I69-V73 WeakPolarHBondContact O-CG2 3.22Å; I69-V73 PolarHBondContact O-N 3.05Å; V73-M76 HydrophobicContact CG1-CE 4.31Å; V73-M76 PolarHBondContact O-N 3.41Å; V73-T77 PolarHBondContact O-N 3.46Å; V73-T77 VanDerWaalsContact O-N 3.09Å; V73-T77 PolarHBondContact O-OG1 3.22Å |
| 74 | F | 94.6 | Very high | 91.5 | Very high | 33 Ų | 33 | 29 Ų | 29 | 15% | 0.145 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -59.8 | -52.2 | 174.1 | 174.2 | -103.3 | 0 | 0 | 0 | 111 | S70 I71 M76 T77 F78 S431 F432 L435 | S70-F74 WeakPolarHBondContact O-CB 3.36Å; S70-F74 PolarHBondContact O-N 3.39Å; I71-F74 PolarHBondContact O-N 3.47Å; F74-M76 VanDerWaalsContact C-N 3.31Å; F74-M76 PolarHBondContact O-N 3.01Å; F74-T77 PolarHBondContact O-N 3.49Å; F74-T77 PolarHBondContact O-OG1 3.09Å; F74-F78 HydrophobicContact CD1-CB 4.49Å; F74-F78 HydrophobicContact CD2-CB 4.31Å; F74-F78 HydrophobicContact CE1-CB 4.22Å; F74-F78 HydrophobicContact CE1-CD1 4.35Å; F74-F78 HydrophobicContact CE1-CD2 4.41Å; F74-F78 HydrophobicContact CE1-CG 4.1Å; F74-F78 HydrophobicContact CE2-CB 4.04Å; F74-F78 AromaticContact CE2-CD2 3.66Å; F74-F78 HydrophobicContact CE2-CD2 3.66Å; F74-F78 HydrophobicContact CE2-CE2 4.32Å; F74-F78 AromaticContact CE2-CG 4Å; F74-F78 HydrophobicContact CE2-CG 4Å; F74-F78 HydrophobicContact CZ-CB 3.99Å; F74-F78 HydrophobicContact CZ-CD1 4.17Å; F74-F78 AromaticContact CZ-CD2 3.5Å; F74-F78 HydrophobicContact CZ-CD2 3.5Å; F74-F78 AromaticContact CZ-CE2 3.92Å; F74-F78 HydrophobicContact CZ-CE2 3.92Å; F74-F78 AromaticContact CZ-CG 3.63Å; F74-F78 HydrophobicContact CZ-CG 3.63Å; F74-F78 HydrophobicContact CZ-CZ 4.43Å; F74-F78 WeakPolarHBondContact O-CB 3.38Å; F74-F78 PolarHBondContact O-N 2.87Å; F74-S431 WeakPolarHBondContact CD2-O 3.09Å; F74-F432 HydrophobicContact CE2-CD1 4.43Å; F74-F432 HydrophobicContact CE2-CE1 4.4Å; F74-L435 HydrophobicContact CB-CB 3.93Å; F74-L435 HydrophobicContact CB-CD1 3.83Å; F74-L435 HydrophobicContact CB-CG 4.37Å; F74-L435 HydrophobicContact CD1-CD1 4.34Å; F74-L435 HydrophobicContact CD2-CB 3.85Å; F74-L435 HydrophobicContact CD2-CD2 4.01Å; F74-L435 HydrophobicContact CD2-CG 4.35Å; F74-L435 HydrophobicContact CE2-CD2 4.19Å; F74-L435 HydrophobicContact CG-CB 4.05Å; F74-L435 HydrophobicContact CG-CD1 3.99Å; F74-L435 HydrophobicContact CG-CD2 4.17Å; F74-L435 HydrophobicContact CG-CG 4.3Å |
| 75 | I | 95.1 | Very high | 91 | Very high | 19 Ų | 19 | 27.4 Ų | 27.4 | 10% | 0.097 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -63.1 | -39.8 | -179.3 | -67.8 | -63 | 0 | 0 | 0 | 111.1 | I71 C72 T77 N79 L125 L129 | I71-I75 HydrophobicContact CG2-CG1 4.15Å; I71-I75 WeakPolarHBondContact O-CB 3.25Å; I71-I75 WeakPolarHBondContact O-CG1 3.31Å; I71-I75 PolarHBondContact O-N 3.14Å; C72-I75 PolarHBondContact O-N 3.46Å; I75-T77 VanDerWaalsContact C-N 3.34Å; I75-T77 PolarHBondContact O-N 3.45Å; I75-N79 WeakPolarHBondContact O-CB 3.24Å; I75-N79 PolarHBondContact O-N 3.41Å; I75-N79 PolarHBondContact O-ND2 3.19Å; I75-L125 HydrophobicContact CD1-CD1 3.61Å; I75-L125 HydrophobicContact CG1-CD1 3.89Å; I75-L125 HydrophobicContact CG2-CD1 4.31Å; I75-L129 HydrophobicContact CG2-CB 4.24Å; I75-L129 HydrophobicContact CG2-CD2 3.69Å; I75-L129 HydrophobicContact CG2-CG 3.58Å; I75-L129 VanDerWaalsContact CG2-N 3.32Å |
| 76 | M | 91.8 | Very high | 90.6 | Very high | 6 Ų | 6 | 29.2 Ų | 29.2 | 3% | 0.03 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -57 | -45.4 | 176.1 | 178.2 | -172.7 | 72.4 | 0 | 0 | 112.1 | Y41 I44 C72 V73 F74 G128 C132 | Y41-M76 HydrophobicContact CE1-CE 3.61Å; Y41-M76 HydrophobicContact CE1-SD 4.17Å; Y41-M76 HydrophobicContact CE2-CE 4.42Å; Y41-M76 HydrophobicContact CE2-SD 4.17Å; Y41-M76 VanDerWaalsContact CZ-CE 3.48Å; Y41-M76 WeakPolarHBondContact OH-CE 3.35Å; I44-M76 HydrophobicContact CD1-SD 4.06Å; C72-M76 WeakPolarHBondContact O-CB 3.37Å; C72-M76 PolarHBondContact O-N 3.05Å; V73-M76 HydrophobicContact CG1-CE 4.31Å; V73-M76 PolarHBondContact O-N 3.41Å; F74-M76 VanDerWaalsContact C-N 3.31Å; F74-M76 PolarHBondContact O-N 3.01Å; M76-G128 WeakPolarHBondContact CA-O 3.49Å; M76-C132 VanDerWaalsContact O-CB 3.29Å; M76-C132 WeakPolarHBondContact O-CB 3.35Å; M76-C132 PolarHBondContact O-SG 3.15Å; M76-C132 VanDerWaalsContact O-SG 3.41Å |
| 77 | T | 88.3 | Confident | 90.1 | Very high | 15 Ų | 15 | 29.5 Ų | 29.5 | 9% | 0.092 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -88.1 | -43.5 | -173.8 | 49.4 | 0 | 0 | 0 | 0 | 112.7 | V73 F74 I75 N79 S80 V427 S431 | V73-T77 PolarHBondContact O-N 3.46Å; V73-T77 VanDerWaalsContact O-N 3.09Å; V73-T77 PolarHBondContact O-OG1 3.22Å; F74-T77 PolarHBondContact O-N 3.49Å; F74-T77 PolarHBondContact O-OG1 3.09Å; I75-T77 VanDerWaalsContact C-N 3.34Å; I75-T77 PolarHBondContact O-N 3.45Å; T77-N79 VanDerWaalsContact C-N 3.31Å; T77-N79 PolarHBondContact O-N 3.43Å; T77-S80 VanDerWaalsContact O-CB 3.31Å; T77-S80 WeakPolarHBondContact O-CB 3.27Å; T77-S80 PolarHBondContact O-N 3.19Å; T77-S80 VanDerWaalsContact O-N 3.14Å; T77-S80 PolarHBondContact O-OG 2.78Å; T77-V427 HydrophobicContact CG2-CG1 4.08Å; T77-S431 WeakPolarHBondContact OG1-CA 3.21Å; T77-S431 WeakPolarHBondContact OG1-CB 3.28Å |
| 78 | F | 90.4 | Very high | 89.5 | Confident | 72 Ų | 72 | 30.3 Ų | 30.3 | 32% | 0.316 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -61.1 | -36.7 | -178.8 | -174.8 | -96.6 | 0 | 0 | 0 | 112.5 | F74 S80 P81 F428 | F74-F78 HydrophobicContact CD1-CB 4.49Å; F74-F78 HydrophobicContact CD2-CB 4.31Å; F74-F78 HydrophobicContact CE1-CB 4.22Å; F74-F78 HydrophobicContact CE1-CD1 4.35Å; F74-F78 HydrophobicContact CE1-CD2 4.41Å; F74-F78 HydrophobicContact CE1-CG 4.1Å; F74-F78 HydrophobicContact CE2-CB 4.04Å; F74-F78 AromaticContact CE2-CD2 3.66Å; F74-F78 HydrophobicContact CE2-CD2 3.66Å; F74-F78 HydrophobicContact CE2-CE2 4.32Å; F74-F78 AromaticContact CE2-CG 4Å; F74-F78 HydrophobicContact CE2-CG 4Å; F74-F78 HydrophobicContact CZ-CB 3.99Å; F74-F78 HydrophobicContact CZ-CD1 4.17Å; F74-F78 AromaticContact CZ-CD2 3.5Å; F74-F78 HydrophobicContact CZ-CD2 3.5Å; F74-F78 AromaticContact CZ-CE2 3.92Å; F74-F78 HydrophobicContact CZ-CE2 3.92Å; F74-F78 AromaticContact CZ-CG 3.63Å; F74-F78 HydrophobicContact CZ-CG 3.63Å; F74-F78 HydrophobicContact CZ-CZ 4.43Å; F74-F78 WeakPolarHBondContact O-CB 3.38Å; F74-F78 PolarHBondContact O-N 2.87Å; F78-S80 VanDerWaalsContact C-N 3.26Å; F78-S80 PolarHBondContact O-N 3.37Å; F78-P81 WeakPolarHBondContact O-CD 3.39Å; F78-F428 AromaticContact CD2-CD2 3.89Å; F78-F428 HydrophobicContact CD2-CD2 3.89Å; F78-F428 AromaticContact CD2-CE2 3.45Å; F78-F428 HydrophobicContact CD2-CE2 3.45Å; F78-F428 VanDerWaalsContact CD2-CE2 3.45Å; F78-F428 HydrophobicContact CD2-CZ 4.2Å; F78-F428 HydrophobicContact CE2-CD2 4.09Å; F78-F428 AromaticContact CE2-CE2 3.17Å; F78-F428 HydrophobicContact CE2-CE2 3.17Å; F78-F428 AromaticContact CE2-CZ 3.64Å; F78-F428 HydrophobicContact CE2-CZ 3.64Å; F78-F428 HydrophobicContact CG-CE2 4.4Å; F78-F428 AromaticContact CZ-CE2 3.92Å; F78-F428 HydrophobicContact CZ-CE2 3.92Å; F78-F428 HydrophobicContact CZ-CZ 4.46Å |
| 79 | N | 88.9 | Confident | 89 | Confident | 30 Ų | 30 | 38.9 Ų | 38.9 | 16% | 0.16 | 20% | 0.197 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -83.2 | 7.8 | -180 | -69.7 | -81.3 | 0 | 0 | 0 | 113.9 | I75 T77 P81 L82 S83 L129 C132 | I75-N79 WeakPolarHBondContact O-CB 3.24Å; I75-N79 PolarHBondContact O-N 3.41Å; I75-N79 PolarHBondContact O-ND2 3.19Å; T77-N79 VanDerWaalsContact C-N 3.31Å; T77-N79 PolarHBondContact O-N 3.43Å; N79-P81 VanDerWaalsContact C-CD 3.45Å; N79-P81 VanDerWaalsContact C-N 3.34Å; N79-L82 HydrophobicContact CB-CB 4.47Å; N79-L82 VanDerWaalsContact O-CB 3.3Å; N79-L82 WeakPolarHBondContact O-CB 3.35Å; N79-L82 PolarHBondContact O-N 2.98Å; N79-S83 PolarHBondContact O-N 2.91Å; N79-S83 VanDerWaalsContact O-N 3.12Å; N79-L129 HydrophobicContact CB-CD2 4.27Å; N79-C132 HydrophobicContact CB-CB 4.31Å; N79-C132 PolarHBondContact O-SG 3.27Å |
| 80 | S | 83.6 | Confident | 88.5 | Confident | 20 Ų | 20 | 41.8 Ų | 41.8 | 14% | 0.14 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -52.8 | -42.9 | 179.9 | -62.3 | 0 | 0 | 0 | 0 | 113.7 | T77 F78 L82 S83 S84 L136 | T77-S80 VanDerWaalsContact O-CB 3.31Å; T77-S80 WeakPolarHBondContact O-CB 3.27Å; T77-S80 PolarHBondContact O-N 3.19Å; T77-S80 VanDerWaalsContact O-N 3.14Å; T77-S80 PolarHBondContact O-OG 2.78Å; F78-S80 VanDerWaalsContact C-N 3.26Å; F78-S80 PolarHBondContact O-N 3.37Å; S80-L82 VanDerWaalsContact C-N 3.3Å; S80-L82 PolarHBondContact O-N 3.45Å; S80-S83 PolarHBondContact O-N 3.41Å; S80-S84 PolarHBondContact O-N 3.01Å; S80-S84 VanDerWaalsContact O-N 3.09Å; S80-L136 WeakPolarHBondContact O-CD2 3.47Å |
| 81 | P | 83.6 | Confident | 88.1 | Confident | 27 Ų | 27 | 42.7 Ų | 42.7 | 18% | 0.175 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -61.9 | -36.6 | 176.3 | -22 | 33.7 | 0 | 0 | 0 | 113.2 | F78 N79 S84 V85 L282 L283 | F78-P81 WeakPolarHBondContact O-CD 3.39Å; N79-P81 VanDerWaalsContact C-CD 3.45Å; N79-P81 VanDerWaalsContact C-N 3.34Å; P81-S84 WeakPolarHBondContact O-CB 3.5Å; P81-S84 PolarHBondContact O-N 3.17Å; P81-V85 PolarHBondContact O-N 3.24Å; P81-V85 VanDerWaalsContact O-N 3.12Å; P81-L282 HydrophobicContact CB-CB 4.49Å; P81-L283 HydrophobicContact CB-CG 4.49Å; P81-L283 HydrophobicContact CG-CD1 3.78Å; P81-L283 HydrophobicContact CG-CD2 4.09Å; P81-L283 HydrophobicContact CG-CG 3.97Å |
| 82 | L | 86.8 | Confident | 87.7 | Confident | 83 Ų | 83 | 41.8 Ų | 41.8 | 44% | 0.435 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -62.8 | -45.7 | 176.6 | 175.5 | 64.7 | 0 | 0 | 0 | 110.6 | N79 S80 S84 V85 M86 | N79-L82 HydrophobicContact CB-CB 4.47Å; N79-L82 VanDerWaalsContact O-CB 3.3Å; N79-L82 WeakPolarHBondContact O-CB 3.35Å; N79-L82 PolarHBondContact O-N 2.98Å; S80-L82 VanDerWaalsContact C-N 3.3Å; S80-L82 PolarHBondContact O-N 3.45Å; L82-S84 VanDerWaalsContact C-N 3.28Å; L82-S84 PolarHBondContact O-N 2.71Å; L82-V85 PolarHBondContact O-N 3.46Å; L82-M86 HydrophobicContact CD1-CG 4.39Å; L82-M86 HydrophobicContact CD1-SD 4.33Å; L82-M86 HydrophobicContact CG-SD 4.19Å; L82-M86 WeakPolarHBondContact O-CG 3.38Å; L82-M86 PolarHBondContact O-N 3.36Å |
| 83 | S | 87.3 | Confident | 87.5 | Confident | 0 Ų | 0 | 42.1 Ų | 42.1 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -59.8 | -38 | 176.4 | -176.4 | 0 | 0 | 0 | 0 | 112.1 | N79 S80 M86 M87 C132 P137 | N79-S83 PolarHBondContact O-N 2.91Å; N79-S83 VanDerWaalsContact O-N 3.12Å; S80-S83 PolarHBondContact O-N 3.41Å; S83-M86 PolarHBondContact O-N 3.37Å; S83-M87 PolarHBondContact O-N 3.28Å; S83-C132 VanDerWaalsContact CB-SG 3.54Å; S83-C132 PolarHBondContact OG-O 3.1Å; S83-P137 WeakPolarHBondContact OG-CD 3.44Å |
| 84 | S | 83 | Confident | 87.4 | Confident | 37 Ų | 37 | 44.3 Ų | 44.3 | 26% | 0.259 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -61 | -45.8 | 173 | -175.5 | 0 | 0 | 0 | 0 | 113.2 | S80 P81 L82 M86 M87 N88 | S80-S84 PolarHBondContact O-N 3.01Å; S80-S84 VanDerWaalsContact O-N 3.09Å; P81-S84 WeakPolarHBondContact O-CB 3.5Å; P81-S84 PolarHBondContact O-N 3.17Å; L82-S84 VanDerWaalsContact C-N 3.28Å; L82-S84 PolarHBondContact O-N 2.71Å; S84-M86 PolarHBondContact O-N 3.48Å; S84-M87 VanDerWaalsContact O-CG 3.24Å; S84-M87 WeakPolarHBondContact O-CG 3.06Å; S84-N88 VanDerWaalsContact O-CG 3.26Å; S84-N88 PolarHBondContact O-N 2.94Å; S84-N88 PolarHBondContact O-ND2 3.05Å |
| 85 | V | 84.9 | Confident | 87.4 | Confident | 58 Ų | 58 | 42.7 Ų | 42.7 | 35% | 0.352 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -62.8 | -45.6 | 176.3 | 177.1 | 0 | 0 | 0 | 0 | 111 | P81 L82 N88 R89 L282 | P81-V85 PolarHBondContact O-N 3.24Å; P81-V85 VanDerWaalsContact O-N 3.12Å; L82-V85 PolarHBondContact O-N 3.46Å; V85-N88 PolarHBondContact O-N 3.46Å; V85-R89 WeakPolarHBondContact O-CB 3.05Å; V85-R89 PolarHBondContact O-N 3.23Å; V85-L282 HydrophobicContact CG2-CD1 3.19Å; V85-L282 HydrophobicContact CG2-CD2 3.55Å; V85-L282 HydrophobicContact CG2-CG 3.99Å |
| 86 | M | 85.9 | Confident | 87.4 | Confident | 39 Ų | 39 | 41.8 Ų | 41.8 | 19% | 0.192 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -63.3 | -44.5 | -177.9 | -70.8 | -176.2 | 71.9 | 0 | 0 | 111.6 | L82 S83 S84 N88 R89 F90 V95 L133 | L82-M86 HydrophobicContact CD1-CG 4.39Å; L82-M86 HydrophobicContact CD1-SD 4.33Å; L82-M86 HydrophobicContact CG-SD 4.19Å; L82-M86 WeakPolarHBondContact O-CG 3.38Å; L82-M86 PolarHBondContact O-N 3.36Å; S83-M86 PolarHBondContact O-N 3.37Å; S84-M86 PolarHBondContact O-N 3.48Å; M86-N88 VanDerWaalsContact C-N 3.29Å; M86-N88 PolarHBondContact O-N 3.44Å; M86-R89 PolarHBondContact O-N 3.08Å; M86-F90 HydrophobicContact CB-CD2 4.32Å; M86-F90 WeakPolarHBondContact O-CB 3.19Å; M86-F90 PolarHBondContact O-N 3.1Å; M86-V95 HydrophobicContact CB-CG1 4.19Å; M86-V95 HydrophobicContact CB-CG2 3.87Å; M86-V95 WeakPolarHBondContact O-CG2 3.32Å; M86-L133 HydrophobicContact CE-CD1 4.35Å; M86-L133 HydrophobicContact CE-CD2 4.35Å; M86-L133 HydrophobicContact SD-CD1 4.42Å; M86-L133 HydrophobicContact SD-CD2 3.61Å |
| 87 | M | 85.3 | Confident | 87.6 | Confident | 6 Ų | 6 | 43.1 Ų | 43.1 | 3% | 0.03 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -66.5 | -32.3 | 179.8 | 73.7 | 174.3 | 84.9 | 0 | 0 | 112.5 | S83 S84 G91 F92 L136 P137 T140 | S83-M87 PolarHBondContact O-N 3.28Å; S84-M87 VanDerWaalsContact O-CG 3.24Å; S84-M87 WeakPolarHBondContact O-CG 3.06Å; M87-G91 CarbonylContact O-C 3.45Å; M87-G91 WeakPolarHBondContact O-CA 3.48Å; M87-G91 PolarHBondContact O-N 2.96Å; M87-F92 HydrophobicContact CB-CD1 4.33Å; M87-F92 HydrophobicContact CB-CE1 4.34Å; M87-F92 HydrophobicContact CG-CE1 4.23Å; M87-F92 HydrophobicContact SD-CD1 4.11Å; M87-F92 HydrophobicContact SD-CE1 3.4Å; M87-F92 WeakPolarHBondContact SD-CE1 3.48Å; M87-F92 HydrophobicContact SD-CZ 4Å; M87-L136 HydrophobicContact CE-CB 4.18Å; M87-L136 HydrophobicContact CE-CD2 3.74Å; M87-L136 HydrophobicContact CE-CG 3.64Å; M87-P137 HydrophobicContact CB-CB 4.2Å; M87-P137 HydrophobicContact CB-CG 4.24Å; M87-P137 HydrophobicContact CE-CB 4Å; M87-P137 HydrophobicContact CE-CG 3.74Å; M87-P137 HydrophobicContact SD-CB 4.24Å; M87-T140 HydrophobicContact SD-CG2 4.07Å |
| 88 | N | 82.3 | Confident | 88 | Confident | 112 Ų | 112 | 44.8 Ų | 44.8 | 60% | 0.599 | 22% | 0.224 | S | C | * | . | H | α-helix | trans | -73.2 | -36.8 | 176.8 | -70.8 | -28.9 | 0 | 0 | 0 | 111.9 | S84 V85 M86 | S84-N88 VanDerWaalsContact O-CG 3.26Å; S84-N88 PolarHBondContact O-N 2.94Å; S84-N88 PolarHBondContact O-ND2 3.05Å; V85-N88 PolarHBondContact O-N 3.46Å; M86-N88 VanDerWaalsContact C-N 3.29Å; M86-N88 PolarHBondContact O-N 3.44Å |
| 89 | R | 84.2 | Confident | 88.2 | Confident | 180 Ų | 180 | 41.3 Ų | 41.3 | 68% | 0.679 | 21% | 0.209 | S | C | * | . | H | α-helix | trans | -81.9 | -45.1 | -178.1 | -172.3 | 174.9 | -174.9 | 178.7 | 1.4 | 113.5 | V85 M86 | V85-R89 WeakPolarHBondContact O-CB 3.05Å; V85-R89 PolarHBondContact O-N 3.23Å; M86-R89 PolarHBondContact O-N 3.08Å |
| 90 | F | 84.1 | Confident | 88.6 | Confident | 74 Ų | 74 | 39.9 Ų | 39.9 | 33% | 0.325 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -106.7 | -10 | -171.4 | -57 | -67.4 | 0 | 0 | 0 | 113.6 | V8 M86 F94 V95 | V8-F90 HydrophobicContact CG2-CD1 4.03Å; M86-F90 HydrophobicContact CB-CD2 4.32Å; M86-F90 WeakPolarHBondContact O-CB 3.19Å; M86-F90 PolarHBondContact O-N 3.1Å; F90-F94 HydrophobicContact CB-CD1 3.78Å; F90-F94 HydrophobicContact CB-CE1 4.4Å; F90-F94 HydrophobicContact CG-CD1 4.37Å; F90-V95 HydrophobicContact CB-CG2 4.21Å |
| 91 | G | 85.9 | Confident | 89.3 | Confident | 18 Ų | 18 | 43.2 Ų | 43.2 | 19% | 0.186 | 22% | 0.217 | C | C | . | . | trans | 89.5 | 158.5 | -178.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | M87 Q93 V95 | M87-G91 CarbonylContact O-C 3.45Å; M87-G91 WeakPolarHBondContact O-CA 3.48Å; M87-G91 PolarHBondContact O-N 2.96Å; G91-Q93 PolarHBondContact O-N 3.32Å; G91-V95 VanDerWaalsContact O-CG2 3.28Å; G91-V95 WeakPolarHBondContact O-CG2 3.27Å; G91-V95 PolarHBondContact O-N 3.26Å | ||
| 92 | F | 87.7 | Confident | 90 | Very high | 18 Ų | 18 | 44.4 Ų | 44.4 | 8% | 0.079 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -61.3 | -46.1 | -175.7 | -66.3 | -88.2 | 0 | 0 | 0 | 113.3 | M87 V95 V96 P137 T140 I141 | M87-F92 HydrophobicContact CB-CD1 4.33Å; M87-F92 HydrophobicContact CB-CE1 4.34Å; M87-F92 HydrophobicContact CG-CE1 4.23Å; M87-F92 HydrophobicContact SD-CD1 4.11Å; M87-F92 HydrophobicContact SD-CE1 3.4Å; M87-F92 WeakPolarHBondContact SD-CE1 3.48Å; M87-F92 HydrophobicContact SD-CZ 4Å; F92-V95 PolarHBondContact O-N 2.83Å; F92-V96 WeakPolarHBondContact O-CG2 3.39Å; F92-V96 PolarHBondContact O-N 3.45Å; F92-V96 VanDerWaalsContact O-N 3.14Å; F92-P137 HydrophobicContact CD1-CB 3.85Å; F92-P137 WeakPolarHBondContact CD1-O 3.44Å; F92-T140 HydrophobicContact CE1-CG2 3.82Å; F92-T140 HydrophobicContact CZ-CG2 4.11Å; F92-I141 HydrophobicContact CB-CD1 4.16Å; F92-I141 HydrophobicContact CD1-CB 3.93Å; F92-I141 HydrophobicContact CD2-CD1 4.45Å; F92-I141 HydrophobicContact CE1-CB 4.21Å; F92-I141 HydrophobicContact CG-CB 4.3Å; F92-I141 HydrophobicContact CG-CD1 4.15Å |
| 93 | Q | 91.3 | Very high | 90.5 | Very high | 7 Ų | 7 | 40.5 Ų | 40.5 | 3% | 0.033 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -60.7 | -52.5 | -174.1 | -61.3 | 179.9 | -60.6 | 0 | 0 | 112 | G91 V95 V96 M97 G199 V200 L202 | G91-Q93 PolarHBondContact O-N 3.32Å; Q93-V95 VanDerWaalsContact C-N 3.33Å; Q93-V95 PolarHBondContact O-N 3.36Å; Q93-V96 PolarHBondContact O-N 3.47Å; Q93-M97 WeakPolarHBondContact O-CB 3.24Å; Q93-M97 VanDerWaalsContact O-CG 3.25Å; Q93-M97 WeakPolarHBondContact O-CG 3.33Å; Q93-M97 PolarHBondContact O-N 3.26Å; Q93-G199 WeakPolarHBondContact CA-O 3.47Å; Q93-G199 WeakPolarHBondContact CB-O 3.41Å; Q93-G199 WeakPolarHBondContact CG-O 3.18Å; Q93-V200 PolarHBondContact NE2-O 3.03Å; Q93-L202 HydrophobicContact CG-CB 4.38Å; Q93-L202 WeakPolarHBondContact CG-O 3.37Å |
| 94 | F | 90.8 | Very high | 91 | Very high | 76 Ų | 76 | 41.1 Ų | 41.1 | 33% | 0.333 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -62.6 | -41.2 | -176 | -176.8 | -103.8 | 0 | 0 | 0 | 112.1 | V8 F90 M97 I98 | V8-F94 HydrophobicContact CG1-CB 4.17Å; V8-F94 HydrophobicContact CG1-CD2 3.95Å; V8-F94 HydrophobicContact CG1-CE2 4.46Å; V8-F94 HydrophobicContact CG1-CG 3.97Å; F90-F94 HydrophobicContact CB-CD1 3.78Å; F90-F94 HydrophobicContact CB-CE1 4.4Å; F90-F94 HydrophobicContact CG-CD1 4.37Å; F94-M97 PolarHBondContact O-N 2.99Å; F94-I98 HydrophobicContact CD1-CD1 3.78Å; F94-I98 HydrophobicContact CE1-CD1 3.19Å; F94-I98 HydrophobicContact CE1-CG1 4.23Å; F94-I98 HydrophobicContact CE2-CD1 4.21Å; F94-I98 HydrophobicContact CZ-CD1 3.45Å; F94-I98 VanDerWaalsContact CZ-CD1 3.45Å; F94-I98 HydrophobicContact CZ-CG1 4.26Å; F94-I98 WeakPolarHBondContact O-CG1 3.48Å; F94-I98 PolarHBondContact O-N 3.31Å |
| 95 | V | 93.4 | Very high | 91.7 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -66.9 | -43.2 | -179.4 | 178.4 | 0 | 0 | 0 | 0 | 111.5 | M86 F90 G91 F92 Q93 I98 G99 L133 P137 | M86-V95 HydrophobicContact CB-CG1 4.19Å; M86-V95 HydrophobicContact CB-CG2 3.87Å; M86-V95 WeakPolarHBondContact O-CG2 3.32Å; F90-V95 HydrophobicContact CB-CG2 4.21Å; G91-V95 VanDerWaalsContact O-CG2 3.28Å; G91-V95 WeakPolarHBondContact O-CG2 3.27Å; G91-V95 PolarHBondContact O-N 3.26Å; F92-V95 PolarHBondContact O-N 2.83Å; Q93-V95 VanDerWaalsContact C-N 3.33Å; Q93-V95 PolarHBondContact O-N 3.36Å; V95-I98 PolarHBondContact O-N 3Å; V95-G99 PolarHBondContact O-N 2.8Å; V95-L133 HydrophobicContact CG1-CB 4.09Å; V95-L133 HydrophobicContact CG1-CD2 3.98Å; V95-P137 HydrophobicContact CG1-CG 3.9Å |
| 96 | V | 95.2 | Very high | 92.3 | Very high | 0 Ų | 0 | 40.4 Ų | 40.4 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -67.6 | -36.6 | 176.7 | 176.7 | 0 | 0 | 0 | 0 | 111.5 | F92 Q93 G99 G100 T134 P137 I195 L202 | F92-V96 WeakPolarHBondContact O-CG2 3.39Å; F92-V96 PolarHBondContact O-N 3.45Å; F92-V96 VanDerWaalsContact O-N 3.14Å; Q93-V96 PolarHBondContact O-N 3.47Å; V96-G99 PolarHBondContact O-N 3.14Å; V96-G100 PolarHBondContact O-N 2.96Å; V96-T134 HydrophobicContact CG1-CG2 4.13Å; V96-T134 WeakPolarHBondContact O-CG2 3.4Å; V96-P137 HydrophobicContact CG2-CB 3.71Å; V96-P137 HydrophobicContact CG2-CG 4.1Å; V96-I195 HydrophobicContact CG1-CG2 4.25Å; V96-L202 HydrophobicContact CB-CD1 3.98Å; V96-L202 HydrophobicContact CG1-CD1 4.03Å; V96-L202 HydrophobicContact CG2-CD1 3.56Å |
| 97 | M | 95.8 | Very high | 92.9 | Very high | 33 Ų | 33 | 38.5 Ų | 38.5 | 16% | 0.163 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -63.6 | -45.3 | 174.7 | -72.5 | 172.4 | 63.8 | 0 | 0 | 112.4 | F11 Q93 F94 G99 G100 L101 I196 V200 | F11-M97 HydrophobicContact CD2-SD 4.05Å; F11-M97 HydrophobicContact CE2-CE 3.86Å; F11-M97 HydrophobicContact CE2-SD 3.92Å; F11-M97 HydrophobicContact CZ-CE 4.17Å; Q93-M97 WeakPolarHBondContact O-CB 3.24Å; Q93-M97 VanDerWaalsContact O-CG 3.25Å; Q93-M97 WeakPolarHBondContact O-CG 3.33Å; Q93-M97 PolarHBondContact O-N 3.26Å; F94-M97 PolarHBondContact O-N 2.99Å; M97-G99 VanDerWaalsContact C-N 3.32Å; M97-G99 PolarHBondContact O-N 3.1Å; M97-G100 PolarHBondContact O-N 3.39Å; M97-L101 WeakPolarHBondContact O-CG 3.47Å; M97-L101 PolarHBondContact O-N 3.43Å; M97-I196 HydrophobicContact CB-CG2 4.45Å; M97-I196 HydrophobicContact CE-CG2 4.42Å; M97-I196 HydrophobicContact CG-CG2 4.25Å; M97-V200 HydrophobicContact CE-CG2 4.3Å; M97-V200 HydrophobicContact CG-CG2 4.38Å; M97-V200 HydrophobicContact SD-CG2 3.82Å |
| 98 | I | 96.6 | Very high | 93.5 | Very high | 50 Ų | 50 | 40.9 Ų | 40.9 | 26% | 0.256 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -59.8 | -45.8 | 173.8 | -74.3 | 179.6 | 0 | 0 | 0 | 110.4 | F94 V95 G100 L101 L102 L133 | F94-I98 HydrophobicContact CD1-CD1 3.78Å; F94-I98 HydrophobicContact CE1-CD1 3.19Å; F94-I98 HydrophobicContact CE1-CG1 4.23Å; F94-I98 HydrophobicContact CE2-CD1 4.21Å; F94-I98 HydrophobicContact CZ-CD1 3.45Å; F94-I98 VanDerWaalsContact CZ-CD1 3.45Å; F94-I98 HydrophobicContact CZ-CG1 4.26Å; F94-I98 WeakPolarHBondContact O-CG1 3.48Å; F94-I98 PolarHBondContact O-N 3.31Å; V95-I98 PolarHBondContact O-N 3Å; I98-G100 PolarHBondContact O-N 3Å; I98-L101 PolarHBondContact O-N 3.14Å; I98-L102 HydrophobicContact CG2-CD1 3.98Å; I98-L102 HydrophobicContact CG2-CG 4.4Å; I98-L102 WeakPolarHBondContact O-CG 3.49Å; I98-L102 PolarHBondContact O-N 3.17Å; I98-L133 HydrophobicContact CG2-CD1 4.13Å |
| 99 | G | 96.6 | Very high | 94.2 | Very high | 0 Ų | 0 | 37.4 Ų | 37.4 | 0% | 0 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -62.5 | -41.2 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | V95 V96 M97 L101 L102 I103 G130 | V95-G99 PolarHBondContact O-N 2.8Å; V96-G99 PolarHBondContact O-N 3.14Å; M97-G99 VanDerWaalsContact C-N 3.32Å; M97-G99 PolarHBondContact O-N 3.1Å; G99-L101 PolarHBondContact O-N 3.5Å; G99-L102 PolarHBondContact O-N 3.46Å; G99-I103 VanDerWaalsContact O-CG1 3.25Å; G99-I103 WeakPolarHBondContact O-CG1 3.39Å; G99-I103 PolarHBondContact O-N 3.34Å; G99-G130 WeakPolarHBondContact O-CA 3.49Å |
| 100 | G | 97.3 | Very high | 94.8 | Very high | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -62.4 | -39.5 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | V96 M97 I98 I103 S104 | V96-G100 PolarHBondContact O-N 2.96Å; M97-G100 PolarHBondContact O-N 3.39Å; I98-G100 PolarHBondContact O-N 3Å; G100-I103 PolarHBondContact O-N 2.92Å; G100-S104 WeakPolarHBondContact O-CB 3.03Å; G100-S104 PolarHBondContact O-N 2.62Å |
| 101 | L | 97.8 | Very high | 95.4 | Very high | 89 Ų | 89 | 25.8 Ų | 25.8 | 47% | 0.466 | 15% | 0.146 | S | C | . | . | H | α-helix | trans | -63.2 | -44.6 | 172.9 | -75.4 | 167.8 | 0 | 0 | 0 | 111.7 | M97 I98 G99 S104 T105 I196 | M97-L101 WeakPolarHBondContact O-CG 3.47Å; M97-L101 PolarHBondContact O-N 3.43Å; I98-L101 PolarHBondContact O-N 3.14Å; G99-L101 PolarHBondContact O-N 3.5Å; L101-S104 PolarHBondContact O-N 3.4Å; L101-T105 WeakPolarHBondContact O-CB 3.4Å; L101-T105 VanDerWaalsContact O-CG2 3.31Å; L101-T105 WeakPolarHBondContact O-CG2 3.44Å; L101-T105 PolarHBondContact O-N 3.45Å; L101-T105 PolarHBondContact O-OG1 3.2Å; L101-I196 HydrophobicContact CD2-CD1 3.48Å; L101-I196 VanDerWaalsContact CD2-CD1 3.48Å; L101-I196 HydrophobicContact CD2-CG1 4.44Å; L101-I196 HydrophobicContact CG-CD1 3.77Å; L101-I196 HydrophobicContact CG-CG1 4.21Å |
| 102 | L | 97.9 | Very high | 95.9 | Very high | 53 Ų | 53 | 32.2 Ų | 32.2 | 28% | 0.277 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -62.8 | -41.8 | 176.6 | -71.1 | 171.3 | 0 | 0 | 0 | 112.1 | I98 G99 T105 G106 V126 L133 | I98-L102 HydrophobicContact CG2-CD1 3.98Å; I98-L102 HydrophobicContact CG2-CG 4.4Å; I98-L102 WeakPolarHBondContact O-CG 3.49Å; I98-L102 PolarHBondContact O-N 3.17Å; G99-L102 PolarHBondContact O-N 3.46Å; L102-T105 PolarHBondContact O-OG1 2.97Å; L102-G106 WeakPolarHBondContact O-CA 2.94Å; L102-G106 PolarHBondContact O-N 2.97Å; L102-V126 HydrophobicContact CB-CG1 4.46Å; L102-V126 HydrophobicContact CD2-CG1 4.15Å; L102-L133 HydrophobicContact CD1-CD1 4.02Å |
| 103 | I | 98.1 | Very high | 96.2 | Very high | 0 Ų | 0 | 31.6 Ų | 31.6 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -62 | -50.9 | 177 | -67.6 | 162.9 | 0 | 0 | 0 | 110.6 | T40 G99 G100 T107 T127 Y131 T134 Q192 I195 | T40-I103 HydrophobicContact CG2-CD1 4.08Å; G99-I103 VanDerWaalsContact O-CG1 3.25Å; G99-I103 WeakPolarHBondContact O-CG1 3.39Å; G99-I103 PolarHBondContact O-N 3.34Å; G100-I103 PolarHBondContact O-N 2.92Å; I103-T107 WeakPolarHBondContact O-CB 3.41Å; I103-T107 PolarHBondContact O-N 3.42Å; I103-T107 PolarHBondContact O-OG1 3.49Å; I103-T127 HydrophobicContact CB-CG2 4.3Å; I103-T127 HydrophobicContact CG1-CG2 4.34Å; I103-T127 HydrophobicContact CG2-CG2 3.98Å; I103-Y131 HydrophobicContact CB-CE1 4.46Å; I103-Y131 HydrophobicContact CD1-CD1 3.44Å; I103-Y131 VanDerWaalsContact CD1-CD1 3.44Å; I103-Y131 HydrophobicContact CD1-CE1 3.82Å; I103-Y131 HydrophobicContact CD1-CG 4.46Å; I103-Y131 HydrophobicContact CG1-CD1 3.63Å; I103-Y131 HydrophobicContact CG1-CE1 3.82Å; I103-Y131 HydrophobicContact CG1-CG 4.44Å; I103-Y131 HydrophobicContact CG2-CD1 4.41Å; I103-Y131 HydrophobicContact CG2-CE1 3.73Å; I103-T134 HydrophobicContact CD1-CG2 3.84Å; I103-Q192 HydrophobicContact CG2-CB 3.75Å; I103-Q192 HydrophobicContact CG2-CG 3.99Å; I103-I195 HydrophobicContact CD1-CD1 3.74Å; I103-I195 HydrophobicContact CG2-CD1 4.48Å |
| 104 | S | 97.7 | Very high | 96.3 | Very high | 13 Ų | 13 | 35.5 Ų | 35.5 | 9% | 0.091 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -64.1 | -48.4 | -176.9 | -176.7 | 0 | 0 | 0 | 0 | 111.1 | G100 L101 I108 G189 | G100-S104 WeakPolarHBondContact O-CB 3.03Å; G100-S104 PolarHBondContact O-N 2.62Å; L101-S104 PolarHBondContact O-N 3.4Å; S104-I108 WeakPolarHBondContact O-CB 3.38Å; S104-I108 WeakPolarHBondContact O-CD1 3.25Å; S104-I108 WeakPolarHBondContact O-CG1 3.29Å; S104-I108 PolarHBondContact O-N 2.83Å; S104-G189 WeakPolarHBondContact CA-O 3.43Å; S104-G189 VanDerWaalsContact CB-O 3.31Å; S104-G189 WeakPolarHBondContact CB-O 3.15Å; S104-G189 PolarHBondContact OG-O 3.35Å |
| 105 | T | 97.7 | Very high | 96.5 | Very high | 78 Ų | 78 | 33.7 Ų | 33.7 | 48% | 0.479 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -67.7 | -39.6 | 179.2 | 54.5 | 0 | 0 | 0 | 0 | 112.8 | L101 L102 A109 | L101-T105 WeakPolarHBondContact O-CB 3.4Å; L101-T105 VanDerWaalsContact O-CG2 3.31Å; L101-T105 WeakPolarHBondContact O-CG2 3.44Å; L101-T105 PolarHBondContact O-N 3.45Å; L101-T105 PolarHBondContact O-OG1 3.2Å; L102-T105 PolarHBondContact O-OG1 2.97Å; T105-A109 WeakPolarHBondContact O-CB 2.85Å; T105-A109 PolarHBondContact O-N 3.15Å |
| 106 | G | 97.7 | Very high | 96.5 | Very high | 2 Ų | 2 | 34 Ų | 34 | 2% | 0.021 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -64.5 | -43.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | L102 A109 T110 T127 | L102-G106 WeakPolarHBondContact O-CA 2.94Å; L102-G106 PolarHBondContact O-N 2.97Å; G106-A109 PolarHBondContact O-N 3.47Å; G106-T110 PolarHBondContact O-N 2.97Å; G106-T110 VanDerWaalsContact O-N 3.07Å; G106-T110 PolarHBondContact O-OG1 2.78Å; G106-T127 WeakPolarHBondContact CA-OG1 3.46Å |
| 107 | T | 97.3 | Very high | 96.5 | Very high | 0 Ų | 0 | 38.4 Ų | 38.4 | 0% | 0 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -71.2 | -40.4 | 178.8 | -52 | 0 | 0 | 0 | 0 | 111.8 | I103 T110 Y123 T127 M185 I188 Q192 | I103-T107 WeakPolarHBondContact O-CB 3.41Å; I103-T107 PolarHBondContact O-N 3.42Å; I103-T107 PolarHBondContact O-OG1 3.49Å; T107-T110 VanDerWaalsContact O-CB 3.25Å; T107-T110 WeakPolarHBondContact O-CB 3.36Å; T107-T110 PolarHBondContact O-N 3.35Å; T107-Y123 HydrophobicContact CG2-CE2 4.3Å; T107-T127 PolarHBondContact N-OG1 3.26Å; T107-M185 WeakPolarHBondContact CG2-O 3.29Å; T107-M185 HydrophobicContact CG2-SD 4.38Å; T107-I188 HydrophobicContact CG2-CB 4.44Å; T107-I188 HydrophobicContact CG2-CG2 4.17Å; T107-Q192 PolarHBondContact OG1-OE1 3.38Å |
| 108 | I | 97.8 | Very high | 96.6 | Very high | 55 Ų | 55 | 41 Ų | 41 | 28% | 0.282 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -65.1 | -43 | 172.5 | -68 | 166.8 | 0 | 0 | 0 | 110.6 | S104 T110 S111 F112 | S104-I108 WeakPolarHBondContact O-CB 3.38Å; S104-I108 WeakPolarHBondContact O-CD1 3.25Å; S104-I108 WeakPolarHBondContact O-CG1 3.29Å; S104-I108 PolarHBondContact O-N 2.83Å; I108-T110 PolarHBondContact O-N 3.36Å; I108-S111 PolarHBondContact O-N 3.33Å; I108-S111 VanDerWaalsContact O-N 3.07Å; I108-S111 PolarHBondContact O-OG 3.27Å; I108-F112 HydrophobicContact CG2-CE2 3.91Å; I108-F112 VanDerWaalsContact O-CD2 3.31Å; I108-F112 WeakPolarHBondContact O-CD2 3.35Å |
| 109 | A | 97.4 | Very high | 96.6 | Very high | 39 Ų | 39 | 38.6 Ų | 38.6 | 32% | 0.322 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -59.5 | -32 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112 | T105 G106 S111 F112 T113 T122 | T105-A109 WeakPolarHBondContact O-CB 2.85Å; T105-A109 PolarHBondContact O-N 3.15Å; G106-A109 PolarHBondContact O-N 3.47Å; A109-S111 PolarHBondContact O-N 3.44Å; A109-F112 PolarHBondContact O-N 3.47Å; A109-F112 VanDerWaalsContact O-N 3.12Å; A109-T113 WeakPolarHBondContact O-CG2 3.24Å; A109-T122 HydrophobicContact CB-CG2 3.76Å |
| 110 | T | 97.1 | Very high | 96.6 | Very high | 0 Ų | 0 | 40.4 Ų | 40.4 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -57.3 | -35 | 176.5 | -56.2 | 0 | 0 | 0 | 0 | 112 | G106 T107 I108 F112 T113 I119 T122 | G106-T110 PolarHBondContact O-N 2.97Å; G106-T110 VanDerWaalsContact O-N 3.07Å; G106-T110 PolarHBondContact O-OG1 2.78Å; T107-T110 VanDerWaalsContact O-CB 3.25Å; T107-T110 WeakPolarHBondContact O-CB 3.36Å; T107-T110 PolarHBondContact O-N 3.35Å; I108-T110 PolarHBondContact O-N 3.36Å; T110-F112 PolarHBondContact O-N 2.99Å; T110-T113 PolarHBondContact O-N 3.21Å; T110-T113 PolarHBondContact O-OG1 3.27Å; T110-I119 HydrophobicContact CG2-CG1 4.25Å; T110-I119 HydrophobicContact CG2-CG2 3.99Å; T110-T122 PolarHBondContact OG1-OG1 3.27Å |
| 111 | S | 96.5 | Very high | 96.7 | Very high | 10 Ų | 10 | 45.2 Ų | 45.2 | 7% | 0.07 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -65.3 | -23.2 | 179.8 | 70.2 | 0 | 0 | 0 | 0 | 114.2 | I108 A109 R182 | I108-S111 PolarHBondContact O-N 3.33Å; I108-S111 VanDerWaalsContact O-N 3.07Å; I108-S111 PolarHBondContact O-OG 3.27Å; A109-S111 PolarHBondContact O-N 3.44Å; S111-R182 WeakPolarHBondContact CB-O 3.44Å; S111-R182 PolarHBondContact O-NH1 3.34Å |
| 112 | F | 95.4 | Very high | 96.7 | Very high | 154 Ų | 154 | 42.1 Ų | 42.1 | 68% | 0.675 | 23% | 0.232 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -97.7 | 0.9 | -178.2 | -59.1 | -77.4 | 0 | 0 | 0 | 113.3 | I108 A109 T110 | I108-F112 HydrophobicContact CG2-CE2 3.91Å; I108-F112 VanDerWaalsContact O-CD2 3.31Å; I108-F112 WeakPolarHBondContact O-CD2 3.35Å; A109-F112 PolarHBondContact O-N 3.47Å; A109-F112 VanDerWaalsContact O-N 3.12Å; T110-F112 PolarHBondContact O-N 2.99Å |
| 113 | T | 95.9 | Very high | 96.6 | Very high | 5 Ų | 5 | 39.6 Ų | 39.6 | 3% | 0.031 | 22% | 0.219 | C | C | . | . | trans | -73.8 | 150.4 | -177.5 | 60.4 | 0 | 0 | 0 | 0 | 112.2 | A109 T110 Q118 I119 T122 R182 | A109-T113 WeakPolarHBondContact O-CG2 3.24Å; T110-T113 PolarHBondContact O-N 3.21Å; T110-T113 PolarHBondContact O-OG1 3.27Å; T113-Q118 HydrophobicContact CG2-CB 3.69Å; T113-I119 HydrophobicContact CG2-CG1 4.17Å; T113-I119 WeakPolarHBondContact OG1-CG1 3.31Å; T113-T122 HydrophobicContact CG2-CG2 4.22Å; T113-R182 PolarHBondContact O-NH1 3.29Å; T113-R182 PolarHBondContact O-NH2 3.22Å | ||
| 114 | S | 93.3 | Very high | 96.5 | Very high | 88 Ų | 88 | 39.6 Ų | 39.6 | 62% | 0.615 | 22% | 0.219 | S | C | * | . | S | Bend | trans | -120.3 | 4.3 | 178.6 | -54.5 | 0 | 0 | 0 | 0 | 113 | ||
| 115 | S | 94.3 | Very high | 96.4 | Very high | 39 Ų | 39 | 42.5 Ų | 42.5 | 27% | 0.273 | 23% | 0.233 | S | C | . | . | S | Bend | trans | -152.3 | 152.2 | 175.8 | 62 | 0 | 0 | 0 | 0 | 111.7 | N117 Q118 I119 | S115-N117 PolarHBondContact O-N 3.33Å; S115-Q118 WeakPolarHBondContact O-CB 3.32Å; S115-Q118 PolarHBondContact O-N 3.45Å; S115-Q118 WeakPolarHBondContact OG-CG 3.13Å; S115-I119 PolarHBondContact O-N 3.27Å |
| 116 | L | 93.9 | Very high | 96.4 | Very high | 5 Ų | 5 | 40.8 Ų | 40.8 | 3% | 0.026 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -57 | -35.4 | 176 | -73.9 | -172.5 | 0 | 0 | 0 | 113.3 | F58 E60 R64 V65 I68 Q118 I119 Y120 | F58-L116 HydrophobicContact CB-CD2 4.32Å; F58-L116 HydrophobicContact CB-CG 4.01Å; F58-L116 HydrophobicContact CD2-CD2 3.51Å; F58-L116 HydrophobicContact CD2-CG 4.04Å; F58-L116 HydrophobicContact CE2-CD2 4.06Å; F58-L116 HydrophobicContact CG-CD2 3.99Å; F58-L116 HydrophobicContact CG-CG 3.99Å; E60-L116 HydrophobicContact CB-CD1 3.45Å; E60-L116 VanDerWaalsContact CB-CD1 3.45Å; E60-L116 HydrophobicContact CG-CD1 3.45Å; E60-L116 VanDerWaalsContact CG-CD1 3.45Å; E60-L116 HydrophobicContact CG-CG 4.2Å; R64-L116 HydrophobicContact CB-CD1 4.14Å; V65-L116 HydrophobicContact CG2-CD1 4.17Å; V65-L116 HydrophobicContact CG2-CD2 4.3Å; I68-L116 HydrophobicContact CD1-CD2 4.17Å; L116-Q118 PolarHBondContact O-N 2.82Å; L116-I119 HydrophobicContact CD2-CD1 4.3Å; L116-I119 WeakPolarHBondContact O-CA 3.12Å; L116-I119 WeakPolarHBondContact O-CB 3.49Å; L116-I119 PolarHBondContact O-N 2.88Å; L116-Y120 PolarHBondContact O-N 3.24Å |
| 117 | N | 95.2 | Very high | 96.4 | Very high | 93 Ų | 93 | 40.7 Ų | 40.7 | 50% | 0.497 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -62.2 | -34.8 | 178.7 | -65.7 | -26.5 | 0 | 0 | 0 | 111.9 | S115 I119 Y120 I121 | S115-N117 PolarHBondContact O-N 3.33Å; N117-I119 VanDerWaalsContact C-N 3.35Å; N117-Y120 PolarHBondContact O-N 2.94Å; N117-I121 WeakPolarHBondContact O-CG1 3.46Å; N117-I121 PolarHBondContact O-N 3.19Å |
| 118 | Q | 96.8 | Very high | 96.4 | Very high | 88 Ų | 88 | 40.7 Ų | 40.7 | 41% | 0.411 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -70.2 | -33.2 | 173.5 | -68.2 | 171.3 | 0.6 | 0 | 0 | 111.6 | T113 S115 L116 I121 T122 | T113-Q118 HydrophobicContact CG2-CB 3.69Å; S115-Q118 WeakPolarHBondContact O-CB 3.32Å; S115-Q118 PolarHBondContact O-N 3.45Å; S115-Q118 WeakPolarHBondContact OG-CG 3.13Å; L116-Q118 PolarHBondContact O-N 2.82Å; Q118-I121 PolarHBondContact O-N 3.11Å; Q118-T122 WeakPolarHBondContact O-CB 3.11Å; Q118-T122 WeakPolarHBondContact O-CG2 3.37Å; Q118-T122 PolarHBondContact O-N 2.67Å; Q118-T122 PolarHBondContact O-OG1 3.07Å |
| 119 | I | 97.1 | Very high | 96.3 | Very high | 0 Ų | 0 | 40.5 Ų | 40.5 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -68.6 | -37 | 175.6 | -57.9 | -179.6 | 0 | 0 | 0 | 111.3 | F58 I68 T110 T113 S115 L116 N117 I121 T122 Y123 G124 W181 | F58-I119 HydrophobicContact CE2-CD1 3.54Å; F58-I119 HydrophobicContact CZ-CD1 3.8Å; I68-I119 HydrophobicContact CD1-CB 4.3Å; I68-I119 HydrophobicContact CD1-CG2 3.59Å; I68-I119 HydrophobicContact CG1-CG2 3.84Å; I68-I119 HydrophobicContact CG2-CG2 3.87Å; T110-I119 HydrophobicContact CG2-CG1 4.25Å; T110-I119 HydrophobicContact CG2-CG2 3.99Å; T113-I119 HydrophobicContact CG2-CG1 4.17Å; T113-I119 WeakPolarHBondContact OG1-CG1 3.31Å; S115-I119 PolarHBondContact O-N 3.27Å; L116-I119 HydrophobicContact CD2-CD1 4.3Å; L116-I119 WeakPolarHBondContact O-CA 3.12Å; L116-I119 WeakPolarHBondContact O-CB 3.49Å; L116-I119 PolarHBondContact O-N 2.88Å; N117-I119 VanDerWaalsContact C-N 3.35Å; I119-I121 PolarHBondContact O-N 3.39Å; I119-T122 WeakPolarHBondContact CA-OG1 3.08Å; I119-T122 PolarHBondContact O-N 3.43Å; I119-Y123 WeakPolarHBondContact O-CA 3.23Å; I119-Y123 WeakPolarHBondContact O-CB 3.19Å; I119-Y123 PolarHBondContact O-N 3.21Å; I119-G124 PolarHBondContact O-N 2.96Å; I119-G124 VanDerWaalsContact O-N 3.16Å; I119-W181 HydrophobicContact CD1-CH2 4.23Å |
| 120 | Y | 97.4 | Very high | 96.3 | Very high | 38 Ų | 38 | 38.6 Ų | 38.6 | 15% | 0.149 | 21% | 0.205 | C | C | . | . | I | π-helix | trans | -58.8 | -36 | 172.5 | -61.1 | -22.8 | 0 | 0 | 0 | 112.4 | R64 W67 I68 I71 L116 N117 G124 L125 | R64-Y120 PolarHBondContact O-OH 3.47Å; W67-Y120 HydrophobicContact CB-CE1 3.74Å; I68-Y120 HydrophobicContact CG1-CD1 3.71Å; I68-Y120 HydrophobicContact CG1-CE1 3.68Å; I71-Y120 HydrophobicContact CD1-CD1 4.02Å; I71-Y120 HydrophobicContact CD1-CD2 4.37Å; I71-Y120 HydrophobicContact CD1-CG 3.87Å; L116-Y120 PolarHBondContact O-N 3.24Å; N117-Y120 PolarHBondContact O-N 2.94Å; Y120-G124 CarbonylContact O-C 3.34Å; Y120-G124 WeakPolarHBondContact O-CA 3.3Å; Y120-G124 PolarHBondContact O-N 2.92Å; Y120-L125 PolarHBondContact O-N 2.93Å |
| 121 | I | 97.8 | Very high | 96.2 | Very high | 101 Ų | 101 | 38.6 Ų | 38.6 | 52% | 0.518 | 21% | 0.205 | S | C | . | . | I | π-helix | trans | -77.1 | -50.2 | 178.5 | -61.8 | 169.9 | 0 | 0 | 0 | 110.6 | N117 Q118 I119 L125 V126 | N117-I121 WeakPolarHBondContact O-CG1 3.46Å; N117-I121 PolarHBondContact O-N 3.19Å; Q118-I121 PolarHBondContact O-N 3.11Å; I119-I121 PolarHBondContact O-N 3.39Å; I121-L125 WeakPolarHBondContact O-CB 3.37Å; I121-L125 PolarHBondContact O-N 3.28Å; I121-V126 WeakPolarHBondContact O-CG2 3.34Å; I121-V126 PolarHBondContact O-N 2.83Å |
| 122 | T | 97.6 | Very high | 96 | Very high | 23 Ų | 23 | 38.2 Ų | 38.2 | 14% | 0.141 | 20% | 0.203 | C | C | . | . | I | π-helix | trans | -73.9 | -55.9 | -174.2 | 50.2 | 0 | 0 | 0 | 0 | 112.5 | A109 T110 T113 Q118 I119 V126 T127 | A109-T122 HydrophobicContact CB-CG2 3.76Å; T110-T122 PolarHBondContact OG1-OG1 3.27Å; T113-T122 HydrophobicContact CG2-CG2 4.22Å; Q118-T122 WeakPolarHBondContact O-CB 3.11Å; Q118-T122 WeakPolarHBondContact O-CG2 3.37Å; Q118-T122 PolarHBondContact O-N 2.67Å; Q118-T122 PolarHBondContact O-OG1 3.07Å; I119-T122 WeakPolarHBondContact CA-OG1 3.08Å; I119-T122 PolarHBondContact O-N 3.43Å; T122-V126 WeakPolarHBondContact O-CB 3.35Å; T122-T127 PolarHBondContact O-N 3.05Å; T122-T127 VanDerWaalsContact O-N 3.13Å; T122-T127 PolarHBondContact O-OG1 3.13Å |
| 123 | Y | 96.4 | Very high | 96 | Very high | 1 Ų | 1 | 31.5 Ų | 31.5 | 0% | 0.004 | 17% | 0.174 | C | C | . | . | I | π-helix | trans | -83.1 | -44.8 | 179.8 | -162.1 | -89.9 | 0 | 0 | 0 | 112.3 | F47 I68 I69 T107 I119 T127 | F47-Y123 AromaticContact CD2-CE1 3.91Å; F47-Y123 HydrophobicContact CD2-CE1 3.91Å; F47-Y123 AromaticContact CD2-CZ 3.87Å; F47-Y123 HydrophobicContact CE2-CD1 4.25Å; F47-Y123 AromaticContact CE2-CE1 3.89Å; F47-Y123 HydrophobicContact CE2-CE1 3.89Å; I68-Y123 HydrophobicContact CG2-CD1 3.43Å; I68-Y123 VanDerWaalsContact CG2-CD1 3.43Å; I68-Y123 HydrophobicContact CG2-CE1 4.23Å; I68-Y123 HydrophobicContact CG2-CG 4.05Å; I69-Y123 HydrophobicContact CD1-CE1 4.42Å; T107-Y123 HydrophobicContact CG2-CE2 4.3Å; I119-Y123 WeakPolarHBondContact O-CA 3.23Å; I119-Y123 WeakPolarHBondContact O-CB 3.19Å; I119-Y123 PolarHBondContact O-N 3.21Å; Y123-T127 VanDerWaalsContact O-CB 3.23Å; Y123-T127 WeakPolarHBondContact O-CB 3.33Å |
| 124 | G | 95.7 | Very high | 95.9 | Very high | 0 Ų | 0 | 31.3 Ų | 31.3 | 0% | 0 | 17% | 0.172 | C | C | . | . | I | π-helix | trans | -66.1 | -64.9 | -178.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | C72 I119 Y120 G128 | C72-G124 WeakPolarHBondContact CA-O 3.47Å; I119-G124 PolarHBondContact O-N 2.96Å; I119-G124 VanDerWaalsContact O-N 3.16Å; Y120-G124 CarbonylContact O-C 3.34Å; Y120-G124 WeakPolarHBondContact O-CA 3.3Å; Y120-G124 PolarHBondContact O-N 2.92Å; G124-G128 WeakPolarHBondContact O-CA 3.36Å; G124-G128 PolarHBondContact O-N 2.9Å |
| 125 | L | 96.9 | Very high | 95.7 | Very high | 73 Ų | 73 | 29.3 Ų | 29.3 | 38% | 0.382 | 15% | 0.153 | S | C | . | . | I | π-helix | trans | -79.2 | -55.8 | -172.6 | -175.6 | 66.3 | 0 | 0 | 0 | 113.1 | I75 Y120 I121 L129 | I75-L125 HydrophobicContact CD1-CD1 3.61Å; I75-L125 HydrophobicContact CG1-CD1 3.89Å; I75-L125 HydrophobicContact CG2-CD1 4.31Å; Y120-L125 PolarHBondContact O-N 2.93Å; I121-L125 WeakPolarHBondContact O-CB 3.37Å; I121-L125 PolarHBondContact O-N 3.28Å; L125-L129 HydrophobicContact CD1-CD1 4.29Å; L125-L129 HydrophobicContact CD1-CG 4.48Å; L125-L129 HydrophobicContact CG-CD1 4.36Å; L125-L129 WeakPolarHBondContact O-CB 3.43Å; L125-L129 VanDerWaalsContact O-CG 3.3Å; L125-L129 WeakPolarHBondContact O-CG 3.39Å; L125-L129 PolarHBondContact O-N 3.24Å |
| 126 | V | 97.8 | Very high | 95.3 | Very high | 43 Ų | 43 | 29.2 Ų | 29.2 | 26% | 0.261 | 15% | 0.149 | S | C | . | . | I | π-helix | trans | -67.3 | -50.9 | -173.2 | 172 | 0 | 0 | 0 | 0 | 111.2 | L102 I121 T122 L129 G130 | L102-V126 HydrophobicContact CB-CG1 4.46Å; L102-V126 HydrophobicContact CD2-CG1 4.15Å; I121-V126 WeakPolarHBondContact O-CG2 3.34Å; I121-V126 PolarHBondContact O-N 2.83Å; T122-V126 WeakPolarHBondContact O-CB 3.35Å; V126-L129 PolarHBondContact O-N 3.16Å; V126-G130 PolarHBondContact O-N 3.05Å; V126-G130 VanDerWaalsContact O-N 3.09Å |
| 127 | T | 97.4 | Very high | 95.1 | Very high | 0 Ų | 0 | 29 Ų | 29 | 0% | 0 | 15% | 0.148 | C | C | . | . | I | π-helix | trans | -67.7 | -39 | 178.8 | -47.4 | 0 | 0 | 0 | 0 | 111.1 | I103 G106 T107 T122 Y123 L129 G130 Y131 | I103-T127 HydrophobicContact CB-CG2 4.3Å; I103-T127 HydrophobicContact CG1-CG2 4.34Å; I103-T127 HydrophobicContact CG2-CG2 3.98Å; G106-T127 WeakPolarHBondContact CA-OG1 3.46Å; T107-T127 PolarHBondContact N-OG1 3.26Å; T122-T127 PolarHBondContact O-N 3.05Å; T122-T127 VanDerWaalsContact O-N 3.13Å; T122-T127 PolarHBondContact O-OG1 3.13Å; Y123-T127 VanDerWaalsContact O-CB 3.23Å; Y123-T127 WeakPolarHBondContact O-CB 3.33Å; T127-L129 PolarHBondContact O-N 2.92Å; T127-G130 CarbonylContact O-C 3.55Å; T127-G130 WeakPolarHBondContact O-CA 3.46Å; T127-G130 PolarHBondContact O-N 2.76Å; T127-G130 VanDerWaalsContact O-N 3.13Å; T127-Y131 HydrophobicContact CG2-CD2 4.26Å; T127-Y131 HydrophobicContact CG2-CE1 4.01Å; T127-Y131 HydrophobicContact CG2-CE2 3.62Å; T127-Y131 VanDerWaalsContact CG2-CZ 3.48Å; T127-Y131 WeakPolarHBondContact O-CD2 3.47Å; T127-Y131 PolarHBondContact O-N 3.44Å |
| 128 | G | 96.1 | Very high | 94.8 | Very high | 0 Ų | 0 | 24.6 Ų | 24.6 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -59.8 | -41.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | M76 G124 G130 Y131 C132 | M76-G128 WeakPolarHBondContact CA-O 3.49Å; G124-G128 WeakPolarHBondContact O-CA 3.36Å; G124-G128 PolarHBondContact O-N 2.9Å; G128-G130 VanDerWaalsContact C-N 3.33Å; G128-Y131 PolarHBondContact O-N 3.05Å; G128-C132 PolarHBondContact O-N 3.44Å; G128-C132 VanDerWaalsContact O-N 3.14Å |
| 129 | L | 96.6 | Very high | 94.2 | Very high | 50 Ų | 50 | 21.9 Ų | 21.9 | 26% | 0.262 | 11% | 0.114 | S | C | . | . | H | α-helix | trans | -63 | -42.4 | 173.5 | -77.8 | 173.1 | 0 | 0 | 0 | 110.8 | I75 N79 L125 V126 T127 Y131 C132 L133 | I75-L129 HydrophobicContact CG2-CB 4.24Å; I75-L129 HydrophobicContact CG2-CD2 3.69Å; I75-L129 HydrophobicContact CG2-CG 3.58Å; I75-L129 VanDerWaalsContact CG2-N 3.32Å; N79-L129 HydrophobicContact CB-CD2 4.27Å; L125-L129 HydrophobicContact CD1-CD1 4.29Å; L125-L129 HydrophobicContact CD1-CG 4.48Å; L125-L129 HydrophobicContact CG-CD1 4.36Å; L125-L129 WeakPolarHBondContact O-CB 3.43Å; L125-L129 VanDerWaalsContact O-CG 3.3Å; L125-L129 WeakPolarHBondContact O-CG 3.39Å; L125-L129 PolarHBondContact O-N 3.24Å; V126-L129 PolarHBondContact O-N 3.16Å; T127-L129 PolarHBondContact O-N 2.92Å; L129-Y131 PolarHBondContact O-N 3.47Å; L129-C132 WeakPolarHBondContact O-CB 3.34Å; L129-C132 PolarHBondContact O-N 3.47Å; L129-L133 WeakPolarHBondContact O-CG 3.43Å; L129-L133 PolarHBondContact O-N 3.24Å; L129-L133 VanDerWaalsContact O-N 3.08Å |
| 130 | G | 96.8 | Very high | 93.6 | Very high | 0 Ų | 0 | 23.7 Ų | 23.7 | 0% | 0 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -61 | -40.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | G99 V126 T127 G128 C132 L133 T134 | G99-G130 WeakPolarHBondContact O-CA 3.49Å; V126-G130 PolarHBondContact O-N 3.05Å; V126-G130 VanDerWaalsContact O-N 3.09Å; T127-G130 CarbonylContact O-C 3.55Å; T127-G130 WeakPolarHBondContact O-CA 3.46Å; T127-G130 PolarHBondContact O-N 2.76Å; T127-G130 VanDerWaalsContact O-N 3.13Å; G128-G130 VanDerWaalsContact C-N 3.33Å; G130-C132 PolarHBondContact O-N 3.38Å; G130-L133 PolarHBondContact O-N 2.95Å; G130-T134 WeakPolarHBondContact O-CG2 3.29Å; G130-T134 PolarHBondContact O-N 3.43Å; G130-T134 VanDerWaalsContact O-N 3.12Å; G130-T134 PolarHBondContact O-OG1 3.25Å |
| 131 | Y | 95.4 | Very high | 93 | Very high | 0 Ų | 0 | 21.9 Ų | 21.9 | 0% | 0 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -60.6 | -42.5 | 173.6 | -67.2 | -34.6 | 0 | 0 | 0 | 112.2 | T40 I44 C72 I103 T127 G128 L129 L133 T134 F135 Q192 | T40-Y131 HydrophobicContact CG2-CD1 3.39Å; T40-Y131 HydrophobicContact CG2-CE1 3.71Å; T40-Y131 HydrophobicContact CG2-CG 4.46Å; I44-Y131 HydrophobicContact CD1-CD2 3.72Å; I44-Y131 HydrophobicContact CD1-CE2 3.68Å; I44-Y131 HydrophobicContact CD1-CG 4.46Å; I44-Y131 HydrophobicContact CG1-CD2 4.25Å; I44-Y131 HydrophobicContact CG1-CE2 3.67Å; C72-Y131 VanDerWaalsContact SG-CD2 3.59Å; C72-Y131 VanDerWaalsContact SG-CE2 3.51Å; I103-Y131 HydrophobicContact CB-CE1 4.46Å; I103-Y131 HydrophobicContact CD1-CD1 3.44Å; I103-Y131 VanDerWaalsContact CD1-CD1 3.44Å; I103-Y131 HydrophobicContact CD1-CE1 3.82Å; I103-Y131 HydrophobicContact CD1-CG 4.46Å; I103-Y131 HydrophobicContact CG1-CD1 3.63Å; I103-Y131 HydrophobicContact CG1-CE1 3.82Å; I103-Y131 HydrophobicContact CG1-CG 4.44Å; I103-Y131 HydrophobicContact CG2-CD1 4.41Å; I103-Y131 HydrophobicContact CG2-CE1 3.73Å; T127-Y131 HydrophobicContact CG2-CD2 4.26Å; T127-Y131 HydrophobicContact CG2-CE1 4.01Å; T127-Y131 HydrophobicContact CG2-CE2 3.62Å; T127-Y131 VanDerWaalsContact CG2-CZ 3.48Å; T127-Y131 WeakPolarHBondContact O-CD2 3.47Å; T127-Y131 PolarHBondContact O-N 3.44Å; G128-Y131 PolarHBondContact O-N 3.05Å; L129-Y131 PolarHBondContact O-N 3.47Å; Y131-L133 PolarHBondContact O-N 3.43Å; Y131-T134 WeakPolarHBondContact CA-OG1 3.29Å; Y131-T134 PolarHBondContact O-N 3.24Å; Y131-T134 PolarHBondContact O-OG1 3.34Å; Y131-F135 WeakPolarHBondContact O-CB 3.45Å; Y131-F135 PolarHBondContact O-N 3.45Å; Y131-Q192 PolarHBondContact OH-NE2 2.97Å |
| 132 | C | 93.3 | Very high | 92.5 | Very high | 2 Ų | 2 | 17.1 Ų | 17.1 | 1% | 0.014 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -61.5 | -44 | 175.3 | -177.6 | 0 | 0 | 0 | 0 | 113.1 | M76 N79 S83 G128 L129 G130 T134 | M76-C132 VanDerWaalsContact O-CB 3.29Å; M76-C132 WeakPolarHBondContact O-CB 3.35Å; M76-C132 PolarHBondContact O-SG 3.15Å; M76-C132 VanDerWaalsContact O-SG 3.41Å; N79-C132 HydrophobicContact CB-CB 4.31Å; N79-C132 PolarHBondContact O-SG 3.27Å; S83-C132 VanDerWaalsContact CB-SG 3.54Å; S83-C132 PolarHBondContact OG-O 3.1Å; G128-C132 PolarHBondContact O-N 3.44Å; G128-C132 VanDerWaalsContact O-N 3.14Å; L129-C132 WeakPolarHBondContact O-CB 3.34Å; L129-C132 PolarHBondContact O-N 3.47Å; G130-C132 PolarHBondContact O-N 3.38Å; C132-T134 PolarHBondContact O-N 3.45Å |
| 133 | L | 94.3 | Very high | 91.6 | Very high | 13 Ų | 13 | 17.2 Ų | 17.2 | 7% | 0.068 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -74.1 | -10.8 | -178.7 | -63.6 | -178.3 | 0 | 0 | 0 | 113.4 | M86 V95 I98 L102 L129 G130 Y131 P137 | M86-L133 HydrophobicContact CE-CD1 4.35Å; M86-L133 HydrophobicContact CE-CD2 4.35Å; M86-L133 HydrophobicContact SD-CD1 4.42Å; M86-L133 HydrophobicContact SD-CD2 3.61Å; V95-L133 HydrophobicContact CG1-CB 4.09Å; V95-L133 HydrophobicContact CG1-CD2 3.98Å; I98-L133 HydrophobicContact CG2-CD1 4.13Å; L102-L133 HydrophobicContact CD1-CD1 4.02Å; L129-L133 WeakPolarHBondContact O-CG 3.43Å; L129-L133 PolarHBondContact O-N 3.24Å; L129-L133 VanDerWaalsContact O-N 3.08Å; G130-L133 PolarHBondContact O-N 2.95Å; Y131-L133 PolarHBondContact O-N 3.43Å; L133-P137 WeakPolarHBondContact O-CD 3.22Å; L133-P137 VanDerWaalsContact O-CG 3.29Å; L133-P137 WeakPolarHBondContact O-CG 3.3Å |
| 134 | T | 94.6 | Very high | 91 | Very high | 0 Ų | 0 | 20.9 Ų | 20.9 | 0% | 0 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -104.2 | -48.5 | 178.4 | 48.2 | 0 | 0 | 0 | 0 | 111.8 | V96 I103 G130 Y131 C132 T138 I195 | V96-T134 HydrophobicContact CG1-CG2 4.13Å; V96-T134 WeakPolarHBondContact O-CG2 3.4Å; I103-T134 HydrophobicContact CD1-CG2 3.84Å; G130-T134 WeakPolarHBondContact O-CG2 3.29Å; G130-T134 PolarHBondContact O-N 3.43Å; G130-T134 VanDerWaalsContact O-N 3.12Å; G130-T134 PolarHBondContact O-OG1 3.25Å; Y131-T134 WeakPolarHBondContact CA-OG1 3.29Å; Y131-T134 PolarHBondContact O-N 3.24Å; Y131-T134 PolarHBondContact O-OG1 3.34Å; C132-T134 PolarHBondContact O-N 3.45Å; T134-T138 VanDerWaalsContact O-CB 3.29Å; T134-T138 WeakPolarHBondContact O-CB 3.45Å; T134-T138 PolarHBondContact O-N 3.19Å; T134-T138 PolarHBondContact O-OG1 2.94Å; T134-I195 HydrophobicContact CG2-CG2 3.53Å |
| 135 | F | 89 | Confident | 90.4 | Very high | 47 Ų | 47 | 20.9 Ų | 20.9 | 21% | 0.206 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -63.2 | -56.2 | -176.2 | 175.2 | -105.7 | 0 | 0 | 0 | 112.4 | F33 E37 Y41 Y131 T138 V139 | F33-F135 HydrophobicContact CE2-CD2 4.19Å; F33-F135 HydrophobicContact CE2-CE2 4.17Å; F33-F135 HydrophobicContact CZ-CE2 4.15Å; E37-F135 WeakPolarHBondContact OE1-CE2 3.29Å; Y41-F135 HydrophobicContact CD2-CD2 4.31Å; Y41-F135 HydrophobicContact CD2-CE2 4.4Å; Y41-F135 AromaticContact CE2-CD2 3.7Å; Y41-F135 HydrophobicContact CE2-CD2 3.7Å; Y41-F135 AromaticContact CE2-CE2 3.7Å; Y41-F135 HydrophobicContact CE2-CE2 3.7Å; Y41-F135 HydrophobicContact CE2-CG 4.15Å; Y41-F135 HydrophobicContact CE2-CZ 4.15Å; Y131-F135 WeakPolarHBondContact O-CB 3.45Å; Y131-F135 PolarHBondContact O-N 3.45Å; F135-T138 PolarHBondContact O-N 3.21Å; F135-V139 WeakPolarHBondContact O-CG1 3.47Å; F135-V139 PolarHBondContact O-N 3.41Å |
| 136 | L | 86 | Confident | 89.7 | Confident | 37 Ų | 37 | 17.5 Ų | 17.5 | 19% | 0.194 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -63.9 | -44.4 | -171.6 | -172.4 | 71.5 | 0 | 0 | 0 | 113.4 | S80 M87 T138 V139 T140 | S80-L136 WeakPolarHBondContact O-CD2 3.47Å; M87-L136 HydrophobicContact CE-CB 4.18Å; M87-L136 HydrophobicContact CE-CD2 3.74Å; M87-L136 HydrophobicContact CE-CG 3.64Å; L136-T138 VanDerWaalsContact C-N 3.31Å; L136-T138 PolarHBondContact O-N 3.37Å; L136-V139 HydrophobicContact CD1-CG1 4.39Å; L136-V139 VanDerWaalsContact O-CG1 3.26Å; L136-V139 WeakPolarHBondContact O-CG1 3.22Å; L136-T140 VanDerWaalsContact O-CB 3.29Å; L136-T140 WeakPolarHBondContact O-CB 3.03Å; L136-T140 PolarHBondContact O-N 2.94Å; L136-T140 VanDerWaalsContact O-N 3.09Å; L136-T140 PolarHBondContact O-OG1 2.81Å |
| 137 | P | 88.7 | Confident | 88.5 | Confident | 0 Ų | 0 | 19.2 Ų | 19.2 | 0% | 0 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -66.6 | -35.7 | 177.5 | -20.6 | 34.3 | 0 | 0 | 0 | 112 | S83 M87 F92 V95 V96 L133 T140 I141 | S83-P137 WeakPolarHBondContact OG-CD 3.44Å; M87-P137 HydrophobicContact CB-CB 4.2Å; M87-P137 HydrophobicContact CB-CG 4.24Å; M87-P137 HydrophobicContact CE-CB 4Å; M87-P137 HydrophobicContact CE-CG 3.74Å; M87-P137 HydrophobicContact SD-CB 4.24Å; F92-P137 HydrophobicContact CD1-CB 3.85Å; F92-P137 WeakPolarHBondContact CD1-O 3.44Å; V95-P137 HydrophobicContact CG1-CG 3.9Å; V96-P137 HydrophobicContact CG2-CB 3.71Å; V96-P137 HydrophobicContact CG2-CG 4.1Å; L133-P137 WeakPolarHBondContact O-CD 3.22Å; L133-P137 VanDerWaalsContact O-CG 3.29Å; L133-P137 WeakPolarHBondContact O-CG 3.3Å; P137-T140 PolarHBondContact O-N 3.3Å; P137-I141 WeakPolarHBondContact O-CG2 3.45Å; P137-I141 PolarHBondContact O-N 3.13Å |
| 138 | T | 89.8 | Confident | 87.3 | Confident | 0 Ų | 0 | 27.2 Ų | 27.2 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -70.7 | -42.5 | -177.6 | -49.4 | 0 | 0 | 0 | 0 | 112 | F33 V36 T134 F135 L136 T140 I141 L142 L202 | F33-T138 HydrophobicContact CB-CG2 3.71Å; F33-T138 HydrophobicContact CD2-CG2 3.5Å; F33-T138 HydrophobicContact CG-CG2 4.04Å; V36-T138 HydrophobicContact CG2-CG2 4.36Å; T134-T138 VanDerWaalsContact O-CB 3.29Å; T134-T138 WeakPolarHBondContact O-CB 3.45Å; T134-T138 PolarHBondContact O-N 3.19Å; T134-T138 PolarHBondContact O-OG1 2.94Å; F135-T138 PolarHBondContact O-N 3.21Å; L136-T138 VanDerWaalsContact C-N 3.31Å; L136-T138 PolarHBondContact O-N 3.37Å; T138-T140 VanDerWaalsContact C-N 3.32Å; T138-T140 PolarHBondContact O-N 3.26Å; T138-I141 VanDerWaalsContact O-CG2 3.26Å; T138-I141 WeakPolarHBondContact O-CG2 3.34Å; T138-L142 WeakPolarHBondContact O-CB 3.41Å; T138-L142 PolarHBondContact O-N 2.92Å; T138-L142 VanDerWaalsContact O-N 3.08Å; T138-L202 HydrophobicContact CG2-CD1 4.19Å; T138-L202 HydrophobicContact CG2-CD2 4.01Å |
| 139 | V | 84.6 | Confident | 86.1 | Confident | 32 Ų | 32 | 33.6 Ų | 33.6 | 19% | 0.194 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -65.8 | -37.4 | 173.1 | 69.3 | 0 | 0 | 0 | 0 | 111.6 | F33 F135 L136 L142 S143 | F33-V139 HydrophobicContact CE2-CB 3.78Å; F33-V139 HydrophobicContact CE2-CG2 4.41Å; F33-V139 HydrophobicContact CZ-CB 3.92Å; F33-V139 HydrophobicContact CZ-CG2 4.04Å; F135-V139 WeakPolarHBondContact O-CG1 3.47Å; F135-V139 PolarHBondContact O-N 3.41Å; L136-V139 HydrophobicContact CD1-CG1 4.39Å; L136-V139 VanDerWaalsContact O-CG1 3.26Å; L136-V139 WeakPolarHBondContact O-CG1 3.22Å; V139-L142 PolarHBondContact O-N 3.32Å; V139-S143 WeakPolarHBondContact O-CB 3.15Å; V139-S143 PolarHBondContact O-N 3.41Å |
| 140 | T | 83.4 | Confident | 85 | Confident | 37 Ų | 37 | 37 Ų | 37 | 23% | 0.227 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -65.8 | -46.3 | 179.8 | -60.6 | 0 | 0 | 0 | 0 | 111.1 | M87 F92 L136 P137 T138 S143 K144 | M87-T140 HydrophobicContact SD-CG2 4.07Å; F92-T140 HydrophobicContact CE1-CG2 3.82Å; F92-T140 HydrophobicContact CZ-CG2 4.11Å; L136-T140 VanDerWaalsContact O-CB 3.29Å; L136-T140 WeakPolarHBondContact O-CB 3.03Å; L136-T140 PolarHBondContact O-N 2.94Å; L136-T140 VanDerWaalsContact O-N 3.09Å; L136-T140 PolarHBondContact O-OG1 2.81Å; P137-T140 PolarHBondContact O-N 3.3Å; T138-T140 VanDerWaalsContact C-N 3.32Å; T138-T140 PolarHBondContact O-N 3.26Å; T140-S143 PolarHBondContact O-N 3.15Å; T140-S143 PolarHBondContact O-OG 3.22Å; T140-K144 PolarHBondContact O-N 2.96Å |
| 141 | I | 85.6 | Confident | 83.8 | Confident | 0 Ų | 0 | 41.3 Ų | 41.3 | 0% | 0 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -67.3 | -39.8 | 178.4 | -164.6 | 172 | 0 | 0 | 0 | 111.6 | V29 F92 P137 T138 S143 K144 Y145 L202 R203 | V29-I141 HydrophobicContact CG1-CG2 3.81Å; F92-I141 HydrophobicContact CB-CD1 4.16Å; F92-I141 HydrophobicContact CD1-CB 3.93Å; F92-I141 HydrophobicContact CD2-CD1 4.45Å; F92-I141 HydrophobicContact CE1-CB 4.21Å; F92-I141 HydrophobicContact CG-CB 4.3Å; F92-I141 HydrophobicContact CG-CD1 4.15Å; P137-I141 WeakPolarHBondContact O-CG2 3.45Å; P137-I141 PolarHBondContact O-N 3.13Å; T138-I141 VanDerWaalsContact O-CG2 3.26Å; T138-I141 WeakPolarHBondContact O-CG2 3.34Å; I141-S143 VanDerWaalsContact C-N 3.27Å; I141-S143 PolarHBondContact O-N 3.44Å; I141-K144 WeakPolarHBondContact O-CB 3.5Å; I141-K144 PolarHBondContact O-N 3.31Å; I141-Y145 HydrophobicContact CD1-CE2 4.26Å; I141-Y145 HydrophobicContact CG1-CD2 4.09Å; I141-Y145 HydrophobicContact CG1-CE2 3.91Å; I141-Y145 WeakPolarHBondContact O-CD2 3.42Å; I141-Y145 PolarHBondContact O-N 2.96Å; I141-L202 HydrophobicContact CD1-CB 3.98Å; I141-L202 HydrophobicContact CG2-CD1 4.38Å; I141-L202 HydrophobicContact CG2-CD2 4.01Å; I141-R203 WeakPolarHBondContact CD1-O 3.36Å |
| 142 | L | 85.7 | Confident | 83 | Confident | 2 Ų | 2 | 46.8 Ų | 46.8 | 1% | 0.01 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -56.9 | -43.8 | 174.9 | -175.9 | 64.3 | 0 | 0 | 0 | 111.4 | V29 A30 F33 T138 V139 K144 Y145 F146 V153 A157 | V29-L142 HydrophobicContact CG1-CB 4.31Å; V29-L142 HydrophobicContact CG1-CD1 4.16Å; A30-L142 HydrophobicContact CB-CD1 3.88Å; F33-L142 HydrophobicContact CB-CD2 4.1Å; F33-L142 HydrophobicContact CD1-CD2 3.35Å; F33-L142 HydrophobicContact CE1-CD2 3.99Å; F33-L142 HydrophobicContact CG-CD2 3.9Å; T138-L142 WeakPolarHBondContact O-CB 3.41Å; T138-L142 PolarHBondContact O-N 2.92Å; T138-L142 VanDerWaalsContact O-N 3.08Å; V139-L142 PolarHBondContact O-N 3.32Å; L142-K144 PolarHBondContact O-N 3.34Å; L142-Y145 PolarHBondContact O-N 2.82Å; L142-Y145 VanDerWaalsContact O-N 3.13Å; L142-F146 HydrophobicContact CD1-CD2 3.87Å; L142-F146 HydrophobicContact CD1-CE2 3.86Å; L142-F146 PolarHBondContact O-N 3.41Å; L142-V153 HydrophobicContact CD1-CG1 3.84Å; L142-V153 HydrophobicContact CD2-CG1 4.34Å; L142-V153 HydrophobicContact CG-CG1 4.36Å; L142-A157 HydrophobicContact CD2-CB 4.3Å |
| 143 | S | 80.1 | Confident | 82.5 | Confident | 25 Ų | 25 | 46.9 Ų | 46.9 | 18% | 0.175 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -65.4 | -21.9 | 177.4 | 75.9 | 0 | 0 | 0 | 0 | 114.6 | V139 T140 I141 F146 | V139-S143 WeakPolarHBondContact O-CB 3.15Å; V139-S143 PolarHBondContact O-N 3.41Å; T140-S143 PolarHBondContact O-N 3.15Å; T140-S143 PolarHBondContact O-OG 3.22Å; I141-S143 VanDerWaalsContact C-N 3.27Å; I141-S143 PolarHBondContact O-N 3.44Å; S143-F146 VanDerWaalsContact O-O 3.07Å |
| 144 | K | 82.6 | Confident | 81.9 | Confident | 77 Ų | 77 | 47.9 Ų | 47.9 | 34% | 0.335 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -80.7 | -29.4 | 174.2 | -67.8 | -179.8 | 177.5 | -176.1 | 0 | 112.1 | T140 I141 L142 I205 | T140-K144 PolarHBondContact O-N 2.96Å; I141-K144 WeakPolarHBondContact O-CB 3.5Å; I141-K144 PolarHBondContact O-N 3.31Å; L142-K144 PolarHBondContact O-N 3.34Å; K144-I205 HydrophobicContact CB-CD1 3.75Å; K144-I205 HydrophobicContact CB-CG1 4.12Å; K144-I205 WeakPolarHBondContact O-CD1 3.48Å |
| 145 | Y | 83.8 | Confident | 81.3 | Confident | 0 Ų | 0 | 49.1 Ų | 49.1 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -76.2 | -32.6 | 179.7 | -90.7 | -90.2 | 0 | 0 | 0 | 112.9 | P21 D22 W25 V29 I141 L142 R203 I205 | P21-Y145 WeakPolarHBondContact CD-O 3.3Å; P21-Y145 HydrophobicContact CG-CD1 3.64Å; P21-Y145 HydrophobicContact CG-CE1 4.24Å; P21-Y145 HydrophobicContact CG-CG 4.46Å; D22-Y145 PolarHBondContact N-O 3.35Å; W25-Y145 HydrophobicContact CB-CE1 4.16Å; V29-Y145 HydrophobicContact CB-CD2 4.46Å; V29-Y145 HydrophobicContact CG1-CD2 4.4Å; V29-Y145 HydrophobicContact CG2-CD2 4.13Å; V29-Y145 HydrophobicContact CG2-CE2 3.79Å; I141-Y145 HydrophobicContact CD1-CE2 4.26Å; I141-Y145 HydrophobicContact CG1-CD2 4.09Å; I141-Y145 HydrophobicContact CG1-CE2 3.91Å; I141-Y145 WeakPolarHBondContact O-CD2 3.42Å; I141-Y145 PolarHBondContact O-N 2.96Å; L142-Y145 PolarHBondContact O-N 2.82Å; L142-Y145 VanDerWaalsContact O-N 3.13Å; Y145-R203 WeakPolarHBondContact CE2-O 3.09Å; Y145-R203 PolarHBondContact OH-O 2.98Å; Y145-I205 HydrophobicContact CD1-CD1 4.37Å; Y145-I205 HydrophobicContact CD2-CD1 3.81Å; Y145-I205 HydrophobicContact CD2-CG1 4.33Å; Y145-I205 HydrophobicContact CE1-CG2 3.88Å; Y145-I205 HydrophobicContact CE2-CD1 4Å; Y145-I205 HydrophobicContact CE2-CG1 4.1Å; Y145-I205 HydrophobicContact CE2-CG2 3.74Å; Y145-I205 HydrophobicContact CG-CD1 4.01Å; Y145-I205 VanDerWaalsContact OH-CG2 3.25Å; Y145-I205 WeakPolarHBondContact OH-CG2 3.44Å |
| 146 | F | 81.8 | Confident | 81.1 | Confident | 2 Ų | 2 | 50.7 Ų | 50.7 | 1% | 0.009 | 26% | 0.264 | C | S | . | . | trans | -119.5 | 124.4 | -177.3 | -63.5 | -83.5 | 0 | 0 | 0 | 111.4 | D22 G26 W27 L142 S143 R150 V153 | D22-F146 VanDerWaalsContact OD1-CA 3.25Å; D22-F146 WeakPolarHBondContact OD1-CA 3.44Å; G26-F146 WeakPolarHBondContact O-CE2 3.23Å; W27-F146 HydrophobicContact CD2-CZ 4.31Å; L142-F146 HydrophobicContact CD1-CD2 3.87Å; L142-F146 HydrophobicContact CD1-CE2 3.86Å; L142-F146 PolarHBondContact O-N 3.41Å; S143-F146 VanDerWaalsContact O-O 3.07Å; F146-R150 WeakPolarHBondContact O-CB 3.12Å; F146-V153 HydrophobicContact CD1-CG2 3.88Å; F146-V153 HydrophobicContact CD2-CB 4.24Å; F146-V153 HydrophobicContact CD2-CG1 3.82Å; F146-V153 HydrophobicContact CD2-CG2 4.26Å; F146-V153 HydrophobicContact CE1-CG2 3.99Å; F146-V153 HydrophobicContact CE2-CB 4.49Å; F146-V153 HydrophobicContact CE2-CG1 3.72Å; F146-V153 HydrophobicContact CE2-CG2 4.37Å; F146-V153 HydrophobicContact CG-CB 4.31Å; F146-V153 HydrophobicContact CG-CG1 4.37Å; F146-V153 HydrophobicContact CG-CG2 4Å; F146-V153 HydrophobicContact CZ-CG1 4.2Å; F146-V153 HydrophobicContact CZ-CG2 4.23Å | ||
| 147 | S | 74 | Confident | 81.2 | Confident | 80 Ų | 80 | 49.1 Ų | 49.1 | 56% | 0.559 | 26% | 0.256 | S | S | * | . | S | Bend | trans | -105.7 | -55 | 176.9 | 71.3 | 0 | 0 | 0 | 0 | 111.2 | D22 | D22-S147 PolarHBondContact OD1-N 2.94Å; D22-S147 PolarHBondContact OD2-N 3.25Å; D22-S147 PolarHBondContact OD2-OG 2.96Å |
| 148 | H | 71.8 | Confident | 81.1 | Confident | 167 Ų | 167 | 49.8 Ų | 49.8 | 77% | 0.773 | 26% | 0.261 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.6 | -29.1 | -175.5 | -168.7 | -71.5 | 0 | 0 | 0 | 112.7 | D22 | D22-H148 PolarHBondContact OD1-N 3.1Š|
| 149 | R | 71.2 | Confident | 81.1 | Confident | 135 Ų | 135 | 50.4 Ų | 50.4 | 51% | 0.509 | 27% | 0.265 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -110.3 | 16.6 | -178 | -60.3 | -176.5 | -177.2 | -169.2 | 0.7 | 113.4 | S151 L152 V153 | R149-S151 PolarHBondContact O-N 3.3Å; R149-L152 PolarHBondContact O-N 3.34Å; R149-V153 HydrophobicContact CB-CG2 4.17Å; R149-V153 WeakPolarHBondContact O-CG2 3.43Å; R149-V153 PolarHBondContact O-N 3.05Å |
| 150 | R | 73.1 | Confident | 81.4 | Confident | 121 Ų | 121 | 48.9 Ų | 48.9 | 46% | 0.457 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -52.5 | -52.1 | -172.6 | -176.4 | 178.4 | 167.7 | 179.1 | 2.1 | 112.9 | F146 L152 V153 T154 | F146-R150 WeakPolarHBondContact O-CB 3.12Å; R150-L152 PolarHBondContact O-N 3.5Å; R150-V153 PolarHBondContact O-N 3.38Å; R150-T154 WeakPolarHBondContact O-CB 3.23Å; R150-T154 PolarHBondContact O-N 3.25Å; R150-T154 PolarHBondContact O-OG1 3.29Å |
| 151 | S | 72.3 | Confident | 81.8 | Confident | 91 Ų | 91 | 48 Ų | 48 | 64% | 0.636 | 25% | 0.249 | S | C | * | . | H | α-helix | trans | -61.6 | -43.1 | -178.4 | 52.5 | 0 | 0 | 0 | 0 | 112.5 | R149 A155 | R149-S151 PolarHBondContact O-N 3.3Å; S151-A155 VanDerWaalsContact O-CB 3.25Å; S151-A155 WeakPolarHBondContact O-CB 3.48Å; S151-A155 PolarHBondContact O-N 2.93Å |
| 152 | L | 78.2 | Confident | 82.1 | Confident | 114 Ų | 114 | 48 Ų | 48 | 60% | 0.597 | 25% | 0.249 | S | C | * | . | H | α-helix | trans | -65.3 | -46.2 | 178.6 | -67.4 | 174.9 | 0 | 0 | 0 | 111.9 | R149 R150 A155 L156 | R149-L152 PolarHBondContact O-N 3.34Å; R150-L152 PolarHBondContact O-N 3.5Å; L152-A155 PolarHBondContact O-N 3.4Å; L152-L156 VanDerWaalsContact O-CB 3.31Å; L152-L156 WeakPolarHBondContact O-CB 3.4Å; L152-L156 PolarHBondContact O-N 2.83Å |
| 153 | V | 82.9 | Confident | 82.4 | Confident | 5 Ų | 5 | 51.4 Ų | 51.4 | 3% | 0.03 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -69.3 | -40.8 | -178.9 | 178.1 | 0 | 0 | 0 | 0 | 111 | W27 A30 L142 F146 R149 R150 L156 A157 | W27-V153 HydrophobicContact CH2-CG2 4.38Å; A30-V153 HydrophobicContact CB-CG1 3.78Å; L142-V153 HydrophobicContact CD1-CG1 3.84Å; L142-V153 HydrophobicContact CD2-CG1 4.34Å; L142-V153 HydrophobicContact CG-CG1 4.36Å; F146-V153 HydrophobicContact CD1-CG2 3.88Å; F146-V153 HydrophobicContact CD2-CB 4.24Å; F146-V153 HydrophobicContact CD2-CG1 3.82Å; F146-V153 HydrophobicContact CD2-CG2 4.26Å; F146-V153 HydrophobicContact CE1-CG2 3.99Å; F146-V153 HydrophobicContact CE2-CB 4.49Å; F146-V153 HydrophobicContact CE2-CG1 3.72Å; F146-V153 HydrophobicContact CE2-CG2 4.37Å; F146-V153 HydrophobicContact CG-CB 4.31Å; F146-V153 HydrophobicContact CG-CG1 4.37Å; F146-V153 HydrophobicContact CG-CG2 4Å; F146-V153 HydrophobicContact CZ-CG1 4.2Å; F146-V153 HydrophobicContact CZ-CG2 4.23Å; R149-V153 HydrophobicContact CB-CG2 4.17Å; R149-V153 WeakPolarHBondContact O-CG2 3.43Å; R149-V153 PolarHBondContact O-N 3.05Å; R150-V153 PolarHBondContact O-N 3.38Å; V153-L156 PolarHBondContact O-N 2.97Å; V153-A157 VanDerWaalsContact O-CB 3.25Å; V153-A157 WeakPolarHBondContact O-CB 3.49Å; V153-A157 PolarHBondContact O-N 3.22Å |
| 154 | T | 81.8 | Confident | 82.9 | Confident | 34 Ų | 34 | 50.2 Ų | 50.2 | 21% | 0.209 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -62.5 | -45.8 | 174 | -60.4 | 0 | 0 | 0 | 0 | 110.9 | F33 R150 L156 A157 S158 | F33-T154 HydrophobicContact CE1-CG2 4.36Å; R150-T154 WeakPolarHBondContact O-CB 3.23Å; R150-T154 PolarHBondContact O-N 3.25Å; R150-T154 PolarHBondContact O-OG1 3.29Å; T154-L156 PolarHBondContact O-N 2.81Å; T154-A157 PolarHBondContact O-N 2.81Å; T154-S158 WeakPolarHBondContact O-CB 3.31Å; T154-S158 PolarHBondContact O-N 2.9Å; T154-S158 PolarHBondContact O-OG 3.33Å; T154-S158 VanDerWaalsContact O-OG 3.14Å |
| 155 | A | 80.4 | Confident | 83.2 | Confident | 25 Ų | 25 | 46.6 Ų | 46.6 | 21% | 0.207 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -61 | -45.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | S151 L152 S158 T159 | S151-A155 VanDerWaalsContact O-CB 3.25Å; S151-A155 WeakPolarHBondContact O-CB 3.48Å; S151-A155 PolarHBondContact O-N 2.93Å; L152-A155 PolarHBondContact O-N 3.4Å; A155-S158 PolarHBondContact O-N 3.35Å; A155-T159 WeakPolarHBondContact O-CG2 3.24Å; A155-T159 PolarHBondContact O-N 2.88Å |
| 156 | L | 86.3 | Confident | 83.6 | Confident | 80 Ų | 80 | 47.5 Ų | 47.5 | 42% | 0.419 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -61.1 | -47.3 | 177.7 | -179.8 | 63.8 | 0 | 0 | 0 | 111.4 | W27 L152 V153 T154 T159 F344 | W27-L156 HydrophobicContact CZ3-CD2 4.31Å; L152-L156 VanDerWaalsContact O-CB 3.31Å; L152-L156 WeakPolarHBondContact O-CB 3.4Å; L152-L156 PolarHBondContact O-N 2.83Å; V153-L156 PolarHBondContact O-N 2.97Å; T154-L156 PolarHBondContact O-N 2.81Å; L156-T159 WeakPolarHBondContact O-CB 3.4Å; L156-T159 PolarHBondContact O-N 3.24Å; L156-T159 PolarHBondContact O-OG1 3.26Å; L156-F344 HydrophobicContact CD1-CZ 4.1Å |
| 157 | A | 87.5 | Confident | 84 | Confident | 4 Ų | 4 | 50.3 Ų | 50.3 | 3% | 0.033 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -71.3 | -35.1 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | A30 F33 F34 L142 V153 T154 T159 G160 | A30-A157 WeakPolarHBondContact O-CB 3.38Å; F33-A157 HydrophobicContact CB-CB 4.3Å; F33-A157 HydrophobicContact CD1-CB 3.48Å; F33-A157 VanDerWaalsContact CD1-CB 3.48Å; F33-A157 HydrophobicContact CE1-CB 4.27Å; F33-A157 HydrophobicContact CG-CB 4.35Å; F34-A157 VanDerWaalsContact CA-O 3.27Å; F34-A157 WeakPolarHBondContact CA-O 3.43Å; F34-A157 HydrophobicContact CB-CB 4.37Å; F34-A157 WeakPolarHBondContact CD2-O 3.29Å; L142-A157 HydrophobicContact CD2-CB 4.3Å; V153-A157 VanDerWaalsContact O-CB 3.25Å; V153-A157 WeakPolarHBondContact O-CB 3.49Å; V153-A157 PolarHBondContact O-N 3.22Å; T154-A157 PolarHBondContact O-N 2.81Å; A157-T159 PolarHBondContact O-N 2.99Å; A157-G160 PolarHBondContact O-N 3.43Å |
| 158 | S | 85.9 | Confident | 84.7 | Confident | 14 Ų | 14 | 48.8 Ų | 48.8 | 10% | 0.098 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -67.4 | -13.1 | 173.1 | -63.8 | 0 | 0 | 0 | 0 | 113.4 | F33 E37 T154 A155 G160 E161 R343 | F33-S158 WeakPolarHBondContact CE1-OG 3.47Å; E37-S158 PolarHBondContact OE1-OG 3.23Å; T154-S158 WeakPolarHBondContact O-CB 3.31Å; T154-S158 PolarHBondContact O-N 2.9Å; T154-S158 PolarHBondContact O-OG 3.33Å; T154-S158 VanDerWaalsContact O-OG 3.14Å; A155-S158 PolarHBondContact O-N 3.35Å; S158-G160 PolarHBondContact O-N 3.26Å; S158-E161 WeakPolarHBondContact O-CG 3.42Å; S158-E161 PolarHBondContact O-N 3.02Å; S158-R343 PolarHBondContact O-NH1 3.43Å |
| 159 | T | 90.8 | Very high | 85.4 | Confident | 14 Ų | 14 | 40.9 Ų | 40.9 | 9% | 0.086 | 22% | 0.221 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -60.4 | -15 | 171.3 | 65.7 | 0 | 0 | 0 | 0 | 113.5 | F34 A155 L156 A157 E161 S162 L163 I340 F344 | F34-T159 WeakPolarHBondContact CE2-OG1 3.29Å; A155-T159 WeakPolarHBondContact O-CG2 3.24Å; A155-T159 PolarHBondContact O-N 2.88Å; L156-T159 WeakPolarHBondContact O-CB 3.4Å; L156-T159 PolarHBondContact O-N 3.24Å; L156-T159 PolarHBondContact O-OG1 3.26Å; A157-T159 PolarHBondContact O-N 2.99Å; T159-E161 PolarHBondContact O-N 3.01Å; T159-S162 PolarHBondContact O-N 3.46Å; T159-S162 VanDerWaalsContact O-N 3.13Å; T159-L163 PolarHBondContact O-N 3.41Å; T159-I340 HydrophobicContact CG2-CG2 4.27Å; T159-F344 HydrophobicContact CG2-CE2 4.33Å; T159-F344 HydrophobicContact CG2-CZ 4.45Å |
| 160 | G | 91 | Very high | 86.3 | Confident | 0 Ų | 0 | 36 Ų | 36 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -55 | -36.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | F34 M38 A157 S158 S162 L163 A164 | F34-G160 VanDerWaalsContact CE2-N 3.3Å; M38-G160 WeakPolarHBondContact CA-O 3.41Å; M38-G160 WeakPolarHBondContact CB-O 3.25Å; A157-G160 PolarHBondContact O-N 3.43Å; S158-G160 PolarHBondContact O-N 3.26Å; G160-S162 VanDerWaalsContact C-N 3.34Å; G160-S162 PolarHBondContact O-N 2.84Å; G160-L163 PolarHBondContact O-N 2.93Å; G160-A164 PolarHBondContact O-N 3Å |
| 161 | E | 91.6 | Very high | 87.2 | Confident | 17 Ų | 17 | 32 Ų | 32 | 8% | 0.079 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -62.6 | -41.4 | 177.9 | 78.4 | -172.1 | -112.6 | 0 | 0 | 111.9 | K45 S158 T159 A164 M165 R343 | K45-E161 IonicContact NZ-OE1 2.71Å; K45-E161 PolarHBondContact NZ-OE1 3.26Å; S158-E161 WeakPolarHBondContact O-CG 3.42Å; S158-E161 PolarHBondContact O-N 3.02Å; T159-E161 PolarHBondContact O-N 3.01Å; E161-A164 PolarHBondContact O-N 3.18Å; E161-M165 PolarHBondContact O-N 2.83Å; E161-R343 IonicContact OE1-CZ 3.88Å; E161-R343 IonicContact OE1-NH2 2.85Å; E161-R343 PolarHBondContact OE1-NH2 3.05Å; E161-R343 IonicContact OE2-CZ 3.15Å; E161-R343 IonicContact OE2-NH1 2.76Å; E161-R343 PolarHBondContact OE2-NH1 3.47Å; E161-R343 VanDerWaalsContact OE2-NH1 3.1Å; E161-R343 IonicContact OE2-NH2 3.34Å; E161-R343 PolarHBondContact OE2-NH2 2.94Å |
| 162 | S | 91.9 | Very high | 88.2 | Confident | 0 Ų | 0 | 28.2 Ų | 28.2 | 0% | 0 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -76.1 | -31.6 | -179.4 | -53.4 | 0 | 0 | 0 | 0 | 110.8 | T159 G160 M165 S166 A336 E339 I340 | T159-S162 PolarHBondContact O-N 3.46Å; T159-S162 VanDerWaalsContact O-N 3.13Å; G160-S162 VanDerWaalsContact C-N 3.34Å; G160-S162 PolarHBondContact O-N 2.84Å; S162-M165 PolarHBondContact O-N 3.21Å; S162-S166 WeakPolarHBondContact O-CB 3.37Å; S162-S166 PolarHBondContact O-N 3.18Å; S162-S166 PolarHBondContact O-OG 2.76Å; S162-A336 WeakPolarHBondContact CB-O 3.43Å; S162-A336 WeakPolarHBondContact O-CB 3.48Å; S162-E339 PolarHBondContact OG-OE2 3.42Å; S162-I340 VanDerWaalsContact CB-CG1 3.45Å |
| 163 | L | 90.9 | Very high | 88.8 | Confident | 75 Ų | 75 | 23 Ų | 23 | 39% | 0.393 | 15% | 0.149 | S | C | . | . | H | α-helix | trans | -66.1 | -42.2 | 171.9 | -172.1 | 65.3 | 0 | 0 | 0 | 111.4 | F34 T159 G160 S166 A167 | F34-L163 HydrophobicContact CE1-CD2 4.19Å; F34-L163 HydrophobicContact CZ-CB 4.26Å; F34-L163 HydrophobicContact CZ-CD2 3.6Å; T159-L163 PolarHBondContact O-N 3.41Å; G160-L163 PolarHBondContact O-N 2.93Å; L163-S166 WeakPolarHBondContact CA-OG 3.48Å; L163-S166 PolarHBondContact O-N 3.19Å; L163-S166 PolarHBondContact O-OG 3.44Å; L163-S166 VanDerWaalsContact O-OG 3.13Å; L163-A167 WeakPolarHBondContact O-CB 3.16Å; L163-A167 PolarHBondContact O-N 2.97Å |
| 164 | A | 90.8 | Very high | 89.3 | Confident | 0 Ų | 0 | 26.5 Ų | 26.5 | 0% | 0 | 17% | 0.17 | C | C | . | . | I | π-helix | trans | -58 | -49.9 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | M38 G160 E161 S166 L168 A169 | M38-A164 HydrophobicContact CB-CB 4.35Å; M38-A164 HydrophobicContact CG-CB 3.56Å; M38-A164 WeakPolarHBondContact O-CB 3.24Å; G160-A164 PolarHBondContact O-N 3Å; E161-A164 PolarHBondContact O-N 3.18Å; A164-S166 VanDerWaalsContact C-N 3.27Å; A164-S166 PolarHBondContact O-N 2.84Å; A164-L168 HydrophobicContact CB-CD1 4Å; A164-L168 VanDerWaalsContact O-CA 3.31Å; A164-L168 WeakPolarHBondContact O-CA 3.14Å; A164-L168 WeakPolarHBondContact O-CB 3.5Å; A164-L168 PolarHBondContact O-N 3.31Å; A164-A169 PolarHBondContact O-N 3.32Å; A164-A169 VanDerWaalsContact O-N 3.15Å |
| 165 | M | 90.2 | Very high | 89.9 | Confident | 1 Ų | 1 | 27.1 Ų | 27.1 | 1% | 0.005 | 17% | 0.172 | C | C | . | . | I | π-helix | trans | -64.3 | -31.4 | -179.1 | -171.9 | 176.1 | -163.8 | 0 | 0 | 113.1 | K45 E161 S162 A169 P311 L332 M335 A336 | K45-M165 HydrophobicContact CB-CE 4.25Å; K45-M165 HydrophobicContact CB-SD 3.96Å; K45-M165 HydrophobicContact CD-SD 3.98Å; E161-M165 PolarHBondContact O-N 2.83Å; S162-M165 PolarHBondContact O-N 3.21Å; M165-A169 WeakPolarHBondContact O-CB 3.38Å; M165-P311 HydrophobicContact CE-CB 3.85Å; M165-L332 HydrophobicContact CE-CB 3.83Å; M165-L332 HydrophobicContact CE-CD1 4.47Å; M165-L332 HydrophobicContact CE-CD2 3.32Å; M165-L332 HydrophobicContact CE-CG 4.04Å; M165-L332 HydrophobicContact CG-CB 4.26Å; M165-M335 HydrophobicContact CE-CE 3.23Å; M165-M335 HydrophobicContact SD-CE 4.2Å; M165-A336 HydrophobicContact CB-CB 3.72Å; M165-A336 HydrophobicContact CG-CB 3.82Å; M165-A336 HydrophobicContact SD-CB 4.03Å |
| 166 | S | 91.6 | Very high | 90.5 | Very high | 19 Ų | 19 | 26.3 Ų | 26.3 | 13% | 0.133 | 16% | 0.164 | C | C | . | . | I | π-helix | trans | -82.2 | -42.2 | 178.9 | 53 | 0 | 0 | 0 | 0 | 114.5 | S162 L163 A164 P170 S333 | S162-S166 WeakPolarHBondContact O-CB 3.37Å; S162-S166 PolarHBondContact O-N 3.18Å; S162-S166 PolarHBondContact O-OG 2.76Å; L163-S166 WeakPolarHBondContact CA-OG 3.48Å; L163-S166 PolarHBondContact O-N 3.19Å; L163-S166 PolarHBondContact O-OG 3.44Å; L163-S166 VanDerWaalsContact O-OG 3.13Å; A164-S166 VanDerWaalsContact C-N 3.27Å; A164-S166 PolarHBondContact O-N 2.84Å; S166-P170 VanDerWaalsContact O-CD 3.29Å; S166-P170 WeakPolarHBondContact O-CD 3.5Å; S166-P170 WeakPolarHBondContact O-CG 3.44Å; S166-S333 PolarHBondContact O-OG 2.77Å |
| 167 | A | 89.6 | Confident | 90.8 | Very high | 60 Ų | 60 | 27.5 Ų | 27.5 | 50% | 0.496 | 17% | 0.17 | S | C | . | . | I | π-helix | trans | -100.6 | -42.3 | -173.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | L163 | L163-A167 WeakPolarHBondContact O-CB 3.16Å; L163-A167 PolarHBondContact O-N 2.97Å |
| 168 | L | 88.2 | Confident | 91.2 | Very high | 49 Ų | 49 | 35.4 Ų | 35.4 | 26% | 0.257 | 20% | 0.204 | S | C | . | . | I | π-helix | trans | -81.1 | -30.4 | -177.4 | -57.6 | 178.3 | 0 | 0 | 0 | 112.2 | M38 F39 A164 G171 F172 | M38-L168 HydrophobicContact CG-CD1 4.18Å; M38-L168 HydrophobicContact SD-CD1 4.47Å; F39-L168 HydrophobicContact CE1-CD1 4.28Å; A164-L168 HydrophobicContact CB-CD1 4Å; A164-L168 VanDerWaalsContact O-CA 3.31Å; A164-L168 WeakPolarHBondContact O-CA 3.14Å; A164-L168 WeakPolarHBondContact O-CB 3.5Å; A164-L168 PolarHBondContact O-N 3.31Å; L168-G171 CarbonylContact O-C 3.48Å; L168-G171 WeakPolarHBondContact O-CA 3.01Å; L168-G171 PolarHBondContact O-N 3.42Å; L168-G171 VanDerWaalsContact O-N 3.15Å; L168-F172 HydrophobicContact CB-CD2 4.22Å; L168-F172 HydrophobicContact CB-CE2 3.66Å; L168-F172 HydrophobicContact CB-CZ 3.9Å; L168-F172 HydrophobicContact CD1-CZ 4.31Å; L168-F172 VanDerWaalsContact O-CD2 3.28Å; L168-F172 WeakPolarHBondContact O-CD2 3.4Å; L168-F172 VanDerWaalsContact O-CG 3.26Å; L168-F172 WeakPolarHBondContact O-CG 3.37Å; L168-F172 PolarHBondContact O-N 3.31Å |
| 169 | A | 87.8 | Confident | 91.6 | Very high | 0 Ų | 0 | 38.1 Ų | 38.1 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -61.4 | -48.2 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | I49 A164 M165 G171 F172 S173 L332 | I49-A169 HydrophobicContact CD1-CB 3.88Å; I49-A169 VanDerWaalsContact CD1-O 3.22Å; I49-A169 WeakPolarHBondContact CD1-O 3.46Å; A164-A169 PolarHBondContact O-N 3.32Å; A164-A169 VanDerWaalsContact O-N 3.15Å; M165-A169 WeakPolarHBondContact O-CB 3.38Å; A169-G171 VanDerWaalsContact C-N 3.31Å; A169-G171 PolarHBondContact O-N 3.19Å; A169-F172 PolarHBondContact O-N 3.15Å; A169-S173 PolarHBondContact O-N 2.65Å; A169-L332 HydrophobicContact CB-CD1 4.27Å |
| 170 | P | 90.6 | Very high | 91.8 | Very high | 32 Ų | 32 | 38.9 Ų | 38.9 | 21% | 0.208 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -60.4 | -40.2 | 170.6 | -22.6 | 34.2 | 0 | 0 | 0 | 112.8 | S166 F172 S173 V174 T329 S333 | S166-P170 VanDerWaalsContact O-CD 3.29Å; S166-P170 WeakPolarHBondContact O-CD 3.5Å; S166-P170 WeakPolarHBondContact O-CG 3.44Å; P170-F172 PolarHBondContact O-N 2.66Å; P170-S173 WeakPolarHBondContact O-CB 3.39Å; P170-S173 PolarHBondContact O-N 2.85Å; P170-V174 WeakPolarHBondContact O-CG2 3.19Å; P170-V174 PolarHBondContact O-N 3.44Å; P170-T329 HydrophobicContact CB-CG2 4.3Å; P170-T329 HydrophobicContact CG-CG2 4.25Å; P170-S333 VanDerWaalsContact CG-OG 3.29Å; P170-S333 WeakPolarHBondContact CG-OG 2.98Å |
| 171 | G | 92 | Very high | 92 | Very high | 39 Ų | 39 | 39.5 Ų | 39.5 | 40% | 0.402 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -59.4 | -43.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113 | L168 A169 L175 | L168-G171 CarbonylContact O-C 3.48Å; L168-G171 WeakPolarHBondContact O-CA 3.01Å; L168-G171 PolarHBondContact O-N 3.42Å; L168-G171 VanDerWaalsContact O-N 3.15Å; A169-G171 VanDerWaalsContact C-N 3.31Å; A169-G171 PolarHBondContact O-N 3.19Å; G171-L175 WeakPolarHBondContact O-CB 3.48Å; G171-L175 PolarHBondContact O-N 3.37Å |
| 172 | F | 91.9 | Very high | 92.2 | Very high | 10 Ų | 10 | 42 Ų | 42 | 4% | 0.044 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -71.3 | -33 | 176.1 | -62.8 | -32.9 | 0 | 0 | 0 | 112.6 | I43 I49 F50 L168 A169 P170 L175 R176 T184 I188 L191 | I43-F172 HydrophobicContact CD1-CE2 3.43Å; I43-F172 VanDerWaalsContact CD1-CE2 3.43Å; I43-F172 HydrophobicContact CD1-CZ 3.89Å; I49-F172 HydrophobicContact CD1-CB 4.38Å; F50-F172 HydrophobicContact CZ-CB 4.37Å; L168-F172 HydrophobicContact CB-CD2 4.22Å; L168-F172 HydrophobicContact CB-CE2 3.66Å; L168-F172 HydrophobicContact CB-CZ 3.9Å; L168-F172 HydrophobicContact CD1-CZ 4.31Å; L168-F172 VanDerWaalsContact O-CD2 3.28Å; L168-F172 WeakPolarHBondContact O-CD2 3.4Å; L168-F172 VanDerWaalsContact O-CG 3.26Å; L168-F172 WeakPolarHBondContact O-CG 3.37Å; L168-F172 PolarHBondContact O-N 3.31Å; A169-F172 PolarHBondContact O-N 3.15Å; P170-F172 PolarHBondContact O-N 2.66Å; F172-L175 PolarHBondContact O-N 3.39Å; F172-R176 VanDerWaalsContact O-CB 3.23Å; F172-R176 WeakPolarHBondContact O-CB 3.23Å; F172-R176 PolarHBondContact O-N 3.46Å; F172-T184 HydrophobicContact CB-CG2 4.37Å; F172-I188 HydrophobicContact CD1-CD1 4.11Å; F172-I188 HydrophobicContact CD1-CG1 3.84Å; F172-I188 HydrophobicContact CD2-CD1 4.02Å; F172-I188 HydrophobicContact CD2-CG1 4.31Å; F172-I188 HydrophobicContact CE1-CD1 4.29Å; F172-I188 HydrophobicContact CE1-CG1 3.61Å; F172-I188 HydrophobicContact CE2-CD1 4.2Å; F172-I188 HydrophobicContact CE2-CG1 4.1Å; F172-I188 HydrophobicContact CG-CD1 3.98Å; F172-I188 HydrophobicContact CG-CG1 4.21Å; F172-I188 HydrophobicContact CZ-CD1 4.34Å; F172-I188 HydrophobicContact CZ-CG1 3.74Å; F172-L191 HydrophobicContact CE1-CD1 3.94Å; F172-L191 HydrophobicContact CZ-CD1 4.28Å |
| 173 | S | 92.1 | Very high | 92.4 | Very high | 6 Ų | 6 | 47.7 Ų | 47.7 | 4% | 0.042 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -61.5 | -50.7 | 172.2 | -169.6 | 0 | 0 | 0 | 0 | 110.8 | A169 P170 L175 R176 D177 T329 | A169-S173 PolarHBondContact O-N 2.65Å; P170-S173 WeakPolarHBondContact O-CB 3.39Å; P170-S173 PolarHBondContact O-N 2.85Å; S173-L175 VanDerWaalsContact C-N 3.28Å; S173-L175 PolarHBondContact O-N 3.34Å; S173-R176 WeakPolarHBondContact O-CB 3.25Å; S173-R176 PolarHBondContact O-N 3.38Å; S173-R176 PolarHBondContact OG-NH2 3.22Å; S173-D177 PolarHBondContact O-N 3.41Å; S173-T329 PolarHBondContact OG-OG1 2.81Å |
| 174 | V | 92.9 | Very high | 92.6 | Very high | 77 Ų | 77 | 44.1 Ų | 44.1 | 47% | 0.467 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -62.3 | -37.6 | 177.7 | 173.6 | 0 | 0 | 0 | 0 | 111.6 | P170 D177 K178 | P170-V174 WeakPolarHBondContact O-CG2 3.19Å; P170-V174 PolarHBondContact O-N 3.44Å; V174-D177 PolarHBondContact O-N 2.96Å; V174-K178 HydrophobicContact CG1-CD 4.49Å; V174-K178 WeakPolarHBondContact O-CG 3.39Å; V174-K178 PolarHBondContact O-N 3.24Å |
| 175 | L | 93.6 | Very high | 92.9 | Very high | 47 Ų | 47 | 44.2 Ų | 44.2 | 25% | 0.246 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -67.3 | -46 | 177.1 | -168.9 | 60.5 | 0 | 0 | 0 | 111.1 | G171 F172 S173 D177 K178 I179 T184 V187 | G171-L175 WeakPolarHBondContact O-CB 3.48Å; G171-L175 PolarHBondContact O-N 3.37Å; F172-L175 PolarHBondContact O-N 3.39Å; S173-L175 VanDerWaalsContact C-N 3.28Å; S173-L175 PolarHBondContact O-N 3.34Å; L175-D177 VanDerWaalsContact C-N 3.28Å; L175-D177 PolarHBondContact O-N 3.07Å; L175-K178 PolarHBondContact O-N 3.34Å; L175-K178 VanDerWaalsContact O-N 3.1Å; L175-I179 HydrophobicContact CD1-CD1 3.54Å; L175-I179 HydrophobicContact CD1-CG1 3.86Å; L175-I179 HydrophobicContact CD2-CD1 4.23Å; L175-I179 HydrophobicContact CG-CD1 3.68Å; L175-I179 HydrophobicContact CG-CG1 3.91Å; L175-I179 VanDerWaalsContact O-CG1 3.22Å; L175-I179 WeakPolarHBondContact O-CG1 3.12Å; L175-I179 PolarHBondContact O-N 2.91Å; L175-T184 HydrophobicContact CB-CG2 4.32Å; L175-T184 HydrophobicContact CD2-CG2 4.2Å; L175-T184 HydrophobicContact CG-CG2 4.33Å; L175-V187 HydrophobicContact CD2-CB 4.01Å; L175-V187 HydrophobicContact CD2-CG1 3.78Å; L175-V187 HydrophobicContact CD2-CG2 4.27Å |
| 176 | R | 94.3 | Very high | 93.2 | Very high | 8 Ų | 8 | 45.4 Ų | 45.4 | 3% | 0.03 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -54.6 | -45.2 | 174.3 | 177.9 | -150.7 | 55.3 | -164.7 | -2.3 | 111.1 | I49 F50 D53 F172 S173 K178 G180 W181 T184 | I49-R176 PolarHBondContact O-NH1 3.5Å; F50-R176 HydrophobicContact CD1-CG 4.37Å; F50-R176 HydrophobicContact CE1-CB 4.21Å; F50-R176 HydrophobicContact CE1-CG 4.31Å; D53-R176 WeakPolarHBondContact OD2-CD 3.31Å; D53-R176 IonicContact OD2-NH1 3.85Å; F172-R176 VanDerWaalsContact O-CB 3.23Å; F172-R176 WeakPolarHBondContact O-CB 3.23Å; F172-R176 PolarHBondContact O-N 3.46Å; S173-R176 WeakPolarHBondContact O-CB 3.25Å; S173-R176 PolarHBondContact O-N 3.38Å; S173-R176 PolarHBondContact OG-NH2 3.22Å; R176-K178 PolarHBondContact O-N 3.46Å; R176-G180 WeakPolarHBondContact O-CA 3.23Å; R176-G180 PolarHBondContact O-N 3.37Å; R176-W181 HydrophobicContact CG-CB 4.24Å; R176-T184 VanDerWaalsContact CA-OG1 3.23Å; R176-T184 WeakPolarHBondContact CA-OG1 3.23Å; R176-T184 HydrophobicContact CB-CG2 4.48Å; R176-T184 PolarHBondContact N-OG1 2.82Å |
| 177 | D | 92.6 | Very high | 93.5 | Very high | 105 Ų | 105 | 47.2 Ų | 47.2 | 56% | 0.561 | 27% | 0.267 | S | S | * | . | H | α-helix | trans | -66 | -27.8 | -177.9 | -59.8 | -19.4 | 0 | 0 | 0 | 112.4 | S173 V174 L175 | S173-D177 PolarHBondContact O-N 3.41Å; V174-D177 PolarHBondContact O-N 2.96Å; L175-D177 VanDerWaalsContact C-N 3.28Å; L175-D177 PolarHBondContact O-N 3.07Å |
| 178 | K | 94.4 | Very high | 93.8 | Very high | 170 Ų | 170 | 44.4 Ų | 44.4 | 74% | 0.739 | 24% | 0.244 | S | C | * | . | H | α-helix | trans | -88.9 | -41.9 | -179.8 | -71.6 | -178.2 | -179.6 | -178.2 | 0 | 114.6 | V174 L175 R176 | V174-K178 HydrophobicContact CG1-CD 4.49Å; V174-K178 WeakPolarHBondContact O-CG 3.39Å; V174-K178 PolarHBondContact O-N 3.24Å; L175-K178 PolarHBondContact O-N 3.34Å; L175-K178 VanDerWaalsContact O-N 3.1Å; R176-K178 PolarHBondContact O-N 3.46Å |
| 179 | I | 95.4 | Very high | 94.2 | Very high | 71 Ų | 71 | 42 Ų | 42 | 36% | 0.364 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -120 | 0 | -171.2 | 65.2 | 168.9 | 0 | 0 | 0 | 113.7 | L175 H183 V187 | L175-I179 HydrophobicContact CD1-CD1 3.54Å; L175-I179 HydrophobicContact CD1-CG1 3.86Å; L175-I179 HydrophobicContact CD2-CD1 4.23Å; L175-I179 HydrophobicContact CG-CD1 3.68Å; L175-I179 HydrophobicContact CG-CG1 3.91Å; L175-I179 VanDerWaalsContact O-CG1 3.22Å; L175-I179 WeakPolarHBondContact O-CG1 3.12Å; L175-I179 PolarHBondContact O-N 2.91Å; I179-H183 HydrophobicContact CB-CB 4.15Å; I179-H183 HydrophobicContact CD1-CB 3.66Å; I179-H183 HydrophobicContact CG1-CB 3.94Å; I179-H183 PolarHBondContact O-ND1 3.4Å; I179-V187 HydrophobicContact CD1-CG2 4.33Å |
| 180 | G | 94.5 | Very high | 94.6 | Very high | 31 Ų | 31 | 44.5 Ų | 44.5 | 32% | 0.32 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | 81.6 | 164.3 | -177.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | R176 R182 T184 | R176-G180 WeakPolarHBondContact O-CA 3.23Å; R176-G180 PolarHBondContact O-N 3.37Å; G180-R182 PolarHBondContact O-N 3.34Å; G180-T184 WeakPolarHBondContact O-CB 3.33Å; G180-T184 PolarHBondContact O-N 3.26Å; G180-T184 VanDerWaalsContact O-N 3.13Å; G180-T184 PolarHBondContact O-OG1 3.43Å |
| 181 | W | 94.8 | Very high | 94.9 | Very high | 13 Ų | 13 | 46.2 Ų | 46.2 | 5% | 0.049 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -67.1 | -35.9 | -176.5 | 72.1 | -92.1 | 0 | 0 | 0 | 113.1 | F50 D53 M54 E57 F58 I119 R176 T184 M185 | F50-W181 HydrophobicContact CD1-CB 3.78Å; F50-W181 HydrophobicContact CE1-CB 4.4Å; D53-W181 HydrophobicContact CB-CB 4.2Å; D53-W181 HydrophobicContact CB-CG 4.02Å; M54-W181 HydrophobicContact CE-CE3 3.8Å; M54-W181 HydrophobicContact CE-CZ3 3.77Å; M54-W181 HydrophobicContact CG-CE3 4.49Å; E57-W181 WeakPolarHBondContact OE2-CZ2 3.34Å; E57-W181 PolarHBondContact OE2-NE1 2.9Å; F58-W181 AromaticContact CE2-CH2 3.95Å; F58-W181 HydrophobicContact CE2-CH2 3.95Å; F58-W181 AromaticContact CE2-CZ2 3.92Å; F58-W181 HydrophobicContact CE2-CZ2 3.92Å; F58-W181 HydrophobicContact CZ-CH2 4.07Å; F58-W181 HydrophobicContact CZ-CZ2 4.1Å; I119-W181 HydrophobicContact CD1-CH2 4.23Å; R176-W181 HydrophobicContact CG-CB 4.24Å; W181-T184 PolarHBondContact O-N 3.08Å; W181-M185 HydrophobicContact CE3-CG 4.19Å; W181-M185 WeakPolarHBondContact O-CG 3.24Å; W181-M185 PolarHBondContact O-N 3.47Å |
| 182 | R | 95.8 | Very high | 95.1 | Very high | 68 Ų | 68 | 44.4 Ų | 44.4 | 26% | 0.257 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -59.6 | -53.7 | 179.2 | -70.2 | 178.5 | 173.3 | -115.4 | 2.5 | 111.7 | E57 S111 T113 G180 T184 M185 A186 | E57-R182 IonicContact OE1-CZ 2.67Å; E57-R182 IonicContact OE1-NE 3.59Å; E57-R182 PolarHBondContact OE1-NE 3.39Å; E57-R182 IonicContact OE1-NH2 3.95Å; E57-R182 PolarHBondContact OE1-NH2 3.37Å; E57-R182 IonicContact OE2-NE 3.52Å; S111-R182 WeakPolarHBondContact CB-O 3.44Å; S111-R182 PolarHBondContact O-NH1 3.34Å; T113-R182 PolarHBondContact O-NH1 3.29Å; T113-R182 PolarHBondContact O-NH2 3.22Å; G180-R182 PolarHBondContact O-N 3.34Å; R182-T184 VanDerWaalsContact C-N 3.29Å; R182-T184 PolarHBondContact O-N 3.15Å; R182-M185 PolarHBondContact O-N 3.44Å; R182-A186 PolarHBondContact O-N 2.97Å; R182-A186 VanDerWaalsContact O-N 3.17Å |
| 183 | H | 96 | Very high | 95.3 | Very high | 121 Ų | 121 | 46.1 Ų | 46.1 | 56% | 0.56 | 25% | 0.253 | S | S | * | . | H | α-helix | trans | -67.6 | -33.2 | 179.1 | -56.6 | 100.1 | 0 | 0 | 0 | 111.8 | I179 M185 A186 V187 | I179-H183 HydrophobicContact CB-CB 4.15Å; I179-H183 HydrophobicContact CD1-CB 3.66Å; I179-H183 HydrophobicContact CG1-CB 3.94Å; I179-H183 PolarHBondContact O-ND1 3.4Å; H183-M185 PolarHBondContact O-N 3.32Å; H183-A186 WeakPolarHBondContact O-CB 3.49Å; H183-A186 PolarHBondContact O-N 3.22Å; H183-V187 WeakPolarHBondContact O-CG2 3.36Å; H183-V187 PolarHBondContact O-N 3.43Å |
| 184 | T | 96.5 | Very high | 95.5 | Very high | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -62.2 | -42.5 | 174.2 | -58.6 | 0 | 0 | 0 | 0 | 111.5 | F50 F172 L175 R176 G180 W181 R182 A186 V187 I188 | F50-T184 HydrophobicContact CE1-CG2 3.67Å; F50-T184 HydrophobicContact CZ-CG2 3.71Å; F172-T184 HydrophobicContact CB-CG2 4.37Å; L175-T184 HydrophobicContact CB-CG2 4.32Å; L175-T184 HydrophobicContact CD2-CG2 4.2Å; L175-T184 HydrophobicContact CG-CG2 4.33Å; R176-T184 VanDerWaalsContact CA-OG1 3.23Å; R176-T184 WeakPolarHBondContact CA-OG1 3.23Å; R176-T184 HydrophobicContact CB-CG2 4.48Å; R176-T184 PolarHBondContact N-OG1 2.82Å; G180-T184 WeakPolarHBondContact O-CB 3.33Å; G180-T184 PolarHBondContact O-N 3.26Å; G180-T184 VanDerWaalsContact O-N 3.13Å; G180-T184 PolarHBondContact O-OG1 3.43Å; W181-T184 PolarHBondContact O-N 3.08Å; R182-T184 VanDerWaalsContact C-N 3.29Å; R182-T184 PolarHBondContact O-N 3.15Å; T184-A186 VanDerWaalsContact C-N 3.34Å; T184-A186 PolarHBondContact O-N 3.13Å; T184-V187 PolarHBondContact O-N 3.34Å; T184-I188 HydrophobicContact CG2-CD1 4.04Å; T184-I188 VanDerWaalsContact O-CG1 3.3Å; T184-I188 WeakPolarHBondContact O-CG1 3.2Å; T184-I188 PolarHBondContact O-N 2.85Å |
| 185 | M | 95.8 | Very high | 95.7 | Very high | 1 Ų | 1 | 44.3 Ų | 44.3 | 1% | 0.005 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -61.3 | -40.9 | 173.5 | -73.7 | -64.1 | -173.6 | 0 | 0 | 112.2 | F47 F50 M54 T107 W181 R182 H183 V187 I188 G189 | F47-M185 HydrophobicContact CD2-CE 4.13Å; F47-M185 HydrophobicContact CE2-CE 3.87Å; F50-M185 HydrophobicContact CB-CE 4.06Å; F50-M185 HydrophobicContact CD1-CE 4.24Å; F50-M185 HydrophobicContact CD2-CE 3.29Å; F50-M185 HydrophobicContact CD2-SD 4.46Å; F50-M185 HydrophobicContact CE2-CE 3.71Å; F50-M185 HydrophobicContact CE2-SD 4.32Å; F50-M185 HydrophobicContact CG-CE 3.59Å; F50-M185 HydrophobicContact CZ-CE 4.33Å; M54-M185 HydrophobicContact CE-CE 3.73Å; T107-M185 WeakPolarHBondContact CG2-O 3.29Å; T107-M185 HydrophobicContact CG2-SD 4.38Å; W181-M185 HydrophobicContact CE3-CG 4.19Å; W181-M185 WeakPolarHBondContact O-CG 3.24Å; W181-M185 PolarHBondContact O-N 3.47Å; R182-M185 PolarHBondContact O-N 3.44Å; H183-M185 PolarHBondContact O-N 3.32Å; M185-V187 VanDerWaalsContact C-N 3.34Å; M185-V187 PolarHBondContact O-N 3.13Å; M185-I188 PolarHBondContact O-N 2.8Å; M185-I188 HydrophobicContact SD-CD1 4.35Å; M185-G189 PolarHBondContact O-N 2.73Å |
| 186 | A | 97.3 | Very high | 95.8 | Very high | 27 Ų | 27 | 44 Ų | 44 | 22% | 0.223 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -61.4 | -42.1 | 175 | 0 | 0 | 0 | 0 | 0 | 112.1 | R182 H183 T184 G189 A190 | R182-A186 PolarHBondContact O-N 2.97Å; R182-A186 VanDerWaalsContact O-N 3.17Å; H183-A186 WeakPolarHBondContact O-CB 3.49Å; H183-A186 PolarHBondContact O-N 3.22Å; T184-A186 VanDerWaalsContact C-N 3.34Å; T184-A186 PolarHBondContact O-N 3.13Å; A186-G189 PolarHBondContact O-N 3.14Å; A186-A190 PolarHBondContact O-N 3.47Å |
| 187 | V | 97.2 | Very high | 95.8 | Very high | 56 Ų | 56 | 48.8 Ų | 48.8 | 34% | 0.339 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -64.9 | -43.1 | 175.3 | 174.2 | 0 | 0 | 0 | 0 | 111.3 | L175 I179 H183 T184 M185 G189 A190 L191 | L175-V187 HydrophobicContact CD2-CB 4.01Å; L175-V187 HydrophobicContact CD2-CG1 3.78Å; L175-V187 HydrophobicContact CD2-CG2 4.27Å; I179-V187 HydrophobicContact CD1-CG2 4.33Å; H183-V187 WeakPolarHBondContact O-CG2 3.36Å; H183-V187 PolarHBondContact O-N 3.43Å; T184-V187 PolarHBondContact O-N 3.34Å; M185-V187 VanDerWaalsContact C-N 3.34Å; M185-V187 PolarHBondContact O-N 3.13Å; V187-G189 VanDerWaalsContact C-N 3.35Å; V187-G189 PolarHBondContact O-N 3.15Å; V187-A190 WeakPolarHBondContact O-CB 3.33Å; V187-A190 PolarHBondContact O-N 2.93Å; V187-L191 HydrophobicContact CG1-CD1 4.27Å; V187-L191 WeakPolarHBondContact O-CG 3.44Å; V187-L191 PolarHBondContact O-N 3.01Å |
| 188 | I | 96.2 | Very high | 95.8 | Very high | 1 Ų | 1 | 43.9 Ų | 43.9 | 1% | 0.005 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -59.1 | -47.4 | 175.4 | -69.6 | 168.1 | 0 | 0 | 0 | 110.3 | I43 F50 T107 F172 T184 M185 A190 L191 Q192 | I43-I188 HydrophobicContact CD1-CG2 4.02Å; I43-I188 HydrophobicContact CG1-CG2 4.3Å; I43-I188 HydrophobicContact CG2-CG2 3.87Å; F50-I188 HydrophobicContact CE2-CD1 3.91Å; F50-I188 HydrophobicContact CZ-CD1 3.63Å; T107-I188 HydrophobicContact CG2-CB 4.44Å; T107-I188 HydrophobicContact CG2-CG2 4.17Å; F172-I188 HydrophobicContact CD1-CD1 4.11Å; F172-I188 HydrophobicContact CD1-CG1 3.84Å; F172-I188 HydrophobicContact CD2-CD1 4.02Å; F172-I188 HydrophobicContact CD2-CG1 4.31Å; F172-I188 HydrophobicContact CE1-CD1 4.29Å; F172-I188 HydrophobicContact CE1-CG1 3.61Å; F172-I188 HydrophobicContact CE2-CD1 4.2Å; F172-I188 HydrophobicContact CE2-CG1 4.1Å; F172-I188 HydrophobicContact CG-CD1 3.98Å; F172-I188 HydrophobicContact CG-CG1 4.21Å; F172-I188 HydrophobicContact CZ-CD1 4.34Å; F172-I188 HydrophobicContact CZ-CG1 3.74Å; T184-I188 HydrophobicContact CG2-CD1 4.04Å; T184-I188 VanDerWaalsContact O-CG1 3.3Å; T184-I188 WeakPolarHBondContact O-CG1 3.2Å; T184-I188 PolarHBondContact O-N 2.85Å; M185-I188 PolarHBondContact O-N 2.8Å; M185-I188 HydrophobicContact SD-CD1 4.35Å; I188-A190 VanDerWaalsContact C-N 3.29Å; I188-A190 PolarHBondContact O-N 2.76Å; I188-L191 WeakPolarHBondContact O-CB 3.49Å; I188-L191 PolarHBondContact O-N 3.5Å; I188-L191 VanDerWaalsContact O-N 3.12Å; I188-Q192 HydrophobicContact CG2-CG 4.31Å; I188-Q192 WeakPolarHBondContact O-CG 3.47Å; I188-Q192 PolarHBondContact O-N 2.67Å |
| 189 | G | 96.8 | Very high | 95.6 | Very high | 0 Ų | 0 | 35.8 Ų | 35.8 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -63.2 | -34.3 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | S104 M185 A186 V187 Q192 S193 | S104-G189 WeakPolarHBondContact CA-O 3.43Å; S104-G189 VanDerWaalsContact CB-O 3.31Å; S104-G189 WeakPolarHBondContact CB-O 3.15Å; S104-G189 PolarHBondContact OG-O 3.35Å; M185-G189 PolarHBondContact O-N 2.73Å; A186-G189 PolarHBondContact O-N 3.14Å; V187-G189 VanDerWaalsContact C-N 3.35Å; V187-G189 PolarHBondContact O-N 3.15Å; G189-Q192 PolarHBondContact O-N 3.05Å; G189-S193 PolarHBondContact O-N 3.11Å |
| 190 | A | 96.9 | Very high | 95.4 | Very high | 51 Ų | 51 | 34.8 Ų | 34.8 | 42% | 0.421 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -66.4 | -42.3 | 171.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | A186 V187 I188 Q192 S193 | A186-A190 PolarHBondContact O-N 3.47Å; V187-A190 WeakPolarHBondContact O-CB 3.33Å; V187-A190 PolarHBondContact O-N 2.93Å; I188-A190 VanDerWaalsContact C-N 3.29Å; I188-A190 PolarHBondContact O-N 2.76Å; A190-Q192 VanDerWaalsContact C-N 3.34Å; A190-Q192 PolarHBondContact O-N 3.29Å; A190-S193 VanDerWaalsContact O-CB 3.25Å; A190-S193 WeakPolarHBondContact O-CB 3.44Å; A190-S193 PolarHBondContact O-N 3.28Å; A190-S193 PolarHBondContact O-OG 2.63Å |
| 191 | L | 95.9 | Very high | 95.2 | Very high | 69 Ų | 69 | 36 Ų | 36 | 36% | 0.361 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -63.5 | -39 | 174.7 | -69.5 | 171.7 | 0 | 0 | 0 | 112.1 | F39 F172 V187 I188 S193 V194 | F39-L191 HydrophobicContact CE1-CB 3.83Å; F39-L191 HydrophobicContact CZ-CB 4.37Å; F172-L191 HydrophobicContact CE1-CD1 3.94Å; F172-L191 HydrophobicContact CZ-CD1 4.28Å; V187-L191 HydrophobicContact CG1-CD1 4.27Å; V187-L191 WeakPolarHBondContact O-CG 3.44Å; V187-L191 PolarHBondContact O-N 3.01Å; I188-L191 WeakPolarHBondContact O-CB 3.49Å; I188-L191 PolarHBondContact O-N 3.5Å; I188-L191 VanDerWaalsContact O-N 3.12Å; L191-S193 PolarHBondContact O-N 3.32Å; L191-S193 VanDerWaalsContact O-N 3.14Å; L191-V194 WeakPolarHBondContact O-CB 3.28Å; L191-V194 VanDerWaalsContact O-CG2 3.27Å; L191-V194 WeakPolarHBondContact O-CG2 3.43Å; L191-V194 PolarHBondContact O-N 3.43Å; L191-V194 VanDerWaalsContact O-N 3.16Å |
| 192 | Q | 96.7 | Very high | 94.8 | Very high | 0 Ų | 0 | 35.4 Ų | 35.4 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -64.3 | -16 | 177 | -71.9 | 176.5 | -47.9 | 0 | 0 | 113.5 | F39 I103 T107 Y131 I188 G189 A190 V194 I195 | F39-Q192 HydrophobicContact CB-CG 4.18Å; F39-Q192 HydrophobicContact CD1-CG 4.32Å; F39-Q192 PolarHBondContact O-NE2 3.49Å; I103-Q192 HydrophobicContact CG2-CB 3.75Å; I103-Q192 HydrophobicContact CG2-CG 3.99Å; T107-Q192 PolarHBondContact OG1-OE1 3.38Å; Y131-Q192 PolarHBondContact OH-NE2 2.97Å; I188-Q192 HydrophobicContact CG2-CG 4.31Å; I188-Q192 WeakPolarHBondContact O-CG 3.47Å; I188-Q192 PolarHBondContact O-N 2.67Å; G189-Q192 PolarHBondContact O-N 3.05Å; A190-Q192 VanDerWaalsContact C-N 3.34Å; A190-Q192 PolarHBondContact O-N 3.29Å; Q192-V194 PolarHBondContact O-N 3.24Å; Q192-V194 VanDerWaalsContact O-N 3.16Å; Q192-I195 WeakPolarHBondContact O-CB 3.42Å; Q192-I195 VanDerWaalsContact O-CG1 3.31Å; Q192-I195 WeakPolarHBondContact O-CG1 3.29Å; Q192-I195 PolarHBondContact O-N 3.32Å; Q192-I195 VanDerWaalsContact O-N 3.07Å |
| 193 | S | 96.5 | Very high | 94.1 | Very high | 46 Ų | 46 | 34.6 Ų | 34.6 | 32% | 0.322 | 20% | 0.195 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -61.3 | -20.4 | 173 | 74.3 | 0 | 0 | 0 | 0 | 113.4 | G189 A190 L191 I195 I196 | G189-S193 PolarHBondContact O-N 3.11Å; A190-S193 VanDerWaalsContact O-CB 3.25Å; A190-S193 WeakPolarHBondContact O-CB 3.44Å; A190-S193 PolarHBondContact O-N 3.28Å; A190-S193 PolarHBondContact O-OG 2.63Å; L191-S193 PolarHBondContact O-N 3.32Å; L191-S193 VanDerWaalsContact O-N 3.14Å; S193-I195 PolarHBondContact O-N 2.99Å; S193-I195 VanDerWaalsContact O-N 3.1Å; S193-I196 VanDerWaalsContact O-CB 3.27Å; S193-I196 WeakPolarHBondContact O-CB 3.21Å; S193-I196 WeakPolarHBondContact O-CG1 3.31Å; S193-I196 PolarHBondContact O-N 3.32Å |
| 194 | V | 96.3 | Very high | 93.2 | Very high | 46 Ų | 46 | 29.5 Ų | 29.5 | 28% | 0.279 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -55.7 | -26.4 | 172.2 | 172.7 | 0 | 0 | 0 | 0 | 112 | L35 F39 L191 Q192 I196 I197 C198 | L35-V194 HydrophobicContact CD1-CG1 4.4Å; F39-V194 HydrophobicContact CD2-CB 4.42Å; F39-V194 HydrophobicContact CE2-CB 4.06Å; F39-V194 HydrophobicContact CE2-CG1 4.12Å; F39-V194 HydrophobicContact CE2-CG2 4.46Å; L191-V194 WeakPolarHBondContact O-CB 3.28Å; L191-V194 VanDerWaalsContact O-CG2 3.27Å; L191-V194 WeakPolarHBondContact O-CG2 3.43Å; L191-V194 PolarHBondContact O-N 3.43Å; L191-V194 VanDerWaalsContact O-N 3.16Å; Q192-V194 PolarHBondContact O-N 3.24Å; Q192-V194 VanDerWaalsContact O-N 3.16Å; V194-I196 PolarHBondContact O-N 3.31Å; V194-I197 WeakPolarHBondContact O-CB 3.26Å; V194-I197 PolarHBondContact O-N 3.28Å; V194-I197 VanDerWaalsContact O-N 3.14Å; V194-C198 PolarHBondContact O-N 3.13Å; V194-C198 PolarHBondContact O-SG 2.78Å |
| 195 | I | 95.8 | Very high | 92.3 | Very high | 0 Ų | 0 | 30.2 Ų | 30.2 | 0% | 0 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -60.8 | -31.4 | 175.3 | -63.3 | 170.8 | 0 | 0 | 0 | 111.7 | V36 F39 T40 V96 I103 T134 Q192 S193 I197 C198 G199 | V36-I195 HydrophobicContact CG2-CG2 4.2Å; F39-I195 HydrophobicContact CB-CD1 3.83Å; F39-I195 HydrophobicContact CB-CG1 4.06Å; T40-I195 HydrophobicContact CG2-CD1 3.91Å; V96-I195 HydrophobicContact CG1-CG2 4.25Å; I103-I195 HydrophobicContact CD1-CD1 3.74Å; I103-I195 HydrophobicContact CG2-CD1 4.48Å; T134-I195 HydrophobicContact CG2-CG2 3.53Å; Q192-I195 WeakPolarHBondContact O-CB 3.42Å; Q192-I195 VanDerWaalsContact O-CG1 3.31Å; Q192-I195 WeakPolarHBondContact O-CG1 3.29Å; Q192-I195 PolarHBondContact O-N 3.32Å; Q192-I195 VanDerWaalsContact O-N 3.07Å; S193-I195 PolarHBondContact O-N 2.99Å; S193-I195 VanDerWaalsContact O-N 3.1Å; I195-I197 VanDerWaalsContact C-N 3.33Å; I195-I197 PolarHBondContact O-N 2.97Å; I195-C198 WeakPolarHBondContact O-CB 3.4Å; I195-C198 PolarHBondContact O-N 2.83Å; I195-G199 PolarHBondContact O-N 3.45Å |
| 196 | I | 96.2 | Very high | 91.2 | Very high | 39 Ų | 39 | 34.4 Ų | 34.4 | 20% | 0.2 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -63.6 | -43.6 | 177.4 | -57.4 | 166.1 | 0 | 0 | 0 | 109.8 | M97 L101 S193 V194 C198 G199 V200 | M97-I196 HydrophobicContact CB-CG2 4.45Å; M97-I196 HydrophobicContact CE-CG2 4.42Å; M97-I196 HydrophobicContact CG-CG2 4.25Å; L101-I196 HydrophobicContact CD2-CD1 3.48Å; L101-I196 VanDerWaalsContact CD2-CD1 3.48Å; L101-I196 HydrophobicContact CD2-CG1 4.44Å; L101-I196 HydrophobicContact CG-CD1 3.77Å; L101-I196 HydrophobicContact CG-CG1 4.21Å; S193-I196 VanDerWaalsContact O-CB 3.27Å; S193-I196 WeakPolarHBondContact O-CB 3.21Å; S193-I196 WeakPolarHBondContact O-CG1 3.31Å; S193-I196 PolarHBondContact O-N 3.32Å; V194-I196 PolarHBondContact O-N 3.31Å; I196-C198 VanDerWaalsContact C-N 3.34Å; I196-G199 PolarHBondContact O-N 3.37Å; I196-V200 PolarHBondContact O-N 3.17Å |
| 197 | I | 94.7 | Very high | 89.8 | Confident | 109 Ų | 109 | 36.9 Ų | 36.9 | 56% | 0.559 | 21% | 0.206 | S | C | * | . | H | α-helix | trans | -63.7 | -42.7 | 175.5 | -56.8 | 173.6 | 0 | 0 | 0 | 109.8 | V194 I195 G199 V200 L201 | V194-I197 WeakPolarHBondContact O-CB 3.26Å; V194-I197 PolarHBondContact O-N 3.28Å; V194-I197 VanDerWaalsContact O-N 3.14Å; I195-I197 VanDerWaalsContact C-N 3.33Å; I195-I197 PolarHBondContact O-N 2.97Å; I197-G199 VanDerWaalsContact C-N 3.27Å; I197-G199 PolarHBondContact O-N 3.44Å; I197-V200 WeakPolarHBondContact O-CB 3.37Å; I197-V200 PolarHBondContact O-N 3.15Å; I197-V200 VanDerWaalsContact O-N 3.11Å; I197-L201 PolarHBondContact O-N 3.22Å |
| 198 | C | 92.9 | Very high | 87.6 | Confident | 3 Ų | 3 | 39.9 Ų | 39.9 | 2% | 0.02 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -57 | -42 | 174.9 | -63.3 | 0 | 0 | 0 | 0 | 111.4 | A32 V36 V194 I195 I196 V200 L201 L202 | A32-C198 HydrophobicContact CB-CB 4.12Å; V36-C198 HydrophobicContact CG2-CB 4.13Å; V194-C198 PolarHBondContact O-N 3.13Å; V194-C198 PolarHBondContact O-SG 2.78Å; I195-C198 WeakPolarHBondContact O-CB 3.4Å; I195-C198 PolarHBondContact O-N 2.83Å; I196-C198 VanDerWaalsContact C-N 3.34Å; C198-V200 VanDerWaalsContact C-N 3.32Å; C198-V200 PolarHBondContact O-N 2.93Å; C198-L201 WeakPolarHBondContact O-CB 3.47Å; C198-L201 PolarHBondContact O-N 2.87Å; C198-L201 VanDerWaalsContact O-N 3.07Å; C198-L202 WeakPolarHBondContact O-CG 3.39Å; C198-L202 PolarHBondContact O-N 2.78Å |
| 199 | G | 90.1 | Very high | 85 | Confident | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -57.7 | -40 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | Q93 I195 I196 I197 L201 L202 | Q93-G199 WeakPolarHBondContact CA-O 3.47Å; Q93-G199 WeakPolarHBondContact CB-O 3.41Å; Q93-G199 WeakPolarHBondContact CG-O 3.18Å; I195-G199 PolarHBondContact O-N 3.45Å; I196-G199 PolarHBondContact O-N 3.37Å; I197-G199 VanDerWaalsContact C-N 3.27Å; I197-G199 PolarHBondContact O-N 3.44Å; G199-L201 VanDerWaalsContact C-N 3.3Å; G199-L201 PolarHBondContact O-N 3.3Å; G199-L202 PolarHBondContact O-N 3.1Å |
| 200 | V | 90.6 | Very high | 82 | Confident | 49 Ų | 49 | 55 Ų | 55 | 30% | 0.297 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -63.3 | -37.4 | 175.5 | 179.2 | 0 | 0 | 0 | 0 | 111.3 | F11 L12 Q93 M97 I196 I197 C198 L202 | F11-V200 HydrophobicContact CB-CG1 4.36Å; L12-V200 WeakPolarHBondContact CD1-O 3.39Å; Q93-V200 PolarHBondContact NE2-O 3.03Å; M97-V200 HydrophobicContact CE-CG2 4.3Å; M97-V200 HydrophobicContact CG-CG2 4.38Å; M97-V200 HydrophobicContact SD-CG2 3.82Å; I196-V200 PolarHBondContact O-N 3.17Å; I197-V200 WeakPolarHBondContact O-CB 3.37Å; I197-V200 PolarHBondContact O-N 3.15Å; I197-V200 VanDerWaalsContact O-N 3.11Å; C198-V200 VanDerWaalsContact C-N 3.32Å; C198-V200 PolarHBondContact O-N 2.93Å; V200-L202 PolarHBondContact O-N 2.85Å |
| 201 | L | 90.2 | Very high | 79.1 | Confident | 57 Ų | 57 | 59.4 Ų | 59.4 | 30% | 0.298 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -69.8 | -17.6 | -179 | -63.5 | 172.3 | 0 | 0 | 0 | 114 | W25 V28 I197 C198 G199 R203 | W25-L201 PolarHBondContact NE1-O 2.74Å; W25-L201 VanDerWaalsContact NE1-O 3.08Å; V28-L201 HydrophobicContact CG1-CB 4.28Å; V28-L201 HydrophobicContact CG1-CD1 4.42Å; V28-L201 HydrophobicContact CG1-CD2 4.27Å; I197-L201 PolarHBondContact O-N 3.22Å; C198-L201 WeakPolarHBondContact O-CB 3.47Å; C198-L201 PolarHBondContact O-N 2.87Å; C198-L201 VanDerWaalsContact O-N 3.07Å; G199-L201 VanDerWaalsContact C-N 3.3Å; G199-L201 PolarHBondContact O-N 3.3Å; L201-R203 VanDerWaalsContact C-N 3.27Å; L201-R203 PolarHBondContact O-N 2.87Å |
| 202 | L | 85.9 | Confident | 75.9 | Confident | 1 Ų | 1 | 60 Ų | 60 | 1% | 0.005 | 31% | 0.309 | C | S | . | . | trans | -73.5 | 74.3 | -177.9 | -59 | -175.5 | 0 | 0 | 0 | 112.4 | V29 A32 Q93 V96 T138 I141 C198 G199 V200 P204 | V29-L202 HydrophobicContact CG1-CD2 4.05Å; A32-L202 HydrophobicContact CB-CD2 3.94Å; Q93-L202 HydrophobicContact CG-CB 4.38Å; Q93-L202 WeakPolarHBondContact CG-O 3.37Å; V96-L202 HydrophobicContact CB-CD1 3.98Å; V96-L202 HydrophobicContact CG1-CD1 4.03Å; V96-L202 HydrophobicContact CG2-CD1 3.56Å; T138-L202 HydrophobicContact CG2-CD1 4.19Å; T138-L202 HydrophobicContact CG2-CD2 4.01Å; I141-L202 HydrophobicContact CD1-CB 3.98Å; I141-L202 HydrophobicContact CG2-CD1 4.38Å; I141-L202 HydrophobicContact CG2-CD2 4.01Å; C198-L202 WeakPolarHBondContact O-CG 3.39Å; C198-L202 PolarHBondContact O-N 2.78Å; G199-L202 PolarHBondContact O-N 3.1Å; V200-L202 PolarHBondContact O-N 2.85Å; L202-P204 WeakPolarHBondContact O-CD 3.28Å | ||
| 203 | R | 82.3 | Confident | 73 | Confident | 50 Ų | 50 | 67.4 Ų | 67.4 | 19% | 0.189 | 34% | 0.344 | C | S | . | . | trans | -68.7 | 118.8 | -178.6 | -173.3 | 178.2 | -168.8 | 162.2 | 9.9 | 111.4 | L12 G13 I141 Y145 L201 | L12-R203 HydrophobicContact CB-CB 4.28Å; L12-R203 HydrophobicContact CB-CG 4Å; L12-R203 HydrophobicContact CD1-CB 4.16Å; G13-R203 PolarHBondContact O-NE 2.96Å; G13-R203 PolarHBondContact O-NH2 2.71Å; I141-R203 WeakPolarHBondContact CD1-O 3.36Å; Y145-R203 WeakPolarHBondContact CE2-O 3.09Å; Y145-R203 PolarHBondContact OH-O 2.98Å; L201-R203 VanDerWaalsContact C-N 3.27Å; L201-R203 PolarHBondContact O-N 2.87Å | ||
| 204 | P | 76.8 | Confident | 69.8 | Low | 15 Ų | 15 | 68.8 Ų | 68.8 | 10% | 0.097 | 35% | 0.354 | C | S | . | . | trans | -65.8 | 143.8 | 179.7 | 26.1 | -32.1 | 0 | 0 | 0 | 111.5 | A14 K15 L202 | A14-P204 VanDerWaalsContact CA-O 3.31Å; A14-P204 WeakPolarHBondContact CA-O 3.46Å; A14-P204 HydrophobicContact CB-CG 4.15Å; K15-P204 PolarHBondContact N-O 3.48Å; L202-P204 WeakPolarHBondContact O-CD 3.28Å | ||
| 205 | I | 78.4 | Confident | 67 | Low | 15 Ų | 15 | 71.5 Ų | 71.5 | 8% | 0.077 | 36% | 0.363 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.8 | 139.6 | 176.4 | 56 | 171.4 | 0 | 0 | 0 | 111.1 | K15 Y17 K144 Y145 | K15-I205 WeakPolarHBondContact O-CA 3.32Å; Y17-I205 HydrophobicContact CD2-CB 4.14Å; Y17-I205 HydrophobicContact CD2-CG2 3.8Å; Y17-I205 HydrophobicContact CE2-CB 4.42Å; Y17-I205 HydrophobicContact CE2-CG2 3.58Å; K144-I205 HydrophobicContact CB-CD1 3.75Å; K144-I205 HydrophobicContact CB-CG1 4.12Å; K144-I205 WeakPolarHBondContact O-CD1 3.48Å; Y145-I205 HydrophobicContact CD1-CD1 4.37Å; Y145-I205 HydrophobicContact CD2-CD1 3.81Å; Y145-I205 HydrophobicContact CD2-CG1 4.33Å; Y145-I205 HydrophobicContact CE1-CG2 3.88Å; Y145-I205 HydrophobicContact CE2-CD1 4Å; Y145-I205 HydrophobicContact CE2-CG1 4.1Å; Y145-I205 HydrophobicContact CE2-CG2 3.74Å; Y145-I205 HydrophobicContact CG-CD1 4.01Å; Y145-I205 VanDerWaalsContact OH-CG2 3.25Å; Y145-I205 WeakPolarHBondContact OH-CG2 3.44Å |
| 206 | I | 72.5 | Confident | 63.9 | Low | 89 Ų | 89 | 77.3 Ų | 77.3 | 46% | 0.456 | 39% | 0.394 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.3 | 111.8 | 173.1 | -57.7 | 172 | 0 | 0 | 0 | 106.6 | A14 K15 Q16 Y17 K208 | A14-I206 HydrophobicContact CB-CD1 4.05Å; A14-I206 HydrophobicContact CB-CG1 4.3Å; K15-I206 PolarHBondContact O-N 2.88Å; Q16-I206 WeakPolarHBondContact CA-O 2.93Å; Y17-I206 PolarHBondContact N-O 3.26Å; Y17-I206 VanDerWaalsContact N-O 3.08Å; I206-K208 HydrophobicContact CG2-CG 4.11Å |
| 207 | I | 66.9 | Low | 61.2 | Low | 78 Ų | 78 | 80.3 Ų | 80.3 | 40% | 0.4 | 41% | 0.41 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.2 | 109 | 174.8 | -56.6 | 173.1 | 0 | 0 | 0 | 106.8 | Y17 | Y17-I207 WeakPolarHBondContact O-CA 3.38Å |
| 208 | K | 51.4 | Low | 58.4 | Low | 120 Ų | 120 | 81.6 Ų | 81.6 | 52% | 0.522 | 41% | 0.413 | S | S | . | . | trans | -104.3 | 113.4 | 167.6 | -66.7 | -161.3 | -168.6 | 172.2 | 0 | 107.4 | Y17 S18 I206 R210 | Y17-K208 PolarHBondContact O-N 3.05Å; Y17-K208 VanDerWaalsContact O-N 3.1Å; S18-K208 WeakPolarHBondContact CA-O 3.28Å; I206-K208 HydrophobicContact CG2-CG 4.11Å; K208-R210 PolarHBondContact O-N 3.05Å | ||
| 209 | P | 41.4 | Very low | 55.8 | Low | 109 Ų | 109 | 84.5 Ų | 84.5 | 71% | 0.708 | 43% | 0.431 | S | S | * | . | trans | -57.6 | 131.8 | 175.6 | 22.2 | -29.6 | 0 | 0 | 0 | 108.9 | M211 | P209-M211 PolarHBondContact O-N 2.72Å; P209-M211 VanDerWaalsContact O-N 3.13Å | ||
| 210 | R | 33.3 | Very low | 53.1 | Low | 208 Ų | 208 | 87.6 Ų | 87.6 | 79% | 0.785 | 45% | 0.453 | S | S | * | . | trans | -64.9 | 114.1 | 171.1 | -169.7 | 177.1 | -172.6 | 167.6 | 1.5 | 106.1 | K208 S212 | K208-R210 PolarHBondContact O-N 3.05Å; R210-S212 VanDerWaalsContact C-N 3.26Å; R210-S212 PolarHBondContact O-N 3.4Å | ||
| 211 | M | 36.4 | Very low | 50.8 | Low | 145 Ų | 145 | 93 Ų | 93 | 71% | 0.714 | 47% | 0.469 | S | S | * | . | trans | -60.9 | 97.3 | 164.2 | -62.2 | -169.2 | -37.5 | 0 | 0 | 106.7 | P209 Q213 | P209-M211 PolarHBondContact O-N 2.72Å; P209-M211 VanDerWaalsContact O-N 3.13Å; M211-Q213 PolarHBondContact O-N 3.17Å | ||
| 212 | S | 29.1 | Very low | 48.5 | Very low | 81 Ų | 81 | 92.7 Ų | 92.7 | 57% | 0.566 | 47% | 0.472 | S | S | * | . | trans | -79.9 | 107.6 | 177.1 | 47.7 | 0 | 0 | 0 | 0 | 108 | R210 S214 | R210-S212 VanDerWaalsContact C-N 3.26Å; R210-S212 PolarHBondContact O-N 3.4Å; S212-S214 PolarHBondContact O-N 3.31Å; S212-S214 PolarHBondContact O-OG 2.89Å | ||
| 213 | Q | 34.3 | Very low | 46.5 | Very low | 156 Ų | 156 | 99.3 Ų | 99.3 | 73% | 0.729 | 50% | 0.5 | S | S | * | . | S | Bend | trans | 47.1 | -11.6 | 150.2 | -89.1 | 167.4 | -35 | 0 | 0 | 121.8 | M211 Q215 N216 I217 | M211-Q213 PolarHBondContact O-N 3.17Å; Q213-Q215 VanDerWaalsContact C-N 3.31Å; Q213-Q215 PolarHBondContact O-N 2.73Å; Q213-N216 PolarHBondContact O-N 3.13Å; Q213-I217 PolarHBondContact O-N 3.43Å |
| 214 | S | 31.2 | Very low | 44.7 | Very low | 75 Ų | 75 | 102.4 Ų | 102.4 | 52% | 0.524 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -69.5 | -30.7 | 177.4 | -50.4 | 0 | 0 | 0 | 0 | 111.7 | S212 N216 I217 E218 | S212-S214 PolarHBondContact O-N 3.31Å; S212-S214 PolarHBondContact O-OG 2.89Å; S214-N216 VanDerWaalsContact C-N 3.34Å; S214-N216 PolarHBondContact O-N 3.49Å; S214-I217 PolarHBondContact O-N 2.8Å; S214-E218 WeakPolarHBondContact O-CB 3.48Å; S214-E218 PolarHBondContact O-N 2.98Å |
| 215 | Q | 36.5 | Very low | 43.1 | Very low | 102 Ų | 102 | 106.6 Ų | 106.6 | 48% | 0.477 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -67 | -32.4 | 172.5 | -88.5 | -177.9 | -24.1 | 0 | 0 | 112.6 | Q213 I217 T219 | Q213-Q215 VanDerWaalsContact C-N 3.31Å; Q213-Q215 PolarHBondContact O-N 2.73Å; Q215-I217 VanDerWaalsContact C-N 3.31Å; Q215-T219 WeakPolarHBondContact O-CB 3.2Å; Q215-T219 PolarHBondContact O-N 3.26Å; Q215-T219 PolarHBondContact O-OG1 2.71Å |
| 216 | N | 31.8 | Very low | 41.5 | Very low | 123 Ų | 123 | 111.9 Ų | 111.9 | 66% | 0.658 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -72.7 | -29.1 | 175.7 | -80.7 | -3.9 | 0 | 0 | 0 | 111.7 | Q213 S214 S220 | Q213-N216 PolarHBondContact O-N 3.13Å; S214-N216 VanDerWaalsContact C-N 3.34Å; S214-N216 PolarHBondContact O-N 3.49Å; N216-S220 WeakPolarHBondContact O-CB 3.49Å; N216-S220 PolarHBondContact O-N 3.41Å; N216-S220 VanDerWaalsContact O-N 3.12Å |
| 217 | I | 39 | Very low | 40.1 | Very low | 101 Ų | 101 | 110.3 Ų | 110.3 | 52% | 0.518 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -76.6 | -47.3 | 175 | -60.8 | 172.9 | 0 | 0 | 0 | 109.8 | Q213 S214 Q215 T219 S220 Y221 | Q213-I217 PolarHBondContact O-N 3.43Å; S214-I217 PolarHBondContact O-N 2.8Å; Q215-I217 VanDerWaalsContact C-N 3.31Å; I217-T219 PolarHBondContact O-N 3.1Å; I217-S220 PolarHBondContact O-N 3.12Å; I217-S220 VanDerWaalsContact O-N 3.17Å; I217-Y221 HydrophobicContact CG2-CD2 3.6Å; I217-Y221 HydrophobicContact CG2-CE2 3.72Å; I217-Y221 WeakPolarHBondContact O-CB 3.31Å; I217-Y221 WeakPolarHBondContact O-CD2 3.36Å; I217-Y221 PolarHBondContact O-N 3.36Å |
| 218 | E | 35.5 | Very low | 39 | Very low | 136 Ų | 136 | 112.3 Ų | 112.3 | 64% | 0.636 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -62.7 | -38.8 | 175.9 | -80.9 | 175.3 | 157.5 | 0 | 0 | 112.7 | S214 S220 S222 | S214-E218 WeakPolarHBondContact O-CB 3.48Å; S214-E218 PolarHBondContact O-N 2.98Å; E218-S220 VanDerWaalsContact C-N 3.33Å; E218-S222 VanDerWaalsContact O-CB 3.25Å; E218-S222 WeakPolarHBondContact O-CB 3.4Å; E218-S222 PolarHBondContact O-N 3.42Å; E218-S222 PolarHBondContact O-OG 3.32Å |
| 219 | T | 38.7 | Very low | 38.5 | Very low | 65 Ų | 65 | 112.5 Ų | 112.5 | 40% | 0.399 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -73.6 | -25.6 | 176.5 | -44.1 | 0 | 0 | 0 | 0 | 111.9 | Q215 I217 S222 K223 | Q215-T219 WeakPolarHBondContact O-CB 3.2Å; Q215-T219 PolarHBondContact O-N 3.26Å; Q215-T219 PolarHBondContact O-OG1 2.71Å; I217-T219 PolarHBondContact O-N 3.1Å; T219-S222 WeakPolarHBondContact CA-OG 3.26Å; T219-S222 PolarHBondContact O-OG 3.14Å; T219-K223 WeakPolarHBondContact O-CB 3.16Å; T219-K223 VanDerWaalsContact O-CG 3.25Å; T219-K223 WeakPolarHBondContact O-CG 3.3Å; T219-K223 PolarHBondContact O-N 3.45Å |
| 220 | S | 33.4 | Very low | 38.5 | Very low | 65 Ų | 65 | 111.6 Ų | 111.6 | 46% | 0.455 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -78.6 | -42.5 | 174.2 | -158.1 | 0 | 0 | 0 | 0 | 111.2 | N216 I217 E218 K223 E224 | N216-S220 WeakPolarHBondContact O-CB 3.49Å; N216-S220 PolarHBondContact O-N 3.41Å; N216-S220 VanDerWaalsContact O-N 3.12Å; I217-S220 PolarHBondContact O-N 3.12Å; I217-S220 VanDerWaalsContact O-N 3.17Å; E218-S220 VanDerWaalsContact C-N 3.33Å; S220-K223 PolarHBondContact O-N 2.9Å; S220-E224 PolarHBondContact O-N 3.3Å |
| 221 | Y | 41.9 | Very low | 38.7 | Very low | 161 Ų | 161 | 108.1 Ų | 108.1 | 63% | 0.631 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -65.6 | -38.2 | 173.7 | -91.9 | -83.8 | 0 | 0 | 0 | 112.1 | I217 L225 | I217-Y221 HydrophobicContact CG2-CD2 3.6Å; I217-Y221 HydrophobicContact CG2-CE2 3.72Å; I217-Y221 WeakPolarHBondContact O-CB 3.31Å; I217-Y221 WeakPolarHBondContact O-CD2 3.36Å; I217-Y221 PolarHBondContact O-N 3.36Å; Y221-L225 VanDerWaalsContact O-CB 3.22Å; Y221-L225 WeakPolarHBondContact O-CB 3.19Å; Y221-L225 PolarHBondContact O-N 2.88Å |
| 222 | S | 41.6 | Very low | 38.7 | Very low | 52 Ų | 52 | 108.1 Ų | 108.1 | 36% | 0.364 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -68.7 | -36.5 | 176.5 | 71.4 | 0 | 0 | 0 | 0 | 112 | E218 T219 L225 E226 | E218-S222 VanDerWaalsContact O-CB 3.25Å; E218-S222 WeakPolarHBondContact O-CB 3.4Å; E218-S222 PolarHBondContact O-N 3.42Å; E218-S222 PolarHBondContact O-OG 3.32Å; T219-S222 WeakPolarHBondContact CA-OG 3.26Å; T219-S222 PolarHBondContact O-OG 3.14Å; S222-L225 PolarHBondContact O-N 3.43Å; S222-E226 WeakPolarHBondContact O-CB 3.41Å; S222-E226 WeakPolarHBondContact O-CG 3.42Å; S222-E226 PolarHBondContact O-N 2.76Å |
| 223 | K | 43.4 | Very low | 39 | Very low | 139 Ų | 139 | 109.5 Ų | 109.5 | 60% | 0.604 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -71 | -38.5 | 175.4 | -80.1 | 179.9 | 177.2 | -175.5 | 0 | 113.1 | T219 S220 A227 | T219-K223 WeakPolarHBondContact O-CB 3.16Å; T219-K223 VanDerWaalsContact O-CG 3.25Å; T219-K223 WeakPolarHBondContact O-CG 3.3Å; T219-K223 PolarHBondContact O-N 3.45Å; S220-K223 PolarHBondContact O-N 2.9Å; K223-A227 WeakPolarHBondContact O-CB 3Å; K223-A227 PolarHBondContact O-N 3.43Å |
| 224 | E | 46 | Very low | 39.2 | Very low | 116 Ų | 116 | 106.1 Ų | 106.1 | 54% | 0.542 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -66.4 | -38.9 | 172.4 | -84.4 | 178.6 | 150.5 | 0 | 0 | 111.6 | S220 A227 L228 | S220-E224 PolarHBondContact O-N 3.3Å; E224-A227 PolarHBondContact O-N 3.06Å; E224-L228 PolarHBondContact O-N 3.28Å |
| 225 | L | 41.5 | Very low | 39.3 | Very low | 102 Ų | 102 | 108 Ų | 108 | 53% | 0.534 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -70.6 | -32.5 | 177.8 | -160 | 75.9 | 0 | 0 | 0 | 112.8 | Y221 S222 K229 | Y221-L225 VanDerWaalsContact O-CB 3.22Å; Y221-L225 WeakPolarHBondContact O-CB 3.19Å; Y221-L225 PolarHBondContact O-N 2.88Å; S222-L225 PolarHBondContact O-N 3.43Å; L225-K229 VanDerWaalsContact O-CG 3.31Å; L225-K229 WeakPolarHBondContact O-CG 3.37Å; L225-K229 PolarHBondContact O-N 2.75Å |
| 226 | E | 44.6 | Very low | 39.2 | Very low | 127 Ų | 127 | 106.4 Ų | 106.4 | 59% | 0.593 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -73 | -37.3 | 171.9 | -79.5 | 180 | 175.3 | 0 | 0 | 112.2 | S222 K229 T230 | S222-E226 WeakPolarHBondContact O-CB 3.41Å; S222-E226 WeakPolarHBondContact O-CG 3.42Å; S222-E226 PolarHBondContact O-N 2.76Å; E226-K229 PolarHBondContact O-N 3.18Å; E226-T230 PolarHBondContact O-N 3.47Å; E226-T230 PolarHBondContact O-OG1 3.32Å |
| 227 | A | 44.9 | Very low | 39.5 | Very low | 55 Ų | 55 | 107 Ų | 107 | 46% | 0.455 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -64.1 | -41.1 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112 | K223 E224 T230 Q231 | K223-A227 WeakPolarHBondContact O-CB 3Å; K223-A227 PolarHBondContact O-N 3.43Å; E224-A227 PolarHBondContact O-N 3.06Å; A227-T230 PolarHBondContact O-N 2.68Å; A227-Q231 PolarHBondContact O-N 2.97Å |
| 228 | L | 42.4 | Very low | 39.2 | Very low | 120 Ų | 120 | 107.7 Ų | 107.7 | 63% | 0.628 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -64.2 | -40.6 | 175 | -92.9 | 147.2 | 0 | 0 | 0 | 113.1 | E224 Q231 E232 | E224-L228 PolarHBondContact O-N 3.28Å; L228-Q231 PolarHBondContact O-N 2.88Å; L228-E232 PolarHBondContact O-N 3.41Å |
| 229 | K | 41.4 | Very low | 39.1 | Very low | 124 Ų | 124 | 108.8 Ų | 108.8 | 54% | 0.539 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -69.7 | -31.3 | 176.4 | -75 | 176.1 | 179.2 | -176.7 | 0 | 113.4 | L225 E226 Q231 N233 | L225-K229 VanDerWaalsContact O-CG 3.31Å; L225-K229 WeakPolarHBondContact O-CG 3.37Å; L225-K229 PolarHBondContact O-N 2.75Å; E226-K229 PolarHBondContact O-N 3.18Å; K229-Q231 VanDerWaalsContact C-N 3.26Å; K229-N233 PolarHBondContact O-N 3.39Å |
| 230 | T | 40.4 | Very low | 38.7 | Very low | 90 Ų | 90 | 114 Ų | 114 | 55% | 0.552 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -69.2 | -31.6 | 175.5 | -49 | 0 | 0 | 0 | 0 | 110.6 | E226 A227 V234 | E226-T230 PolarHBondContact O-N 3.47Å; E226-T230 PolarHBondContact O-OG1 3.32Å; A227-T230 PolarHBondContact O-N 2.68Å; T230-V234 VanDerWaalsContact O-CG2 3.27Å; T230-V234 WeakPolarHBondContact O-CG2 3.49Å; T230-V234 PolarHBondContact O-N 3.24Å |
| 231 | Q | 38 | Very low | 38.6 | Very low | 136 Ų | 136 | 118 Ų | 118 | 64% | 0.636 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -73.9 | -40.8 | 178.3 | -148.9 | 130.3 | -9.8 | 0 | 0 | 112.4 | A227 L228 K229 N233 V234 D235 | A227-Q231 PolarHBondContact O-N 2.97Å; L228-Q231 PolarHBondContact O-N 2.88Å; K229-Q231 VanDerWaalsContact C-N 3.26Å; Q231-N233 VanDerWaalsContact C-N 3.33Å; Q231-N233 PolarHBondContact O-N 3.01Å; Q231-V234 PolarHBondContact O-N 3.37Å; Q231-D235 PolarHBondContact O-N 2.92Å |
| 232 | E | 37.2 | Very low | 37.9 | Very low | 144 Ų | 144 | 118 Ų | 118 | 67% | 0.673 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -62.9 | -35.5 | 173.6 | -106.7 | 179.6 | 162.1 | 0 | 0 | 113.3 | L228 S236 | L228-E232 PolarHBondContact O-N 3.41Å; E232-S236 PolarHBondContact O-N 3.27Å; E232-S236 PolarHBondContact O-OG 2.72Å |
| 233 | N | 35.6 | Very low | 37.1 | Very low | 111 Ų | 111 | 123.8 Ų | 123.8 | 59% | 0.594 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -73.9 | -23.6 | 176.8 | -87.7 | -3.2 | 0 | 0 | 0 | 113.6 | K229 Q231 S236 L237 | K229-N233 PolarHBondContact O-N 3.39Å; Q231-N233 VanDerWaalsContact C-N 3.33Å; Q231-N233 PolarHBondContact O-N 3.01Å; N233-S236 WeakPolarHBondContact CA-OG 2.88Å; N233-S236 PolarHBondContact O-OG 3.26Å; N233-L237 VanDerWaalsContact O-CD1 3.31Å; N233-L237 WeakPolarHBondContact O-CD1 2.92Å; N233-L237 VanDerWaalsContact O-CG 3.32Å; N233-L237 WeakPolarHBondContact O-CG 3.38Å |
| 234 | V | 38.8 | Very low | 36.2 | Very low | 84 Ų | 84 | 122.4 Ų | 122.4 | 51% | 0.509 | 64% | 0.644 | S | S | . | * | H | α-helix | trans | -82.2 | -36.8 | 177 | 174.4 | 0 | 0 | 0 | 0 | 110.9 | T230 Q231 S236 L237 | T230-V234 VanDerWaalsContact O-CG2 3.27Å; T230-V234 WeakPolarHBondContact O-CG2 3.49Å; T230-V234 PolarHBondContact O-N 3.24Å; Q231-V234 PolarHBondContact O-N 3.37Å; V234-S236 VanDerWaalsContact C-N 3.33Å; V234-S236 PolarHBondContact O-N 3.4Å; V234-L237 PolarHBondContact O-N 2.75Å |
| 235 | D | 33 | Very low | 35.1 | Very low | 115 Ų | 115 | 122.3 Ų | 122.3 | 62% | 0.615 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -70.8 | -27.5 | 178.1 | -75 | -20.8 | 0 | 0 | 0 | 112.9 | Q231 | Q231-D235 PolarHBondContact O-N 2.92Å |
| 236 | S | 34.7 | Very low | 34.3 | Very low | 69 Ų | 69 | 125.1 Ų | 125.1 | 48% | 0.483 | 67% | 0.667 | S | S | . | * | H | α-helix | trans | -77.3 | -23.9 | 175.7 | 43.9 | 0 | 0 | 0 | 0 | 113.9 | E232 N233 V234 V238 | E232-S236 PolarHBondContact O-N 3.27Å; E232-S236 PolarHBondContact O-OG 2.72Å; N233-S236 WeakPolarHBondContact CA-OG 2.88Å; N233-S236 PolarHBondContact O-OG 3.26Å; V234-S236 VanDerWaalsContact C-N 3.33Å; V234-S236 PolarHBondContact O-N 3.4Å; S236-V238 VanDerWaalsContact C-N 3.34Å |
| 237 | L | 36.6 | Very low | 33.4 | Very low | 136 Ų | 136 | 122.9 Ų | 122.9 | 71% | 0.712 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81 | -10.7 | 178.2 | -74.4 | 168.3 | 0 | 0 | 0 | 113.9 | N233 V234 | N233-L237 VanDerWaalsContact O-CD1 3.31Å; N233-L237 WeakPolarHBondContact O-CD1 2.92Å; N233-L237 VanDerWaalsContact O-CG 3.32Å; N233-L237 WeakPolarHBondContact O-CG 3.38Å; V234-L237 PolarHBondContact O-N 2.75Å |
| 238 | V | 34.6 | Very low | 32.3 | Very low | 115 Ų | 115 | 126.7 Ų | 126.7 | 70% | 0.697 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.4 | -13.7 | -179.4 | 178.3 | 0 | 0 | 0 | 0 | 112.3 | S236 | S236-V238 VanDerWaalsContact C-N 3.34Š|
| 239 | L | 32.3 | Very low | 31.4 | Very low | 158 Ų | 158 | 129 Ų | 129 | 83% | 0.827 | 71% | 0.708 | S | S | * | * | S | Bend | trans | -99.9 | 0.2 | -171.6 | -116.9 | 115 | 0 | 0 | 0 | 116.7 | ||
| 240 | E | 30.1 | Very low | 30.5 | Very low | 174 Ų | 174 | 127.5 Ų | 127.5 | 81% | 0.813 | 71% | 0.712 | S | S | * | * | S | Bend | trans | -109.3 | 13.3 | -171.6 | -139.7 | 174 | -169.1 | 0 | 0 | 116 | ||
| 241 | N | 32.2 | Very low | 29.7 | Very low | 151 Ų | 151 | 131.4 Ų | 131.4 | 81% | 0.807 | 73% | 0.729 | S | S | * | * | trans | -111.3 | 58.6 | -179.1 | -82.3 | -26.5 | 0 | 0 | 0 | 114.9 | ||||
| 242 | I | 26.4 | Very low | 29 | Very low | 160 Ų | 160 | 133.4 Ų | 133.4 | 82% | 0.821 | 74% | 0.735 | S | S | * | * | trans | -138.9 | 104.9 | 167.1 | -55.2 | -179.8 | 0 | 0 | 0 | 111.6 | ||||
| 243 | E | 25 | Very low | 28.3 | Very low | 173 Ų | 173 | 133.1 Ų | 133.1 | 81% | 0.808 | 74% | 0.739 | S | S | * | * | trans | 16.1 | 155.2 | 144.6 | -66.2 | -175.9 | 163 | 0 | 0 | 121.6 | ||||
| 244 | T | 23.9 | Very low | 27.7 | Very low | 111 Ų | 111 | 134.1 Ų | 134.1 | 68% | 0.681 | 75% | 0.749 | S | S | * | * | cis | -174.6 | 160.9 | 3.7 | 21.7 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 245 | T | 23.7 | Very low | 26.9 | Very low | 114 Ų | 114 | 135.5 Ų | 135.5 | 70% | 0.699 | 76% | 0.761 | S | S | * | * | trans | 86.2 | 130.7 | 143.6 | 23.9 | 0 | 0 | 0 | 0 | 127.1 | ||||
| 246 | N | 24.4 | Very low | 26.5 | Very low | 160 Ų | 160 | 136.1 Ų | 136.1 | 86% | 0.856 | 77% | 0.769 | S | S | * | * | trans | 97.2 | 122.2 | 141.8 | -64.7 | -16.6 | 0 | 0 | 0 | 122.6 | ||||
| 247 | G | 25 | Very low | 26.1 | Very low | 81 Ų | 81 | 138.4 Ų | 138.4 | 84% | 0.835 | 78% | 0.782 | S | S | * | * | trans | 135.6 | 118.2 | 138.7 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 248 | V | 23.6 | Very low | 25.6 | Very low | 135 Ų | 135 | 141 Ų | 141 | 82% | 0.818 | 79% | 0.791 | S | S | * | * | trans | -70.5 | 141.1 | -177.1 | 176.2 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 249 | L | 22.9 | Very low | 25 | Very low | 169 Ų | 169 | 144.8 Ų | 144.8 | 89% | 0.885 | 80% | 0.801 | S | S | * | * | 175.3 | 148.5 | 111.6 | -126.9 | 119.1 | 0 | 0 | 0 | 114.6 | |||||
| 250 | S | 22.1 | Very low | 24.6 | Very low | 91 Ų | 91 | 144.3 Ų | 144.3 | 64% | 0.636 | 80% | 0.799 | S | S | * | * | trans | -84.9 | 148.9 | -169.4 | 178 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 251 | L | 24.2 | Very low | 24.3 | Very low | 173 Ų | 173 | 142.1 Ų | 142.1 | 91% | 0.906 | 80% | 0.798 | S | S | * | * | -177.1 | 141.4 | 116.5 | -94.7 | 161.9 | 0 | 0 | 0 | 111.9 | |||||
| 252 | K | 23.3 | Very low | 23.9 | Very low | 177 Ų | 177 | 140 Ų | 140 | 77% | 0.77 | 80% | 0.795 | S | S | * | * | trans | -103.8 | 138.7 | -170.5 | -147.7 | -176.2 | -177.2 | 178.5 | 0 | 108.7 | ||||
| 253 | D | 22.6 | Very low | 24 | Very low | 138 Ų | 138 | 139.8 Ų | 139.8 | 74% | 0.738 | 80% | 0.795 | S | S | * | * | 155.3 | 140.8 | 119.9 | -81.1 | -28.6 | 0 | 0 | 0 | 113.4 | |||||
| 254 | T | 22.2 | Very low | 23.9 | Very low | 132 Ų | 132 | 138.8 Ų | 138.8 | 81% | 0.81 | 80% | 0.795 | S | S | * | * | trans | 88.6 | 90.4 | 160.1 | -2.4 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 255 | C | 21.9 | Very low | 23.9 | Very low | 114 Ų | 114 | 143.6 Ų | 143.6 | 77% | 0.77 | 81% | 0.806 | S | S | * | * | trans | 8.6 | 128.7 | 131.4 | -61.2 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 256 | T | 23.8 | Very low | 24.1 | Very low | 128 Ų | 128 | 147.6 Ų | 147.6 | 79% | 0.785 | 82% | 0.817 | S | S | * | * | cis | -166.7 | 136.2 | 12.4 | 29.6 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 257 | P | 28 | Very low | 24.2 | Very low | 116 Ų | 116 | 144.6 Ų | 144.6 | 75% | 0.753 | 82% | 0.815 | S | S | * | * | trans | -141.6 | 151 | 137.2 | 33.5 | -17.4 | 0 | 0 | 0 | 113.3 | ||||
| 258 | E | 25.4 | Very low | 24.1 | Very low | 191 Ų | 191 | 149.5 Ų | 149.5 | 89% | 0.893 | 81% | 0.813 | S | S | * | * | trans | 55 | 108.9 | 153.6 | -64.6 | 179.6 | 168.7 | 0 | 0 | 118.3 | ||||
| 259 | E | 22.5 | Very low | 24.2 | Very low | 195 Ų | 195 | 151.3 Ų | 151.3 | 91% | 0.911 | 82% | 0.817 | S | S | * | * | trans | -138.8 | 130.2 | 143.1 | -142.8 | 169.4 | -159.1 | 0 | 0 | 111.1 | ||||
| 260 | N | 23.7 | Very low | 24.3 | Very low | 148 Ų | 148 | 150.6 Ų | 150.6 | 79% | 0.791 | 81% | 0.809 | S | S | * | * | trans | -59.5 | 169.5 | 169.7 | -70.4 | -52.5 | 0 | 0 | 0 | 111 | ||||
| 261 | T | 23.2 | Very low | 24.6 | Very low | 127 Ų | 127 | 152.7 Ų | 152.7 | 78% | 0.779 | 82% | 0.818 | S | S | * | * | trans | 89.6 | 94.9 | 151.1 | -2.9 | 0 | 0 | 0 | 0 | 117 | L263 | T261-L263 PolarHBondContact O-N 3.15Š| ||
| 262 | S | 24.7 | Very low | 24.6 | Very low | 107 Ų | 107 | 148.5 Ų | 148.5 | 75% | 0.748 | 81% | 0.809 | S | S | * | * | trans | -26.4 | 113.1 | 142.8 | 51.2 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 263 | L | 27.1 | Very low | 24.8 | Very low | 156 Ų | 156 | 146 Ų | 146 | 82% | 0.817 | 81% | 0.81 | S | S | * | * | trans | -149.2 | 110.9 | 143.1 | -71.5 | 173.9 | 0 | 0 | 0 | 104.1 | T261 | T261-L263 PolarHBondContact O-N 3.15Š| ||
| 264 | D | 22.7 | Very low | 25 | Very low | 152 Ų | 152 | 147 Ų | 147 | 81% | 0.813 | 82% | 0.816 | S | S | * | * | -165.2 | 111.5 | 88.1 | -78.4 | -34.1 | 0 | 0 | 0 | 110.2 | |||||
| 265 | K | 25.6 | Very low | 25.3 | Very low | 212 Ų | 212 | 145.9 Ų | 145.9 | 92% | 0.922 | 81% | 0.814 | S | S | * | * | trans | -155.6 | 74.5 | 151.4 | -75.2 | -160.8 | -178.7 | 169.6 | 0 | 109.7 | ||||
| 266 | E | 26.4 | Very low | 25.7 | Very low | 197 Ų | 197 | 148.4 Ų | 148.4 | 92% | 0.921 | 82% | 0.819 | S | S | * | * | trans | -124 | 154.8 | 160.6 | -77.3 | -166.2 | 158.4 | 0 | 0 | 111.2 | ||||
| 267 | A | 26.8 | Very low | 26.4 | Very low | 98 Ų | 98 | 151 Ų | 151 | 81% | 0.81 | 82% | 0.822 | S | S | * | * | trans | 81.3 | 59.4 | -176 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 268 | K | 23.7 | Very low | 26.5 | Very low | 184 Ų | 184 | 154.9 Ų | 154.9 | 80% | 0.8 | 83% | 0.827 | S | S | * | * | trans | -142.2 | 87.5 | 130.6 | -85.6 | -166.6 | 179.2 | -178.6 | 0 | 109.9 | E270 | K268-E270 PolarHBondContact O-N 3.22Š| ||
| 269 | L | 26.1 | Very low | 27 | Very low | 172 Ų | 172 | 153.3 Ų | 153.3 | 90% | 0.901 | 83% | 0.825 | S | S | * | * | trans | -73.2 | 74.1 | 163.2 | -170.6 | 81.1 | 0 | 0 | 0 | 108 | T271 | L269-T271 PolarHBondContact O-N 3.09Š| ||
| 270 | E | 25 | Very low | 28.2 | Very low | 154 Ų | 154 | 148.7 Ų | 148.7 | 72% | 0.72 | 81% | 0.814 | S | S | * | * | trans | -77.6 | 112.4 | 160.4 | -81.6 | -174.2 | 177.2 | 0 | 0 | 107.7 | K268 A272 | K268-E270 PolarHBondContact O-N 3.22Å; E270-A272 VanDerWaalsContact C-N 3.35Å; E270-A272 PolarHBondContact O-N 2.89Å | ||
| 271 | T | 28.1 | Very low | 29.8 | Very low | 135 Ų | 135 | 151.2 Ų | 151.2 | 83% | 0.828 | 81% | 0.812 | S | S | * | * | trans | -46.2 | 94.2 | 163.4 | 36 | 0 | 0 | 0 | 0 | 110.7 | L269 | L269-T271 PolarHBondContact O-N 3.09Š| ||
| 272 | A | 24.3 | Very low | 31.5 | Very low | 86 Ų | 86 | 149.5 Ų | 149.5 | 71% | 0.711 | 80% | 0.798 | S | S | * | * | trans | -69.4 | 127.2 | 167.6 | 0 | 0 | 0 | 0 | 0 | 108.6 | E270 N274 | E270-A272 VanDerWaalsContact C-N 3.35Å; E270-A272 PolarHBondContact O-N 2.89Å; A272-N274 PolarHBondContact O-N 2.91Å | ||
| 273 | P | 26.9 | Very low | 33.5 | Very low | 123 Ų | 123 | 145.9 Ų | 145.9 | 80% | 0.799 | 77% | 0.77 | S | S | * | * | trans | -64.6 | 138.1 | 175.8 | 28.3 | -31.6 | 0 | 0 | 0 | 108.7 | S275 | P273-S275 PolarHBondContact O-N 3.25Š| ||
| 274 | N | 26.6 | Very low | 35.8 | Very low | 159 Ų | 159 | 141 Ų | 141 | 85% | 0.85 | 75% | 0.745 | S | S | * | * | trans | -28.7 | 121.3 | 176.5 | -73.5 | -29.4 | 0 | 0 | 0 | 113 | A272 L276 | A272-N274 PolarHBondContact O-N 2.91Å; N274-L276 PolarHBondContact O-N 3.43Å | ||
| 275 | S | 28.4 | Very low | 38.7 | Very low | 110 Ų | 110 | 138.5 Ų | 138.5 | 77% | 0.769 | 73% | 0.727 | S | S | * | * | trans | -31.5 | 117.5 | 169.5 | 39.9 | 0 | 0 | 0 | 0 | 113.1 | P273 | P273-S275 PolarHBondContact O-N 3.25Š| ||
| 276 | L | 31.9 | Very low | 41.4 | Very low | 166 Ų | 166 | 130.8 Ų | 130.8 | 87% | 0.869 | 70% | 0.699 | S | S | * | * | trans | 13.9 | 109.2 | 145.8 | -71.2 | 154.3 | 0 | 0 | 0 | 114.5 | N274 K278 | N274-L276 PolarHBondContact O-N 3.43Å; L276-K278 PolarHBondContact O-N 2.85Å | ||
| 277 | E | 36.5 | Very low | 44.1 | Very low | 184 Ų | 184 | 121.8 Ų | 121.8 | 86% | 0.86 | 66% | 0.658 | S | S | * | * | trans | -42.9 | 108.4 | 156.8 | -79.7 | 179.2 | 152.9 | 0 | 0 | 108.3 | N279 | E277-N279 PolarHBondContact O-N 3.23Š| ||
| 278 | K | 31.3 | Very low | 46.9 | Very low | 196 Ų | 196 | 120.3 Ų | 120.3 | 85% | 0.852 | 64% | 0.636 | S | S | * | * | trans | -51.1 | 114.3 | 172.9 | -176.8 | 177.2 | -176.3 | 176.9 | 0 | 106.5 | L276 S280 | L276-K278 PolarHBondContact O-N 2.85Å; K278-S280 PolarHBondContact O-N 3.1Å | ||
| 279 | N | 35.1 | Very low | 49.9 | Very low | 159 Ų | 159 | 120.3 Ų | 120.3 | 85% | 0.85 | 64% | 0.636 | S | S | * | * | trans | -52.9 | 90.8 | 171.9 | -93.1 | -26.7 | 0 | 0 | 0 | 108.5 | E277 R281 | E277-N279 PolarHBondContact O-N 3.23Å; N279-R281 PolarHBondContact O-N 3.06Å | ||
| 280 | S | 48.9 | Very low | 52.8 | Low | 97 Ų | 97 | 114.8 Ų | 114.8 | 68% | 0.678 | 61% | 0.607 | S | S | * | * | trans | -68.6 | 105.3 | 171.9 | 54.6 | 0 | 0 | 0 | 0 | 105.5 | K278 L282 | K278-S280 PolarHBondContact O-N 3.1Å; S280-L282 PolarHBondContact O-N 3.33Å | ||
| 281 | R | 56.9 | Low | 55.7 | Low | 201 Ų | 201 | 111.2 Ų | 111.2 | 76% | 0.758 | 60% | 0.599 | S | S | * | * | trans | -50.7 | 118.7 | 169.6 | -67.3 | -178.5 | -178.9 | -178 | -0.9 | 106.7 | N279 L283 | N279-R281 PolarHBondContact O-N 3.06Å; R281-L283 PolarHBondContact O-N 3.24Å; R281-L283 VanDerWaalsContact O-N 3.1Å | ||
| 282 | L | 57.9 | Low | 58.6 | Low | 92 Ų | 92 | 104.9 Ų | 104.9 | 48% | 0.482 | 56% | 0.56 | S | S | . | * | S | Bend | trans | -59.1 | -24.8 | -173.3 | -70.3 | 158.5 | 0 | 0 | 0 | 112.6 | P81 V85 S280 | P81-L282 HydrophobicContact CB-CB 4.49Å; V85-L282 HydrophobicContact CG2-CD1 3.19Å; V85-L282 HydrophobicContact CG2-CD2 3.55Å; V85-L282 HydrophobicContact CG2-CG 3.99Å; S280-L282 PolarHBondContact O-N 3.33Å |
| 283 | L | 67 | Low | 61.8 | Low | 31 Ų | 31 | 100.8 Ų | 100.8 | 16% | 0.162 | 53% | 0.526 | C | S | . | . | S | Bend | trans | -132.9 | 113.3 | 169 | -67.2 | 173.7 | 0 | 0 | 0 | 107.9 | P81 R281 F285 V425 | P81-L283 HydrophobicContact CB-CG 4.49Å; P81-L283 HydrophobicContact CG-CD1 3.78Å; P81-L283 HydrophobicContact CG-CD2 4.09Å; P81-L283 HydrophobicContact CG-CG 3.97Å; R281-L283 PolarHBondContact O-N 3.24Å; R281-L283 VanDerWaalsContact O-N 3.1Å; L283-F285 HydrophobicContact CB-CD2 4.1Å; L283-F285 HydrophobicContact CB-CE2 3.64Å; L283-F285 HydrophobicContact CB-CZ 4.05Å; L283-F285 HydrophobicContact CD1-CE2 3.96Å; L283-F285 HydrophobicContact CD1-CZ 3.72Å; L283-F285 HydrophobicContact CG-CE2 4.48Å; L283-F285 PolarHBondContact O-N 2.89Å; L283-V425 HydrophobicContact CB-CG2 4.3Å; L283-V425 HydrophobicContact CD2-CG2 4.01Å |
| 284 | D | 76.7 | Confident | 64.9 | Low | 54 Ų | 54 | 97.4 Ų | 97.4 | 29% | 0.289 | 50% | 0.504 | S | S | . | . | trans | -89.3 | 92.6 | 169.2 | -168.4 | 8.6 | 0 | 0 | 0 | 110.2 | S286 I287 S421 | D284-S286 PolarHBondContact O-N 3.25Å; D284-S286 VanDerWaalsContact O-N 3.13Å; D284-S286 WeakPolarHBondContact OD1-CB 3.5Å; D284-S286 PolarHBondContact OD1-N 3.21Å; D284-S286 PolarHBondContact OD1-OG 3.02Å; D284-S286 PolarHBondContact OD2-OG 3.13Å; D284-I287 PolarHBondContact O-N 3.36Å; D284-S421 VanDerWaalsContact CB-OG 3.24Å; D284-S421 WeakPolarHBondContact CB-OG 3.44Å; D284-S421 PolarHBondContact N-OG 3.31Å | ||
| 285 | F | 82.3 | Confident | 68.1 | Low | 98 Ų | 98 | 91.4 Ų | 91.4 | 43% | 0.43 | 47% | 0.471 | S | S | . | . | G | 310 helix | trans | -67 | -3.8 | 174.6 | -69 | -77.6 | 0 | 0 | 0 | 113.3 | L283 I287 L288 V425 | L283-F285 HydrophobicContact CB-CD2 4.1Å; L283-F285 HydrophobicContact CB-CE2 3.64Å; L283-F285 HydrophobicContact CB-CZ 4.05Å; L283-F285 HydrophobicContact CD1-CE2 3.96Å; L283-F285 HydrophobicContact CD1-CZ 3.72Å; L283-F285 HydrophobicContact CG-CE2 4.48Å; L283-F285 PolarHBondContact O-N 2.89Å; F285-I287 PolarHBondContact O-N 3.34Å; F285-I287 VanDerWaalsContact O-N 3.13Å; F285-L288 HydrophobicContact CB-CD1 4.43Å; F285-L288 HydrophobicContact CD1-CD1 3.72Å; F285-L288 WeakPolarHBondContact O-CB 3.46Å; F285-L288 PolarHBondContact O-N 3.44Å; F285-L288 VanDerWaalsContact O-N 3.11Å; F285-V425 HydrophobicContact CD1-CG1 4.08Å; F285-V425 HydrophobicContact CD1-CG2 4.31Å; F285-V425 HydrophobicContact CE1-CG1 4.18Å; F285-V425 HydrophobicContact CE1-CG2 4.45Å |
| 286 | S | 83.3 | Confident | 71.2 | Confident | 50 Ų | 50 | 86.2 Ų | 86.2 | 35% | 0.35 | 44% | 0.435 | S | S | . | . | G | 310 helix | trans | -57.1 | -26.2 | 173 | 78.3 | 0 | 0 | 0 | 0 | 112.8 | D284 L288 K289 | D284-S286 PolarHBondContact O-N 3.25Å; D284-S286 VanDerWaalsContact O-N 3.13Å; D284-S286 WeakPolarHBondContact OD1-CB 3.5Å; D284-S286 PolarHBondContact OD1-N 3.21Å; D284-S286 PolarHBondContact OD1-OG 3.02Å; D284-S286 PolarHBondContact OD2-OG 3.13Å; S286-L288 VanDerWaalsContact C-N 3.25Å; S286-L288 PolarHBondContact O-N 3.06Å; S286-K289 WeakPolarHBondContact O-CB 3.42Å; S286-K289 WeakPolarHBondContact O-CG 3.45Å; S286-K289 PolarHBondContact O-N 3.45Å |
| 287 | I | 82.7 | Confident | 74.1 | Confident | 8 Ų | 8 | 78.5 Ų | 78.5 | 4% | 0.041 | 40% | 0.395 | C | S | . | . | G | 310 helix | trans | -67.3 | -24.8 | -179.7 | -57.9 | 175.4 | 0 | 0 | 0 | 111.8 | D284 F285 K289 D290 F293 V414 R418 A422 | D284-I287 PolarHBondContact O-N 3.36Å; F285-I287 PolarHBondContact O-N 3.34Å; F285-I287 VanDerWaalsContact O-N 3.13Å; I287-K289 PolarHBondContact O-N 3.32Å; I287-D290 PolarHBondContact O-N 2.92Å; I287-F293 HydrophobicContact CB-CD1 4.35Å; I287-F293 HydrophobicContact CB-CE1 4.37Å; I287-F293 HydrophobicContact CG2-CB 4.16Å; I287-F293 HydrophobicContact CG2-CD1 3.52Å; I287-F293 HydrophobicContact CG2-CD2 3.98Å; I287-F293 HydrophobicContact CG2-CE1 3.79Å; I287-F293 HydrophobicContact CG2-CE2 4.24Å; I287-F293 HydrophobicContact CG2-CG 3.6Å; I287-F293 HydrophobicContact CG2-CZ 4.14Å; I287-V414 HydrophobicContact CG2-CG2 4.23Å; I287-R418 HydrophobicContact CD1-CB 4.32Å; I287-A422 HydrophobicContact CD1-CB 3.96Å; I287-A422 HydrophobicContact CG2-CB 4.23Å |
| 288 | L | 86.1 | Confident | 76.9 | Confident | 67 Ų | 67 | 72.3 Ų | 72.3 | 35% | 0.351 | 37% | 0.367 | S | S | . | . | G | 310 helix | trans | -65.6 | -9.3 | 175 | -67 | 176.4 | 0 | 0 | 0 | 113.8 | F285 S286 D290 F293 V294 V425 I429 | F285-L288 HydrophobicContact CB-CD1 4.43Å; F285-L288 HydrophobicContact CD1-CD1 3.72Å; F285-L288 WeakPolarHBondContact O-CB 3.46Å; F285-L288 PolarHBondContact O-N 3.44Å; F285-L288 VanDerWaalsContact O-N 3.11Å; S286-L288 VanDerWaalsContact C-N 3.25Å; S286-L288 PolarHBondContact O-N 3.06Å; L288-D290 VanDerWaalsContact C-N 3.3Å; L288-F293 HydrophobicContact CD2-CD1 4.02Å; L288-F293 HydrophobicContact CD2-CE1 3.72Å; L288-F293 HydrophobicContact CG-CE1 4.49Å; L288-V294 WeakPolarHBondContact O-CG2 3.36Å; L288-V425 HydrophobicContact CD2-CG1 4.06Å; L288-V425 HydrophobicContact CG-CG1 4.22Å; L288-I429 HydrophobicContact CD2-CD1 3.85Å |
| 289 | K | 85.6 | Confident | 79.9 | Confident | 184 Ų | 184 | 63 Ų | 63 | 80% | 0.8 | 33% | 0.327 | S | S | * | . | G | 310 helix | trans | -74.1 | -20.9 | 172 | -65.2 | -177.9 | 178.9 | -177 | 0 | 112.9 | S286 I287 S291 | S286-K289 WeakPolarHBondContact O-CB 3.42Å; S286-K289 WeakPolarHBondContact O-CG 3.45Å; S286-K289 PolarHBondContact O-N 3.45Å; I287-K289 PolarHBondContact O-N 3.32Å; K289-S291 PolarHBondContact O-N 3.49Å |
| 290 | D | 86.7 | Confident | 82.5 | Confident | 57 Ų | 57 | 55.4 Ų | 55.4 | 31% | 0.305 | 29% | 0.286 | S | S | . | . | trans | -80.9 | 115.1 | 176.5 | -172 | -19.8 | 0 | 0 | 0 | 110 | I287 L288 S292 F293 V294 | I287-D290 PolarHBondContact O-N 2.92Å; L288-D290 VanDerWaalsContact C-N 3.3Å; D290-S292 PolarHBondContact O-N 2.81Å; D290-S292 VanDerWaalsContact OD1-CB 3.26Å; D290-S292 WeakPolarHBondContact OD1-CB 2.87Å; D290-S292 PolarHBondContact OD1-N 3.43Å; D290-S292 PolarHBondContact OD1-OG 3.36Å; D290-F293 HydrophobicContact CB-CB 4.15Å; D290-F293 PolarHBondContact O-N 3.08Å; D290-F293 VanDerWaalsContact O-N 3.1Å; D290-V294 PolarHBondContact O-N 3.36Å | ||
| 291 | S | 87.7 | Confident | 84.7 | Confident | 78 Ų | 78 | 52.5 Ų | 52.5 | 55% | 0.545 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -58.1 | -31.7 | 179.2 | -54 | 0 | 0 | 0 | 0 | 112.9 | K289 V294 L295 | K289-S291 PolarHBondContact O-N 3.49Å; S291-V294 PolarHBondContact O-N 3.21Å; S291-L295 WeakPolarHBondContact O-CG 3.37Å; S291-L295 PolarHBondContact O-N 2.97Å |
| 292 | S | 88.8 | Confident | 86.5 | Confident | 2 Ų | 2 | 45.1 Ų | 45.1 | 1% | 0.014 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -66.2 | -41.8 | 178.2 | -32.8 | 0 | 0 | 0 | 0 | 110.8 | D290 Y296 K476 | D290-S292 PolarHBondContact O-N 2.81Å; D290-S292 VanDerWaalsContact OD1-CB 3.26Å; D290-S292 WeakPolarHBondContact OD1-CB 2.87Å; D290-S292 PolarHBondContact OD1-N 3.43Å; D290-S292 PolarHBondContact OD1-OG 3.36Å; S292-Y296 WeakPolarHBondContact O-CB 3.49Å; S292-Y296 PolarHBondContact O-N 3.31Å; S292-K476 VanDerWaalsContact OG-CB 3.28Å; S292-K476 WeakPolarHBondContact OG-CB 3.27Å; S292-K476 WeakPolarHBondContact OG-CG 3.4Å |
| 293 | F | 90.8 | Very high | 88.1 | Confident | 0 Ų | 0 | 40.8 Ų | 40.8 | 0% | 0 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -70.3 | -38.6 | 177.2 | 178.3 | -106.1 | 0 | 0 | 0 | 112.3 | I287 L288 D290 Y296 S297 L408 V414 A422 V425 | I287-F293 HydrophobicContact CB-CD1 4.35Å; I287-F293 HydrophobicContact CB-CE1 4.37Å; I287-F293 HydrophobicContact CG2-CB 4.16Å; I287-F293 HydrophobicContact CG2-CD1 3.52Å; I287-F293 HydrophobicContact CG2-CD2 3.98Å; I287-F293 HydrophobicContact CG2-CE1 3.79Å; I287-F293 HydrophobicContact CG2-CE2 4.24Å; I287-F293 HydrophobicContact CG2-CG 3.6Å; I287-F293 HydrophobicContact CG2-CZ 4.14Å; L288-F293 HydrophobicContact CD2-CD1 4.02Å; L288-F293 HydrophobicContact CD2-CE1 3.72Å; L288-F293 HydrophobicContact CG-CE1 4.49Å; D290-F293 HydrophobicContact CB-CB 4.15Å; D290-F293 PolarHBondContact O-N 3.08Å; D290-F293 VanDerWaalsContact O-N 3.1Å; F293-Y296 PolarHBondContact O-N 2.93Å; F293-S297 WeakPolarHBondContact CE1-OG 3.21Å; F293-S297 WeakPolarHBondContact CZ-OG 3.42Å; F293-S297 WeakPolarHBondContact O-CB 3.14Å; F293-S297 PolarHBondContact O-N 3.48Å; F293-S297 PolarHBondContact O-OG 3.36Å; F293-L408 HydrophobicContact CD2-CD2 4.16Å; F293-L408 HydrophobicContact CE2-CD2 3.94Å; F293-V414 HydrophobicContact CB-CG2 3.97Å; F293-V414 HydrophobicContact CD2-CG2 3.37Å; F293-V414 HydrophobicContact CE2-CG2 4.18Å; F293-V414 HydrophobicContact CG-CG2 3.97Å; F293-A422 HydrophobicContact CD2-CB 4.31Å; F293-A422 HydrophobicContact CE2-CB 3.72Å; F293-A422 HydrophobicContact CZ-CB 4.23Å; F293-A422 WeakPolarHBondContact CZ-O 3.47Å; F293-V425 HydrophobicContact CE1-CB 4.43Å; F293-V425 HydrophobicContact CE1-CG1 3.98Å; F293-V425 HydrophobicContact CZ-CB 4.18Å; F293-V425 HydrophobicContact CZ-CG1 4.16Å |
| 294 | V | 92.8 | Very high | 89.2 | Confident | 53 Ų | 53 | 40.3 Ų | 40.3 | 32% | 0.321 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -61.2 | -48 | 175.8 | 174.3 | 0 | 0 | 0 | 0 | 110.6 | L288 D290 S291 Y296 S297 L298 | L288-V294 WeakPolarHBondContact O-CG2 3.36Å; D290-V294 PolarHBondContact O-N 3.36Å; S291-V294 PolarHBondContact O-N 3.21Å; V294-Y296 VanDerWaalsContact C-N 3.33Å; V294-Y296 PolarHBondContact O-N 3.42Å; V294-S297 PolarHBondContact O-N 3.45Å; V294-L298 HydrophobicContact CG1-CD1 4.34Å; V294-L298 WeakPolarHBondContact O-CG 3.27Å; V294-L298 PolarHBondContact O-N 3.22Å |
| 295 | L | 93.3 | Very high | 89.8 | Confident | 33 Ų | 33 | 39.5 Ų | 39.5 | 17% | 0.173 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -61.7 | -41.5 | 176.6 | -72.9 | 168 | 0 | 0 | 0 | 112.1 | S291 S297 L298 F299 F468 F471 V472 A475 | S291-L295 WeakPolarHBondContact O-CG 3.37Å; S291-L295 PolarHBondContact O-N 2.97Å; L295-S297 VanDerWaalsContact C-N 3.33Å; L295-S297 PolarHBondContact O-N 3.26Å; L295-L298 PolarHBondContact O-N 3.06Å; L295-F299 PolarHBondContact O-N 3.19Å; L295-F468 HydrophobicContact CD2-CD1 3.82Å; L295-F468 HydrophobicContact CD2-CE1 4.46Å; L295-F471 HydrophobicContact CD1-CB 4.07Å; L295-F471 HydrophobicContact CD2-CB 4.34Å; L295-V472 HydrophobicContact CB-CG2 3.88Å; L295-A475 HydrophobicContact CD1-CB 3.33Å |
| 296 | Y | 93.4 | Very high | 90.1 | Very high | 0 Ų | 0 | 34.8 Ų | 34.8 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -66.3 | -35.9 | 176.6 | -164.4 | -93 | 0 | 0 | 0 | 112.4 | S292 F293 V294 F299 G300 L360 L363 H404 M407 L408 V413 Y426 L469 V472 | S292-Y296 WeakPolarHBondContact O-CB 3.49Å; S292-Y296 PolarHBondContact O-N 3.31Å; F293-Y296 PolarHBondContact O-N 2.93Å; V294-Y296 VanDerWaalsContact C-N 3.33Å; V294-Y296 PolarHBondContact O-N 3.42Å; Y296-F299 HydrophobicContact CD2-CD1 4.05Å; Y296-F299 HydrophobicContact CE1-CD1 4.34Å; Y296-F299 HydrophobicContact CE1-CE1 4.47Å; Y296-F299 AromaticContact CE2-CD1 3.79Å; Y296-F299 HydrophobicContact CE2-CD1 3.79Å; Y296-F299 AromaticContact CE2-CE1 3.87Å; Y296-F299 HydrophobicContact CE2-CE1 3.87Å; Y296-F299 HydrophobicContact CG-CD1 4.41Å; Y296-F299 AromaticContact CZ-CD1 3.93Å; Y296-F299 AromaticContact CZ-CE1 3.78Å; Y296-F299 WeakPolarHBondContact O-CB 3.45Å; Y296-F299 PolarHBondContact O-N 2.89Å; Y296-G300 PolarHBondContact O-N 2.91Å; Y296-L360 HydrophobicContact CE2-CD1 4.22Å; Y296-L363 HydrophobicContact CE2-CD2 4.47Å; Y296-H404 AromaticContact CE1-CE1 3.59Å; Y296-H404 AromaticContact CE1-NE2 3.42Å; Y296-H404 WeakPolarHBondContact CE1-NE2 3.39Å; Y296-H404 AromaticContact CZ-NE2 3.65Å; Y296-H404 PolarHBondContact OH-NE2 3.12Å; Y296-H404 PolarHBondContact OH-O 3.47Å; Y296-M407 HydrophobicContact CE2-CB 4.4Å; Y296-M407 HydrophobicContact CE2-CG 4.11Å; Y296-M407 VanDerWaalsContact OH-CB 3.3Å; Y296-M407 WeakPolarHBondContact OH-CB 3.39Å; Y296-L408 HydrophobicContact CD1-CD2 3.47Å; Y296-L408 VanDerWaalsContact CD1-CD2 3.47Å; Y296-L408 HydrophobicContact CD1-CG 4.3Å; Y296-L408 HydrophobicContact CE1-CD2 3.62Å; Y296-L408 HydrophobicContact CE1-CG 3.94Å; Y296-L408 HydrophobicContact CG-CD2 4.5Å; Y296-V413 HydrophobicContact CD1-CG1 3.94Å; Y296-V413 HydrophobicContact CD2-CG1 3.99Å; Y296-V413 HydrophobicContact CD2-CG2 4.06Å; Y296-V413 HydrophobicContact CE2-CG2 4.31Å; Y296-V413 HydrophobicContact CG-CG1 3.63Å; Y296-Y426 HydrophobicContact CD1-CD2 4.2Å; Y296-Y426 HydrophobicContact CD1-CE2 4.18Å; Y296-Y426 HydrophobicContact CE1-CD2 4.47Å; Y296-Y426 HydrophobicContact CE1-CE2 4.23Å; Y296-L469 HydrophobicContact CD2-CD1 4.03Å; Y296-L469 HydrophobicContact CE2-CD1 3.82Å; Y296-V472 HydrophobicContact CD2-CG2 4.22Å |
| 297 | S | 92.4 | Very high | 90.3 | Very high | 4 Ų | 4 | 34.1 Ų | 34.1 | 3% | 0.028 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -67.9 | -38.1 | 174.8 | -58.7 | 0 | 0 | 0 | 0 | 111.9 | F293 V294 L295 G300 L301 | F293-S297 WeakPolarHBondContact CE1-OG 3.21Å; F293-S297 WeakPolarHBondContact CZ-OG 3.42Å; F293-S297 WeakPolarHBondContact O-CB 3.14Å; F293-S297 PolarHBondContact O-N 3.48Å; F293-S297 PolarHBondContact O-OG 3.36Å; V294-S297 PolarHBondContact O-N 3.45Å; L295-S297 VanDerWaalsContact C-N 3.33Å; L295-S297 PolarHBondContact O-N 3.26Å; S297-G300 PolarHBondContact O-N 3.14Å; S297-L301 PolarHBondContact O-N 3.32Å |
| 298 | L | 94.4 | Very high | 90.4 | Very high | 54 Ų | 54 | 35 Ų | 35 | 28% | 0.283 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -65 | -43 | 172.6 | -71.2 | 172.7 | 0 | 0 | 0 | 111.7 | V294 L295 G300 L301 F302 F468 | V294-L298 HydrophobicContact CG1-CD1 4.34Å; V294-L298 WeakPolarHBondContact O-CG 3.27Å; V294-L298 PolarHBondContact O-N 3.22Å; L295-L298 PolarHBondContact O-N 3.06Å; L298-G300 VanDerWaalsContact C-N 3.27Å; L298-G300 PolarHBondContact O-N 2.85Å; L298-L301 HydrophobicContact CD2-CD2 4.42Å; L298-L301 PolarHBondContact O-N 3.18Å; L298-F302 VanDerWaalsContact O-CD2 3.24Å; L298-F302 WeakPolarHBondContact O-CD2 3.14Å; L298-F302 PolarHBondContact O-N 2.6Å; L298-F468 HydrophobicContact CB-CB 4.41Å; L298-F468 HydrophobicContact CB-CD1 3.98Å; L298-F468 HydrophobicContact CB-CD2 4.12Å; L298-F468 HydrophobicContact CB-CE1 4.28Å; L298-F468 HydrophobicContact CB-CE2 4.44Å; L298-F468 HydrophobicContact CB-CG 3.9Å; L298-F468 HydrophobicContact CD1-CD1 3.97Å; L298-F468 HydrophobicContact CD1-CE1 3.69Å; L298-F468 HydrophobicContact CD1-CZ 4.22Å |
| 299 | F | 94.4 | Very high | 90.5 | Very high | 0 Ų | 0 | 31.8 Ų | 31.8 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -51.4 | -49.9 | 169.4 | 152.3 | -113.9 | 0 | 0 | 0 | 110.7 | L295 Y296 L301 F302 A303 L363 V367 H404 S465 F468 L469 | L295-F299 PolarHBondContact O-N 3.19Å; Y296-F299 HydrophobicContact CD2-CD1 4.05Å; Y296-F299 HydrophobicContact CE1-CD1 4.34Å; Y296-F299 HydrophobicContact CE1-CE1 4.47Å; Y296-F299 AromaticContact CE2-CD1 3.79Å; Y296-F299 HydrophobicContact CE2-CD1 3.79Å; Y296-F299 AromaticContact CE2-CE1 3.87Å; Y296-F299 HydrophobicContact CE2-CE1 3.87Å; Y296-F299 HydrophobicContact CG-CD1 4.41Å; Y296-F299 AromaticContact CZ-CD1 3.93Å; Y296-F299 AromaticContact CZ-CE1 3.78Å; Y296-F299 WeakPolarHBondContact O-CB 3.45Å; Y296-F299 PolarHBondContact O-N 2.89Å; F299-L301 PolarHBondContact O-N 3.23Å; F299-F302 PolarHBondContact O-N 3.44Å; F299-A303 HydrophobicContact CD2-CB 4.31Å; F299-A303 HydrophobicContact CE2-CB 4.01Å; F299-A303 WeakPolarHBondContact O-CB 3.15Å; F299-A303 PolarHBondContact O-N 3.27Å; F299-L363 HydrophobicContact CE1-CD2 3.99Å; F299-L363 HydrophobicContact CZ-CD1 4.5Å; F299-L363 HydrophobicContact CZ-CD2 4Å; F299-L363 HydrophobicContact CZ-CG 4.33Å; F299-V367 HydrophobicContact CE2-CG1 4.49Å; F299-V367 HydrophobicContact CE2-CG2 3.79Å; F299-V367 HydrophobicContact CZ-CG2 4.23Å; F299-H404 AromaticContact CD1-NE2 3.77Å; F299-H404 AromaticContact CE1-CD2 3.19Å; F299-H404 WeakPolarHBondContact CE1-CD2 3.49Å; F299-H404 AromaticContact CE1-NE2 3.36Å; F299-H404 WeakPolarHBondContact CE1-NE2 3.47Å; F299-H404 AromaticContact CZ-CD2 3.66Å; F299-S465 WeakPolarHBondContact CD2-O 3.14Å; F299-S465 WeakPolarHBondContact O-CB 3.19Å; F299-F468 HydrophobicContact CB-CB 4.12Å; F299-L469 HydrophobicContact CB-CB 4.24Å; F299-L469 HydrophobicContact CD1-CD1 3.97Å; F299-L469 HydrophobicContact CD2-CB 3.87Å; F299-L469 HydrophobicContact CD2-CD2 4.25Å; F299-L469 HydrophobicContact CD2-CG 4.45Å; F299-L469 HydrophobicContact CE1-CD1 4.1Å; F299-L469 HydrophobicContact CE1-CD2 4.47Å; F299-L469 HydrophobicContact CE2-CB 4.43Å; F299-L469 HydrophobicContact CE2-CD2 3.96Å; F299-L469 HydrophobicContact CG-CB 3.99Å; F299-L469 HydrophobicContact CG-CD1 4.18Å; F299-L469 HydrophobicContact CZ-CD2 4.07Å |
| 300 | G | 91.5 | Very high | 90.8 | Very high | 0 Ų | 0 | 23 Ų | 23 | 0% | 0 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -57.9 | -46.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 115.7 | Y296 S297 L298 A303 T304 Y426 | Y296-G300 PolarHBondContact O-N 2.91Å; S297-G300 PolarHBondContact O-N 3.14Å; L298-G300 VanDerWaalsContact C-N 3.27Å; L298-G300 PolarHBondContact O-N 2.85Å; G300-A303 PolarHBondContact O-N 3.42Å; G300-T304 WeakPolarHBondContact O-CB 3.44Å; G300-T304 PolarHBondContact O-N 2.88Å; G300-T304 PolarHBondContact O-OG1 2.89Å; G300-Y426 WeakPolarHBondContact CA-OH 3.31Å |
| 301 | L | 93.5 | Very high | 91 | Very high | 36 Ų | 36 | 21 Ų | 21 | 19% | 0.188 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -56.3 | -53.7 | 176.5 | -176.1 | 76.4 | 0 | 0 | 0 | 110.6 | S297 L298 F299 T304 L305 I429 F432 A433 | S297-L301 PolarHBondContact O-N 3.32Å; L298-L301 HydrophobicContact CD2-CD2 4.42Å; L298-L301 PolarHBondContact O-N 3.18Å; F299-L301 PolarHBondContact O-N 3.23Å; L301-T304 WeakPolarHBondContact O-CB 3.28Å; L301-T304 PolarHBondContact O-N 3.03Å; L301-L305 PolarHBondContact O-N 3.24Å; L301-I429 HydrophobicContact CB-CG2 4.38Å; L301-I429 HydrophobicContact CD1-CG2 4.21Å; L301-I429 WeakPolarHBondContact CD1-O 3.39Å; L301-F432 HydrophobicContact CD1-CB 4.26Å; L301-A433 HydrophobicContact CD1-CB 3.62Å; L301-A433 HydrophobicContact CG-CB 4.09Å; L301-A433 WeakPolarHBondContact O-CB 3.26Å |
| 302 | F | 94.5 | Very high | 91.3 | Very high | 47 Ų | 47 | 17.8 Ų | 17.8 | 21% | 0.206 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -71.4 | -34.5 | -177.7 | -77 | -70.5 | 0 | 0 | 0 | 113.4 | L298 F299 T304 L305 G306 G461 L464 F468 | L298-F302 VanDerWaalsContact O-CD2 3.24Å; L298-F302 WeakPolarHBondContact O-CD2 3.14Å; L298-F302 PolarHBondContact O-N 2.6Å; F299-F302 PolarHBondContact O-N 3.44Å; F302-T304 VanDerWaalsContact C-N 3.26Å; F302-T304 PolarHBondContact O-N 3.3Å; F302-L305 HydrophobicContact CD1-CD1 4.02Å; F302-L305 HydrophobicContact CE1-CD1 4.41Å; F302-L305 WeakPolarHBondContact O-CB 3.41Å; F302-L305 PolarHBondContact O-N 3.42Å; F302-G306 PolarHBondContact O-N 3.45Å; F302-G461 WeakPolarHBondContact CB-O 3.45Å; F302-G461 CarbonylContact O-C 3.57Å; F302-L464 HydrophobicContact CB-CB 4.42Å; F302-L464 HydrophobicContact CD1-CB 4.08Å; F302-L464 HydrophobicContact CD1-CD1 3.96Å; F302-L464 HydrophobicContact CE1-CD1 3.76Å; F302-L464 HydrophobicContact CG-CB 4.11Å; F302-L464 HydrophobicContact CZ-CD1 4.39Å; F302-F468 AromaticContact CD2-CD2 3.65Å; F302-F468 HydrophobicContact CD2-CD2 3.65Å; F302-F468 AromaticContact CD2-CE2 3.42Å; F302-F468 HydrophobicContact CD2-CE2 3.42Å; F302-F468 VanDerWaalsContact CD2-CE2 3.42Å; F302-F468 HydrophobicContact CD2-CZ 4.49Å; F302-F468 HydrophobicContact CE2-CD2 4.01Å; F302-F468 AromaticContact CE2-CE2 3.3Å; F302-F468 HydrophobicContact CE2-CE2 3.3Å; F302-F468 HydrophobicContact CE2-CZ 4.02Å; F302-F468 HydrophobicContact CG-CE2 4.46Å; F302-F468 HydrophobicContact CZ-CE2 4.25Å |
| 303 | A | 92.8 | Very high | 91.5 | Very high | 1 Ų | 1 | 17.7 Ų | 17.7 | 1% | 0.008 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -61.6 | -38 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | F299 G300 L305 G306 F307 M462 | F299-A303 HydrophobicContact CD2-CB 4.31Å; F299-A303 HydrophobicContact CE2-CB 4.01Å; F299-A303 WeakPolarHBondContact O-CB 3.15Å; F299-A303 PolarHBondContact O-N 3.27Å; G300-A303 PolarHBondContact O-N 3.42Å; A303-L305 VanDerWaalsContact C-N 3.35Å; A303-L305 PolarHBondContact O-N 3.45Å; A303-G306 WeakPolarHBondContact O-CA 3.39Å; A303-G306 PolarHBondContact O-N 2.97Å; A303-F307 HydrophobicContact CB-CE2 4Å; A303-F307 HydrophobicContact CB-CZ 3.79Å; A303-F307 WeakPolarHBondContact O-CD1 3.48Å; A303-F307 VanDerWaalsContact O-CD2 3.25Å; A303-F307 WeakPolarHBondContact O-CD2 3.4Å; A303-F307 WeakPolarHBondContact O-CE2 3.34Å; A303-F307 VanDerWaalsContact O-CG 3.24Å; A303-F307 WeakPolarHBondContact O-CG 3.25Å; A303-F307 PolarHBondContact O-N 3.12Å; A303-M462 HydrophobicContact CB-SD 4.33Å |
| 304 | T | 90 | Very high | 91.7 | Very high | 20 Ų | 20 | 17.7 Ų | 17.7 | 12% | 0.123 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -65.9 | -36.9 | 177.6 | -54.3 | 0 | 0 | 0 | 0 | 112.6 | G300 L301 F302 G306 F307 Q430 A433 | G300-T304 WeakPolarHBondContact O-CB 3.44Å; G300-T304 PolarHBondContact O-N 2.88Å; G300-T304 PolarHBondContact O-OG1 2.89Å; L301-T304 WeakPolarHBondContact O-CB 3.28Å; L301-T304 PolarHBondContact O-N 3.03Å; F302-T304 VanDerWaalsContact C-N 3.26Å; F302-T304 PolarHBondContact O-N 3.3Å; T304-G306 PolarHBondContact O-N 2.86Å; T304-F307 PolarHBondContact O-N 3.36Å; T304-Q430 HydrophobicContact CG2-CG 4Å; T304-Q430 VanDerWaalsContact OG1-CD 3.26Å; T304-Q430 WeakPolarHBondContact OG1-CG 3.24Å; T304-Q430 PolarHBondContact OG1-NE2 2.82Å; T304-A433 HydrophobicContact CG2-CB 4Å |
| 305 | L | 89.7 | Confident | 91.7 | Very high | 37 Ų | 37 | 15.2 Ų | 15.2 | 19% | 0.194 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -62.4 | -27.2 | 169.3 | -65.7 | 174.6 | 0 | 0 | 0 | 111.7 | L301 F302 A303 F308 A433 C458 | L301-L305 PolarHBondContact O-N 3.24Å; F302-L305 HydrophobicContact CD1-CD1 4.02Å; F302-L305 HydrophobicContact CE1-CD1 4.41Å; F302-L305 WeakPolarHBondContact O-CB 3.41Å; F302-L305 PolarHBondContact O-N 3.42Å; A303-L305 VanDerWaalsContact C-N 3.35Å; A303-L305 PolarHBondContact O-N 3.45Å; L305-F308 WeakPolarHBondContact O-CD1 3.48Å; L305-F308 WeakPolarHBondContact O-CE1 3.38Å; L305-A433 HydrophobicContact CD2-CB 3.87Å; L305-A433 WeakPolarHBondContact CD2-O 3.31Å; L305-A433 HydrophobicContact CG-CB 3.76Å; L305-C458 PolarHBondContact O-SG 2.87Å |
| 306 | G | 88 | Confident | 91.6 | Very high | 0 Ų | 0 | 14 Ų | 14 | 0% | 0 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -82.3 | -11.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | F302 A303 T304 C458 | F302-G306 PolarHBondContact O-N 3.45Å; A303-G306 WeakPolarHBondContact O-CA 3.39Å; A303-G306 PolarHBondContact O-N 2.97Å; T304-G306 PolarHBondContact O-N 2.86Å; G306-C458 WeakPolarHBondContact CA-O 3.48Å |
| 307 | F | 88.1 | Confident | 91.5 | Very high | 36 Ų | 36 | 14 Ų | 14 | 16% | 0.158 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -94.8 | -18.1 | -171.5 | -60.3 | -33.4 | 0 | 0 | 0 | 115 | A303 T304 P311 M370 Y393 M397 I400 M462 | A303-F307 HydrophobicContact CB-CE2 4Å; A303-F307 HydrophobicContact CB-CZ 3.79Å; A303-F307 WeakPolarHBondContact O-CD1 3.48Å; A303-F307 VanDerWaalsContact O-CD2 3.25Å; A303-F307 WeakPolarHBondContact O-CD2 3.4Å; A303-F307 WeakPolarHBondContact O-CE2 3.34Å; A303-F307 VanDerWaalsContact O-CG 3.24Å; A303-F307 WeakPolarHBondContact O-CG 3.25Å; A303-F307 PolarHBondContact O-N 3.12Å; T304-F307 PolarHBondContact O-N 3.36Å; F307-P311 VanDerWaalsContact O-CD 3.29Å; F307-P311 WeakPolarHBondContact O-CD 3.47Å; F307-M370 HydrophobicContact CD1-CE 3.5Å; F307-M370 VanDerWaalsContact CD1-CE 3.5Å; F307-M370 HydrophobicContact CD1-SD 4.28Å; F307-M370 HydrophobicContact CE1-CE 3.61Å; F307-M370 HydrophobicContact CE1-SD 3.78Å; F307-Y393 PolarHBondContact O-OH 3.04Å; F307-Y393 VanDerWaalsContact O-OH 3.08Å; F307-M397 HydrophobicContact CB-SD 4.17Å; F307-M397 HydrophobicContact CD1-CE 3.92Å; F307-M397 HydrophobicContact CD1-SD 3.38Å; F307-M397 WeakPolarHBondContact CD1-SD 3.38Å; F307-M397 HydrophobicContact CD2-CE 4.02Å; F307-M397 HydrophobicContact CD2-SD 4.33Å; F307-M397 HydrophobicContact CE1-CE 3.82Å; F307-M397 HydrophobicContact CE1-SD 3.75Å; F307-M397 HydrophobicContact CE2-CE 3.97Å; F307-M397 HydrophobicContact CG-CE 4.02Å; F307-M397 HydrophobicContact CG-SD 3.72Å; F307-M397 HydrophobicContact CZ-CE 3.88Å; F307-M397 HydrophobicContact CZ-SD 4.4Å; F307-I400 HydrophobicContact CE1-CG2 4.38Å; F307-I400 HydrophobicContact CZ-CG2 3.72Å; F307-M462 HydrophobicContact CD1-CE 3.37Å; F307-M462 HydrophobicContact CE1-CE 3.14Å; F307-M462 HydrophobicContact CE1-SD 4.11Å; F307-M462 HydrophobicContact CG-CE 4.45Å; F307-M462 HydrophobicContact CZ-CE 4.05Å |
| 308 | F | 83.8 | Confident | 91.6 | Very high | 26 Ų | 26 | 13.9 Ų | 13.9 | 11% | 0.114 | 7% | 0.07 | C | C | . | . | S | Bend | trans | -82.6 | -34.7 | -167 | 71.6 | -96.1 | 0 | 0 | 0 | 114.1 | L305 P311 L312 Y313 G437 P438 | L305-F308 WeakPolarHBondContact O-CD1 3.48Å; L305-F308 WeakPolarHBondContact O-CE1 3.38Å; F308-P311 WeakPolarHBondContact O-CD 3.41Å; F308-P311 WeakPolarHBondContact O-CG 3.04Å; F308-L312 HydrophobicContact CD2-CD2 4.48Å; F308-L312 WeakPolarHBondContact O-CB 3.27Å; F308-L312 PolarHBondContact O-N 2.87Å; F308-Y313 HydrophobicContact CE2-CE2 4.25Å; F308-G437 WeakPolarHBondContact CE1-O 3.45Å; F308-G437 WeakPolarHBondContact CE2-O 3.32Å; F308-G437 WeakPolarHBondContact CZ-O 3.35Å; F308-P438 HydrophobicContact CB-CG 4.01Å; F308-P438 HydrophobicContact CD2-CB 4.03Å; F308-P438 HydrophobicContact CD2-CG 3.98Å; F308-P438 HydrophobicContact CE2-CB 4.49Å; F308-P438 HydrophobicContact CG-CB 4.49Å; F308-P438 HydrophobicContact CG-CG 3.93Å |
| 309 | A | 88.6 | Confident | 91.4 | Very high | 0 Ų | 0 | 13.5 Ų | 13.5 | 0% | 0 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -67.1 | -43.7 | -170.1 | 0 | 0 | 0 | 0 | 0 | 114 | L312 Y313 A454 C458 | A309-L312 PolarHBondContact O-N 3.29Å; A309-Y313 HydrophobicContact CB-CD2 3.99Å; A309-Y313 WeakPolarHBondContact O-CB 3.36Å; A309-Y313 PolarHBondContact O-N 3.47Å; A309-A454 HydrophobicContact CB-CB 4.08Å; A309-C458 HydrophobicContact CB-CB 4.32Å; A309-C458 WeakPolarHBondContact CB-SG 3.4Å |
| 310 | P | 92.7 | Very high | 91.2 | Very high | 0 Ų | 0 | 16.8 Ų | 16.8 | 0% | 0 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -59.7 | -53.2 | -178.3 | -27.5 | 39.8 | 0 | 0 | 0 | 114 | L312 I314 M335 L374 Y393 F455 | P310-L312 VanDerWaalsContact C-N 3.28Å; P310-L312 PolarHBondContact O-N 3.41Å; P310-I314 WeakPolarHBondContact O-CB 3.39Å; P310-I314 WeakPolarHBondContact O-CG2 3.19Å; P310-I314 PolarHBondContact O-N 2.88Å; P310-I314 VanDerWaalsContact O-N 3.1Å; P310-M335 HydrophobicContact CB-SD 4.19Å; P310-L374 HydrophobicContact CG-CD2 3.59Å; P310-Y393 HydrophobicContact CB-CD1 4.23Å; P310-Y393 HydrophobicContact CB-CD2 4.35Å; P310-Y393 HydrophobicContact CB-CE1 3.82Å; P310-Y393 HydrophobicContact CB-CE2 3.95Å; P310-Y393 HydrophobicContact CB-CG 4.47Å; P310-Y393 HydrophobicContact CG-CD2 4.05Å; P310-Y393 HydrophobicContact CG-CE1 4.25Å; P310-Y393 HydrophobicContact CG-CE2 3.46Å; P310-Y393 VanDerWaalsContact CG-CE2 3.46Å; P310-F455 HydrophobicContact CB-CE1 3.95Å; P310-F455 HydrophobicContact CG-CD1 4.07Å; P310-F455 HydrophobicContact CG-CE1 3.75Å |
| 311 | P | 90.9 | Very high | 91.1 | Very high | 15 Ų | 15 | 20.3 Ų | 20.3 | 10% | 0.097 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -65.2 | -29.6 | 176.4 | 26.3 | -34.5 | 0 | 0 | 0 | 113.6 | K45 M165 F307 F308 M335 | K45-P311 HydrophobicContact CB-CB 4.43Å; K45-P311 HydrophobicContact CG-CB 4.46Å; M165-P311 HydrophobicContact CE-CB 3.85Å; F307-P311 VanDerWaalsContact O-CD 3.29Å; F307-P311 WeakPolarHBondContact O-CD 3.47Å; F308-P311 WeakPolarHBondContact O-CD 3.41Å; F308-P311 WeakPolarHBondContact O-CG 3.04Å; P311-M335 HydrophobicContact CB-CE 4.09Å |
| 312 | L | 92.4 | Very high | 90.8 | Very high | 10 Ų | 10 | 22 Ų | 22 | 5% | 0.052 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -83.1 | -40.1 | -175.3 | -171.5 | 62.8 | 0 | 0 | 0 | 113.7 | F47 G48 L51 F308 A309 P310 P438 | F47-L312 HydrophobicContact CD1-CD1 4.36Å; G48-L312 WeakPolarHBondContact CA-O 3.44Å; L51-L312 HydrophobicContact CD1-CD1 4.45Å; F308-L312 HydrophobicContact CD2-CD2 4.48Å; F308-L312 WeakPolarHBondContact O-CB 3.27Å; F308-L312 PolarHBondContact O-N 2.87Å; A309-L312 PolarHBondContact O-N 3.29Å; P310-L312 VanDerWaalsContact C-N 3.28Å; P310-L312 PolarHBondContact O-N 3.41Å; L312-P438 HydrophobicContact CD2-CB 3.87Å |
| 313 | Y | 94.3 | Very high | 90.6 | Very high | 0 Ų | 0 | 20.7 Ų | 20.7 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -116.8 | -2.9 | -169.4 | -60.8 | -53.8 | 0 | 0 | 0 | 114.5 | L51 S66 F308 A309 I315 E316 L317 P438 G442 Y451 A454 | L51-Y313 HydrophobicContact CD2-CD1 3.67Å; L51-Y313 HydrophobicContact CD2-CE1 3.51Å; S66-Y313 PolarHBondContact OG-OH 3.22Å; F308-Y313 HydrophobicContact CE2-CE2 4.25Å; A309-Y313 HydrophobicContact CB-CD2 3.99Å; A309-Y313 WeakPolarHBondContact O-CB 3.36Å; A309-Y313 PolarHBondContact O-N 3.47Å; Y313-I315 VanDerWaalsContact C-N 3.25Å; Y313-I315 PolarHBondContact O-N 2.92Å; Y313-E316 PolarHBondContact O-N 3.21Å; Y313-L317 WeakPolarHBondContact O-CB 3.3Å; Y313-L317 PolarHBondContact O-N 3.46Å; Y313-P438 PolarHBondContact OH-O 2.92Å; Y313-G442 WeakPolarHBondContact OH-CA 3.46Å; Y313-G442 PolarHBondContact OH-N 3.41Å; Y313-Y451 HydrophobicContact CD1-CD1 4.05Å; Y313-Y451 HydrophobicContact CD1-CE1 4.19Å; Y313-Y451 HydrophobicContact CG-CD1 4.31Å; Y313-A454 HydrophobicContact CD2-CB 3.65Å; Y313-A454 HydrophobicContact CE2-CB 3.78Å |
| 314 | I | 94.2 | Very high | 90.5 | Very high | 0 Ų | 0 | 26.5 Ų | 26.5 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -61.1 | -34.6 | -178.5 | -170.6 | 59.2 | 0 | 0 | 0 | 112.8 | P310 L317 S318 M331 L332 F377 L386 F455 | P310-I314 WeakPolarHBondContact O-CB 3.39Å; P310-I314 WeakPolarHBondContact O-CG2 3.19Å; P310-I314 PolarHBondContact O-N 2.88Å; P310-I314 VanDerWaalsContact O-N 3.1Å; I314-L317 HydrophobicContact CD1-CD2 4.24Å; I314-S318 WeakPolarHBondContact O-CB 3.48Å; I314-S318 PolarHBondContact O-N 3.18Å; I314-S318 PolarHBondContact O-OG 3.27Å; I314-M331 HydrophobicContact CG1-CB 3.76Å; I314-M331 HydrophobicContact CG1-CG 4.3Å; I314-M331 HydrophobicContact CG2-CB 4.44Å; I314-L332 HydrophobicContact CG2-CD2 3.35Å; I314-L332 HydrophobicContact CG2-CG 4.17Å; I314-F377 HydrophobicContact CD1-CD1 3.86Å; I314-F377 HydrophobicContact CD1-CE1 3.62Å; I314-L386 HydrophobicContact CD1-CD1 4.05Å; I314-L386 HydrophobicContact CD1-CD2 4.1Å; I314-L386 HydrophobicContact CD1-CG 4.1Å; I314-F455 HydrophobicContact CD1-CZ 4.35Å |
| 315 | I | 92.1 | Very high | 90.3 | Very high | 1 Ų | 1 | 28.4 Ų | 28.4 | 1% | 0.005 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -63.3 | -51.4 | 176.5 | -65.9 | 177.7 | 0 | 0 | 0 | 109.6 | I49 Y313 L317 S318 V319 A328 L332 | I49-I315 HydrophobicContact CG1-CD1 3.78Å; Y313-I315 VanDerWaalsContact C-N 3.25Å; Y313-I315 PolarHBondContact O-N 2.92Å; I315-L317 PolarHBondContact O-N 3.22Å; I315-S318 WeakPolarHBondContact O-CB 3.42Å; I315-S318 PolarHBondContact O-N 3.02Å; I315-V319 HydrophobicContact CG2-CG2 4.47Å; I315-V319 WeakPolarHBondContact O-CG2 3.47Å; I315-V319 PolarHBondContact O-N 3.17Å; I315-A328 HydrophobicContact CG2-CB 4.05Å; I315-L332 HydrophobicContact CD1-CD1 3.57Å; I315-L332 HydrophobicContact CD1-CG 4.15Å; I315-L332 HydrophobicContact CG1-CD1 4.16Å; I315-L332 HydrophobicContact CG1-CG 4.18Å |
| 316 | E | 91.6 | Very high | 90 | Very high | 7 Ų | 7 | 31.9 Ų | 31.9 | 3% | 0.033 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -66.3 | -37.6 | -178.4 | -61.3 | -54.9 | 134 | 0 | 0 | 112.3 | L51 Q52 Y313 S320 R325 Y451 | L51-E316 HydrophobicContact CD2-CG 4.31Å; Q52-E316 PolarHBondContact OE1-OE2 2.91Å; Y313-E316 PolarHBondContact O-N 3.21Å; E316-S320 VanDerWaalsContact O-CB 3.32Å; E316-S320 WeakPolarHBondContact O-CB 3.33Å; E316-S320 PolarHBondContact O-N 2.77Å; E316-S320 PolarHBondContact O-OG 3.45Å; E316-R325 IonicContact OE1-NH2 3.5Å; E316-R325 PolarHBondContact OE1-NH2 2.99Å; E316-Y451 HydrophobicContact CB-CD1 3.87Å; E316-Y451 HydrophobicContact CB-CD2 4.03Å; E316-Y451 HydrophobicContact CB-CE1 3.57Å; E316-Y451 HydrophobicContact CB-CE2 3.73Å; E316-Y451 HydrophobicContact CB-CG 4.1Å; E316-Y451 VanDerWaalsContact CB-CZ 3.49Å; E316-Y451 HydrophobicContact CG-CE1 4.14Å |
| 317 | L | 92.8 | Very high | 90 | Very high | 1 Ų | 1 | 35.8 Ų | 35.8 | 1% | 0.005 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -60.6 | -46.2 | 171.7 | -175.6 | 70.3 | 0 | 0 | 0 | 110.9 | Y313 I314 I315 S320 H321 L386 F455 | Y313-L317 WeakPolarHBondContact O-CB 3.3Å; Y313-L317 PolarHBondContact O-N 3.46Å; I314-L317 HydrophobicContact CD1-CD2 4.24Å; I315-L317 PolarHBondContact O-N 3.22Å; L317-S320 PolarHBondContact O-N 3.5Å; L317-S320 PolarHBondContact O-OG 2.65Å; L317-H321 PolarHBondContact O-N 2.97Å; L317-H321 PolarHBondContact O-ND1 2.89Å; L317-L386 HydrophobicContact CD2-CD1 4.36Å; L317-F455 HydrophobicContact CB-CE2 4.23Å; L317-F455 HydrophobicContact CD2-CD2 4.13Å; L317-F455 HydrophobicContact CD2-CE1 4.38Å; L317-F455 HydrophobicContact CD2-CE2 3.66Å; L317-F455 HydrophobicContact CD2-CZ 3.79Å; L317-F455 HydrophobicContact CG-CE2 4.4Å |
| 318 | S | 92.6 | Very high | 90.1 | Very high | 0 Ų | 0 | 34 Ų | 34 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -61.1 | -49.1 | 179.3 | -65.4 | 0 | 0 | 0 | 0 | 111.5 | I314 I315 S320 H321 M323 A328 L386 | I314-S318 WeakPolarHBondContact O-CB 3.48Å; I314-S318 PolarHBondContact O-N 3.18Å; I314-S318 PolarHBondContact O-OG 3.27Å; I315-S318 WeakPolarHBondContact O-CB 3.42Å; I315-S318 PolarHBondContact O-N 3.02Å; S318-S320 VanDerWaalsContact C-N 3.32Å; S318-S320 PolarHBondContact O-N 3.15Å; S318-H321 PolarHBondContact O-N 3.03Å; S318-H321 VanDerWaalsContact O-N 3.15Å; S318-M323 WeakPolarHBondContact CB-SD 3.31Å; S318-M323 VanDerWaalsContact O-CB 3.29Å; S318-M323 WeakPolarHBondContact O-CB 3.21Å; S318-M323 VanDerWaalsContact O-CG 3.27Å; S318-M323 WeakPolarHBondContact O-CG 3.3Å; S318-M323 PolarHBondContact O-N 3.09Å; S318-A328 VanDerWaalsContact CB-CB 3.49Å; S318-L386 WeakPolarHBondContact OG-CD2 3.31Å |
| 319 | V | 91.9 | Very high | 90.4 | Very high | 47 Ų | 47 | 33 Ų | 33 | 29% | 0.285 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -63.7 | -37.9 | 178.3 | 174.1 | 0 | 0 | 0 | 0 | 111.1 | I315 H321 G322 R325 A328 | I315-V319 HydrophobicContact CG2-CG2 4.47Å; I315-V319 WeakPolarHBondContact O-CG2 3.47Å; I315-V319 PolarHBondContact O-N 3.17Å; V319-H321 PolarHBondContact O-N 3.14Å; V319-G322 PolarHBondContact O-N 3.43Å; V319-R325 HydrophobicContact CG2-CB 4.45Å; V319-R325 HydrophobicContact CG2-CG 4.4Å; V319-A328 HydrophobicContact CG2-CB 3.92Å |
| 320 | S | 90.1 | Very high | 90.4 | Very high | 68 Ų | 68 | 38 Ų | 38 | 48% | 0.476 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -63.5 | -22.2 | 177.1 | 74.7 | 0 | 0 | 0 | 0 | 114.1 | E316 L317 S318 G322 | E316-S320 VanDerWaalsContact O-CB 3.32Å; E316-S320 WeakPolarHBondContact O-CB 3.33Å; E316-S320 PolarHBondContact O-N 2.77Å; E316-S320 PolarHBondContact O-OG 3.45Å; L317-S320 PolarHBondContact O-N 3.5Å; L317-S320 PolarHBondContact O-OG 2.65Å; S318-S320 VanDerWaalsContact C-N 3.32Å; S318-S320 PolarHBondContact O-N 3.15Å; S320-G322 VanDerWaalsContact C-N 3.3Å |
| 321 | H | 89.7 | Confident | 90.4 | Very high | 75 Ų | 75 | 38 Ų | 38 | 35% | 0.347 | 20% | 0.203 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -88.2 | 6.9 | 173.3 | -70.4 | 94.6 | 0 | 0 | 0 | 113.5 | L317 S318 V319 T381 | L317-H321 PolarHBondContact O-N 2.97Å; L317-H321 PolarHBondContact O-ND1 2.89Å; S318-H321 PolarHBondContact O-N 3.03Å; S318-H321 VanDerWaalsContact O-N 3.15Å; V319-H321 PolarHBondContact O-N 3.14Å; H321-T381 VanDerWaalsContact CD2-CG2 3.49Å; H321-T381 WeakPolarHBondContact CD2-CG2 3.47Å |
| 322 | G | 86.8 | Confident | 90.5 | Very high | 71 Ų | 71 | 37.2 Ų | 37.2 | 73% | 0.732 | 20% | 0.198 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 89 | 14.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 114.7 | V319 S320 | V319-G322 PolarHBondContact O-N 3.43Å; S320-G322 VanDerWaalsContact C-N 3.3Å |
| 323 | M | 90.7 | Very high | 90.5 | Very high | 20 Ų | 20 | 37.5 Ų | 37.5 | 10% | 0.099 | 20% | 0.201 | C | C | . | . | trans | -75.9 | 149.5 | 173.6 | -60.5 | -178.4 | 156.3 | 0 | 0 | 112.1 | S318 M331 F383 L386 | S318-M323 WeakPolarHBondContact CB-SD 3.31Å; S318-M323 VanDerWaalsContact O-CB 3.29Å; S318-M323 WeakPolarHBondContact O-CB 3.21Å; S318-M323 VanDerWaalsContact O-CG 3.27Å; S318-M323 WeakPolarHBondContact O-CG 3.3Å; S318-M323 PolarHBondContact O-N 3.09Å; M323-M331 HydrophobicContact CE-CE 4.29Å; M323-F383 HydrophobicContact CE-CB 3.41Å; M323-F383 VanDerWaalsContact CE-CB 3.41Å; M323-F383 HydrophobicContact CE-CD2 3.35Å; M323-F383 HydrophobicContact CE-CE2 4.45Å; M323-F383 HydrophobicContact CE-CG 3.77Å; M323-F383 HydrophobicContact SD-CD2 4.05Å; M323-L386 HydrophobicContact CE-CD2 4.07Å; M323-L386 HydrophobicContact SD-CD2 4.32Å | ||
| 324 | E | 89.8 | Confident | 90.5 | Very high | 122 Ų | 122 | 39.9 Ų | 39.9 | 57% | 0.57 | 21% | 0.213 | S | C | * | . | trans | -66.4 | 146.1 | 169.3 | -170.8 | 168.6 | -164.7 | 0 | 0 | 110.9 | E326 Q327 A328 | E324-E326 HydrophobicContact CG-CB 4.45Å; E324-E326 PolarHBondContact O-N 3.23Å; E324-Q327 HydrophobicContact CB-CB 4.46Å; E324-Q327 HydrophobicContact CB-CG 4.24Å; E324-Q327 WeakPolarHBondContact O-CB 3.49Å; E324-Q327 PolarHBondContact O-N 3.22Å; E324-A328 PolarHBondContact O-N 2.74Å | ||
| 325 | R | 85.6 | Confident | 90.5 | Very high | 61 Ų | 61 | 40 Ų | 40 | 23% | 0.23 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -62.1 | -33.6 | -176.9 | -162.3 | 165.7 | -152.7 | 141.2 | 14.4 | 112.7 | E316 V319 A328 T329 | E316-R325 IonicContact OE1-NH2 3.5Å; E316-R325 PolarHBondContact OE1-NH2 2.99Å; V319-R325 HydrophobicContact CG2-CB 4.45Å; V319-R325 HydrophobicContact CG2-CG 4.4Å; R325-A328 PolarHBondContact O-N 2.66Å; R325-T329 PolarHBondContact O-N 3.22Å; R325-T329 PolarHBondContact O-OG1 3.19Å |
| 326 | E | 83.8 | Confident | 90.6 | Very high | 110 Ų | 110 | 40 Ų | 40 | 51% | 0.514 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -61.9 | -45.2 | 173.8 | -166 | -172.5 | 150.7 | 0 | 0 | 111.3 | E324 A328 T329 Y330 | E324-E326 HydrophobicContact CG-CB 4.45Å; E324-E326 PolarHBondContact O-N 3.23Å; E326-A328 VanDerWaalsContact C-N 3.34Å; E326-A328 PolarHBondContact O-N 2.82Å; E326-T329 PolarHBondContact O-N 3.35Å; E326-Y330 HydrophobicContact CG-CE2 4.11Å; E326-Y330 WeakPolarHBondContact O-CD2 3.47Å; E326-Y330 PolarHBondContact O-N 3.07Å; E326-Y330 PolarHBondContact OE1-OH 3.23Å |
| 327 | Q | 87.6 | Confident | 90.8 | Very high | 81 Ų | 81 | 42.7 Ų | 42.7 | 38% | 0.379 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -63.7 | -38.9 | 176.7 | -68.3 | -177.4 | -22.9 | 0 | 0 | 112.4 | E324 T329 Y330 F383 | E324-Q327 HydrophobicContact CB-CB 4.46Å; E324-Q327 HydrophobicContact CB-CG 4.24Å; E324-Q327 WeakPolarHBondContact O-CB 3.49Å; E324-Q327 PolarHBondContact O-N 3.22Å; Q327-T329 VanDerWaalsContact C-N 3.34Å; Q327-T329 PolarHBondContact O-N 3.12Å; Q327-Y330 PolarHBondContact O-N 3.27Å; Q327-F383 HydrophobicContact CB-CD2 4.38Å; Q327-F383 HydrophobicContact CB-CE2 3.92Å; Q327-F383 HydrophobicContact CG-CE2 4.49Å |
| 328 | A | 89.8 | Confident | 90.9 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -63.8 | -37.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | I315 S318 V319 E324 R325 E326 Y330 M331 | I315-A328 HydrophobicContact CG2-CB 4.05Å; S318-A328 VanDerWaalsContact CB-CB 3.49Å; V319-A328 HydrophobicContact CG2-CB 3.92Å; E324-A328 PolarHBondContact O-N 2.74Å; R325-A328 PolarHBondContact O-N 2.66Å; E326-A328 VanDerWaalsContact C-N 3.34Å; E326-A328 PolarHBondContact O-N 2.82Å; A328-Y330 VanDerWaalsContact C-N 3.31Å; A328-Y330 PolarHBondContact O-N 2.96Å; A328-M331 VanDerWaalsContact O-CB 3.27Å; A328-M331 WeakPolarHBondContact O-CB 3.25Å; A328-M331 WeakPolarHBondContact O-CG 3.34Å; A328-M331 PolarHBondContact O-N 2.98Å; A328-M331 VanDerWaalsContact O-N 3.15Å |
| 329 | T | 89.6 | Confident | 90.9 | Very high | 4 Ų | 4 | 43.1 Ų | 43.1 | 3% | 0.025 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -66.7 | -31.8 | 177.3 | -60.6 | 0 | 0 | 0 | 0 | 112 | P170 S173 R325 E326 Q327 M331 L332 | P170-T329 HydrophobicContact CB-CG2 4.3Å; P170-T329 HydrophobicContact CG-CG2 4.25Å; S173-T329 PolarHBondContact OG-OG1 2.81Å; R325-T329 PolarHBondContact O-N 3.22Å; R325-T329 PolarHBondContact O-OG1 3.19Å; E326-T329 PolarHBondContact O-N 3.35Å; Q327-T329 VanDerWaalsContact C-N 3.34Å; Q327-T329 PolarHBondContact O-N 3.12Å; T329-M331 PolarHBondContact O-N 3.2Å; T329-L332 PolarHBondContact O-N 3.36Å |
| 330 | Y | 90.6 | Very high | 90.9 | Very high | 104 Ų | 104 | 42.7 Ų | 42.7 | 41% | 0.408 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -61.3 | -23.3 | 173.6 | -65.7 | -49.7 | 0 | 0 | 0 | 113.1 | E326 Q327 A328 L332 S333 I334 | E326-Y330 HydrophobicContact CG-CE2 4.11Å; E326-Y330 WeakPolarHBondContact O-CD2 3.47Å; E326-Y330 PolarHBondContact O-N 3.07Å; E326-Y330 PolarHBondContact OE1-OH 3.23Å; Q327-Y330 PolarHBondContact O-N 3.27Å; A328-Y330 VanDerWaalsContact C-N 3.31Å; A328-Y330 PolarHBondContact O-N 2.96Å; Y330-L332 VanDerWaalsContact C-N 3.34Å; Y330-L332 PolarHBondContact O-N 3.4Å; Y330-S333 PolarHBondContact O-N 3.08Å; Y330-S333 VanDerWaalsContact O-N 3.14Å; Y330-I334 VanDerWaalsContact O-CG1 3.31Å; Y330-I334 WeakPolarHBondContact O-CG1 3.37Å; Y330-I334 PolarHBondContact O-N 3.39Å |
| 331 | M | 92.3 | Very high | 91.1 | Very high | 0 Ų | 0 | 45.5 Ų | 45.5 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -62.3 | -40 | 176 | -62.7 | -64.9 | 146.6 | 0 | 0 | 112.2 | I314 M323 A328 T329 S333 I334 M335 F383 L386 A387 | I314-M331 HydrophobicContact CG1-CB 3.76Å; I314-M331 HydrophobicContact CG1-CG 4.3Å; I314-M331 HydrophobicContact CG2-CB 4.44Å; M323-M331 HydrophobicContact CE-CE 4.29Å; A328-M331 VanDerWaalsContact O-CB 3.27Å; A328-M331 WeakPolarHBondContact O-CB 3.25Å; A328-M331 WeakPolarHBondContact O-CG 3.34Å; A328-M331 PolarHBondContact O-N 2.98Å; A328-M331 VanDerWaalsContact O-N 3.15Å; T329-M331 PolarHBondContact O-N 3.2Å; M331-S333 VanDerWaalsContact C-N 3.3Å; M331-S333 PolarHBondContact O-N 3.29Å; M331-I334 PolarHBondContact O-N 2.88Å; M331-M335 VanDerWaalsContact O-CB 3.27Å; M331-M335 WeakPolarHBondContact O-CB 3.4Å; M331-M335 PolarHBondContact O-N 3.43Å; M331-F383 HydrophobicContact CE-CD1 4.48Å; M331-F383 HydrophobicContact CE-CD2 3.4Å; M331-F383 HydrophobicContact CE-CE1 4.24Å; M331-F383 HydrophobicContact CE-CE2 3.06Å; M331-F383 HydrophobicContact CE-CG 4.1Å; M331-F383 HydrophobicContact CE-CZ 3.54Å; M331-L386 HydrophobicContact SD-CG 4.44Å; M331-A387 HydrophobicContact CE-CB 4.06Å; M331-A387 HydrophobicContact SD-CB 4.08Å |
| 332 | L | 91.7 | Very high | 91.1 | Very high | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -62.3 | -41 | 174.3 | -63.6 | -177.8 | 0 | 0 | 0 | 110.8 | I49 M165 A169 I314 I315 T329 Y330 M335 A336 | I49-L332 HydrophobicContact CG1-CD1 4.23Å; M165-L332 HydrophobicContact CE-CB 3.83Å; M165-L332 HydrophobicContact CE-CD1 4.47Å; M165-L332 HydrophobicContact CE-CD2 3.32Å; M165-L332 HydrophobicContact CE-CG 4.04Å; M165-L332 HydrophobicContact CG-CB 4.26Å; A169-L332 HydrophobicContact CB-CD1 4.27Å; I314-L332 HydrophobicContact CG2-CD2 3.35Å; I314-L332 HydrophobicContact CG2-CG 4.17Å; I315-L332 HydrophobicContact CD1-CD1 3.57Å; I315-L332 HydrophobicContact CD1-CG 4.15Å; I315-L332 HydrophobicContact CG1-CD1 4.16Å; I315-L332 HydrophobicContact CG1-CG 4.18Å; T329-L332 PolarHBondContact O-N 3.36Å; Y330-L332 VanDerWaalsContact C-N 3.34Å; Y330-L332 PolarHBondContact O-N 3.4Å; L332-M335 HydrophobicContact CD2-CE 4.05Å; L332-A336 VanDerWaalsContact O-CB 3.3Å; L332-A336 WeakPolarHBondContact O-CB 3.23Å; L332-A336 PolarHBondContact O-N 3.46Å |
| 333 | S | 93.1 | Very high | 91.2 | Very high | 16 Ų | 16 | 39 Ų | 39 | 11% | 0.112 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -67.8 | -44.7 | 179.4 | -56.6 | 0 | 0 | 0 | 0 | 112.9 | S166 P170 Y330 M331 M335 A336 V337 | S166-S333 PolarHBondContact O-OG 2.77Å; P170-S333 VanDerWaalsContact CG-OG 3.29Å; P170-S333 WeakPolarHBondContact CG-OG 2.98Å; Y330-S333 PolarHBondContact O-N 3.08Å; Y330-S333 VanDerWaalsContact O-N 3.14Å; M331-S333 VanDerWaalsContact C-N 3.3Å; M331-S333 PolarHBondContact O-N 3.29Å; S333-M335 VanDerWaalsContact C-N 3.33Å; S333-M335 PolarHBondContact O-N 3.09Å; S333-A336 PolarHBondContact O-N 3.21Å; S333-V337 WeakPolarHBondContact O-CG2 3.44Å; S333-V337 PolarHBondContact O-N 2.92Å |
| 334 | I | 94.5 | Very high | 91 | Very high | 49 Ų | 49 | 43.4 Ų | 43.4 | 25% | 0.251 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -59.7 | -46.5 | 176.4 | -69.5 | 167.6 | 0 | 0 | 0 | 110.2 | Y330 M331 A336 V337 A338 A387 C390 I391 | Y330-I334 VanDerWaalsContact O-CG1 3.31Å; Y330-I334 WeakPolarHBondContact O-CG1 3.37Å; Y330-I334 PolarHBondContact O-N 3.39Å; M331-I334 PolarHBondContact O-N 2.88Å; I334-A336 VanDerWaalsContact C-N 3.35Å; I334-A336 PolarHBondContact O-N 2.79Å; I334-V337 PolarHBondContact O-N 3.25Å; I334-A338 WeakPolarHBondContact O-CB 3.14Å; I334-A338 PolarHBondContact O-N 3.4Å; I334-A387 HydrophobicContact CD1-CB 4.04Å; I334-C390 HydrophobicContact CG2-CB 4.18Å; I334-I391 HydrophobicContact CG2-CD1 4.12Å; I334-I391 HydrophobicContact CG2-CG1 3.38Å |
| 335 | M | 94.6 | Very high | 90.9 | Very high | 3 Ų | 3 | 40.7 Ų | 40.7 | 2% | 0.015 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -60.1 | -44.4 | 177.8 | -174.7 | 168.1 | 62.8 | 0 | 0 | 112 | M165 P310 P311 M331 L332 S333 A338 E339 C390 Y393 G394 | M165-M335 HydrophobicContact CE-CE 3.23Å; M165-M335 HydrophobicContact SD-CE 4.2Å; P310-M335 HydrophobicContact CB-SD 4.19Å; P311-M335 HydrophobicContact CB-CE 4.09Å; M331-M335 VanDerWaalsContact O-CB 3.27Å; M331-M335 WeakPolarHBondContact O-CB 3.4Å; M331-M335 PolarHBondContact O-N 3.43Å; L332-M335 HydrophobicContact CD2-CE 4.05Å; S333-M335 VanDerWaalsContact C-N 3.33Å; S333-M335 PolarHBondContact O-N 3.09Å; M335-A338 PolarHBondContact O-N 3.27Å; M335-E339 WeakPolarHBondContact O-CB 3.31Å; M335-E339 PolarHBondContact O-N 2.9Å; M335-C390 HydrophobicContact CB-CB 4.17Å; M335-Y393 HydrophobicContact CG-CD1 3.74Å; M335-Y393 HydrophobicContact CG-CE1 4.29Å; M335-Y393 HydrophobicContact SD-CD1 3.28Å; M335-Y393 WeakPolarHBondContact SD-CD1 3.15Å; M335-Y393 HydrophobicContact SD-CE1 3.53Å; M335-Y393 VanDerWaalsContact SD-CE1 3.53Å; M335-Y393 HydrophobicContact SD-CG 4.32Å; M335-G394 WeakPolarHBondContact O-CA 3.12Å |
| 336 | A | 93.8 | Very high | 90.8 | Very high | 0 Ų | 0 | 38.2 Ų | 38.2 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -69 | -39.1 | -179.5 | 0 | 0 | 0 | 0 | 0 | 113 | S162 M165 L332 S333 I334 E339 I340 | S162-A336 WeakPolarHBondContact CB-O 3.43Å; S162-A336 WeakPolarHBondContact O-CB 3.48Å; M165-A336 HydrophobicContact CB-CB 3.72Å; M165-A336 HydrophobicContact CG-CB 3.82Å; M165-A336 HydrophobicContact SD-CB 4.03Å; L332-A336 VanDerWaalsContact O-CB 3.3Å; L332-A336 WeakPolarHBondContact O-CB 3.23Å; L332-A336 PolarHBondContact O-N 3.46Å; S333-A336 PolarHBondContact O-N 3.21Å; I334-A336 VanDerWaalsContact C-N 3.35Å; I334-A336 PolarHBondContact O-N 2.79Å; A336-E339 WeakPolarHBondContact O-CB 3.48Å; A336-E339 PolarHBondContact O-N 2.84Å; A336-I340 WeakPolarHBondContact O-CG1 3.49Å; A336-I340 PolarHBondContact O-N 3.29Å |
| 337 | V | 94.7 | Very high | 90.4 | Very high | 64 Ų | 64 | 34.6 Ų | 34.6 | 39% | 0.388 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -62.1 | -46.2 | 174.3 | 170.9 | 0 | 0 | 0 | 0 | 110.2 | S333 I334 E339 I340 F341 | S333-V337 WeakPolarHBondContact O-CG2 3.44Å; S333-V337 PolarHBondContact O-N 2.92Å; I334-V337 PolarHBondContact O-N 3.25Å; V337-E339 VanDerWaalsContact C-N 3.27Å; V337-E339 PolarHBondContact O-N 2.79Å; V337-I340 WeakPolarHBondContact O-CB 3Å; V337-I340 PolarHBondContact O-N 2.99Å; V337-F341 HydrophobicContact CG1-CD2 4.06Å; V337-F341 HydrophobicContact CG1-CE2 3.66Å; V337-F341 WeakPolarHBondContact O-CD2 3.44Å; V337-F341 PolarHBondContact O-N 2.91Å |
| 338 | A | 95.4 | Very high | 90 | Very high | 8 Ų | 8 | 39.1 Ų | 39.1 | 7% | 0.066 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -62.8 | -34.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | I334 M335 I340 F341 G342 I391 F395 | I334-A338 WeakPolarHBondContact O-CB 3.14Å; I334-A338 PolarHBondContact O-N 3.4Å; M335-A338 PolarHBondContact O-N 3.27Å; A338-I340 VanDerWaalsContact C-N 3.34Å; A338-I340 PolarHBondContact O-N 3.16Å; A338-F341 PolarHBondContact O-N 3.27Å; A338-G342 PolarHBondContact O-N 2.79Å; A338-I391 HydrophobicContact CB-CB 4.39Å; A338-I391 HydrophobicContact CB-CG2 4.17Å; A338-I391 VanDerWaalsContact CB-O 3.25Å; A338-I391 WeakPolarHBondContact CB-O 3.47Å; A338-F395 WeakPolarHBondContact O-CA 3.36Å |
| 339 | E | 93.9 | Very high | 89.7 | Confident | 3 Ų | 3 | 40.9 Ų | 40.9 | 1% | 0.014 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -58.1 | -44.2 | 173.5 | -165.9 | -177.9 | 169 | 0 | 0 | 112.4 | K45 S162 M335 A336 V337 F341 G342 R343 G394 | K45-E339 VanDerWaalsContact NZ-CD 3.31Å; K45-E339 IonicContact NZ-OE1 2.96Å; K45-E339 PolarHBondContact NZ-OE1 3.49Å; K45-E339 IonicContact NZ-OE2 3.18Å; K45-E339 PolarHBondContact NZ-OE2 2.93Å; S162-E339 PolarHBondContact OG-OE2 3.42Å; M335-E339 WeakPolarHBondContact O-CB 3.31Å; M335-E339 PolarHBondContact O-N 2.9Å; A336-E339 WeakPolarHBondContact O-CB 3.48Å; A336-E339 PolarHBondContact O-N 2.84Å; V337-E339 VanDerWaalsContact C-N 3.27Å; V337-E339 PolarHBondContact O-N 2.79Å; E339-F341 PolarHBondContact O-N 2.83Å; E339-G342 PolarHBondContact O-N 3.1Å; E339-R343 WeakPolarHBondContact O-CG 2.98Å; E339-R343 PolarHBondContact O-N 2.88Å; E339-R343 VanDerWaalsContact O-N 3.1Å; E339-R343 IonicContact OE1-CZ 3.44Å; E339-R343 IonicContact OE1-NE 2.76Å; E339-R343 IonicContact OE1-NH2 2.66Å; E339-R343 PolarHBondContact OE1-NH2 3.42Å; E339-G394 WeakPolarHBondContact CA-O 3.35Å |
| 340 | I | 91.9 | Very high | 89.1 | Confident | 37 Ų | 37 | 42.8 Ų | 42.8 | 19% | 0.19 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -59 | -48.1 | 176.7 | -63.4 | 170.2 | 0 | 0 | 0 | 110.3 | T159 S162 A336 V337 A338 G342 R343 F344 | T159-I340 HydrophobicContact CG2-CG2 4.27Å; S162-I340 VanDerWaalsContact CB-CG1 3.45Å; A336-I340 WeakPolarHBondContact O-CG1 3.49Å; A336-I340 PolarHBondContact O-N 3.29Å; V337-I340 WeakPolarHBondContact O-CB 3Å; V337-I340 PolarHBondContact O-N 2.99Å; A338-I340 VanDerWaalsContact C-N 3.34Å; A338-I340 PolarHBondContact O-N 3.16Å; I340-G342 VanDerWaalsContact C-N 3.34Å; I340-G342 PolarHBondContact O-N 2.99Å; I340-R343 PolarHBondContact O-N 3.22Å; I340-F344 HydrophobicContact CG2-CD2 3.91Å; I340-F344 HydrophobicContact CG2-CE2 3.55Å; I340-F344 WeakPolarHBondContact O-CD2 3.35Å; I340-F344 PolarHBondContact O-N 3.21Å |
| 341 | F | 92.4 | Very high | 88.3 | Confident | 128 Ų | 128 | 41.2 Ų | 41.2 | 56% | 0.561 | 22% | 0.216 | S | C | * | . | H | α-helix | trans | -60.7 | -42.3 | 177.8 | -74.5 | -75.7 | 0 | 0 | 0 | 112.3 | V337 A338 E339 R343 F344 V345 | V337-F341 HydrophobicContact CG1-CD2 4.06Å; V337-F341 HydrophobicContact CG1-CE2 3.66Å; V337-F341 WeakPolarHBondContact O-CD2 3.44Å; V337-F341 PolarHBondContact O-N 2.91Å; A338-F341 PolarHBondContact O-N 3.27Å; E339-F341 PolarHBondContact O-N 2.83Å; F341-R343 VanDerWaalsContact C-N 3.32Å; F341-R343 PolarHBondContact O-N 3.42Å; F341-F344 PolarHBondContact O-N 3.06Å; F341-V345 WeakPolarHBondContact O-CG2 3.16Å; F341-V345 PolarHBondContact O-N 3.45Å |
| 342 | G | 91 | Very high | 87.6 | Confident | 0 Ų | 0 | 44.9 Ų | 44.9 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -56.2 | -44 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | A338 E339 I340 F344 V345 I346 F395 T399 | A338-G342 PolarHBondContact O-N 2.79Å; E339-G342 PolarHBondContact O-N 3.1Å; I340-G342 VanDerWaalsContact C-N 3.34Å; I340-G342 PolarHBondContact O-N 2.99Å; G342-F344 PolarHBondContact O-N 3.37Å; G342-V345 PolarHBondContact O-N 3.33Å; G342-I346 WeakPolarHBondContact O-CG2 3.35Å; G342-I346 PolarHBondContact O-N 2.9Å; G342-F395 WeakPolarHBondContact CA-O 3.02Å; G342-T399 PolarHBondContact O-OG1 3.36Å |
| 343 | R | 88.6 | Confident | 86.7 | Confident | 10 Ų | 10 | 50.4 Ų | 50.4 | 4% | 0.038 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -60.8 | -42.5 | 178.1 | -65.5 | 177.9 | -179.6 | -140.8 | -9.7 | 112.4 | S158 E161 E339 I340 F341 I346 G347 G398 C402 | S158-R343 PolarHBondContact O-NH1 3.43Å; E161-R343 IonicContact OE1-CZ 3.88Å; E161-R343 IonicContact OE1-NH2 2.85Å; E161-R343 PolarHBondContact OE1-NH2 3.05Å; E161-R343 IonicContact OE2-CZ 3.15Å; E161-R343 IonicContact OE2-NH1 2.76Å; E161-R343 PolarHBondContact OE2-NH1 3.47Å; E161-R343 VanDerWaalsContact OE2-NH1 3.1Å; E161-R343 IonicContact OE2-NH2 3.34Å; E161-R343 PolarHBondContact OE2-NH2 2.94Å; E339-R343 WeakPolarHBondContact O-CG 2.98Å; E339-R343 PolarHBondContact O-N 2.88Å; E339-R343 VanDerWaalsContact O-N 3.1Å; E339-R343 IonicContact OE1-CZ 3.44Å; E339-R343 IonicContact OE1-NE 2.76Å; E339-R343 IonicContact OE1-NH2 2.66Å; E339-R343 PolarHBondContact OE1-NH2 3.42Å; I340-R343 PolarHBondContact O-N 3.22Å; F341-R343 VanDerWaalsContact C-N 3.32Å; F341-R343 PolarHBondContact O-N 3.42Å; R343-I346 WeakPolarHBondContact O-CG2 3.42Å; R343-G347 PolarHBondContact O-N 3.31Å; R343-G398 WeakPolarHBondContact CG-O 3.4Å; R343-C402 VanDerWaalsContact CG-SG 3.51Å |
| 344 | F | 85.8 | Confident | 85.8 | Confident | 112 Ų | 112 | 54.8 Ų | 54.8 | 49% | 0.491 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -71.2 | -44.7 | 178.6 | -74.1 | -69.8 | 0 | 0 | 0 | 112.5 | L156 T159 I340 F341 G342 I346 G347 W348 | L156-F344 HydrophobicContact CD1-CZ 4.1Å; T159-F344 HydrophobicContact CG2-CE2 4.33Å; T159-F344 HydrophobicContact CG2-CZ 4.45Å; I340-F344 HydrophobicContact CG2-CD2 3.91Å; I340-F344 HydrophobicContact CG2-CE2 3.55Å; I340-F344 WeakPolarHBondContact O-CD2 3.35Å; I340-F344 PolarHBondContact O-N 3.21Å; F341-F344 PolarHBondContact O-N 3.06Å; G342-F344 PolarHBondContact O-N 3.37Å; F344-I346 PolarHBondContact O-N 3.27Å; F344-G347 PolarHBondContact O-N 3Å; F344-W348 PolarHBondContact O-N 3.35Å; F344-W348 VanDerWaalsContact O-N 3.11Å |
| 345 | V | 87.1 | Confident | 84.8 | Confident | 64 Ų | 64 | 56.1 Ų | 56.1 | 39% | 0.388 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -62.8 | -44.6 | -178 | 172.7 | 0 | 0 | 0 | 0 | 110.8 | F341 G342 G347 W348 V349 F395 | F341-V345 WeakPolarHBondContact O-CG2 3.16Å; F341-V345 PolarHBondContact O-N 3.45Å; G342-V345 PolarHBondContact O-N 3.33Å; V345-G347 VanDerWaalsContact C-N 3.33Å; V345-G347 PolarHBondContact O-N 2.89Å; V345-W348 WeakPolarHBondContact O-CB 3.18Å; V345-W348 PolarHBondContact O-N 3.38Å; V345-V349 HydrophobicContact CG1-CG2 4.19Å; V345-V349 VanDerWaalsContact O-CG2 3.3Å; V345-V349 WeakPolarHBondContact O-CG2 3.4Å; V345-V349 PolarHBondContact O-N 2.91Å; V345-F395 HydrophobicContact CB-CE2 3.86Å; V345-F395 HydrophobicContact CB-CZ 4.03Å; V345-F395 HydrophobicContact CG1-CE2 4.11Å; V345-F395 HydrophobicContact CG1-CZ 3.82Å; V345-F395 HydrophobicContact CG2-CE2 3.94Å; V345-F395 HydrophobicContact CG2-CZ 4.48Å |
| 346 | I | 84.1 | Confident | 83.6 | Confident | 9 Ų | 9 | 63.2 Ų | 63.2 | 5% | 0.046 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -67.2 | -36.2 | 179.1 | -165.1 | 61.8 | 0 | 0 | 0 | 112.6 | G342 R343 F344 W348 V349 L350 V362 T399 C402 T403 | G342-I346 WeakPolarHBondContact O-CG2 3.35Å; G342-I346 PolarHBondContact O-N 2.9Å; R343-I346 WeakPolarHBondContact O-CG2 3.42Å; F344-I346 PolarHBondContact O-N 3.27Å; I346-W348 VanDerWaalsContact C-N 3.26Å; I346-W348 PolarHBondContact O-N 3.44Å; I346-V349 HydrophobicContact CD1-CB 4.3Å; I346-V349 HydrophobicContact CD1-CG1 4.36Å; I346-V349 PolarHBondContact O-N 2.97Å; I346-L350 HydrophobicContact CD1-CD1 4.42Å; I346-L350 HydrophobicContact CD1-CG 4.06Å; I346-L350 HydrophobicContact CG1-CD1 3.93Å; I346-L350 HydrophobicContact CG1-CG 4.02Å; I346-L350 WeakPolarHBondContact O-CB 3.45Å; I346-L350 WeakPolarHBondContact O-CG 3.45Å; I346-L350 PolarHBondContact O-N 3.48Å; I346-V362 HydrophobicContact CD1-CG1 3.85Å; I346-T399 HydrophobicContact CB-CG2 3.84Å; I346-T399 HydrophobicContact CD1-CG2 3.71Å; I346-T399 HydrophobicContact CG1-CG2 3.69Å; I346-T399 HydrophobicContact CG2-CG2 4.46Å; I346-C402 HydrophobicContact CG2-CB 4.2Å; I346-T403 HydrophobicContact CB-CG2 4.47Å; I346-T403 HydrophobicContact CD1-CG2 4.35Å; I346-T403 HydrophobicContact CG1-CG2 3.42Å; I346-T403 VanDerWaalsContact CG1-CG2 3.42Å; I346-T403 HydrophobicContact CG2-CG2 4.19Å |
| 347 | G | 75.8 | Confident | 82.4 | Confident | 34 Ų | 34 | 68.2 Ų | 68.2 | 35% | 0.351 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -58.3 | -41.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | R343 F344 V345 S351 | R343-G347 PolarHBondContact O-N 3.31Å; F344-G347 PolarHBondContact O-N 3Å; V345-G347 VanDerWaalsContact C-N 3.33Å; V345-G347 PolarHBondContact O-N 2.89Å; G347-S351 PolarHBondContact O-N 2.99Å |
| 348 | W | 80.1 | Confident | 81.8 | Confident | 176 Ų | 176 | 72.4 Ų | 72.4 | 67% | 0.667 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -66.3 | -50.4 | 172.8 | -178.1 | -89.7 | 0 | 0 | 0 | 112.2 | F344 V345 I346 L350 S351 Q352 | F344-W348 PolarHBondContact O-N 3.35Å; F344-W348 VanDerWaalsContact O-N 3.11Å; V345-W348 WeakPolarHBondContact O-CB 3.18Å; V345-W348 PolarHBondContact O-N 3.38Å; I346-W348 VanDerWaalsContact C-N 3.26Å; I346-W348 PolarHBondContact O-N 3.44Å; W348-L350 VanDerWaalsContact C-N 3.31Å; W348-L350 PolarHBondContact O-N 3.39Å; W348-S351 WeakPolarHBondContact O-CB 3.5Å; W348-S351 PolarHBondContact O-N 2.89Å; W348-S351 PolarHBondContact O-OG 3.23Å; W348-Q352 PolarHBondContact O-N 3.14Å |
| 349 | V | 82.9 | Confident | 81.2 | Confident | 38 Ų | 38 | 74.2 Ų | 74.2 | 23% | 0.23 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -57.4 | -43.2 | -178.5 | 169.6 | 0 | 0 | 0 | 0 | 111.7 | V345 I346 S351 Q352 F355 | V345-V349 HydrophobicContact CG1-CG2 4.19Å; V345-V349 VanDerWaalsContact O-CG2 3.3Å; V345-V349 WeakPolarHBondContact O-CG2 3.4Å; V345-V349 PolarHBondContact O-N 2.91Å; I346-V349 HydrophobicContact CD1-CB 4.3Å; I346-V349 HydrophobicContact CD1-CG1 4.36Å; I346-V349 PolarHBondContact O-N 2.97Å; V349-S351 VanDerWaalsContact C-N 3.3Å; V349-S351 PolarHBondContact O-N 2.66Å; V349-Q352 WeakPolarHBondContact O-CB 3.42Å; V349-Q352 PolarHBondContact O-N 3.2Å; V349-F355 HydrophobicContact CG1-CD2 4Å; V349-F355 HydrophobicContact CG1-CE2 4.31Å; V349-F355 HydrophobicContact CG1-CG 4.28Å |
| 350 | L | 76.3 | Confident | 80.8 | Confident | 44 Ų | 44 | 74.4 Ų | 74.4 | 23% | 0.23 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -74 | -18.4 | 179.3 | -68.3 | -179.8 | 0 | 0 | 0 | 114 | I346 W348 Q352 K359 T403 | I346-L350 HydrophobicContact CD1-CD1 4.42Å; I346-L350 HydrophobicContact CD1-CG 4.06Å; I346-L350 HydrophobicContact CG1-CD1 3.93Å; I346-L350 HydrophobicContact CG1-CG 4.02Å; I346-L350 WeakPolarHBondContact O-CB 3.45Å; I346-L350 WeakPolarHBondContact O-CG 3.45Å; I346-L350 PolarHBondContact O-N 3.48Å; W348-L350 VanDerWaalsContact C-N 3.31Å; W348-L350 PolarHBondContact O-N 3.39Å; L350-Q352 VanDerWaalsContact C-N 3.31Å; L350-K359 HydrophobicContact CD2-CB 4.09Å; L350-K359 HydrophobicContact CD2-CD 4.28Å; L350-K359 HydrophobicContact CD2-CG 3.86Å; L350-T403 HydrophobicContact CD1-CG2 3.41Å; L350-T403 VanDerWaalsContact CD1-CG2 3.41Å |
| 351 | S | 74.8 | Confident | 80.7 | Confident | 70 Ų | 70 | 76.9 Ų | 76.9 | 49% | 0.49 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -75.4 | -22.4 | 174.7 | 76.9 | 0 | 0 | 0 | 0 | 112.7 | G347 W348 V349 | G347-S351 PolarHBondContact O-N 2.99Å; W348-S351 WeakPolarHBondContact O-CB 3.5Å; W348-S351 PolarHBondContact O-N 2.89Å; W348-S351 PolarHBondContact O-OG 3.23Å; V349-S351 VanDerWaalsContact C-N 3.3Å; V349-S351 PolarHBondContact O-N 2.66Å |
| 352 | Q | 77.8 | Confident | 80.6 | Confident | 77 Ų | 77 | 72 Ų | 72 | 36% | 0.36 | 36% | 0.357 | S | S | . | . | S | Bend | trans | -71.5 | 133.9 | -179 | -62.7 | -66.9 | -23.3 | 0 | 0 | 111.4 | W348 V349 L350 V354 F355 | W348-Q352 PolarHBondContact O-N 3.14Å; V349-Q352 WeakPolarHBondContact O-CB 3.42Å; V349-Q352 PolarHBondContact O-N 3.2Å; L350-Q352 VanDerWaalsContact C-N 3.31Å; Q352-V354 PolarHBondContact O-N 3.16Å; Q352-V354 VanDerWaalsContact O-N 3.14Å; Q352-F355 HydrophobicContact CB-CD2 4.13Å; Q352-F355 PolarHBondContact O-N 3.41Å; Q352-F355 VanDerWaalsContact O-N 3.15Å |
| 353 | N | 71.6 | Confident | 80.6 | Confident | 116 Ų | 116 | 72.1 Ų | 72.1 | 62% | 0.62 | 36% | 0.358 | S | S | * | . | G | 310 helix | trans | -59.9 | -28.5 | -177.4 | -73.1 | -24.5 | 0 | 0 | 0 | 113.4 | F355 R356 | N353-F355 VanDerWaalsContact C-N 3.31Å; N353-F355 PolarHBondContact O-N 3.07Å; N353-R356 WeakPolarHBondContact O-CB 3.46Å; N353-R356 PolarHBondContact O-N 2.6Å; N353-R356 PolarHBondContact OD1-NH2 2.98Å |
| 354 | V | 74.9 | Confident | 80.8 | Confident | 108 Ų | 108 | 73.6 Ų | 73.6 | 66% | 0.655 | 37% | 0.367 | S | S | * | . | G | 310 helix | trans | -62.9 | -35.4 | 179.4 | -179.4 | 0 | 0 | 0 | 0 | 112.3 | Q352 | Q352-V354 PolarHBondContact O-N 3.16Å; Q352-V354 VanDerWaalsContact O-N 3.14Å |
| 355 | F | 73.4 | Confident | 81.2 | Confident | 77 Ų | 77 | 72.1 Ų | 72.1 | 34% | 0.338 | 37% | 0.367 | S | S | . | . | G | 310 helix | trans | -95.5 | -1.2 | -176.1 | -63.9 | -71.9 | 0 | 0 | 0 | 113.3 | V349 Q352 N353 T357 R358 K359 V362 | V349-F355 HydrophobicContact CG1-CD2 4Å; V349-F355 HydrophobicContact CG1-CE2 4.31Å; V349-F355 HydrophobicContact CG1-CG 4.28Å; Q352-F355 HydrophobicContact CB-CD2 4.13Å; Q352-F355 PolarHBondContact O-N 3.41Å; Q352-F355 VanDerWaalsContact O-N 3.15Å; N353-F355 VanDerWaalsContact C-N 3.31Å; N353-F355 PolarHBondContact O-N 3.07Å; F355-T357 VanDerWaalsContact C-N 3.27Å; F355-T357 PolarHBondContact O-N 3.48Å; F355-R358 CarbonylContact O-C 3.57Å; F355-R358 PolarHBondContact O-N 3.46Å; F355-K359 VanDerWaalsContact O-CG 3.29Å; F355-K359 WeakPolarHBondContact O-CG 3.34Å; F355-K359 PolarHBondContact O-N 3.16Å; F355-K359 VanDerWaalsContact O-N 3.17Å; F355-V362 HydrophobicContact CD1-CG2 3.8Å; F355-V362 HydrophobicContact CE1-CG2 4.44Å; F355-V362 HydrophobicContact CG-CG2 4.46Å |
| 356 | R | 68.4 | Low | 81.5 | Confident | 152 Ų | 152 | 69.7 Ų | 69.7 | 57% | 0.574 | 35% | 0.352 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.9 | -36.2 | -177.1 | -172.9 | 176.6 | -72.1 | 175.2 | -1.3 | 113.1 | N353 | N353-R356 WeakPolarHBondContact O-CB 3.46Å; N353-R356 PolarHBondContact O-N 2.6Å; N353-R356 PolarHBondContact OD1-NH2 2.98Å |
| 357 | T | 69 | Low | 82 | Confident | 106 Ų | 106 | 69.2 Ų | 69.2 | 65% | 0.65 | 35% | 0.35 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.9 | -2.6 | 178.8 | 50.4 | 0 | 0 | 0 | 0 | 113.7 | F355 R473 | F355-T357 VanDerWaalsContact C-N 3.27Å; F355-T357 PolarHBondContact O-N 3.48Å; T357-R473 PolarHBondContact O-NH2 2.69Å |
| 358 | R | 82.3 | Confident | 83 | Confident | 151 Ų | 151 | 71.2 Ų | 71.2 | 57% | 0.57 | 35% | 0.352 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -121 | 15.4 | -176 | -62.4 | -170.3 | -177.2 | -179.5 | 1.3 | 113.7 | F355 L360 Q361 V362 | F355-R358 CarbonylContact O-C 3.57Å; F355-R358 PolarHBondContact O-N 3.46Å; R358-L360 VanDerWaalsContact C-N 3.3Å; R358-L360 PolarHBondContact O-N 2.98Å; R358-Q361 HydrophobicContact CB-CB 4.49Å; R358-Q361 WeakPolarHBondContact O-CB 3.49Å; R358-Q361 PolarHBondContact O-N 2.84Å; R358-V362 PolarHBondContact O-N 2.93Å |
| 359 | K | 83.1 | Confident | 83.7 | Confident | 47 Ų | 47 | 67.2 Ų | 67.2 | 20% | 0.204 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -54.3 | -42.8 | -176.9 | -56.7 | -174.1 | -172.7 | 170 | 0 | 113.2 | L350 F355 Q361 V362 L363 M407 E410 | L350-K359 HydrophobicContact CD2-CB 4.09Å; L350-K359 HydrophobicContact CD2-CD 4.28Å; L350-K359 HydrophobicContact CD2-CG 3.86Å; F355-K359 VanDerWaalsContact O-CG 3.29Å; F355-K359 WeakPolarHBondContact O-CG 3.34Å; F355-K359 PolarHBondContact O-N 3.16Å; F355-K359 VanDerWaalsContact O-N 3.17Å; K359-Q361 VanDerWaalsContact C-N 3.33Å; K359-Q361 PolarHBondContact O-N 3.46Å; K359-V362 WeakPolarHBondContact O-CB 3.49Å; K359-V362 PolarHBondContact O-N 3.07Å; K359-L363 PolarHBondContact O-N 3.32Å; K359-M407 HydrophobicContact CB-CE 3.9Å; K359-M407 HydrophobicContact CB-SD 3.92Å; K359-M407 WeakPolarHBondContact O-CE 3.5Å; K359-E410 WeakPolarHBondContact CD-OE1 3.39Å; K359-E410 IonicContact NZ-OE1 2.65Å; K359-E410 PolarHBondContact NZ-OE1 3.29Å; K359-E410 IonicContact NZ-OE2 3.88Å |
| 360 | L | 86.2 | Confident | 84.3 | Confident | 6 Ų | 6 | 65.4 Ų | 65.4 | 3% | 0.031 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -65.5 | -35 | 178.2 | -161.1 | 78.9 | 0 | 0 | 0 | 112.6 | Y296 R358 L363 L364 M407 V413 L469 V472 R473 | Y296-L360 HydrophobicContact CE2-CD1 4.22Å; R358-L360 VanDerWaalsContact C-N 3.3Å; R358-L360 PolarHBondContact O-N 2.98Å; L360-L363 PolarHBondContact O-N 3.31Å; L360-L364 WeakPolarHBondContact O-CB 3.41Å; L360-L364 PolarHBondContact O-N 3.47Å; L360-M407 HydrophobicContact CD1-CG 3.87Å; L360-M407 HydrophobicContact CD1-SD 4.19Å; L360-V413 HydrophobicContact CD1-CG2 4.35Å; L360-L469 HydrophobicContact CD1-CD1 3.68Å; L360-L469 HydrophobicContact CG-CD1 4.17Å; L360-V472 HydrophobicContact CD2-CB 4.19Å; L360-V472 HydrophobicContact CD2-CG1 4.18Å; L360-R473 HydrophobicContact CD2-CB 4.31Å; L360-R473 HydrophobicContact CD2-CG 3.55Å |
| 361 | Q | 88.5 | Confident | 85.2 | Confident | 89 Ų | 89 | 64.4 Ų | 64.4 | 42% | 0.416 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -68.9 | -38.5 | 174.2 | -83.8 | 169.9 | -19.3 | 0 | 0 | 111.9 | R358 K359 L363 L364 V365 R473 | R358-Q361 HydrophobicContact CB-CB 4.49Å; R358-Q361 WeakPolarHBondContact O-CB 3.49Å; R358-Q361 PolarHBondContact O-N 2.84Å; K359-Q361 VanDerWaalsContact C-N 3.33Å; K359-Q361 PolarHBondContact O-N 3.46Å; Q361-L363 VanDerWaalsContact C-N 3.34Å; Q361-L364 PolarHBondContact O-N 3Å; Q361-V365 WeakPolarHBondContact O-CG2 3.5Å; Q361-V365 PolarHBondContact O-N 2.99Å; Q361-R473 VanDerWaalsContact CG-NH1 3.31Å |
| 362 | V | 90.6 | Very high | 86.2 | Confident | 25 Ų | 25 | 65.6 Ų | 65.6 | 15% | 0.152 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -60 | -47.5 | 173.8 | 176.6 | 0 | 0 | 0 | 0 | 109.8 | I346 F355 R358 K359 L364 V365 C366 | I346-V362 HydrophobicContact CD1-CG1 3.85Å; F355-V362 HydrophobicContact CD1-CG2 3.8Å; F355-V362 HydrophobicContact CE1-CG2 4.44Å; F355-V362 HydrophobicContact CG-CG2 4.46Å; R358-V362 PolarHBondContact O-N 2.93Å; K359-V362 WeakPolarHBondContact O-CB 3.49Å; K359-V362 PolarHBondContact O-N 3.07Å; V362-L364 VanDerWaalsContact C-N 3.33Å; V362-L364 PolarHBondContact O-N 3.19Å; V362-V365 PolarHBondContact O-N 3.23Å; V362-C366 PolarHBondContact O-N 3.48Å; V362-C366 PolarHBondContact O-SG 3.48Å |
| 363 | L | 90.9 | Very high | 87.1 | Confident | 4 Ų | 4 | 62.6 Ų | 62.6 | 2% | 0.021 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -58.7 | -44 | 175.9 | -178.3 | 60.5 | 0 | 0 | 0 | 111.8 | Y296 F299 K359 L360 Q361 V365 C366 V367 I400 T403 M407 L469 | Y296-L363 HydrophobicContact CE2-CD2 4.47Å; F299-L363 HydrophobicContact CE1-CD2 3.99Å; F299-L363 HydrophobicContact CZ-CD1 4.5Å; F299-L363 HydrophobicContact CZ-CD2 4Å; F299-L363 HydrophobicContact CZ-CG 4.33Å; K359-L363 PolarHBondContact O-N 3.32Å; L360-L363 PolarHBondContact O-N 3.31Å; Q361-L363 VanDerWaalsContact C-N 3.34Å; L363-V365 PolarHBondContact O-N 3.48Å; L363-C366 WeakPolarHBondContact O-CB 3.47Å; L363-C366 PolarHBondContact O-N 3.33Å; L363-V367 HydrophobicContact CD1-CG2 4.35Å; L363-V367 VanDerWaalsContact O-CG2 3.29Å; L363-V367 WeakPolarHBondContact O-CG2 3.14Å; L363-V367 PolarHBondContact O-N 3.27Å; L363-I400 HydrophobicContact CD1-CG1 4.13Å; L363-I400 HydrophobicContact CD1-CG2 4.41Å; L363-T403 WeakPolarHBondContact CD1-OG1 3.5Å; L363-M407 HydrophobicContact CB-CE 3.9Å; L363-M407 HydrophobicContact CD2-CE 3.88Å; L363-M407 HydrophobicContact CD2-CG 4.43Å; L363-L469 HydrophobicContact CB-CD2 4.28Å; L363-L469 HydrophobicContact CD2-CD1 4.18Å; L363-L469 HydrophobicContact CD2-CD2 4Å; L363-L469 HydrophobicContact CG-CD2 3.71Å |
| 364 | L | 93.2 | Very high | 88.2 | Confident | 41 Ų | 41 | 57.1 Ų | 57.1 | 22% | 0.215 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -60.1 | -44.6 | 177.3 | -179.4 | 64.2 | 0 | 0 | 0 | 112.5 | L360 Q361 V362 C366 V367 I368 A466 L469 | L360-L364 WeakPolarHBondContact O-CB 3.41Å; L360-L364 PolarHBondContact O-N 3.47Å; Q361-L364 PolarHBondContact O-N 3Å; V362-L364 VanDerWaalsContact C-N 3.33Å; V362-L364 PolarHBondContact O-N 3.19Å; L364-C366 VanDerWaalsContact C-N 3.33Å; L364-C366 PolarHBondContact O-N 2.87Å; L364-V367 PolarHBondContact O-N 3.38Å; L364-I368 HydrophobicContact CD1-CD1 4.14Å; L364-I368 HydrophobicContact CD1-CG1 4.42Å; L364-I368 HydrophobicContact CG-CD1 3.95Å; L364-I368 VanDerWaalsContact O-CG1 3.31Å; L364-I368 WeakPolarHBondContact O-CG1 3.27Å; L364-I368 PolarHBondContact O-N 3.44Å; L364-A466 HydrophobicContact CD1-CB 4.18Å; L364-A466 WeakPolarHBondContact CD1-O 3.25Å; L364-L469 HydrophobicContact CB-CD2 4.08Å; L364-L469 HydrophobicContact CD1-CB 4.25Å; L364-L469 HydrophobicContact CD1-CD2 4.22Å; L364-L469 HydrophobicContact CD1-CG 4.33Å |
| 365 | V | 93.8 | Very high | 89.2 | Confident | 81 Ų | 81 | 54.4 Ų | 54.4 | 49% | 0.491 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -61.5 | -42.6 | 176.7 | 171.5 | 0 | 0 | 0 | 0 | 110.8 | Q361 V362 L363 V367 I368 M369 | Q361-V365 WeakPolarHBondContact O-CG2 3.5Å; Q361-V365 PolarHBondContact O-N 2.99Å; V362-V365 PolarHBondContact O-N 3.23Å; L363-V365 PolarHBondContact O-N 3.48Å; V365-V367 PolarHBondContact O-N 3.25Å; V365-I368 PolarHBondContact O-N 3.14Å; V365-M369 HydrophobicContact CG1-CG 4.37Å; V365-M369 VanDerWaalsContact O-CG 3.3Å; V365-M369 WeakPolarHBondContact O-CG 3.47Å; V365-M369 PolarHBondContact O-N 2.96Å |
| 366 | C | 93.8 | Very high | 90.1 | Very high | 12 Ų | 12 | 51.6 Ų | 51.6 | 8% | 0.081 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -61.5 | -43.2 | 177.1 | -64.2 | 0 | 0 | 0 | 0 | 112.4 | V362 L363 L364 M369 M370 F396 T399 I400 | V362-C366 PolarHBondContact O-N 3.48Å; V362-C366 PolarHBondContact O-SG 3.48Å; L363-C366 WeakPolarHBondContact O-CB 3.47Å; L363-C366 PolarHBondContact O-N 3.33Å; L364-C366 VanDerWaalsContact C-N 3.33Å; L364-C366 PolarHBondContact O-N 2.87Å; C366-M369 PolarHBondContact O-N 3.46Å; C366-M370 WeakPolarHBondContact O-CB 3.41Å; C366-M370 PolarHBondContact O-N 3.4Å; C366-F396 HydrophobicContact CB-CD1 3.97Å; C366-F396 HydrophobicContact CB-CE1 4.45Å; C366-T399 HydrophobicContact CB-CG2 4.13Å; C366-T399 WeakPolarHBondContact SG-CG2 3.43Å; C366-I400 HydrophobicContact CB-CD1 4.43Å; C366-I400 HydrophobicContact CB-CG1 4.16Å |
| 367 | V | 94.8 | Very high | 91.3 | Very high | 0 Ų | 0 | 44.4 Ų | 44.4 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -66.3 | -39.9 | 178.6 | 176 | 0 | 0 | 0 | 0 | 111.4 | F299 L363 L364 V365 M370 T371 I400 M462 S465 A466 L469 | F299-V367 HydrophobicContact CE2-CG1 4.49Å; F299-V367 HydrophobicContact CE2-CG2 3.79Å; F299-V367 HydrophobicContact CZ-CG2 4.23Å; L363-V367 HydrophobicContact CD1-CG2 4.35Å; L363-V367 VanDerWaalsContact O-CG2 3.29Å; L363-V367 WeakPolarHBondContact O-CG2 3.14Å; L363-V367 PolarHBondContact O-N 3.27Å; L364-V367 PolarHBondContact O-N 3.38Å; V365-V367 PolarHBondContact O-N 3.25Å; V367-M370 PolarHBondContact O-N 3.43Å; V367-T371 PolarHBondContact O-N 2.8Å; V367-T371 PolarHBondContact O-OG1 3.5Å; V367-I400 HydrophobicContact CG2-CD1 3.93Å; V367-I400 HydrophobicContact CG2-CG1 4.27Å; V367-M462 HydrophobicContact CG1-CG 3.99Å; V367-M462 HydrophobicContact CG1-SD 3.82Å; V367-S465 VanDerWaalsContact CG1-OG 3.27Å; V367-S465 WeakPolarHBondContact CG1-OG 3.45Å; V367-A466 HydrophobicContact CG1-CB 3.81Å; V367-L469 HydrophobicContact CG2-CD2 4.21Å |
| 368 | I | 96.1 | Very high | 92.2 | Very high | 76 Ų | 76 | 40.9 Ų | 40.9 | 39% | 0.39 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -64.1 | -46.6 | 175.6 | -68.2 | 167.3 | 0 | 0 | 0 | 110.6 | L364 V365 M370 T371 V372 A466 | L364-I368 HydrophobicContact CD1-CD1 4.14Å; L364-I368 HydrophobicContact CD1-CG1 4.42Å; L364-I368 HydrophobicContact CG-CD1 3.95Å; L364-I368 VanDerWaalsContact O-CG1 3.31Å; L364-I368 WeakPolarHBondContact O-CG1 3.27Å; L364-I368 PolarHBondContact O-N 3.44Å; V365-I368 PolarHBondContact O-N 3.14Å; I368-M370 VanDerWaalsContact C-N 3.32Å; I368-M370 PolarHBondContact O-N 2.85Å; I368-T371 WeakPolarHBondContact O-CB 3.3Å; I368-T371 PolarHBondContact O-N 3.13Å; I368-T371 VanDerWaalsContact O-N 3.11Å; I368-V372 PolarHBondContact O-N 3.44Å; I368-V372 VanDerWaalsContact O-N 3.08Å; I368-A466 HydrophobicContact CG1-CB 4Å |
| 369 | M | 95.8 | Very high | 92.5 | Very high | 92 Ų | 92 | 39.5 Ų | 39.5 | 45% | 0.453 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -62.8 | -40.2 | 178.6 | -69.8 | -64.4 | 160.8 | 0 | 0 | 112 | V365 C366 T371 V372 D373 F396 | V365-M369 HydrophobicContact CG1-CG 4.37Å; V365-M369 VanDerWaalsContact O-CG 3.3Å; V365-M369 WeakPolarHBondContact O-CG 3.47Å; V365-M369 PolarHBondContact O-N 2.96Å; C366-M369 PolarHBondContact O-N 3.46Å; M369-T371 VanDerWaalsContact C-N 3.29Å; M369-T371 PolarHBondContact O-N 3.13Å; M369-V372 PolarHBondContact O-N 3.09Å; M369-D373 PolarHBondContact O-N 3.33Å; M369-F396 HydrophobicContact CB-CD1 4.45Å; M369-F396 HydrophobicContact CB-CD2 4.15Å; M369-F396 HydrophobicContact CB-CE1 3.92Å; M369-F396 HydrophobicContact CB-CE2 3.56Å; M369-F396 HydrophobicContact CB-CZ 3.44Å; M369-F396 VanDerWaalsContact CB-CZ 3.44Å; M369-F396 HydrophobicContact CG-CE1 4.44Å; M369-F396 HydrophobicContact CG-CE2 4.46Å; M369-F396 HydrophobicContact CG-CZ 3.96Å |
| 370 | M | 94.9 | Very high | 92.8 | Very high | 0 Ų | 0 | 38.7 Ų | 38.7 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -63.5 | -34.8 | 173.7 | -170.4 | 176.3 | -173 | 0 | 0 | 112.6 | F307 C366 V367 I368 D373 L374 Y393 F396 M397 I400 M462 | F307-M370 HydrophobicContact CD1-CE 3.5Å; F307-M370 VanDerWaalsContact CD1-CE 3.5Å; F307-M370 HydrophobicContact CD1-SD 4.28Å; F307-M370 HydrophobicContact CE1-CE 3.61Å; F307-M370 HydrophobicContact CE1-SD 3.78Å; C366-M370 WeakPolarHBondContact O-CB 3.41Å; C366-M370 PolarHBondContact O-N 3.4Å; V367-M370 PolarHBondContact O-N 3.43Å; I368-M370 VanDerWaalsContact C-N 3.32Å; I368-M370 PolarHBondContact O-N 2.85Å; M370-D373 PolarHBondContact O-N 3.39Å; M370-L374 WeakPolarHBondContact O-CG 3.35Å; M370-L374 PolarHBondContact O-N 3.29Å; M370-Y393 HydrophobicContact CE-CD2 3.74Å; M370-Y393 HydrophobicContact CE-CE1 4.47Å; M370-Y393 HydrophobicContact CE-CE2 3.09Å; M370-Y393 HydrophobicContact CG-CD2 4.42Å; M370-F396 HydrophobicContact CB-CB 4.12Å; M370-F396 HydrophobicContact CG-CB 4.44Å; M370-M397 HydrophobicContact CE-CB 4.14Å; M370-M397 HydrophobicContact CE-SD 3.78Å; M370-I400 HydrophobicContact CB-CD1 4.33Å; M370-I400 HydrophobicContact SD-CD1 3.38Å; M370-I400 WeakPolarHBondContact SD-CD1 3.32Å; M370-M462 HydrophobicContact CE-CE 3.93Å; M370-M462 HydrophobicContact CG-CE 4.41Å; M370-M462 HydrophobicContact SD-CE 3.7Å; M370-M462 HydrophobicContact SD-SD 4.26Å |
| 371 | T | 96 | Very high | 92.7 | Very high | 22 Ų | 22 | 42.2 Ų | 42.2 | 14% | 0.135 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -64.1 | -44.7 | 175 | -55 | 0 | 0 | 0 | 0 | 111.2 | V367 I368 M369 D373 L374 V375 A459 M462 | V367-T371 PolarHBondContact O-N 2.8Å; V367-T371 PolarHBondContact O-OG1 3.5Å; I368-T371 WeakPolarHBondContact O-CB 3.3Å; I368-T371 PolarHBondContact O-N 3.13Å; I368-T371 VanDerWaalsContact O-N 3.11Å; M369-T371 VanDerWaalsContact C-N 3.29Å; M369-T371 PolarHBondContact O-N 3.13Å; T371-D373 VanDerWaalsContact C-N 3.33Å; T371-L374 PolarHBondContact O-N 3.36Å; T371-V375 PolarHBondContact O-N 3.48Å; T371-A459 WeakPolarHBondContact CG2-O 3.32Å; T371-M462 WeakPolarHBondContact OG1-CB 3.22Å; T371-M462 VanDerWaalsContact OG1-CG 3.23Å; T371-M462 WeakPolarHBondContact OG1-CG 3.31Å |
| 372 | V | 96.2 | Very high | 92.7 | Very high | 95 Ų | 95 | 43.1 Ų | 43.1 | 58% | 0.576 | 25% | 0.246 | S | C | * | . | H | α-helix | trans | -62.9 | -42.4 | 177.2 | 175.4 | 0 | 0 | 0 | 0 | 110.8 | I368 M369 V375 G376 | I368-V372 PolarHBondContact O-N 3.44Å; I368-V372 VanDerWaalsContact O-N 3.08Å; M369-V372 PolarHBondContact O-N 3.09Å; V372-V375 PolarHBondContact O-N 2.84Å; V372-G376 PolarHBondContact O-N 2.82Å |
| 373 | D | 95.9 | Very high | 92.7 | Very high | 15 Ų | 15 | 44.7 Ų | 44.7 | 8% | 0.08 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -65 | -40.4 | 178.6 | -173.8 | 54.6 | 0 | 0 | 0 | 112.6 | M369 M370 T371 V375 G376 F377 C389 V392 Y393 | M369-D373 PolarHBondContact O-N 3.33Å; M370-D373 PolarHBondContact O-N 3.39Å; T371-D373 VanDerWaalsContact C-N 3.33Å; D373-V375 VanDerWaalsContact C-N 3.29Å; D373-V375 PolarHBondContact O-N 3.35Å; D373-G376 CarbonylContact O-C 3.5Å; D373-G376 VanDerWaalsContact O-CA 3.25Å; D373-G376 WeakPolarHBondContact O-CA 3.25Å; D373-G376 PolarHBondContact O-N 2.95Å; D373-F377 VanDerWaalsContact O-CD2 3.29Å; D373-F377 WeakPolarHBondContact O-CD2 3.31Å; D373-F377 PolarHBondContact O-N 2.71Å; D373-C389 WeakPolarHBondContact OD1-CA 3.29Å; D373-V392 HydrophobicContact CB-CG1 3.9Å; D373-Y393 WeakPolarHBondContact OD2-CA 3.37Å; D373-Y393 WeakPolarHBondContact OD2-CB 3.32Å; D373-Y393 PolarHBondContact OD2-N 2.97Å |
| 374 | L | 95.1 | Very high | 92.7 | Very high | 0 Ų | 0 | 53.7 Ų | 53.7 | 0% | 0 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -59.2 | -36.7 | 173 | -78.5 | 169.1 | 0 | 0 | 0 | 113 | P310 M370 T371 Y393 F455 C458 A459 M462 | P310-L374 HydrophobicContact CG-CD2 3.59Å; M370-L374 WeakPolarHBondContact O-CG 3.35Å; M370-L374 PolarHBondContact O-N 3.29Å; T371-L374 PolarHBondContact O-N 3.36Å; L374-Y393 HydrophobicContact CD2-CD2 4.24Å; L374-Y393 HydrophobicContact CD2-CE2 4Å; L374-Y393 HydrophobicContact CG-CE2 4.49Å; L374-F455 HydrophobicContact CD2-CD1 4.4Å; L374-C458 HydrophobicContact CD1-CB 4.21Å; L374-C458 HydrophobicContact CD2-CB 4.21Å; L374-A459 HydrophobicContact CB-CB 3.79Å; L374-M462 HydrophobicContact CD1-CB 3.93Å; L374-M462 HydrophobicContact CD1-CE 4.36Å; L374-M462 HydrophobicContact CD1-CG 4.32Å |
| 375 | V | 95 | Very high | 92.7 | Very high | 52 Ų | 52 | 54.4 Ų | 54.4 | 32% | 0.315 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -68 | -39.6 | 170.3 | 177.6 | 0 | 0 | 0 | 0 | 110.2 | T371 V372 D373 F377 T378 L379 Y456 A459 | T371-V375 PolarHBondContact O-N 3.48Å; V372-V375 PolarHBondContact O-N 2.84Å; D373-V375 VanDerWaalsContact C-N 3.29Å; D373-V375 PolarHBondContact O-N 3.35Å; V375-F377 VanDerWaalsContact C-N 3.32Å; V375-F377 PolarHBondContact O-N 3.14Å; V375-T378 PolarHBondContact O-N 3.34Å; V375-T378 PolarHBondContact O-OG1 3.3Å; V375-L379 HydrophobicContact CG1-CD1 4.34Å; V375-Y456 HydrophobicContact CG1-CE1 4.28Å; V375-A459 HydrophobicContact CG2-CB 3.74Å |
| 376 | G | 92.9 | Very high | 92.7 | Very high | 17 Ų | 17 | 50.6 Ų | 50.6 | 18% | 0.175 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -52.3 | -43.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | V372 D373 T378 L379 V380 | V372-G376 PolarHBondContact O-N 2.82Å; D373-G376 CarbonylContact O-C 3.5Å; D373-G376 VanDerWaalsContact O-CA 3.25Å; D373-G376 WeakPolarHBondContact O-CA 3.25Å; D373-G376 PolarHBondContact O-N 2.95Å; G376-T378 PolarHBondContact O-N 3.01Å; G376-L379 PolarHBondContact O-N 3.48Å; G376-V380 VanDerWaalsContact O-CG2 3.28Å; G376-V380 WeakPolarHBondContact O-CG2 3.25Å; G376-V380 PolarHBondContact O-N 3.41Å |
| 377 | F | 92.4 | Very high | 92.7 | Very high | 1 Ų | 1 | 50.5 Ų | 50.5 | 0% | 0.004 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -53.2 | -26.2 | 176.2 | -83.6 | -83.5 | 0 | 0 | 0 | 114.3 | I314 D373 V375 L386 C389 Y393 F455 | I314-F377 HydrophobicContact CD1-CD1 3.86Å; I314-F377 HydrophobicContact CD1-CE1 3.62Å; D373-F377 VanDerWaalsContact O-CD2 3.29Å; D373-F377 WeakPolarHBondContact O-CD2 3.31Å; D373-F377 PolarHBondContact O-N 2.71Å; V375-F377 VanDerWaalsContact C-N 3.32Å; V375-F377 PolarHBondContact O-N 3.14Å; F377-L386 HydrophobicContact CD1-CD1 3.66Å; F377-L386 HydrophobicContact CE1-CD1 4.11Å; F377-C389 HydrophobicContact CD1-CB 4.08Å; F377-C389 HydrophobicContact CD2-CB 4.04Å; F377-C389 HydrophobicContact CE1-CB 3.78Å; F377-C389 HydrophobicContact CE2-CB 3.74Å; F377-C389 HydrophobicContact CG-CB 4.2Å; F377-C389 VanDerWaalsContact CZ-C 3.47Å; F377-C389 HydrophobicContact CZ-CB 3.61Å; F377-Y393 HydrophobicContact CE2-CD2 4.33Å; F377-Y393 HydrophobicContact CE2-CG 4.31Å; F377-F455 HydrophobicContact CB-CB 4.43Å; F377-F455 HydrophobicContact CB-CD1 3.53Å; F377-F455 HydrophobicContact CB-CE1 3.99Å; F377-F455 HydrophobicContact CB-CG 4.12Å; F377-F455 HydrophobicContact CD1-CD1 4.18Å; F377-F455 AromaticContact CD1-CE1 3.76Å; F377-F455 HydrophobicContact CD1-CE1 3.76Å; F377-F455 HydrophobicContact CD2-CD1 4.15Å; F377-F455 HydrophobicContact CD2-CE1 4.32Å; F377-F455 HydrophobicContact CE1-CE1 4.33Å; F377-F455 AromaticContact CG-CD1 3.7Å; F377-F455 HydrophobicContact CG-CD1 3.7Å; F377-F455 AromaticContact CG-CE1 3.76Å; F377-F455 HydrophobicContact CG-CE1 3.76Å |
| 378 | T | 88.3 | Confident | 92.8 | Very high | 32 Ų | 32 | 55.4 Ų | 55.4 | 20% | 0.196 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -90.7 | -17.7 | -176.1 | 70.7 | 0 | 0 | 0 | 0 | 113.8 | V375 G376 G452 F455 Y456 | V375-T378 PolarHBondContact O-N 3.34Å; V375-T378 PolarHBondContact O-OG1 3.3Å; G376-T378 PolarHBondContact O-N 3.01Å; T378-G452 WeakPolarHBondContact CG2-O 3.48Å; T378-F455 HydrophobicContact CG2-CB 3.68Å; T378-Y456 HydrophobicContact CG2-CD1 4.39Å; T378-Y456 HydrophobicContact CG2-CD2 3.57Å; T378-Y456 HydrophobicContact CG2-CE1 4.41Å; T378-Y456 HydrophobicContact CG2-CE2 3.59Å; T378-Y456 HydrophobicContact CG2-CG 3.99Å; T378-Y456 VanDerWaalsContact OG1-CE2 3.27Å; T378-Y456 WeakPolarHBondContact OG1-CE2 3.33Å; T378-Y456 PolarHBondContact OG1-OH 3.43Å |
| 379 | L | 89 | Confident | 92.7 | Very high | 123 Ų | 123 | 52.4 Ų | 52.4 | 64% | 0.644 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -95.7 | -13.7 | -177.4 | -60.5 | 176.9 | 0 | 0 | 0 | 112.1 | V375 G376 | V375-L379 HydrophobicContact CG1-CD1 4.34Å; G376-L379 PolarHBondContact O-N 3.48Å |
| 380 | V | 88.7 | Confident | 92.7 | Very high | 30 Ų | 30 | 48 Ų | 48 | 18% | 0.182 | 26% | 0.259 | C | S | . | . | trans | -111.7 | 130.1 | -164.8 | 173.1 | 0 | 0 | 0 | 0 | 110.6 | G376 T385 L386 | G376-V380 VanDerWaalsContact O-CG2 3.28Å; G376-V380 WeakPolarHBondContact O-CG2 3.25Å; G376-V380 PolarHBondContact O-N 3.41Å; V380-T385 WeakPolarHBondContact CG1-OG1 3.35Å; V380-L386 HydrophobicContact CG1-CB 4.5Å | ||
| 381 | T | 85.1 | Confident | 92.8 | Very high | 79 Ų | 79 | 51.9 Ų | 51.9 | 49% | 0.485 | 28% | 0.279 | S | S | . | . | trans | -117 | -21.6 | -177.3 | 59.6 | 0 | 0 | 0 | 0 | 113.8 | H321 | H321-T381 VanDerWaalsContact CD2-CG2 3.49Å; H321-T381 WeakPolarHBondContact CD2-CG2 3.47Å | ||
| 382 | N | 89.3 | Confident | 92.9 | Very high | 108 Ų | 108 | 53.1 Ų | 53.1 | 58% | 0.578 | 29% | 0.286 | S | S | * | . | S | Bend | trans | -81.6 | 150.2 | -177 | -63.5 | -47.6 | 0 | 0 | 0 | 112.5 | Y384 T385 L386 | N382-Y384 PolarHBondContact O-N 2.94Å; N382-T385 WeakPolarHBondContact CB-OG1 3.31Å; N382-T385 PolarHBondContact O-N 3.39Å; N382-T385 PolarHBondContact O-OG1 3.35Å; N382-L386 WeakPolarHBondContact O-CB 3.45Å; N382-L386 PolarHBondContact O-N 3.11Å |
| 383 | F | 89.4 | Confident | 92.9 | Very high | 59 Ų | 59 | 48.9 Ų | 48.9 | 26% | 0.259 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -55.5 | -54.4 | -179.9 | -179.5 | -89 | 0 | 0 | 0 | 114.6 | M323 Q327 M331 T385 L386 A387 | M323-F383 HydrophobicContact CE-CB 3.41Å; M323-F383 VanDerWaalsContact CE-CB 3.41Å; M323-F383 HydrophobicContact CE-CD2 3.35Å; M323-F383 HydrophobicContact CE-CE2 4.45Å; M323-F383 HydrophobicContact CE-CG 3.77Å; M323-F383 HydrophobicContact SD-CD2 4.05Å; Q327-F383 HydrophobicContact CB-CD2 4.38Å; Q327-F383 HydrophobicContact CB-CE2 3.92Å; Q327-F383 HydrophobicContact CG-CE2 4.49Å; M331-F383 HydrophobicContact CE-CD1 4.48Å; M331-F383 HydrophobicContact CE-CD2 3.4Å; M331-F383 HydrophobicContact CE-CE1 4.24Å; M331-F383 HydrophobicContact CE-CE2 3.06Å; M331-F383 HydrophobicContact CE-CG 4.1Å; M331-F383 HydrophobicContact CE-CZ 3.54Å; F383-T385 VanDerWaalsContact C-N 3.28Å; F383-T385 PolarHBondContact O-N 3.07Å; F383-L386 PolarHBondContact O-N 2.9Å; F383-A387 WeakPolarHBondContact O-CB 3.2Å; F383-A387 PolarHBondContact O-N 2.93Å |
| 384 | Y | 91.8 | Very high | 92.8 | Very high | 193 Ų | 193 | 48.2 Ų | 48.2 | 76% | 0.757 | 26% | 0.256 | S | S | * | . | H | α-helix | trans | -64.5 | -34.9 | -174.9 | -62 | -73.8 | 0 | 0 | 0 | 112.7 | N382 L388 | N382-Y384 PolarHBondContact O-N 2.94Å; Y384-L388 PolarHBondContact O-N 3.29Å |
| 385 | T | 92.6 | Very high | 92.8 | Very high | 55 Ų | 55 | 51.1 Ų | 51.1 | 34% | 0.337 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -77.2 | -34.9 | 178.8 | 44.8 | 0 | 0 | 0 | 0 | 111.8 | V380 N382 F383 L388 C389 | V380-T385 WeakPolarHBondContact CG1-OG1 3.35Å; N382-T385 WeakPolarHBondContact CB-OG1 3.31Å; N382-T385 PolarHBondContact O-N 3.39Å; N382-T385 PolarHBondContact O-OG1 3.35Å; F383-T385 VanDerWaalsContact C-N 3.28Å; F383-T385 PolarHBondContact O-N 3.07Å; T385-L388 WeakPolarHBondContact O-CB 3.28Å; T385-L388 PolarHBondContact O-N 2.95Å; T385-C389 PolarHBondContact O-N 3.21Å |
| 386 | L | 92.9 | Very high | 92.8 | Very high | 1 Ų | 1 | 50.3 Ų | 50.3 | 1% | 0.005 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -67.4 | -41.4 | 172.8 | -167.9 | 67.8 | 0 | 0 | 0 | 110.8 | I314 L317 S318 M323 M331 F377 V380 N382 F383 L388 C389 C390 | I314-L386 HydrophobicContact CD1-CD1 4.05Å; I314-L386 HydrophobicContact CD1-CD2 4.1Å; I314-L386 HydrophobicContact CD1-CG 4.1Å; L317-L386 HydrophobicContact CD2-CD1 4.36Å; S318-L386 WeakPolarHBondContact OG-CD2 3.31Å; M323-L386 HydrophobicContact CE-CD2 4.07Å; M323-L386 HydrophobicContact SD-CD2 4.32Å; M331-L386 HydrophobicContact SD-CG 4.44Å; F377-L386 HydrophobicContact CD1-CD1 3.66Å; F377-L386 HydrophobicContact CE1-CD1 4.11Å; V380-L386 HydrophobicContact CG1-CB 4.5Å; N382-L386 WeakPolarHBondContact O-CB 3.45Å; N382-L386 PolarHBondContact O-N 3.11Å; F383-L386 PolarHBondContact O-N 2.9Å; L386-L388 VanDerWaalsContact C-N 3.29Å; L386-L388 PolarHBondContact O-N 3.23Å; L386-C389 WeakPolarHBondContact O-CB 3.44Å; L386-C389 PolarHBondContact O-N 3.24Å; L386-C390 PolarHBondContact O-N 3.5Å; L386-C390 PolarHBondContact O-SG 2.87Å; L386-C390 VanDerWaalsContact O-SG 3.42Å |
| 387 | A | 94.8 | Very high | 92.8 | Very high | 10 Ų | 10 | 50.3 Ų | 50.3 | 8% | 0.083 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -59.5 | -39.6 | 171.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | M331 I334 F383 C390 I391 | M331-A387 HydrophobicContact CE-CB 4.06Å; M331-A387 HydrophobicContact SD-CB 4.08Å; I334-A387 HydrophobicContact CD1-CB 4.04Å; F383-A387 WeakPolarHBondContact O-CB 3.2Å; F383-A387 PolarHBondContact O-N 2.93Å; A387-C390 WeakPolarHBondContact O-CB 3.4Å; A387-C390 PolarHBondContact O-N 3.13Å; A387-I391 WeakPolarHBondContact O-CG1 3.47Å; A387-I391 PolarHBondContact O-N 3.11Å |
| 388 | L | 95.9 | Very high | 92.7 | Very high | 104 Ų | 104 | 50.3 Ų | 50.3 | 55% | 0.545 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -62 | -44.7 | 174.5 | -177.4 | 64.3 | 0 | 0 | 0 | 111.6 | Y384 T385 L386 C390 I391 V392 | Y384-L388 PolarHBondContact O-N 3.29Å; T385-L388 WeakPolarHBondContact O-CB 3.28Å; T385-L388 PolarHBondContact O-N 2.95Å; L386-L388 VanDerWaalsContact C-N 3.29Å; L386-L388 PolarHBondContact O-N 3.23Å; L388-C390 VanDerWaalsContact C-N 3.32Å; L388-C390 PolarHBondContact O-N 3.26Å; L388-I391 WeakPolarHBondContact O-CB 3.46Å; L388-I391 PolarHBondContact O-N 2.89Å; L388-V392 WeakPolarHBondContact O-CG2 3.5Å; L388-V392 PolarHBondContact O-N 3.38Å |
| 389 | C | 95.8 | Very high | 92.8 | Very high | 13 Ų | 13 | 49 Ų | 49 | 9% | 0.088 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -58.8 | -42.6 | 172.2 | -71.1 | 0 | 0 | 0 | 0 | 111.5 | D373 F377 T385 L386 I391 V392 Y393 | D373-C389 WeakPolarHBondContact OD1-CA 3.29Å; F377-C389 HydrophobicContact CD1-CB 4.08Å; F377-C389 HydrophobicContact CD2-CB 4.04Å; F377-C389 HydrophobicContact CE1-CB 3.78Å; F377-C389 HydrophobicContact CE2-CB 3.74Å; F377-C389 HydrophobicContact CG-CB 4.2Å; F377-C389 VanDerWaalsContact CZ-C 3.47Å; F377-C389 HydrophobicContact CZ-CB 3.61Å; T385-C389 PolarHBondContact O-N 3.21Å; L386-C389 WeakPolarHBondContact O-CB 3.44Å; L386-C389 PolarHBondContact O-N 3.24Å; C389-I391 VanDerWaalsContact C-N 3.32Å; C389-I391 PolarHBondContact O-N 3.36Å; C389-V392 PolarHBondContact O-N 2.92Å; C389-Y393 VanDerWaalsContact O-CB 3.26Å; C389-Y393 WeakPolarHBondContact O-CB 3.33Å; C389-Y393 PolarHBondContact O-N 2.79Å |
| 390 | C | 95.6 | Very high | 92.8 | Very high | 0 Ų | 0 | 43.1 Ų | 43.1 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -59.6 | -38.9 | 174.4 | -69.8 | 0 | 0 | 0 | 0 | 113.2 | I334 M335 L386 A387 L388 G394 | I334-C390 HydrophobicContact CG2-CB 4.18Å; M335-C390 HydrophobicContact CB-CB 4.17Å; L386-C390 PolarHBondContact O-N 3.5Å; L386-C390 PolarHBondContact O-SG 2.87Å; L386-C390 VanDerWaalsContact O-SG 3.42Å; A387-C390 WeakPolarHBondContact O-CB 3.4Å; A387-C390 PolarHBondContact O-N 3.13Å; L388-C390 VanDerWaalsContact C-N 3.32Å; L388-C390 PolarHBondContact O-N 3.26Å; C390-G394 PolarHBondContact O-N 3.14Å |
| 391 | I | 96.9 | Very high | 92.7 | Very high | 81 Ų | 81 | 43.6 Ų | 43.6 | 42% | 0.415 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -64.7 | -48.8 | 175.7 | -67 | 167.6 | 0 | 0 | 0 | 110.4 | I334 A338 A387 L388 C389 G394 F395 | I334-I391 HydrophobicContact CG2-CD1 4.12Å; I334-I391 HydrophobicContact CG2-CG1 3.38Å; A338-I391 HydrophobicContact CB-CB 4.39Å; A338-I391 HydrophobicContact CB-CG2 4.17Å; A338-I391 VanDerWaalsContact CB-O 3.25Å; A338-I391 WeakPolarHBondContact CB-O 3.47Å; A387-I391 WeakPolarHBondContact O-CG1 3.47Å; A387-I391 PolarHBondContact O-N 3.11Å; L388-I391 WeakPolarHBondContact O-CB 3.46Å; L388-I391 PolarHBondContact O-N 2.89Å; C389-I391 VanDerWaalsContact C-N 3.32Å; C389-I391 PolarHBondContact O-N 3.36Å; I391-G394 PolarHBondContact O-N 3.49Å; I391-F395 WeakPolarHBondContact O-CB 3.49Å; I391-F395 PolarHBondContact O-N 3.34Å |
| 392 | V | 96.6 | Very high | 92.5 | Very high | 48 Ų | 48 | 41.3 Ų | 41.3 | 29% | 0.291 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -62.9 | -48.7 | -178.7 | 174.9 | 0 | 0 | 0 | 0 | 110.4 | D373 L388 C389 F395 F396 | D373-V392 HydrophobicContact CB-CG1 3.9Å; L388-V392 WeakPolarHBondContact O-CG2 3.5Å; L388-V392 PolarHBondContact O-N 3.38Å; C389-V392 PolarHBondContact O-N 2.92Å; V392-F395 PolarHBondContact O-N 3.34Å; V392-F396 HydrophobicContact CG1-CD2 3.75Å; V392-F396 HydrophobicContact CG1-CE2 3.66Å; V392-F396 VanDerWaalsContact O-CD2 3.22Å; V392-F396 WeakPolarHBondContact O-CD2 3.34Å; V392-F396 PolarHBondContact O-N 3.13Å; V392-F396 VanDerWaalsContact O-N 3.09Å |
| 393 | Y | 95.9 | Very high | 92.1 | Very high | 6 Ų | 6 | 36.6 Ų | 36.6 | 2% | 0.024 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -56.8 | -52.5 | 175.6 | -179.1 | -92.8 | 0 | 0 | 0 | 111.9 | F307 P310 M335 M370 D373 L374 F377 C389 F395 F396 M397 | F307-Y393 PolarHBondContact O-OH 3.04Å; F307-Y393 VanDerWaalsContact O-OH 3.08Å; P310-Y393 HydrophobicContact CB-CD1 4.23Å; P310-Y393 HydrophobicContact CB-CD2 4.35Å; P310-Y393 HydrophobicContact CB-CE1 3.82Å; P310-Y393 HydrophobicContact CB-CE2 3.95Å; P310-Y393 HydrophobicContact CB-CG 4.47Å; P310-Y393 HydrophobicContact CG-CD2 4.05Å; P310-Y393 HydrophobicContact CG-CE1 4.25Å; P310-Y393 HydrophobicContact CG-CE2 3.46Å; P310-Y393 VanDerWaalsContact CG-CE2 3.46Å; M335-Y393 HydrophobicContact CG-CD1 3.74Å; M335-Y393 HydrophobicContact CG-CE1 4.29Å; M335-Y393 HydrophobicContact SD-CD1 3.28Å; M335-Y393 WeakPolarHBondContact SD-CD1 3.15Å; M335-Y393 HydrophobicContact SD-CE1 3.53Å; M335-Y393 VanDerWaalsContact SD-CE1 3.53Å; M335-Y393 HydrophobicContact SD-CG 4.32Å; M370-Y393 HydrophobicContact CE-CD2 3.74Å; M370-Y393 HydrophobicContact CE-CE1 4.47Å; M370-Y393 HydrophobicContact CE-CE2 3.09Å; M370-Y393 HydrophobicContact CG-CD2 4.42Å; D373-Y393 WeakPolarHBondContact OD2-CA 3.37Å; D373-Y393 WeakPolarHBondContact OD2-CB 3.32Å; D373-Y393 PolarHBondContact OD2-N 2.97Å; L374-Y393 HydrophobicContact CD2-CD2 4.24Å; L374-Y393 HydrophobicContact CD2-CE2 4Å; L374-Y393 HydrophobicContact CG-CE2 4.49Å; F377-Y393 HydrophobicContact CE2-CD2 4.33Å; F377-Y393 HydrophobicContact CE2-CG 4.31Å; C389-Y393 VanDerWaalsContact O-CB 3.26Å; C389-Y393 WeakPolarHBondContact O-CB 3.33Å; C389-Y393 PolarHBondContact O-N 2.79Å; Y393-F395 VanDerWaalsContact C-N 3.31Å; Y393-F395 PolarHBondContact O-N 3.01Å; Y393-F396 PolarHBondContact O-N 3.27Å; Y393-M397 HydrophobicContact CD1-CB 4.33Å; Y393-M397 HydrophobicContact CE1-CB 4.04Å; Y393-M397 HydrophobicContact CE1-CG 4.2Å; Y393-M397 VanDerWaalsContact O-CB 3.24Å; Y393-M397 WeakPolarHBondContact O-CB 3.5Å; Y393-M397 PolarHBondContact O-N 3.32Å |
| 394 | G | 95.3 | Very high | 91.9 | Very high | 0 Ų | 0 | 34.3 Ų | 34.3 | 0% | 0 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -55.9 | -49.1 | -178.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | M335 E339 C390 I391 F396 M397 G398 | M335-G394 WeakPolarHBondContact O-CA 3.12Å; E339-G394 WeakPolarHBondContact CA-O 3.35Å; C390-G394 PolarHBondContact O-N 3.14Å; I391-G394 PolarHBondContact O-N 3.49Å; G394-F396 PolarHBondContact O-N 3.46Å; G394-M397 PolarHBondContact O-N 3.27Å; G394-G398 PolarHBondContact O-N 3.47Å |
| 395 | F | 95.5 | Very high | 91.4 | Very high | 62 Ų | 62 | 28.7 Ų | 28.7 | 27% | 0.272 | 16% | 0.159 | S | C | . | . | H | α-helix | trans | -56.6 | -48.2 | 177.8 | -179.7 | -92.2 | 0 | 0 | 0 | 113.1 | A338 G342 V345 I391 V392 Y393 T399 | A338-F395 WeakPolarHBondContact O-CA 3.36Å; G342-F395 WeakPolarHBondContact CA-O 3.02Å; V345-F395 HydrophobicContact CB-CE2 3.86Å; V345-F395 HydrophobicContact CB-CZ 4.03Å; V345-F395 HydrophobicContact CG1-CE2 4.11Å; V345-F395 HydrophobicContact CG1-CZ 3.82Å; V345-F395 HydrophobicContact CG2-CE2 3.94Å; V345-F395 HydrophobicContact CG2-CZ 4.48Å; I391-F395 WeakPolarHBondContact O-CB 3.49Å; I391-F395 PolarHBondContact O-N 3.34Å; V392-F395 PolarHBondContact O-N 3.34Å; Y393-F395 VanDerWaalsContact C-N 3.31Å; Y393-F395 PolarHBondContact O-N 3.01Å; F395-T399 WeakPolarHBondContact O-CB 3.3Å; F395-T399 PolarHBondContact O-N 2.92Å; F395-T399 PolarHBondContact O-OG1 3.1Å |
| 396 | F | 94.9 | Very high | 90.7 | Very high | 35 Ų | 35 | 29.2 Ų | 29.2 | 15% | 0.154 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -73.1 | -35.3 | 179.8 | -73.6 | -59.9 | 0 | 0 | 0 | 113.1 | C366 M369 M370 V392 Y393 G394 T399 I400 | C366-F396 HydrophobicContact CB-CD1 3.97Å; C366-F396 HydrophobicContact CB-CE1 4.45Å; M369-F396 HydrophobicContact CB-CD1 4.45Å; M369-F396 HydrophobicContact CB-CD2 4.15Å; M369-F396 HydrophobicContact CB-CE1 3.92Å; M369-F396 HydrophobicContact CB-CE2 3.56Å; M369-F396 HydrophobicContact CB-CZ 3.44Å; M369-F396 VanDerWaalsContact CB-CZ 3.44Å; M369-F396 HydrophobicContact CG-CE1 4.44Å; M369-F396 HydrophobicContact CG-CE2 4.46Å; M369-F396 HydrophobicContact CG-CZ 3.96Å; M370-F396 HydrophobicContact CB-CB 4.12Å; M370-F396 HydrophobicContact CG-CB 4.44Å; V392-F396 HydrophobicContact CG1-CD2 3.75Å; V392-F396 HydrophobicContact CG1-CE2 3.66Å; V392-F396 VanDerWaalsContact O-CD2 3.22Å; V392-F396 WeakPolarHBondContact O-CD2 3.34Å; V392-F396 PolarHBondContact O-N 3.13Å; V392-F396 VanDerWaalsContact O-N 3.09Å; Y393-F396 PolarHBondContact O-N 3.27Å; G394-F396 PolarHBondContact O-N 3.46Å; F396-T399 WeakPolarHBondContact O-CB 3.41Å; F396-T399 PolarHBondContact O-N 2.89Å; F396-I400 WeakPolarHBondContact O-CB 3.4Å; F396-I400 VanDerWaalsContact O-CG1 3.31Å; F396-I400 WeakPolarHBondContact O-CG1 3.45Å; F396-I400 PolarHBondContact O-N 2.67Å |
| 397 | M | 92.1 | Very high | 90.3 | Very high | 17 Ų | 17 | 29.6 Ų | 29.6 | 8% | 0.084 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -60.9 | -46.7 | 173.2 | -175.7 | 66 | -106.1 | 0 | 0 | 110.6 | F307 M370 Y393 G394 T399 I400 A401 | F307-M397 HydrophobicContact CB-SD 4.17Å; F307-M397 HydrophobicContact CD1-CE 3.92Å; F307-M397 HydrophobicContact CD1-SD 3.38Å; F307-M397 WeakPolarHBondContact CD1-SD 3.38Å; F307-M397 HydrophobicContact CD2-CE 4.02Å; F307-M397 HydrophobicContact CD2-SD 4.33Å; F307-M397 HydrophobicContact CE1-CE 3.82Å; F307-M397 HydrophobicContact CE1-SD 3.75Å; F307-M397 HydrophobicContact CE2-CE 3.97Å; F307-M397 HydrophobicContact CG-CE 4.02Å; F307-M397 HydrophobicContact CG-SD 3.72Å; F307-M397 HydrophobicContact CZ-CE 3.88Å; F307-M397 HydrophobicContact CZ-SD 4.4Å; M370-M397 HydrophobicContact CE-CB 4.14Å; M370-M397 HydrophobicContact CE-SD 3.78Å; Y393-M397 HydrophobicContact CD1-CB 4.33Å; Y393-M397 HydrophobicContact CE1-CB 4.04Å; Y393-M397 HydrophobicContact CE1-CG 4.2Å; Y393-M397 VanDerWaalsContact O-CB 3.24Å; Y393-M397 WeakPolarHBondContact O-CB 3.5Å; Y393-M397 PolarHBondContact O-N 3.32Å; G394-M397 PolarHBondContact O-N 3.27Å; M397-T399 VanDerWaalsContact C-N 3.28Å; M397-T399 PolarHBondContact O-N 3.48Å; M397-I400 PolarHBondContact O-N 2.72Å; M397-A401 HydrophobicContact CE-CB 3.99Å; M397-A401 VanDerWaalsContact O-CB 3.24Å; M397-A401 WeakPolarHBondContact O-CB 3.31Å; M397-A401 PolarHBondContact O-N 3.08Å |
| 398 | G | 90.2 | Very high | 89.7 | Confident | 0 Ų | 0 | 29.1 Ų | 29.1 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -61.8 | -39 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | R343 G394 C402 | R343-G398 WeakPolarHBondContact CG-O 3.4Å; G394-G398 PolarHBondContact O-N 3.47Å; G398-C402 PolarHBondContact O-N 2.62Å |
| 399 | T | 89.9 | Confident | 88.8 | Confident | 4 Ų | 4 | 25.2 Ų | 25.2 | 3% | 0.025 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -61.8 | -47.9 | 175 | -64.6 | 0 | 0 | 0 | 0 | 112 | G342 I346 C366 F395 F396 M397 T403 | G342-T399 PolarHBondContact O-OG1 3.36Å; I346-T399 HydrophobicContact CB-CG2 3.84Å; I346-T399 HydrophobicContact CD1-CG2 3.71Å; I346-T399 HydrophobicContact CG1-CG2 3.69Å; I346-T399 HydrophobicContact CG2-CG2 4.46Å; C366-T399 HydrophobicContact CB-CG2 4.13Å; C366-T399 WeakPolarHBondContact SG-CG2 3.43Å; F395-T399 WeakPolarHBondContact O-CB 3.3Å; F395-T399 PolarHBondContact O-N 2.92Å; F395-T399 PolarHBondContact O-OG1 3.1Å; F396-T399 WeakPolarHBondContact O-CB 3.41Å; F396-T399 PolarHBondContact O-N 2.89Å; M397-T399 VanDerWaalsContact C-N 3.28Å; M397-T399 PolarHBondContact O-N 3.48Å; T399-T403 WeakPolarHBondContact O-CB 3.42Å; T399-T403 VanDerWaalsContact O-CG2 3.28Å; T399-T403 WeakPolarHBondContact O-CG2 3.33Å; T399-T403 PolarHBondContact O-N 3.09Å; T399-T403 PolarHBondContact O-OG1 3.35Å |
| 400 | I | 90.3 | Very high | 88.1 | Confident | 1 Ų | 1 | 27.3 Ų | 27.3 | 1% | 0.005 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -72.3 | -42.2 | -178 | -68 | 160.9 | 0 | 0 | 0 | 111 | F307 L363 C366 V367 M370 F396 M397 C402 T403 H404 | F307-I400 HydrophobicContact CE1-CG2 4.38Å; F307-I400 HydrophobicContact CZ-CG2 3.72Å; L363-I400 HydrophobicContact CD1-CG1 4.13Å; L363-I400 HydrophobicContact CD1-CG2 4.41Å; C366-I400 HydrophobicContact CB-CD1 4.43Å; C366-I400 HydrophobicContact CB-CG1 4.16Å; V367-I400 HydrophobicContact CG2-CD1 3.93Å; V367-I400 HydrophobicContact CG2-CG1 4.27Å; M370-I400 HydrophobicContact CB-CD1 4.33Å; M370-I400 HydrophobicContact SD-CD1 3.38Å; M370-I400 WeakPolarHBondContact SD-CD1 3.32Å; F396-I400 WeakPolarHBondContact O-CB 3.4Å; F396-I400 VanDerWaalsContact O-CG1 3.31Å; F396-I400 WeakPolarHBondContact O-CG1 3.45Å; F396-I400 PolarHBondContact O-N 2.67Å; M397-I400 PolarHBondContact O-N 2.72Å; I400-C402 VanDerWaalsContact C-N 3.32Å; I400-C402 PolarHBondContact O-N 3.37Å; I400-T403 PolarHBondContact O-N 2.98Å; I400-T403 VanDerWaalsContact O-N 3.12Å; I400-T403 PolarHBondContact O-OG1 2.95Å; I400-H404 HydrophobicContact CG2-CB 4.49Å; I400-H404 WeakPolarHBondContact O-CB 3.48Å; I400-H404 PolarHBondContact O-N 3Å |
| 401 | A | 85.4 | Confident | 87.2 | Confident | 39 Ų | 39 | 33.3 Ų | 33.3 | 32% | 0.322 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -56.2 | -44.1 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | M397 | M397-A401 HydrophobicContact CE-CB 3.99Å; M397-A401 VanDerWaalsContact O-CB 3.24Å; M397-A401 WeakPolarHBondContact O-CB 3.31Å; M397-A401 PolarHBondContact O-N 3.08Å |
| 402 | C | 81.2 | Confident | 86.3 | Confident | 32 Ų | 32 | 32.2 Ų | 32.2 | 22% | 0.216 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -74.1 | -24.7 | 179.2 | -77.3 | 0 | 0 | 0 | 0 | 114.2 | R343 I346 G398 I400 P406 | R343-C402 VanDerWaalsContact CG-SG 3.51Å; I346-C402 HydrophobicContact CG2-CB 4.2Å; G398-C402 PolarHBondContact O-N 2.62Å; I400-C402 VanDerWaalsContact C-N 3.32Å; I400-C402 PolarHBondContact O-N 3.37Å; C402-P406 VanDerWaalsContact O-CD 3.3Å; C402-P406 WeakPolarHBondContact O-CD 3.36Å; C402-P406 VanDerWaalsContact O-CG 3.31Å; C402-P406 WeakPolarHBondContact O-CG 3.29Å |
| 403 | T | 81.7 | Confident | 85.5 | Confident | 8 Ų | 8 | 30 Ų | 30 | 5% | 0.049 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -101.7 | -30 | -170.2 | 51.5 | 0 | 0 | 0 | 0 | 113.7 | I346 L350 L363 T399 I400 I405 P406 M407 | I346-T403 HydrophobicContact CB-CG2 4.47Å; I346-T403 HydrophobicContact CD1-CG2 4.35Å; I346-T403 HydrophobicContact CG1-CG2 3.42Å; I346-T403 VanDerWaalsContact CG1-CG2 3.42Å; I346-T403 HydrophobicContact CG2-CG2 4.19Å; L350-T403 HydrophobicContact CD1-CG2 3.41Å; L350-T403 VanDerWaalsContact CD1-CG2 3.41Å; L363-T403 WeakPolarHBondContact CD1-OG1 3.5Å; T399-T403 WeakPolarHBondContact O-CB 3.42Å; T399-T403 VanDerWaalsContact O-CG2 3.28Å; T399-T403 WeakPolarHBondContact O-CG2 3.33Å; T399-T403 PolarHBondContact O-N 3.09Å; T399-T403 PolarHBondContact O-OG1 3.35Å; I400-T403 PolarHBondContact O-N 2.98Å; I400-T403 VanDerWaalsContact O-N 3.12Å; I400-T403 PolarHBondContact O-OG1 2.95Å; T403-I405 PolarHBondContact O-N 3.46Å; T403-P406 WeakPolarHBondContact O-CD 3.46Å; T403-M407 WeakPolarHBondContact O-CB 3.25Å; T403-M407 PolarHBondContact O-N 3.22Å; T403-M407 VanDerWaalsContact O-N 3.1Å |
| 404 | H | 84 | Confident | 84.9 | Confident | 12 Ų | 12 | 30.7 Ų | 30.7 | 6% | 0.056 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -53.1 | -54.9 | -175.6 | 176 | -66.7 | 0 | 0 | 0 | 112.6 | Y296 F299 I400 Y426 | Y296-H404 AromaticContact CE1-CE1 3.59Å; Y296-H404 AromaticContact CE1-NE2 3.42Å; Y296-H404 WeakPolarHBondContact CE1-NE2 3.39Å; Y296-H404 AromaticContact CZ-NE2 3.65Å; Y296-H404 PolarHBondContact OH-NE2 3.12Å; Y296-H404 PolarHBondContact OH-O 3.47Å; F299-H404 AromaticContact CD1-NE2 3.77Å; F299-H404 AromaticContact CE1-CD2 3.19Å; F299-H404 WeakPolarHBondContact CE1-CD2 3.49Å; F299-H404 AromaticContact CE1-NE2 3.36Å; F299-H404 WeakPolarHBondContact CE1-NE2 3.47Å; F299-H404 AromaticContact CZ-CD2 3.66Å; I400-H404 HydrophobicContact CG2-CB 4.49Å; I400-H404 WeakPolarHBondContact O-CB 3.48Å; I400-H404 PolarHBondContact O-N 3Å; H404-Y426 PolarHBondContact CD2-OH 2.87Å; H404-Y426 AromaticContact CE1-CD1 3.95Å; H404-Y426 AromaticContact CE1-CE1 3.16Å; H404-Y426 WeakPolarHBondContact CE1-CE1 3.3Å; H404-Y426 AromaticContact CE1-CE2 3.26Å; H404-Y426 WeakPolarHBondContact CE1-CE2 3.45Å; H404-Y426 AromaticContact CE1-CZ 2.79Å; H404-Y426 PolarHBondContact CE1-OH 3.31Å; H404-Y426 AromaticContact ND1-CE1 3.63Å; H404-Y426 AromaticContact ND1-CZ 3.6Å; H404-Y426 PolarHBondContact ND1-OH 3.34Å; H404-Y426 AromaticContact NE2-CE1 3.98Å; H404-Y426 AromaticContact NE2-CE2 3.41Å; H404-Y426 WeakPolarHBondContact NE2-CE2 3.39Å; H404-Y426 AromaticContact NE2-CZ 3.16Å; H404-Y426 PolarHBondContact NE2-OH 3.35Å |
| 405 | I | 81.7 | Confident | 83.9 | Confident | 74 Ų | 74 | 31 Ų | 31 | 38% | 0.379 | 17% | 0.173 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -73.1 | -46.5 | -175 | -62.3 | 173.1 | 0 | 0 | 0 | 111.7 | T403 M407 L408 | T403-I405 PolarHBondContact O-N 3.46Å; I405-M407 PolarHBondContact O-N 2.91Å; I405-L408 WeakPolarHBondContact O-CB 3.27Å; I405-L408 PolarHBondContact O-N 3.26Å |
| 406 | P | 78.4 | Confident | 82.9 | Confident | 66 Ų | 66 | 33.3 Ų | 33.3 | 43% | 0.429 | 19% | 0.192 | S | C | . | . | G | 310 helix | trans | -60 | -28.2 | 177.5 | -28.4 | 38.5 | 0 | 0 | 0 | 114.5 | C402 T403 L408 A409 | C402-P406 VanDerWaalsContact O-CD 3.3Å; C402-P406 WeakPolarHBondContact O-CD 3.36Å; C402-P406 VanDerWaalsContact O-CG 3.31Å; C402-P406 WeakPolarHBondContact O-CG 3.29Å; T403-P406 WeakPolarHBondContact O-CD 3.46Å; P406-L408 PolarHBondContact O-N 2.85Å; P406-A409 WeakPolarHBondContact O-CB 3.26Å; P406-A409 PolarHBondContact O-N 3.46Å |
| 407 | M | 83.9 | Confident | 81.7 | Confident | 10 Ų | 10 | 40.6 Ų | 40.6 | 5% | 0.049 | 23% | 0.226 | C | C | . | . | G | 310 helix | trans | -62.4 | -22.4 | 178.8 | -162.6 | 72.1 | 74.2 | 0 | 0 | 113.2 | Y296 K359 L360 L363 T403 I405 A409 E410 V413 | Y296-M407 HydrophobicContact CE2-CB 4.4Å; Y296-M407 HydrophobicContact CE2-CG 4.11Å; Y296-M407 VanDerWaalsContact OH-CB 3.3Å; Y296-M407 WeakPolarHBondContact OH-CB 3.39Å; K359-M407 HydrophobicContact CB-CE 3.9Å; K359-M407 HydrophobicContact CB-SD 3.92Å; K359-M407 WeakPolarHBondContact O-CE 3.5Å; L360-M407 HydrophobicContact CD1-CG 3.87Å; L360-M407 HydrophobicContact CD1-SD 4.19Å; L363-M407 HydrophobicContact CB-CE 3.9Å; L363-M407 HydrophobicContact CD2-CE 3.88Å; L363-M407 HydrophobicContact CD2-CG 4.43Å; T403-M407 WeakPolarHBondContact O-CB 3.25Å; T403-M407 PolarHBondContact O-N 3.22Å; T403-M407 VanDerWaalsContact O-N 3.1Å; I405-M407 PolarHBondContact O-N 2.91Å; M407-A409 PolarHBondContact O-N 2.91Å; M407-E410 HydrophobicContact CG-CG 4.47Å; M407-E410 WeakPolarHBondContact O-CB 3.26Å; M407-E410 PolarHBondContact O-N 3.26Å; M407-E410 VanDerWaalsContact O-N 3.09Å; M407-E410 HydrophobicContact SD-CG 3.81Å; M407-V413 HydrophobicContact CG-CG2 4.27Å |
| 408 | L | 82.1 | Confident | 80.9 | Confident | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 25% | 0.25 | C | C | . | . | G | 310 helix | trans | -59.6 | -27.7 | 172 | -70.4 | 170.2 | 0 | 0 | 0 | 112.2 | F293 Y296 I405 P406 E410 V413 V414 G415 M419 A423 Y426 | F293-L408 HydrophobicContact CD2-CD2 4.16Å; F293-L408 HydrophobicContact CE2-CD2 3.94Å; Y296-L408 HydrophobicContact CD1-CD2 3.47Å; Y296-L408 VanDerWaalsContact CD1-CD2 3.47Å; Y296-L408 HydrophobicContact CD1-CG 4.3Å; Y296-L408 HydrophobicContact CE1-CD2 3.62Å; Y296-L408 HydrophobicContact CE1-CG 3.94Å; Y296-L408 HydrophobicContact CG-CD2 4.5Å; I405-L408 WeakPolarHBondContact O-CB 3.27Å; I405-L408 PolarHBondContact O-N 3.26Å; P406-L408 PolarHBondContact O-N 2.85Å; L408-E410 PolarHBondContact O-N 3Å; L408-V413 HydrophobicContact CD2-CG1 3.94Å; L408-V414 WeakPolarHBondContact O-CB 3.49Å; L408-V414 PolarHBondContact O-N 3.48Å; L408-G415 PolarHBondContact O-N 2.67Å; L408-M419 HydrophobicContact CB-CG 4.29Å; L408-A423 HydrophobicContact CD1-CB 4.08Å; L408-Y426 HydrophobicContact CD1-CD1 4.31Å; L408-Y426 HydrophobicContact CD1-CG 4.05Å; L408-Y426 HydrophobicContact CD2-CD2 4.48Å |
| 409 | A | 76.9 | Confident | 80.2 | Confident | 21 Ų | 21 | 49 Ų | 49 | 17% | 0.174 | 26% | 0.259 | C | S | . | . | G | 310 helix | trans | -73.4 | -16.7 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | P406 M407 G415 V416 M419 | P406-A409 WeakPolarHBondContact O-CB 3.26Å; P406-A409 PolarHBondContact O-N 3.46Å; M407-A409 PolarHBondContact O-N 2.91Å; A409-G415 CarbonylContact O-C 3.58Å; A409-G415 VanDerWaalsContact O-CA 3.31Å; A409-G415 WeakPolarHBondContact O-CA 3.46Å; A409-V416 HydrophobicContact CB-CG2 4.47Å; A409-V416 WeakPolarHBondContact O-CG2 3.29Å; A409-V416 PolarHBondContact O-N 3.36Å; A409-M419 HydrophobicContact CB-CB 4.45Å; A409-M419 HydrophobicContact CB-CE 4.18Å; A409-M419 HydrophobicContact CB-CG 3.97Å; A409-M419 HydrophobicContact CB-SD 3.62Å |
| 410 | E | 81.1 | Confident | 79.2 | Confident | 57 Ų | 57 | 53.7 Ų | 53.7 | 27% | 0.266 | 29% | 0.292 | S | S | . | . | S | Bend | trans | -71.6 | 143 | -179.1 | -62.8 | -67.8 | 151.8 | 0 | 0 | 110.6 | K359 M407 L408 E412 V413 V414 G415 | K359-E410 WeakPolarHBondContact CD-OE1 3.39Å; K359-E410 IonicContact NZ-OE1 2.65Å; K359-E410 PolarHBondContact NZ-OE1 3.29Å; K359-E410 IonicContact NZ-OE2 3.88Å; M407-E410 HydrophobicContact CG-CG 4.47Å; M407-E410 WeakPolarHBondContact O-CB 3.26Å; M407-E410 PolarHBondContact O-N 3.26Å; M407-E410 VanDerWaalsContact O-N 3.09Å; M407-E410 HydrophobicContact SD-CG 3.81Å; L408-E410 PolarHBondContact O-N 3Å; E410-E412 PolarHBondContact O-N 2.94Å; E410-E412 VanDerWaalsContact O-N 3.15Å; E410-V413 PolarHBondContact O-N 3.45Å; E410-V414 PolarHBondContact O-N 3.45Å; E410-V414 VanDerWaalsContact O-N 3.14Å; E410-G415 PolarHBondContact O-N 3.35Å |
| 411 | D | 77.4 | Confident | 78.6 | Confident | 127 Ų | 127 | 55 Ų | 55 | 68% | 0.679 | 30% | 0.302 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.9 | -19.9 | 178.4 | -63.1 | -33 | 0 | 0 | 0 | 112.1 | V413 K476 | D411-V413 PolarHBondContact O-N 3.3Å; D411-K476 WeakPolarHBondContact O-CD 3.49Å; D411-K476 WeakPolarHBondContact O-CE 3.31Å; D411-K476 PolarHBondContact O-NZ 3.08Å |
| 412 | E | 77 | Confident | 78.4 | Confident | 58 Ų | 58 | 53.1 Ų | 53.1 | 27% | 0.271 | 29% | 0.286 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70.4 | -13.5 | 171.6 | -66.3 | -169.6 | 161.6 | 0 | 0 | 113.3 | E410 R473 K476 | E410-E412 PolarHBondContact O-N 2.94Å; E410-E412 VanDerWaalsContact O-N 3.15Å; E412-R473 IonicContact OE1-CZ 2.83Å; E412-R473 IonicContact OE1-NE 2.84Å; E412-R473 PolarHBondContact OE1-NE 3.41Å; E412-R473 IonicContact OE1-NH2 3.54Å; E412-R473 PolarHBondContact OE1-NH2 3.42Å; E412-R473 IonicContact OE2-CZ 2.88Å; E412-R473 VanDerWaalsContact OE2-CZ 3.23Å; E412-R473 IonicContact OE2-NE 3.19Å; E412-R473 PolarHBondContact OE2-NE 2.7Å; E412-R473 IonicContact OE2-NH2 3.23Å; E412-R473 PolarHBondContact OE2-NH2 2.97Å; E412-K476 WeakPolarHBondContact O-CD 3.46Å |
| 413 | V | 80.6 | Confident | 78.3 | Confident | 0 Ų | 0 | 52.7 Ų | 52.7 | 0% | 0 | 29% | 0.285 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -119.1 | -74.2 | -176.9 | -173.7 | 0 | 0 | 0 | 0 | 110.9 | Y296 L360 M407 L408 E410 D411 V472 K476 | Y296-V413 HydrophobicContact CD1-CG1 3.94Å; Y296-V413 HydrophobicContact CD2-CG1 3.99Å; Y296-V413 HydrophobicContact CD2-CG2 4.06Å; Y296-V413 HydrophobicContact CE2-CG2 4.31Å; Y296-V413 HydrophobicContact CG-CG1 3.63Å; L360-V413 HydrophobicContact CD1-CG2 4.35Å; M407-V413 HydrophobicContact CG-CG2 4.27Å; L408-V413 HydrophobicContact CD2-CG1 3.94Å; E410-V413 PolarHBondContact O-N 3.45Å; D411-V413 PolarHBondContact O-N 3.3Å; V413-V472 HydrophobicContact CG2-CG1 4.31Å; V413-K476 PolarHBondContact O-NZ 2.86Å |
| 414 | V | 82.3 | Confident | 78.2 | Confident | 22 Ų | 22 | 53.5 Ų | 53.5 | 13% | 0.133 | 30% | 0.295 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -129.1 | -35.6 | 178.8 | 169.1 | 0 | 0 | 0 | 0 | 112.6 | I287 F293 L408 E410 R418 A422 | I287-V414 HydrophobicContact CG2-CG2 4.23Å; F293-V414 HydrophobicContact CB-CG2 3.97Å; F293-V414 HydrophobicContact CD2-CG2 3.37Å; F293-V414 HydrophobicContact CE2-CG2 4.18Å; F293-V414 HydrophobicContact CG-CG2 3.97Å; L408-V414 WeakPolarHBondContact O-CB 3.49Å; L408-V414 PolarHBondContact O-N 3.48Å; E410-V414 PolarHBondContact O-N 3.45Å; E410-V414 VanDerWaalsContact O-N 3.14Å; V414-R418 HydrophobicContact CG1-CB 3.52Å; V414-A422 HydrophobicContact CB-CB 4.33Å; V414-A422 HydrophobicContact CG1-CB 3.91Å; V414-A422 HydrophobicContact CG2-CB 3.99Å |
| 415 | G | 75.3 | Confident | 78.2 | Confident | 7 Ų | 7 | 52.9 Ų | 52.9 | 7% | 0.072 | 29% | 0.292 | C | S | . | . | trans | 91.4 | 159.4 | -173.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | L408 A409 E410 E417 R418 M419 | L408-G415 PolarHBondContact O-N 2.67Å; A409-G415 CarbonylContact O-C 3.58Å; A409-G415 VanDerWaalsContact O-CA 3.31Å; A409-G415 WeakPolarHBondContact O-CA 3.46Å; E410-G415 PolarHBondContact O-N 3.35Å; G415-E417 VanDerWaalsContact C-N 3.34Å; G415-E417 PolarHBondContact O-N 3.35Å; G415-R418 PolarHBondContact O-N 2.94Å; G415-M419 PolarHBondContact O-N 3.31Å | ||
| 416 | V | 74.1 | Confident | 78.4 | Confident | 110 Ų | 110 | 49.5 Ų | 49.5 | 67% | 0.667 | 27% | 0.274 | S | S | * | . | G | 310 helix | trans | -63 | -36.8 | -168.3 | -176.6 | 0 | 0 | 0 | 0 | 112.9 | A409 R418 M419 | A409-V416 HydrophobicContact CB-CG2 4.47Å; A409-V416 WeakPolarHBondContact O-CG2 3.29Å; A409-V416 PolarHBondContact O-N 3.36Å; V416-R418 VanDerWaalsContact C-N 3.33Å; V416-R418 PolarHBondContact O-N 3.01Å; V416-M419 PolarHBondContact O-N 3.09Å |
| 417 | E | 70.8 | Confident | 78.8 | Confident | 187 Ų | 187 | 47.7 Ų | 47.7 | 87% | 0.874 | 26% | 0.262 | S | S | * | . | G | 310 helix | trans | -64.9 | -33.8 | -174 | -63.1 | -170.9 | 166 | 0 | 0 | 113.6 | G415 | G415-E417 VanDerWaalsContact C-N 3.34Å; G415-E417 PolarHBondContact O-N 3.35Å |
| 418 | R | 74.9 | Confident | 78.8 | Confident | 153 Ų | 153 | 49.4 Ų | 49.4 | 58% | 0.577 | 27% | 0.269 | S | S | * | . | G | 310 helix | trans | -106.8 | 1 | -176.1 | -64 | -178 | -174.9 | -171.9 | 1.9 | 113.3 | I287 V414 G415 V416 S420 S421 A422 | I287-R418 HydrophobicContact CD1-CB 4.32Å; V414-R418 HydrophobicContact CG1-CB 3.52Å; G415-R418 PolarHBondContact O-N 2.94Å; V416-R418 VanDerWaalsContact C-N 3.33Å; V416-R418 PolarHBondContact O-N 3.01Å; R418-S420 VanDerWaalsContact C-N 3.33Å; R418-S420 PolarHBondContact O-N 3.17Å; R418-S421 PolarHBondContact O-N 3.24Å; R418-A422 WeakPolarHBondContact O-CB 3.29Å; R418-A422 PolarHBondContact O-N 3.13Å |
| 419 | M | 75.6 | Confident | 79.2 | Confident | 40 Ų | 40 | 51.1 Ų | 51.1 | 20% | 0.197 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -55.1 | -43.4 | -176.3 | -175.6 | -153.9 | 177.6 | 0 | 0 | 112.9 | L408 A409 G415 V416 S421 A422 A423 | L408-M419 HydrophobicContact CB-CG 4.29Å; A409-M419 HydrophobicContact CB-CB 4.45Å; A409-M419 HydrophobicContact CB-CE 4.18Å; A409-M419 HydrophobicContact CB-CG 3.97Å; A409-M419 HydrophobicContact CB-SD 3.62Å; G415-M419 PolarHBondContact O-N 3.31Å; V416-M419 PolarHBondContact O-N 3.09Å; M419-S421 PolarHBondContact O-N 3.34Å; M419-A422 PolarHBondContact O-N 3.48Å; M419-A423 VanDerWaalsContact O-CB 3.28Å; M419-A423 WeakPolarHBondContact O-CB 3.34Å; M419-A423 PolarHBondContact O-N 3.37Å |
| 420 | S | 69.6 | Low | 79.7 | Confident | 103 Ų | 103 | 52 Ų | 52 | 72% | 0.72 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -64.5 | -40.9 | -176.3 | 55.2 | 0 | 0 | 0 | 0 | 112.8 | R418 | R418-S420 VanDerWaalsContact C-N 3.33Å; R418-S420 PolarHBondContact O-N 3.17Å |
| 421 | S | 76.1 | Confident | 80.2 | Confident | 29 Ų | 29 | 49.4 Ų | 49.4 | 20% | 0.203 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -74.1 | -40 | 175.1 | -175.8 | 0 | 0 | 0 | 0 | 111.8 | D284 R418 M419 A423 G424 V425 | D284-S421 VanDerWaalsContact CB-OG 3.24Å; D284-S421 WeakPolarHBondContact CB-OG 3.44Å; D284-S421 PolarHBondContact N-OG 3.31Å; R418-S421 PolarHBondContact O-N 3.24Å; M419-S421 PolarHBondContact O-N 3.34Å; S421-A423 PolarHBondContact O-N 2.99Å; S421-G424 PolarHBondContact O-N 3.12Å; S421-V425 PolarHBondContact O-N 2.73Å |
| 422 | A | 81.6 | Confident | 80.8 | Confident | 0 Ų | 0 | 48.4 Ų | 48.4 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -62.8 | -41.5 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | I287 F293 V414 R418 M419 G424 V425 Y426 | I287-A422 HydrophobicContact CD1-CB 3.96Å; I287-A422 HydrophobicContact CG2-CB 4.23Å; F293-A422 HydrophobicContact CD2-CB 4.31Å; F293-A422 HydrophobicContact CE2-CB 3.72Å; F293-A422 HydrophobicContact CZ-CB 4.23Å; F293-A422 WeakPolarHBondContact CZ-O 3.47Å; V414-A422 HydrophobicContact CB-CB 4.33Å; V414-A422 HydrophobicContact CG1-CB 3.91Å; V414-A422 HydrophobicContact CG2-CB 3.99Å; R418-A422 WeakPolarHBondContact O-CB 3.29Å; R418-A422 PolarHBondContact O-N 3.13Å; M419-A422 PolarHBondContact O-N 3.48Å; A422-G424 VanDerWaalsContact C-N 3.31Å; A422-G424 PolarHBondContact O-N 3.1Å; A422-V425 PolarHBondContact O-N 2.97Å; A422-Y426 WeakPolarHBondContact O-CB 3.34Å; A422-Y426 PolarHBondContact O-N 3.04Å |
| 423 | A | 79.5 | Confident | 81.4 | Confident | 22 Ų | 22 | 45.9 Ų | 45.9 | 18% | 0.182 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -60.3 | -39.8 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | L408 M419 S421 Y426 V427 | L408-A423 HydrophobicContact CD1-CB 4.08Å; M419-A423 VanDerWaalsContact O-CB 3.28Å; M419-A423 WeakPolarHBondContact O-CB 3.34Å; M419-A423 PolarHBondContact O-N 3.37Å; S421-A423 PolarHBondContact O-N 2.99Å; A423-Y426 PolarHBondContact O-N 3.09Å; A423-V427 VanDerWaalsContact O-CG2 3.31Å; A423-V427 WeakPolarHBondContact O-CG2 3Å; A423-V427 PolarHBondContact O-N 3.37Å |
| 424 | G | 78.7 | Confident | 81.6 | Confident | 25 Ų | 25 | 46.2 Ų | 46.2 | 26% | 0.258 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -64.5 | -47.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | S421 A422 Y426 F428 | S421-G424 PolarHBondContact O-N 3.12Å; A422-G424 VanDerWaalsContact C-N 3.31Å; A422-G424 PolarHBondContact O-N 3.1Å; G424-Y426 VanDerWaalsContact C-N 3.34Å; G424-F428 WeakPolarHBondContact O-CB 3.42Å; G424-F428 PolarHBondContact O-N 3.12Å |
| 425 | V | 84.4 | Confident | 82.2 | Confident | 0 Ų | 0 | 47.3 Ų | 47.3 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -65.4 | -39.7 | 176.8 | 177.7 | 0 | 0 | 0 | 0 | 111.1 | L283 F285 L288 F293 S421 A422 F428 I429 | L283-V425 HydrophobicContact CB-CG2 4.3Å; L283-V425 HydrophobicContact CD2-CG2 4.01Å; F285-V425 HydrophobicContact CD1-CG1 4.08Å; F285-V425 HydrophobicContact CD1-CG2 4.31Å; F285-V425 HydrophobicContact CE1-CG1 4.18Å; F285-V425 HydrophobicContact CE1-CG2 4.45Å; L288-V425 HydrophobicContact CD2-CG1 4.06Å; L288-V425 HydrophobicContact CG-CG1 4.22Å; F293-V425 HydrophobicContact CE1-CB 4.43Å; F293-V425 HydrophobicContact CE1-CG1 3.98Å; F293-V425 HydrophobicContact CZ-CB 4.18Å; F293-V425 HydrophobicContact CZ-CG1 4.16Å; S421-V425 PolarHBondContact O-N 2.73Å; A422-V425 PolarHBondContact O-N 2.97Å; V425-F428 WeakPolarHBondContact O-CB 3.41Å; V425-F428 PolarHBondContact O-N 3.38Å; V425-I429 HydrophobicContact CG1-CD1 4.1Å; V425-I429 WeakPolarHBondContact O-CG1 3.39Å; V425-I429 PolarHBondContact O-N 3.29Å |
| 426 | Y | 87.1 | Confident | 82.9 | Confident | 2 Ų | 2 | 47.9 Ų | 47.9 | 1% | 0.008 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -60.3 | -51.3 | 177.1 | 170.2 | -85.5 | 0 | 0 | 0 | 111.5 | Y296 G300 H404 L408 A422 A423 G424 F428 I429 Q430 | Y296-Y426 HydrophobicContact CD1-CD2 4.2Å; Y296-Y426 HydrophobicContact CD1-CE2 4.18Å; Y296-Y426 HydrophobicContact CE1-CD2 4.47Å; Y296-Y426 HydrophobicContact CE1-CE2 4.23Å; G300-Y426 WeakPolarHBondContact CA-OH 3.31Å; H404-Y426 PolarHBondContact CD2-OH 2.87Å; H404-Y426 AromaticContact CE1-CD1 3.95Å; H404-Y426 AromaticContact CE1-CE1 3.16Å; H404-Y426 WeakPolarHBondContact CE1-CE1 3.3Å; H404-Y426 AromaticContact CE1-CE2 3.26Å; H404-Y426 WeakPolarHBondContact CE1-CE2 3.45Å; H404-Y426 AromaticContact CE1-CZ 2.79Å; H404-Y426 PolarHBondContact CE1-OH 3.31Å; H404-Y426 AromaticContact ND1-CE1 3.63Å; H404-Y426 AromaticContact ND1-CZ 3.6Å; H404-Y426 PolarHBondContact ND1-OH 3.34Å; H404-Y426 AromaticContact NE2-CE1 3.98Å; H404-Y426 AromaticContact NE2-CE2 3.41Å; H404-Y426 WeakPolarHBondContact NE2-CE2 3.39Å; H404-Y426 AromaticContact NE2-CZ 3.16Å; H404-Y426 PolarHBondContact NE2-OH 3.35Å; L408-Y426 HydrophobicContact CD1-CD1 4.31Å; L408-Y426 HydrophobicContact CD1-CG 4.05Å; L408-Y426 HydrophobicContact CD2-CD2 4.48Å; A422-Y426 WeakPolarHBondContact O-CB 3.34Å; A422-Y426 PolarHBondContact O-N 3.04Å; A423-Y426 PolarHBondContact O-N 3.09Å; G424-Y426 VanDerWaalsContact C-N 3.34Å; Y426-F428 VanDerWaalsContact C-N 3.3Å; Y426-F428 PolarHBondContact O-N 3.1Å; Y426-I429 PolarHBondContact O-N 3.12Å; Y426-Q430 WeakPolarHBondContact O-CB 3.39Å; Y426-Q430 PolarHBondContact O-N 2.71Å |
| 427 | V | 85 | Confident | 83.7 | Confident | 29 Ų | 29 | 42.7 Ų | 42.7 | 18% | 0.176 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -65.3 | -34.8 | 178.6 | 172.1 | 0 | 0 | 0 | 0 | 111.4 | T77 A423 Q430 S431 | T77-V427 HydrophobicContact CG2-CG1 4.08Å; A423-V427 VanDerWaalsContact O-CG2 3.31Å; A423-V427 WeakPolarHBondContact O-CG2 3Å; A423-V427 PolarHBondContact O-N 3.37Å; V427-Q430 WeakPolarHBondContact O-CB 3.4Å; V427-Q430 PolarHBondContact O-N 3.29Å; V427-S431 PolarHBondContact O-N 3.02Å; V427-S431 VanDerWaalsContact O-N 3.08Å |
| 428 | F | 85.3 | Confident | 84.8 | Confident | 45 Ų | 45 | 34 Ų | 34 | 20% | 0.197 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -62.6 | -41.8 | 173.8 | 176.7 | -91.3 | 0 | 0 | 0 | 112.3 | F78 G424 V425 Y426 Q430 S431 F432 | F78-F428 AromaticContact CD2-CD2 3.89Å; F78-F428 HydrophobicContact CD2-CD2 3.89Å; F78-F428 AromaticContact CD2-CE2 3.45Å; F78-F428 HydrophobicContact CD2-CE2 3.45Å; F78-F428 VanDerWaalsContact CD2-CE2 3.45Å; F78-F428 HydrophobicContact CD2-CZ 4.2Å; F78-F428 HydrophobicContact CE2-CD2 4.09Å; F78-F428 AromaticContact CE2-CE2 3.17Å; F78-F428 HydrophobicContact CE2-CE2 3.17Å; F78-F428 AromaticContact CE2-CZ 3.64Å; F78-F428 HydrophobicContact CE2-CZ 3.64Å; F78-F428 HydrophobicContact CG-CE2 4.4Å; F78-F428 AromaticContact CZ-CE2 3.92Å; F78-F428 HydrophobicContact CZ-CE2 3.92Å; F78-F428 HydrophobicContact CZ-CZ 4.46Å; G424-F428 WeakPolarHBondContact O-CB 3.42Å; G424-F428 PolarHBondContact O-N 3.12Å; V425-F428 WeakPolarHBondContact O-CB 3.41Å; V425-F428 PolarHBondContact O-N 3.38Å; Y426-F428 VanDerWaalsContact C-N 3.3Å; Y426-F428 PolarHBondContact O-N 3.1Å; F428-Q430 VanDerWaalsContact C-N 3.33Å; F428-S431 PolarHBondContact O-N 3.08Å; F428-S431 PolarHBondContact O-OG 3.07Å; F428-F432 HydrophobicContact CD1-CE2 4.41Å; F428-F432 AromaticContact CE1-CE2 3.93Å; F428-F432 HydrophobicContact CE1-CE2 3.93Å; F428-F432 HydrophobicContact CE1-CZ 4.43Å; F428-F432 HydrophobicContact CZ-CE2 4.27Å; F428-F432 HydrophobicContact CZ-CZ 4.4Å |
| 429 | I | 89.1 | Confident | 85.6 | Confident | 37 Ų | 37 | 27 Ų | 27 | 19% | 0.19 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -66.3 | -41.3 | 174.9 | -68.9 | 167.2 | 0 | 0 | 0 | 110.1 | L288 L301 V425 Y426 S431 F432 | L288-I429 HydrophobicContact CD2-CD1 3.85Å; L301-I429 HydrophobicContact CB-CG2 4.38Å; L301-I429 HydrophobicContact CD1-CG2 4.21Å; L301-I429 WeakPolarHBondContact CD1-O 3.39Å; V425-I429 HydrophobicContact CG1-CD1 4.1Å; V425-I429 WeakPolarHBondContact O-CG1 3.39Å; V425-I429 PolarHBondContact O-N 3.29Å; Y426-I429 PolarHBondContact O-N 3.12Å; I429-S431 PolarHBondContact O-N 3.42Å; I429-F432 PolarHBondContact O-N 3.27Å |
| 430 | Q | 88.6 | Confident | 86.4 | Confident | 40 Ų | 40 | 29.8 Ų | 29.8 | 19% | 0.187 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -58.7 | -30.7 | 178.7 | -160 | -176.2 | -0.7 | 0 | 0 | 113.2 | T304 Y426 V427 F428 F432 A433 G434 | T304-Q430 HydrophobicContact CG2-CG 4Å; T304-Q430 VanDerWaalsContact OG1-CD 3.26Å; T304-Q430 WeakPolarHBondContact OG1-CG 3.24Å; T304-Q430 PolarHBondContact OG1-NE2 2.82Å; Y426-Q430 WeakPolarHBondContact O-CB 3.39Å; Y426-Q430 PolarHBondContact O-N 2.71Å; V427-Q430 WeakPolarHBondContact O-CB 3.4Å; V427-Q430 PolarHBondContact O-N 3.29Å; F428-Q430 VanDerWaalsContact C-N 3.33Å; Q430-F432 PolarHBondContact O-N 3.3Å; Q430-A433 WeakPolarHBondContact O-CB 3.3Å; Q430-A433 PolarHBondContact O-N 3.41Å; Q430-A433 VanDerWaalsContact O-N 3.09Å; Q430-G434 PolarHBondContact O-N 3.11Å |
| 431 | S | 90.3 | Very high | 87.4 | Confident | 1 Ų | 1 | 24.9 Ų | 24.9 | 1% | 0.007 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -59.7 | -33.9 | -177.1 | 78.1 | 0 | 0 | 0 | 0 | 112.9 | F74 T77 V427 F428 I429 A433 G434 L435 | F74-S431 WeakPolarHBondContact CD2-O 3.09Å; T77-S431 WeakPolarHBondContact OG1-CA 3.21Å; T77-S431 WeakPolarHBondContact OG1-CB 3.28Å; V427-S431 PolarHBondContact O-N 3.02Å; V427-S431 VanDerWaalsContact O-N 3.08Å; F428-S431 PolarHBondContact O-N 3.08Å; F428-S431 PolarHBondContact O-OG 3.07Å; I429-S431 PolarHBondContact O-N 3.42Å; S431-A433 VanDerWaalsContact C-N 3.31Å; S431-A433 PolarHBondContact O-N 3.21Å; S431-G434 PolarHBondContact O-N 3.34Å; S431-G434 VanDerWaalsContact O-N 3.15Å; S431-L435 PolarHBondContact O-N 3.23Å |
| 432 | F | 90.8 | Very high | 88.2 | Confident | 107 Ų | 107 | 23.5 Ų | 23.5 | 47% | 0.469 | 13% | 0.134 | S | C | . | . | H | α-helix | trans | -65.1 | -35 | 178.6 | -67.1 | -77.8 | 0 | 0 | 0 | 112.5 | F74 L301 F428 I429 Q430 L435 G436 | F74-F432 HydrophobicContact CE2-CD1 4.43Å; F74-F432 HydrophobicContact CE2-CE1 4.4Å; L301-F432 HydrophobicContact CD1-CB 4.26Å; F428-F432 HydrophobicContact CD1-CE2 4.41Å; F428-F432 AromaticContact CE1-CE2 3.93Å; F428-F432 HydrophobicContact CE1-CE2 3.93Å; F428-F432 HydrophobicContact CE1-CZ 4.43Å; F428-F432 HydrophobicContact CZ-CE2 4.27Å; F428-F432 HydrophobicContact CZ-CZ 4.4Å; I429-F432 PolarHBondContact O-N 3.27Å; Q430-F432 PolarHBondContact O-N 3.3Å; F432-L435 PolarHBondContact O-N 3.27Å; F432-G436 PolarHBondContact O-N 3.38Å; F432-G436 VanDerWaalsContact O-N 3.08Å |
| 433 | A | 89.3 | Confident | 88.8 | Confident | 4 Ų | 4 | 26.8 Ų | 26.8 | 3% | 0.033 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -67.9 | -40 | 172.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | L301 T304 L305 Q430 S431 L435 G436 G437 | L301-A433 HydrophobicContact CD1-CB 3.62Å; L301-A433 HydrophobicContact CG-CB 4.09Å; L301-A433 WeakPolarHBondContact O-CB 3.26Å; T304-A433 HydrophobicContact CG2-CB 4Å; L305-A433 HydrophobicContact CD2-CB 3.87Å; L305-A433 WeakPolarHBondContact CD2-O 3.31Å; L305-A433 HydrophobicContact CG-CB 3.76Å; Q430-A433 WeakPolarHBondContact O-CB 3.3Å; Q430-A433 PolarHBondContact O-N 3.41Å; Q430-A433 VanDerWaalsContact O-N 3.09Å; S431-A433 VanDerWaalsContact C-N 3.31Å; S431-A433 PolarHBondContact O-N 3.21Å; A433-L435 VanDerWaalsContact C-N 3.25Å; A433-L435 PolarHBondContact O-N 3.02Å; A433-G436 PolarHBondContact O-N 3.26Å; A433-G437 PolarHBondContact O-N 3.21Å |
| 434 | G | 86.2 | Confident | 89.5 | Confident | 8 Ų | 8 | 28.8 Ų | 28.8 | 8% | 0.082 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -61.2 | -32.9 | 173.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | S70 Q430 S431 P438 | S70-G434 WeakPolarHBondContact CA-O 3.42Å; S70-G434 WeakPolarHBondContact CB-O 3.36Å; Q430-G434 PolarHBondContact O-N 3.11Å; S431-G434 PolarHBondContact O-N 3.34Å; S431-G434 VanDerWaalsContact O-N 3.15Å; G434-P438 WeakPolarHBondContact O-CD 3.47Å |
| 435 | L | 93.3 | Very high | 90.2 | Very high | 44 Ų | 44 | 27.8 Ų | 27.8 | 23% | 0.23 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -73.5 | -41.9 | 176.6 | -172.8 | 61.7 | 0 | 0 | 0 | 112.9 | W67 S70 I71 F74 S431 F432 A433 | W67-L435 HydrophobicContact CE3-CD1 4.31Å; W67-L435 HydrophobicContact CZ3-CD1 3.76Å; W67-L435 HydrophobicContact CZ3-CG 4.04Å; S70-L435 VanDerWaalsContact CB-O 3.27Å; S70-L435 WeakPolarHBondContact CB-O 3.48Å; I71-L435 HydrophobicContact CG1-CD1 4.4Å; F74-L435 HydrophobicContact CB-CB 3.93Å; F74-L435 HydrophobicContact CB-CD1 3.83Å; F74-L435 HydrophobicContact CB-CG 4.37Å; F74-L435 HydrophobicContact CD1-CD1 4.34Å; F74-L435 HydrophobicContact CD2-CB 3.85Å; F74-L435 HydrophobicContact CD2-CD2 4.01Å; F74-L435 HydrophobicContact CD2-CG 4.35Å; F74-L435 HydrophobicContact CE2-CD2 4.19Å; F74-L435 HydrophobicContact CG-CB 4.05Å; F74-L435 HydrophobicContact CG-CD1 3.99Å; F74-L435 HydrophobicContact CG-CD2 4.17Å; F74-L435 HydrophobicContact CG-CG 4.3Å; S431-L435 PolarHBondContact O-N 3.23Å; F432-L435 PolarHBondContact O-N 3.27Å; A433-L435 VanDerWaalsContact C-N 3.25Å; A433-L435 PolarHBondContact O-N 3.02Å |
| 436 | G | 90.9 | Very high | 90.7 | Very high | 20 Ų | 20 | 29 Ų | 29 | 21% | 0.206 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -86 | -33.2 | -175.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | F432 A433 L440 | F432-G436 PolarHBondContact O-N 3.38Å; F432-G436 VanDerWaalsContact O-N 3.08Å; A433-G436 PolarHBondContact O-N 3.26Å; G436-L440 VanDerWaalsContact O-CB 3.31Å; G436-L440 WeakPolarHBondContact O-CB 3.47Å; G436-L440 WeakPolarHBondContact O-CD1 3.39Å; G436-L440 WeakPolarHBondContact O-CG 3.4Å; G436-L440 PolarHBondContact O-N 3.48Å |
| 437 | G | 91.4 | Very high | 91 | Very high | 1 Ų | 1 | 34.4 Ų | 34.4 | 1% | 0.01 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -54.7 | -66.4 | -168.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | F308 A433 L440 G441 | F308-G437 WeakPolarHBondContact CE1-O 3.45Å; F308-G437 WeakPolarHBondContact CE2-O 3.32Å; F308-G437 WeakPolarHBondContact CZ-O 3.35Å; A433-G437 PolarHBondContact O-N 3.21Å; G437-L440 WeakPolarHBondContact O-CB 3.46Å; G437-L440 PolarHBondContact O-N 3.46Å; G437-L440 VanDerWaalsContact O-N 3.16Å; G437-G441 PolarHBondContact O-N 2.96Å |
| 438 | P | 92.4 | Very high | 91.4 | Very high | 4 Ų | 4 | 36.4 Ų | 36.4 | 3% | 0.026 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -59 | -43.6 | -175.4 | -19.2 | 28.7 | 0 | 0 | 0 | 114.5 | I69 S70 F308 L312 Y313 G434 L440 G441 G442 | I69-P438 HydrophobicContact CG2-CG 4.38Å; S70-P438 VanDerWaalsContact OG-CB 3.23Å; S70-P438 WeakPolarHBondContact OG-CB 3.42Å; S70-P438 VanDerWaalsContact OG-CD 3.25Å; S70-P438 WeakPolarHBondContact OG-CD 3.41Å; S70-P438 WeakPolarHBondContact OG-CG 3.41Å; F308-P438 HydrophobicContact CB-CG 4.01Å; F308-P438 HydrophobicContact CD2-CB 4.03Å; F308-P438 HydrophobicContact CD2-CG 3.98Å; F308-P438 HydrophobicContact CE2-CB 4.49Å; F308-P438 HydrophobicContact CG-CB 4.49Å; F308-P438 HydrophobicContact CG-CG 3.93Å; L312-P438 HydrophobicContact CD2-CB 3.87Å; Y313-P438 PolarHBondContact OH-O 2.92Å; G434-P438 WeakPolarHBondContact O-CD 3.47Å; P438-L440 PolarHBondContact O-N 3.36Å; P438-G441 PolarHBondContact O-N 3.14Å; P438-G442 PolarHBondContact O-N 2.98Å |
| 439 | P | 93.3 | Very high | 91.6 | Very high | 6 Ų | 6 | 42.4 Ų | 42.4 | 4% | 0.039 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -60.2 | -42.2 | 174.2 | -30.6 | 30.5 | 0 | 0 | 0 | 113.3 | S63 W67 S70 G442 V443 | S63-P439 PolarHBondContact OG-O 3.4Å; S63-P439 VanDerWaalsContact OG-O 3.05Å; W67-P439 HydrophobicContact CD2-CB 4.03Å; W67-P439 HydrophobicContact CD2-CG 3.39Å; W67-P439 VanDerWaalsContact CE2-CG 3.43Å; W67-P439 HydrophobicContact CE3-CG 3.77Å; W67-P439 HydrophobicContact CG-CB 4.33Å; W67-P439 HydrophobicContact CG-CG 3.74Å; W67-P439 HydrophobicContact CH2-CG 4.19Å; W67-P439 HydrophobicContact CZ2-CB 3.8Å; W67-P439 HydrophobicContact CZ2-CG 3.86Å; W67-P439 HydrophobicContact CZ3-CG 4.15Å; S70-P439 WeakPolarHBondContact OG-CD 3.5Å; P439-G442 PolarHBondContact O-N 3.38Å; P439-V443 WeakPolarHBondContact O-CG2 3.35Å; P439-V443 PolarHBondContact O-N 3.38Å |
| 440 | L | 92.4 | Very high | 91.7 | Very high | 98 Ų | 98 | 44.8 Ų | 44.8 | 51% | 0.513 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -62 | -47.2 | 176.4 | -73.1 | 169.1 | 0 | 0 | 0 | 110.1 | G436 G437 P438 G442 V443 L444 | G436-L440 VanDerWaalsContact O-CB 3.31Å; G436-L440 WeakPolarHBondContact O-CB 3.47Å; G436-L440 WeakPolarHBondContact O-CD1 3.39Å; G436-L440 WeakPolarHBondContact O-CG 3.4Å; G436-L440 PolarHBondContact O-N 3.48Å; G437-L440 WeakPolarHBondContact O-CB 3.46Å; G437-L440 PolarHBondContact O-N 3.46Å; G437-L440 VanDerWaalsContact O-N 3.16Å; P438-L440 PolarHBondContact O-N 3.36Å; L440-G442 VanDerWaalsContact C-N 3.33Å; L440-G442 PolarHBondContact O-N 2.95Å; L440-V443 PolarHBondContact O-N 3.5Å; L440-L444 WeakPolarHBondContact O-CD1 3.34Å; L440-L444 PolarHBondContact O-N 3.18Å |
| 441 | G | 90.8 | Very high | 91.7 | Very high | 0 Ų | 0 | 44.7 Ų | 44.7 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -56.5 | -46.2 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | G437 P438 V443 L444 V445 | G437-G441 PolarHBondContact O-N 2.96Å; P438-G441 PolarHBondContact O-N 3.14Å; G441-V443 PolarHBondContact O-N 3.49Å; G441-L444 WeakPolarHBondContact O-CB 3.46Å; G441-L444 PolarHBondContact O-N 3.33Å; G441-V445 WeakPolarHBondContact O-CG2 3.4Å; G441-V445 PolarHBondContact O-N 2.95Å |
| 442 | G | 92.3 | Very high | 91.8 | Very high | 0 Ų | 0 | 44.8 Ų | 44.8 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -62.1 | -40.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | Y313 P438 P439 L440 L444 V445 D446 | Y313-G442 WeakPolarHBondContact OH-CA 3.46Å; Y313-G442 PolarHBondContact OH-N 3.41Å; P438-G442 PolarHBondContact O-N 2.98Å; P439-G442 PolarHBondContact O-N 3.38Å; L440-G442 VanDerWaalsContact C-N 3.33Å; L440-G442 PolarHBondContact O-N 2.95Å; G442-L444 VanDerWaalsContact C-N 3.34Å; G442-L444 PolarHBondContact O-N 3.06Å; G442-V445 PolarHBondContact O-N 3.28Å; G442-D446 WeakPolarHBondContact O-CB 3.37Å; G442-D446 PolarHBondContact O-N 3.02Å |
| 443 | V | 94.9 | Very high | 91.8 | Very high | 69 Ų | 69 | 40.3 Ų | 40.3 | 42% | 0.418 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -62.2 | -44.2 | 174.4 | 171.6 | 0 | 0 | 0 | 0 | 110.4 | S63 P439 L440 G441 V445 D446 V447 | S63-V443 VanDerWaalsContact OG-CG2 3.23Å; S63-V443 WeakPolarHBondContact OG-CG2 3.41Å; P439-V443 WeakPolarHBondContact O-CG2 3.35Å; P439-V443 PolarHBondContact O-N 3.38Å; L440-V443 PolarHBondContact O-N 3.5Å; G441-V443 PolarHBondContact O-N 3.49Å; V443-V445 VanDerWaalsContact C-N 3.31Å; V443-V445 PolarHBondContact O-N 3.36Å; V443-D446 PolarHBondContact O-N 2.98Å; V443-V447 HydrophobicContact CG1-CG2 4.16Å; V443-V447 WeakPolarHBondContact O-CB 3.38Å; V443-V447 WeakPolarHBondContact O-CG2 3.25Å; V443-V447 PolarHBondContact O-N 3.12Å |
| 444 | L | 93.9 | Very high | 92 | Very high | 65 Ų | 65 | 40.1 Ų | 40.1 | 34% | 0.34 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -58.2 | -44.6 | 176.7 | -89.6 | 137.6 | 0 | 0 | 0 | 111.2 | L440 G441 G442 T448 A453 | L440-L444 WeakPolarHBondContact O-CD1 3.34Å; L440-L444 PolarHBondContact O-N 3.18Å; G441-L444 WeakPolarHBondContact O-CB 3.46Å; G441-L444 PolarHBondContact O-N 3.33Å; G442-L444 VanDerWaalsContact C-N 3.34Å; G442-L444 PolarHBondContact O-N 3.06Å; L444-T448 VanDerWaalsContact O-CB 3.31Å; L444-T448 WeakPolarHBondContact O-CB 3.48Å; L444-T448 VanDerWaalsContact O-CG2 3.29Å; L444-T448 WeakPolarHBondContact O-CG2 3.24Å; L444-T448 PolarHBondContact O-N 3.5Å; L444-T448 PolarHBondContact O-OG1 2.99Å; L444-A453 HydrophobicContact CB-CB 4.23Å; L444-A453 HydrophobicContact CD2-CB 4.3Å |
| 445 | V | 93.6 | Very high | 92.4 | Very high | 4 Ų | 4 | 39.8 Ų | 39.8 | 2% | 0.024 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -64.8 | -43.4 | 174.8 | 177.5 | 0 | 0 | 0 | 0 | 111.4 | G441 G442 V443 V447 K449 Y451 A454 | G441-V445 WeakPolarHBondContact O-CG2 3.4Å; G441-V445 PolarHBondContact O-N 2.95Å; G442-V445 PolarHBondContact O-N 3.28Å; V443-V445 VanDerWaalsContact C-N 3.31Å; V443-V445 PolarHBondContact O-N 3.36Å; V445-V447 VanDerWaalsContact C-N 3.32Å; V445-V447 PolarHBondContact O-N 2.82Å; V445-K449 WeakPolarHBondContact O-CA 3.46Å; V445-K449 PolarHBondContact O-N 3.3Å; V445-Y451 HydrophobicContact CB-CD1 4.48Å; V445-Y451 HydrophobicContact CG1-CD1 3.6Å; V445-Y451 HydrophobicContact CG1-CE1 3.63Å; V445-Y451 HydrophobicContact CG1-CG 4.15Å; V445-Y451 HydrophobicContact CG2-CD1 4.05Å; V445-A454 HydrophobicContact CG2-CB 3.84Å |
| 446 | D | 93.6 | Very high | 92.4 | Very high | 25 Ų | 25 | 42.9 Ų | 42.9 | 13% | 0.134 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -63.2 | -37.9 | -178.1 | -72.7 | -30 | 0 | 0 | 0 | 112.5 | T61 N62 S63 G442 V443 K449 | T61-D446 WeakPolarHBondContact CB-OD2 3.5Å; T61-D446 PolarHBondContact OG1-OD2 3.03Å; N62-D446 VanDerWaalsContact CB-OD1 3.24Å; N62-D446 WeakPolarHBondContact CB-OD1 3.49Å; N62-D446 PolarHBondContact N-OD1 3.12Å; N62-D446 PolarHBondContact N-OD2 3.18Å; N62-D446 PolarHBondContact ND2-OD1 3.34Å; S63-D446 WeakPolarHBondContact CB-OD2 3.45Å; S63-D446 PolarHBondContact N-OD2 2.74Å; G442-D446 WeakPolarHBondContact O-CB 3.37Å; G442-D446 PolarHBondContact O-N 3.02Å; V443-D446 PolarHBondContact O-N 2.98Å; D446-K449 WeakPolarHBondContact O-CD 3.38Å; D446-K449 VanDerWaalsContact O-CE 3.23Å; D446-K449 WeakPolarHBondContact O-CE 3.4Å; D446-K449 PolarHBondContact O-NZ 3.33Å |
| 447 | V | 94.4 | Very high | 92.6 | Very high | 116 Ų | 116 | 43.9 Ų | 43.9 | 70% | 0.703 | 23% | 0.231 | S | C | * | . | H | α-helix | trans | -78.9 | -47 | 179.1 | 172.8 | 0 | 0 | 0 | 0 | 111.7 | V443 V445 | V443-V447 HydrophobicContact CG1-CG2 4.16Å; V443-V447 WeakPolarHBondContact O-CB 3.38Å; V443-V447 WeakPolarHBondContact O-CG2 3.25Å; V443-V447 PolarHBondContact O-N 3.12Å; V445-V447 VanDerWaalsContact C-N 3.32Å; V445-V447 PolarHBondContact O-N 2.82Å |
| 448 | T | 92.8 | Very high | 92.7 | Very high | 71 Ų | 71 | 43.8 Ų | 43.8 | 44% | 0.436 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -83.3 | -16.4 | -175.3 | 62.5 | 0 | 0 | 0 | 0 | 113.5 | L444 N450 A453 | L444-T448 VanDerWaalsContact O-CB 3.31Å; L444-T448 WeakPolarHBondContact O-CB 3.48Å; L444-T448 VanDerWaalsContact O-CG2 3.29Å; L444-T448 WeakPolarHBondContact O-CG2 3.24Å; L444-T448 PolarHBondContact O-N 3.5Å; L444-T448 PolarHBondContact O-OG1 2.99Å; T448-N450 PolarHBondContact O-N 3.2Å; T448-N450 PolarHBondContact OG1-N 3.39Å; T448-N450 PolarHBondContact OG1-O 3.02Å; T448-A453 HydrophobicContact CG2-CB 3.93Å; T448-A453 VanDerWaalsContact OG1-CB 3.23Å; T448-A453 WeakPolarHBondContact OG1-CB 3.25Å |
| 449 | K | 89.5 | Confident | 92.9 | Very high | 171 Ų | 171 | 43.9 Ų | 43.9 | 74% | 0.743 | 23% | 0.232 | S | C | * | . | S | Bend | trans | 54.8 | 25.2 | -169.5 | -56.1 | -56.6 | -173.4 | -162 | 0 | 113.4 | V445 D446 | V445-K449 WeakPolarHBondContact O-CA 3.46Å; V445-K449 PolarHBondContact O-N 3.3Å; D446-K449 WeakPolarHBondContact O-CD 3.38Å; D446-K449 VanDerWaalsContact O-CE 3.23Å; D446-K449 WeakPolarHBondContact O-CE 3.4Å; D446-K449 PolarHBondContact O-NZ 3.33Å |
| 450 | N | 90.5 | Very high | 92.9 | Very high | 86 Ų | 86 | 48.1 Ų | 48.1 | 46% | 0.46 | 26% | 0.257 | S | S | . | . | trans | -132.7 | 119.4 | -179.4 | -174.3 | -14.5 | 0 | 0 | 0 | 110.2 | T448 G452 A453 | T448-N450 PolarHBondContact O-N 3.2Å; T448-N450 PolarHBondContact OG1-N 3.39Å; T448-N450 PolarHBondContact OG1-O 3.02Å; N450-G452 PolarHBondContact O-N 2.97Å; N450-G452 PolarHBondContact OD1-N 3.08Å; N450-A453 WeakPolarHBondContact O-CB 3.21Å; N450-A453 PolarHBondContact O-N 2.99Å; N450-A453 VanDerWaalsContact O-N 3.1Å | ||
| 451 | Y | 90 | Very high | 93 | Very high | 38 Ų | 38 | 43.8 Ų | 43.8 | 15% | 0.149 | 24% | 0.236 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -60.3 | -28.4 | 176.8 | -71.4 | -75.7 | 0 | 0 | 0 | 112.8 | Y313 E316 V445 A453 A454 F455 | Y313-Y451 HydrophobicContact CD1-CD1 4.05Å; Y313-Y451 HydrophobicContact CD1-CE1 4.19Å; Y313-Y451 HydrophobicContact CG-CD1 4.31Å; E316-Y451 HydrophobicContact CB-CD1 3.87Å; E316-Y451 HydrophobicContact CB-CD2 4.03Å; E316-Y451 HydrophobicContact CB-CE1 3.57Å; E316-Y451 HydrophobicContact CB-CE2 3.73Å; E316-Y451 HydrophobicContact CB-CG 4.1Å; E316-Y451 VanDerWaalsContact CB-CZ 3.49Å; E316-Y451 HydrophobicContact CG-CE1 4.14Å; V445-Y451 HydrophobicContact CB-CD1 4.48Å; V445-Y451 HydrophobicContact CG1-CD1 3.6Å; V445-Y451 HydrophobicContact CG1-CE1 3.63Å; V445-Y451 HydrophobicContact CG1-CG 4.15Å; V445-Y451 HydrophobicContact CG2-CD1 4.05Å; Y451-A453 PolarHBondContact O-N 2.84Å; Y451-A454 WeakPolarHBondContact O-CB 3.35Å; Y451-A454 PolarHBondContact O-N 2.69Å; Y451-A454 VanDerWaalsContact O-N 3.12Å; Y451-F455 WeakPolarHBondContact O-CD2 2.98Å |
| 452 | G | 91.3 | Very high | 93.3 | Very high | 3 Ų | 3 | 43.8 Ų | 43.8 | 3% | 0.031 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -60 | -24.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 114 | T378 N450 A454 F455 Y456 | T378-G452 WeakPolarHBondContact CG2-O 3.48Å; N450-G452 PolarHBondContact O-N 2.97Å; N450-G452 PolarHBondContact OD1-N 3.08Å; G452-A454 VanDerWaalsContact C-N 3.27Å; G452-A454 PolarHBondContact O-N 3.18Å; G452-F455 WeakPolarHBondContact O-CB 3.37Å; G452-F455 PolarHBondContact O-N 3.22Å; G452-F455 VanDerWaalsContact O-N 3.12Å; G452-Y456 WeakPolarHBondContact O-CD2 3.13Å; G452-Y456 PolarHBondContact O-N 3.45Å |
| 453 | A | 92.3 | Very high | 93.4 | Very high | 14 Ų | 14 | 44.9 Ų | 44.9 | 12% | 0.116 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -63.1 | -33.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | L444 T448 N450 Y451 F455 Y456 S457 | L444-A453 HydrophobicContact CB-CB 4.23Å; L444-A453 HydrophobicContact CD2-CB 4.3Å; T448-A453 HydrophobicContact CG2-CB 3.93Å; T448-A453 VanDerWaalsContact OG1-CB 3.23Å; T448-A453 WeakPolarHBondContact OG1-CB 3.25Å; N450-A453 WeakPolarHBondContact O-CB 3.21Å; N450-A453 PolarHBondContact O-N 2.99Å; N450-A453 VanDerWaalsContact O-N 3.1Å; Y451-A453 PolarHBondContact O-N 2.84Å; A453-F455 VanDerWaalsContact C-N 3.34Å; A453-Y456 PolarHBondContact O-N 3.13Å; A453-S457 PolarHBondContact O-N 3.37Å |
| 454 | A | 93.3 | Very high | 93.5 | Very high | 0 Ų | 0 | 45.1 Ų | 45.1 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -67.2 | -35.9 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | A309 Y313 V445 Y451 G452 S457 C458 | A309-A454 HydrophobicContact CB-CB 4.08Å; Y313-A454 HydrophobicContact CD2-CB 3.65Å; Y313-A454 HydrophobicContact CE2-CB 3.78Å; V445-A454 HydrophobicContact CG2-CB 3.84Å; Y451-A454 WeakPolarHBondContact O-CB 3.35Å; Y451-A454 PolarHBondContact O-N 2.69Å; Y451-A454 VanDerWaalsContact O-N 3.12Å; G452-A454 VanDerWaalsContact C-N 3.27Å; G452-A454 PolarHBondContact O-N 3.18Å; A454-S457 PolarHBondContact O-N 2.97Å; A454-C458 PolarHBondContact O-N 2.83Å; A454-C458 PolarHBondContact O-SG 2.84Å; A454-C458 VanDerWaalsContact O-SG 3.33Å |
| 455 | F | 94.7 | Very high | 93.6 | Very high | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -69.3 | -40.7 | 176.4 | -71.3 | -102.1 | 0 | 0 | 0 | 111.5 | P310 I314 L317 L374 F377 T378 Y451 G452 A453 S457 C458 A459 | P310-F455 HydrophobicContact CB-CE1 3.95Å; P310-F455 HydrophobicContact CG-CD1 4.07Å; P310-F455 HydrophobicContact CG-CE1 3.75Å; I314-F455 HydrophobicContact CD1-CZ 4.35Å; L317-F455 HydrophobicContact CB-CE2 4.23Å; L317-F455 HydrophobicContact CD2-CD2 4.13Å; L317-F455 HydrophobicContact CD2-CE1 4.38Å; L317-F455 HydrophobicContact CD2-CE2 3.66Å; L317-F455 HydrophobicContact CD2-CZ 3.79Å; L317-F455 HydrophobicContact CG-CE2 4.4Å; L374-F455 HydrophobicContact CD2-CD1 4.4Å; F377-F455 HydrophobicContact CB-CB 4.43Å; F377-F455 HydrophobicContact CB-CD1 3.53Å; F377-F455 HydrophobicContact CB-CE1 3.99Å; F377-F455 HydrophobicContact CB-CG 4.12Å; F377-F455 HydrophobicContact CD1-CD1 4.18Å; F377-F455 AromaticContact CD1-CE1 3.76Å; F377-F455 HydrophobicContact CD1-CE1 3.76Å; F377-F455 HydrophobicContact CD2-CD1 4.15Å; F377-F455 HydrophobicContact CD2-CE1 4.32Å; F377-F455 HydrophobicContact CE1-CE1 4.33Å; F377-F455 AromaticContact CG-CD1 3.7Å; F377-F455 HydrophobicContact CG-CD1 3.7Å; F377-F455 AromaticContact CG-CE1 3.76Å; F377-F455 HydrophobicContact CG-CE1 3.76Å; T378-F455 HydrophobicContact CG2-CB 3.68Å; Y451-F455 WeakPolarHBondContact O-CD2 2.98Å; G452-F455 WeakPolarHBondContact O-CB 3.37Å; G452-F455 PolarHBondContact O-N 3.22Å; G452-F455 VanDerWaalsContact O-N 3.12Å; A453-F455 VanDerWaalsContact C-N 3.34Å; F455-S457 VanDerWaalsContact C-N 3.35Å; F455-S457 PolarHBondContact O-N 3.13Å; F455-C458 WeakPolarHBondContact O-CB 3.31Å; F455-C458 PolarHBondContact O-N 3.28Å; F455-A459 PolarHBondContact O-N 3.39Å |
| 456 | Y | 93.3 | Very high | 93.7 | Very high | 110 Ų | 110 | 42.4 Ų | 42.4 | 43% | 0.431 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -59.2 | -44.5 | 171.4 | -86.3 | -64.3 | 0 | 0 | 0 | 112.4 | V375 T378 G452 A453 C458 A459 V460 | V375-Y456 HydrophobicContact CG1-CE1 4.28Å; T378-Y456 HydrophobicContact CG2-CD1 4.39Å; T378-Y456 HydrophobicContact CG2-CD2 3.57Å; T378-Y456 HydrophobicContact CG2-CE1 4.41Å; T378-Y456 HydrophobicContact CG2-CE2 3.59Å; T378-Y456 HydrophobicContact CG2-CG 3.99Å; T378-Y456 VanDerWaalsContact OG1-CE2 3.27Å; T378-Y456 WeakPolarHBondContact OG1-CE2 3.33Å; T378-Y456 PolarHBondContact OG1-OH 3.43Å; G452-Y456 WeakPolarHBondContact O-CD2 3.13Å; G452-Y456 PolarHBondContact O-N 3.45Å; A453-Y456 PolarHBondContact O-N 3.13Å; Y456-C458 VanDerWaalsContact C-N 3.32Å; Y456-C458 PolarHBondContact O-N 3.1Å; Y456-A459 WeakPolarHBondContact O-CB 3.43Å; Y456-A459 PolarHBondContact O-N 3.28Å; Y456-A459 VanDerWaalsContact O-N 3.16Å; Y456-V460 WeakPolarHBondContact O-CG2 3.28Å; Y456-V460 PolarHBondContact O-N 2.64Å |
| 457 | S | 93.6 | Very high | 93.8 | Very high | 40 Ų | 40 | 44.9 Ų | 44.9 | 28% | 0.28 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -59.7 | -43.4 | 175.3 | 178.1 | 0 | 0 | 0 | 0 | 111.9 | A453 A454 F455 A459 V460 G461 | A453-S457 PolarHBondContact O-N 3.37Å; A454-S457 PolarHBondContact O-N 2.97Å; F455-S457 VanDerWaalsContact C-N 3.35Å; F455-S457 PolarHBondContact O-N 3.13Å; S457-A459 VanDerWaalsContact C-N 3.34Å; S457-A459 PolarHBondContact O-N 2.82Å; S457-V460 PolarHBondContact O-N 3.39Å; S457-G461 PolarHBondContact O-N 3.23Å |
| 458 | C | 94.3 | Very high | 93.8 | Very high | 0 Ų | 0 | 41.7 Ų | 41.7 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -63 | -39.2 | 173.9 | -72.3 | 0 | 0 | 0 | 0 | 112.4 | L305 G306 A309 L374 A454 F455 Y456 G461 M462 | L305-C458 PolarHBondContact O-SG 2.87Å; G306-C458 WeakPolarHBondContact CA-O 3.48Å; A309-C458 HydrophobicContact CB-CB 4.32Å; A309-C458 WeakPolarHBondContact CB-SG 3.4Å; L374-C458 HydrophobicContact CD1-CB 4.21Å; L374-C458 HydrophobicContact CD2-CB 4.21Å; A454-C458 PolarHBondContact O-N 2.83Å; A454-C458 PolarHBondContact O-SG 2.84Å; A454-C458 VanDerWaalsContact O-SG 3.33Å; F455-C458 WeakPolarHBondContact O-CB 3.31Å; F455-C458 PolarHBondContact O-N 3.28Å; Y456-C458 VanDerWaalsContact C-N 3.32Å; Y456-C458 PolarHBondContact O-N 3.1Å; C458-G461 PolarHBondContact O-N 3.47Å; C458-M462 WeakPolarHBondContact O-CB 3.48Å; C458-M462 PolarHBondContact O-N 2.99Å |
| 459 | A | 95.6 | Very high | 93.8 | Very high | 6 Ų | 6 | 38.4 Ų | 38.4 | 5% | 0.05 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -63.2 | -42.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | T371 L374 V375 F455 Y456 S457 M462 G463 | T371-A459 WeakPolarHBondContact CG2-O 3.32Å; L374-A459 HydrophobicContact CB-CB 3.79Å; V375-A459 HydrophobicContact CG2-CB 3.74Å; F455-A459 PolarHBondContact O-N 3.39Å; Y456-A459 WeakPolarHBondContact O-CB 3.43Å; Y456-A459 PolarHBondContact O-N 3.28Å; Y456-A459 VanDerWaalsContact O-N 3.16Å; S457-A459 VanDerWaalsContact C-N 3.34Å; S457-A459 PolarHBondContact O-N 2.82Å; A459-M462 PolarHBondContact O-N 3.26Å; A459-G463 PolarHBondContact O-N 3.48Å |
| 460 | V | 95.1 | Very high | 93.9 | Very high | 95 Ų | 95 | 31.7 Ų | 31.7 | 58% | 0.576 | 19% | 0.185 | S | C | * | . | H | α-helix | trans | -62.4 | -45.8 | 174.8 | 173.2 | 0 | 0 | 0 | 0 | 110.7 | Y456 S457 M462 G463 L464 | Y456-V460 WeakPolarHBondContact O-CG2 3.28Å; Y456-V460 PolarHBondContact O-N 2.64Å; S457-V460 PolarHBondContact O-N 3.39Å; V460-M462 PolarHBondContact O-N 3.25Å; V460-G463 PolarHBondContact O-N 3.26Å; V460-L464 HydrophobicContact CG1-CD1 4.29Å; V460-L464 WeakPolarHBondContact O-CG 3.47Å; V460-L464 PolarHBondContact O-N 3.43Å |
| 461 | G | 94.5 | Very high | 94 | Very high | 6 Ų | 6 | 33.2 Ų | 33.2 | 6% | 0.062 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -57.6 | -48 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | F302 S457 C458 G463 L464 S465 | F302-G461 WeakPolarHBondContact CB-O 3.45Å; F302-G461 CarbonylContact O-C 3.57Å; S457-G461 PolarHBondContact O-N 3.23Å; C458-G461 PolarHBondContact O-N 3.47Å; G461-G463 PolarHBondContact O-N 2.77Å; G461-L464 PolarHBondContact O-N 2.79Å; G461-S465 PolarHBondContact O-N 2.84Å |
| 462 | M | 95.1 | Very high | 94 | Very high | 0 Ų | 0 | 31.4 Ų | 31.4 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -64.5 | -40.4 | 178.7 | -160.9 | 59.8 | 69 | 0 | 0 | 112.4 | A303 F307 V367 M370 T371 L374 C458 A459 V460 S465 A466 | A303-M462 HydrophobicContact CB-SD 4.33Å; F307-M462 HydrophobicContact CD1-CE 3.37Å; F307-M462 HydrophobicContact CE1-CE 3.14Å; F307-M462 HydrophobicContact CE1-SD 4.11Å; F307-M462 HydrophobicContact CG-CE 4.45Å; F307-M462 HydrophobicContact CZ-CE 4.05Å; V367-M462 HydrophobicContact CG1-CG 3.99Å; V367-M462 HydrophobicContact CG1-SD 3.82Å; M370-M462 HydrophobicContact CE-CE 3.93Å; M370-M462 HydrophobicContact CG-CE 4.41Å; M370-M462 HydrophobicContact SD-CE 3.7Å; M370-M462 HydrophobicContact SD-SD 4.26Å; T371-M462 WeakPolarHBondContact OG1-CB 3.22Å; T371-M462 VanDerWaalsContact OG1-CG 3.23Å; T371-M462 WeakPolarHBondContact OG1-CG 3.31Å; L374-M462 HydrophobicContact CD1-CB 3.93Å; L374-M462 HydrophobicContact CD1-CE 4.36Å; L374-M462 HydrophobicContact CD1-CG 4.32Å; C458-M462 WeakPolarHBondContact O-CB 3.48Å; C458-M462 PolarHBondContact O-N 2.99Å; A459-M462 PolarHBondContact O-N 3.26Å; V460-M462 PolarHBondContact O-N 3.25Å; M462-S465 WeakPolarHBondContact O-CA 3.46Å; M462-S465 WeakPolarHBondContact O-CB 3.42Å; M462-S465 PolarHBondContact O-N 3.17Å; M462-S465 VanDerWaalsContact O-N 3.15Å; M462-S465 PolarHBondContact O-OG 2.54Å; M462-A466 PolarHBondContact O-N 2.84Å |
| 463 | G | 96.1 | Very high | 93.7 | Very high | 23 Ų | 23 | 33.3 Ų | 33.3 | 24% | 0.237 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -62.7 | -44.7 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | A459 V460 G461 S465 A466 V467 | A459-G463 PolarHBondContact O-N 3.48Å; V460-G463 PolarHBondContact O-N 3.26Å; G461-G463 PolarHBondContact O-N 2.77Å; G463-S465 VanDerWaalsContact C-N 3.27Å; G463-S465 PolarHBondContact O-N 3.44Å; G463-A466 WeakPolarHBondContact O-CB 3.25Å; G463-A466 PolarHBondContact O-N 3.18Å; G463-V467 WeakPolarHBondContact O-CG2 3.43Å; G463-V467 PolarHBondContact O-N 3.38Å; G463-V467 VanDerWaalsContact O-N 3.14Å |
| 464 | L | 96 | Very high | 93.4 | Very high | 75 Ų | 75 | 35.6 Ų | 35.6 | 39% | 0.393 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -60 | -40.2 | 172.5 | -71.6 | 173.3 | 0 | 0 | 0 | 111.3 | F302 V460 G461 A466 V467 F468 | F302-L464 HydrophobicContact CB-CB 4.42Å; F302-L464 HydrophobicContact CD1-CB 4.08Å; F302-L464 HydrophobicContact CD1-CD1 3.96Å; F302-L464 HydrophobicContact CE1-CD1 3.76Å; F302-L464 HydrophobicContact CG-CB 4.11Å; F302-L464 HydrophobicContact CZ-CD1 4.39Å; V460-L464 HydrophobicContact CG1-CD1 4.29Å; V460-L464 WeakPolarHBondContact O-CG 3.47Å; V460-L464 PolarHBondContact O-N 3.43Å; G461-L464 PolarHBondContact O-N 2.79Å; L464-A466 VanDerWaalsContact C-N 3.32Å; L464-A466 PolarHBondContact O-N 2.86Å; L464-V467 WeakPolarHBondContact O-CB 3.22Å; L464-V467 PolarHBondContact O-N 2.94Å; L464-F468 WeakPolarHBondContact O-CD2 3.35Å; L464-F468 PolarHBondContact O-N 3.02Å; L464-F468 VanDerWaalsContact O-N 3.07Å |
| 465 | S | 95.3 | Very high | 93 | Very high | 0 Ų | 0 | 36.9 Ų | 36.9 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -60.5 | -40.7 | 176 | 91.3 | 0 | 0 | 0 | 0 | 112.1 | F299 V367 G461 M462 G463 V467 F468 L469 | F299-S465 WeakPolarHBondContact CD2-O 3.14Å; F299-S465 WeakPolarHBondContact O-CB 3.19Å; V367-S465 VanDerWaalsContact CG1-OG 3.27Å; V367-S465 WeakPolarHBondContact CG1-OG 3.45Å; G461-S465 PolarHBondContact O-N 2.84Å; M462-S465 WeakPolarHBondContact O-CA 3.46Å; M462-S465 WeakPolarHBondContact O-CB 3.42Å; M462-S465 PolarHBondContact O-N 3.17Å; M462-S465 VanDerWaalsContact O-N 3.15Å; M462-S465 PolarHBondContact O-OG 2.54Å; G463-S465 VanDerWaalsContact C-N 3.27Å; G463-S465 PolarHBondContact O-N 3.44Å; S465-V467 VanDerWaalsContact C-N 3.33Å; S465-V467 PolarHBondContact O-N 3.49Å; S465-F468 PolarHBondContact O-N 3.12Å; S465-L469 WeakPolarHBondContact O-CB 3.36Å; S465-L469 PolarHBondContact O-N 3.39Å |
| 466 | A | 95.7 | Very high | 92.2 | Very high | 11 Ų | 11 | 40.4 Ų | 40.4 | 9% | 0.091 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -62.3 | -40.7 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | L364 V367 I368 M462 G463 L464 L469 G470 | L364-A466 HydrophobicContact CD1-CB 4.18Å; L364-A466 WeakPolarHBondContact CD1-O 3.25Å; V367-A466 HydrophobicContact CG1-CB 3.81Å; I368-A466 HydrophobicContact CG1-CB 4Å; M462-A466 PolarHBondContact O-N 2.84Å; G463-A466 WeakPolarHBondContact O-CB 3.25Å; G463-A466 PolarHBondContact O-N 3.18Å; L464-A466 VanDerWaalsContact C-N 3.32Å; L464-A466 PolarHBondContact O-N 2.86Å; A466-L469 PolarHBondContact O-N 3.47Å; A466-G470 PolarHBondContact O-N 2.96Å |
| 467 | V | 95.8 | Very high | 91.5 | Very high | 78 Ų | 78 | 43.4 Ų | 43.4 | 47% | 0.473 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -61.5 | -51.2 | 177 | 175 | 0 | 0 | 0 | 0 | 110.5 | G463 L464 S465 L469 G470 F471 | G463-V467 WeakPolarHBondContact O-CG2 3.43Å; G463-V467 PolarHBondContact O-N 3.38Å; G463-V467 VanDerWaalsContact O-N 3.14Å; L464-V467 WeakPolarHBondContact O-CB 3.22Å; L464-V467 PolarHBondContact O-N 2.94Å; S465-V467 VanDerWaalsContact C-N 3.33Å; S465-V467 PolarHBondContact O-N 3.49Å; V467-L469 VanDerWaalsContact C-N 3.33Å; V467-L469 PolarHBondContact O-N 3.25Å; V467-G470 PolarHBondContact O-N 2.86Å; V467-F471 HydrophobicContact CG1-CD2 3.86Å; V467-F471 HydrophobicContact CG1-CE2 3.51Å; V467-F471 WeakPolarHBondContact O-CD2 3.25Å; V467-F471 PolarHBondContact O-N 2.96Å |
| 468 | F | 94.9 | Very high | 90 | Very high | 48 Ų | 48 | 43.5 Ų | 43.5 | 21% | 0.211 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -60.4 | -43 | 178.2 | -73.6 | -64.1 | 0 | 0 | 0 | 112.3 | L295 L298 F299 F302 L464 S465 G470 F471 V472 | L295-F468 HydrophobicContact CD2-CD1 3.82Å; L295-F468 HydrophobicContact CD2-CE1 4.46Å; L298-F468 HydrophobicContact CB-CB 4.41Å; L298-F468 HydrophobicContact CB-CD1 3.98Å; L298-F468 HydrophobicContact CB-CD2 4.12Å; L298-F468 HydrophobicContact CB-CE1 4.28Å; L298-F468 HydrophobicContact CB-CE2 4.44Å; L298-F468 HydrophobicContact CB-CG 3.9Å; L298-F468 HydrophobicContact CD1-CD1 3.97Å; L298-F468 HydrophobicContact CD1-CE1 3.69Å; L298-F468 HydrophobicContact CD1-CZ 4.22Å; F299-F468 HydrophobicContact CB-CB 4.12Å; F302-F468 AromaticContact CD2-CD2 3.65Å; F302-F468 HydrophobicContact CD2-CD2 3.65Å; F302-F468 AromaticContact CD2-CE2 3.42Å; F302-F468 HydrophobicContact CD2-CE2 3.42Å; F302-F468 VanDerWaalsContact CD2-CE2 3.42Å; F302-F468 HydrophobicContact CD2-CZ 4.49Å; F302-F468 HydrophobicContact CE2-CD2 4.01Å; F302-F468 AromaticContact CE2-CE2 3.3Å; F302-F468 HydrophobicContact CE2-CE2 3.3Å; F302-F468 HydrophobicContact CE2-CZ 4.02Å; F302-F468 HydrophobicContact CG-CE2 4.46Å; F302-F468 HydrophobicContact CZ-CE2 4.25Å; L464-F468 WeakPolarHBondContact O-CD2 3.35Å; L464-F468 PolarHBondContact O-N 3.02Å; L464-F468 VanDerWaalsContact O-N 3.07Å; S465-F468 PolarHBondContact O-N 3.12Å; F468-G470 VanDerWaalsContact C-N 3.31Å; F468-G470 PolarHBondContact O-N 3.38Å; F468-F471 PolarHBondContact O-N 3.22Å; F468-F471 VanDerWaalsContact O-N 3.13Å; F468-V472 WeakPolarHBondContact O-CG2 3.31Å; F468-V472 PolarHBondContact O-N 2.99Å |
| 469 | L | 93.2 | Very high | 87.7 | Confident | 2 Ų | 2 | 49.8 Ų | 49.8 | 1% | 0.01 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -62 | -38.8 | 177.3 | -175.4 | 62.4 | 0 | 0 | 0 | 112.1 | Y296 F299 L360 L363 L364 V367 S465 A466 V467 F471 V472 | Y296-L469 HydrophobicContact CD2-CD1 4.03Å; Y296-L469 HydrophobicContact CE2-CD1 3.82Å; F299-L469 HydrophobicContact CB-CB 4.24Å; F299-L469 HydrophobicContact CD1-CD1 3.97Å; F299-L469 HydrophobicContact CD2-CB 3.87Å; F299-L469 HydrophobicContact CD2-CD2 4.25Å; F299-L469 HydrophobicContact CD2-CG 4.45Å; F299-L469 HydrophobicContact CE1-CD1 4.1Å; F299-L469 HydrophobicContact CE1-CD2 4.47Å; F299-L469 HydrophobicContact CE2-CB 4.43Å; F299-L469 HydrophobicContact CE2-CD2 3.96Å; F299-L469 HydrophobicContact CG-CB 3.99Å; F299-L469 HydrophobicContact CG-CD1 4.18Å; F299-L469 HydrophobicContact CZ-CD2 4.07Å; L360-L469 HydrophobicContact CD1-CD1 3.68Å; L360-L469 HydrophobicContact CG-CD1 4.17Å; L363-L469 HydrophobicContact CB-CD2 4.28Å; L363-L469 HydrophobicContact CD2-CD1 4.18Å; L363-L469 HydrophobicContact CD2-CD2 4Å; L363-L469 HydrophobicContact CG-CD2 3.71Å; L364-L469 HydrophobicContact CB-CD2 4.08Å; L364-L469 HydrophobicContact CD1-CB 4.25Å; L364-L469 HydrophobicContact CD1-CD2 4.22Å; L364-L469 HydrophobicContact CD1-CG 4.33Å; V367-L469 HydrophobicContact CG2-CD2 4.21Å; S465-L469 WeakPolarHBondContact O-CB 3.36Å; S465-L469 PolarHBondContact O-N 3.39Å; A466-L469 PolarHBondContact O-N 3.47Å; V467-L469 VanDerWaalsContact C-N 3.33Å; V467-L469 PolarHBondContact O-N 3.25Å; L469-F471 VanDerWaalsContact C-N 3.27Å; L469-F471 PolarHBondContact O-N 3.22Å; L469-V472 WeakPolarHBondContact O-CB 3.38Å; L469-V472 PolarHBondContact O-N 3.22Å |
| 470 | G | 92.3 | Very high | 85.2 | Confident | 31 Ų | 31 | 55.9 Ų | 55.9 | 32% | 0.32 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -61.3 | -33 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | A466 V467 F468 P474 | A466-G470 PolarHBondContact O-N 2.96Å; V467-G470 PolarHBondContact O-N 2.86Å; F468-G470 VanDerWaalsContact C-N 3.31Å; F468-G470 PolarHBondContact O-N 3.38Å; G470-P474 WeakPolarHBondContact O-CD 3.41Å |
| 471 | F | 92.6 | Very high | 82.9 | Confident | 117 Ų | 117 | 56.3 Ų | 56.3 | 51% | 0.513 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -81.9 | -13.1 | 179.2 | -75 | -63.3 | 0 | 0 | 0 | 115 | L295 V467 F468 L469 R473 P474 A475 | L295-F471 HydrophobicContact CD1-CB 4.07Å; L295-F471 HydrophobicContact CD2-CB 4.34Å; V467-F471 HydrophobicContact CG1-CD2 3.86Å; V467-F471 HydrophobicContact CG1-CE2 3.51Å; V467-F471 WeakPolarHBondContact O-CD2 3.25Å; V467-F471 PolarHBondContact O-N 2.96Å; F468-F471 PolarHBondContact O-N 3.22Å; F468-F471 VanDerWaalsContact O-N 3.13Å; L469-F471 VanDerWaalsContact C-N 3.27Å; L469-F471 PolarHBondContact O-N 3.22Å; F471-R473 PolarHBondContact O-N 3.21Å; F471-P474 WeakPolarHBondContact O-CD 3.37Å; F471-A475 VanDerWaalsContact O-CB 3.29Å; F471-A475 WeakPolarHBondContact O-CB 3.42Å; F471-A475 PolarHBondContact O-N 3.44Å |
| 472 | V | 89.5 | Confident | 80.3 | Confident | 0 Ų | 0 | 67.8 Ų | 67.8 | 0% | 0 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -59.1 | -48.1 | -179.8 | 174.1 | 0 | 0 | 0 | 0 | 111.7 | L295 Y296 L360 V413 F468 L469 A475 K476 | L295-V472 HydrophobicContact CB-CG2 3.88Å; Y296-V472 HydrophobicContact CD2-CG2 4.22Å; L360-V472 HydrophobicContact CD2-CB 4.19Å; L360-V472 HydrophobicContact CD2-CG1 4.18Å; V413-V472 HydrophobicContact CG2-CG1 4.31Å; F468-V472 WeakPolarHBondContact O-CG2 3.31Å; F468-V472 PolarHBondContact O-N 2.99Å; L469-V472 WeakPolarHBondContact O-CB 3.38Å; L469-V472 PolarHBondContact O-N 3.22Å; V472-A475 PolarHBondContact O-N 3.34Å; V472-K476 PolarHBondContact O-N 3.22Å; V472-K476 VanDerWaalsContact O-N 3.13Å |
| 473 | R | 84.9 | Confident | 77.7 | Confident | 44 Ų | 44 | 79.7 Ų | 79.7 | 17% | 0.166 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -62.5 | -51 | 178.7 | -96.6 | 170 | -176.4 | -152.6 | -6 | 113.2 | T357 L360 Q361 E412 F471 A475 K476 K477 | T357-R473 PolarHBondContact O-NH2 2.69Å; L360-R473 HydrophobicContact CD2-CB 4.31Å; L360-R473 HydrophobicContact CD2-CG 3.55Å; Q361-R473 VanDerWaalsContact CG-NH1 3.31Å; E412-R473 IonicContact OE1-CZ 2.83Å; E412-R473 IonicContact OE1-NE 2.84Å; E412-R473 PolarHBondContact OE1-NE 3.41Å; E412-R473 IonicContact OE1-NH2 3.54Å; E412-R473 PolarHBondContact OE1-NH2 3.42Å; E412-R473 IonicContact OE2-CZ 2.88Å; E412-R473 VanDerWaalsContact OE2-CZ 3.23Å; E412-R473 IonicContact OE2-NE 3.19Å; E412-R473 PolarHBondContact OE2-NE 2.7Å; E412-R473 IonicContact OE2-NH2 3.23Å; E412-R473 PolarHBondContact OE2-NH2 2.97Å; F471-R473 PolarHBondContact O-N 3.21Å; R473-A475 VanDerWaalsContact C-N 3.33Å; R473-A475 PolarHBondContact O-N 3.29Å; R473-K476 PolarHBondContact O-N 3.01Å; R473-K477 PolarHBondContact O-N 3.24Å |
| 474 | P | 86.1 | Confident | 75 | Confident | 62 Ų | 62 | 93.9 Ų | 93.9 | 40% | 0.403 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -56.9 | -42.5 | 174.4 | -27 | 32.7 | 0 | 0 | 0 | 113.7 | G470 F471 K476 K477 G478 | G470-P474 WeakPolarHBondContact O-CD 3.41Å; F471-P474 WeakPolarHBondContact O-CD 3.37Å; P474-K476 VanDerWaalsContact C-N 3.33Å; P474-K476 PolarHBondContact O-N 3.2Å; P474-K477 PolarHBondContact O-N 3.24Å; P474-G478 CarbonylContact O-C 3.58Å; P474-G478 PolarHBondContact O-N 3.32Å |
| 475 | A | 83.7 | Confident | 73.9 | Confident | 27 Ų | 27 | 94.9 Ų | 94.9 | 22% | 0.223 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -63.4 | -40.1 | -179.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | L295 F471 V472 R473 G478 | L295-A475 HydrophobicContact CD1-CB 3.33Å; F471-A475 VanDerWaalsContact O-CB 3.29Å; F471-A475 WeakPolarHBondContact O-CB 3.42Å; F471-A475 PolarHBondContact O-N 3.44Å; V472-A475 PolarHBondContact O-N 3.34Å; R473-A475 VanDerWaalsContact C-N 3.33Å; R473-A475 PolarHBondContact O-N 3.29Å; A475-G478 PolarHBondContact O-N 3.42Å |
| 476 | K | 78.9 | Confident | 72.8 | Confident | 74 Ų | 74 | 99.8 Ų | 99.8 | 32% | 0.322 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -74.2 | -33.5 | -179.2 | -161.7 | 154.9 | -164.1 | 165.6 | 0 | 114.3 | S292 D411 E412 V413 V472 R473 P474 G478 | S292-K476 VanDerWaalsContact OG-CB 3.28Å; S292-K476 WeakPolarHBondContact OG-CB 3.27Å; S292-K476 WeakPolarHBondContact OG-CG 3.4Å; D411-K476 WeakPolarHBondContact O-CD 3.49Å; D411-K476 WeakPolarHBondContact O-CE 3.31Å; D411-K476 PolarHBondContact O-NZ 3.08Å; E412-K476 WeakPolarHBondContact O-CD 3.46Å; V413-K476 PolarHBondContact O-NZ 2.86Å; V472-K476 PolarHBondContact O-N 3.22Å; V472-K476 VanDerWaalsContact O-N 3.13Å; R473-K476 PolarHBondContact O-N 3.01Å; P474-K476 VanDerWaalsContact C-N 3.33Å; P474-K476 PolarHBondContact O-N 3.2Å; K476-G478 PolarHBondContact O-N 3.38Å |
| 477 | K | 77.6 | Confident | 71.5 | Confident | 172 Ų | 172 | 104.8 Ų | 104.8 | 75% | 0.748 | 51% | 0.51 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.3 | -2.8 | 175.8 | -70.3 | -174.2 | 178 | -175.3 | 0 | 113.2 | R473 P474 | R473-K477 PolarHBondContact O-N 3.24Å; P474-K477 PolarHBondContact O-N 3.24Å |
| 478 | G | 62.4 | Low | 70.1 | Confident | 42 Ų | 42 | 106.4 Ų | 106.4 | 43% | 0.433 | 51% | 0.512 | S | S | . | . | trans | 73.9 | 127.2 | -167 | 0 | 0 | 0 | 0 | 0 | 109.4 | P474 A475 K476 P480 | P474-G478 CarbonylContact O-C 3.58Å; P474-G478 PolarHBondContact O-N 3.32Å; A475-G478 PolarHBondContact O-N 3.42Å; K476-G478 PolarHBondContact O-N 3.38Å; G478-P480 WeakPolarHBondContact O-CD 3.32Å | ||
| 479 | L | 45.8 | Very low | 68.5 | Low | 133 Ų | 133 | 110 Ų | 110 | 70% | 0.696 | 53% | 0.531 | S | S | * | . | trans | -52.1 | 130.6 | 165.2 | -85.7 | 115.3 | 0 | 0 | 0 | 107.9 | C481 | L479-C481 HydrophobicContact CB-CB 4.38Å; L479-C481 PolarHBondContact O-N 3.46Å | ||
| 480 | P | 43.9 | Very low | 66.9 | Low | 133 Ų | 133 | 117.2 Ų | 117.2 | 86% | 0.864 | 57% | 0.565 | S | S | * | * | S | Bend | trans | -72.2 | 60.3 | 170.3 | 30.9 | -33.5 | 0 | 0 | 0 | 109.5 | G478 | G478-P480 WeakPolarHBondContact O-CD 3.32Š|
| 481 | C | 45.6 | Very low | 65.1 | Low | 104 Ų | 104 | 123.4 Ų | 123.4 | 70% | 0.703 | 58% | 0.583 | S | S | * | * | trans | -141.7 | 63.5 | -180 | -83 | 0 | 0 | 0 | 0 | 110.3 | L479 | L479-C481 HydrophobicContact CB-CB 4.38Å; L479-C481 PolarHBondContact O-N 3.46Å | ||
| 482 | R | 40.5 | Very low | 62.9 | Low | 247 Ų | 247 | 123.8 Ų | 123.8 | 93% | 0.932 | 59% | 0.588 | S | S | * | * | trans | -161 | 62.1 | 146.3 | -135.7 | 176.3 | -178.9 | -173.5 | -0.1 | 111.9 | ||||
| 483 | R | 40.1 | Very low | 60.7 | Low | 250 Ų | 250 | 134.2 Ų | 134.2 | 94% | 0.943 | 64% | 0.637 | S | S | * | * | trans | -122.2 | 87.6 | 151.2 | -96.1 | -172.3 | 178 | -179.9 | -0.1 | 106.8 | ||||
| 484 | R | 39.3 | Very low | 58.5 | Low | 322 Ų | 322 | 142.4 Ų | 142.4 | 100% | 1.215 | 68% | 0.68 | S | S | * | * | trans | -143.8 | 0 | 153.8 | -98.4 | -169 | -178.6 | -178.7 | 0.5 | 107.5 |
Retrieved 484 of 484 residues in 986.8 ms
(Link to these results)