| 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 | 35.4 | Very low | 31.5 | Very low | 253 Ų | 253 | 139.7 Ų | 139.7 | 100% | 1.246 | 84% | 0.842 | S | S | * | * | 0 | 132.7 | 0 | -91.1 | 167.4 | 171.2 | 0 | 0 | 108 | |||||
| 2 | A | 25.7 | Very low | 31.8 | Very low | 94 Ų | 94 | 138.3 Ų | 138.3 | 78% | 0.777 | 84% | 0.839 | S | S | * | * | trans | -55 | -178.1 | -174.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 3 | P | 39.9 | Very low | 32.1 | Very low | 108 Ų | 108 | 138.8 Ų | 138.8 | 70% | 0.701 | 83% | 0.833 | S | S | * | * | cis | -136.1 | 179 | -48.5 | 34.1 | -16.3 | 0 | 0 | 0 | 113 | ||||
| 4 | S | 31.8 | Very low | 32.6 | Very low | 104 Ų | 104 | 140.1 Ų | 140.1 | 73% | 0.727 | 83% | 0.834 | S | S | * | * | trans | -39.9 | 135.2 | 163.3 | 49.2 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 5 | L | 31.7 | Very low | 33.1 | Very low | 174 Ų | 174 | 137.1 Ų | 137.1 | 91% | 0.911 | 82% | 0.822 | S | S | * | * | trans | -103.3 | 109.3 | 159.3 | -108.3 | 89.7 | 0 | 0 | 0 | 110.8 | ||||
| 6 | S | 29.8 | Very low | 33.8 | Very low | 101 Ų | 101 | 133.9 Ų | 133.9 | 71% | 0.706 | 81% | 0.809 | S | S | * | * | trans | -61 | 151.2 | 165.4 | -54.8 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 7 | G | 32.9 | Very low | 34.7 | Very low | 80 Ų | 80 | 130 Ų | 130 | 83% | 0.825 | 79% | 0.788 | S | S | * | * | trans | -62.3 | 153.3 | -177 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 8 | T | 27.9 | Very low | 35.2 | Very low | 138 Ų | 138 | 130.7 Ų | 130.7 | 85% | 0.847 | 78% | 0.783 | S | S | * | * | trans | -124.2 | 99.4 | 166.7 | -35.9 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 9 | Q | 29.9 | Very low | 36.2 | Very low | 187 Ų | 187 | 126.8 Ų | 126.8 | 87% | 0.874 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -59.1 | 132.4 | 162 | -81.8 | 167.4 | -42.2 | 0 | 0 | 109 | ||
| 10 | M | 29.2 | Very low | 36.9 | Very low | 182 Ų | 182 | 126.4 Ų | 126.4 | 90% | 0.897 | 75% | 0.751 | S | S | * | * | P | Polyproline II helix | trans | -63.1 | 131.6 | 166.3 | -71 | -179.2 | -121.4 | 0 | 0 | 109.4 | ||
| 11 | P | 32.1 | Very low | 37.3 | Very low | 116 Ų | 116 | 125.7 Ų | 125.7 | 75% | 0.753 | 74% | 0.744 | S | S | * | * | P | Polyproline II helix | trans | -73.9 | 147 | 173.9 | 29.5 | -31.7 | 0 | 0 | 0 | 110.8 | ||
| 12 | P | 34.9 | Very low | 37.9 | Very low | 123 Ų | 123 | 115.5 Ų | 115.5 | 80% | 0.799 | 70% | 0.697 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 135.3 | 178.4 | 29.7 | -31.6 | 0 | 0 | 0 | 110.9 | N14 | P12-N14 PolarHBondContact O-N 3.5Å; P12-N14 VanDerWaalsContact O-N 3.15Å |
| 13 | N | 36.8 | Very low | 38.8 | Very low | 144 Ų | 144 | 113.5 Ų | 113.5 | 77% | 0.77 | 67% | 0.673 | S | S | * | * | trans | -65 | 103 | 178.7 | -161.5 | 16.3 | 0 | 0 | 0 | 110.4 | ||||
| 14 | N | 39.1 | Very low | 39.1 | Very low | 158 Ų | 158 | 111.4 Ų | 111.4 | 85% | 0.845 | 66% | 0.658 | S | S | * | * | trans | -129.6 | 58.6 | 173.4 | -129.6 | 24.4 | 0 | 0 | 0 | 110.2 | P12 S16 | P12-N14 PolarHBondContact O-N 3.5Å; P12-N14 VanDerWaalsContact O-N 3.15Å; N14-S16 PolarHBondContact O-N 3.29Å | ||
| 15 | S | 38.8 | Very low | 39.9 | Very low | 94 Ų | 94 | 109.4 Ų | 109.4 | 66% | 0.657 | 64% | 0.644 | S | S | * | * | trans | -85.9 | 81 | 168.6 | -48.7 | 0 | 0 | 0 | 0 | 109.2 | C17 | S15-C17 PolarHBondContact O-N 3.06Š| ||
| 16 | S | 45.3 | Very low | 41.2 | Very low | 86 Ų | 86 | 104.3 Ų | 104.3 | 60% | 0.601 | 62% | 0.62 | S | S | * | * | trans | -51.3 | 113.8 | 162.4 | 45.6 | 0 | 0 | 0 | 0 | 109 | N14 M18 | N14-S16 PolarHBondContact O-N 3.29Å; S16-M18 PolarHBondContact O-N 2.69Å | ||
| 17 | C | 49.4 | Very low | 42.9 | Very low | 68 Ų | 68 | 103.9 Ų | 103.9 | 46% | 0.459 | 62% | 0.615 | S | S | . | * | trans | -63.7 | 85.2 | 174 | -77.6 | 0 | 0 | 0 | 0 | 109.9 | S15 I19 C266 L271 | S15-C17 PolarHBondContact O-N 3.06Å; C17-I19 PolarHBondContact O-N 3.41Å; C17-C266 VanDerWaalsContact SG-SG 3.65Å; C17-L271 HydrophobicContact CB-CD2 4.03Å | ||
| 18 | M | 43.5 | Very low | 44.7 | Very low | 142 Ų | 142 | 103.2 Ų | 103.2 | 70% | 0.7 | 60% | 0.602 | S | S | * | * | trans | -72.1 | 114.4 | 179.7 | -72.7 | -89.4 | -144.8 | 0 | 0 | 109.9 | S16 | S16-M18 PolarHBondContact O-N 2.69Š| ||
| 19 | I | 53.8 | Low | 46.9 | Very low | 58 Ų | 58 | 98.3 Ų | 98.3 | 30% | 0.297 | 58% | 0.575 | S | S | . | * | trans | -99.2 | 108.2 | 165 | -57.3 | -179.6 | 0 | 0 | 0 | 107.4 | C17 L271 E274 | C17-I19 PolarHBondContact O-N 3.41Å; I19-L271 HydrophobicContact CD1-CB 4.45Å; I19-L271 HydrophobicContact CD1-CD2 3.9Å; I19-L271 HydrophobicContact CG1-CD2 4.25Å; I19-E274 HydrophobicContact CD1-CB 4.06Å | ||
| 20 | N | 50.8 | Low | 49.2 | Very low | 118 Ų | 118 | 90.1 Ų | 90.1 | 63% | 0.631 | 54% | 0.538 | S | S | * | . | trans | -86.5 | 137.3 | 166.1 | -91.3 | -11.6 | 0 | 0 | 0 | 111.1 | ||||
| 21 | D | 45.6 | Very low | 51.9 | Low | 112 Ų | 112 | 85.5 Ų | 85.5 | 60% | 0.599 | 52% | 0.52 | S | S | * | . | trans | 84.4 | 86.1 | 167.1 | -56.3 | -37 | 0 | 0 | 0 | 119.6 | ||||
| 22 | S | 47 | Very low | 54.5 | Low | 38 Ų | 38 | 83.6 Ų | 83.6 | 27% | 0.266 | 51% | 0.506 | S | S | . | . | trans | -88.8 | 135.7 | 151.7 | 59.2 | 0 | 0 | 0 | 0 | 111.1 | V24 S25 R176 | S22-V24 PolarHBondContact O-N 3.2Å; S22-S25 PolarHBondContact O-N 3.3Å; S22-S25 PolarHBondContact O-OG 2.65Å; S22-R176 PolarHBondContact O-NH1 3Å; S22-R176 PolarHBondContact O-NH2 3.19Å; S22-R176 PolarHBondContact OG-NH1 3.21Å | ||
| 23 | I | 44.8 | Very low | 56.9 | Low | 53 Ų | 53 | 78 Ų | 78 | 27% | 0.272 | 47% | 0.472 | S | S | . | . | G | 310 helix | trans | -53.9 | -0.8 | -172 | -81.4 | -174.4 | 0 | 0 | 0 | 117.4 | S25 T26 A29 K279 | I23-S25 PolarHBondContact O-N 3.13Å; I23-T26 PolarHBondContact O-N 3.4Å; I23-T26 VanDerWaalsContact O-N 3.14Å; I23-T26 PolarHBondContact O-OG1 3.23Å; I23-A29 HydrophobicContact CG2-CB 3.51Å; I23-K279 HydrophobicContact CD1-CD 4.07Å; I23-K279 VanDerWaalsContact CD1-CE 3.41Å; I23-K279 HydrophobicContact CD1-CG 3.45Å; I23-K279 VanDerWaalsContact CD1-CG 3.45Å; I23-K279 HydrophobicContact CG1-CG 3.93Å |
| 24 | V | 45.9 | Very low | 59.4 | Low | 64 Ų | 64 | 72.5 Ų | 72.5 | 39% | 0.388 | 44% | 0.443 | S | S | . | . | G | 310 helix | trans | -59.8 | -7.4 | 164.7 | -169.6 | 0 | 0 | 0 | 0 | 111.2 | S22 M93 | S22-V24 PolarHBondContact O-N 3.2Å; V24-M93 WeakPolarHBondContact O-CE 3.48Å |
| 25 | S | 49 | Very low | 61.9 | Low | 62 Ų | 62 | 70.5 Ų | 70.5 | 43% | 0.434 | 43% | 0.432 | S | S | . | . | G | 310 helix | trans | -92.2 | -4.6 | 175.2 | 42.4 | 0 | 0 | 0 | 0 | 117.1 | S22 I23 P27 | S22-S25 PolarHBondContact O-N 3.3Å; S22-S25 PolarHBondContact O-OG 2.65Å; I23-S25 PolarHBondContact O-N 3.13Å; S25-P27 WeakPolarHBondContact O-CD 3.41Å |
| 26 | T | 58.9 | Low | 64.4 | Low | 66 Ų | 66 | 68.9 Ų | 68.9 | 41% | 0.405 | 42% | 0.415 | S | S | . | . | trans | -98.7 | 116.6 | 172.6 | 28.7 | 0 | 0 | 0 | 0 | 111.2 | I23 A28 A29 | I23-T26 PolarHBondContact O-N 3.4Å; I23-T26 VanDerWaalsContact O-N 3.14Å; I23-T26 PolarHBondContact O-OG1 3.23Å; T26-A28 PolarHBondContact O-N 3.02Å; T26-A29 PolarHBondContact O-N 3.3Å | ||
| 27 | P | 64.8 | Low | 66.6 | Low | 92 Ų | 92 | 65.1 Ų | 65.1 | 60% | 0.597 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -50.9 | -33.8 | 176 | -26.6 | 33.3 | 0 | 0 | 0 | 113 | S25 A29 T30 V31 | S25-P27 WeakPolarHBondContact O-CD 3.41Å; P27-A29 PolarHBondContact O-N 3.26Å; P27-T30 PolarHBondContact O-N 3.08Å; P27-T30 PolarHBondContact O-OG1 3.43Å; P27-V31 WeakPolarHBondContact O-CB 3.49Å; P27-V31 WeakPolarHBondContact O-CG2 3.39Å; P27-V31 PolarHBondContact O-N 2.98Å |
| 28 | A | 71.7 | Confident | 68.7 | Low | 66 Ų | 66 | 63.7 Ų | 63.7 | 55% | 0.545 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -60.4 | -44.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | T26 T30 V31 T32 | T26-A28 PolarHBondContact O-N 3.02Å; A28-T30 PolarHBondContact O-N 3.44Å; A28-V31 PolarHBondContact O-N 3.12Å; A28-T32 WeakPolarHBondContact O-CB 3.47Å; A28-T32 PolarHBondContact O-N 3.08Å; A28-T32 PolarHBondContact O-OG1 3.48Å |
| 29 | A | 74.7 | Confident | 71 | Confident | 35 Ų | 35 | 59.1 Ų | 59.1 | 29% | 0.289 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -68 | -37.4 | -177.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | I23 T26 P27 G33 | I23-A29 HydrophobicContact CG2-CB 3.51Å; T26-A29 PolarHBondContact O-N 3.3Å; P27-A29 PolarHBondContact O-N 3.26Å; A29-G33 PolarHBondContact O-N 3.41Å |
| 30 | T | 78.1 | Confident | 72.9 | Confident | 16 Ų | 16 | 56.6 Ų | 56.6 | 10% | 0.098 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -74.2 | -38.4 | 175.8 | 49 | 0 | 0 | 0 | 0 | 112.4 | P27 A28 G33 T34 L90 M93 | P27-T30 PolarHBondContact O-N 3.08Å; P27-T30 PolarHBondContact O-OG1 3.43Å; A28-T30 PolarHBondContact O-N 3.44Å; T30-G33 PolarHBondContact O-N 3.3Å; T30-T34 WeakPolarHBondContact O-CB 3.46Å; T30-T34 PolarHBondContact O-N 2.96Å; T30-T34 PolarHBondContact O-OG1 3.4Å; T30-L90 HydrophobicContact CG2-CD2 4.44Å; T30-M93 HydrophobicContact CG2-CE 3.27Å; T30-M93 WeakPolarHBondContact OG1-CE 3.44Å |
| 31 | V | 84.7 | Confident | 75 | Confident | 84 Ų | 84 | 53.8 Ų | 53.8 | 51% | 0.509 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -62 | -49.7 | 173.1 | 169.7 | 0 | 0 | 0 | 0 | 110.2 | P27 A28 G33 T34 L35 | P27-V31 WeakPolarHBondContact O-CB 3.49Å; P27-V31 WeakPolarHBondContact O-CG2 3.39Å; P27-V31 PolarHBondContact O-N 2.98Å; A28-V31 PolarHBondContact O-N 3.12Å; V31-G33 PolarHBondContact O-N 3.09Å; V31-T34 PolarHBondContact O-N 3.02Å; V31-L35 HydrophobicContact CG1-CD1 4.09Å; V31-L35 WeakPolarHBondContact O-CG 3.4Å; V31-L35 PolarHBondContact O-N 3.06Å |
| 32 | T | 86.3 | Confident | 77.3 | Confident | 76 Ų | 76 | 54.1 Ų | 54.1 | 47% | 0.466 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -60.2 | -44.7 | 176.8 | -58.4 | 0 | 0 | 0 | 0 | 111.6 | A28 T34 L35 I36 | A28-T32 WeakPolarHBondContact O-CB 3.47Å; A28-T32 PolarHBondContact O-N 3.08Å; A28-T32 PolarHBondContact O-OG1 3.48Å; T32-T34 PolarHBondContact O-N 3.13Å; T32-L35 PolarHBondContact O-N 3.48Å; T32-I36 HydrophobicContact CG2-CD1 3.78Å; T32-I36 HydrophobicContact CG2-CG1 4.43Å; T32-I36 VanDerWaalsContact O-CG1 3.28Å; T32-I36 WeakPolarHBondContact O-CG1 3.5Å; T32-I36 PolarHBondContact O-N 3.38Å |
| 33 | G | 86.5 | Confident | 79.5 | Confident | 7 Ų | 7 | 57.4 Ų | 57.4 | 7% | 0.072 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -60.3 | -44.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | A29 T30 V31 I36 L37 | A29-G33 PolarHBondContact O-N 3.41Å; T30-G33 PolarHBondContact O-N 3.3Å; V31-G33 PolarHBondContact O-N 3.09Å; G33-I36 PolarHBondContact O-N 2.98Å; G33-L37 PolarHBondContact O-N 3.31Å |
| 34 | T | 88.5 | Confident | 81.8 | Confident | 28 Ų | 28 | 54.9 Ų | 54.9 | 17% | 0.172 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -61.9 | -44.2 | 176.3 | -63.3 | 0 | 0 | 0 | 0 | 111.7 | T30 V31 T32 S38 I87 L90 | T30-T34 WeakPolarHBondContact O-CB 3.46Å; T30-T34 PolarHBondContact O-N 2.96Å; T30-T34 PolarHBondContact O-OG1 3.4Å; V31-T34 PolarHBondContact O-N 3.02Å; T32-T34 PolarHBondContact O-N 3.13Å; T34-S38 VanDerWaalsContact O-CB 3.28Å; T34-S38 WeakPolarHBondContact O-CB 3.36Å; T34-S38 PolarHBondContact O-N 3.15Å; T34-S38 PolarHBondContact O-OG 3.3Å; T34-I87 HydrophobicContact CG2-CG2 4.21Å; T34-L90 VanDerWaalsContact OG1-CB 3.28Å; T34-L90 WeakPolarHBondContact OG1-CB 3.38Å |
| 35 | L | 91.2 | Very high | 84.1 | Confident | 116 Ų | 116 | 55.7 Ų | 55.7 | 61% | 0.607 | 33% | 0.334 | S | S | * | . | H | α-helix | trans | -62.8 | -45.2 | 177.2 | -71.6 | 173.7 | 0 | 0 | 0 | 111.7 | V31 T32 S38 A39 | V31-L35 HydrophobicContact CG1-CD1 4.09Å; V31-L35 WeakPolarHBondContact O-CG 3.4Å; V31-L35 PolarHBondContact O-N 3.06Å; T32-L35 PolarHBondContact O-N 3.48Å; L35-S38 PolarHBondContact O-N 3.31Å; L35-A39 PolarHBondContact O-N 3.16Å |
| 36 | I | 91.7 | Very high | 86.3 | Confident | 60 Ų | 60 | 56 Ų | 56 | 31% | 0.308 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -63.3 | -50 | 178.3 | -65.9 | 166.9 | 0 | 0 | 0 | 110.5 | T32 G33 S38 A39 V40 T286 I290 | T32-I36 HydrophobicContact CG2-CD1 3.78Å; T32-I36 HydrophobicContact CG2-CG1 4.43Å; T32-I36 VanDerWaalsContact O-CG1 3.28Å; T32-I36 WeakPolarHBondContact O-CG1 3.5Å; T32-I36 PolarHBondContact O-N 3.38Å; G33-I36 PolarHBondContact O-N 2.98Å; I36-S38 VanDerWaalsContact C-N 3.28Å; I36-S38 PolarHBondContact O-N 2.87Å; I36-A39 PolarHBondContact O-N 3.02Å; I36-V40 HydrophobicContact CG2-CG2 4.2Å; I36-V40 WeakPolarHBondContact O-CB 3.48Å; I36-V40 VanDerWaalsContact O-CG2 3.26Å; I36-V40 WeakPolarHBondContact O-CG2 3.41Å; I36-V40 PolarHBondContact O-N 3.31Å; I36-T286 HydrophobicContact CB-CG2 3.85Å; I36-T286 HydrophobicContact CD1-CG2 4.33Å; I36-T286 HydrophobicContact CG2-CG2 3.52Å; I36-I290 HydrophobicContact CG2-CD1 4.03Å; I36-I290 HydrophobicContact CG2-CG1 4.16Å |
| 37 | L | 91.8 | Very high | 87.9 | Confident | 6 Ų | 6 | 53.5 Ų | 53.5 | 3% | 0.031 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -63.6 | -34.5 | 179.8 | -72.7 | -173.3 | 0 | 0 | 0 | 112.4 | G33 V40 F41 T83 F86 I87 L90 T286 F289 | G33-L37 PolarHBondContact O-N 3.31Å; L37-V40 PolarHBondContact O-N 3.32Å; L37-F41 WeakPolarHBondContact O-CB 3.35Å; L37-F41 PolarHBondContact O-N 2.91Å; L37-T83 HydrophobicContact CB-CG2 4.1Å; L37-T83 HydrophobicContact CD2-CG2 4.3Å; L37-F86 HydrophobicContact CD1-CB 3.9Å; L37-I87 HydrophobicContact CB-CD1 4.32Å; L37-I87 HydrophobicContact CB-CG1 3.76Å; L37-L90 HydrophobicContact CD1-CD1 3.54Å; L37-L90 HydrophobicContact CG-CD1 4.4Å; L37-T286 HydrophobicContact CD2-CG2 4.12Å; L37-T286 HydrophobicContact CG-CG2 4.22Å; L37-F289 HydrophobicContact CD2-CB 3.84Å; L37-F289 HydrophobicContact CD2-CD1 3.93Å; L37-F289 HydrophobicContact CD2-CG 3.95Å |
| 38 | S | 93.3 | Very high | 89.3 | Confident | 38 Ų | 38 | 49.1 Ų | 49.1 | 27% | 0.266 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -64.4 | -44.8 | 174.6 | -58.9 | 0 | 0 | 0 | 0 | 111.5 | T34 L35 I36 F41 L42 | T34-S38 VanDerWaalsContact O-CB 3.28Å; T34-S38 WeakPolarHBondContact O-CB 3.36Å; T34-S38 PolarHBondContact O-N 3.15Å; T34-S38 PolarHBondContact O-OG 3.3Å; L35-S38 PolarHBondContact O-N 3.31Å; I36-S38 VanDerWaalsContact C-N 3.28Å; I36-S38 PolarHBondContact O-N 2.87Å; S38-F41 PolarHBondContact O-N 3.12Å; S38-L42 WeakPolarHBondContact O-CB 3.2Å; S38-L42 VanDerWaalsContact O-CG 3.29Å; S38-L42 WeakPolarHBondContact O-CG 3.28Å; S38-L42 PolarHBondContact O-N 2.96Å |
| 39 | A | 93.1 | Very high | 90.3 | Very high | 47 Ų | 47 | 50.5 Ų | 50.5 | 39% | 0.388 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -63.9 | -42.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | L35 I36 F41 L42 L43 | L35-A39 PolarHBondContact O-N 3.16Å; I36-A39 PolarHBondContact O-N 3.02Å; A39-F41 VanDerWaalsContact C-N 3.34Å; A39-F41 PolarHBondContact O-N 2.75Å; A39-L42 PolarHBondContact O-N 3.48Å; A39-L43 WeakPolarHBondContact O-CB 3.35Å; A39-L43 WeakPolarHBondContact O-CG 3.39Å; A39-L43 PolarHBondContact O-N 2.98Å |
| 40 | V | 93.7 | Very high | 91.1 | Very high | 5 Ų | 5 | 51.7 Ų | 51.7 | 3% | 0.03 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -60.4 | -43.2 | 175.6 | 168.7 | 0 | 0 | 0 | 0 | 111 | I36 L37 G44 M80 I290 C293 | I36-V40 HydrophobicContact CG2-CG2 4.2Å; I36-V40 WeakPolarHBondContact O-CB 3.48Å; I36-V40 VanDerWaalsContact O-CG2 3.26Å; I36-V40 WeakPolarHBondContact O-CG2 3.41Å; I36-V40 PolarHBondContact O-N 3.31Å; L37-V40 PolarHBondContact O-N 3.32Å; V40-G44 VanDerWaalsContact O-CA 3.29Å; V40-G44 WeakPolarHBondContact O-CA 3.45Å; V40-G44 PolarHBondContact O-N 2.88Å; V40-M80 HydrophobicContact CG1-CE 3.88Å; V40-M80 HydrophobicContact CG1-SD 3.64Å; V40-I290 HydrophobicContact CG2-CB 4.33Å; V40-I290 HydrophobicContact CG2-CG1 3.72Å; V40-C293 HydrophobicContact CG1-CB 4.16Å |
| 41 | F | 94.3 | Very high | 91.7 | Very high | 58 Ų | 58 | 51 Ų | 51 | 25% | 0.254 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -62.7 | -49.7 | 175.6 | 173.1 | -105.4 | 0 | 0 | 0 | 111.8 | L37 S38 A39 L43 G44 F45 M80 T83 P84 I87 | L37-F41 WeakPolarHBondContact O-CB 3.35Å; L37-F41 PolarHBondContact O-N 2.91Å; S38-F41 PolarHBondContact O-N 3.12Å; A39-F41 VanDerWaalsContact C-N 3.34Å; A39-F41 PolarHBondContact O-N 2.75Å; F41-L43 VanDerWaalsContact C-N 3.27Å; F41-L43 PolarHBondContact O-N 2.99Å; F41-G44 PolarHBondContact O-N 2.82Å; F41-F45 HydrophobicContact CD2-CB 4.05Å; F41-F45 HydrophobicContact CE2-CB 3.88Å; F41-F45 HydrophobicContact CE2-CD2 4.29Å; F41-F45 AromaticContact CE2-CG 3.98Å; F41-F45 HydrophobicContact CE2-CG 3.98Å; F41-F45 HydrophobicContact CZ-CB 4.47Å; F41-F45 HydrophobicContact CZ-CG 4.46Å; F41-F45 VanDerWaalsContact O-CB 3.28Å; F41-F45 WeakPolarHBondContact O-CB 3.37Å; F41-F45 PolarHBondContact O-N 3.46Å; F41-M80 WeakPolarHBondContact CD2-O 3.48Å; F41-T83 HydrophobicContact CB-CG2 4.12Å; F41-P84 HydrophobicContact CD2-CG 3.9Å; F41-P84 HydrophobicContact CE2-CG 3.6Å; F41-P84 HydrophobicContact CZ-CG 4Å; F41-I87 HydrophobicContact CB-CD1 4.32Å |
| 42 | L | 94.1 | Very high | 92.1 | Very high | 120 Ų | 120 | 48.6 Ų | 48.6 | 63% | 0.628 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -62.9 | -31.4 | -178.3 | -72.8 | 174.3 | 0 | 0 | 0 | 113.3 | S38 A39 P46 | S38-L42 WeakPolarHBondContact O-CB 3.2Å; S38-L42 VanDerWaalsContact O-CG 3.29Å; S38-L42 WeakPolarHBondContact O-CG 3.28Å; S38-L42 PolarHBondContact O-N 2.96Å; A39-L42 PolarHBondContact O-N 3.48Å; L42-P46 VanDerWaalsContact O-CD 3.26Å; L42-P46 WeakPolarHBondContact O-CD 3.43Å; L42-P46 WeakPolarHBondContact O-CG 3.33Å |
| 43 | L | 92.3 | Very high | 92.3 | Very high | 106 Ų | 106 | 50.7 Ų | 50.7 | 56% | 0.555 | 27% | 0.269 | S | S | * | . | H | α-helix | trans | -88 | -44.8 | 176.3 | -66.5 | 172.8 | 0 | 0 | 0 | 112 | A39 F41 G47 C293 | A39-L43 WeakPolarHBondContact O-CB 3.35Å; A39-L43 WeakPolarHBondContact O-CG 3.39Å; A39-L43 PolarHBondContact O-N 2.98Å; F41-L43 VanDerWaalsContact C-N 3.27Å; F41-L43 PolarHBondContact O-N 2.99Å; L43-G47 PolarHBondContact O-N 3.27Å; L43-C293 HydrophobicContact CB-CB 4.38Å |
| 44 | G | 93.1 | Very high | 92.2 | Very high | 0 Ų | 0 | 50.3 Ų | 50.3 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -75.6 | -43.3 | -170 | 0 | 0 | 0 | 0 | 0 | 113.5 | V40 F41 N48 C293 | V40-G44 VanDerWaalsContact O-CA 3.29Å; V40-G44 WeakPolarHBondContact O-CA 3.45Å; V40-G44 PolarHBondContact O-N 2.88Å; F41-G44 PolarHBondContact O-N 2.82Å; G44-N48 WeakPolarHBondContact O-CB 3.25Å; G44-N48 PolarHBondContact O-N 3.43Å; G44-N48 PolarHBondContact O-ND2 2.99Å; G44-C293 VanDerWaalsContact CA-CB 3.46Å |
| 45 | F | 94.5 | Very high | 92 | Very high | 81 Ų | 81 | 49.1 Ų | 49.1 | 36% | 0.355 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -63.8 | -57.4 | -178.1 | -173.5 | -102.2 | 0 | 0 | 0 | 112.4 | F41 G47 N48 L49 M80 A81 | F41-F45 HydrophobicContact CD2-CB 4.05Å; F41-F45 HydrophobicContact CE2-CB 3.88Å; F41-F45 HydrophobicContact CE2-CD2 4.29Å; F41-F45 AromaticContact CE2-CG 3.98Å; F41-F45 HydrophobicContact CE2-CG 3.98Å; F41-F45 HydrophobicContact CZ-CB 4.47Å; F41-F45 HydrophobicContact CZ-CG 4.46Å; F41-F45 VanDerWaalsContact O-CB 3.28Å; F41-F45 WeakPolarHBondContact O-CB 3.37Å; F41-F45 PolarHBondContact O-N 3.46Å; F45-G47 VanDerWaalsContact C-N 3.3Å; F45-G47 PolarHBondContact O-N 2.89Å; F45-N48 PolarHBondContact O-N 2.96Å; F45-L49 WeakPolarHBondContact O-CB 3.31Å; F45-L49 PolarHBondContact O-N 3.24Å; F45-M80 HydrophobicContact CB-CB 4.1Å; F45-M80 HydrophobicContact CD2-CB 4.22Å; F45-A81 HydrophobicContact CD2-CB 4.46Å; F45-A81 HydrophobicContact CE2-CB 4.05Å |
| 46 | P | 94.6 | Very high | 91.8 | Very high | 68 Ų | 68 | 48.7 Ų | 48.7 | 44% | 0.442 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -66.2 | -33.3 | 177.4 | 26.8 | -34.2 | 0 | 0 | 0 | 112.2 | L42 F50 | L42-P46 VanDerWaalsContact O-CD 3.26Å; L42-P46 WeakPolarHBondContact O-CD 3.43Å; L42-P46 WeakPolarHBondContact O-CG 3.33Å; P46-F50 VanDerWaalsContact O-CB 3.23Å; P46-F50 WeakPolarHBondContact O-CB 3.33Å; P46-F50 PolarHBondContact O-N 3.1Å |
| 47 | G | 92.6 | Very high | 91.3 | Very high | 15 Ų | 15 | 48.9 Ų | 48.9 | 16% | 0.155 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -62.3 | -49.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | L43 F45 F50 V51 | L43-G47 PolarHBondContact O-N 3.27Å; F45-G47 VanDerWaalsContact C-N 3.3Å; F45-G47 PolarHBondContact O-N 2.89Å; G47-F50 PolarHBondContact O-N 3.04Å; G47-V51 WeakPolarHBondContact O-CG2 3.28Å; G47-V51 PolarHBondContact O-N 3.39Å; G47-V51 VanDerWaalsContact O-N 3.09Å |
| 48 | N | 94.4 | Very high | 90.3 | Very high | 0 Ų | 0 | 53.4 Ų | 53.4 | 0% | 0 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -69.5 | -38.2 | 178 | -75.1 | -63.3 | 0 | 0 | 0 | 111.7 | G44 F45 F50 V51 I52 S292 | G44-N48 WeakPolarHBondContact O-CB 3.25Å; G44-N48 PolarHBondContact O-N 3.43Å; G44-N48 PolarHBondContact O-ND2 2.99Å; F45-N48 PolarHBondContact O-N 2.96Å; N48-F50 VanDerWaalsContact C-N 3.32Å; N48-F50 PolarHBondContact O-N 3.42Å; N48-V51 PolarHBondContact O-N 2.86Å; N48-I52 WeakPolarHBondContact O-CG1 3.33Å; N48-I52 PolarHBondContact O-N 3.49Å; N48-S292 PolarHBondContact ND2-O 3.09Å |
| 49 | L | 94 | Very high | 89.2 | Confident | 94 Ų | 94 | 52.5 Ų | 52.5 | 49% | 0.492 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -61.3 | -41.4 | 173.9 | -174.9 | 61.3 | 0 | 0 | 0 | 111.9 | F45 V51 I52 W53 | F45-L49 WeakPolarHBondContact O-CB 3.31Å; F45-L49 PolarHBondContact O-N 3.24Å; L49-V51 VanDerWaalsContact C-N 3.35Å; L49-V51 PolarHBondContact O-N 3.17Å; L49-I52 PolarHBondContact O-N 3.4Å; L49-W53 WeakPolarHBondContact O-CB 3.47Å; L49-W53 PolarHBondContact O-N 3.47Å |
| 50 | F | 91.3 | Very high | 87.7 | Confident | 61 Ų | 61 | 60.4 Ų | 60.4 | 27% | 0.268 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -61.9 | -41.2 | 174.6 | 176.1 | -102.4 | 0 | 0 | 0 | 112.1 | P46 G47 N48 W53 S54 L312 F314 M315 | P46-F50 VanDerWaalsContact O-CB 3.23Å; P46-F50 WeakPolarHBondContact O-CB 3.33Å; P46-F50 PolarHBondContact O-N 3.1Å; G47-F50 PolarHBondContact O-N 3.04Å; N48-F50 VanDerWaalsContact C-N 3.32Å; N48-F50 PolarHBondContact O-N 3.42Å; F50-W53 HydrophobicContact CD2-CE3 4.11Å; F50-W53 HydrophobicContact CD2-CZ3 4.38Å; F50-W53 HydrophobicContact CE2-CE3 4.13Å; F50-W53 HydrophobicContact CE2-CZ3 4Å; F50-S54 WeakPolarHBondContact O-CB 3.43Å; F50-S54 PolarHBondContact O-N 2.91Å; F50-L312 HydrophobicContact CE2-CB 4.5Å; F50-L312 HydrophobicContact CE2-CD2 3.95Å; F50-L312 HydrophobicContact CZ-CD2 4.11Å; F50-F314 HydrophobicContact CE1-CE1 4.03Å; F50-F314 HydrophobicContact CZ-CE1 4.29Å; F50-M315 HydrophobicContact CE1-CE 4.39Å; F50-M315 HydrophobicContact CE1-CG 4.1Å |
| 51 | V | 90.5 | Very high | 86.3 | Confident | 0 Ų | 0 | 67.2 Ų | 67.2 | 0% | 0 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -62.2 | -47.5 | 175.7 | 172.7 | 0 | 0 | 0 | 0 | 110.7 | G47 N48 L49 S54 I55 I69 A73 P296 Y299 M315 | G47-V51 WeakPolarHBondContact O-CG2 3.28Å; G47-V51 PolarHBondContact O-N 3.39Å; G47-V51 VanDerWaalsContact O-N 3.09Å; N48-V51 PolarHBondContact O-N 2.86Å; L49-V51 VanDerWaalsContact C-N 3.35Å; L49-V51 PolarHBondContact O-N 3.17Å; V51-S54 PolarHBondContact O-N 3.3Å; V51-I55 HydrophobicContact CG1-CD1 3.82Å; V51-I55 WeakPolarHBondContact O-CB 3.36Å; V51-I55 VanDerWaalsContact O-CG1 3.3Å; V51-I55 WeakPolarHBondContact O-CG1 3.3Å; V51-I55 PolarHBondContact O-N 3.28Å; V51-I69 HydrophobicContact CG1-CG2 4.11Å; V51-A73 HydrophobicContact CB-CB 4.08Å; V51-A73 HydrophobicContact CG1-CB 3.67Å; V51-P296 HydrophobicContact CG2-CB 4.49Å; V51-Y299 HydrophobicContact CG2-CD2 3.92Å; V51-Y299 HydrophobicContact CG2-CE2 4.39Å; V51-M315 HydrophobicContact CG2-CE 4.38Å |
| 52 | I | 91.9 | Very high | 85.1 | Confident | 35 Ų | 35 | 69.2 Ų | 69.2 | 18% | 0.179 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -58.3 | -53.3 | 177.1 | -66.6 | 166.2 | 0 | 0 | 0 | 110.1 | N48 L49 S54 I55 L56 L70 A73 I74 | N48-I52 WeakPolarHBondContact O-CG1 3.33Å; N48-I52 PolarHBondContact O-N 3.49Å; L49-I52 PolarHBondContact O-N 3.4Å; I52-S54 PolarHBondContact O-N 3.01Å; I52-I55 PolarHBondContact O-N 3.14Å; I52-L56 HydrophobicContact CG2-CD1 3.71Å; I52-L56 HydrophobicContact CG2-CG 4.37Å; I52-L56 WeakPolarHBondContact O-CB 3.39Å; I52-L56 WeakPolarHBondContact O-CG 3.46Å; I52-L56 PolarHBondContact O-N 3.22Å; I52-L70 HydrophobicContact CB-CD1 4.27Å; I52-L70 HydrophobicContact CG1-CD1 4.18Å; I52-L70 HydrophobicContact CG2-CD1 4.09Å; I52-A73 HydrophobicContact CD1-CB 4.47Å; I52-A73 HydrophobicContact CG1-CB 3.81Å; I52-I74 HydrophobicContact CD1-CG1 4.03Å; I52-I74 HydrophobicContact CG1-CG1 4.23Å |
| 53 | W | 90.7 | Very high | 84.4 | Confident | 119 Ų | 119 | 64.6 Ų | 64.6 | 45% | 0.451 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -60.6 | -46.6 | -179.4 | 175.2 | 78.4 | 0 | 0 | 0 | 112.4 | L49 F50 I55 L56 A57 L312 | L49-W53 WeakPolarHBondContact O-CB 3.47Å; L49-W53 PolarHBondContact O-N 3.47Å; F50-W53 HydrophobicContact CD2-CE3 4.11Å; F50-W53 HydrophobicContact CD2-CZ3 4.38Å; F50-W53 HydrophobicContact CE2-CE3 4.13Å; F50-W53 HydrophobicContact CE2-CZ3 4Å; W53-I55 VanDerWaalsContact C-N 3.31Å; W53-I55 PolarHBondContact O-N 3.14Å; W53-L56 PolarHBondContact O-N 3.36Å; W53-A57 WeakPolarHBondContact O-CB 3.45Å; W53-A57 PolarHBondContact O-N 2.89Å; W53-L312 HydrophobicContact CH2-CD1 4.16Å; W53-L312 HydrophobicContact CZ3-CB 4.34Å; W53-L312 HydrophobicContact CZ3-CD1 4.25Å |
| 54 | S | 85.3 | Confident | 83.9 | Confident | 0 Ų | 0 | 60.5 Ų | 60.5 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -61.9 | -39.8 | -179.3 | -172.7 | 0 | 0 | 0 | 0 | 111.6 | F50 V51 I52 R58 L312 | F50-S54 WeakPolarHBondContact O-CB 3.43Å; F50-S54 PolarHBondContact O-N 2.91Å; V51-S54 PolarHBondContact O-N 3.3Å; I52-S54 PolarHBondContact O-N 3.01Å; S54-R58 WeakPolarHBondContact O-CB 3.19Å; S54-R58 PolarHBondContact O-N 3.38Å; S54-R58 VanDerWaalsContact O-N 3.14Å; S54-L312 PolarHBondContact OG-O 3.07Å |
| 55 | I | 84.7 | Confident | 83.4 | Confident | 2 Ų | 2 | 60.8 Ų | 60.8 | 1% | 0.01 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -68.7 | -49.5 | 176.4 | -69.7 | 171.7 | 0 | 0 | 0 | 111 | V51 I52 W53 A59 T66 I69 L70 | V51-I55 HydrophobicContact CG1-CD1 3.82Å; V51-I55 WeakPolarHBondContact O-CB 3.36Å; V51-I55 VanDerWaalsContact O-CG1 3.3Å; V51-I55 WeakPolarHBondContact O-CG1 3.3Å; V51-I55 PolarHBondContact O-N 3.28Å; I52-I55 PolarHBondContact O-N 3.14Å; W53-I55 VanDerWaalsContact C-N 3.31Å; W53-I55 PolarHBondContact O-N 3.14Å; I55-A59 HydrophobicContact CG2-CB 4.45Å; I55-A59 WeakPolarHBondContact O-CB 3.16Å; I55-A59 PolarHBondContact O-N 2.9Å; I55-A59 VanDerWaalsContact O-N 3.12Å; I55-T66 HydrophobicContact CB-CG2 4.29Å; I55-T66 HydrophobicContact CD1-CG2 4.25Å; I55-T66 HydrophobicContact CG1-CG2 4.05Å; I55-T66 HydrophobicContact CG2-CG2 3.38Å; I55-I69 HydrophobicContact CD1-CB 4.48Å; I55-I69 HydrophobicContact CD1-CG2 3.97Å; I55-L70 HydrophobicContact CB-CD1 4.38Å; I55-L70 HydrophobicContact CD1-CB 4.2Å; I55-L70 HydrophobicContact CG2-CB 4.22Å; I55-L70 HydrophobicContact CG2-CD1 4.24Å; I55-L70 HydrophobicContact CG2-CD2 4.24Å; I55-L70 HydrophobicContact CG2-CG 4.47Å |
| 56 | L | 85.8 | Confident | 82.9 | Confident | 108 Ų | 108 | 57 Ų | 57 | 57% | 0.565 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -67.8 | -40.3 | -176.2 | -69.2 | 178.1 | 0 | 0 | 0 | 112.8 | I52 W53 L70 | I52-L56 HydrophobicContact CG2-CD1 3.71Å; I52-L56 HydrophobicContact CG2-CG 4.37Å; I52-L56 WeakPolarHBondContact O-CB 3.39Å; I52-L56 WeakPolarHBondContact O-CG 3.46Å; I52-L56 PolarHBondContact O-N 3.22Å; W53-L56 PolarHBondContact O-N 3.36Å; L56-L70 HydrophobicContact CD2-CD1 4.48Å; L56-L70 HydrophobicContact CD2-CD2 3.9Å; L56-L70 HydrophobicContact CG-CD1 4.32Å |
| 57 | A | 81.1 | Confident | 82.6 | Confident | 64 Ų | 64 | 54.7 Ų | 54.7 | 53% | 0.529 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -84 | -28.6 | -175.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | W53 | W53-A57 WeakPolarHBondContact O-CB 3.45Å; W53-A57 PolarHBondContact O-N 2.89Å |
| 58 | R | 72.1 | Confident | 82.5 | Confident | 100 Ų | 100 | 54.2 Ų | 54.2 | 38% | 0.377 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -125 | -9 | -167.2 | -55.7 | -174.8 | 174.7 | -140.7 | -3 | 115.2 | S54 R60 A313 A316 | S54-R58 WeakPolarHBondContact O-CB 3.19Å; S54-R58 PolarHBondContact O-N 3.38Å; S54-R58 VanDerWaalsContact O-N 3.14Å; R58-R60 PolarHBondContact O-N 3.16Å; R58-R60 VanDerWaalsContact O-N 3.14Å; R58-A313 HydrophobicContact CB-CB 4.4Å; R58-A316 HydrophobicContact CB-CB 4.27Å |
| 59 | A | 69.9 | Low | 82.2 | Confident | 19 Ų | 19 | 54.4 Ų | 54.4 | 16% | 0.157 | 26% | 0.258 | C | S | . | . | trans | -76.9 | 102 | 174.5 | 0 | 0 | 0 | 0 | 0 | 110.7 | I55 K61 T66 A316 | I55-A59 HydrophobicContact CG2-CB 4.45Å; I55-A59 WeakPolarHBondContact O-CB 3.16Å; I55-A59 PolarHBondContact O-N 2.9Å; I55-A59 VanDerWaalsContact O-N 3.12Å; A59-K61 PolarHBondContact O-N 3.37Å; A59-T66 HydrophobicContact CB-CG2 4.23Å; A59-A316 HydrophobicContact CB-CB 4.17Å | ||
| 60 | R | 60.6 | Low | 82.1 | Confident | 213 Ų | 213 | 50.6 Ų | 50.6 | 80% | 0.804 | 24% | 0.238 | S | C | * | . | S | Bend | trans | -61 | -31.6 | 176 | -76.7 | -171.2 | -178.3 | 170.1 | 1.8 | 113 | R58 | R58-R60 PolarHBondContact O-N 3.16Å; R58-R60 VanDerWaalsContact O-N 3.14Å |
| 61 | K | 64.8 | Low | 82.3 | Confident | 149 Ų | 149 | 48.7 Ų | 48.7 | 65% | 0.648 | 23% | 0.231 | S | C | * | . | S | Bend | trans | -131.4 | 124.2 | 173.2 | -65.1 | -173.5 | 179.3 | -174.7 | 0 | 110.2 | A59 S63 | A59-K61 PolarHBondContact O-N 3.37Å; K61-S63 VanDerWaalsContact C-N 3.32Å; K61-S63 PolarHBondContact O-N 3Å |
| 62 | Q | 69.2 | Low | 82.4 | Confident | 100 Ų | 100 | 48.7 Ų | 48.7 | 47% | 0.467 | 23% | 0.231 | S | C | . | . | trans | -73.8 | 87.5 | 172.3 | -70.7 | -178.5 | -24.2 | 0 | 0 | 109.6 | ||||
| 63 | S | 78.3 | Confident | 82.6 | Confident | 22 Ų | 22 | 47.1 Ų | 47.1 | 15% | 0.154 | 22% | 0.223 | C | C | . | . | trans | -68 | 161.1 | 169.5 | 85.1 | 0 | 0 | 0 | 0 | 110.7 | K61 T65 T66 L67 | K61-S63 VanDerWaalsContact C-N 3.32Å; K61-S63 PolarHBondContact O-N 3Å; S63-T65 VanDerWaalsContact C-N 3.35Å; S63-T65 PolarHBondContact O-N 2.96Å; S63-T66 WeakPolarHBondContact O-CB 3.46Å; S63-T66 PolarHBondContact O-N 2.96Å; S63-T66 VanDerWaalsContact O-N 3.13Å; S63-T66 PolarHBondContact OG-N 2.95Å; S63-T66 PolarHBondContact OG-OG1 3.4Å; S63-L67 PolarHBondContact O-N 2.98Å | ||
| 64 | V | 82.8 | Confident | 82.8 | Confident | 21 Ų | 21 | 44.6 Ų | 44.6 | 13% | 0.127 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -60.7 | -45 | 179.9 | -174.4 | 0 | 0 | 0 | 0 | 111.3 | T66 L67 L68 Y126 T141 I146 | V64-T66 VanDerWaalsContact C-N 3.31Å; V64-T66 PolarHBondContact O-N 3.3Å; V64-L67 PolarHBondContact O-N 3.47Å; V64-L68 HydrophobicContact CG1-CD1 4.36Å; V64-L68 WeakPolarHBondContact O-CG 3.29Å; V64-L68 PolarHBondContact O-N 3.48Å; V64-Y126 HydrophobicContact CB-CD2 4.28Å; V64-Y126 HydrophobicContact CB-CE1 4.25Å; V64-Y126 HydrophobicContact CB-CE2 3.8Å; V64-Y126 HydrophobicContact CG1-CD2 3.84Å; V64-Y126 HydrophobicContact CG1-CE2 3.88Å; V64-Y126 HydrophobicContact CG1-CG 4.17Å; V64-Y126 HydrophobicContact CG2-CE2 4.1Å; V64-T141 HydrophobicContact CB-CG2 4.11Å; V64-T141 HydrophobicContact CG1-CG2 3.69Å; V64-T141 HydrophobicContact CG2-CG2 3.6Å; V64-I146 HydrophobicContact CB-CD1 3.88Å; V64-I146 HydrophobicContact CG1-CD1 3.63Å; V64-I146 HydrophobicContact CG1-CG1 4.01Å; V64-I146 HydrophobicContact CG1-CG2 4.24Å; V64-I146 HydrophobicContact CG2-CD1 3.24Å; V64-I146 HydrophobicContact CG2-CG1 4.38Å |
| 65 | T | 81.7 | Confident | 83.3 | Confident | 5 Ų | 5 | 44.8 Ų | 44.8 | 3% | 0.031 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -56.1 | -46.8 | 173.7 | -45.5 | 0 | 0 | 0 | 0 | 111.2 | S63 L67 L68 I69 Y126 F319 T322 | S63-T65 VanDerWaalsContact C-N 3.35Å; S63-T65 PolarHBondContact O-N 2.96Å; T65-L67 VanDerWaalsContact C-N 3.31Å; T65-L67 PolarHBondContact O-N 3.32Å; T65-L68 PolarHBondContact O-N 3.38Å; T65-I69 HydrophobicContact CG2-CD1 3.87Å; T65-I69 VanDerWaalsContact O-CG1 3.31Å; T65-I69 WeakPolarHBondContact O-CG1 3.43Å; T65-I69 PolarHBondContact O-N 3.49Å; T65-Y126 WeakPolarHBondContact OG1-CE1 3.45Å; T65-F319 HydrophobicContact CG2-CD1 4.33Å; T65-T322 PolarHBondContact OG1-OG1 3.28Å |
| 66 | T | 83.8 | Confident | 83.8 | Confident | 1 Ų | 1 | 44.7 Ų | 44.7 | 1% | 0.006 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -63.4 | -38.9 | -178.7 | -53.5 | 0 | 0 | 0 | 0 | 111.3 | I55 A59 S63 V64 L70 | I55-T66 HydrophobicContact CB-CG2 4.29Å; I55-T66 HydrophobicContact CD1-CG2 4.25Å; I55-T66 HydrophobicContact CG1-CG2 4.05Å; I55-T66 HydrophobicContact CG2-CG2 3.38Å; A59-T66 HydrophobicContact CB-CG2 4.23Å; S63-T66 WeakPolarHBondContact O-CB 3.46Å; S63-T66 PolarHBondContact O-N 2.96Å; S63-T66 VanDerWaalsContact O-N 3.13Å; S63-T66 PolarHBondContact OG-N 2.95Å; S63-T66 PolarHBondContact OG-OG1 3.4Å; V64-T66 VanDerWaalsContact C-N 3.31Å; V64-T66 PolarHBondContact O-N 3.3Å; T66-L70 VanDerWaalsContact O-CB 3.3Å; T66-L70 WeakPolarHBondContact O-CB 3.44Å; T66-L70 PolarHBondContact O-N 2.88Å |
| 67 | L | 88.5 | Confident | 84.2 | Confident | 21 Ų | 21 | 40 Ų | 40 | 11% | 0.11 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -68.6 | -41 | 177.1 | -172.3 | 68.8 | 0 | 0 | 0 | 112.4 | S63 V64 T65 L70 N71 I146 M147 L150 | S63-L67 PolarHBondContact O-N 2.98Å; V64-L67 PolarHBondContact O-N 3.47Å; T65-L67 VanDerWaalsContact C-N 3.31Å; T65-L67 PolarHBondContact O-N 3.32Å; L67-L70 PolarHBondContact O-N 2.94Å; L67-N71 PolarHBondContact O-N 3.5Å; L67-N71 PolarHBondContact O-ND2 3.37Å; L67-I146 HydrophobicContact CD2-CG2 3.79Å; L67-M147 HydrophobicContact CD2-SD 3.86Å; L67-L150 HydrophobicContact CD2-CD1 3.62Å; L67-L150 HydrophobicContact CG-CD1 3.86Å |
| 68 | L | 90.6 | Very high | 84.8 | Confident | 5 Ų | 5 | 40.1 Ų | 40.1 | 3% | 0.026 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -64.4 | -43.1 | 176.3 | -68.2 | 175.7 | 0 | 0 | 0 | 111.5 | V64 T65 L70 N71 L72 L119 L122 M123 L150 | V64-L68 HydrophobicContact CG1-CD1 4.36Å; V64-L68 WeakPolarHBondContact O-CG 3.29Å; V64-L68 PolarHBondContact O-N 3.48Å; T65-L68 PolarHBondContact O-N 3.38Å; L68-L70 VanDerWaalsContact C-N 3.35Å; L68-N71 PolarHBondContact O-N 3.38Å; L68-L72 PolarHBondContact O-N 3.09Å; L68-L119 HydrophobicContact CD2-CD2 4.13Å; L68-L122 HydrophobicContact CD1-CB 4.49Å; L68-L122 HydrophobicContact CD2-CB 4.16Å; L68-L122 HydrophobicContact CD2-CD2 4.18Å; L68-M123 HydrophobicContact CB-CG 3.64Å; L68-M123 HydrophobicContact CB-SD 4.29Å; L68-M123 HydrophobicContact CD1-CB 4.33Å; L68-M123 HydrophobicContact CD1-CG 3.61Å; L68-M123 HydrophobicContact CG-CG 4.23Å; L68-L150 HydrophobicContact CD2-CD2 3.99Å |
| 69 | I | 89.8 | Confident | 85.9 | Confident | 4 Ų | 4 | 35.6 Ų | 35.6 | 2% | 0.021 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -67.2 | -37.5 | 177 | -68.1 | 173.7 | 0 | 0 | 0 | 111.3 | V51 I55 T65 L72 A73 M123 Y299 F319 | V51-I69 HydrophobicContact CG1-CG2 4.11Å; I55-I69 HydrophobicContact CD1-CB 4.48Å; I55-I69 HydrophobicContact CD1-CG2 3.97Å; T65-I69 HydrophobicContact CG2-CD1 3.87Å; T65-I69 VanDerWaalsContact O-CG1 3.31Å; T65-I69 WeakPolarHBondContact O-CG1 3.43Å; T65-I69 PolarHBondContact O-N 3.49Å; I69-L72 PolarHBondContact O-N 2.7Å; I69-A73 WeakPolarHBondContact O-CB 3.28Å; I69-A73 PolarHBondContact O-N 2.95Å; I69-M123 HydrophobicContact CG1-SD 3.84Å; I69-Y299 HydrophobicContact CG2-CE2 4.06Å; I69-F319 HydrophobicContact CD1-CD1 3.24Å; I69-F319 HydrophobicContact CD1-CD2 3.93Å; I69-F319 HydrophobicContact CD1-CE1 3.18Å; I69-F319 HydrophobicContact CD1-CE2 3.89Å; I69-F319 HydrophobicContact CD1-CG 3.64Å; I69-F319 HydrophobicContact CD1-CZ 3.53Å; I69-F319 HydrophobicContact CG2-CE2 4.13Å; I69-F319 HydrophobicContact CG2-CZ 4.39Å |
| 70 | L | 91.5 | Very high | 87 | Confident | 13 Ų | 13 | 34.7 Ų | 34.7 | 7% | 0.068 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -61 | -46.6 | 173.6 | 178.9 | 63.9 | 0 | 0 | 0 | 111.4 | I52 I55 L56 T66 L67 L68 L72 A73 I74 | I52-L70 HydrophobicContact CB-CD1 4.27Å; I52-L70 HydrophobicContact CG1-CD1 4.18Å; I52-L70 HydrophobicContact CG2-CD1 4.09Å; I55-L70 HydrophobicContact CB-CD1 4.38Å; I55-L70 HydrophobicContact CD1-CB 4.2Å; I55-L70 HydrophobicContact CG2-CB 4.22Å; I55-L70 HydrophobicContact CG2-CD1 4.24Å; I55-L70 HydrophobicContact CG2-CD2 4.24Å; I55-L70 HydrophobicContact CG2-CG 4.47Å; L56-L70 HydrophobicContact CD2-CD1 4.48Å; L56-L70 HydrophobicContact CD2-CD2 3.9Å; L56-L70 HydrophobicContact CG-CD1 4.32Å; T66-L70 VanDerWaalsContact O-CB 3.3Å; T66-L70 WeakPolarHBondContact O-CB 3.44Å; T66-L70 PolarHBondContact O-N 2.88Å; L67-L70 PolarHBondContact O-N 2.94Å; L68-L70 VanDerWaalsContact C-N 3.35Å; L70-L72 VanDerWaalsContact C-N 3.29Å; L70-L72 PolarHBondContact O-N 2.87Å; L70-A73 PolarHBondContact O-N 3.5Å; L70-I74 HydrophobicContact CD1-CD1 4.3Å; L70-I74 HydrophobicContact CG-CD1 4.04Å; L70-I74 VanDerWaalsContact O-CG1 3.28Å; L70-I74 WeakPolarHBondContact O-CG1 3.37Å; L70-I74 PolarHBondContact O-N 2.91Å |
| 71 | N | 94.6 | Very high | 88.6 | Confident | 22 Ų | 22 | 26.7 Ų | 26.7 | 12% | 0.118 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -62.5 | -37.7 | 176.6 | -82.5 | -97.8 | 0 | 0 | 0 | 111.6 | L67 L68 I74 A75 L119 W154 | L67-N71 PolarHBondContact O-N 3.5Å; L67-N71 PolarHBondContact O-ND2 3.37Å; L68-N71 PolarHBondContact O-N 3.38Å; N71-I74 PolarHBondContact O-N 3.03Å; N71-A75 PolarHBondContact O-N 3.44Å; N71-L119 HydrophobicContact CB-CD1 3.93Å; N71-L119 HydrophobicContact CB-CD2 3.76Å; N71-W154 PolarHBondContact OD1-NE1 2.89Å |
| 72 | L | 93.8 | Very high | 89.9 | Confident | 0 Ų | 0 | 20.9 Ų | 20.9 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -65.6 | -44.2 | 176.6 | -178.6 | 62.3 | 0 | 0 | 0 | 111.3 | L68 I69 L70 I74 A75 D76 S116 L119 I120 M123 | L68-L72 PolarHBondContact O-N 3.09Å; I69-L72 PolarHBondContact O-N 2.7Å; L70-L72 VanDerWaalsContact C-N 3.29Å; L70-L72 PolarHBondContact O-N 2.87Å; L72-I74 VanDerWaalsContact C-N 3.29Å; L72-I74 PolarHBondContact O-N 3.43Å; L72-A75 PolarHBondContact O-N 3.33Å; L72-D76 WeakPolarHBondContact O-CB 3.37Å; L72-D76 PolarHBondContact O-N 3.42Å; L72-S116 WeakPolarHBondContact CD1-OG 3.42Å; L72-L119 HydrophobicContact CB-CD1 4.11Å; L72-L119 HydrophobicContact CD1-CB 4.48Å; L72-L119 HydrophobicContact CD1-CD1 4.37Å; L72-I120 HydrophobicContact CD2-CG1 4.43Å; L72-M123 HydrophobicContact CB-CE 4.43Å; L72-M123 HydrophobicContact CD2-CE 3.54Å |
| 73 | A | 94.5 | Very high | 91 | Very high | 1 Ų | 1 | 16.1 Ų | 16.1 | 1% | 0.008 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -65.1 | -32.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | V51 I52 I69 L70 G77 | V51-A73 HydrophobicContact CB-CB 4.08Å; V51-A73 HydrophobicContact CG1-CB 3.67Å; I52-A73 HydrophobicContact CD1-CB 4.47Å; I52-A73 HydrophobicContact CG1-CB 3.81Å; I69-A73 WeakPolarHBondContact O-CB 3.28Å; I69-A73 PolarHBondContact O-N 2.95Å; L70-A73 PolarHBondContact O-N 3.5Å; A73-G77 WeakPolarHBondContact O-CA 3.19Å; A73-G77 PolarHBondContact O-N 2.87Å |
| 74 | I | 95.3 | Very high | 91.7 | Very high | 67 Ų | 67 | 17.4 Ų | 17.4 | 34% | 0.344 | 11% | 0.11 | S | C | . | . | H | α-helix | trans | -66.9 | -46 | 172.8 | -70.2 | 165.3 | 0 | 0 | 0 | 110.7 | I52 L70 N71 L72 S78 | I52-I74 HydrophobicContact CD1-CG1 4.03Å; I52-I74 HydrophobicContact CG1-CG1 4.23Å; L70-I74 HydrophobicContact CD1-CD1 4.3Å; L70-I74 HydrophobicContact CG-CD1 4.04Å; L70-I74 VanDerWaalsContact O-CG1 3.28Å; L70-I74 WeakPolarHBondContact O-CG1 3.37Å; L70-I74 PolarHBondContact O-N 2.91Å; N71-I74 PolarHBondContact O-N 3.03Å; L72-I74 VanDerWaalsContact C-N 3.29Å; L72-I74 PolarHBondContact O-N 3.43Å; I74-S78 WeakPolarHBondContact O-CB 3.26Å; I74-S78 PolarHBondContact O-N 2.9Å; I74-S78 PolarHBondContact O-OG 3.27Å |
| 75 | A | 95.6 | Very high | 92.1 | Very high | 4 Ų | 4 | 20.2 Ų | 20.2 | 3% | 0.033 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -59.6 | -59.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 110.6 | N71 L72 G77 S78 L79 N112 A115 W154 | N71-A75 PolarHBondContact O-N 3.44Å; L72-A75 PolarHBondContact O-N 3.33Å; A75-G77 VanDerWaalsContact C-N 3.33Å; A75-G77 PolarHBondContact O-N 3.05Å; A75-S78 WeakPolarHBondContact O-CA 3.44Å; A75-S78 WeakPolarHBondContact O-CB 3.3Å; A75-S78 PolarHBondContact O-N 3.01Å; A75-L79 PolarHBondContact O-N 3.08Å; A75-N112 PolarHBondContact O-OD1 3.06Å; A75-A115 HydrophobicContact CB-CB 4.06Å; A75-W154 HydrophobicContact CB-CH2 4.14Å |
| 76 | D | 95.2 | Very high | 92.6 | Very high | 0 Ų | 0 | 20.7 Ų | 20.7 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -60.7 | -42.3 | -178.2 | -73.9 | -32.7 | 0 | 0 | 0 | 111.7 | L72 S78 L79 M80 N112 S116 S292 N295 | L72-D76 WeakPolarHBondContact O-CB 3.37Å; L72-D76 PolarHBondContact O-N 3.42Å; D76-S78 VanDerWaalsContact C-N 3.29Å; D76-S78 PolarHBondContact O-N 2.92Å; D76-L79 PolarHBondContact O-N 2.86Å; D76-M80 VanDerWaalsContact O-CG 3.26Å; D76-M80 WeakPolarHBondContact O-CG 3.27Å; D76-M80 PolarHBondContact O-N 3.44Å; D76-N112 PolarHBondContact N-OD1 3.43Å; D76-S116 PolarHBondContact OD1-OG 2.79Å; D76-S292 WeakPolarHBondContact OD1-CB 3.22Å; D76-S292 PolarHBondContact OD1-OG 3.46Å; D76-N295 PolarHBondContact OD2-ND2 3.48Å |
| 77 | G | 94.1 | Very high | 92.9 | Very high | 10 Ų | 10 | 22.1 Ų | 22.1 | 10% | 0.103 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -61 | -37.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | A73 A75 M80 A81 | A73-G77 WeakPolarHBondContact O-CA 3.19Å; A73-G77 PolarHBondContact O-N 2.87Å; A75-G77 VanDerWaalsContact C-N 3.33Å; A75-G77 PolarHBondContact O-N 3.05Å; G77-M80 PolarHBondContact O-N 3.4Å; G77-A81 PolarHBondContact O-N 3.1Å |
| 78 | S | 94.2 | Very high | 93 | Very high | 65 Ų | 65 | 22.6 Ų | 22.6 | 46% | 0.455 | 14% | 0.136 | S | C | . | . | H | α-helix | trans | -64.3 | -46.4 | 173.9 | -57.4 | 0 | 0 | 0 | 0 | 110.6 | I74 A75 D76 M80 A81 L82 | I74-S78 WeakPolarHBondContact O-CB 3.26Å; I74-S78 PolarHBondContact O-N 2.9Å; I74-S78 PolarHBondContact O-OG 3.27Å; A75-S78 WeakPolarHBondContact O-CA 3.44Å; A75-S78 WeakPolarHBondContact O-CB 3.3Å; A75-S78 PolarHBondContact O-N 3.01Å; D76-S78 VanDerWaalsContact C-N 3.29Å; D76-S78 PolarHBondContact O-N 2.92Å; S78-M80 VanDerWaalsContact C-N 3.31Å; S78-M80 PolarHBondContact O-N 3.14Å; S78-A81 WeakPolarHBondContact O-CB 3.41Å; S78-A81 PolarHBondContact O-N 2.96Å; S78-A81 VanDerWaalsContact O-N 3.15Å; S78-L82 WeakPolarHBondContact O-CG 3.41Å; S78-L82 PolarHBondContact O-N 3.29Å |
| 79 | L | 94.6 | Very high | 92.9 | Very high | 5 Ų | 5 | 24.4 Ų | 24.4 | 3% | 0.026 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -60.4 | -40.4 | 174.8 | -178.7 | 66.2 | 0 | 0 | 0 | 112.2 | A75 D76 A81 L82 T83 C109 N112 F289 | A75-L79 PolarHBondContact O-N 3.08Å; D76-L79 PolarHBondContact O-N 2.86Å; L79-A81 VanDerWaalsContact C-N 3.3Å; L79-A81 PolarHBondContact O-N 2.97Å; L79-L82 WeakPolarHBondContact O-CB 3.18Å; L79-L82 PolarHBondContact O-N 3.23Å; L79-T83 PolarHBondContact O-N 3.46Å; L79-T83 VanDerWaalsContact O-N 3.09Å; L79-T83 PolarHBondContact O-OG1 3.37Å; L79-C109 HydrophobicContact CD1-CB 4.19Å; L79-C109 WeakPolarHBondContact CD1-SG 3.29Å; L79-N112 HydrophobicContact CB-CB 4.15Å; L79-N112 VanDerWaalsContact CD2-ND2 3.32Å; L79-N112 WeakPolarHBondContact CD2-ND2 3.4Å; L79-F289 HydrophobicContact CD1-CD1 4.45Å; L79-F289 HydrophobicContact CD1-CE1 3.75Å; L79-F289 HydrophobicContact CD1-CZ 3.94Å; L79-F289 HydrophobicContact CD2-CD1 4.16Å; L79-F289 HydrophobicContact CD2-CE1 4.25Å; L79-F289 HydrophobicContact CD2-CG 4.47Å; L79-F289 HydrophobicContact CG-CD1 4.29Å; L79-F289 HydrophobicContact CG-CE1 4.05Å |
| 80 | M | 94.3 | Very high | 92.7 | Very high | 0 Ų | 0 | 25.9 Ų | 25.9 | 0% | 0 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -62.8 | -38 | 176.4 | -65.4 | -59.4 | 91.4 | 0 | 0 | 111.6 | V40 F41 F45 D76 G77 S78 L82 T83 P84 F289 | V40-M80 HydrophobicContact CG1-CE 3.88Å; V40-M80 HydrophobicContact CG1-SD 3.64Å; F41-M80 WeakPolarHBondContact CD2-O 3.48Å; F45-M80 HydrophobicContact CB-CB 4.1Å; F45-M80 HydrophobicContact CD2-CB 4.22Å; D76-M80 VanDerWaalsContact O-CG 3.26Å; D76-M80 WeakPolarHBondContact O-CG 3.27Å; D76-M80 PolarHBondContact O-N 3.44Å; G77-M80 PolarHBondContact O-N 3.4Å; S78-M80 VanDerWaalsContact C-N 3.31Å; S78-M80 PolarHBondContact O-N 3.14Å; M80-L82 PolarHBondContact O-N 3.43Å; M80-T83 WeakPolarHBondContact O-CB 3.29Å; M80-T83 PolarHBondContact O-N 2.82Å; M80-T83 VanDerWaalsContact O-N 3.16Å; M80-T83 PolarHBondContact O-OG1 3.25Å; M80-P84 WeakPolarHBondContact O-CD 3.38Å; M80-F289 HydrophobicContact CE-CD1 4.44Å |
| 81 | A | 93.3 | Very high | 92.4 | Very high | 45 Ų | 45 | 28.5 Ų | 28.5 | 37% | 0.372 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -63.8 | -26.1 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | F45 G77 S78 L79 P84 | F45-A81 HydrophobicContact CD2-CB 4.46Å; F45-A81 HydrophobicContact CE2-CB 4.05Å; G77-A81 PolarHBondContact O-N 3.1Å; S78-A81 WeakPolarHBondContact O-CB 3.41Å; S78-A81 PolarHBondContact O-N 2.96Å; S78-A81 VanDerWaalsContact O-N 3.15Å; L79-A81 VanDerWaalsContact C-N 3.3Å; L79-A81 PolarHBondContact O-N 2.97Å; A81-P84 WeakPolarHBondContact O-CD 3.23Å |
| 82 | L | 93.1 | Very high | 91.9 | Very high | 27 Ų | 27 | 33 Ų | 33 | 14% | 0.141 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -83.8 | -20.7 | 175.8 | -56.5 | -176.8 | 0 | 0 | 0 | 113.4 | S78 L79 M80 P84 F85 F86 L105 L108 | S78-L82 WeakPolarHBondContact O-CG 3.41Å; S78-L82 PolarHBondContact O-N 3.29Å; L79-L82 WeakPolarHBondContact O-CB 3.18Å; L79-L82 PolarHBondContact O-N 3.23Å; M80-L82 PolarHBondContact O-N 3.43Å; L82-P84 VanDerWaalsContact C-N 3.34Å; L82-F85 WeakPolarHBondContact O-CB 3.48Å; L82-F85 WeakPolarHBondContact O-CD2 3.39Å; L82-F85 PolarHBondContact O-N 3.25Å; L82-F85 VanDerWaalsContact O-N 3.08Å; L82-F86 HydrophobicContact CB-CE2 4.31Å; L82-F86 WeakPolarHBondContact O-CD2 3.39Å; L82-L105 HydrophobicContact CB-CD2 3.91Å; L82-L105 HydrophobicContact CD1-CD2 4.05Å; L82-L105 HydrophobicContact CD2-CD2 3.68Å; L82-L105 HydrophobicContact CG-CD2 4.05Å; L82-L108 HydrophobicContact CD1-CB 3.46Å; L82-L108 VanDerWaalsContact CD1-CB 3.46Å; L82-L108 HydrophobicContact CD1-CD1 3.75Å; L82-L108 HydrophobicContact CD1-CG 4.26Å; L82-L108 HydrophobicContact CD2-CD1 4.3Å |
| 83 | T | 92.1 | Very high | 91.3 | Very high | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -55.6 | -37.2 | -175.4 | -58.5 | 0 | 0 | 0 | 0 | 114.2 | L37 F41 L79 M80 F85 F86 I87 | L37-T83 HydrophobicContact CB-CG2 4.1Å; L37-T83 HydrophobicContact CD2-CG2 4.3Å; F41-T83 HydrophobicContact CB-CG2 4.12Å; L79-T83 PolarHBondContact O-N 3.46Å; L79-T83 VanDerWaalsContact O-N 3.09Å; L79-T83 PolarHBondContact O-OG1 3.37Å; M80-T83 WeakPolarHBondContact O-CB 3.29Å; M80-T83 PolarHBondContact O-N 2.82Å; M80-T83 VanDerWaalsContact O-N 3.16Å; M80-T83 PolarHBondContact O-OG1 3.25Å; T83-F85 PolarHBondContact O-N 3.25Å; T83-F86 WeakPolarHBondContact O-CB 3.38Å; T83-F86 PolarHBondContact O-N 2.96Å; T83-I87 HydrophobicContact CG2-CD1 4.13Å; T83-I87 HydrophobicContact CG2-CG1 4.34Å; T83-I87 WeakPolarHBondContact O-CG1 3.5Å; T83-I87 PolarHBondContact O-N 2.66Å |
| 84 | P | 92.8 | Very high | 90.8 | Very high | 50 Ų | 50 | 36.5 Ų | 36.5 | 33% | 0.325 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -55.4 | -33.8 | 174.7 | -28.6 | 36.9 | 0 | 0 | 0 | 114.8 | F41 M80 A81 L82 F86 I87 A88 | F41-P84 HydrophobicContact CD2-CG 3.9Å; F41-P84 HydrophobicContact CE2-CG 3.6Å; F41-P84 HydrophobicContact CZ-CG 4Å; M80-P84 WeakPolarHBondContact O-CD 3.38Å; A81-P84 WeakPolarHBondContact O-CD 3.23Å; L82-P84 VanDerWaalsContact C-N 3.34Å; P84-F86 VanDerWaalsContact C-N 3.35Å; P84-I87 PolarHBondContact O-N 3.49Å; P84-A88 PolarHBondContact O-N 3.37Å |
| 85 | F | 92 | Very high | 90.4 | Very high | 80 Ų | 80 | 33.5 Ų | 33.5 | 35% | 0.351 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -67.4 | -37.1 | 176.4 | -62.1 | -79.3 | 0 | 0 | 0 | 111.6 | L82 T83 A88 Y89 M97 L105 | L82-F85 WeakPolarHBondContact O-CB 3.48Å; L82-F85 WeakPolarHBondContact O-CD2 3.39Å; L82-F85 PolarHBondContact O-N 3.25Å; L82-F85 VanDerWaalsContact O-N 3.08Å; T83-F85 PolarHBondContact O-N 3.25Å; F85-A88 PolarHBondContact O-N 3.4Å; F85-Y89 PolarHBondContact O-N 2.72Å; F85-M97 HydrophobicContact CB-CE 4.27Å; F85-M97 HydrophobicContact CB-SD 4.1Å; F85-M97 HydrophobicContact CD1-CE 4.27Å; F85-M97 HydrophobicContact CD1-SD 3.63Å; F85-M97 HydrophobicContact CG-SD 4.32Å; F85-M97 WeakPolarHBondContact O-CE 3.17Å; F85-L105 HydrophobicContact CB-CD1 3.69Å; F85-L105 HydrophobicContact CB-CD2 4.43Å; F85-L105 HydrophobicContact CD2-CD2 4.02Å; F85-L105 HydrophobicContact CG-CD1 4.07Å; F85-L105 HydrophobicContact CG-CD2 4.37Å |
| 86 | F | 90.5 | Very high | 90 | Very high | 15 Ų | 15 | 40.6 Ų | 40.6 | 7% | 0.066 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -70.2 | -36.4 | 174.4 | -64.9 | -77.9 | 0 | 0 | 0 | 112.3 | L37 L82 T83 P84 Y89 L90 L105 F106 C109 F289 | L37-F86 HydrophobicContact CD1-CB 3.9Å; L82-F86 HydrophobicContact CB-CE2 4.31Å; L82-F86 WeakPolarHBondContact O-CD2 3.39Å; T83-F86 WeakPolarHBondContact O-CB 3.38Å; T83-F86 PolarHBondContact O-N 2.96Å; P84-F86 VanDerWaalsContact C-N 3.35Å; F86-Y89 PolarHBondContact O-N 3.04Å; F86-L90 WeakPolarHBondContact O-CG 3.25Å; F86-L90 PolarHBondContact O-N 2.93Å; F86-L105 HydrophobicContact CZ-CB 4.06Å; F86-F106 HydrophobicContact CD1-CZ 4.47Å; F86-F106 HydrophobicContact CE1-CD2 4.41Å; F86-F106 HydrophobicContact CE1-CE1 4.05Å; F86-F106 AromaticContact CE1-CE2 3.85Å; F86-F106 HydrophobicContact CE1-CE2 3.85Å; F86-F106 AromaticContact CE1-CZ 3.67Å; F86-F106 HydrophobicContact CE1-CZ 3.67Å; F86-C109 VanDerWaalsContact CE2-SG 3.54Å; F86-C109 WeakPolarHBondContact CZ-SG 3.45Å; F86-F289 HydrophobicContact CD2-CE1 4.01Å; F86-F289 HydrophobicContact CD2-CZ 4.05Å; F86-F289 HydrophobicContact CE2-CE1 4.21Å; F86-F289 AromaticContact CE2-CZ 3.96Å; F86-F289 HydrophobicContact CE2-CZ 3.96Å; F86-F289 HydrophobicContact CG-CZ 4.44Å; F86-F289 HydrophobicContact CZ-CZ 4.29Å |
| 87 | I | 90.5 | Very high | 89.6 | Confident | 30 Ų | 30 | 43.7 Ų | 43.7 | 15% | 0.154 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -60.7 | -48 | 172.4 | -67.4 | 169.9 | 0 | 0 | 0 | 110 | T34 L37 F41 T83 P84 Y89 L90 A91 | T34-I87 HydrophobicContact CG2-CG2 4.21Å; L37-I87 HydrophobicContact CB-CD1 4.32Å; L37-I87 HydrophobicContact CB-CG1 3.76Å; F41-I87 HydrophobicContact CB-CD1 4.32Å; T83-I87 HydrophobicContact CG2-CD1 4.13Å; T83-I87 HydrophobicContact CG2-CG1 4.34Å; T83-I87 WeakPolarHBondContact O-CG1 3.5Å; T83-I87 PolarHBondContact O-N 2.66Å; P84-I87 PolarHBondContact O-N 3.49Å; I87-Y89 VanDerWaalsContact C-N 3.34Å; I87-Y89 PolarHBondContact O-N 3.16Å; I87-L90 PolarHBondContact O-N 3.12Å; I87-A91 WeakPolarHBondContact O-CB 3.2Å; I87-A91 PolarHBondContact O-N 3.18Å |
| 88 | A | 90.4 | Very high | 89.4 | Confident | 31 Ų | 31 | 45 Ų | 45 | 26% | 0.256 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -60.9 | -42.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | P84 F85 A91 M92 M97 | P84-A88 PolarHBondContact O-N 3.37Å; F85-A88 PolarHBondContact O-N 3.4Å; A88-A91 PolarHBondContact O-N 2.89Å; A88-M92 WeakPolarHBondContact O-CB 3.34Å; A88-M92 WeakPolarHBondContact O-CG 3.36Å; A88-M92 PolarHBondContact O-N 3.22Å; A88-M97 HydrophobicContact CB-CE 3.87Å |
| 89 | Y | 88.1 | Confident | 89.2 | Confident | 43 Ų | 43 | 44.6 Ų | 44.6 | 17% | 0.169 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -61.1 | -44.5 | 175.3 | 173.3 | -123.5 | 0 | 0 | 0 | 112.6 | F85 F86 I87 M93 W95 | F85-Y89 PolarHBondContact O-N 2.72Å; F86-Y89 PolarHBondContact O-N 3.04Å; I87-Y89 VanDerWaalsContact C-N 3.34Å; I87-Y89 PolarHBondContact O-N 3.16Å; Y89-M93 VanDerWaalsContact O-CA 3.31Å; Y89-M93 WeakPolarHBondContact O-CA 3.3Å; Y89-M93 PolarHBondContact O-N 3.47Å; Y89-W95 HydrophobicContact CD1-CE3 4.31Å; Y89-W95 HydrophobicContact CD1-CZ3 4.5Å; Y89-W95 HydrophobicContact CD2-CB 4.04Å; Y89-W95 HydrophobicContact CD2-CD2 4.44Å; Y89-W95 AromaticContact CD2-CE3 3.55Å; Y89-W95 HydrophobicContact CD2-CE3 3.55Å; Y89-W95 HydrophobicContact CD2-CZ3 4.35Å; Y89-W95 HydrophobicContact CE2-CB 3.83Å; Y89-W95 HydrophobicContact CE2-CE3 4.04Å; Y89-W95 AromaticContact CG-CE3 3.68Å; Y89-W95 HydrophobicContact CG-CE3 3.68Å; Y89-W95 HydrophobicContact CG-CZ3 4.03Å |
| 90 | L | 85.6 | Confident | 89.1 | Confident | 36 Ų | 36 | 49.8 Ų | 49.8 | 19% | 0.188 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -67.3 | -36.6 | 177.5 | -73.4 | 168.7 | 0 | 0 | 0 | 112.6 | T30 T34 L37 F86 I87 | T30-L90 HydrophobicContact CG2-CD2 4.44Å; T34-L90 VanDerWaalsContact OG1-CB 3.28Å; T34-L90 WeakPolarHBondContact OG1-CB 3.38Å; L37-L90 HydrophobicContact CD1-CD1 3.54Å; L37-L90 HydrophobicContact CG-CD1 4.4Å; F86-L90 WeakPolarHBondContact O-CG 3.25Å; F86-L90 PolarHBondContact O-N 2.93Å; I87-L90 PolarHBondContact O-N 3.12Å |
| 91 | A | 86 | Confident | 89 | Confident | 67 Ų | 67 | 53.1 Ų | 53.1 | 55% | 0.554 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -70.4 | -42.7 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | I87 A88 M93 | I87-A91 WeakPolarHBondContact O-CB 3.2Å; I87-A91 PolarHBondContact O-N 3.18Å; A88-A91 PolarHBondContact O-N 2.89Å; A91-M93 VanDerWaalsContact C-N 3.32Å |
| 92 | M | 84.1 | Confident | 89 | Confident | 118 Ų | 118 | 51 Ų | 51 | 58% | 0.581 | 28% | 0.283 | S | S | * | . | H | α-helix | trans | -80.2 | -17.6 | 178.1 | -63.7 | -176.5 | -175.2 | 0 | 0 | 112.7 | A88 D94 | A88-M92 WeakPolarHBondContact O-CB 3.34Å; A88-M92 WeakPolarHBondContact O-CG 3.36Å; A88-M92 PolarHBondContact O-N 3.22Å; M92-D94 PolarHBondContact O-N 3.14Å |
| 93 | M | 81 | Confident | 89 | Confident | 41 Ų | 41 | 52.9 Ų | 52.9 | 20% | 0.202 | 29% | 0.29 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 50.4 | 23.9 | -169.8 | -51 | -171.8 | 100.8 | 0 | 0 | 113.9 | V24 T30 Y89 A91 R178 | V24-M93 WeakPolarHBondContact O-CE 3.48Å; T30-M93 HydrophobicContact CG2-CE 3.27Å; T30-M93 WeakPolarHBondContact OG1-CE 3.44Å; Y89-M93 VanDerWaalsContact O-CA 3.31Å; Y89-M93 WeakPolarHBondContact O-CA 3.3Å; Y89-M93 PolarHBondContact O-N 3.47Å; A91-M93 VanDerWaalsContact C-N 3.32Å; M93-R178 WeakPolarHBondContact O-CD 3.22Å; M93-R178 PolarHBondContact SD-NH1 3.12Å |
| 94 | D | 84.3 | Confident | 89.1 | Confident | 33 Ų | 33 | 55.7 Ų | 55.7 | 18% | 0.176 | 31% | 0.307 | C | S | . | . | S | Bend | trans | -150.4 | 134 | -173.8 | -173.2 | 33.7 | 0 | 0 | 0 | 110.1 | M92 K96 T179 | M92-D94 PolarHBondContact O-N 3.14Å; D94-K96 PolarHBondContact O-N 3.35Å; D94-K96 WeakPolarHBondContact OD2-CE 3.38Å; D94-K96 WeakPolarHBondContact OD2-CG 3.4Å; D94-T179 WeakPolarHBondContact OD1-CA 3.22Å; D94-T179 PolarHBondContact OD1-N 3.14Å |
| 95 | W | 86.9 | Confident | 89.1 | Confident | 4 Ų | 4 | 53.4 Ų | 53.4 | 2% | 0.015 | 29% | 0.292 | C | S | . | . | trans | -89.9 | 99.8 | -179.3 | -172.5 | -89.5 | 0 | 0 | 0 | 111.4 | Y89 M97 G98 M101 C102 L105 T179 C181 | Y89-W95 HydrophobicContact CD1-CE3 4.31Å; Y89-W95 HydrophobicContact CD1-CZ3 4.5Å; Y89-W95 HydrophobicContact CD2-CB 4.04Å; Y89-W95 HydrophobicContact CD2-CD2 4.44Å; Y89-W95 AromaticContact CD2-CE3 3.55Å; Y89-W95 HydrophobicContact CD2-CE3 3.55Å; Y89-W95 HydrophobicContact CD2-CZ3 4.35Å; Y89-W95 HydrophobicContact CE2-CB 3.83Å; Y89-W95 HydrophobicContact CE2-CE3 4.04Å; Y89-W95 AromaticContact CG-CE3 3.68Å; Y89-W95 HydrophobicContact CG-CE3 3.68Å; Y89-W95 HydrophobicContact CG-CZ3 4.03Å; W95-M97 HydrophobicContact CH2-SD 4.08Å; W95-M97 HydrophobicContact CZ2-CB 3.94Å; W95-M97 HydrophobicContact CZ2-SD 4.17Å; W95-G98 PolarHBondContact NE1-O 2.97Å; W95-M101 HydrophobicContact CZ2-CB 4.2Å; W95-M101 HydrophobicContact CZ2-CG 4.14Å; W95-C102 VanDerWaalsContact CZ2-CA 3.46Å; W95-C102 HydrophobicContact CZ2-CB 3.86Å; W95-L105 HydrophobicContact CH2-CD1 3.55Å; W95-L105 HydrophobicContact CZ2-CD1 4.11Å; W95-T179 HydrophobicContact CB-CG2 4.19Å; W95-T179 WeakPolarHBondContact CB-O 3.34Å; W95-T179 PolarHBondContact N-O 3.13Å; W95-T179 WeakPolarHBondContact O-CB 3.49Å; W95-T179 WeakPolarHBondContact O-CG2 3.47Å; W95-C181 HydrophobicContact CD2-CB 3.79Å; W95-C181 HydrophobicContact CE3-CB 3.94Å; W95-C181 HydrophobicContact CG-CB 4.01Å | ||
| 96 | K | 87.1 | Confident | 89.2 | Confident | 152 Ų | 152 | 51.6 Ų | 51.6 | 66% | 0.661 | 28% | 0.284 | S | S | * | . | trans | -101.6 | -4.4 | -178.8 | -62.6 | -171.8 | 178 | -176.9 | 0 | 115.3 | D94 G98 | D94-K96 PolarHBondContact O-N 3.35Å; D94-K96 WeakPolarHBondContact OD2-CE 3.38Å; D94-K96 WeakPolarHBondContact OD2-CG 3.4Å; K96-G98 PolarHBondContact O-N 3.49Å | ||
| 97 | M | 86.8 | Confident | 89.4 | Confident | 65 Ų | 65 | 52.2 Ų | 52.2 | 32% | 0.32 | 29% | 0.286 | S | S | . | . | S | Bend | trans | -83.7 | 5 | -171.8 | -54.5 | 172.1 | -154.4 | 0 | 0 | 113.9 | F85 A88 W95 M101 | F85-M97 HydrophobicContact CB-CE 4.27Å; F85-M97 HydrophobicContact CB-SD 4.1Å; F85-M97 HydrophobicContact CD1-CE 4.27Å; F85-M97 HydrophobicContact CD1-SD 3.63Å; F85-M97 HydrophobicContact CG-SD 4.32Å; F85-M97 WeakPolarHBondContact O-CE 3.17Å; A88-M97 HydrophobicContact CB-CE 3.87Å; W95-M97 HydrophobicContact CH2-SD 4.08Å; W95-M97 HydrophobicContact CZ2-CB 3.94Å; W95-M97 HydrophobicContact CZ2-SD 4.17Å; M97-M101 HydrophobicContact CB-CB 3.9Å; M97-M101 HydrophobicContact CB-CG 3.85Å; M97-M101 VanDerWaalsContact O-CB 3.27Å; M97-M101 WeakPolarHBondContact O-CB 3.38Å; M97-M101 HydrophobicContact SD-CG 4.27Å |
| 98 | G | 89.8 | Confident | 89.6 | Confident | 38 Ų | 38 | 54 Ų | 54 | 39% | 0.392 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | 78 | 169.6 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | W95 K96 C102 | W95-G98 PolarHBondContact NE1-O 2.97Å; K96-G98 PolarHBondContact O-N 3.49Å; G98-C102 PolarHBondContact O-N 2.96Å |
| 99 | T | 91 | Very high | 89.8 | Confident | 56 Ų | 56 | 53.2 Ų | 53.2 | 34% | 0.344 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -67.7 | -38.2 | -173.6 | -53.9 | 0 | 0 | 0 | 0 | 113.2 | M101 C102 K103 D169 | T99-M101 PolarHBondContact O-N 2.95Å; T99-C102 WeakPolarHBondContact O-CB 3.33Å; T99-C102 PolarHBondContact O-N 3.45Å; T99-K103 HydrophobicContact CG2-CD 4.3Å; T99-K103 WeakPolarHBondContact O-CG 3.13Å; T99-K103 PolarHBondContact O-N 2.88Å; T99-D169 WeakPolarHBondContact CG2-OD1 3.15Å |
| 100 | V | 92.5 | Very high | 90.1 | Very high | 114 Ų | 114 | 51.8 Ų | 51.8 | 69% | 0.691 | 28% | 0.283 | S | S | * | . | H | α-helix | trans | -61.6 | -47.1 | -179.5 | 178.7 | 0 | 0 | 0 | 0 | 110.5 | C102 K103 V104 | V100-C102 VanDerWaalsContact C-N 3.33Å; V100-C102 PolarHBondContact O-N 3.37Å; V100-K103 PolarHBondContact O-N 3.44Å; V100-V104 HydrophobicContact CG1-CG2 4.3Å; V100-V104 WeakPolarHBondContact O-CB 3.39Å; V100-V104 WeakPolarHBondContact O-CG2 3.45Å; V100-V104 PolarHBondContact O-N 3.37Å |
| 101 | M | 91.8 | Very high | 90.5 | Very high | 71 Ų | 71 | 50.3 Ų | 50.3 | 35% | 0.35 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -64.7 | -38.6 | 178.9 | -167.7 | 60.6 | 77.1 | 0 | 0 | 111.5 | W95 M97 T99 L105 | W95-M101 HydrophobicContact CZ2-CB 4.2Å; W95-M101 HydrophobicContact CZ2-CG 4.14Å; M97-M101 HydrophobicContact CB-CB 3.9Å; M97-M101 HydrophobicContact CB-CG 3.85Å; M97-M101 VanDerWaalsContact O-CB 3.27Å; M97-M101 WeakPolarHBondContact O-CB 3.38Å; M97-M101 HydrophobicContact SD-CG 4.27Å; T99-M101 PolarHBondContact O-N 2.95Å; M101-L105 HydrophobicContact CG-CD1 3.6Å; M101-L105 HydrophobicContact CG-CG 4.13Å; M101-L105 VanDerWaalsContact O-CB 3.29Å; M101-L105 WeakPolarHBondContact O-CB 3.31Å; M101-L105 VanDerWaalsContact O-CG 3.25Å; M101-L105 WeakPolarHBondContact O-CG 3.33Å; M101-L105 PolarHBondContact O-N 2.86Å; M101-L105 HydrophobicContact SD-CD1 3.91Å; M101-L105 HydrophobicContact SD-CD2 4.4Å; M101-L105 HydrophobicContact SD-CG 3.91Å |
| 102 | C | 92.9 | Very high | 91 | Very high | 0 Ų | 0 | 47.5 Ų | 47.5 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -57.3 | -51.2 | 173.8 | 165.1 | 0 | 0 | 0 | 0 | 111.2 | W95 G98 T99 V100 F106 A170 C181 | W95-C102 VanDerWaalsContact CZ2-CA 3.46Å; W95-C102 HydrophobicContact CZ2-CB 3.86Å; G98-C102 PolarHBondContact O-N 2.96Å; T99-C102 WeakPolarHBondContact O-CB 3.33Å; T99-C102 PolarHBondContact O-N 3.45Å; V100-C102 VanDerWaalsContact C-N 3.33Å; V100-C102 PolarHBondContact O-N 3.37Å; C102-F106 WeakPolarHBondContact O-CD2 3.02Å; C102-F106 PolarHBondContact O-N 3.45Å; C102-A170 HydrophobicContact CB-CB 4.07Å; C102-C181 VanDerWaalsContact CA-SG 3.52Å; C102-C181 HydrophobicContact CB-CB 3.81Å; C102-C181 WeakPolarHBondContact CB-SG 3.38Å; C102-C181 WeakPolarHBondContact SG-CB 3.5Å; C102-C181 CovalentContact SG-SG 2.01Å; C102-C181 PolarHBondContact SG-SG 3.31Å |
| 103 | K | 93.8 | Very high | 91.5 | Very high | 67 Ų | 67 | 42 Ų | 42 | 29% | 0.291 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -61.5 | -50.7 | 178.8 | -73.7 | -177.4 | 170.5 | -168.5 | 0 | 112.1 | T99 V100 Y107 L165 R168 | T99-K103 HydrophobicContact CG2-CD 4.3Å; T99-K103 WeakPolarHBondContact O-CG 3.13Å; T99-K103 PolarHBondContact O-N 2.88Å; V100-K103 PolarHBondContact O-N 3.44Å; K103-Y107 WeakPolarHBondContact O-CB 3.48Å; K103-Y107 PolarHBondContact O-N 2.86Å; K103-L165 HydrophobicContact CB-CD2 3.9Å; K103-L165 WeakPolarHBondContact CD-O 3.2Å; K103-L165 WeakPolarHBondContact CE-O 3.16Å; K103-R168 WeakPolarHBondContact CE-O 3.36Å; K103-R168 WeakPolarHBondContact CG-O 3.39Å |
| 104 | V | 93.9 | Very high | 92.2 | Very high | 59 Ų | 59 | 40.2 Ų | 40.2 | 36% | 0.358 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -64.4 | -44 | -176.1 | 172.1 | 0 | 0 | 0 | 0 | 111.9 | V100 Y107 L108 | V100-V104 HydrophobicContact CG1-CG2 4.3Å; V100-V104 WeakPolarHBondContact O-CB 3.39Å; V100-V104 WeakPolarHBondContact O-CG2 3.45Å; V100-V104 PolarHBondContact O-N 3.37Å; V104-Y107 PolarHBondContact O-N 3.08Å; V104-L108 HydrophobicContact CG1-CD1 3.93Å; V104-L108 HydrophobicContact CG1-CG 4.36Å; V104-L108 WeakPolarHBondContact O-CG 3.44Å; V104-L108 PolarHBondContact O-N 3.39Å |
| 105 | L | 93.4 | Very high | 92.7 | Very high | 2 Ų | 2 | 38.7 Ų | 38.7 | 1% | 0.01 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -64.3 | -47.8 | -178.1 | -74 | 171.4 | 0 | 0 | 0 | 111.9 | L82 F85 F86 W95 M101 Y107 L108 C109 | L82-L105 HydrophobicContact CB-CD2 3.91Å; L82-L105 HydrophobicContact CD1-CD2 4.05Å; L82-L105 HydrophobicContact CD2-CD2 3.68Å; L82-L105 HydrophobicContact CG-CD2 4.05Å; F85-L105 HydrophobicContact CB-CD1 3.69Å; F85-L105 HydrophobicContact CB-CD2 4.43Å; F85-L105 HydrophobicContact CD2-CD2 4.02Å; F85-L105 HydrophobicContact CG-CD1 4.07Å; F85-L105 HydrophobicContact CG-CD2 4.37Å; F86-L105 HydrophobicContact CZ-CB 4.06Å; W95-L105 HydrophobicContact CH2-CD1 3.55Å; W95-L105 HydrophobicContact CZ2-CD1 4.11Å; M101-L105 HydrophobicContact CG-CD1 3.6Å; M101-L105 HydrophobicContact CG-CG 4.13Å; M101-L105 VanDerWaalsContact O-CB 3.29Å; M101-L105 WeakPolarHBondContact O-CB 3.31Å; M101-L105 VanDerWaalsContact O-CG 3.25Å; M101-L105 WeakPolarHBondContact O-CG 3.33Å; M101-L105 PolarHBondContact O-N 2.86Å; M101-L105 HydrophobicContact SD-CD1 3.91Å; M101-L105 HydrophobicContact SD-CD2 4.4Å; M101-L105 HydrophobicContact SD-CG 3.91Å; L105-Y107 VanDerWaalsContact C-N 3.34Å; L105-Y107 PolarHBondContact O-N 3.01Å; L105-L108 PolarHBondContact O-N 3.07Å; L105-C109 PolarHBondContact O-N 3.49Å; L105-C109 PolarHBondContact O-SG 3.38Å |
| 106 | F | 92.6 | Very high | 93.2 | Very high | 42 Ų | 42 | 38.5 Ų | 38.5 | 18% | 0.184 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -69.7 | -32.1 | 178.8 | -80.5 | -83.3 | 0 | 0 | 0 | 112.7 | F86 C102 C109 L110 R168 C181 | F86-F106 HydrophobicContact CD1-CZ 4.47Å; F86-F106 HydrophobicContact CE1-CD2 4.41Å; F86-F106 HydrophobicContact CE1-CE1 4.05Å; F86-F106 AromaticContact CE1-CE2 3.85Å; F86-F106 HydrophobicContact CE1-CE2 3.85Å; F86-F106 AromaticContact CE1-CZ 3.67Å; F86-F106 HydrophobicContact CE1-CZ 3.67Å; C102-F106 WeakPolarHBondContact O-CD2 3.02Å; C102-F106 PolarHBondContact O-N 3.45Å; F106-C109 PolarHBondContact O-N 2.87Å; F106-L110 PolarHBondContact O-N 3Å; F106-R168 HydrophobicContact CB-CG 4.19Å; F106-R168 HydrophobicContact CD2-CG 4.44Å; F106-R168 HydrophobicContact CG-CG 4.4Å; F106-R168 VanDerWaalsContact CZ-NH2 3.27Å; F106-C181 WeakPolarHBondContact CD2-SG 3.44Å; F106-C181 HydrophobicContact CE2-CB 4.18Å; F106-C181 WeakPolarHBondContact CE2-SG 3.44Å |
| 107 | Y | 94.9 | Very high | 93.6 | Very high | 27 Ų | 27 | 31.2 Ų | 31.2 | 11% | 0.106 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -60.7 | -47.9 | 170.1 | 172 | -97 | 0 | 0 | 0 | 111.9 | K103 V104 L105 C109 L110 A111 M158 S161 L165 | K103-Y107 WeakPolarHBondContact O-CB 3.48Å; K103-Y107 PolarHBondContact O-N 2.86Å; V104-Y107 PolarHBondContact O-N 3.08Å; L105-Y107 VanDerWaalsContact C-N 3.34Å; L105-Y107 PolarHBondContact O-N 3.01Å; Y107-C109 VanDerWaalsContact C-N 3.33Å; Y107-C109 PolarHBondContact O-N 3.33Å; Y107-L110 PolarHBondContact O-N 2.98Å; Y107-A111 WeakPolarHBondContact O-CB 3.48Å; Y107-A111 PolarHBondContact O-N 2.62Å; Y107-M158 HydrophobicContact CE1-CE 3.81Å; Y107-M158 HydrophobicContact CE1-SD 4.07Å; Y107-M158 WeakPolarHBondContact OH-CA 3.06Å; Y107-M158 WeakPolarHBondContact OH-CB 3.26Å; Y107-M158 VanDerWaalsContact OH-CE 3.26Å; Y107-M158 WeakPolarHBondContact OH-CE 3.34Å; Y107-M158 PolarHBondContact OH-O 3.36Å; Y107-M158 PolarHBondContact OH-SD 3.21Å; Y107-M158 VanDerWaalsContact OH-SD 3.36Å; Y107-S161 VanDerWaalsContact CD2-O 3.28Å; Y107-S161 WeakPolarHBondContact CD2-O 3.45Å; Y107-L165 HydrophobicContact CD2-CD1 3.56Å; Y107-L165 HydrophobicContact CD2-CD2 4.14Å; Y107-L165 HydrophobicContact CD2-CG 3.45Å; Y107-L165 VanDerWaalsContact CD2-CG 3.45Å; Y107-L165 HydrophobicContact CE2-CD1 3.74Å; Y107-L165 HydrophobicContact CE2-CG 4.15Å; Y107-L165 HydrophobicContact CG-CD1 3.96Å; Y107-L165 HydrophobicContact CG-CD2 3.88Å; Y107-L165 HydrophobicContact CG-CG 3.73Å |
| 108 | L | 95 | Very high | 94 | Very high | 67 Ų | 67 | 29.9 Ų | 29.9 | 35% | 0.351 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -67.1 | -32.9 | 177.9 | -69.1 | 175.2 | 0 | 0 | 0 | 112.4 | L82 V104 L105 N112 | L82-L108 HydrophobicContact CD1-CB 3.46Å; L82-L108 VanDerWaalsContact CD1-CB 3.46Å; L82-L108 HydrophobicContact CD1-CD1 3.75Å; L82-L108 HydrophobicContact CD1-CG 4.26Å; L82-L108 HydrophobicContact CD2-CD1 4.3Å; V104-L108 HydrophobicContact CG1-CD1 3.93Å; V104-L108 HydrophobicContact CG1-CG 4.36Å; V104-L108 WeakPolarHBondContact O-CG 3.44Å; V104-L108 PolarHBondContact O-N 3.39Å; L105-L108 PolarHBondContact O-N 3.07Å; L108-N112 WeakPolarHBondContact O-CB 3.42Å; L108-N112 PolarHBondContact O-N 3.37Å |
| 109 | C | 94 | Very high | 94.2 | Very high | 16 Ų | 16 | 28 Ų | 28 | 11% | 0.108 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -62.4 | -45.2 | 171.5 | -68.7 | 0 | 0 | 0 | 0 | 112.2 | L79 F86 L105 F106 Y107 N112 M113 | L79-C109 HydrophobicContact CD1-CB 4.19Å; L79-C109 WeakPolarHBondContact CD1-SG 3.29Å; F86-C109 VanDerWaalsContact CE2-SG 3.54Å; F86-C109 WeakPolarHBondContact CZ-SG 3.45Å; L105-C109 PolarHBondContact O-N 3.49Å; L105-C109 PolarHBondContact O-SG 3.38Å; F106-C109 PolarHBondContact O-N 2.87Å; Y107-C109 VanDerWaalsContact C-N 3.33Å; Y107-C109 PolarHBondContact O-N 3.33Å; C109-N112 PolarHBondContact O-N 2.91Å; C109-M113 PolarHBondContact O-N 2.93Å |
| 110 | L | 93.9 | Very high | 94.3 | Very high | 12 Ų | 12 | 25.5 Ų | 25.5 | 6% | 0.063 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -67.7 | -41.5 | 177.9 | -175.8 | 61.7 | 0 | 0 | 0 | 111.4 | F106 Y107 N112 M113 Y114 A164 E198 | F106-L110 PolarHBondContact O-N 3Å; Y107-L110 PolarHBondContact O-N 2.98Å; L110-N112 VanDerWaalsContact C-N 3.31Å; L110-N112 PolarHBondContact O-N 3.34Å; L110-M113 HydrophobicContact CD1-CE 3.48Å; L110-M113 VanDerWaalsContact CD1-CE 3.48Å; L110-M113 HydrophobicContact CD1-SD 4.28Å; L110-M113 WeakPolarHBondContact O-CB 3.08Å; L110-M113 PolarHBondContact O-N 3.2Å; L110-Y114 HydrophobicContact CD1-CD2 4.38Å; L110-Y114 HydrophobicContact CD1-CE1 4.48Å; L110-Y114 HydrophobicContact CD1-CE2 3.82Å; L110-Y114 HydrophobicContact CD2-CE2 3.99Å; L110-Y114 HydrophobicContact CG-CD2 4.1Å; L110-Y114 HydrophobicContact CG-CE2 3.63Å; L110-Y114 PolarHBondContact O-N 3.1Å; L110-A164 HydrophobicContact CB-CB 4.39Å; L110-A164 HydrophobicContact CD2-CB 3.66Å; L110-E198 HydrophobicContact CD1-CG 3.99Å |
| 111 | A | 95.7 | Very high | 94.4 | Very high | 6 Ų | 6 | 21.1 Ų | 21.1 | 5% | 0.05 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -60.3 | -41 | 174 | 0 | 0 | 0 | 0 | 0 | 111.6 | Y107 Y114 A115 V157 M158 S161 | Y107-A111 WeakPolarHBondContact O-CB 3.48Å; Y107-A111 PolarHBondContact O-N 2.62Å; A111-Y114 PolarHBondContact O-N 2.95Å; A111-A115 VanDerWaalsContact O-CB 3.25Å; A111-A115 WeakPolarHBondContact O-CB 3.24Å; A111-A115 PolarHBondContact O-N 2.88Å; A111-V157 HydrophobicContact CB-CG1 4.08Å; A111-V157 WeakPolarHBondContact O-CG1 3.44Å; A111-M158 HydrophobicContact CB-SD 4.34Å; A111-S161 VanDerWaalsContact CA-OG 3.22Å; A111-S161 WeakPolarHBondContact CA-OG 3.25Å; A111-S161 PolarHBondContact N-OG 2.83Å |
| 112 | N | 95.3 | Very high | 94.5 | Very high | 8 Ų | 8 | 19.2 Ų | 19.2 | 4% | 0.043 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -60.9 | -47.3 | 174 | 179.8 | 77.9 | 0 | 0 | 0 | 111.9 | A75 D76 L79 L108 C109 L110 Y114 A115 S116 | A75-N112 PolarHBondContact O-OD1 3.06Å; D76-N112 PolarHBondContact N-OD1 3.43Å; L79-N112 HydrophobicContact CB-CB 4.15Å; L79-N112 VanDerWaalsContact CD2-ND2 3.32Å; L79-N112 WeakPolarHBondContact CD2-ND2 3.4Å; L108-N112 WeakPolarHBondContact O-CB 3.42Å; L108-N112 PolarHBondContact O-N 3.37Å; C109-N112 PolarHBondContact O-N 2.91Å; L110-N112 VanDerWaalsContact C-N 3.31Å; L110-N112 PolarHBondContact O-N 3.34Å; N112-Y114 VanDerWaalsContact C-N 3.34Å; N112-Y114 PolarHBondContact O-N 3.14Å; N112-A115 PolarHBondContact O-N 2.93Å; N112-S116 WeakPolarHBondContact O-CB 3.36Å; N112-S116 PolarHBondContact O-N 3.28Å; N112-S116 PolarHBondContact O-OG 3.5Å |
| 113 | M | 94.4 | Very high | 94.4 | Very high | 2 Ų | 2 | 19.4 Ų | 19.4 | 1% | 0.01 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -52.9 | -52.9 | 177.1 | -178.9 | -170.7 | 82.3 | 0 | 0 | 111.1 | C109 L110 S116 I117 W247 Y250 | C109-M113 PolarHBondContact O-N 2.93Å; L110-M113 HydrophobicContact CD1-CE 3.48Å; L110-M113 VanDerWaalsContact CD1-CE 3.48Å; L110-M113 HydrophobicContact CD1-SD 4.28Å; L110-M113 WeakPolarHBondContact O-CB 3.08Å; L110-M113 PolarHBondContact O-N 3.2Å; M113-S116 PolarHBondContact O-N 3.45Å; M113-I117 WeakPolarHBondContact O-CG2 3.31Å; M113-I117 PolarHBondContact O-N 2.85Å; M113-I117 VanDerWaalsContact O-N 3.11Å; M113-W247 HydrophobicContact CB-CH2 3.43Å; M113-W247 VanDerWaalsContact CB-CH2 3.43Å; M113-W247 HydrophobicContact CB-CZ2 3.89Å; M113-W247 HydrophobicContact CB-CZ3 3.86Å; M113-W247 HydrophobicContact CG-CD2 4.12Å; M113-W247 HydrophobicContact CG-CE3 3.68Å; M113-W247 HydrophobicContact CG-CH2 3.38Å; M113-W247 HydrophobicContact CG-CZ2 3.81Å; M113-W247 HydrophobicContact CG-CZ3 3.31Å; M113-W247 HydrophobicContact SD-CE3 3.64Å; M113-W247 HydrophobicContact SD-CH2 3.88Å; M113-W247 HydrophobicContact SD-CZ3 3.22Å; M113-W247 WeakPolarHBondContact SD-CZ3 3.44Å; M113-Y250 HydrophobicContact SD-CE1 4.17Å |
| 114 | Y | 95.6 | Very high | 94.2 | Very high | 4 Ų | 4 | 16.2 Ų | 16.2 | 2% | 0.016 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -65.3 | -43.7 | 179.5 | -67.7 | -40.8 | 0 | 0 | 0 | 112.4 | L110 A111 N112 S116 I117 Q118 A160 S161 L197 E198 L201 | L110-Y114 HydrophobicContact CD1-CD2 4.38Å; L110-Y114 HydrophobicContact CD1-CE1 4.48Å; L110-Y114 HydrophobicContact CD1-CE2 3.82Å; L110-Y114 HydrophobicContact CD2-CE2 3.99Å; L110-Y114 HydrophobicContact CG-CD2 4.1Å; L110-Y114 HydrophobicContact CG-CE2 3.63Å; L110-Y114 PolarHBondContact O-N 3.1Å; A111-Y114 PolarHBondContact O-N 2.95Å; N112-Y114 VanDerWaalsContact C-N 3.34Å; N112-Y114 PolarHBondContact O-N 3.14Å; Y114-S116 PolarHBondContact O-N 3.38Å; Y114-I117 WeakPolarHBondContact O-CG2 3.11Å; Y114-Q118 VanDerWaalsContact O-CB 3.26Å; Y114-Q118 WeakPolarHBondContact O-CB 3.28Å; Y114-Q118 WeakPolarHBondContact O-CG 3.36Å; Y114-Q118 PolarHBondContact O-N 3.42Å; Y114-A160 HydrophobicContact CD2-CB 4.07Å; Y114-A160 HydrophobicContact CE2-CB 3.89Å; Y114-S161 WeakPolarHBondContact CD2-OG 3.32Å; Y114-L197 VanDerWaalsContact OH-CD2 3.25Å; Y114-L197 WeakPolarHBondContact OH-CD2 3.45Å; Y114-E198 VanDerWaalsContact OH-CA 3.26Å; Y114-E198 WeakPolarHBondContact OH-CA 3.39Å; Y114-E198 WeakPolarHBondContact OH-CG 3.36Å; Y114-L201 HydrophobicContact CD1-CB 4.41Å; Y114-L201 HydrophobicContact CE1-CB 3.93Å |
| 115 | A | 96.5 | Very high | 94.1 | Very high | 0 Ų | 0 | 16.4 Ų | 16.4 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -57.9 | -49.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 110.8 | A75 A111 N112 Q118 L119 W154 V157 | A75-A115 HydrophobicContact CB-CB 4.06Å; A111-A115 VanDerWaalsContact O-CB 3.25Å; A111-A115 WeakPolarHBondContact O-CB 3.24Å; A111-A115 PolarHBondContact O-N 2.88Å; N112-A115 PolarHBondContact O-N 2.93Å; A115-Q118 PolarHBondContact O-N 2.84Å; A115-L119 VanDerWaalsContact O-CB 3.27Å; A115-L119 WeakPolarHBondContact O-CB 3.48Å; A115-L119 WeakPolarHBondContact O-CD1 3.45Å; A115-L119 WeakPolarHBondContact O-CG 3.24Å; A115-L119 PolarHBondContact O-N 2.89Å; A115-W154 HydrophobicContact CB-CH2 4.12Å; A115-W154 HydrophobicContact CB-CZ3 4.11Å; A115-V157 HydrophobicContact CB-CG1 4.15Å; A115-V157 HydrophobicContact CB-CG2 4.48Å |
| 116 | S | 95.6 | Very high | 93.8 | Very high | 0 Ų | 0 | 17.9 Ų | 17.9 | 0% | 0 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -62.5 | -48.2 | -177.1 | -66.7 | 0 | 0 | 0 | 0 | 111.9 | L72 D76 N112 M113 Y114 L119 I120 | L72-S116 WeakPolarHBondContact CD1-OG 3.42Å; D76-S116 PolarHBondContact OD1-OG 2.79Å; N112-S116 WeakPolarHBondContact O-CB 3.36Å; N112-S116 PolarHBondContact O-N 3.28Å; N112-S116 PolarHBondContact O-OG 3.5Å; M113-S116 PolarHBondContact O-N 3.45Å; Y114-S116 PolarHBondContact O-N 3.38Å; S116-L119 PolarHBondContact O-N 3.23Å; S116-I120 WeakPolarHBondContact O-CD1 3.21Å; S116-I120 WeakPolarHBondContact O-CG1 3.26Å; S116-I120 PolarHBondContact O-N 2.91Å |
| 117 | I | 95.3 | Very high | 93.5 | Very high | 0 Ų | 0 | 17 Ų | 17 | 0% | 0 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -67.4 | -39.5 | 179.2 | -170 | 62.2 | 0 | 0 | 0 | 112.5 | M113 Y114 L119 I120 M121 P206 Y207 I210 F243 | M113-I117 WeakPolarHBondContact O-CG2 3.31Å; M113-I117 PolarHBondContact O-N 2.85Å; M113-I117 VanDerWaalsContact O-N 3.11Å; Y114-I117 WeakPolarHBondContact O-CG2 3.11Å; I117-L119 VanDerWaalsContact C-N 3.34Å; I117-L119 PolarHBondContact O-N 2.9Å; I117-I120 PolarHBondContact O-N 3.2Å; I117-M121 WeakPolarHBondContact O-CB 3.32Å; I117-M121 PolarHBondContact O-N 3.22Å; I117-P206 HydrophobicContact CD1-CB 3.97Å; I117-P206 HydrophobicContact CG1-CB 3.33Å; I117-P206 HydrophobicContact CG1-CG 3.74Å; I117-P206 HydrophobicContact CG2-CG 4.18Å; I117-Y207 HydrophobicContact CD1-CD2 4.36Å; I117-Y207 HydrophobicContact CD1-CE1 4.47Å; I117-Y207 HydrophobicContact CD1-CE2 3.79Å; I117-I210 HydrophobicContact CD1-CD1 4.08Å; I117-F243 HydrophobicContact CB-CD1 4.49Å; I117-F243 HydrophobicContact CB-CE1 3.62Å; I117-F243 HydrophobicContact CB-CZ 3.93Å; I117-F243 HydrophobicContact CD1-CD1 3.66Å; I117-F243 HydrophobicContact CD1-CE1 3.59Å; I117-F243 HydrophobicContact CG1-CE1 4Å |
| 118 | Q | 95.2 | Very high | 93.1 | Very high | 36 Ų | 36 | 17.2 Ų | 17.2 | 17% | 0.168 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -67.6 | -36.6 | 178.5 | -64.7 | -70 | 46.2 | 0 | 0 | 111.3 | Y114 A115 M121 L122 M153 V157 | Y114-Q118 VanDerWaalsContact O-CB 3.26Å; Y114-Q118 WeakPolarHBondContact O-CB 3.28Å; Y114-Q118 WeakPolarHBondContact O-CG 3.36Å; Y114-Q118 PolarHBondContact O-N 3.42Å; A115-Q118 PolarHBondContact O-N 2.84Å; Q118-M121 PolarHBondContact O-N 3.1Å; Q118-L122 WeakPolarHBondContact O-CB 3.42Å; Q118-L122 WeakPolarHBondContact O-CD1 3.09Å; Q118-L122 PolarHBondContact O-N 3.42Å; Q118-M153 HydrophobicContact CB-CG 3.89Å; Q118-M153 HydrophobicContact CB-SD 4.13Å; Q118-V157 HydrophobicContact CG-CG2 4.42Å |
| 119 | L | 94.9 | Very high | 92.7 | Very high | 0 Ų | 0 | 15 Ų | 15 | 0% | 0 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -65.3 | -40.7 | 172.6 | -73.8 | 165.5 | 0 | 0 | 0 | 112 | L68 N71 L72 A115 S116 I117 L122 M123 L150 M153 | L68-L119 HydrophobicContact CD2-CD2 4.13Å; N71-L119 HydrophobicContact CB-CD1 3.93Å; N71-L119 HydrophobicContact CB-CD2 3.76Å; L72-L119 HydrophobicContact CB-CD1 4.11Å; L72-L119 HydrophobicContact CD1-CB 4.48Å; L72-L119 HydrophobicContact CD1-CD1 4.37Å; A115-L119 VanDerWaalsContact O-CB 3.27Å; A115-L119 WeakPolarHBondContact O-CB 3.48Å; A115-L119 WeakPolarHBondContact O-CD1 3.45Å; A115-L119 WeakPolarHBondContact O-CG 3.24Å; A115-L119 PolarHBondContact O-N 2.89Å; S116-L119 PolarHBondContact O-N 3.23Å; I117-L119 VanDerWaalsContact C-N 3.34Å; I117-L119 PolarHBondContact O-N 2.9Å; L119-L122 PolarHBondContact O-N 3.23Å; L119-M123 HydrophobicContact CB-CE 4.49Å; L119-M123 WeakPolarHBondContact O-CB 3.07Å; L119-M123 WeakPolarHBondContact O-CG 3.33Å; L119-M123 PolarHBondContact O-N 2.92Å; L119-L150 HydrophobicContact CD2-CD2 3.72Å; L119-M153 HydrophobicContact CD1-CE 4.39Å; L119-M153 HydrophobicContact CD2-CE 3.51Å; L119-M153 HydrophobicContact CG-CE 3.75Å |
| 120 | I | 93.4 | Very high | 92.2 | Very high | 2 Ų | 2 | 15 Ų | 15 | 1% | 0.01 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -63.7 | -41.4 | 174.2 | -67.9 | 165.9 | 0 | 0 | 0 | 111.2 | L72 S116 I117 M123 S124 I210 I239 V240 F243 | L72-I120 HydrophobicContact CD2-CG1 4.43Å; S116-I120 WeakPolarHBondContact O-CD1 3.21Å; S116-I120 WeakPolarHBondContact O-CG1 3.26Å; S116-I120 PolarHBondContact O-N 2.91Å; I117-I120 PolarHBondContact O-N 3.2Å; I120-M123 HydrophobicContact CG1-CE 4.14Å; I120-M123 PolarHBondContact O-N 2.91Å; I120-S124 PolarHBondContact O-N 3.41Å; I120-S124 PolarHBondContact O-OG 2.95Å; I120-I210 HydrophobicContact CG2-CD1 3.93Å; I120-I239 HydrophobicContact CD1-CG2 3.97Å; I120-I239 HydrophobicContact CG1-CG2 4.01Å; I120-V240 HydrophobicContact CG2-CG2 3.53Å; I120-F243 HydrophobicContact CD1-CB 3.85Å; I120-F243 HydrophobicContact CD1-CD1 4.1Å; I120-F243 HydrophobicContact CD1-CD2 3.62Å; I120-F243 HydrophobicContact CD1-CE2 4.19Å; I120-F243 HydrophobicContact CD1-CG 3.58Å |
| 121 | M | 94.8 | Very high | 91.5 | Very high | 23 Ų | 23 | 16.3 Ų | 16.3 | 11% | 0.113 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -62 | -48.4 | 173.7 | -177.4 | -173.2 | 67.8 | 0 | 0 | 111.2 | I117 Q118 M123 S124 I125 P206 V209 I210 | I117-M121 WeakPolarHBondContact O-CB 3.32Å; I117-M121 PolarHBondContact O-N 3.22Å; Q118-M121 PolarHBondContact O-N 3.1Å; M121-M123 VanDerWaalsContact C-N 3.32Å; M121-M123 PolarHBondContact O-N 3.46Å; M121-S124 WeakPolarHBondContact O-CB 3.41Å; M121-S124 PolarHBondContact O-N 3.07Å; M121-S124 VanDerWaalsContact O-N 3.08Å; M121-I125 HydrophobicContact CG-CD1 4.03Å; M121-I125 WeakPolarHBondContact O-CG1 3.45Å; M121-I125 PolarHBondContact O-N 3.47Å; M121-P206 HydrophobicContact CB-CB 4.36Å; M121-P206 HydrophobicContact SD-CB 4.24Å; M121-V209 HydrophobicContact CG-CB 4Å; M121-V209 HydrophobicContact CG-CG1 3.74Å; M121-V209 HydrophobicContact SD-CB 3.87Å; M121-V209 HydrophobicContact SD-CG1 3.97Å; M121-V209 HydrophobicContact SD-CG2 4.09Å; M121-I210 HydrophobicContact CB-CD1 4.25Å; M121-I210 HydrophobicContact CB-CG1 4.15Å; M121-I210 HydrophobicContact CG-CG1 4.35Å |
| 122 | L | 93.7 | Very high | 90.9 | Very high | 30 Ų | 30 | 17.5 Ų | 17.5 | 16% | 0.157 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -59.1 | -41.2 | 175.8 | -99.6 | 61.7 | 0 | 0 | 0 | 112.1 | L68 Q118 L119 S124 I125 Y126 V149 L150 | L68-L122 HydrophobicContact CD1-CB 4.49Å; L68-L122 HydrophobicContact CD2-CB 4.16Å; L68-L122 HydrophobicContact CD2-CD2 4.18Å; Q118-L122 WeakPolarHBondContact O-CB 3.42Å; Q118-L122 WeakPolarHBondContact O-CD1 3.09Å; Q118-L122 PolarHBondContact O-N 3.42Å; L119-L122 PolarHBondContact O-N 3.23Å; L122-S124 VanDerWaalsContact C-N 3.3Å; L122-S124 PolarHBondContact O-N 2.83Å; L122-I125 PolarHBondContact O-N 2.87Å; L122-Y126 VanDerWaalsContact O-CB 3.31Å; L122-Y126 WeakPolarHBondContact O-CB 3.34Å; L122-Y126 PolarHBondContact O-N 3.38Å; L122-V149 HydrophobicContact CD2-CG1 3.69Å; L122-V149 HydrophobicContact CG-CG1 4.38Å; L122-L150 HydrophobicContact CD2-CD2 4.49Å |
| 123 | M | 90.2 | Very high | 90.2 | Very high | 5 Ų | 5 | 23.8 Ų | 23.8 | 3% | 0.025 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -60.3 | -41.1 | 174.2 | -78.9 | -171.1 | -92.5 | 0 | 0 | 111.7 | L68 I69 L72 L119 I120 M121 R127 | L68-M123 HydrophobicContact CB-CG 3.64Å; L68-M123 HydrophobicContact CB-SD 4.29Å; L68-M123 HydrophobicContact CD1-CB 4.33Å; L68-M123 HydrophobicContact CD1-CG 3.61Å; L68-M123 HydrophobicContact CG-CG 4.23Å; I69-M123 HydrophobicContact CG1-SD 3.84Å; L72-M123 HydrophobicContact CB-CE 4.43Å; L72-M123 HydrophobicContact CD2-CE 3.54Å; L119-M123 HydrophobicContact CB-CE 4.49Å; L119-M123 WeakPolarHBondContact O-CB 3.07Å; L119-M123 WeakPolarHBondContact O-CG 3.33Å; L119-M123 PolarHBondContact O-N 2.92Å; I120-M123 HydrophobicContact CG1-CE 4.14Å; I120-M123 PolarHBondContact O-N 2.91Å; M121-M123 VanDerWaalsContact C-N 3.32Å; M121-M123 PolarHBondContact O-N 3.46Å; M123-R127 WeakPolarHBondContact O-CG 3.38Å; M123-R127 PolarHBondContact O-N 2.85Å; M123-R127 VanDerWaalsContact O-N 3.08Å |
| 124 | S | 90.4 | Very high | 89.2 | Confident | 0 Ų | 0 | 26.8 Ų | 26.8 | 0% | 0 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -69 | -43.7 | 178.9 | -55.4 | 0 | 0 | 0 | 0 | 111.9 | I120 M121 L122 R127 L128 | I120-S124 PolarHBondContact O-N 3.41Å; I120-S124 PolarHBondContact O-OG 2.95Å; M121-S124 WeakPolarHBondContact O-CB 3.41Å; M121-S124 PolarHBondContact O-N 3.07Å; M121-S124 VanDerWaalsContact O-N 3.08Å; L122-S124 VanDerWaalsContact C-N 3.3Å; L122-S124 PolarHBondContact O-N 2.83Å; S124-R127 PolarHBondContact O-N 3.25Å; S124-L128 PolarHBondContact O-N 2.88Å |
| 125 | I | 91.3 | Very high | 88.2 | Confident | 63 Ų | 63 | 35.4 Ų | 35.4 | 32% | 0.323 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -61.1 | -46.9 | 173.7 | -65.5 | 167.6 | 0 | 0 | 0 | 110.7 | M121 L122 R127 L128 V129 V209 | M121-I125 HydrophobicContact CG-CD1 4.03Å; M121-I125 WeakPolarHBondContact O-CG1 3.45Å; M121-I125 PolarHBondContact O-N 3.47Å; L122-I125 PolarHBondContact O-N 2.87Å; I125-R127 PolarHBondContact O-N 2.97Å; I125-L128 WeakPolarHBondContact O-CB 3.43Å; I125-L128 PolarHBondContact O-N 3.39Å; I125-L128 VanDerWaalsContact O-N 3.1Å; I125-V129 HydrophobicContact CG2-CG2 4.32Å; I125-V129 WeakPolarHBondContact O-CG2 3.33Å; I125-V129 PolarHBondContact O-N 2.99Å; I125-V209 HydrophobicContact CD1-CG1 3.85Å; I125-V209 HydrophobicContact CG1-CG1 3.83Å |
| 126 | Y | 88.1 | Confident | 87 | Confident | 32 Ų | 32 | 43.7 Ų | 43.7 | 13% | 0.125 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -57.9 | -40.7 | 178.5 | 171.8 | -109 | 0 | 0 | 0 | 111.5 | V64 T65 L122 V129 S130 I137 T141 | V64-Y126 HydrophobicContact CB-CD2 4.28Å; V64-Y126 HydrophobicContact CB-CE1 4.25Å; V64-Y126 HydrophobicContact CB-CE2 3.8Å; V64-Y126 HydrophobicContact CG1-CD2 3.84Å; V64-Y126 HydrophobicContact CG1-CE2 3.88Å; V64-Y126 HydrophobicContact CG1-CG 4.17Å; V64-Y126 HydrophobicContact CG2-CE2 4.1Å; T65-Y126 WeakPolarHBondContact OG1-CE1 3.45Å; L122-Y126 VanDerWaalsContact O-CB 3.31Å; L122-Y126 WeakPolarHBondContact O-CB 3.34Å; L122-Y126 PolarHBondContact O-N 3.38Å; Y126-V129 PolarHBondContact O-N 3.33Å; Y126-S130 WeakPolarHBondContact O-CB 3.43Å; Y126-S130 PolarHBondContact O-N 3.4Å; Y126-I137 HydrophobicContact CD2-CD1 4.27Å; Y126-I137 HydrophobicContact CE2-CD1 3.91Å; Y126-I137 HydrophobicContact CE2-CG1 4.35Å; Y126-T141 HydrophobicContact CD2-CG2 3.74Å; Y126-T141 HydrophobicContact CE2-CG2 3.63Å |
| 127 | R | 86.1 | Confident | 86 | Confident | 24 Ų | 24 | 44.9 Ų | 44.9 | 9% | 0.091 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -64.3 | -44.6 | 174.2 | -73.5 | -63.7 | 179.6 | -158.6 | -5.6 | 112.8 | M123 S124 I125 V129 S130 V131 I217 I236 T322 | M123-R127 WeakPolarHBondContact O-CG 3.38Å; M123-R127 PolarHBondContact O-N 2.85Å; M123-R127 VanDerWaalsContact O-N 3.08Å; S124-R127 PolarHBondContact O-N 3.25Å; I125-R127 PolarHBondContact O-N 2.97Å; R127-V129 VanDerWaalsContact C-N 3.35Å; R127-V129 PolarHBondContact O-N 3.44Å; R127-S130 PolarHBondContact O-N 3.23Å; R127-V131 WeakPolarHBondContact O-CG2 3.41Å; R127-V131 PolarHBondContact O-N 2.96Å; R127-I217 HydrophobicContact CB-CD1 4.14Å; R127-I236 HydrophobicContact CG-CD1 3.44Å; R127-I236 VanDerWaalsContact CG-CD1 3.44Å; R127-T322 PolarHBondContact NH2-OG1 3.48Å |
| 128 | L | 86.8 | Confident | 84.7 | Confident | 32 Ų | 32 | 49.8 Ų | 49.8 | 17% | 0.168 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -55.2 | -51.7 | 175.6 | 173 | 67.5 | 0 | 0 | 0 | 111 | S124 I125 S130 V131 V132 C216 I217 | S124-L128 PolarHBondContact O-N 2.88Å; I125-L128 WeakPolarHBondContact O-CB 3.43Å; I125-L128 PolarHBondContact O-N 3.39Å; I125-L128 VanDerWaalsContact O-N 3.1Å; L128-S130 VanDerWaalsContact C-N 3.3Å; L128-S130 PolarHBondContact O-N 3.41Å; L128-V131 PolarHBondContact O-N 2.97Å; L128-V131 VanDerWaalsContact O-N 3.16Å; L128-V132 HydrophobicContact CD1-CG2 3.61Å; L128-V132 HydrophobicContact CG-CG2 4.39Å; L128-V132 WeakPolarHBondContact O-CB 3.23Å; L128-V132 WeakPolarHBondContact O-CG2 3.45Å; L128-V132 PolarHBondContact O-N 3.13Å; L128-C216 HydrophobicContact CD1-CB 3.42Å; L128-C216 VanDerWaalsContact CD1-CB 3.42Å; L128-I217 HydrophobicContact CB-CD1 4.2Å; L128-I217 HydrophobicContact CB-CG1 4.21Å; L128-I217 HydrophobicContact CD1-CG1 3.95Å |
| 129 | V | 86.6 | Confident | 83.4 | Confident | 21 Ų | 21 | 53.8 Ų | 53.8 | 13% | 0.127 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -61.4 | -41 | 179.9 | 179.9 | 0 | 0 | 0 | 0 | 110.8 | I125 Y126 R127 V131 W133 I137 I140 | I125-V129 HydrophobicContact CG2-CG2 4.32Å; I125-V129 WeakPolarHBondContact O-CG2 3.33Å; I125-V129 PolarHBondContact O-N 2.99Å; Y126-V129 PolarHBondContact O-N 3.33Å; R127-V129 VanDerWaalsContact C-N 3.35Å; R127-V129 PolarHBondContact O-N 3.44Å; V129-V131 VanDerWaalsContact C-N 3.3Å; V129-V131 PolarHBondContact O-N 3.43Å; V129-W133 HydrophobicContact CG1-CE3 4.33Å; V129-W133 HydrophobicContact CG2-CE3 4.44Å; V129-W133 CarbonylContact O-C 3.58Å; V129-W133 WeakPolarHBondContact O-CA 2.96Å; V129-W133 PolarHBondContact O-N 2.93Å; V129-I137 HydrophobicContact CB-CD1 4.11Å; V129-I137 HydrophobicContact CG1-CD1 3.61Å; V129-I140 HydrophobicContact CG1-CD1 4.22Å; V129-I140 HydrophobicContact CG1-CG2 4.49Å |
| 130 | S | 82.5 | Confident | 82.1 | Confident | 15 Ų | 15 | 57.2 Ų | 57.2 | 11% | 0.105 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -64.6 | -30.2 | 177.9 | -179.7 | 0 | 0 | 0 | 0 | 113.8 | Y126 R127 L128 | Y126-S130 WeakPolarHBondContact O-CB 3.43Å; Y126-S130 PolarHBondContact O-N 3.4Å; R127-S130 PolarHBondContact O-N 3.23Å; L128-S130 VanDerWaalsContact C-N 3.3Å; L128-S130 PolarHBondContact O-N 3.41Å |
| 131 | V | 80.2 | Confident | 81.1 | Confident | 39 Ų | 39 | 58.4 Ų | 58.4 | 24% | 0.236 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -88.4 | -39.6 | -178.7 | 171.7 | 0 | 0 | 0 | 0 | 111.4 | R127 L128 V129 R220 I221 | R127-V131 WeakPolarHBondContact O-CG2 3.41Å; R127-V131 PolarHBondContact O-N 2.96Å; L128-V131 PolarHBondContact O-N 2.97Å; L128-V131 VanDerWaalsContact O-N 3.16Å; V129-V131 VanDerWaalsContact C-N 3.3Å; V129-V131 PolarHBondContact O-N 3.43Å; V131-R220 HydrophobicContact CG1-CB 4.18Å; V131-R220 HydrophobicContact CG1-CG 3.9Å; V131-I221 HydrophobicContact CG1-CG1 4.41Å |
| 132 | V | 81.9 | Confident | 80.4 | Confident | 31 Ų | 31 | 58.7 Ų | 58.7 | 19% | 0.188 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -83.5 | -41.2 | -175.9 | -179.3 | 0 | 0 | 0 | 0 | 111.7 | L128 P134 R220 | L128-V132 HydrophobicContact CD1-CG2 3.61Å; L128-V132 HydrophobicContact CG-CG2 4.39Å; L128-V132 WeakPolarHBondContact O-CB 3.23Å; L128-V132 WeakPolarHBondContact O-CG2 3.45Å; L128-V132 PolarHBondContact O-N 3.13Å; V132-P134 VanDerWaalsContact C-CD 3.48Å; V132-P134 WeakPolarHBondContact O-CD 3.21Å; V132-R220 HydrophobicContact CG2-CG 4.43Å |
| 133 | W | 80.4 | Confident | 79.8 | Confident | 141 Ų | 141 | 64 Ų | 64 | 53% | 0.534 | 33% | 0.328 | S | S | . | . | trans | -127.2 | 64.1 | -175.1 | -59.7 | -67.6 | 0 | 0 | 0 | 113.4 | V129 Q135 R136 I137 | V129-W133 HydrophobicContact CG1-CE3 4.33Å; V129-W133 HydrophobicContact CG2-CE3 4.44Å; V129-W133 CarbonylContact O-C 3.58Å; V129-W133 WeakPolarHBondContact O-CA 2.96Å; V129-W133 PolarHBondContact O-N 2.93Å; W133-Q135 PolarHBondContact O-N 3.32Å; W133-Q135 VanDerWaalsContact O-N 3.14Å; W133-R136 HydrophobicContact CB-CB 4.23Å; W133-R136 PolarHBondContact O-N 2.99Å; W133-R136 VanDerWaalsContact O-N 3.14Å; W133-I137 PolarHBondContact O-N 2.99Å | ||
| 134 | P | 74.9 | Confident | 79.5 | Confident | 64 Ų | 64 | 73 Ų | 73 | 42% | 0.416 | 36% | 0.361 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.6 | -25.7 | -177.4 | 25.6 | -35.2 | 0 | 0 | 0 | 114 | V132 I137 | V132-P134 VanDerWaalsContact C-CD 3.48Å; V132-P134 WeakPolarHBondContact O-CD 3.21Å; P134-I137 WeakPolarHBondContact O-CG2 3.48Å |
| 135 | Q | 72.9 | Confident | 79.4 | Confident | 185 Ų | 185 | 77.5 Ų | 77.5 | 86% | 0.864 | 38% | 0.384 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.3 | -28.2 | 178.9 | -67.8 | 176.3 | -19.5 | 0 | 0 | 113.2 | W133 | W133-Q135 PolarHBondContact O-N 3.32Å; W133-Q135 VanDerWaalsContact O-N 3.14Å |
| 136 | R | 71.1 | Confident | 79.3 | Confident | 174 Ų | 174 | 75.4 Ų | 75.4 | 66% | 0.657 | 37% | 0.373 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.4 | -11.6 | -178.9 | -65.6 | -83.2 | -174.2 | 154 | -0.8 | 112.7 | W133 S138 V139 I140 | W133-R136 HydrophobicContact CB-CB 4.23Å; W133-R136 PolarHBondContact O-N 2.99Å; W133-R136 VanDerWaalsContact O-N 3.14Å; R136-S138 VanDerWaalsContact C-N 3.28Å; R136-S138 PolarHBondContact O-N 3.42Å; R136-V139 PolarHBondContact O-N 2.86Å; R136-V139 VanDerWaalsContact O-N 3.09Å; R136-I140 HydrophobicContact CB-CD1 3.7Å; R136-I140 HydrophobicContact CB-CG1 4.4Å; R136-I140 WeakPolarHBondContact O-CG1 3.32Å; R136-I140 PolarHBondContact O-N 3.22Å |
| 137 | I | 75.6 | Confident | 79.4 | Confident | 25 Ų | 25 | 78.7 Ų | 78.7 | 13% | 0.128 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -57.5 | -37.8 | -174 | -163.6 | 68.4 | 0 | 0 | 0 | 113.2 | Y126 V129 W133 P134 V139 I140 T141 | Y126-I137 HydrophobicContact CD2-CD1 4.27Å; Y126-I137 HydrophobicContact CE2-CD1 3.91Å; Y126-I137 HydrophobicContact CE2-CG1 4.35Å; V129-I137 HydrophobicContact CB-CD1 4.11Å; V129-I137 HydrophobicContact CG1-CD1 3.61Å; W133-I137 PolarHBondContact O-N 2.99Å; P134-I137 WeakPolarHBondContact O-CG2 3.48Å; I137-V139 VanDerWaalsContact C-N 3.26Å; I137-V139 PolarHBondContact O-N 2.79Å; I137-I140 PolarHBondContact O-N 2.75Å; I137-T141 WeakPolarHBondContact CD1-OG1 3.02Å; I137-T141 WeakPolarHBondContact CG1-OG1 3.49Å; I137-T141 WeakPolarHBondContact O-CA 3.31Å; I137-T141 VanDerWaalsContact O-CB 3.23Å; I137-T141 WeakPolarHBondContact O-CB 3.15Å; I137-T141 PolarHBondContact O-N 3.36Å; I137-T141 PolarHBondContact O-OG1 2.86Å |
| 138 | S | 68.3 | Low | 79.7 | Confident | 103 Ų | 103 | 85.8 Ų | 85.8 | 72% | 0.72 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -69.1 | -27.9 | -177.8 | -171.1 | 0 | 0 | 0 | 0 | 112.5 | R136 | R136-S138 VanDerWaalsContact C-N 3.28Å; R136-S138 PolarHBondContact O-N 3.42Å |
| 139 | V | 67.1 | Low | 80 | Confident | 120 Ų | 120 | 87.2 Ų | 87.2 | 73% | 0.727 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -84.4 | -43.9 | 179 | -177.9 | 0 | 0 | 0 | 0 | 110 | R136 I137 T141 | R136-V139 PolarHBondContact O-N 2.86Å; R136-V139 VanDerWaalsContact O-N 3.09Å; I137-V139 VanDerWaalsContact C-N 3.26Å; I137-V139 PolarHBondContact O-N 2.79Å; V139-T141 VanDerWaalsContact C-N 3.35Å |
| 140 | I | 67.8 | Low | 80.4 | Confident | 73 Ų | 73 | 86.5 Ų | 86.5 | 37% | 0.374 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -73 | -27.9 | -178.3 | -62.2 | 168.9 | 0 | 0 | 0 | 112 | V129 R136 I137 | V129-I140 HydrophobicContact CG1-CD1 4.22Å; V129-I140 HydrophobicContact CG1-CG2 4.49Å; R136-I140 HydrophobicContact CB-CD1 3.7Å; R136-I140 HydrophobicContact CB-CG1 4.4Å; R136-I140 WeakPolarHBondContact O-CG1 3.32Å; R136-I140 PolarHBondContact O-N 3.22Å; I137-I140 PolarHBondContact O-N 2.75Å |
| 141 | T | 73.6 | Confident | 81 | Confident | 26 Ų | 26 | 87.8 Ų | 87.8 | 16% | 0.16 | 44% | 0.439 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -114.4 | 34.8 | -171.6 | -20 | 0 | 0 | 0 | 0 | 112.9 | V64 Y126 I137 V139 I146 | V64-T141 HydrophobicContact CB-CG2 4.11Å; V64-T141 HydrophobicContact CG1-CG2 3.69Å; V64-T141 HydrophobicContact CG2-CG2 3.6Å; Y126-T141 HydrophobicContact CD2-CG2 3.74Å; Y126-T141 HydrophobicContact CE2-CG2 3.63Å; I137-T141 WeakPolarHBondContact CD1-OG1 3.02Å; I137-T141 WeakPolarHBondContact CG1-OG1 3.49Å; I137-T141 WeakPolarHBondContact O-CA 3.31Å; I137-T141 VanDerWaalsContact O-CB 3.23Å; I137-T141 WeakPolarHBondContact O-CB 3.15Å; I137-T141 PolarHBondContact O-N 3.36Å; I137-T141 PolarHBondContact O-OG1 2.86Å; V139-T141 VanDerWaalsContact C-N 3.35Å; T141-I146 HydrophobicContact CG2-CD1 3.83Å; T141-I146 HydrophobicContact CG2-CG1 3.79Å; T141-I146 WeakPolarHBondContact O-CD1 3.16Å |
| 142 | G | 79.1 | Confident | 81.7 | Confident | 29 Ų | 29 | 90 Ų | 90 | 30% | 0.299 | 45% | 0.452 | S | S | . | . | trans | -60.1 | 143.2 | 172.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | R144 M145 I146 | G142-R144 PolarHBondContact O-N 2.81Å; G142-R144 VanDerWaalsContact O-N 3.12Å; G142-M145 WeakPolarHBondContact O-CB 3.42Å; G142-M145 PolarHBondContact O-N 3.28Å; G142-I146 PolarHBondContact O-N 3.34Å; G142-I146 VanDerWaalsContact O-N 3.14Å | ||
| 143 | K | 80.4 | Confident | 82.4 | Confident | 143 Ų | 143 | 89.1 Ų | 89.1 | 62% | 0.622 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -49 | -44.4 | -177.3 | -172.5 | 176.7 | -178.7 | 179.2 | 0 | 112.6 | M145 I146 M147 | K143-M145 PolarHBondContact O-N 2.94Å; K143-I146 PolarHBondContact O-N 3.46Å; K143-M147 VanDerWaalsContact O-CG 3.31Å; K143-M147 WeakPolarHBondContact O-CG 3.38Å; K143-M147 PolarHBondContact O-N 3.18Å |
| 144 | R | 85.4 | Confident | 83.2 | Confident | 192 Ų | 192 | 85.9 Ų | 85.9 | 73% | 0.725 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -64.4 | -37.8 | 179.7 | -170 | 175 | -74.7 | 162.5 | -4.2 | 112.7 | G142 R148 | G142-R144 PolarHBondContact O-N 2.81Å; G142-R144 VanDerWaalsContact O-N 3.12Å; R144-R148 WeakPolarHBondContact O-CG 3.23Å; R144-R148 PolarHBondContact O-N 3.47Å; R144-R148 VanDerWaalsContact O-N 3.1Å |
| 145 | M | 87.8 | Confident | 84.2 | Confident | 96 Ų | 96 | 88.3 Ų | 88.3 | 47% | 0.473 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -68.6 | -43.4 | 178.1 | -175.6 | 164.4 | 173.6 | 0 | 0 | 111.3 | G142 K143 M147 R148 V149 | G142-M145 WeakPolarHBondContact O-CB 3.42Å; G142-M145 PolarHBondContact O-N 3.28Å; K143-M145 PolarHBondContact O-N 2.94Å; M145-M147 PolarHBondContact O-N 3.46Å; M145-R148 WeakPolarHBondContact O-CB 3.27Å; M145-R148 PolarHBondContact O-N 2.87Å; M145-V149 WeakPolarHBondContact O-CG2 3.41Å; M145-V149 PolarHBondContact O-N 3.24Å |
| 146 | I | 88.6 | Confident | 85.3 | Confident | 18 Ų | 18 | 84.6 Ų | 84.6 | 9% | 0.092 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -62.6 | -43.9 | 177.4 | -55 | 154.4 | 0 | 0 | 0 | 110.9 | V64 L67 T141 G142 K143 R148 V149 L150 | V64-I146 HydrophobicContact CB-CD1 3.88Å; V64-I146 HydrophobicContact CG1-CD1 3.63Å; V64-I146 HydrophobicContact CG1-CG1 4.01Å; V64-I146 HydrophobicContact CG1-CG2 4.24Å; V64-I146 HydrophobicContact CG2-CD1 3.24Å; V64-I146 HydrophobicContact CG2-CG1 4.38Å; L67-I146 HydrophobicContact CD2-CG2 3.79Å; T141-I146 HydrophobicContact CG2-CD1 3.83Å; T141-I146 HydrophobicContact CG2-CG1 3.79Å; T141-I146 WeakPolarHBondContact O-CD1 3.16Å; G142-I146 PolarHBondContact O-N 3.34Å; G142-I146 VanDerWaalsContact O-N 3.14Å; K143-I146 PolarHBondContact O-N 3.46Å; I146-R148 VanDerWaalsContact C-N 3.3Å; I146-R148 PolarHBondContact O-N 3.47Å; I146-V149 PolarHBondContact O-N 3.29Å; I146-L150 HydrophobicContact CG2-CD1 3.96Å; I146-L150 HydrophobicContact CG2-CG 4.35Å; I146-L150 WeakPolarHBondContact O-CB 3.3Å; I146-L150 WeakPolarHBondContact O-CG 2.96Å; I146-L150 PolarHBondContact O-N 3.3Å |
| 147 | M | 89.5 | Confident | 86.5 | Confident | 102 Ų | 102 | 76.5 Ų | 76.5 | 50% | 0.502 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -61.1 | -39.4 | 177.2 | -69.4 | -60.5 | -63.1 | 0 | 0 | 111.8 | L67 K143 M145 G151 | L67-M147 HydrophobicContact CD2-SD 3.86Å; K143-M147 VanDerWaalsContact O-CG 3.31Å; K143-M147 WeakPolarHBondContact O-CG 3.38Å; K143-M147 PolarHBondContact O-N 3.18Å; M145-M147 PolarHBondContact O-N 3.46Å; M147-G151 PolarHBondContact O-N 3.4Å |
| 148 | R | 92.8 | Very high | 87.4 | Confident | 172 Ų | 172 | 78.9 Ų | 78.9 | 65% | 0.649 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -63.6 | -47.7 | 173.2 | -73.2 | 176 | -174.1 | 168.5 | -1.4 | 111.8 | R144 M145 I146 L150 G151 V152 | R144-R148 WeakPolarHBondContact O-CG 3.23Å; R144-R148 PolarHBondContact O-N 3.47Å; R144-R148 VanDerWaalsContact O-N 3.1Å; M145-R148 WeakPolarHBondContact O-CB 3.27Å; M145-R148 PolarHBondContact O-N 2.87Å; I146-R148 VanDerWaalsContact C-N 3.3Å; I146-R148 PolarHBondContact O-N 3.47Å; R148-L150 VanDerWaalsContact C-N 3.31Å; R148-L150 PolarHBondContact O-N 3.14Å; R148-G151 PolarHBondContact O-N 3.44Å; R148-V152 WeakPolarHBondContact O-CG2 3.35Å; R148-V152 PolarHBondContact O-N 3.2Å |
| 149 | V | 93.7 | Very high | 88.7 | Confident | 63 Ų | 63 | 77.8 Ų | 77.8 | 38% | 0.382 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -59.4 | -43 | 178.3 | 168.5 | 0 | 0 | 0 | 0 | 110.9 | L122 M145 I146 M153 | L122-V149 HydrophobicContact CD2-CG1 3.69Å; L122-V149 HydrophobicContact CG-CG1 4.38Å; M145-V149 WeakPolarHBondContact O-CG2 3.41Å; M145-V149 PolarHBondContact O-N 3.24Å; I146-V149 PolarHBondContact O-N 3.29Å; V149-M153 VanDerWaalsContact O-CB 3.24Å; V149-M153 WeakPolarHBondContact O-CB 3.37Å; V149-M153 PolarHBondContact O-N 2.76Å |
| 150 | L | 94.1 | Very high | 90 | Very high | 6 Ų | 6 | 73 Ų | 73 | 3% | 0.031 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -64.2 | -44.4 | 175.2 | -75.8 | 169.9 | 0 | 0 | 0 | 112 | L67 L68 L119 L122 I146 R148 V152 M153 W154 | L67-L150 HydrophobicContact CD2-CD1 3.62Å; L67-L150 HydrophobicContact CG-CD1 3.86Å; L68-L150 HydrophobicContact CD2-CD2 3.99Å; L119-L150 HydrophobicContact CD2-CD2 3.72Å; L122-L150 HydrophobicContact CD2-CD2 4.49Å; I146-L150 HydrophobicContact CG2-CD1 3.96Å; I146-L150 HydrophobicContact CG2-CG 4.35Å; I146-L150 WeakPolarHBondContact O-CB 3.3Å; I146-L150 WeakPolarHBondContact O-CG 2.96Å; I146-L150 PolarHBondContact O-N 3.3Å; R148-L150 VanDerWaalsContact C-N 3.31Å; R148-L150 PolarHBondContact O-N 3.14Å; L150-V152 PolarHBondContact O-N 2.84Å; L150-M153 HydrophobicContact CD2-CE 3.72Å; L150-M153 PolarHBondContact O-N 2.95Å; L150-W154 WeakPolarHBondContact O-CB 3.48Å; L150-W154 PolarHBondContact O-N 3.46Å |
| 151 | G | 95 | Very high | 91.2 | Very high | 42 Ų | 42 | 69.5 Ų | 69.5 | 43% | 0.433 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -60.1 | -45.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | M147 R148 W154 L155 | M147-G151 PolarHBondContact O-N 3.4Å; R148-G151 PolarHBondContact O-N 3.44Å; G151-W154 PolarHBondContact O-N 3.01Å; G151-L155 WeakPolarHBondContact O-CB 3.28Å; G151-L155 PolarHBondContact O-N 3.18Å |
| 152 | V | 96.1 | Very high | 92.2 | Very high | 85 Ų | 85 | 71.8 Ų | 71.8 | 52% | 0.515 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -63.6 | -43.7 | 175.3 | 172.6 | 0 | 0 | 0 | 0 | 110.9 | R148 L150 L155 L156 | R148-V152 WeakPolarHBondContact O-CG2 3.35Å; R148-V152 PolarHBondContact O-N 3.2Å; L150-V152 PolarHBondContact O-N 2.84Å; V152-L155 PolarHBondContact O-N 3.42Å; V152-L156 HydrophobicContact CG1-CD1 3.88Å; V152-L156 HydrophobicContact CG1-CG 4.27Å; V152-L156 WeakPolarHBondContact O-CB 3.19Å; V152-L156 VanDerWaalsContact O-CG 3.28Å; V152-L156 WeakPolarHBondContact O-CG 3.48Å; V152-L156 PolarHBondContact O-N 2.79Å |
| 153 | M | 95.9 | Very high | 92.7 | Very high | 12 Ų | 12 | 71.7 Ų | 71.7 | 6% | 0.059 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -60.8 | -47.3 | 178.1 | 179.2 | -82.2 | -63.4 | 0 | 0 | 111.6 | Q118 L119 V149 L150 L155 L156 V157 | Q118-M153 HydrophobicContact CB-CG 3.89Å; Q118-M153 HydrophobicContact CB-SD 4.13Å; L119-M153 HydrophobicContact CD1-CE 4.39Å; L119-M153 HydrophobicContact CD2-CE 3.51Å; L119-M153 HydrophobicContact CG-CE 3.75Å; V149-M153 VanDerWaalsContact O-CB 3.24Å; V149-M153 WeakPolarHBondContact O-CB 3.37Å; V149-M153 PolarHBondContact O-N 2.76Å; L150-M153 HydrophobicContact CD2-CE 3.72Å; L150-M153 PolarHBondContact O-N 2.95Å; M153-L155 VanDerWaalsContact C-N 3.35Å; M153-L155 PolarHBondContact O-N 3.41Å; M153-L156 PolarHBondContact O-N 3.42Å; M153-V157 WeakPolarHBondContact O-CB 3.5Å; M153-V157 VanDerWaalsContact O-CG2 3.25Å; M153-V157 WeakPolarHBondContact O-CG2 3.45Å; M153-V157 PolarHBondContact O-N 2.94Å; M153-V157 HydrophobicContact SD-CG2 3.77Å |
| 154 | W | 96.6 | Very high | 93 | Very high | 74 Ų | 74 | 65.2 Ų | 65.2 | 28% | 0.28 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -60.4 | -43.3 | 176.1 | -84.6 | 111 | 0 | 0 | 0 | 112 | N71 A75 A115 L150 G151 V157 M158 | N71-W154 PolarHBondContact OD1-NE1 2.89Å; A75-W154 HydrophobicContact CB-CH2 4.14Å; A115-W154 HydrophobicContact CB-CH2 4.12Å; A115-W154 HydrophobicContact CB-CZ3 4.11Å; L150-W154 WeakPolarHBondContact O-CB 3.48Å; L150-W154 PolarHBondContact O-N 3.46Å; G151-W154 PolarHBondContact O-N 3.01Å; W154-V157 PolarHBondContact O-N 3.06Å; W154-M158 VanDerWaalsContact O-CG 3.23Å; W154-M158 WeakPolarHBondContact O-CG 3.49Å; W154-M158 PolarHBondContact O-N 2.78Å |
| 155 | L | 96.9 | Very high | 93.3 | Very high | 115 Ų | 115 | 58.8 Ų | 58.8 | 60% | 0.602 | 31% | 0.311 | S | S | * | . | H | α-helix | trans | -59.7 | -48.2 | 175.2 | 179.8 | 64.3 | 0 | 0 | 0 | 111.4 | G151 V152 M153 V157 M158 V159 | G151-L155 WeakPolarHBondContact O-CB 3.28Å; G151-L155 PolarHBondContact O-N 3.18Å; V152-L155 PolarHBondContact O-N 3.42Å; M153-L155 VanDerWaalsContact C-N 3.35Å; M153-L155 PolarHBondContact O-N 3.41Å; L155-V157 VanDerWaalsContact C-N 3.33Å; L155-V157 PolarHBondContact O-N 3.19Å; L155-M158 PolarHBondContact O-N 3.07Å; L155-V159 HydrophobicContact CD1-CG2 4.31Å; L155-V159 WeakPolarHBondContact O-CG2 3.26Å; L155-V159 PolarHBondContact O-N 2.93Å |
| 156 | L | 95.6 | Very high | 93.4 | Very high | 106 Ų | 106 | 59.4 Ų | 59.4 | 56% | 0.555 | 32% | 0.315 | S | S | * | . | H | α-helix | trans | -60.6 | -41.8 | 178.3 | -72.4 | 172.2 | 0 | 0 | 0 | 111.9 | V152 M153 V159 A160 | V152-L156 HydrophobicContact CG1-CD1 3.88Å; V152-L156 HydrophobicContact CG1-CG 4.27Å; V152-L156 WeakPolarHBondContact O-CB 3.19Å; V152-L156 VanDerWaalsContact O-CG 3.28Å; V152-L156 WeakPolarHBondContact O-CG 3.48Å; V152-L156 PolarHBondContact O-N 2.79Å; M153-L156 PolarHBondContact O-N 3.42Å; L156-V159 PolarHBondContact O-N 3.46Å; L156-A160 WeakPolarHBondContact O-CB 3.47Å; L156-A160 PolarHBondContact O-N 3.44Å |
| 157 | V | 95.8 | Very high | 93.4 | Very high | 4 Ų | 4 | 60.5 Ų | 60.5 | 2% | 0.024 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -61.3 | -45.5 | 176.9 | 163.2 | 0 | 0 | 0 | 0 | 111.3 | A111 A115 Q118 M153 W154 L155 A160 S161 | A111-V157 HydrophobicContact CB-CG1 4.08Å; A111-V157 WeakPolarHBondContact O-CG1 3.44Å; A115-V157 HydrophobicContact CB-CG1 4.15Å; A115-V157 HydrophobicContact CB-CG2 4.48Å; Q118-V157 HydrophobicContact CG-CG2 4.42Å; M153-V157 WeakPolarHBondContact O-CB 3.5Å; M153-V157 VanDerWaalsContact O-CG2 3.25Å; M153-V157 WeakPolarHBondContact O-CG2 3.45Å; M153-V157 PolarHBondContact O-N 2.94Å; M153-V157 HydrophobicContact SD-CG2 3.77Å; W154-V157 PolarHBondContact O-N 3.06Å; L155-V157 VanDerWaalsContact C-N 3.33Å; L155-V157 PolarHBondContact O-N 3.19Å; V157-A160 PolarHBondContact O-N 3.35Å; V157-S161 WeakPolarHBondContact O-CB 3.46Å; V157-S161 PolarHBondContact O-N 2.88Å; V157-S161 VanDerWaalsContact O-N 3.12Å; V157-S161 PolarHBondContact O-OG 3.44Å |
| 158 | M | 95.2 | Very high | 93.4 | Very high | 76 Ų | 76 | 56.8 Ų | 56.8 | 37% | 0.374 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -64.3 | -46.2 | 179 | -67.7 | -65.1 | -83.6 | 0 | 0 | 110.8 | Y107 A111 W154 L155 S161 | Y107-M158 HydrophobicContact CE1-CE 3.81Å; Y107-M158 HydrophobicContact CE1-SD 4.07Å; Y107-M158 WeakPolarHBondContact OH-CA 3.06Å; Y107-M158 WeakPolarHBondContact OH-CB 3.26Å; Y107-M158 VanDerWaalsContact OH-CE 3.26Å; Y107-M158 WeakPolarHBondContact OH-CE 3.34Å; Y107-M158 PolarHBondContact OH-O 3.36Å; Y107-M158 PolarHBondContact OH-SD 3.21Å; Y107-M158 VanDerWaalsContact OH-SD 3.36Å; A111-M158 HydrophobicContact CB-SD 4.34Å; W154-M158 VanDerWaalsContact O-CG 3.23Å; W154-M158 WeakPolarHBondContact O-CG 3.49Å; W154-M158 PolarHBondContact O-N 2.78Å; L155-M158 PolarHBondContact O-N 3.07Å; M158-S161 PolarHBondContact O-N 3.26Å |
| 159 | V | 95.4 | Very high | 93.2 | Very high | 80 Ų | 80 | 50.3 Ų | 50.3 | 49% | 0.485 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -63 | -45.5 | 177.6 | 173.3 | 0 | 0 | 0 | 0 | 111.7 | L155 L156 S161 I162 | L155-V159 HydrophobicContact CD1-CG2 4.31Å; L155-V159 WeakPolarHBondContact O-CG2 3.26Å; L155-V159 PolarHBondContact O-N 2.93Å; L156-V159 PolarHBondContact O-N 3.46Å; V159-S161 PolarHBondContact O-N 3.43Å; V159-I162 HydrophobicContact CB-CD1 4.43Å; V159-I162 HydrophobicContact CG1-CD1 4.29Å; V159-I162 WeakPolarHBondContact O-CB 3.25Å; V159-I162 VanDerWaalsContact O-CG1 3.27Å; V159-I162 WeakPolarHBondContact O-CG1 3.41Å; V159-I162 PolarHBondContact O-N 2.89Å; V159-I162 VanDerWaalsContact O-N 3.15Å |
| 160 | A | 93.9 | Very high | 93 | Very high | 19 Ų | 19 | 48.1 Ų | 48.1 | 16% | 0.157 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -64.3 | -20.4 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | Y114 L156 V157 P163 L201 | Y114-A160 HydrophobicContact CD2-CB 4.07Å; Y114-A160 HydrophobicContact CE2-CB 3.89Å; L156-A160 WeakPolarHBondContact O-CB 3.47Å; L156-A160 PolarHBondContact O-N 3.44Å; V157-A160 PolarHBondContact O-N 3.35Å; A160-P163 WeakPolarHBondContact O-CD 3.39Å; A160-L201 HydrophobicContact CB-CD1 3.96Å |
| 161 | S | 94.3 | Very high | 92.7 | Very high | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -86.4 | -11.7 | 179.1 | -55.9 | 0 | 0 | 0 | 0 | 113.3 | Y107 A111 Y114 V157 M158 V159 P163 A164 | Y107-S161 VanDerWaalsContact CD2-O 3.28Å; Y107-S161 WeakPolarHBondContact CD2-O 3.45Å; A111-S161 VanDerWaalsContact CA-OG 3.22Å; A111-S161 WeakPolarHBondContact CA-OG 3.25Å; A111-S161 PolarHBondContact N-OG 2.83Å; Y114-S161 WeakPolarHBondContact CD2-OG 3.32Å; V157-S161 WeakPolarHBondContact O-CB 3.46Å; V157-S161 PolarHBondContact O-N 2.88Å; V157-S161 VanDerWaalsContact O-N 3.12Å; V157-S161 PolarHBondContact O-OG 3.44Å; M158-S161 PolarHBondContact O-N 3.26Å; V159-S161 PolarHBondContact O-N 3.43Å; S161-P163 VanDerWaalsContact C-N 3.34Å; S161-A164 WeakPolarHBondContact O-CB 3.34Å; S161-A164 PolarHBondContact O-N 3.01Å |
| 162 | I | 93.1 | Very high | 92.2 | Very high | 73 Ų | 73 | 55.8 Ų | 55.8 | 37% | 0.374 | 29% | 0.288 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -52.5 | -40.2 | -177.6 | -68.3 | 171.7 | 0 | 0 | 0 | 113.9 | V159 A164 L165 I166 | V159-I162 HydrophobicContact CB-CD1 4.43Å; V159-I162 HydrophobicContact CG1-CD1 4.29Å; V159-I162 WeakPolarHBondContact O-CB 3.25Å; V159-I162 VanDerWaalsContact O-CG1 3.27Å; V159-I162 WeakPolarHBondContact O-CG1 3.41Å; V159-I162 PolarHBondContact O-N 2.89Å; V159-I162 VanDerWaalsContact O-N 3.15Å; I162-A164 PolarHBondContact O-N 3.25Å; I162-A164 VanDerWaalsContact O-N 3.07Å; I162-L165 WeakPolarHBondContact O-CB 3.4Å; I162-L165 PolarHBondContact O-N 3.31Å; I162-I166 HydrophobicContact CG2-CD1 3.89Å; I162-I166 HydrophobicContact CG2-CG1 4.29Å; I162-I166 PolarHBondContact O-N 3.47Å |
| 163 | P | 89.6 | Confident | 91.5 | Very high | 28 Ų | 28 | 54.2 Ų | 54.2 | 18% | 0.182 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -53.4 | -33 | 177.8 | -29.2 | 37.3 | 0 | 0 | 0 | 113.3 | A160 S161 L165 I166 Y167 Q194 | A160-P163 WeakPolarHBondContact O-CD 3.39Å; S161-P163 VanDerWaalsContact C-N 3.34Å; P163-L165 VanDerWaalsContact C-N 3.27Å; P163-L165 PolarHBondContact O-N 3.45Å; P163-I166 PolarHBondContact O-N 2.87Å; P163-Y167 HydrophobicContact CB-CD2 4.11Å; P163-Y167 HydrophobicContact CB-CE2 4.13Å; P163-Y167 VanDerWaalsContact O-CD2 3.22Å; P163-Y167 WeakPolarHBondContact O-CD2 3.4Å; P163-Y167 PolarHBondContact O-N 3.28Å; P163-Q194 HydrophobicContact CB-CG 4.11Å |
| 164 | A | 88.4 | Confident | 90.5 | Very high | 7 Ų | 7 | 62.5 Ų | 62.5 | 6% | 0.058 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -67.1 | -22.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | L110 S161 I162 R168 | L110-A164 HydrophobicContact CB-CB 4.39Å; L110-A164 HydrophobicContact CD2-CB 3.66Å; S161-A164 WeakPolarHBondContact O-CB 3.34Å; S161-A164 PolarHBondContact O-N 3.01Å; I162-A164 PolarHBondContact O-N 3.25Å; I162-A164 VanDerWaalsContact O-N 3.07Å; A164-R168 WeakPolarHBondContact O-CB 3.3Å |
| 165 | L | 90.1 | Very high | 89.6 | Confident | 56 Ų | 56 | 64.9 Ų | 64.9 | 29% | 0.293 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -79.8 | -32 | 172.2 | -71.2 | 170 | 0 | 0 | 0 | 112.4 | K103 Y107 I162 P163 | K103-L165 HydrophobicContact CB-CD2 3.9Å; K103-L165 WeakPolarHBondContact CD-O 3.2Å; K103-L165 WeakPolarHBondContact CE-O 3.16Å; Y107-L165 HydrophobicContact CD2-CD1 3.56Å; Y107-L165 HydrophobicContact CD2-CD2 4.14Å; Y107-L165 HydrophobicContact CD2-CG 3.45Å; Y107-L165 VanDerWaalsContact CD2-CG 3.45Å; Y107-L165 HydrophobicContact CE2-CD1 3.74Å; Y107-L165 HydrophobicContact CE2-CG 4.15Å; Y107-L165 HydrophobicContact CG-CD1 3.96Å; Y107-L165 HydrophobicContact CG-CD2 3.88Å; Y107-L165 HydrophobicContact CG-CG 3.73Å; I162-L165 WeakPolarHBondContact O-CB 3.4Å; I162-L165 PolarHBondContact O-N 3.31Å; P163-L165 VanDerWaalsContact C-N 3.27Å; P163-L165 PolarHBondContact O-N 3.45Å |
| 166 | I | 90 | Very high | 88.3 | Confident | 110 Ų | 110 | 62.9 Ų | 62.9 | 56% | 0.564 | 32% | 0.315 | S | S | * | . | H | α-helix | trans | -76.2 | -54.3 | -175.5 | -61.7 | 174.8 | 0 | 0 | 0 | 109.7 | I162 P163 | I162-I166 HydrophobicContact CG2-CD1 3.89Å; I162-I166 HydrophobicContact CG2-CG1 4.29Å; I162-I166 PolarHBondContact O-N 3.47Å; P163-I166 PolarHBondContact O-N 2.87Å |
| 167 | Y | 89.1 | Confident | 87.7 | Confident | 41 Ų | 41 | 64.1 Ų | 64.1 | 16% | 0.161 | 32% | 0.322 | C | S | . | . | S | Bend | trans | -86.8 | -9.4 | -170.9 | -59.7 | -66.1 | 0 | 0 | 0 | 114 | P163 S183 F184 H185 D190 Q194 | P163-Y167 HydrophobicContact CB-CD2 4.11Å; P163-Y167 HydrophobicContact CB-CE2 4.13Å; P163-Y167 VanDerWaalsContact O-CD2 3.22Å; P163-Y167 WeakPolarHBondContact O-CD2 3.4Å; P163-Y167 PolarHBondContact O-N 3.28Å; Y167-S183 CarbonylContact O-C 3.54Å; Y167-S183 WeakPolarHBondContact O-CA 3.22Å; Y167-F184 PolarHBondContact O-N 3.42Å; Y167-H185 AromaticContact CD1-CD2 3.63Å; Y167-H185 AromaticContact CD2-NE2 3.94Å; Y167-H185 AromaticContact CG-CD2 3.67Å; Y167-H185 AromaticContact CG-NE2 3.67Å; Y167-D190 HydrophobicContact CE1-CB 3.67Å; Y167-D190 PolarHBondContact OH-OD1 3.07Å; Y167-Q194 HydrophobicContact CD2-CB 4.42Å; Y167-Q194 HydrophobicContact CE2-CB 4.43Å |
| 168 | R | 90.2 | Very high | 87.1 | Confident | 23 Ų | 23 | 68.8 Ų | 68.8 | 9% | 0.087 | 34% | 0.339 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.2 | 134.1 | -179.3 | -153 | 86.2 | -179.2 | -170.9 | 6.4 | 111.1 | K103 F106 A164 C181 S183 | K103-R168 WeakPolarHBondContact CE-O 3.36Å; K103-R168 WeakPolarHBondContact CG-O 3.39Å; F106-R168 HydrophobicContact CB-CG 4.19Å; F106-R168 HydrophobicContact CD2-CG 4.44Å; F106-R168 HydrophobicContact CG-CG 4.4Å; F106-R168 VanDerWaalsContact CZ-NH2 3.27Å; A164-R168 WeakPolarHBondContact O-CB 3.3Å; R168-C181 PolarHBondContact NH2-O 2.91Å; R168-S183 PolarHBondContact NH1-OG 2.89Å |
| 169 | D | 89.3 | Confident | 86.7 | Confident | 37 Ų | 37 | 67 Ų | 67 | 20% | 0.198 | 33% | 0.333 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -146.9 | 156.8 | 178.9 | -156.9 | 2.7 | 0 | 0 | 0 | 111.6 | T99 R171 C181 D182 F184 | T99-D169 WeakPolarHBondContact CG2-OD1 3.15Å; D169-R171 HydrophobicContact CB-CG 4.22Å; D169-R171 IonicContact OD2-CZ 3.35Å; D169-R171 IonicContact OD2-NE 2.77Å; D169-R171 PolarHBondContact OD2-NE 3.07Å; D169-R171 IonicContact OD2-NH2 3.04Å; D169-R171 PolarHBondContact OD2-NH2 3.45Å; D169-C181 WeakPolarHBondContact O-CA 3.49Å; D169-D182 PolarHBondContact N-O 3.5Å; D169-D182 PolarHBondContact O-N 3.4Å; D169-D182 VanDerWaalsContact O-N 3.11Å; D169-F184 HydrophobicContact CB-CD2 3.7Å; D169-F184 HydrophobicContact CB-CE2 4.11Å; D169-F184 WeakPolarHBondContact O-CE2 3.45Å |
| 170 | A | 89.2 | Confident | 86.2 | Confident | 17 Ų | 17 | 64.6 Ų | 64.6 | 14% | 0.14 | 32% | 0.318 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.1 | 107.1 | 173.8 | 0 | 0 | 0 | 0 | 0 | 108.6 | C102 T179 V180 | C102-A170 HydrophobicContact CB-CB 4.07Å; A170-T179 HydrophobicContact CB-CG2 4.32Å; A170-V180 WeakPolarHBondContact CA-O 3.5Å |
| 171 | R | 87.5 | Confident | 85.8 | Confident | 108 Ų | 108 | 64 Ų | 64 | 41% | 0.408 | 31% | 0.312 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.8 | 145.8 | -175.4 | -60.4 | -172.6 | -178 | 177.1 | 2.4 | 111.6 | D169 N173 V180 F184 | D169-R171 HydrophobicContact CB-CG 4.22Å; D169-R171 IonicContact OD2-CZ 3.35Å; D169-R171 IonicContact OD2-NE 2.77Å; D169-R171 PolarHBondContact OD2-NE 3.07Å; D169-R171 IonicContact OD2-NH2 3.04Å; D169-R171 PolarHBondContact OD2-NH2 3.45Å; R171-N173 PolarHBondContact O-N 2.92Å; R171-V180 PolarHBondContact N-O 3.25Å; R171-V180 PolarHBondContact O-N 2.89Å; R171-F184 HydrophobicContact CB-CE2 4.02Å; R171-F184 HydrophobicContact CB-CZ 3.76Å; R171-F184 HydrophobicContact CG-CD2 4.26Å; R171-F184 HydrophobicContact CG-CE2 3.71Å; R171-F184 HydrophobicContact CG-CZ 3.87Å |
| 172 | L | 84 | Confident | 85.3 | Confident | 100 Ų | 100 | 66.9 Ų | 66.9 | 52% | 0.524 | 33% | 0.328 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.5 | 117.2 | 172.1 | -177.4 | 68.8 | 0 | 0 | 0 | 109.5 | K174 | L172-K174 PolarHBondContact O-N 3.48Å |
| 173 | N | 81.1 | Confident | 84.9 | Confident | 52 Ų | 52 | 64.2 Ų | 64.2 | 28% | 0.278 | 32% | 0.316 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.2 | 101.2 | 170.3 | -171.8 | -28.8 | 0 | 0 | 0 | 109 | R171 N175 R176 N177 R178 V180 | R171-N173 PolarHBondContact O-N 2.92Å; N173-N175 PolarHBondContact O-N 3.29Å; N173-N175 PolarHBondContact OD1-N 3.43Å; N173-R176 PolarHBondContact O-N 3.4Å; N173-N177 PolarHBondContact O-N 3.39Å; N173-R178 WeakPolarHBondContact CB-O 3.27Å; N173-R178 PolarHBondContact N-O 2.99Å; N173-V180 HydrophobicContact CB-CG2 4.22Å |
| 174 | K | 76 | Confident | 84.5 | Confident | 187 Ų | 187 | 65.8 Ų | 65.8 | 81% | 0.813 | 32% | 0.32 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.5 | -34.6 | -177.8 | -66.7 | -174.8 | 179.4 | -178.7 | 0 | 113.1 | L172 R176 | L172-K174 PolarHBondContact O-N 3.48Å; K174-R176 VanDerWaalsContact C-N 3.27Å; K174-R176 PolarHBondContact O-N 3.38Å |
| 175 | N | 75.9 | Confident | 84.3 | Confident | 124 Ų | 124 | 67.1 Ų | 67.1 | 66% | 0.663 | 33% | 0.325 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.3 | -24.7 | -178.3 | -64.8 | 1.3 | 0 | 0 | 0 | 112.7 | N173 | N173-N175 PolarHBondContact O-N 3.29Å; N173-N175 PolarHBondContact OD1-N 3.43Å |
| 176 | R | 70.6 | Confident | 83.7 | Confident | 73 Ų | 73 | 71.3 Ų | 71.3 | 28% | 0.275 | 35% | 0.348 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -117 | -2 | -174.9 | -65.7 | -173.8 | 170.8 | 175.1 | -5.9 | 113.7 | S22 N173 K174 R178 | S22-R176 PolarHBondContact O-NH1 3Å; S22-R176 PolarHBondContact O-NH2 3.19Å; S22-R176 PolarHBondContact OG-NH1 3.21Å; N173-R176 PolarHBondContact O-N 3.4Å; K174-R176 VanDerWaalsContact C-N 3.27Å; K174-R176 PolarHBondContact O-N 3.38Å; R176-R178 WeakPolarHBondContact O-CG 3.3Å; R176-R178 PolarHBondContact O-N 3.44Å |
| 177 | N | 83 | Confident | 83.3 | Confident | 132 Ų | 132 | 72.8 Ų | 72.8 | 71% | 0.706 | 35% | 0.35 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 46.9 | 42 | -173.8 | -159.8 | 34.3 | 0 | 0 | 0 | 113.3 | N173 | N173-N177 PolarHBondContact O-N 3.39Š|
| 178 | R | 83.7 | Confident | 83.2 | Confident | 101 Ų | 101 | 73 Ų | 73 | 38% | 0.381 | 35% | 0.354 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.8 | 144 | -176.5 | -72.5 | 169.1 | -174.9 | -161.7 | 2.5 | 110.4 | M93 N173 R176 | M93-R178 WeakPolarHBondContact O-CD 3.22Å; M93-R178 PolarHBondContact SD-NH1 3.12Å; N173-R178 WeakPolarHBondContact CB-O 3.27Å; N173-R178 PolarHBondContact N-O 2.99Å; R176-R178 WeakPolarHBondContact O-CG 3.3Å; R176-R178 PolarHBondContact O-N 3.44Å |
| 179 | T | 85.7 | Confident | 83.1 | Confident | 40 Ų | 40 | 76.2 Ų | 76.2 | 25% | 0.245 | 38% | 0.378 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.7 | 126.3 | 175 | -52.9 | 0 | 0 | 0 | 0 | 109 | D94 W95 A170 | D94-T179 WeakPolarHBondContact OD1-CA 3.22Å; D94-T179 PolarHBondContact OD1-N 3.14Å; W95-T179 HydrophobicContact CB-CG2 4.19Å; W95-T179 WeakPolarHBondContact CB-O 3.34Å; W95-T179 PolarHBondContact N-O 3.13Å; W95-T179 WeakPolarHBondContact O-CB 3.49Å; W95-T179 WeakPolarHBondContact O-CG2 3.47Å; A170-T179 HydrophobicContact CB-CG2 4.32Å |
| 180 | V | 85.5 | Confident | 83 | Confident | 29 Ų | 29 | 76.4 Ų | 76.4 | 18% | 0.176 | 38% | 0.379 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.5 | 142.9 | 176.9 | -65.2 | 0 | 0 | 0 | 0 | 110.1 | A170 R171 N173 | A170-V180 WeakPolarHBondContact CA-O 3.5Å; R171-V180 PolarHBondContact N-O 3.25Å; R171-V180 PolarHBondContact O-N 2.89Å; N173-V180 HydrophobicContact CB-CG2 4.22Å |
| 181 | C | 86.2 | Confident | 83 | Confident | 5 Ų | 5 | 76.3 Ų | 76.3 | 3% | 0.034 | 38% | 0.376 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.1 | 101 | 171.5 | 174.1 | 0 | 0 | 0 | 0 | 109.1 | W95 C102 F106 R168 D169 | W95-C181 HydrophobicContact CD2-CB 3.79Å; W95-C181 HydrophobicContact CE3-CB 3.94Å; W95-C181 HydrophobicContact CG-CB 4.01Å; C102-C181 VanDerWaalsContact CA-SG 3.52Å; C102-C181 HydrophobicContact CB-CB 3.81Å; C102-C181 WeakPolarHBondContact CB-SG 3.38Å; C102-C181 WeakPolarHBondContact SG-CB 3.5Å; C102-C181 CovalentContact SG-SG 2.01Å; C102-C181 PolarHBondContact SG-SG 3.31Å; F106-C181 WeakPolarHBondContact CD2-SG 3.44Å; F106-C181 HydrophobicContact CE2-CB 4.18Å; F106-C181 WeakPolarHBondContact CE2-SG 3.44Å; R168-C181 PolarHBondContact NH2-O 2.91Å; D169-C181 WeakPolarHBondContact O-CA 3.49Å |
| 182 | D | 83.6 | Confident | 83.1 | Confident | 62 Ų | 62 | 72.7 Ų | 72.7 | 33% | 0.332 | 37% | 0.366 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.7 | 170.2 | -175.3 | -149.1 | -10 | 0 | 0 | 0 | 112 | D169 F184 | D169-D182 PolarHBondContact N-O 3.5Å; D169-D182 PolarHBondContact O-N 3.4Å; D169-D182 VanDerWaalsContact O-N 3.11Å; D182-F184 HydrophobicContact CB-CE2 4.19Å; D182-F184 HydrophobicContact CB-CZ 4.28Å; D182-F184 WeakPolarHBondContact O-CD2 3.3Å |
| 183 | S | 83.7 | Confident | 83.5 | Confident | 17 Ų | 17 | 73.1 Ų | 73.1 | 12% | 0.119 | 37% | 0.368 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.5 | 125.1 | 173.6 | -44.1 | 0 | 0 | 0 | 0 | 109.2 | Y167 R168 | Y167-S183 CarbonylContact O-C 3.54Å; Y167-S183 WeakPolarHBondContact O-CA 3.22Å; R168-S183 PolarHBondContact NH1-OG 2.89Å |
| 184 | F | 81.7 | Confident | 83.9 | Confident | 60 Ų | 60 | 70.9 Ų | 70.9 | 26% | 0.263 | 36% | 0.356 | S | S | . | . | trans | -113.5 | 113.4 | 175.5 | -63 | -84.4 | 0 | 0 | 0 | 108.2 | Y167 D169 R171 D182 | Y167-F184 PolarHBondContact O-N 3.42Å; D169-F184 HydrophobicContact CB-CD2 3.7Å; D169-F184 HydrophobicContact CB-CE2 4.11Å; D169-F184 WeakPolarHBondContact O-CE2 3.45Å; R171-F184 HydrophobicContact CB-CE2 4.02Å; R171-F184 HydrophobicContact CB-CZ 3.76Å; R171-F184 HydrophobicContact CG-CD2 4.26Å; R171-F184 HydrophobicContact CG-CE2 3.71Å; R171-F184 HydrophobicContact CG-CZ 3.87Å; D182-F184 HydrophobicContact CB-CE2 4.19Å; D182-F184 HydrophobicContact CB-CZ 4.28Å; D182-F184 WeakPolarHBondContact O-CD2 3.3Å | ||
| 185 | H | 83.9 | Confident | 84.6 | Confident | 36 Ų | 36 | 62.1 Ų | 62.1 | 17% | 0.167 | 32% | 0.318 | C | S | . | . | trans | -108.2 | 125.4 | 174.6 | -60.1 | 91.5 | 0 | 0 | 0 | 108.2 | Y167 K187 D190 V191 Q194 Y195 | Y167-H185 AromaticContact CD1-CD2 3.63Å; Y167-H185 AromaticContact CD2-NE2 3.94Å; Y167-H185 AromaticContact CG-CD2 3.67Å; Y167-H185 AromaticContact CG-NE2 3.67Å; H185-K187 VanDerWaalsContact C-N 3.3Å; H185-D190 HydrophobicContact CB-CB 4.34Å; H185-V191 HydrophobicContact CB-CG2 3.37Å; H185-V191 VanDerWaalsContact CG-CG2 3.47Å; H185-Q194 PolarHBondContact CE1-OE1 2.95Å; H185-Q194 PolarHBondContact NE2-OE1 2.86Å; H185-Y195 AromaticContact CE1-CE2 3.63Å; H185-Y195 AromaticContact CE1-CZ 3.97Å | ||
| 186 | D | 77.4 | Confident | 85.4 | Confident | 143 Ų | 143 | 60.1 Ų | 60.1 | 77% | 0.765 | 31% | 0.306 | S | S | * | . | S | Bend | trans | -76.6 | -23.2 | 179.8 | -64 | -36.2 | 0 | 0 | 0 | 111.7 | ||
| 187 | K | 83.1 | Confident | 86.5 | Confident | 142 Ų | 142 | 59.3 Ų | 59.3 | 62% | 0.617 | 31% | 0.307 | S | S | * | . | S | Bend | trans | -136.8 | 145.2 | -178.7 | -50.1 | 178.8 | -179.9 | 172.3 | 0 | 111.6 | H185 P189 D190 | H185-K187 VanDerWaalsContact C-N 3.3Å; K187-P189 VanDerWaalsContact C-CD 3.44Å; K187-P189 VanDerWaalsContact C-N 3.33Å; K187-D190 WeakPolarHBondContact O-CB 3.03Å; K187-D190 PolarHBondContact O-N 3.39Å |
| 188 | D | 85.1 | Confident | 87 | Confident | 45 Ų | 45 | 53.2 Ų | 53.2 | 24% | 0.241 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -55 | -37.6 | 175.8 | -75.3 | -22.8 | 0 | 0 | 0 | 113.8 | D190 V191 V192 A261 R270 | D188-D190 VanDerWaalsContact C-N 3.28Å; D188-D190 PolarHBondContact O-N 3.44Å; D188-V191 WeakPolarHBondContact O-CB 3.31Å; D188-V191 PolarHBondContact O-N 3.48Å; D188-V192 WeakPolarHBondContact O-CG2 3.37Å; D188-V192 PolarHBondContact O-N 2.85Å; D188-V192 VanDerWaalsContact O-N 3.08Å; D188-A261 HydrophobicContact CB-CB 4.16Å; D188-R270 IonicContact OD1-CZ 3.56Å; D188-R270 IonicContact OD1-NH1 2.91Å; D188-R270 IonicContact OD1-NH2 3.3Å; D188-R270 PolarHBondContact OD1-NH2 2.93Å; D188-R270 IonicContact OD2-CZ 3.96Å; D188-R270 IonicContact OD2-NH1 2.86Å; D188-R270 PolarHBondContact OD2-NH1 3.11Å; D188-R270 IonicContact OD2-NH2 3.31Å; D188-R270 PolarHBondContact OD2-NH2 3.29Å |
| 189 | P | 88.8 | Confident | 87.4 | Confident | 91 Ų | 91 | 48.8 Ų | 48.8 | 59% | 0.591 | 26% | 0.258 | S | S | * | . | H | α-helix | trans | -60 | -31.9 | 173.9 | -27.1 | 36.6 | 0 | 0 | 0 | 114.7 | K187 V192 L193 | K187-P189 VanDerWaalsContact C-CD 3.44Å; K187-P189 VanDerWaalsContact C-N 3.33Å; P189-V192 PolarHBondContact O-N 2.82Å; P189-L193 WeakPolarHBondContact O-CB 3.37Å; P189-L193 PolarHBondContact O-N 3.45Å |
| 190 | D | 88.2 | Confident | 87.9 | Confident | 41 Ų | 41 | 49.6 Ų | 49.6 | 22% | 0.219 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -69.3 | -38 | 177.9 | -67.3 | -51.6 | 0 | 0 | 0 | 111.2 | Y167 H185 K187 D188 L193 Q194 | Y167-D190 HydrophobicContact CE1-CB 3.67Å; Y167-D190 PolarHBondContact OH-OD1 3.07Å; H185-D190 HydrophobicContact CB-CB 4.34Å; K187-D190 WeakPolarHBondContact O-CB 3.03Å; K187-D190 PolarHBondContact O-N 3.39Å; D188-D190 VanDerWaalsContact C-N 3.28Å; D188-D190 PolarHBondContact O-N 3.44Å; D190-L193 PolarHBondContact O-N 2.98Å; D190-Q194 PolarHBondContact O-N 3.34Å |
| 191 | V | 87.6 | Confident | 88.3 | Confident | 14 Ų | 14 | 51 Ų | 51 | 9% | 0.085 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -58.5 | -52.5 | 171.7 | -179.8 | 0 | 0 | 0 | 0 | 109.3 | H185 D188 L193 Q194 Y195 Q257 A261 | H185-V191 HydrophobicContact CB-CG2 3.37Å; H185-V191 VanDerWaalsContact CG-CG2 3.47Å; D188-V191 WeakPolarHBondContact O-CB 3.31Å; D188-V191 PolarHBondContact O-N 3.48Å; V191-L193 PolarHBondContact O-N 3.42Å; V191-Q194 PolarHBondContact O-N 2.86Å; V191-Y195 HydrophobicContact CB-CD2 4.5Å; V191-Y195 HydrophobicContact CG1-CD2 3.61Å; V191-Y195 HydrophobicContact CG1-CE2 3.83Å; V191-Y195 WeakPolarHBondContact O-CD2 3.4Å; V191-Y195 PolarHBondContact O-N 3.4Å; V191-Q257 HydrophobicContact CG1-CG 3.94Å; V191-A261 HydrophobicContact CB-CB 4.12Å; V191-A261 HydrophobicContact CG1-CB 3.97Å |
| 192 | V | 91 | Very high | 88.5 | Confident | 32 Ų | 32 | 50.7 Ų | 50.7 | 19% | 0.194 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -59 | -48.8 | -179 | 175.5 | 0 | 0 | 0 | 0 | 110.2 | D188 P189 M196 V258 A261 L262 | D188-V192 WeakPolarHBondContact O-CG2 3.37Å; D188-V192 PolarHBondContact O-N 2.85Å; D188-V192 VanDerWaalsContact O-N 3.08Å; P189-V192 PolarHBondContact O-N 2.82Å; V192-M196 HydrophobicContact CG1-CG 3.9Å; V192-M196 WeakPolarHBondContact O-CB 3.42Å; V192-M196 WeakPolarHBondContact O-CG 3.18Å; V192-M196 PolarHBondContact O-N 3.1Å; V192-V258 HydrophobicContact CG1-CG1 4.23Å; V192-V258 HydrophobicContact CG2-CG1 4.35Å; V192-A261 HydrophobicContact CG2-CB 3.91Å; V192-L262 HydrophobicContact CG2-CD2 3.9Å; V192-L262 HydrophobicContact CG2-CG 4.18Å |
| 193 | L | 90.8 | Very high | 88.9 | Confident | 109 Ų | 109 | 49.4 Ų | 49.4 | 57% | 0.571 | 26% | 0.258 | S | S | * | . | H | α-helix | trans | -59 | -52.3 | -178.5 | -179.7 | 65.2 | 0 | 0 | 0 | 112 | P189 D190 V191 L197 | P189-L193 WeakPolarHBondContact O-CB 3.37Å; P189-L193 PolarHBondContact O-N 3.45Å; D190-L193 PolarHBondContact O-N 2.98Å; V191-L193 PolarHBondContact O-N 3.42Å; L193-L197 VanDerWaalsContact O-CB 3.26Å; L193-L197 WeakPolarHBondContact O-CB 3.25Å; L193-L197 PolarHBondContact O-N 3.3Å; L193-L197 VanDerWaalsContact O-N 3.07Å |
| 194 | Q | 90.7 | Very high | 89.4 | Confident | 6 Ų | 6 | 52.4 Ų | 52.4 | 3% | 0.028 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -61.5 | -54 | -178.1 | 178.8 | -177.3 | -26 | 0 | 0 | 111.3 | P163 Y167 H185 D190 V191 L197 E198 | P163-Q194 HydrophobicContact CB-CG 4.11Å; Y167-Q194 HydrophobicContact CD2-CB 4.42Å; Y167-Q194 HydrophobicContact CE2-CB 4.43Å; H185-Q194 PolarHBondContact CE1-OE1 2.95Å; H185-Q194 PolarHBondContact NE2-OE1 2.86Å; D190-Q194 PolarHBondContact O-N 3.34Å; V191-Q194 PolarHBondContact O-N 2.86Å; Q194-L197 PolarHBondContact O-N 3.49Å; Q194-E198 PolarHBondContact NE2-OE1 3.01Å; Q194-E198 WeakPolarHBondContact O-CG 3.18Å; Q194-E198 PolarHBondContact O-N 3.22Å |
| 195 | Y | 91.3 | Very high | 90 | Very high | 2 Ų | 2 | 53 Ų | 53 | 1% | 0.008 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -75.9 | -28.7 | -172 | -66 | -62.7 | 0 | 0 | 0 | 112.8 | H185 V191 E198 I199 N254 Q257 | H185-Y195 AromaticContact CE1-CE2 3.63Å; H185-Y195 AromaticContact CE1-CZ 3.97Å; V191-Y195 HydrophobicContact CB-CD2 4.5Å; V191-Y195 HydrophobicContact CG1-CD2 3.61Å; V191-Y195 HydrophobicContact CG1-CE2 3.83Å; V191-Y195 WeakPolarHBondContact O-CD2 3.4Å; V191-Y195 PolarHBondContact O-N 3.4Å; Y195-E198 PolarHBondContact O-N 2.93Å; Y195-I199 WeakPolarHBondContact O-CD1 3.42Å; Y195-I199 WeakPolarHBondContact O-CG1 3.18Å; Y195-I199 PolarHBondContact O-N 3.27Å; Y195-N254 HydrophobicContact CD1-CB 4.4Å; Y195-Q257 HydrophobicContact CD2-CG 4.08Å; Y195-Q257 HydrophobicContact CE2-CG 4.03Å; Y195-Q257 PolarHBondContact OH-NE2 3.09Å |
| 196 | M | 92.2 | Very high | 90.5 | Very high | 83 Ų | 83 | 51.3 Ų | 51.3 | 41% | 0.409 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -66.3 | -40.6 | 169.6 | -74.2 | -65 | -69.5 | 0 | 0 | 111.5 | V192 E198 I199 V200 V258 | V192-M196 HydrophobicContact CG1-CG 3.9Å; V192-M196 WeakPolarHBondContact O-CB 3.42Å; V192-M196 WeakPolarHBondContact O-CG 3.18Å; V192-M196 PolarHBondContact O-N 3.1Å; M196-E198 VanDerWaalsContact C-N 3.33Å; M196-I199 PolarHBondContact O-N 3.25Å; M196-I199 HydrophobicContact SD-CD1 4.37Å; M196-V200 WeakPolarHBondContact O-CB 3.33Å; M196-V200 VanDerWaalsContact O-CG2 3.28Å; M196-V200 WeakPolarHBondContact O-CG2 3.4Å; M196-V200 PolarHBondContact O-N 2.97Å; M196-V258 HydrophobicContact CG-CG1 3.94Å; M196-V258 HydrophobicContact CG-CG2 4Å; M196-V258 HydrophobicContact SD-CG1 3.84Å; M196-V258 HydrophobicContact SD-CG2 4.19Å |
| 197 | L | 92.6 | Very high | 91.2 | Very high | 55 Ų | 55 | 45.9 Ų | 45.9 | 29% | 0.288 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -61.4 | -43.8 | 174 | -173.8 | 154 | 0 | 0 | 0 | 110.7 | Y114 L193 Q194 I199 V200 L201 | Y114-L197 VanDerWaalsContact OH-CD2 3.25Å; Y114-L197 WeakPolarHBondContact OH-CD2 3.45Å; L193-L197 VanDerWaalsContact O-CB 3.26Å; L193-L197 WeakPolarHBondContact O-CB 3.25Å; L193-L197 PolarHBondContact O-N 3.3Å; L193-L197 VanDerWaalsContact O-N 3.07Å; Q194-L197 PolarHBondContact O-N 3.49Å; L197-I199 VanDerWaalsContact C-N 3.34Å; L197-I199 PolarHBondContact O-N 3.28Å; L197-V200 PolarHBondContact O-N 3.48Å; L197-L201 HydrophobicContact CD2-CD1 3.65Å; L197-L201 HydrophobicContact CD2-CG 4.37Å; L197-L201 HydrophobicContact CG-CD1 3.87Å; L197-L201 HydrophobicContact CG-CG 4.38Å; L197-L201 WeakPolarHBondContact O-CB 3.41Å; L197-L201 PolarHBondContact O-N 3.16Å |
| 198 | E | 93.4 | Very high | 91.7 | Very high | 4 Ų | 4 | 40.7 Ų | 40.7 | 2% | 0.019 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -58 | -42.4 | 172.9 | -71.2 | -177.7 | -148.7 | 0 | 0 | 112.7 | L110 Y114 Q194 Y195 M196 G202 Y250 N254 | L110-E198 HydrophobicContact CD1-CG 3.99Å; Y114-E198 VanDerWaalsContact OH-CA 3.26Å; Y114-E198 WeakPolarHBondContact OH-CA 3.39Å; Y114-E198 WeakPolarHBondContact OH-CG 3.36Å; Q194-E198 PolarHBondContact NE2-OE1 3.01Å; Q194-E198 WeakPolarHBondContact O-CG 3.18Å; Q194-E198 PolarHBondContact O-N 3.22Å; Y195-E198 PolarHBondContact O-N 2.93Å; M196-E198 VanDerWaalsContact C-N 3.33Å; E198-G202 WeakPolarHBondContact O-CA 3.34Å; E198-G202 PolarHBondContact O-N 2.92Å; E198-Y250 PolarHBondContact OE2-OH 3.48Å; E198-N254 PolarHBondContact OE2-ND2 3.48Å |
| 199 | I | 94 | Very high | 92.2 | Very high | 9 Ų | 9 | 41 Ų | 41 | 5% | 0.046 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -69.6 | -45.6 | 178.8 | -69.3 | 159.2 | 0 | 0 | 0 | 111 | Y195 M196 L197 F203 V204 N254 M255 V258 | Y195-I199 WeakPolarHBondContact O-CD1 3.42Å; Y195-I199 WeakPolarHBondContact O-CG1 3.18Å; Y195-I199 PolarHBondContact O-N 3.27Å; M196-I199 PolarHBondContact O-N 3.25Å; M196-I199 HydrophobicContact SD-CD1 4.37Å; L197-I199 VanDerWaalsContact C-N 3.34Å; L197-I199 PolarHBondContact O-N 3.28Å; I199-F203 CarbonylContact O-C 3.41Å; I199-F203 VanDerWaalsContact O-CA 3.32Å; I199-F203 WeakPolarHBondContact O-CA 3.38Å; I199-F203 WeakPolarHBondContact O-CB 3.41Å; I199-F203 PolarHBondContact O-N 2.95Å; I199-V204 HydrophobicContact CG2-CG2 3.91Å; I199-V204 PolarHBondContact O-N 3.47Å; I199-N254 HydrophobicContact CD1-CB 3.95Å; I199-N254 HydrophobicContact CG1-CB 3.96Å; I199-M255 HydrophobicContact CD1-CB 4.4Å; I199-M255 HydrophobicContact CD1-CG 3.67Å; I199-M255 HydrophobicContact CG1-CG 4.36Å; I199-M255 HydrophobicContact CG2-CE 4.12Å; I199-V258 HydrophobicContact CD1-CG2 4.33Å |
| 200 | V | 94.4 | Very high | 92.4 | Very high | 56 Ų | 56 | 36.9 Ų | 36.9 | 34% | 0.339 | 21% | 0.209 | S | C | . | . | I | π-helix | trans | -69.3 | -49.4 | -175.4 | 172 | 0 | 0 | 0 | 0 | 110.8 | M196 L197 V204 V205 | M196-V200 WeakPolarHBondContact O-CB 3.33Å; M196-V200 VanDerWaalsContact O-CG2 3.28Å; M196-V200 WeakPolarHBondContact O-CG2 3.4Å; M196-V200 PolarHBondContact O-N 2.97Å; L197-V200 PolarHBondContact O-N 3.48Å; V200-V204 PolarHBondContact O-N 3.28Å; V200-V205 HydrophobicContact CG1-CG2 3.89Å; V200-V205 WeakPolarHBondContact O-CB 3.14Å; V200-V205 PolarHBondContact O-N 3.02Å |
| 201 | L | 93.8 | Very high | 92.6 | Very high | 58 Ų | 58 | 40.2 Ų | 40.2 | 30% | 0.304 | 23% | 0.226 | S | C | . | . | I | π-helix | trans | -82.2 | -30.3 | -177 | -61.4 | -174.6 | 0 | 0 | 0 | 113.2 | Y114 A160 L197 P206 | Y114-L201 HydrophobicContact CD1-CB 4.41Å; Y114-L201 HydrophobicContact CE1-CB 3.93Å; A160-L201 HydrophobicContact CB-CD1 3.96Å; L197-L201 HydrophobicContact CD2-CD1 3.65Å; L197-L201 HydrophobicContact CD2-CG 4.37Å; L197-L201 HydrophobicContact CG-CD1 3.87Å; L197-L201 HydrophobicContact CG-CG 4.38Å; L197-L201 WeakPolarHBondContact O-CB 3.41Å; L197-L201 PolarHBondContact O-N 3.16Å; L201-P206 WeakPolarHBondContact O-CD 3.37Å; L201-P206 WeakPolarHBondContact O-CG 3.27Å |
| 202 | G | 91.1 | Very high | 92.9 | Very high | 0 Ų | 0 | 43.7 Ų | 43.7 | 0% | 0 | 25% | 0.247 | C | C | . | . | I | π-helix | trans | -87.9 | -22.4 | 180 | 0 | 0 | 0 | 0 | 0 | 113.9 | E198 | E198-G202 WeakPolarHBondContact O-CA 3.34Å; E198-G202 PolarHBondContact O-N 2.92Å |
| 203 | F | 91.6 | Very high | 92.9 | Very high | 34 Ų | 34 | 42.3 Ų | 42.3 | 15% | 0.149 | 24% | 0.239 | C | C | . | . | I | π-helix | trans | -132.5 | -69.5 | -173.3 | -163.6 | -101.3 | 0 | 0 | 0 | 113.1 | I199 V205 P206 Y207 L248 H251 | I199-F203 CarbonylContact O-C 3.41Å; I199-F203 VanDerWaalsContact O-CA 3.32Å; I199-F203 WeakPolarHBondContact O-CA 3.38Å; I199-F203 WeakPolarHBondContact O-CB 3.41Å; I199-F203 PolarHBondContact O-N 2.95Å; F203-V205 PolarHBondContact O-N 3.49Å; F203-P206 WeakPolarHBondContact O-CD 3.45Å; F203-Y207 HydrophobicContact CB-CD2 4.38Å; F203-Y207 HydrophobicContact CD1-CD2 4.47Å; F203-Y207 AromaticContact CD2-CD2 3.42Å; F203-Y207 HydrophobicContact CD2-CD2 3.42Å; F203-Y207 VanDerWaalsContact CD2-CD2 3.42Å; F203-Y207 AromaticContact CD2-CE2 3.3Å; F203-Y207 HydrophobicContact CD2-CE2 3.3Å; F203-Y207 AromaticContact CE2-CD2 3.66Å; F203-Y207 HydrophobicContact CE2-CD2 3.66Å; F203-Y207 AromaticContact CE2-CE2 3.53Å; F203-Y207 HydrophobicContact CE2-CE2 3.53Å; F203-Y207 HydrophobicContact CE2-CG 4.44Å; F203-Y207 AromaticContact CG-CD2 3.85Å; F203-Y207 HydrophobicContact CG-CD2 3.85Å; F203-Y207 HydrophobicContact CG-CE2 4.15Å; F203-Y207 HydrophobicContact CZ-CD2 4.29Å; F203-Y207 WeakPolarHBondContact O-CB 3.39Å; F203-Y207 WeakPolarHBondContact O-CD2 3.23Å; F203-Y207 PolarHBondContact O-N 3.48Å; F203-L248 HydrophobicContact CE1-CD1 4.43Å; F203-L248 HydrophobicContact CE2-CD1 4.06Å; F203-L248 HydrophobicContact CZ-CD1 3.65Å; F203-H251 HydrophobicContact CD2-CB 4.39Å; F203-H251 AromaticContact CD2-CD2 3.41Å; F203-H251 VanDerWaalsContact CD2-CD2 3.41Å; F203-H251 WeakPolarHBondContact CD2-CD2 3.33Å; F203-H251 AromaticContact CD2-CG 3.99Å; F203-H251 HydrophobicContact CG-CB 4.4Å; F203-H251 AromaticContact CG-CD2 3.89Å |
| 204 | V | 93.8 | Very high | 92.7 | Very high | 81 Ų | 81 | 38.3 Ų | 38.3 | 49% | 0.491 | 22% | 0.216 | S | C | . | . | I | π-helix | trans | -59.6 | -52.1 | -166.1 | 178.9 | 0 | 0 | 0 | 0 | 112.9 | I199 V200 G208 | I199-V204 HydrophobicContact CG2-CG2 3.91Å; I199-V204 PolarHBondContact O-N 3.47Å; V200-V204 PolarHBondContact O-N 3.28Å; V204-G208 PolarHBondContact O-N 3.46Å |
| 205 | V | 94.9 | Very high | 92.6 | Very high | 71 Ų | 71 | 41.2 Ų | 41.2 | 43% | 0.43 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -66.9 | -52.8 | -177.7 | 170.8 | 0 | 0 | 0 | 0 | 111.3 | V200 F203 Y207 G208 V209 | V200-V205 HydrophobicContact CG1-CG2 3.89Å; V200-V205 WeakPolarHBondContact O-CB 3.14Å; V200-V205 PolarHBondContact O-N 3.02Å; F203-V205 PolarHBondContact O-N 3.49Å; V205-Y207 PolarHBondContact O-N 3.21Å; V205-G208 PolarHBondContact O-N 3.43Å; V205-V209 WeakPolarHBondContact O-CG2 3.4Å; V205-V209 PolarHBondContact O-N 3.18Å |
| 206 | P | 93.9 | Very high | 92.5 | Very high | 1 Ų | 1 | 43.5 Ų | 43.5 | 1% | 0.006 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -62.5 | -44.7 | -178.6 | -22.5 | 32.4 | 0 | 0 | 0 | 113.5 | I117 M121 L201 F203 G208 V209 I210 | I117-P206 HydrophobicContact CD1-CB 3.97Å; I117-P206 HydrophobicContact CG1-CB 3.33Å; I117-P206 HydrophobicContact CG1-CG 3.74Å; I117-P206 HydrophobicContact CG2-CG 4.18Å; M121-P206 HydrophobicContact CB-CB 4.36Å; M121-P206 HydrophobicContact SD-CB 4.24Å; L201-P206 WeakPolarHBondContact O-CD 3.37Å; L201-P206 WeakPolarHBondContact O-CG 3.27Å; F203-P206 WeakPolarHBondContact O-CD 3.45Å; P206-G208 PolarHBondContact O-N 3.16Å; P206-V209 PolarHBondContact O-N 2.94Å; P206-I210 WeakPolarHBondContact O-CB 3.22Å; P206-I210 WeakPolarHBondContact O-CD1 3.17Å; P206-I210 WeakPolarHBondContact O-CG1 3.43Å; P206-I210 PolarHBondContact O-N 3.14Å |
| 207 | Y | 92.6 | Very high | 92.1 | Very high | 29 Ų | 29 | 39.7 Ų | 39.7 | 11% | 0.114 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -68.4 | -35 | 179.3 | -78.2 | -76.1 | 0 | 0 | 0 | 112.6 | I117 F203 V205 I210 L211 V240 F243 C244 | I117-Y207 HydrophobicContact CD1-CD2 4.36Å; I117-Y207 HydrophobicContact CD1-CE1 4.47Å; I117-Y207 HydrophobicContact CD1-CE2 3.79Å; F203-Y207 HydrophobicContact CB-CD2 4.38Å; F203-Y207 HydrophobicContact CD1-CD2 4.47Å; F203-Y207 AromaticContact CD2-CD2 3.42Å; F203-Y207 HydrophobicContact CD2-CD2 3.42Å; F203-Y207 VanDerWaalsContact CD2-CD2 3.42Å; F203-Y207 AromaticContact CD2-CE2 3.3Å; F203-Y207 HydrophobicContact CD2-CE2 3.3Å; F203-Y207 AromaticContact CE2-CD2 3.66Å; F203-Y207 HydrophobicContact CE2-CD2 3.66Å; F203-Y207 AromaticContact CE2-CE2 3.53Å; F203-Y207 HydrophobicContact CE2-CE2 3.53Å; F203-Y207 HydrophobicContact CE2-CG 4.44Å; F203-Y207 AromaticContact CG-CD2 3.85Å; F203-Y207 HydrophobicContact CG-CD2 3.85Å; F203-Y207 HydrophobicContact CG-CE2 4.15Å; F203-Y207 HydrophobicContact CZ-CD2 4.29Å; F203-Y207 WeakPolarHBondContact O-CB 3.39Å; F203-Y207 WeakPolarHBondContact O-CD2 3.23Å; F203-Y207 PolarHBondContact O-N 3.48Å; V205-Y207 PolarHBondContact O-N 3.21Å; Y207-I210 PolarHBondContact O-N 3.17Å; Y207-L211 WeakPolarHBondContact O-CB 3.35Å; Y207-L211 PolarHBondContact O-N 3.32Å; Y207-V240 HydrophobicContact CE1-CG1 4.4Å; Y207-F243 VanDerWaalsContact OH-CD1 3.23Å; Y207-F243 WeakPolarHBondContact OH-CD1 3.22Å; Y207-C244 HydrophobicContact CE1-CB 3.62Å; Y207-C244 WeakPolarHBondContact OH-CA 3.49Å; Y207-C244 WeakPolarHBondContact OH-CB 3.49Å; Y207-C244 PolarHBondContact OH-N 3.07Å |
| 208 | G | 94.6 | Very high | 91.7 | Very high | 34 Ų | 34 | 41.6 Ų | 41.6 | 35% | 0.351 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -58.7 | -49.4 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | V204 V205 P206 L211 V212 | V204-G208 PolarHBondContact O-N 3.46Å; V205-G208 PolarHBondContact O-N 3.43Å; P206-G208 PolarHBondContact O-N 3.16Å; G208-L211 PolarHBondContact O-N 3.23Å; G208-V212 VanDerWaalsContact O-CG2 3.3Å; G208-V212 WeakPolarHBondContact O-CG2 3.25Å; G208-V212 PolarHBondContact O-N 2.86Å |
| 209 | V | 95.3 | Very high | 91.3 | Very high | 51 Ų | 51 | 49.3 Ų | 49.3 | 31% | 0.309 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -63.9 | -44.7 | 177.9 | 174.8 | 0 | 0 | 0 | 0 | 111.5 | M121 I125 V205 P206 S213 | M121-V209 HydrophobicContact CG-CB 4Å; M121-V209 HydrophobicContact CG-CG1 3.74Å; M121-V209 HydrophobicContact SD-CB 3.87Å; M121-V209 HydrophobicContact SD-CG1 3.97Å; M121-V209 HydrophobicContact SD-CG2 4.09Å; I125-V209 HydrophobicContact CD1-CG1 3.85Å; I125-V209 HydrophobicContact CG1-CG1 3.83Å; V205-V209 WeakPolarHBondContact O-CG2 3.4Å; V205-V209 PolarHBondContact O-N 3.18Å; P206-V209 PolarHBondContact O-N 2.94Å; V209-S213 VanDerWaalsContact O-CB 3.29Å; V209-S213 WeakPolarHBondContact O-CB 3.48Å; V209-S213 PolarHBondContact O-N 2.88Å; V209-S213 PolarHBondContact O-OG 3.12Å |
| 210 | I | 92.8 | Very high | 90.7 | Very high | 4 Ų | 4 | 53.5 Ų | 53.5 | 2% | 0.021 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -59 | -51.7 | 177.1 | -69.3 | 162.8 | 0 | 0 | 0 | 109.8 | I117 I120 M121 P206 Y207 V212 S213 Y214 V240 | I117-I210 HydrophobicContact CD1-CD1 4.08Å; I120-I210 HydrophobicContact CG2-CD1 3.93Å; M121-I210 HydrophobicContact CB-CD1 4.25Å; M121-I210 HydrophobicContact CB-CG1 4.15Å; M121-I210 HydrophobicContact CG-CG1 4.35Å; P206-I210 WeakPolarHBondContact O-CB 3.22Å; P206-I210 WeakPolarHBondContact O-CD1 3.17Å; P206-I210 WeakPolarHBondContact O-CG1 3.43Å; P206-I210 PolarHBondContact O-N 3.14Å; Y207-I210 PolarHBondContact O-N 3.17Å; I210-V212 PolarHBondContact O-N 2.97Å; I210-S213 WeakPolarHBondContact O-CB 3.28Å; I210-S213 PolarHBondContact O-N 3.3Å; I210-S213 VanDerWaalsContact O-N 3.14Å; I210-S213 PolarHBondContact O-OG 3.46Å; I210-Y214 HydrophobicContact CG2-CD2 3.68Å; I210-Y214 HydrophobicContact CG2-CE2 3.78Å; I210-Y214 VanDerWaalsContact O-CD2 3.3Å; I210-Y214 WeakPolarHBondContact O-CD2 3.36Å; I210-Y214 PolarHBondContact O-N 2.94Å; I210-V240 HydrophobicContact CG2-CB 4.39Å; I210-V240 HydrophobicContact CG2-CG1 3.61Å; I210-V240 HydrophobicContact CG2-CG2 3.82Å |
| 211 | L | 92 | Very high | 89.8 | Confident | 111 Ų | 111 | 53 Ų | 53 | 58% | 0.581 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -58.2 | -49.6 | -178.7 | -179.7 | 63.2 | 0 | 0 | 0 | 111.8 | Y207 G208 S213 Y214 I215 | Y207-L211 WeakPolarHBondContact O-CB 3.35Å; Y207-L211 PolarHBondContact O-N 3.32Å; G208-L211 PolarHBondContact O-N 3.23Å; L211-S213 VanDerWaalsContact C-N 3.3Å; L211-S213 PolarHBondContact O-N 3.21Å; L211-Y214 PolarHBondContact O-N 3.09Å; L211-I215 HydrophobicContact CD1-CD1 4.15Å; L211-I215 HydrophobicContact CD1-CG1 4.46Å; L211-I215 HydrophobicContact CG-CD1 3.92Å; L211-I215 VanDerWaalsContact O-CG1 3.29Å; L211-I215 WeakPolarHBondContact O-CG1 3.35Å; L211-I215 PolarHBondContact O-N 3.15Å |
| 212 | V | 93.3 | Very high | 89 | Confident | 88 Ų | 88 | 60.7 Ų | 60.7 | 53% | 0.533 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -59 | -44 | 176.8 | 171.9 | 0 | 0 | 0 | 0 | 110.6 | G208 I210 Y214 I215 C216 | G208-V212 VanDerWaalsContact O-CG2 3.3Å; G208-V212 WeakPolarHBondContact O-CG2 3.25Å; G208-V212 PolarHBondContact O-N 2.86Å; I210-V212 PolarHBondContact O-N 2.97Å; V212-Y214 VanDerWaalsContact C-N 3.34Å; V212-Y214 PolarHBondContact O-N 3.4Å; V212-I215 PolarHBondContact O-N 2.98Å; V212-C216 PolarHBondContact O-N 3.46Å; V212-C216 PolarHBondContact O-SG 2.94Å; V212-C216 VanDerWaalsContact O-SG 3.36Å |
| 213 | S | 91.4 | Very high | 88.3 | Confident | 3 Ų | 3 | 67.8 Ų | 67.8 | 2% | 0.021 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -60.5 | -42.8 | 179 | 79.3 | 0 | 0 | 0 | 0 | 112.2 | V209 I210 L211 C216 I217 | V209-S213 VanDerWaalsContact O-CB 3.29Å; V209-S213 WeakPolarHBondContact O-CB 3.48Å; V209-S213 PolarHBondContact O-N 2.88Å; V209-S213 PolarHBondContact O-OG 3.12Å; I210-S213 WeakPolarHBondContact O-CB 3.28Å; I210-S213 PolarHBondContact O-N 3.3Å; I210-S213 VanDerWaalsContact O-N 3.14Å; I210-S213 PolarHBondContact O-OG 3.46Å; L211-S213 VanDerWaalsContact C-N 3.3Å; L211-S213 PolarHBondContact O-N 3.21Å; S213-C216 PolarHBondContact O-N 3.19Å; S213-I217 WeakPolarHBondContact O-CD1 3.47Å; S213-I217 WeakPolarHBondContact O-CG1 3.34Å; S213-I217 PolarHBondContact O-N 3.25Å |
| 214 | Y | 87.4 | Confident | 87.1 | Confident | 24 Ų | 24 | 68.5 Ų | 68.5 | 9% | 0.094 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -69.4 | -38.6 | 177.7 | -87.6 | -79.7 | 0 | 0 | 0 | 112.8 | I210 L211 V212 C216 I217 L218 I236 L237 V240 | I210-Y214 HydrophobicContact CG2-CD2 3.68Å; I210-Y214 HydrophobicContact CG2-CE2 3.78Å; I210-Y214 VanDerWaalsContact O-CD2 3.3Å; I210-Y214 WeakPolarHBondContact O-CD2 3.36Å; I210-Y214 PolarHBondContact O-N 2.94Å; L211-Y214 PolarHBondContact O-N 3.09Å; V212-Y214 VanDerWaalsContact C-N 3.34Å; V212-Y214 PolarHBondContact O-N 3.4Å; Y214-C216 VanDerWaalsContact C-N 3.33Å; Y214-C216 PolarHBondContact O-N 2.93Å; Y214-I217 PolarHBondContact O-N 3.17Å; Y214-L218 WeakPolarHBondContact O-CB 3.43Å; Y214-L218 VanDerWaalsContact O-CG 3.28Å; Y214-L218 WeakPolarHBondContact O-CG 3.44Å; Y214-L218 PolarHBondContact O-N 3.2Å; Y214-I236 VanDerWaalsContact OH-CB 3.24Å; Y214-I236 WeakPolarHBondContact OH-CB 3.32Å; Y214-I236 WeakPolarHBondContact OH-CG2 3.36Å; Y214-L237 HydrophobicContact CD1-CD1 4.31Å; Y214-L237 HydrophobicContact CE1-CB 4.07Å; Y214-L237 HydrophobicContact CE1-CD1 4.16Å; Y214-L237 PolarHBondContact OH-N 3.3Å; Y214-V240 HydrophobicContact CE2-CG2 4.09Å |
| 215 | I | 88.1 | Confident | 85.4 | Confident | 68 Ų | 68 | 76.9 Ų | 76.9 | 35% | 0.349 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -59.6 | -46.4 | 173.8 | -68.6 | 166 | 0 | 0 | 0 | 110.1 | L211 V212 L218 R219 | L211-I215 HydrophobicContact CD1-CD1 4.15Å; L211-I215 HydrophobicContact CD1-CG1 4.46Å; L211-I215 HydrophobicContact CG-CD1 3.92Å; L211-I215 VanDerWaalsContact O-CG1 3.29Å; L211-I215 WeakPolarHBondContact O-CG1 3.35Å; L211-I215 PolarHBondContact O-N 3.15Å; V212-I215 PolarHBondContact O-N 2.98Å; I215-L218 PolarHBondContact O-N 3.41Å; I215-R219 WeakPolarHBondContact O-CB 3.35Å; I215-R219 WeakPolarHBondContact O-CG 3.34Å; I215-R219 PolarHBondContact O-N 3.33Å |
| 216 | C | 88.9 | Confident | 83.5 | Confident | 49 Ų | 49 | 80 Ų | 80 | 33% | 0.331 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -62.6 | -43.1 | 177.1 | -71.2 | 0 | 0 | 0 | 0 | 112.3 | L128 V212 S213 Y214 R219 R220 | L128-C216 HydrophobicContact CD1-CB 3.42Å; L128-C216 VanDerWaalsContact CD1-CB 3.42Å; V212-C216 PolarHBondContact O-N 3.46Å; V212-C216 PolarHBondContact O-SG 2.94Å; V212-C216 VanDerWaalsContact O-SG 3.36Å; S213-C216 PolarHBondContact O-N 3.19Å; Y214-C216 VanDerWaalsContact C-N 3.33Å; Y214-C216 PolarHBondContact O-N 2.93Å; C216-R219 PolarHBondContact O-N 3.26Å; C216-R220 WeakPolarHBondContact O-CB 3.47Å; C216-R220 PolarHBondContact O-N 3.22Å |
| 217 | I | 84.8 | Confident | 81.5 | Confident | 4 Ų | 4 | 90.5 Ų | 90.5 | 2% | 0.021 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -58.5 | -51.3 | 174.8 | -70.6 | 163.5 | 0 | 0 | 0 | 110.3 | R127 L128 S213 Y214 R219 R220 I221 | R127-I217 HydrophobicContact CB-CD1 4.14Å; L128-I217 HydrophobicContact CB-CD1 4.2Å; L128-I217 HydrophobicContact CB-CG1 4.21Å; L128-I217 HydrophobicContact CD1-CG1 3.95Å; S213-I217 WeakPolarHBondContact O-CD1 3.47Å; S213-I217 WeakPolarHBondContact O-CG1 3.34Å; S213-I217 PolarHBondContact O-N 3.25Å; Y214-I217 PolarHBondContact O-N 3.17Å; I217-R219 VanDerWaalsContact C-N 3.34Å; I217-R219 PolarHBondContact O-N 3.37Å; I217-R220 PolarHBondContact O-N 3.3Å; I217-I221 HydrophobicContact CG2-CD1 3.56Å; I217-I221 HydrophobicContact CG2-CG1 4.35Å; I217-I221 VanDerWaalsContact O-CG1 3.3Å; I217-I221 WeakPolarHBondContact O-CG1 3.46Å; I217-I221 PolarHBondContact O-N 2.9Å |
| 218 | L | 83.1 | Confident | 79.6 | Confident | 95 Ų | 95 | 99.6 Ų | 99.6 | 50% | 0.497 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -61.3 | -41.3 | -179.3 | -72.3 | 173.2 | 0 | 0 | 0 | 112.2 | Y214 I215 I221 R222 | Y214-L218 WeakPolarHBondContact O-CB 3.43Å; Y214-L218 VanDerWaalsContact O-CG 3.28Å; Y214-L218 WeakPolarHBondContact O-CG 3.44Å; Y214-L218 PolarHBondContact O-N 3.2Å; I215-L218 PolarHBondContact O-N 3.41Å; L218-I221 PolarHBondContact O-N 3.13Å; L218-R222 WeakPolarHBondContact O-CG 3.2Å; L218-R222 PolarHBondContact O-N 3.13Å |
| 219 | R | 84.8 | Confident | 77.7 | Confident | 166 Ų | 166 | 102 Ų | 102 | 63% | 0.626 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -60.1 | -47 | 174.4 | -76.2 | 178.1 | 175.6 | -179 | -0.7 | 111.2 | I215 C216 I217 I221 R222 Q223 | I215-R219 WeakPolarHBondContact O-CB 3.35Å; I215-R219 WeakPolarHBondContact O-CG 3.34Å; I215-R219 PolarHBondContact O-N 3.33Å; C216-R219 PolarHBondContact O-N 3.26Å; I217-R219 VanDerWaalsContact C-N 3.34Å; I217-R219 PolarHBondContact O-N 3.37Å; R219-I221 PolarHBondContact O-N 3.09Å; R219-R222 PolarHBondContact O-N 3.08Å; R219-Q223 WeakPolarHBondContact O-CG 3.35Å; R219-Q223 PolarHBondContact O-N 3.15Å; R219-Q223 VanDerWaalsContact O-N 3.12Å |
| 220 | R | 81.3 | Confident | 75.8 | Confident | 96 Ų | 96 | 103.7 Ų | 103.7 | 36% | 0.362 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -65.2 | -39.2 | -179.8 | -173.8 | 59.1 | 168.1 | -171.7 | -2.3 | 112.7 | V131 V132 C216 I217 Q223 T224 | V131-R220 HydrophobicContact CG1-CB 4.18Å; V131-R220 HydrophobicContact CG1-CG 3.9Å; V132-R220 HydrophobicContact CG2-CG 4.43Å; C216-R220 WeakPolarHBondContact O-CB 3.47Å; C216-R220 PolarHBondContact O-N 3.22Å; I217-R220 PolarHBondContact O-N 3.3Å; R220-Q223 PolarHBondContact O-N 3.04Å; R220-T224 PolarHBondContact O-N 3.38Å; R220-T224 VanDerWaalsContact O-N 3.1Å; R220-T224 PolarHBondContact O-OG1 2.88Å |
| 221 | I | 76.3 | Confident | 74.3 | Confident | 46 Ų | 46 | 109 Ų | 109 | 24% | 0.236 | 47% | 0.472 | C | S | . | . | H | α-helix | trans | -67.6 | -37.3 | 176.7 | -68.1 | 169 | 0 | 0 | 0 | 111.1 | V131 I217 L218 R219 Q223 E233 | V131-I221 HydrophobicContact CG1-CG1 4.41Å; I217-I221 HydrophobicContact CG2-CD1 3.56Å; I217-I221 HydrophobicContact CG2-CG1 4.35Å; I217-I221 VanDerWaalsContact O-CG1 3.3Å; I217-I221 WeakPolarHBondContact O-CG1 3.46Å; I217-I221 PolarHBondContact O-N 2.9Å; L218-I221 PolarHBondContact O-N 3.13Å; R219-I221 PolarHBondContact O-N 3.09Å; I221-Q223 VanDerWaalsContact C-N 3.34Å; I221-E233 VanDerWaalsContact CD1-OE1 3.26Å; I221-E233 WeakPolarHBondContact CD1-OE1 3.48Å; I221-E233 VanDerWaalsContact CD1-OE2 3.22Å; I221-E233 WeakPolarHBondContact CD1-OE2 3.47Å |
| 222 | R | 77.1 | Confident | 73 | Confident | 220 Ų | 220 | 105.3 Ų | 105.3 | 83% | 0.83 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -66.4 | -36.4 | 175.5 | -74.7 | 178.8 | -179.8 | -172.8 | 0.7 | 112.6 | L218 R219 | L218-R222 WeakPolarHBondContact O-CG 3.2Å; L218-R222 PolarHBondContact O-N 3.13Å; R219-R222 PolarHBondContact O-N 3.08Å |
| 223 | Q | 75.8 | Confident | 72 | Confident | 149 Ų | 149 | 103 Ų | 103 | 70% | 0.696 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -74.7 | -28.3 | -179.9 | -72.4 | 174.5 | -9.8 | 0 | 0 | 113.3 | R219 R220 I221 | R219-Q223 WeakPolarHBondContact O-CG 3.35Å; R219-Q223 PolarHBondContact O-N 3.15Å; R219-Q223 VanDerWaalsContact O-N 3.12Å; R220-Q223 PolarHBondContact O-N 3.04Å; I221-Q223 VanDerWaalsContact C-N 3.34Å |
| 224 | T | 67.3 | Low | 71.3 | Confident | 48 Ų | 48 | 109.7 Ų | 109.7 | 29% | 0.294 | 47% | 0.467 | S | S | . | . | S | Bend | trans | -101.2 | 125 | -179 | 56.6 | 0 | 0 | 0 | 0 | 109.2 | R220 F226 | R220-T224 PolarHBondContact O-N 3.38Å; R220-T224 VanDerWaalsContact O-N 3.1Å; R220-T224 PolarHBondContact O-OG1 2.88Å; T224-F226 PolarHBondContact O-N 3.17Å |
| 225 | R | 57.3 | Low | 71 | Confident | 258 Ų | 258 | 109.3 Ų | 109.3 | 97% | 0.974 | 47% | 0.467 | S | S | * | . | trans | -61.9 | 9.8 | 176.5 | -72.9 | -171.4 | -179.5 | -178.3 | 1 | 114.2 | R227 | R225-R227 VanDerWaalsContact C-N 3.33Å; R225-R227 PolarHBondContact O-N 3.48Å | ||
| 226 | F | 55.8 | Low | 70.7 | Confident | 135 Ų | 135 | 106.6 Ų | 106.6 | 59% | 0.592 | 45% | 0.453 | S | S | * | . | trans | -76.4 | 77.4 | 176.5 | -94.3 | -75.5 | 0 | 0 | 0 | 111.6 | T224 R228 | T224-F226 PolarHBondContact O-N 3.17Å; F226-R228 PolarHBondContact O-N 2.96Å | ||
| 227 | R | 52.5 | Low | 70.4 | Confident | 222 Ų | 222 | 108.1 Ų | 108.1 | 84% | 0.838 | 46% | 0.457 | S | S | * | . | trans | -67.6 | 5.5 | 171.4 | -96.9 | -172.9 | 171.7 | -162.5 | -0.9 | 115.4 | R225 | R225-R227 VanDerWaalsContact C-N 3.33Å; R225-R227 PolarHBondContact O-N 3.48Å | ||
| 228 | R | 50.9 | Low | 70.6 | Confident | 220 Ų | 220 | 109.5 Ų | 109.5 | 83% | 0.83 | 47% | 0.47 | S | S | * | . | trans | -114.2 | 77.6 | -170.8 | -69.5 | -173.6 | -174.7 | 166.7 | 2.7 | 112.3 | F226 | F226-R228 PolarHBondContact O-N 2.96Š| ||
| 229 | R | 55.9 | Low | 70.8 | Confident | 85 Ų | 85 | 105.1 Ų | 105.1 | 32% | 0.321 | 45% | 0.446 | S | S | . | . | trans | -176.1 | 36 | 152 | -108.1 | 164 | 173.9 | -149.8 | -18.2 | 116.3 | R231 D325 | R229-R231 VanDerWaalsContact C-N 3.32Å; R229-R231 PolarHBondContact O-N 3.03Å; R229-D325 VanDerWaalsContact CZ-CB 3.48Å; R229-D325 IonicContact CZ-OD2 3.26Å; R229-D325 VanDerWaalsContact CZ-OD2 3.26Å; R229-D325 IonicContact NE-OD2 3.04Å; R229-D325 PolarHBondContact NE-OD2 3.2Å; R229-D325 VanDerWaalsContact NH2-N 3.19Å; R229-D325 IonicContact NH2-OD2 2.72Å; R229-D325 PolarHBondContact NH2-OD2 3.27Å | ||
| 230 | I | 55.9 | Low | 71 | Confident | 87 Ų | 87 | 97.8 Ų | 97.8 | 45% | 0.446 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -69.9 | -19 | -171.2 | -60.6 | 169.3 | 0 | 0 | 0 | 114.3 | K234 | I230-K234 HydrophobicContact CG2-CD 3.81Å; I230-K234 VanDerWaalsContact CG2-CE 3.43Å; I230-K234 HydrophobicContact CG2-CG 3.98Å; I230-K234 WeakPolarHBondContact O-CG 3.29Å; I230-K234 PolarHBondContact O-N 3.08Å; I230-K234 VanDerWaalsContact O-N 3.16Å |
| 231 | R | 61.4 | Low | 71.4 | Confident | 116 Ų | 116 | 96.5 Ų | 96.5 | 44% | 0.438 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -73.1 | -42.2 | -167.2 | -166.8 | 173 | -177.7 | 162.3 | -3.6 | 114.3 | R229 L235 A302 S305 | R229-R231 VanDerWaalsContact C-N 3.32Å; R229-R231 PolarHBondContact O-N 3.03Å; R231-L235 PolarHBondContact O-N 3.21Å; R231-A302 PolarHBondContact NE-O 2.86Å; R231-A302 PolarHBondContact NH2-O 2.74Å; R231-S305 PolarHBondContact NH1-OG 2.98Å; R231-S305 PolarHBondContact NH2-OG 2.93Å |
| 232 | S | 63.5 | Low | 72.1 | Confident | 33 Ų | 33 | 95.6 Ų | 95.6 | 23% | 0.231 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -77.2 | -29.2 | -178.9 | -51.4 | 0 | 0 | 0 | 0 | 112.3 | L235 I236 T322 | S232-L235 PolarHBondContact O-N 2.99Å; S232-I236 WeakPolarHBondContact O-CG1 3.34Å; S232-I236 PolarHBondContact O-N 3.03Å; S232-I236 VanDerWaalsContact O-N 3.1Å; S232-T322 WeakPolarHBondContact OG-CG2 3.49Å |
| 233 | E | 71.6 | Confident | 72.7 | Confident | 39 Ų | 39 | 85.3 Ų | 85.3 | 18% | 0.182 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -64.8 | -44.2 | 172.2 | -68.8 | 169.8 | -173.2 | 0 | 0 | 111 | I221 L235 I236 L237 | I221-E233 VanDerWaalsContact CD1-OE1 3.26Å; I221-E233 WeakPolarHBondContact CD1-OE1 3.48Å; I221-E233 VanDerWaalsContact CD1-OE2 3.22Å; I221-E233 WeakPolarHBondContact CD1-OE2 3.47Å; E233-L235 VanDerWaalsContact C-N 3.31Å; E233-L235 PolarHBondContact O-N 3.04Å; E233-I236 PolarHBondContact O-N 2.77Å; E233-L237 VanDerWaalsContact O-CB 3.25Å; E233-L237 WeakPolarHBondContact O-CB 3.29Å; E233-L237 PolarHBondContact O-N 2.9Å |
| 234 | K | 78.6 | Confident | 73.4 | Confident | 144 Ų | 144 | 79.7 Ų | 79.7 | 63% | 0.626 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -59.4 | -39.1 | 174.1 | -77.2 | -177 | 172.8 | -175.4 | 0 | 112.7 | I230 A238 | I230-K234 HydrophobicContact CG2-CD 3.81Å; I230-K234 VanDerWaalsContact CG2-CE 3.43Å; I230-K234 HydrophobicContact CG2-CG 3.98Å; I230-K234 WeakPolarHBondContact O-CG 3.29Å; I230-K234 PolarHBondContact O-N 3.08Å; I230-K234 VanDerWaalsContact O-N 3.16Å; K234-A238 VanDerWaalsContact O-CB 3.32Å; K234-A238 WeakPolarHBondContact O-CB 3.34Å; K234-A238 PolarHBondContact O-N 3.31Å |
| 235 | L | 81.2 | Confident | 74.7 | Confident | 16 Ų | 16 | 82.7 Ų | 82.7 | 8% | 0.084 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -65.6 | -50.4 | 176.7 | 173.8 | 57.5 | 0 | 0 | 0 | 111.7 | R231 S232 E233 L237 A238 I239 L298 Y299 A302 L318 F319 | R231-L235 PolarHBondContact O-N 3.21Å; S232-L235 PolarHBondContact O-N 2.99Å; E233-L235 VanDerWaalsContact C-N 3.31Å; E233-L235 PolarHBondContact O-N 3.04Å; L235-L237 VanDerWaalsContact C-N 3.3Å; L235-L237 PolarHBondContact O-N 3.18Å; L235-A238 WeakPolarHBondContact O-CB 3.4Å; L235-A238 PolarHBondContact O-N 3.07Å; L235-A238 VanDerWaalsContact O-N 3.14Å; L235-I239 HydrophobicContact CD1-CD1 4.18Å; L235-I239 HydrophobicContact CD1-CG1 4.3Å; L235-I239 HydrophobicContact CG-CD1 4.16Å; L235-I239 WeakPolarHBondContact O-CG1 3.47Å; L235-I239 PolarHBondContact O-N 3.49Å; L235-L298 HydrophobicContact CD1-CB 4.22Å; L235-Y299 HydrophobicContact CD1-CD1 4.17Å; L235-Y299 HydrophobicContact CD2-CD1 4.25Å; L235-A302 HydrophobicContact CB-CB 4.27Å; L235-A302 HydrophobicContact CD1-CB 3.75Å; L235-A302 HydrophobicContact CD2-CB 3.84Å; L235-A302 HydrophobicContact CG-CB 4.15Å; L235-L318 HydrophobicContact CD2-CD2 4.28Å; L235-F319 HydrophobicContact CD2-CE1 3.82Å; L235-F319 HydrophobicContact CD2-CZ 4.45Å |
| 236 | I | 80.1 | Confident | 76.4 | Confident | 10 Ų | 10 | 73 Ų | 73 | 5% | 0.051 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -67 | -37.1 | -178 | -57.9 | 168 | 0 | 0 | 0 | 110.2 | R127 Y214 S232 E233 A238 I239 V240 | R127-I236 HydrophobicContact CG-CD1 3.44Å; R127-I236 VanDerWaalsContact CG-CD1 3.44Å; Y214-I236 VanDerWaalsContact OH-CB 3.24Å; Y214-I236 WeakPolarHBondContact OH-CB 3.32Å; Y214-I236 WeakPolarHBondContact OH-CG2 3.36Å; S232-I236 WeakPolarHBondContact O-CG1 3.34Å; S232-I236 PolarHBondContact O-N 3.03Å; S232-I236 VanDerWaalsContact O-N 3.1Å; E233-I236 PolarHBondContact O-N 2.77Å; I236-A238 VanDerWaalsContact C-N 3.32Å; I236-A238 PolarHBondContact O-N 3.02Å; I236-I239 WeakPolarHBondContact O-CB 3.39Å; I236-I239 PolarHBondContact O-N 3.12Å; I236-V240 WeakPolarHBondContact O-CG2 3.33Å; I236-V240 PolarHBondContact O-N 2.7Å |
| 237 | L | 84.4 | Confident | 78.2 | Confident | 81 Ų | 81 | 67.1 Ų | 67.1 | 42% | 0.424 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -61.8 | -41.7 | 173.2 | -177.3 | 65 | 0 | 0 | 0 | 111.3 | Y214 E233 L235 I239 V240 V241 | Y214-L237 HydrophobicContact CD1-CD1 4.31Å; Y214-L237 HydrophobicContact CE1-CB 4.07Å; Y214-L237 HydrophobicContact CE1-CD1 4.16Å; Y214-L237 PolarHBondContact OH-N 3.3Å; E233-L237 VanDerWaalsContact O-CB 3.25Å; E233-L237 WeakPolarHBondContact O-CB 3.29Å; E233-L237 PolarHBondContact O-N 2.9Å; L235-L237 VanDerWaalsContact C-N 3.3Å; L235-L237 PolarHBondContact O-N 3.18Å; L237-I239 VanDerWaalsContact C-N 3.35Å; L237-I239 PolarHBondContact O-N 3.11Å; L237-V240 PolarHBondContact O-N 3.23Å; L237-V241 HydrophobicContact CD1-CG2 4.26Å; L237-V241 HydrophobicContact CG-CG2 4.39Å; L237-V241 WeakPolarHBondContact O-CB 3.17Å; L237-V241 VanDerWaalsContact O-CG2 3.29Å; L237-V241 WeakPolarHBondContact O-CG2 3.23Å; L237-V241 PolarHBondContact O-N 2.85Å |
| 238 | A | 87.6 | Confident | 80.1 | Confident | 34 Ų | 34 | 59.6 Ų | 59.6 | 28% | 0.281 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -60.5 | -44.1 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | K234 L235 I236 V240 V241 T242 L298 | K234-A238 VanDerWaalsContact O-CB 3.32Å; K234-A238 WeakPolarHBondContact O-CB 3.34Å; K234-A238 PolarHBondContact O-N 3.31Å; L235-A238 WeakPolarHBondContact O-CB 3.4Å; L235-A238 PolarHBondContact O-N 3.07Å; L235-A238 VanDerWaalsContact O-N 3.14Å; I236-A238 VanDerWaalsContact C-N 3.32Å; I236-A238 PolarHBondContact O-N 3.02Å; A238-V240 PolarHBondContact O-N 3.32Å; A238-V241 PolarHBondContact O-N 3.21Å; A238-T242 VanDerWaalsContact O-CB 3.23Å; A238-T242 WeakPolarHBondContact O-CB 3.43Å; A238-T242 PolarHBondContact O-N 3.16Å; A238-T242 PolarHBondContact O-OG1 3.42Å; A238-L298 HydrophobicContact CB-CD2 4.22Å |
| 239 | I | 87.6 | Confident | 82.1 | Confident | 2 Ų | 2 | 50.9 Ų | 50.9 | 1% | 0.01 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -58.9 | -48.3 | 175.9 | -63.9 | 163.9 | 0 | 0 | 0 | 110.9 | I120 L235 I236 L237 V241 T242 F243 L298 Y299 | I120-I239 HydrophobicContact CD1-CG2 3.97Å; I120-I239 HydrophobicContact CG1-CG2 4.01Å; L235-I239 HydrophobicContact CD1-CD1 4.18Å; L235-I239 HydrophobicContact CD1-CG1 4.3Å; L235-I239 HydrophobicContact CG-CD1 4.16Å; L235-I239 WeakPolarHBondContact O-CG1 3.47Å; L235-I239 PolarHBondContact O-N 3.49Å; I236-I239 WeakPolarHBondContact O-CB 3.39Å; I236-I239 PolarHBondContact O-N 3.12Å; L237-I239 VanDerWaalsContact C-N 3.35Å; L237-I239 PolarHBondContact O-N 3.11Å; I239-V241 PolarHBondContact O-N 3.04Å; I239-T242 PolarHBondContact O-N 2.69Å; I239-F243 VanDerWaalsContact O-CB 3.3Å; I239-F243 WeakPolarHBondContact O-CB 3.26Å; I239-F243 PolarHBondContact O-N 3.36Å; I239-L298 HydrophobicContact CB-CD1 4.46Å; I239-L298 HydrophobicContact CG1-CD1 3.92Å; I239-Y299 HydrophobicContact CD1-CD1 4.45Å; I239-Y299 HydrophobicContact CD1-CE1 3.57Å; I239-Y299 HydrophobicContact CG1-CE1 4.39Å |
| 240 | V | 88.3 | Confident | 83.9 | Confident | 13 Ų | 13 | 48 Ų | 48 | 8% | 0.079 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -59 | -48.9 | 178.5 | 168.2 | 0 | 0 | 0 | 0 | 111.5 | I120 Y207 I210 Y214 I236 L237 A238 F243 C244 | I120-V240 HydrophobicContact CG2-CG2 3.53Å; Y207-V240 HydrophobicContact CE1-CG1 4.4Å; I210-V240 HydrophobicContact CG2-CB 4.39Å; I210-V240 HydrophobicContact CG2-CG1 3.61Å; I210-V240 HydrophobicContact CG2-CG2 3.82Å; Y214-V240 HydrophobicContact CE2-CG2 4.09Å; I236-V240 WeakPolarHBondContact O-CG2 3.33Å; I236-V240 PolarHBondContact O-N 2.7Å; L237-V240 PolarHBondContact O-N 3.23Å; A238-V240 PolarHBondContact O-N 3.32Å; V240-F243 PolarHBondContact O-N 2.86Å; V240-C244 WeakPolarHBondContact O-CB 3Å; V240-C244 PolarHBondContact O-N 3.34Å |
| 241 | V | 90.7 | Very high | 85.7 | Confident | 69 Ų | 69 | 43.8 Ų | 43.8 | 42% | 0.418 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -65.2 | -46.4 | -178.6 | 170.4 | 0 | 0 | 0 | 0 | 110.2 | L237 A238 I239 F243 C244 L245 | L237-V241 HydrophobicContact CD1-CG2 4.26Å; L237-V241 HydrophobicContact CG-CG2 4.39Å; L237-V241 WeakPolarHBondContact O-CB 3.17Å; L237-V241 VanDerWaalsContact O-CG2 3.29Å; L237-V241 WeakPolarHBondContact O-CG2 3.23Å; L237-V241 PolarHBondContact O-N 2.85Å; A238-V241 PolarHBondContact O-N 3.21Å; I239-V241 PolarHBondContact O-N 3.04Å; V241-F243 PolarHBondContact O-N 2.96Å; V241-C244 WeakPolarHBondContact O-CB 3.37Å; V241-C244 PolarHBondContact O-N 2.93Å; V241-L245 HydrophobicContact CG1-CD1 3.82Å; V241-L245 HydrophobicContact CG1-CG 4.24Å; V241-L245 VanDerWaalsContact O-CG 3.27Å; V241-L245 WeakPolarHBondContact O-CG 3.28Å; V241-L245 PolarHBondContact O-N 3.45Å |
| 242 | T | 90.8 | Very high | 87.3 | Confident | 27 Ų | 27 | 42.1 Ų | 42.1 | 17% | 0.166 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -61.3 | -43.8 | 177.9 | -64.9 | 0 | 0 | 0 | 0 | 111.8 | A238 I239 C244 L245 F246 A294 L298 | A238-T242 VanDerWaalsContact O-CB 3.23Å; A238-T242 WeakPolarHBondContact O-CB 3.43Å; A238-T242 PolarHBondContact O-N 3.16Å; A238-T242 PolarHBondContact O-OG1 3.42Å; I239-T242 PolarHBondContact O-N 2.69Å; T242-C244 VanDerWaalsContact C-N 3.33Å; T242-C244 PolarHBondContact O-N 3.29Å; T242-L245 PolarHBondContact O-N 3.5Å; T242-F246 HydrophobicContact CG2-CD2 3.62Å; T242-F246 HydrophobicContact CG2-CE2 3.35Å; T242-F246 HydrophobicContact CG2-CZ 4.47Å; T242-F246 WeakPolarHBondContact O-CD2 3.2Å; T242-F246 PolarHBondContact O-N 3.21Å; T242-F246 VanDerWaalsContact O-N 3.15Å; T242-A294 HydrophobicContact CG2-CB 3.66Å; T242-L298 HydrophobicContact CG2-CD1 4.22Å |
| 243 | F | 89.2 | Confident | 88.8 | Confident | 3 Ų | 3 | 41 Ų | 41 | 1% | 0.013 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -61.7 | -42.7 | 175.1 | -165.7 | -93.1 | 0 | 0 | 0 | 110.7 | I117 I120 Y207 I239 V240 V241 F246 W247 | I117-F243 HydrophobicContact CB-CD1 4.49Å; I117-F243 HydrophobicContact CB-CE1 3.62Å; I117-F243 HydrophobicContact CB-CZ 3.93Å; I117-F243 HydrophobicContact CD1-CD1 3.66Å; I117-F243 HydrophobicContact CD1-CE1 3.59Å; I117-F243 HydrophobicContact CG1-CE1 4Å; I120-F243 HydrophobicContact CD1-CB 3.85Å; I120-F243 HydrophobicContact CD1-CD1 4.1Å; I120-F243 HydrophobicContact CD1-CD2 3.62Å; I120-F243 HydrophobicContact CD1-CE2 4.19Å; I120-F243 HydrophobicContact CD1-CG 3.58Å; Y207-F243 VanDerWaalsContact OH-CD1 3.23Å; Y207-F243 WeakPolarHBondContact OH-CD1 3.22Å; I239-F243 VanDerWaalsContact O-CB 3.3Å; I239-F243 WeakPolarHBondContact O-CB 3.26Å; I239-F243 PolarHBondContact O-N 3.36Å; V240-F243 PolarHBondContact O-N 2.86Å; V241-F243 PolarHBondContact O-N 2.96Å; F243-F246 PolarHBondContact O-N 3.25Å; F243-W247 AromaticContact CD1-CD1 3.7Å; F243-W247 HydrophobicContact CD1-CG 4.32Å; F243-W247 AromaticContact CD2-CD1 3.61Å; F243-W247 AromaticContact CD2-NE1 3.66Å; F243-W247 HydrophobicContact CE1-CB 4.41Å; F243-W247 AromaticContact CE1-CD1 3.46Å; F243-W247 VanDerWaalsContact CE1-CD1 3.46Å; F243-W247 AromaticContact CE1-CG 3.87Å; F243-W247 HydrophobicContact CE1-CG 3.87Å; F243-W247 AromaticContact CE1-NE1 3.88Å; F243-W247 AromaticContact CE2-CD1 3.43Å; F243-W247 VanDerWaalsContact CE2-CD1 3.43Å; F243-W247 HydrophobicContact CE2-CG 4.44Å; F243-W247 AromaticContact CE2-NE1 3.12Å; F243-W247 AromaticContact CG-CD1 3.75Å; F243-W247 AromaticContact CZ-CD1 3.34Å; F243-W247 HydrophobicContact CZ-CD2 4.24Å; F243-W247 AromaticContact CZ-CE2 3.82Å; F243-W247 AromaticContact CZ-CG 3.96Å; F243-W247 HydrophobicContact CZ-CG 3.96Å; F243-W247 AromaticContact CZ-NE1 3.23Å; F243-W247 WeakPolarHBondContact O-CB 3.34Å; F243-W247 VanDerWaalsContact O-CD1 3.27Å; F243-W247 PolarHBondContact O-N 3.36Å |
| 244 | C | 91.5 | Very high | 89.8 | Confident | 32 Ų | 32 | 39.2 Ų | 39.2 | 22% | 0.216 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -59 | -50 | 174.4 | -166.1 | 0 | 0 | 0 | 0 | 112.9 | Y207 V240 V241 T242 F246 W247 L248 | Y207-C244 HydrophobicContact CE1-CB 3.62Å; Y207-C244 WeakPolarHBondContact OH-CA 3.49Å; Y207-C244 WeakPolarHBondContact OH-CB 3.49Å; Y207-C244 PolarHBondContact OH-N 3.07Å; V240-C244 WeakPolarHBondContact O-CB 3Å; V240-C244 PolarHBondContact O-N 3.34Å; V241-C244 WeakPolarHBondContact O-CB 3.37Å; V241-C244 PolarHBondContact O-N 2.93Å; T242-C244 VanDerWaalsContact C-N 3.33Å; T242-C244 PolarHBondContact O-N 3.29Å; C244-F246 VanDerWaalsContact C-N 3.25Å; C244-F246 PolarHBondContact O-N 3.19Å; C244-W247 PolarHBondContact O-N 2.99Å; C244-L248 WeakPolarHBondContact O-CA 3.46Å; C244-L248 WeakPolarHBondContact O-CB 3.22Å; C244-L248 PolarHBondContact O-N 2.83Å |
| 245 | L | 93.4 | Very high | 90.5 | Very high | 111 Ų | 111 | 36.2 Ų | 36.2 | 58% | 0.581 | 20% | 0.197 | S | C | * | . | H | α-helix | trans | -60.2 | -37.5 | -177.6 | -70 | 171.1 | 0 | 0 | 0 | 112.2 | V241 T242 P249 | V241-L245 HydrophobicContact CG1-CD1 3.82Å; V241-L245 HydrophobicContact CG1-CG 4.24Å; V241-L245 VanDerWaalsContact O-CG 3.27Å; V241-L245 WeakPolarHBondContact O-CG 3.28Å; V241-L245 PolarHBondContact O-N 3.45Å; T242-L245 PolarHBondContact O-N 3.5Å; L245-P249 VanDerWaalsContact O-CD 3.31Å; L245-P249 WeakPolarHBondContact O-CD 3.35Å |
| 246 | F | 93.6 | Very high | 91.1 | Very high | 53 Ų | 53 | 36.9 Ų | 36.9 | 23% | 0.232 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -82.3 | -31.8 | -179.6 | -68.4 | -48.2 | 0 | 0 | 0 | 114 | T242 F243 C244 I287 I290 A294 | T242-F246 HydrophobicContact CG2-CD2 3.62Å; T242-F246 HydrophobicContact CG2-CE2 3.35Å; T242-F246 HydrophobicContact CG2-CZ 4.47Å; T242-F246 WeakPolarHBondContact O-CD2 3.2Å; T242-F246 PolarHBondContact O-N 3.21Å; T242-F246 VanDerWaalsContact O-N 3.15Å; F243-F246 PolarHBondContact O-N 3.25Å; C244-F246 VanDerWaalsContact C-N 3.25Å; C244-F246 PolarHBondContact O-N 3.19Å; F246-I287 HydrophobicContact CB-CG2 4.45Å; F246-I287 HydrophobicContact CD1-CG2 3.82Å; F246-I290 HydrophobicContact CD1-CB 4.22Å; F246-I290 HydrophobicContact CD1-CG2 4.34Å; F246-I290 HydrophobicContact CE1-CB 4.1Å; F246-I290 HydrophobicContact CE1-CG2 3.76Å; F246-I290 HydrophobicContact CE2-CG2 3.92Å; F246-I290 HydrophobicContact CZ-CB 4.26Å; F246-I290 HydrophobicContact CZ-CG2 3.52Å; F246-A294 HydrophobicContact CD2-CB 4.49Å; F246-A294 HydrophobicContact CE2-CB 3.84Å |
| 247 | W | 92.8 | Very high | 91.6 | Very high | 13 Ų | 13 | 36.9 Ų | 36.9 | 5% | 0.049 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -92.6 | -23.8 | -179 | -76.9 | 93.6 | 0 | 0 | 0 | 114.4 | M113 F243 C244 Y250 H251 A288 S291 | M113-W247 HydrophobicContact CB-CH2 3.43Å; M113-W247 VanDerWaalsContact CB-CH2 3.43Å; M113-W247 HydrophobicContact CB-CZ2 3.89Å; M113-W247 HydrophobicContact CB-CZ3 3.86Å; M113-W247 HydrophobicContact CG-CD2 4.12Å; M113-W247 HydrophobicContact CG-CE3 3.68Å; M113-W247 HydrophobicContact CG-CH2 3.38Å; M113-W247 HydrophobicContact CG-CZ2 3.81Å; M113-W247 HydrophobicContact CG-CZ3 3.31Å; M113-W247 HydrophobicContact SD-CE3 3.64Å; M113-W247 HydrophobicContact SD-CH2 3.88Å; M113-W247 HydrophobicContact SD-CZ3 3.22Å; M113-W247 WeakPolarHBondContact SD-CZ3 3.44Å; F243-W247 AromaticContact CD1-CD1 3.7Å; F243-W247 HydrophobicContact CD1-CG 4.32Å; F243-W247 AromaticContact CD2-CD1 3.61Å; F243-W247 AromaticContact CD2-NE1 3.66Å; F243-W247 HydrophobicContact CE1-CB 4.41Å; F243-W247 AromaticContact CE1-CD1 3.46Å; F243-W247 VanDerWaalsContact CE1-CD1 3.46Å; F243-W247 AromaticContact CE1-CG 3.87Å; F243-W247 HydrophobicContact CE1-CG 3.87Å; F243-W247 AromaticContact CE1-NE1 3.88Å; F243-W247 AromaticContact CE2-CD1 3.43Å; F243-W247 VanDerWaalsContact CE2-CD1 3.43Å; F243-W247 HydrophobicContact CE2-CG 4.44Å; F243-W247 AromaticContact CE2-NE1 3.12Å; F243-W247 AromaticContact CG-CD1 3.75Å; F243-W247 AromaticContact CZ-CD1 3.34Å; F243-W247 HydrophobicContact CZ-CD2 4.24Å; F243-W247 AromaticContact CZ-CE2 3.82Å; F243-W247 AromaticContact CZ-CG 3.96Å; F243-W247 HydrophobicContact CZ-CG 3.96Å; F243-W247 AromaticContact CZ-NE1 3.23Å; F243-W247 WeakPolarHBondContact O-CB 3.34Å; F243-W247 VanDerWaalsContact O-CD1 3.27Å; F243-W247 PolarHBondContact O-N 3.36Å; C244-W247 PolarHBondContact O-N 2.99Å; W247-Y250 HydrophobicContact CE3-CD1 4.09Å; W247-Y250 HydrophobicContact CE3-CG 4.2Å; W247-Y250 HydrophobicContact CZ3-CD1 4.14Å; W247-Y250 HydrophobicContact CZ3-CD2 4.48Å; W247-Y250 HydrophobicContact CZ3-CE1 4.41Å; W247-Y250 HydrophobicContact CZ3-CG 4.23Å; W247-Y250 WeakPolarHBondContact O-CB 3.32Å; W247-Y250 PolarHBondContact O-N 3.28Å; W247-Y250 VanDerWaalsContact O-N 3.09Å; W247-H251 PolarHBondContact O-CD2 3.34Å; W247-H251 VanDerWaalsContact O-CD2 3.23Å; W247-H251 PolarHBondContact O-N 3.41Å; W247-A288 HydrophobicContact CD2-CB 3.94Å; W247-A288 HydrophobicContact CE3-CB 3.83Å; W247-A288 HydrophobicContact CH2-CB 3.93Å; W247-A288 HydrophobicContact CZ2-CB 4.06Å; W247-A288 HydrophobicContact CZ3-CB 3.81Å; W247-S291 PolarHBondContact NE1-OG 2.93Å |
| 248 | L | 93 | Very high | 92 | Very high | 63 Ų | 63 | 33.5 Ų | 33.5 | 33% | 0.33 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -54.9 | -45.7 | 179.5 | 176.3 | 67.4 | 0 | 0 | 0 | 112.9 | F203 C244 Y250 H251 I252 | F203-L248 HydrophobicContact CE1-CD1 4.43Å; F203-L248 HydrophobicContact CE2-CD1 4.06Å; F203-L248 HydrophobicContact CZ-CD1 3.65Å; C244-L248 WeakPolarHBondContact O-CA 3.46Å; C244-L248 WeakPolarHBondContact O-CB 3.22Å; C244-L248 PolarHBondContact O-N 2.83Å; L248-Y250 VanDerWaalsContact C-N 3.28Å; L248-Y250 PolarHBondContact O-N 2.86Å; L248-H251 PolarHBondContact O-N 2.82Å; L248-I252 HydrophobicContact CD1-CD1 4.1Å; L248-I252 HydrophobicContact CD1-CG1 4.19Å; L248-I252 HydrophobicContact CG-CD1 3.87Å; L248-I252 HydrophobicContact CG-CG1 4.4Å; L248-I252 WeakPolarHBondContact O-CG1 3.4Å; L248-I252 PolarHBondContact O-N 2.93Å |
| 249 | P | 94 | Very high | 92.2 | Very high | 37 Ų | 37 | 33.8 Ų | 33.8 | 24% | 0.24 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -59.2 | -38.9 | 177.3 | -23.7 | 34.8 | 0 | 0 | 0 | 112.7 | L245 I252 I253 T284 | L245-P249 VanDerWaalsContact O-CD 3.31Å; L245-P249 WeakPolarHBondContact O-CD 3.35Å; P249-I252 PolarHBondContact O-N 3.33Å; P249-I253 WeakPolarHBondContact O-CG1 3.45Å; P249-I253 PolarHBondContact O-N 3.35Å; P249-T284 HydrophobicContact CB-CG2 3.68Å |
| 250 | Y | 93.3 | Very high | 92.4 | Very high | 24 Ų | 24 | 34 Ų | 34 | 9% | 0.094 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -62.9 | -47.7 | 176.7 | 176.6 | -83.3 | 0 | 0 | 0 | 111 | M113 E198 W247 L248 I252 I253 N254 R281 | M113-Y250 HydrophobicContact SD-CE1 4.17Å; E198-Y250 PolarHBondContact OE2-OH 3.48Å; W247-Y250 HydrophobicContact CE3-CD1 4.09Å; W247-Y250 HydrophobicContact CE3-CG 4.2Å; W247-Y250 HydrophobicContact CZ3-CD1 4.14Å; W247-Y250 HydrophobicContact CZ3-CD2 4.48Å; W247-Y250 HydrophobicContact CZ3-CE1 4.41Å; W247-Y250 HydrophobicContact CZ3-CG 4.23Å; W247-Y250 WeakPolarHBondContact O-CB 3.32Å; W247-Y250 PolarHBondContact O-N 3.28Å; W247-Y250 VanDerWaalsContact O-N 3.09Å; L248-Y250 VanDerWaalsContact C-N 3.28Å; L248-Y250 PolarHBondContact O-N 2.86Å; Y250-I252 VanDerWaalsContact C-N 3.34Å; Y250-I252 PolarHBondContact O-N 2.72Å; Y250-I253 PolarHBondContact O-N 2.67Å; Y250-I253 VanDerWaalsContact O-N 3.16Å; Y250-N254 VanDerWaalsContact CE1-ND2 3.3Å; Y250-N254 WeakPolarHBondContact CE1-ND2 3.26Å; Y250-N254 PolarHBondContact O-N 3.05Å; Y250-N254 PolarHBondContact O-OD1 2.89Å; Y250-R281 VanDerWaalsContact CD2-NH1 3.26Å; Y250-R281 VanDerWaalsContact CZ-NH1 3.3Å; Y250-R281 PolarHBondContact OH-NH2 3.25Å |
| 251 | H | 94 | Very high | 92.5 | Very high | 0 Ų | 0 | 33.9 Ų | 33.9 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -67.2 | -32.9 | 179.4 | -69.7 | -62.9 | 0 | 0 | 0 | 113.2 | F203 W247 L248 I253 N254 M255 | F203-H251 HydrophobicContact CD2-CB 4.39Å; F203-H251 AromaticContact CD2-CD2 3.41Å; F203-H251 VanDerWaalsContact CD2-CD2 3.41Å; F203-H251 WeakPolarHBondContact CD2-CD2 3.33Å; F203-H251 AromaticContact CD2-CG 3.99Å; F203-H251 HydrophobicContact CG-CB 4.4Å; F203-H251 AromaticContact CG-CD2 3.89Å; W247-H251 PolarHBondContact O-CD2 3.34Å; W247-H251 VanDerWaalsContact O-CD2 3.23Å; W247-H251 PolarHBondContact O-N 3.41Å; L248-H251 PolarHBondContact O-N 2.82Å; H251-I253 VanDerWaalsContact C-N 3.32Å; H251-I253 PolarHBondContact O-N 2.97Å; H251-N254 WeakPolarHBondContact O-CB 3.26Å; H251-N254 PolarHBondContact O-N 3.37Å; H251-M255 WeakPolarHBondContact O-CG 3.34Å; H251-M255 PolarHBondContact O-N 3.48Å |
| 252 | I | 94.6 | Very high | 92.5 | Very high | 80 Ų | 80 | 36.5 Ų | 36.5 | 41% | 0.41 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -60.8 | -44.1 | 171.9 | -69.9 | 167.3 | 0 | 0 | 0 | 110.3 | L248 P249 Y250 N254 M255 V256 | L248-I252 HydrophobicContact CD1-CD1 4.1Å; L248-I252 HydrophobicContact CD1-CG1 4.19Å; L248-I252 HydrophobicContact CG-CD1 3.87Å; L248-I252 HydrophobicContact CG-CG1 4.4Å; L248-I252 WeakPolarHBondContact O-CG1 3.4Å; L248-I252 PolarHBondContact O-N 2.93Å; P249-I252 PolarHBondContact O-N 3.33Å; Y250-I252 VanDerWaalsContact C-N 3.34Å; Y250-I252 PolarHBondContact O-N 2.72Å; I252-N254 VanDerWaalsContact C-N 3.34Å; I252-N254 PolarHBondContact O-N 2.87Å; I252-M255 WeakPolarHBondContact O-CB 3.1Å; I252-M255 PolarHBondContact O-N 3.14Å; I252-M255 VanDerWaalsContact O-N 3.16Å; I252-V256 WeakPolarHBondContact O-CG2 3.46Å; I252-V256 PolarHBondContact O-N 3.09Å |
| 253 | I | 93.6 | Very high | 92.5 | Very high | 11 Ų | 11 | 37.7 Ų | 37.7 | 6% | 0.056 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -64.6 | -38.8 | 177.1 | -64.7 | -54.7 | 0 | 0 | 0 | 111.5 | P249 Y250 H251 M255 V256 Q257 W277 F280 T284 | P249-I253 WeakPolarHBondContact O-CG1 3.45Å; P249-I253 PolarHBondContact O-N 3.35Å; Y250-I253 PolarHBondContact O-N 2.67Å; Y250-I253 VanDerWaalsContact O-N 3.16Å; H251-I253 VanDerWaalsContact C-N 3.32Å; H251-I253 PolarHBondContact O-N 2.97Å; I253-M255 VanDerWaalsContact C-N 3.33Å; I253-M255 PolarHBondContact O-N 2.85Å; I253-V256 PolarHBondContact O-N 3.26Å; I253-Q257 WeakPolarHBondContact O-CB 3.4Å; I253-Q257 PolarHBondContact O-N 3.02Å; I253-W277 HydrophobicContact CG2-CB 3.82Å; I253-F280 HydrophobicContact CD1-CB 3.63Å; I253-F280 HydrophobicContact CD1-CG 4.48Å; I253-F280 HydrophobicContact CG1-CB 4.16Å; I253-T284 HydrophobicContact CG1-CG2 3.75Å |
| 254 | N | 93.4 | Very high | 92.3 | Very high | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -60.6 | -41.8 | 171.9 | -73.8 | 13.6 | 0 | 0 | 0 | 111.6 | Y195 E198 I199 Y250 H251 I252 V256 Q257 V258 | Y195-N254 HydrophobicContact CD1-CB 4.4Å; E198-N254 PolarHBondContact OE2-ND2 3.48Å; I199-N254 HydrophobicContact CD1-CB 3.95Å; I199-N254 HydrophobicContact CG1-CB 3.96Å; Y250-N254 VanDerWaalsContact CE1-ND2 3.3Å; Y250-N254 WeakPolarHBondContact CE1-ND2 3.26Å; Y250-N254 PolarHBondContact O-N 3.05Å; Y250-N254 PolarHBondContact O-OD1 2.89Å; H251-N254 WeakPolarHBondContact O-CB 3.26Å; H251-N254 PolarHBondContact O-N 3.37Å; I252-N254 VanDerWaalsContact C-N 3.34Å; I252-N254 PolarHBondContact O-N 2.87Å; N254-V256 VanDerWaalsContact C-N 3.35Å; N254-V256 PolarHBondContact O-N 2.99Å; N254-Q257 WeakPolarHBondContact O-CB 3.48Å; N254-Q257 PolarHBondContact O-N 2.92Å; N254-V258 WeakPolarHBondContact O-CG2 3.28Å; N254-V258 PolarHBondContact O-N 3.2Å |
| 255 | M | 94 | Very high | 91.7 | Very high | 82 Ų | 82 | 47.7 Ų | 47.7 | 40% | 0.404 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -62.7 | -41.4 | 176.2 | -68.5 | 172.7 | -161.9 | 0 | 0 | 111.8 | I199 H251 I252 I253 Q257 V258 A259 | I199-M255 HydrophobicContact CD1-CB 4.4Å; I199-M255 HydrophobicContact CD1-CG 3.67Å; I199-M255 HydrophobicContact CG1-CG 4.36Å; I199-M255 HydrophobicContact CG2-CE 4.12Å; H251-M255 WeakPolarHBondContact O-CG 3.34Å; H251-M255 PolarHBondContact O-N 3.48Å; I252-M255 WeakPolarHBondContact O-CB 3.1Å; I252-M255 PolarHBondContact O-N 3.14Å; I252-M255 VanDerWaalsContact O-N 3.16Å; I253-M255 VanDerWaalsContact C-N 3.33Å; I253-M255 PolarHBondContact O-N 2.85Å; M255-Q257 VanDerWaalsContact C-N 3.31Å; M255-Q257 PolarHBondContact O-N 3.2Å; M255-V258 PolarHBondContact O-N 3.44Å; M255-A259 WeakPolarHBondContact O-CB 3.34Å; M255-A259 PolarHBondContact O-N 3.34Å |
| 256 | V | 93.4 | Very high | 91 | Very high | 30 Ų | 30 | 46.6 Ų | 46.6 | 18% | 0.182 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -62.4 | -40.5 | 175.1 | 173.2 | 0 | 0 | 0 | 0 | 110.9 | I252 I253 N254 A259 S260 L273 I276 W277 | I252-V256 WeakPolarHBondContact O-CG2 3.46Å; I252-V256 PolarHBondContact O-N 3.09Å; I253-V256 PolarHBondContact O-N 3.26Å; N254-V256 VanDerWaalsContact C-N 3.35Å; N254-V256 PolarHBondContact O-N 2.99Å; V256-A259 PolarHBondContact O-N 3.31Å; V256-S260 WeakPolarHBondContact O-CB 3.32Å; V256-S260 PolarHBondContact O-N 2.93Å; V256-L273 HydrophobicContact CG1-CB 3.98Å; V256-L273 HydrophobicContact CG1-CD2 4.34Å; V256-L273 HydrophobicContact CG1-CG 3.93Å; V256-I276 HydrophobicContact CG1-CG2 4.39Å; V256-W277 HydrophobicContact CG1-CB 4.08Å |
| 257 | Q | 91.3 | Very high | 90.8 | Very high | 10 Ų | 10 | 45.2 Ų | 45.2 | 5% | 0.047 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -65.3 | -45.4 | 178.1 | -168.4 | 169.7 | 5.2 | 0 | 0 | 111.6 | V191 Y195 I253 N254 M255 S260 A261 W277 | V191-Q257 HydrophobicContact CG1-CG 3.94Å; Y195-Q257 HydrophobicContact CD2-CG 4.08Å; Y195-Q257 HydrophobicContact CE2-CG 4.03Å; Y195-Q257 PolarHBondContact OH-NE2 3.09Å; I253-Q257 WeakPolarHBondContact O-CB 3.4Å; I253-Q257 PolarHBondContact O-N 3.02Å; N254-Q257 WeakPolarHBondContact O-CB 3.48Å; N254-Q257 PolarHBondContact O-N 2.92Å; M255-Q257 VanDerWaalsContact C-N 3.31Å; M255-Q257 PolarHBondContact O-N 3.2Å; Q257-S260 PolarHBondContact O-N 2.8Å; Q257-S260 PolarHBondContact O-OG 3.45Å; Q257-A261 PolarHBondContact O-N 3.02Å; Q257-A261 VanDerWaalsContact O-N 3.14Å; Q257-W277 HydrophobicContact CB-CG 4.3Å; Q257-W277 HydrophobicContact CG-CD2 4.28Å; Q257-W277 HydrophobicContact CG-CG 4.45Å |
| 258 | V | 92.1 | Very high | 90.6 | Very high | 9 Ų | 9 | 49.8 Ų | 49.8 | 6% | 0.055 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -59.6 | -47.7 | 173 | 172.6 | 0 | 0 | 0 | 0 | 111 | V192 M196 I199 N254 M255 S260 A261 L262 | V192-V258 HydrophobicContact CG1-CG1 4.23Å; V192-V258 HydrophobicContact CG2-CG1 4.35Å; M196-V258 HydrophobicContact CG-CG1 3.94Å; M196-V258 HydrophobicContact CG-CG2 4Å; M196-V258 HydrophobicContact SD-CG1 3.84Å; M196-V258 HydrophobicContact SD-CG2 4.19Å; I199-V258 HydrophobicContact CD1-CG2 4.33Å; N254-V258 WeakPolarHBondContact O-CG2 3.28Å; N254-V258 PolarHBondContact O-N 3.2Å; M255-V258 PolarHBondContact O-N 3.44Å; V258-S260 VanDerWaalsContact C-N 3.26Å; V258-S260 PolarHBondContact O-N 3.32Å; V258-A261 PolarHBondContact O-N 3.42Å; V258-A261 VanDerWaalsContact O-N 3.13Å; V258-L262 HydrophobicContact CG1-CD1 4.08Å; V258-L262 HydrophobicContact CG1-CG 4.48Å; V258-L262 WeakPolarHBondContact O-CG 3.26Å; V258-L262 PolarHBondContact O-N 3.13Å; V258-L262 VanDerWaalsContact O-N 3.12Å |
| 259 | A | 92.6 | Very high | 90.5 | Very high | 40 Ų | 40 | 53.8 Ų | 53.8 | 33% | 0.331 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -60.7 | -36.3 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | M255 V256 L262 L263 L273 | M255-A259 WeakPolarHBondContact O-CB 3.34Å; M255-A259 PolarHBondContact O-N 3.34Å; V256-A259 PolarHBondContact O-N 3.31Å; A259-L262 PolarHBondContact O-N 3.05Å; A259-L263 WeakPolarHBondContact O-CG 3.48Å; A259-L273 HydrophobicContact CB-CD2 3.83Å |
| 260 | S | 91.1 | Very high | 90.3 | Very high | 7 Ų | 7 | 53.5 Ų | 53.5 | 5% | 0.049 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -65.8 | -37.3 | 175.9 | 74.7 | 0 | 0 | 0 | 0 | 112.9 | V256 Q257 V258 L263 R270 | V256-S260 WeakPolarHBondContact O-CB 3.32Å; V256-S260 PolarHBondContact O-N 2.93Å; Q257-S260 PolarHBondContact O-N 2.8Å; Q257-S260 PolarHBondContact O-OG 3.45Å; V258-S260 VanDerWaalsContact C-N 3.26Å; V258-S260 PolarHBondContact O-N 3.32Å; S260-L263 PolarHBondContact O-N 3.09Å; S260-R270 WeakPolarHBondContact O-CD 3.37Å; S260-R270 WeakPolarHBondContact O-CG 3.36Å |
| 261 | A | 89.9 | Confident | 90 | Very high | 10 Ų | 10 | 55 Ų | 55 | 8% | 0.083 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -74.6 | -23.7 | 179.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | D188 V191 V192 Q257 V258 L263 | D188-A261 HydrophobicContact CB-CB 4.16Å; V191-A261 HydrophobicContact CB-CB 4.12Å; V191-A261 HydrophobicContact CG1-CB 3.97Å; V192-A261 HydrophobicContact CG2-CB 3.91Å; Q257-A261 PolarHBondContact O-N 3.02Å; Q257-A261 VanDerWaalsContact O-N 3.14Å; V258-A261 PolarHBondContact O-N 3.42Å; V258-A261 VanDerWaalsContact O-N 3.13Å; A261-L263 VanDerWaalsContact C-N 3.32Å |
| 262 | L | 91.1 | Very high | 89.8 | Confident | 124 Ų | 124 | 59.9 Ų | 59.9 | 65% | 0.649 | 33% | 0.329 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.6 | -10.7 | 175.4 | -66.6 | 174.4 | 0 | 0 | 0 | 113.4 | V192 V258 A259 | V192-L262 HydrophobicContact CG2-CD2 3.9Å; V192-L262 HydrophobicContact CG2-CG 4.18Å; V258-L262 HydrophobicContact CG1-CD1 4.08Å; V258-L262 HydrophobicContact CG1-CG 4.48Å; V258-L262 WeakPolarHBondContact O-CG 3.26Å; V258-L262 PolarHBondContact O-N 3.13Å; V258-L262 VanDerWaalsContact O-N 3.12Å; A259-L262 PolarHBondContact O-N 3.05Å |
| 263 | L | 90.1 | Very high | 89.6 | Confident | 52 Ų | 52 | 57.8 Ų | 57.8 | 27% | 0.272 | 32% | 0.318 | S | S | . | . | S | Bend | trans | -88.1 | 148.6 | 179.4 | -72.1 | 171.3 | 0 | 0 | 0 | 111.4 | A259 S260 A261 K269 R270 L273 | A259-L263 WeakPolarHBondContact O-CG 3.48Å; S260-L263 PolarHBondContact O-N 3.09Å; A261-L263 VanDerWaalsContact C-N 3.32Å; L263-K269 HydrophobicContact CD1-CB 3.92Å; L263-R270 HydrophobicContact CB-CB 4.08Å; L263-R270 HydrophobicContact CD1-CB 4.32Å; L263-R270 PolarHBondContact O-NH1 3.49Å; L263-L273 HydrophobicContact CD1-CD2 4.35Å |
| 264 | P | 86.5 | Confident | 89.3 | Confident | 93 Ų | 93 | 58.9 Ų | 58.9 | 60% | 0.604 | 32% | 0.323 | S | S | * | . | P | Polyproline II helix | trans | -53.6 | 143.7 | 175.2 | -24.7 | 33.3 | 0 | 0 | 0 | 112.4 | S267 | P264-S267 WeakPolarHBondContact O-CB 3.29Å; P264-S267 PolarHBondContact O-N 3.45Å; P264-S267 PolarHBondContact O-OG 2.63Å; P264-S267 VanDerWaalsContact O-OG 3.11Å |
| 265 | E | 78.3 | Confident | 89 | Confident | 153 Ų | 153 | 64.4 Ų | 64.4 | 72% | 0.715 | 35% | 0.347 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.5 | 138.9 | 173.1 | -66 | -173 | -176.2 | 0 | 0 | 110.3 | S267 | E265-S267 PolarHBondContact O-N 3.21Š|
| 266 | C | 79.4 | Confident | 88.7 | Confident | 87 Ų | 87 | 63.4 Ų | 63.4 | 59% | 0.588 | 34% | 0.343 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 63.5 | 11 | -178.9 | -57.1 | 0 | 0 | 0 | 0 | 117.3 | C17 | C17-C266 VanDerWaalsContact SG-SG 3.65Š|
| 267 | S | 89.1 | Confident | 88.5 | Confident | 24 Ų | 24 | 63.7 Ų | 63.7 | 17% | 0.168 | 34% | 0.341 | C | S | . | . | trans | -66.9 | 138.3 | 171.9 | 68 | 0 | 0 | 0 | 0 | 111.6 | P264 E265 K269 R270 L271 | P264-S267 WeakPolarHBondContact O-CB 3.29Å; P264-S267 PolarHBondContact O-N 3.45Å; P264-S267 PolarHBondContact O-OG 2.63Å; P264-S267 VanDerWaalsContact O-OG 3.11Å; E265-S267 PolarHBondContact O-N 3.21Å; S267-K269 PolarHBondContact O-N 3.29Å; S267-K269 VanDerWaalsContact O-N 3.1Å; S267-R270 WeakPolarHBondContact O-CB 2.97Å; S267-R270 PolarHBondContact O-N 3.3Å; S267-R270 VanDerWaalsContact OG-CB 3.22Å; S267-R270 WeakPolarHBondContact OG-CB 3.36Å; S267-R270 PolarHBondContact OG-N 3.1Å; S267-L271 PolarHBondContact O-N 3.23Å | ||
| 268 | P | 88.6 | Confident | 88.2 | Confident | 109 Ų | 109 | 67 Ų | 67 | 71% | 0.708 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -55.8 | -32.1 | 177.8 | -27 | 33.6 | 0 | 0 | 0 | 113.2 | L272 | P268-L272 PolarHBondContact O-N 3.19Å; P268-L272 VanDerWaalsContact O-N 3.09Å |
| 269 | K | 89.6 | Confident | 87.7 | Confident | 148 Ų | 148 | 70.8 Ų | 70.8 | 64% | 0.643 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -66 | -44.5 | 175.3 | -67.3 | -177.6 | -179.6 | 178.3 | 0 | 111.9 | L263 S267 L271 L272 L273 | L263-K269 HydrophobicContact CD1-CB 3.92Å; S267-K269 PolarHBondContact O-N 3.29Å; S267-K269 VanDerWaalsContact O-N 3.1Å; K269-L271 PolarHBondContact O-N 3.14Å; K269-L272 WeakPolarHBondContact O-CB 3.47Å; K269-L272 PolarHBondContact O-N 3.23Å; K269-L273 VanDerWaalsContact O-CD1 3.22Å; K269-L273 WeakPolarHBondContact O-CD1 3.26Å; K269-L273 PolarHBondContact O-N 3.16Å |
| 270 | R | 90.2 | Very high | 87.4 | Confident | 30 Ų | 30 | 73.1 Ų | 73.1 | 11% | 0.113 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -59.1 | -47.3 | 176 | 177.8 | 171.8 | 175.5 | 152.8 | 2.4 | 111 | D188 S260 L263 S267 L272 L273 E274 | D188-R270 IonicContact OD1-CZ 3.56Å; D188-R270 IonicContact OD1-NH1 2.91Å; D188-R270 IonicContact OD1-NH2 3.3Å; D188-R270 PolarHBondContact OD1-NH2 2.93Å; D188-R270 IonicContact OD2-CZ 3.96Å; D188-R270 IonicContact OD2-NH1 2.86Å; D188-R270 PolarHBondContact OD2-NH1 3.11Å; D188-R270 IonicContact OD2-NH2 3.31Å; D188-R270 PolarHBondContact OD2-NH2 3.29Å; S260-R270 WeakPolarHBondContact O-CD 3.37Å; S260-R270 WeakPolarHBondContact O-CG 3.36Å; L263-R270 HydrophobicContact CB-CB 4.08Å; L263-R270 HydrophobicContact CD1-CB 4.32Å; L263-R270 PolarHBondContact O-NH1 3.49Å; S267-R270 WeakPolarHBondContact O-CB 2.97Å; S267-R270 PolarHBondContact O-N 3.3Å; S267-R270 VanDerWaalsContact OG-CB 3.22Å; S267-R270 WeakPolarHBondContact OG-CB 3.36Å; S267-R270 PolarHBondContact OG-N 3.1Å; R270-L272 VanDerWaalsContact C-N 3.32Å; R270-L272 PolarHBondContact O-N 3.36Å; R270-L273 PolarHBondContact O-N 3.18Å; R270-E274 HydrophobicContact CG-CG 4.43Å; R270-E274 IonicContact NE-OE1 3.71Å; R270-E274 PolarHBondContact NE-OE1 2.93Å; R270-E274 WeakPolarHBondContact O-CB 3.28Å; R270-E274 WeakPolarHBondContact O-CG 2.89Å; R270-E274 PolarHBondContact O-N 3.44Å |
| 271 | L | 87.3 | Confident | 87.3 | Confident | 55 Ų | 55 | 74.3 Ų | 74.3 | 29% | 0.288 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -59.4 | -41.3 | 178 | -62.8 | 175 | 0 | 0 | 0 | 112.4 | C17 I19 S267 K269 E274 K275 | C17-L271 HydrophobicContact CB-CD2 4.03Å; I19-L271 HydrophobicContact CD1-CB 4.45Å; I19-L271 HydrophobicContact CD1-CD2 3.9Å; I19-L271 HydrophobicContact CG1-CD2 4.25Å; S267-L271 PolarHBondContact O-N 3.23Å; K269-L271 PolarHBondContact O-N 3.14Å; L271-E274 PolarHBondContact O-N 3.49Å; L271-K275 WeakPolarHBondContact O-CB 3.45Å; L271-K275 PolarHBondContact O-N 2.87Å |
| 272 | L | 90.3 | Very high | 87 | Confident | 103 Ų | 103 | 76.3 Ų | 76.3 | 54% | 0.539 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -62.2 | -50 | 175.2 | -178.1 | 73.5 | 0 | 0 | 0 | 111.5 | P268 K269 R270 E274 K275 I276 | P268-L272 PolarHBondContact O-N 3.19Å; P268-L272 VanDerWaalsContact O-N 3.09Å; K269-L272 WeakPolarHBondContact O-CB 3.47Å; K269-L272 PolarHBondContact O-N 3.23Å; R270-L272 VanDerWaalsContact C-N 3.32Å; R270-L272 PolarHBondContact O-N 3.36Å; L272-E274 VanDerWaalsContact C-N 3.31Å; L272-E274 PolarHBondContact O-N 2.91Å; L272-K275 WeakPolarHBondContact O-CB 3.4Å; L272-K275 PolarHBondContact O-N 3.09Å; L272-I276 HydrophobicContact CG-CD1 4.02Å; L272-I276 VanDerWaalsContact O-CG1 3.29Å; L272-I276 WeakPolarHBondContact O-CG1 3.37Å; L272-I276 PolarHBondContact O-N 3.49Å |
| 273 | L | 89.4 | Confident | 86.8 | Confident | 36 Ų | 36 | 73.7 Ų | 73.7 | 19% | 0.188 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -63.7 | -38.5 | 179.9 | -89.6 | 65.3 | 0 | 0 | 0 | 111.4 | V256 A259 L263 K269 R270 I276 W277 | V256-L273 HydrophobicContact CG1-CB 3.98Å; V256-L273 HydrophobicContact CG1-CD2 4.34Å; V256-L273 HydrophobicContact CG1-CG 3.93Å; A259-L273 HydrophobicContact CB-CD2 3.83Å; L263-L273 HydrophobicContact CD1-CD2 4.35Å; K269-L273 VanDerWaalsContact O-CD1 3.22Å; K269-L273 WeakPolarHBondContact O-CD1 3.26Å; K269-L273 PolarHBondContact O-N 3.16Å; R270-L273 PolarHBondContact O-N 3.18Å; L273-I276 PolarHBondContact O-N 3.41Å; L273-W277 PolarHBondContact O-N 3.15Å |
| 274 | E | 87.8 | Confident | 86.8 | Confident | 35 Ų | 35 | 71.7 Ų | 71.7 | 16% | 0.164 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -59.1 | -46.1 | 173.7 | -79.9 | -168.2 | -151.4 | 0 | 0 | 112.7 | I19 R270 L271 L272 I276 W277 K278 | I19-E274 HydrophobicContact CD1-CB 4.06Å; R270-E274 HydrophobicContact CG-CG 4.43Å; R270-E274 IonicContact NE-OE1 3.71Å; R270-E274 PolarHBondContact NE-OE1 2.93Å; R270-E274 WeakPolarHBondContact O-CB 3.28Å; R270-E274 WeakPolarHBondContact O-CG 2.89Å; R270-E274 PolarHBondContact O-N 3.44Å; L271-E274 PolarHBondContact O-N 3.49Å; L272-E274 VanDerWaalsContact C-N 3.31Å; L272-E274 PolarHBondContact O-N 2.91Å; E274-I276 VanDerWaalsContact C-N 3.3Å; E274-I276 PolarHBondContact O-N 3Å; E274-W277 VanDerWaalsContact CA-CD1 3.44Å; E274-K278 VanDerWaalsContact O-CB 3.26Å; E274-K278 WeakPolarHBondContact O-CB 3.33Å; E274-K278 WeakPolarHBondContact O-CD 3.02Å; E274-K278 VanDerWaalsContact O-CG 3.22Å; E274-K278 WeakPolarHBondContact O-CG 3.5Å; E274-K278 PolarHBondContact O-N 3.17Å; E274-K278 IonicContact OE2-NZ 2.75Å; E274-K278 PolarHBondContact OE2-NZ 3.38Å |
| 275 | K | 86.8 | Confident | 86.9 | Confident | 116 Ų | 116 | 68.8 Ų | 68.8 | 50% | 0.504 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -61 | -41.8 | 175.5 | -171.5 | 173.8 | -176 | 172.4 | 0 | 111.1 | L271 L272 K279 | L271-K275 WeakPolarHBondContact O-CB 3.45Å; L271-K275 PolarHBondContact O-N 2.87Å; L272-K275 WeakPolarHBondContact O-CB 3.4Å; L272-K275 PolarHBondContact O-N 3.09Å; K275-K279 WeakPolarHBondContact O-CB 3.33Å; K275-K279 PolarHBondContact O-N 2.84Å; K275-K279 VanDerWaalsContact O-N 3.09Å |
| 276 | I | 88.1 | Confident | 87.4 | Confident | 61 Ų | 61 | 62.3 Ų | 62.3 | 31% | 0.313 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -63.7 | -55.4 | 179.4 | -68 | 165 | 0 | 0 | 0 | 110.7 | V256 L272 L273 E274 K278 K279 F280 | V256-I276 HydrophobicContact CG1-CG2 4.39Å; L272-I276 HydrophobicContact CG-CD1 4.02Å; L272-I276 VanDerWaalsContact O-CG1 3.29Å; L272-I276 WeakPolarHBondContact O-CG1 3.37Å; L272-I276 PolarHBondContact O-N 3.49Å; L273-I276 PolarHBondContact O-N 3.41Å; E274-I276 VanDerWaalsContact C-N 3.3Å; E274-I276 PolarHBondContact O-N 3Å; I276-K278 PolarHBondContact O-N 2.83Å; I276-K279 WeakPolarHBondContact O-CB 3.5Å; I276-K279 PolarHBondContact O-N 2.99Å; I276-F280 HydrophobicContact CG2-CD2 4.04Å; I276-F280 HydrophobicContact CG2-CE2 4.42Å; I276-F280 VanDerWaalsContact O-CD2 3.29Å; I276-F280 WeakPolarHBondContact O-CD2 3.34Å; I276-F280 PolarHBondContact O-N 3.07Å; I276-F280 VanDerWaalsContact O-N 3.09Å |
| 277 | W | 88.1 | Confident | 88 | Confident | 36 Ų | 36 | 60.8 Ų | 60.8 | 14% | 0.136 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -65.8 | -41.8 | -174.9 | 74.7 | -112.6 | 0 | 0 | 0 | 111.7 | I253 V256 Q257 L273 E274 K279 F280 R281 | I253-W277 HydrophobicContact CG2-CB 3.82Å; V256-W277 HydrophobicContact CG1-CB 4.08Å; Q257-W277 HydrophobicContact CB-CG 4.3Å; Q257-W277 HydrophobicContact CG-CD2 4.28Å; Q257-W277 HydrophobicContact CG-CG 4.45Å; L273-W277 PolarHBondContact O-N 3.15Å; E274-W277 VanDerWaalsContact CA-CD1 3.44Å; W277-K279 PolarHBondContact O-N 3.07Å; W277-F280 PolarHBondContact O-N 3.36Å; W277-R281 WeakPolarHBondContact O-CB 3.35Å; W277-R281 PolarHBondContact O-N 3.32Å |
| 278 | K | 85.1 | Confident | 88.1 | Confident | 78 Ų | 78 | 59.7 Ų | 59.7 | 34% | 0.339 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -59.6 | -37.1 | 176.1 | -72.6 | 169.8 | 179.6 | 162.5 | 0 | 111.6 | E274 I276 | E274-K278 VanDerWaalsContact O-CB 3.26Å; E274-K278 WeakPolarHBondContact O-CB 3.33Å; E274-K278 WeakPolarHBondContact O-CD 3.02Å; E274-K278 VanDerWaalsContact O-CG 3.22Å; E274-K278 WeakPolarHBondContact O-CG 3.5Å; E274-K278 PolarHBondContact O-N 3.17Å; E274-K278 IonicContact OE2-NZ 2.75Å; E274-K278 PolarHBondContact OE2-NZ 3.38Å; I276-K278 PolarHBondContact O-N 2.83Å |
| 279 | K | 82.8 | Confident | 88.2 | Confident | 89 Ų | 89 | 55.6 Ų | 55.6 | 39% | 0.387 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -69 | -43 | 180 | -174 | -178.2 | -174.9 | -175.3 | 0 | 112.5 | I23 K275 I276 W277 | I23-K279 HydrophobicContact CD1-CD 4.07Å; I23-K279 VanDerWaalsContact CD1-CE 3.41Å; I23-K279 HydrophobicContact CD1-CG 3.45Å; I23-K279 VanDerWaalsContact CD1-CG 3.45Å; I23-K279 HydrophobicContact CG1-CG 3.93Å; K275-K279 WeakPolarHBondContact O-CB 3.33Å; K275-K279 PolarHBondContact O-N 2.84Å; K275-K279 VanDerWaalsContact O-N 3.09Å; I276-K279 WeakPolarHBondContact O-CB 3.5Å; I276-K279 PolarHBondContact O-N 2.99Å; W277-K279 PolarHBondContact O-N 3.07Å |
| 280 | F | 86.4 | Confident | 88.3 | Confident | 90 Ų | 90 | 50.5 Ų | 50.5 | 40% | 0.395 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -97.6 | -9.6 | -171.6 | -71.5 | -74.5 | 0 | 0 | 0 | 114.4 | I253 I276 W277 A282 V283 T284 | I253-F280 HydrophobicContact CD1-CB 3.63Å; I253-F280 HydrophobicContact CD1-CG 4.48Å; I253-F280 HydrophobicContact CG1-CB 4.16Å; I276-F280 HydrophobicContact CG2-CD2 4.04Å; I276-F280 HydrophobicContact CG2-CE2 4.42Å; I276-F280 VanDerWaalsContact O-CD2 3.29Å; I276-F280 WeakPolarHBondContact O-CD2 3.34Å; I276-F280 PolarHBondContact O-N 3.07Å; I276-F280 VanDerWaalsContact O-N 3.09Å; W277-F280 PolarHBondContact O-N 3.36Å; F280-A282 PolarHBondContact O-N 2.77Å; F280-V283 PolarHBondContact O-N 3.44Å; F280-T284 HydrophobicContact CB-CG2 4.4Å; F280-T284 WeakPolarHBondContact O-CB 3.26Å; F280-T284 WeakPolarHBondContact O-CG2 3.36Å; F280-T284 PolarHBondContact O-N 3.02Å; F280-T284 PolarHBondContact O-OG1 3.03Å |
| 281 | R | 87.8 | Confident | 88.4 | Confident | 31 Ų | 31 | 49.2 Ų | 49.2 | 12% | 0.117 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -52.5 | -50.6 | -178 | -169.5 | 76 | -179.4 | 119.2 | -1.7 | 113.3 | Y250 W277 T284 S285 | Y250-R281 VanDerWaalsContact CD2-NH1 3.26Å; Y250-R281 VanDerWaalsContact CZ-NH1 3.3Å; Y250-R281 PolarHBondContact OH-NH2 3.25Å; W277-R281 WeakPolarHBondContact O-CB 3.35Å; W277-R281 PolarHBondContact O-N 3.32Å; R281-T284 PolarHBondContact O-OG1 3.01Å; R281-T284 VanDerWaalsContact O-OG1 3.13Å; R281-S285 WeakPolarHBondContact O-CB 3.29Å; R281-S285 PolarHBondContact O-N 3.4Å; R281-S285 PolarHBondContact O-OG 2.94Å |
| 282 | A | 83.9 | Confident | 88.7 | Confident | 53 Ų | 53 | 46.6 Ų | 46.6 | 44% | 0.438 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -64.6 | -47.7 | -177.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | F280 S285 T286 | F280-A282 PolarHBondContact O-N 2.77Å; A282-S285 PolarHBondContact O-N 2.93Å; A282-T286 PolarHBondContact O-N 3.46Å; A282-T286 PolarHBondContact O-OG1 2.85Å; A282-T286 VanDerWaalsContact O-OG1 3.11Å |
| 283 | V | 86.9 | Confident | 88.7 | Confident | 69 Ų | 69 | 42.1 Ų | 42.1 | 42% | 0.418 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -62.1 | -48.8 | -179 | 178 | 0 | 0 | 0 | 0 | 111.2 | F280 S285 T286 I287 | F280-V283 PolarHBondContact O-N 3.44Å; V283-S285 VanDerWaalsContact C-N 3.31Å; V283-S285 PolarHBondContact O-N 3.29Å; V283-T286 PolarHBondContact O-N 2.86Å; V283-I287 HydrophobicContact CG1-CD1 4.06Å; V283-I287 WeakPolarHBondContact O-CG1 3.25Å; V283-I287 PolarHBondContact O-N 2.87Å |
| 284 | T | 90.5 | Very high | 88.8 | Confident | 10 Ų | 10 | 41 Ų | 41 | 6% | 0.061 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -65.4 | -34 | 179.7 | 53 | 0 | 0 | 0 | 0 | 112.5 | P249 I253 F280 R281 I287 A288 | P249-T284 HydrophobicContact CB-CG2 3.68Å; I253-T284 HydrophobicContact CG1-CG2 3.75Å; F280-T284 HydrophobicContact CB-CG2 4.4Å; F280-T284 WeakPolarHBondContact O-CB 3.26Å; F280-T284 WeakPolarHBondContact O-CG2 3.36Å; F280-T284 PolarHBondContact O-N 3.02Å; F280-T284 PolarHBondContact O-OG1 3.03Å; R281-T284 PolarHBondContact O-OG1 3.01Å; R281-T284 VanDerWaalsContact O-OG1 3.13Å; T284-I287 PolarHBondContact O-N 3.49Å; T284-A288 PolarHBondContact O-N 3.39Å |
| 285 | S | 88.9 | Confident | 88.9 | Confident | 31 Ų | 31 | 39.5 Ų | 39.5 | 22% | 0.217 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -65.2 | -45.9 | 172.1 | -56.8 | 0 | 0 | 0 | 0 | 111.4 | R281 A282 V283 I287 A288 F289 | R281-S285 WeakPolarHBondContact O-CB 3.29Å; R281-S285 PolarHBondContact O-N 3.4Å; R281-S285 PolarHBondContact O-OG 2.94Å; A282-S285 PolarHBondContact O-N 2.93Å; V283-S285 VanDerWaalsContact C-N 3.31Å; V283-S285 PolarHBondContact O-N 3.29Å; S285-I287 VanDerWaalsContact C-N 3.3Å; S285-I287 PolarHBondContact O-N 2.67Å; S285-A288 WeakPolarHBondContact O-CB 3.44Å; S285-A288 PolarHBondContact O-N 2.89Å; S285-A288 VanDerWaalsContact O-N 3.09Å; S285-F289 VanDerWaalsContact O-CD2 3.28Å; S285-F289 WeakPolarHBondContact O-CD2 3.41Å; S285-F289 PolarHBondContact O-N 3.09Å; S285-F289 VanDerWaalsContact O-N 3.16Å |
| 286 | T | 88.6 | Confident | 88.9 | Confident | 18 Ų | 18 | 34.6 Ų | 34.6 | 11% | 0.11 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -60 | -39.9 | 176.2 | -58.3 | 0 | 0 | 0 | 0 | 112 | I36 L37 A282 V283 A288 F289 | I36-T286 HydrophobicContact CB-CG2 3.85Å; I36-T286 HydrophobicContact CD1-CG2 4.33Å; I36-T286 HydrophobicContact CG2-CG2 3.52Å; L37-T286 HydrophobicContact CD2-CG2 4.12Å; L37-T286 HydrophobicContact CG-CG2 4.22Å; A282-T286 PolarHBondContact O-N 3.46Å; A282-T286 PolarHBondContact O-OG1 2.85Å; A282-T286 VanDerWaalsContact O-OG1 3.11Å; V283-T286 PolarHBondContact O-N 2.86Å; T286-A288 VanDerWaalsContact C-N 3.33Å; T286-A288 PolarHBondContact O-N 3.35Å; T286-F289 PolarHBondContact O-N 3.07Å |
| 287 | I | 91.6 | Very high | 88.9 | Confident | 54 Ų | 54 | 34.7 Ų | 34.7 | 28% | 0.277 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -61.9 | -41.9 | 174.8 | -67.1 | 168.7 | 0 | 0 | 0 | 110.8 | F246 V283 T284 S285 F289 I290 | F246-I287 HydrophobicContact CB-CG2 4.45Å; F246-I287 HydrophobicContact CD1-CG2 3.82Å; V283-I287 HydrophobicContact CG1-CD1 4.06Å; V283-I287 WeakPolarHBondContact O-CG1 3.25Å; V283-I287 PolarHBondContact O-N 2.87Å; T284-I287 PolarHBondContact O-N 3.49Å; S285-I287 VanDerWaalsContact C-N 3.3Å; S285-I287 PolarHBondContact O-N 2.67Å; I287-F289 VanDerWaalsContact C-N 3.3Å; I287-F289 PolarHBondContact O-N 3.43Å; I287-I290 WeakPolarHBondContact O-CB 3.48Å; I287-I290 PolarHBondContact O-N 3.2Å; I287-I290 VanDerWaalsContact O-N 3.14Å |
| 288 | A | 91.8 | Very high | 88.8 | Confident | 1 Ų | 1 | 34.6 Ų | 34.6 | 1% | 0.008 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -61.3 | -36.5 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | W247 T284 S285 T286 I290 S291 | W247-A288 HydrophobicContact CD2-CB 3.94Å; W247-A288 HydrophobicContact CE3-CB 3.83Å; W247-A288 HydrophobicContact CH2-CB 3.93Å; W247-A288 HydrophobicContact CZ2-CB 4.06Å; W247-A288 HydrophobicContact CZ3-CB 3.81Å; T284-A288 PolarHBondContact O-N 3.39Å; S285-A288 WeakPolarHBondContact O-CB 3.44Å; S285-A288 PolarHBondContact O-N 2.89Å; S285-A288 VanDerWaalsContact O-N 3.09Å; T286-A288 VanDerWaalsContact C-N 3.33Å; T286-A288 PolarHBondContact O-N 3.35Å; A288-I290 PolarHBondContact O-N 3.05Å; A288-S291 VanDerWaalsContact O-CB 3.25Å; A288-S291 WeakPolarHBondContact O-CB 3.4Å; A288-S291 PolarHBondContact O-N 3.23Å; A288-S291 VanDerWaalsContact O-N 3.1Å; A288-S291 PolarHBondContact O-OG 3.34Å |
| 289 | F | 90.7 | Very high | 88.8 | Confident | 23 Ų | 23 | 31 Ų | 31 | 10% | 0.101 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -62.5 | -29 | 176.3 | -87.3 | -116.3 | 0 | 0 | 0 | 113.2 | L37 L79 M80 F86 S285 T286 I287 S291 S292 | L37-F289 HydrophobicContact CD2-CB 3.84Å; L37-F289 HydrophobicContact CD2-CD1 3.93Å; L37-F289 HydrophobicContact CD2-CG 3.95Å; L79-F289 HydrophobicContact CD1-CD1 4.45Å; L79-F289 HydrophobicContact CD1-CE1 3.75Å; L79-F289 HydrophobicContact CD1-CZ 3.94Å; L79-F289 HydrophobicContact CD2-CD1 4.16Å; L79-F289 HydrophobicContact CD2-CE1 4.25Å; L79-F289 HydrophobicContact CD2-CG 4.47Å; L79-F289 HydrophobicContact CG-CD1 4.29Å; L79-F289 HydrophobicContact CG-CE1 4.05Å; M80-F289 HydrophobicContact CE-CD1 4.44Å; F86-F289 HydrophobicContact CD2-CE1 4.01Å; F86-F289 HydrophobicContact CD2-CZ 4.05Å; F86-F289 HydrophobicContact CE2-CE1 4.21Å; F86-F289 AromaticContact CE2-CZ 3.96Å; F86-F289 HydrophobicContact CE2-CZ 3.96Å; F86-F289 HydrophobicContact CG-CZ 4.44Å; F86-F289 HydrophobicContact CZ-CZ 4.29Å; S285-F289 VanDerWaalsContact O-CD2 3.28Å; S285-F289 WeakPolarHBondContact O-CD2 3.41Å; S285-F289 PolarHBondContact O-N 3.09Å; S285-F289 VanDerWaalsContact O-N 3.16Å; T286-F289 PolarHBondContact O-N 3.07Å; I287-F289 VanDerWaalsContact C-N 3.3Å; I287-F289 PolarHBondContact O-N 3.43Å; F289-S291 PolarHBondContact O-N 3.15Å; F289-S292 PolarHBondContact O-N 2.98Å |
| 290 | I | 92.2 | Very high | 88.9 | Confident | 42 Ų | 42 | 31.8 Ų | 31.8 | 22% | 0.215 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -61.4 | -27.8 | 176.9 | -56.7 | 172.5 | 0 | 0 | 0 | 111 | I36 V40 F246 I287 A288 S292 C293 A294 | I36-I290 HydrophobicContact CG2-CD1 4.03Å; I36-I290 HydrophobicContact CG2-CG1 4.16Å; V40-I290 HydrophobicContact CG2-CB 4.33Å; V40-I290 HydrophobicContact CG2-CG1 3.72Å; F246-I290 HydrophobicContact CD1-CB 4.22Å; F246-I290 HydrophobicContact CD1-CG2 4.34Å; F246-I290 HydrophobicContact CE1-CB 4.1Å; F246-I290 HydrophobicContact CE1-CG2 3.76Å; F246-I290 HydrophobicContact CE2-CG2 3.92Å; F246-I290 HydrophobicContact CZ-CB 4.26Å; F246-I290 HydrophobicContact CZ-CG2 3.52Å; I287-I290 WeakPolarHBondContact O-CB 3.48Å; I287-I290 PolarHBondContact O-N 3.2Å; I287-I290 VanDerWaalsContact O-N 3.14Å; A288-I290 PolarHBondContact O-N 3.05Å; I290-S292 PolarHBondContact O-N 2.98Å; I290-C293 PolarHBondContact O-N 3.3Å; I290-C293 PolarHBondContact O-SG 3.06Å; I290-A294 PolarHBondContact O-N 2.94Å |
| 291 | S | 92.4 | Very high | 88.7 | Confident | 2 Ų | 2 | 34 Ų | 34 | 1% | 0.014 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -56.6 | -37.6 | 178.2 | 70.9 | 0 | 0 | 0 | 0 | 113 | W247 A288 F289 C293 A294 | W247-S291 PolarHBondContact NE1-OG 2.93Å; A288-S291 VanDerWaalsContact O-CB 3.25Å; A288-S291 WeakPolarHBondContact O-CB 3.4Å; A288-S291 PolarHBondContact O-N 3.23Å; A288-S291 VanDerWaalsContact O-N 3.1Å; A288-S291 PolarHBondContact O-OG 3.34Å; F289-S291 PolarHBondContact O-N 3.15Å; S291-C293 PolarHBondContact O-N 3.39Å; S291-A294 PolarHBondContact O-N 3.03Å |
| 292 | S | 91.6 | Very high | 88.2 | Confident | 0 Ų | 0 | 33.5 Ų | 33.5 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -74.2 | -22.4 | -177.9 | -69 | 0 | 0 | 0 | 0 | 113.8 | N48 D76 F289 I290 | N48-S292 PolarHBondContact ND2-O 3.09Å; D76-S292 WeakPolarHBondContact OD1-CB 3.22Å; D76-S292 PolarHBondContact OD1-OG 3.46Å; F289-S292 PolarHBondContact O-N 2.98Å; I290-S292 PolarHBondContact O-N 2.98Å |
| 293 | C | 91.4 | Very high | 87.5 | Confident | 10 Ų | 10 | 31 Ų | 31 | 7% | 0.068 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -92.6 | -16.4 | 171.6 | 72 | 0 | 0 | 0 | 0 | 113.3 | V40 L43 G44 I290 S291 | V40-C293 HydrophobicContact CG1-CB 4.16Å; L43-C293 HydrophobicContact CB-CB 4.38Å; G44-C293 VanDerWaalsContact CA-CB 3.46Å; I290-C293 PolarHBondContact O-N 3.3Å; I290-C293 PolarHBondContact O-SG 3.06Å; S291-C293 PolarHBondContact O-N 3.39Å |
| 294 | A | 91.2 | Very high | 87 | Confident | 13 Ų | 13 | 34.7 Ų | 34.7 | 11% | 0.107 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -70.4 | -31.1 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | T242 F246 I290 S291 V297 L298 | T242-A294 HydrophobicContact CG2-CB 3.66Å; F246-A294 HydrophobicContact CD2-CB 4.49Å; F246-A294 HydrophobicContact CE2-CB 3.84Å; I290-A294 PolarHBondContact O-N 2.94Å; S291-A294 PolarHBondContact O-N 3.03Å; A294-V297 WeakPolarHBondContact O-CB 3.4Å; A294-V297 PolarHBondContact O-N 3.3Å; A294-L298 WeakPolarHBondContact O-CG 3.48Å; A294-L298 PolarHBondContact O-N 2.96Å |
| 295 | N | 90.1 | Very high | 85.8 | Confident | 2 Ų | 2 | 36.8 Ų | 36.8 | 1% | 0.011 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -58.3 | -55 | -177.6 | -72.1 | -28.2 | 0 | 0 | 0 | 113.1 | D76 V297 L298 Y299 | D76-N295 PolarHBondContact OD2-ND2 3.48Å; N295-V297 VanDerWaalsContact C-N 3.26Å; N295-V297 PolarHBondContact O-N 2.7Å; N295-L298 PolarHBondContact O-N 3.22Å; N295-Y299 HydrophobicContact CB-CE2 4.02Å; N295-Y299 WeakPolarHBondContact O-CD2 3.41Å; N295-Y299 PolarHBondContact O-N 3.02Å |
| 296 | P | 87.4 | Confident | 84.7 | Confident | 14 Ų | 14 | 39.5 Ų | 39.5 | 9% | 0.091 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -54.1 | -39.1 | 173.7 | -27.8 | 34.3 | 0 | 0 | 0 | 114.4 | V51 Y299 F300 | V51-P296 HydrophobicContact CG2-CB 4.49Å; P296-Y299 PolarHBondContact O-N 2.95Å; P296-F300 PolarHBondContact O-N 3.2Å |
| 297 | V | 87.6 | Confident | 83.7 | Confident | 62 Ų | 62 | 41 Ų | 41 | 38% | 0.376 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -64.6 | -46.9 | 178.8 | 177.6 | 0 | 0 | 0 | 0 | 110.5 | A294 N295 Y299 F300 F301 | A294-V297 WeakPolarHBondContact O-CB 3.4Å; A294-V297 PolarHBondContact O-N 3.3Å; N295-V297 VanDerWaalsContact C-N 3.26Å; N295-V297 PolarHBondContact O-N 2.7Å; V297-Y299 VanDerWaalsContact C-N 3.31Å; V297-Y299 PolarHBondContact O-N 2.86Å; V297-F300 PolarHBondContact O-N 2.86Å; V297-F301 HydrophobicContact CG1-CD2 3.77Å; V297-F301 HydrophobicContact CG1-CE2 3.5Å; V297-F301 VanDerWaalsContact CG1-CE2 3.5Å; V297-F301 WeakPolarHBondContact O-CD2 3.33Å; V297-F301 PolarHBondContact O-N 3.11Å; V297-F301 VanDerWaalsContact O-N 3.09Å |
| 298 | L | 86.7 | Confident | 82.3 | Confident | 35 Ų | 35 | 50 Ų | 50 | 18% | 0.183 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -59.5 | -42.3 | 175.1 | -70 | 175.4 | 0 | 0 | 0 | 111.8 | L235 A238 I239 T242 A294 N295 F301 A302 | L235-L298 HydrophobicContact CD1-CB 4.22Å; A238-L298 HydrophobicContact CB-CD2 4.22Å; I239-L298 HydrophobicContact CB-CD1 4.46Å; I239-L298 HydrophobicContact CG1-CD1 3.92Å; T242-L298 HydrophobicContact CG2-CD1 4.22Å; A294-L298 WeakPolarHBondContact O-CG 3.48Å; A294-L298 PolarHBondContact O-N 2.96Å; N295-L298 PolarHBondContact O-N 3.22Å; L298-F301 PolarHBondContact O-N 3.36Å; L298-A302 WeakPolarHBondContact O-CB 3.47Å; L298-A302 PolarHBondContact O-N 3.39Å |
| 299 | Y | 85.4 | Confident | 80.9 | Confident | 1 Ų | 1 | 60.2 Ų | 60.2 | 0% | 0.004 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -63.4 | -42 | 177.3 | -57.8 | -34.7 | 0 | 0 | 0 | 112.2 | V51 I69 L235 I239 N295 P296 V297 A302 G303 M315 F319 | V51-Y299 HydrophobicContact CG2-CD2 3.92Å; V51-Y299 HydrophobicContact CG2-CE2 4.39Å; I69-Y299 HydrophobicContact CG2-CE2 4.06Å; L235-Y299 HydrophobicContact CD1-CD1 4.17Å; L235-Y299 HydrophobicContact CD2-CD1 4.25Å; I239-Y299 HydrophobicContact CD1-CD1 4.45Å; I239-Y299 HydrophobicContact CD1-CE1 3.57Å; I239-Y299 HydrophobicContact CG1-CE1 4.39Å; N295-Y299 HydrophobicContact CB-CE2 4.02Å; N295-Y299 WeakPolarHBondContact O-CD2 3.41Å; N295-Y299 PolarHBondContact O-N 3.02Å; P296-Y299 PolarHBondContact O-N 2.95Å; V297-Y299 VanDerWaalsContact C-N 3.31Å; V297-Y299 PolarHBondContact O-N 2.86Å; Y299-A302 PolarHBondContact O-N 3.35Å; Y299-G303 PolarHBondContact O-N 3.41Å; Y299-M315 HydrophobicContact CG-CE 4.42Å; Y299-F319 HydrophobicContact CD1-CE1 4.36Å; Y299-F319 AromaticContact CD1-CZ 3.69Å; Y299-F319 HydrophobicContact CD1-CZ 3.69Å; Y299-F319 HydrophobicContact CE1-CZ 4.04Å; Y299-F319 HydrophobicContact CG-CZ 4.02Å |
| 300 | F | 83.4 | Confident | 79.7 | Confident | 106 Ų | 106 | 63.3 Ų | 63.3 | 47% | 0.465 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -59.9 | -49.5 | 176.7 | 176.6 | -96.7 | 0 | 0 | 0 | 111.8 | P296 V297 A302 G303 K304 I307 F314 | P296-F300 PolarHBondContact O-N 3.2Å; V297-F300 PolarHBondContact O-N 2.86Å; F300-A302 PolarHBondContact O-N 3.36Å; F300-G303 CarbonylContact O-C 3.54Å; F300-G303 PolarHBondContact O-N 3.35Å; F300-K304 PolarHBondContact O-N 3.3Å; F300-I307 HydrophobicContact CD2-CD1 3.69Å; F300-I307 HydrophobicContact CE2-CD1 3.47Å; F300-I307 VanDerWaalsContact CE2-CD1 3.47Å; F300-I307 HydrophobicContact CZ-CD1 4.14Å; F300-F314 HydrophobicContact CD2-CZ 4.32Å |
| 301 | F | 82.3 | Confident | 78.8 | Confident | 137 Ų | 137 | 63 Ų | 63 | 60% | 0.601 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -63.9 | -41 | 178.8 | -76.5 | -66 | 0 | 0 | 0 | 112.6 | V297 L298 G303 K304 | V297-F301 HydrophobicContact CG1-CD2 3.77Å; V297-F301 HydrophobicContact CG1-CE2 3.5Å; V297-F301 VanDerWaalsContact CG1-CE2 3.5Å; V297-F301 WeakPolarHBondContact O-CD2 3.33Å; V297-F301 PolarHBondContact O-N 3.11Å; V297-F301 VanDerWaalsContact O-N 3.09Å; L298-F301 PolarHBondContact O-N 3.36Å; F301-G303 VanDerWaalsContact C-N 3.28Å; F301-G303 PolarHBondContact O-N 3Å; F301-K304 PolarHBondContact O-N 3.48Å |
| 302 | A | 77.1 | Confident | 77.6 | Confident | 20 Ų | 20 | 67 Ų | 67 | 17% | 0.165 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -66.4 | -32.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | R231 L235 L298 Y299 F300 L318 | R231-A302 PolarHBondContact NE-O 2.86Å; R231-A302 PolarHBondContact NH2-O 2.74Å; L235-A302 HydrophobicContact CB-CB 4.27Å; L235-A302 HydrophobicContact CD1-CB 3.75Å; L235-A302 HydrophobicContact CD2-CB 3.84Å; L235-A302 HydrophobicContact CG-CB 4.15Å; L298-A302 WeakPolarHBondContact O-CB 3.47Å; L298-A302 PolarHBondContact O-N 3.39Å; Y299-A302 PolarHBondContact O-N 3.35Å; F300-A302 PolarHBondContact O-N 3.36Å; A302-L318 HydrophobicContact CB-CD2 4.28Å |
| 303 | G | 70.6 | Confident | 76.5 | Confident | 0 Ų | 0 | 67.8 Ų | 67.8 | 0% | 0 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -84.1 | -7.6 | 179.9 | 0 | 0 | 0 | 0 | 0 | 115.9 | Y299 F300 F301 S305 Y306 I307 | Y299-G303 PolarHBondContact O-N 3.41Å; F300-G303 CarbonylContact O-C 3.54Å; F300-G303 PolarHBondContact O-N 3.35Å; F301-G303 VanDerWaalsContact C-N 3.28Å; F301-G303 PolarHBondContact O-N 3Å; G303-S305 PolarHBondContact O-N 2.78Å; G303-Y306 WeakPolarHBondContact O-CA 3.34Å; G303-Y306 PolarHBondContact O-N 3.43Å; G303-I307 PolarHBondContact O-N 3.18Å |
| 304 | K | 75.3 | Confident | 75.7 | Confident | 148 Ų | 148 | 67.7 Ų | 67.7 | 64% | 0.643 | 32% | 0.322 | S | S | * | . | H | α-helix | trans | -47.2 | -35.5 | -173.1 | -170.4 | 175.5 | -179.8 | 178.2 | 0 | 115.2 | F300 F301 | F300-K304 PolarHBondContact O-N 3.3Å; F301-K304 PolarHBondContact O-N 3.48Å |
| 305 | S | 66.6 | Low | 74.7 | Confident | 54 Ų | 54 | 67.3 Ų | 67.3 | 38% | 0.378 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -75.8 | -22.9 | 178.1 | 63.1 | 0 | 0 | 0 | 0 | 114.8 | R231 G303 | R231-S305 PolarHBondContact NH1-OG 2.98Å; R231-S305 PolarHBondContact NH2-OG 2.93Å; G303-S305 PolarHBondContact O-N 2.78Å |
| 306 | Y | 64.7 | Low | 73.6 | Confident | 87 Ų | 87 | 67.3 Ų | 67.3 | 34% | 0.341 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -89.5 | -26.3 | 178.3 | -66.8 | -84.9 | 0 | 0 | 0 | 112 | G303 R308 R309 E310 L318 | G303-Y306 WeakPolarHBondContact O-CA 3.34Å; G303-Y306 PolarHBondContact O-N 3.43Å; Y306-R308 PolarHBondContact O-N 2.96Å; Y306-R309 PolarHBondContact O-N 3.39Å; Y306-E310 PolarHBondContact O-N 2.92Å; Y306-L318 HydrophobicContact CD2-CD1 4.15Å; Y306-L318 HydrophobicContact CE2-CD1 4.07Å |
| 307 | I | 68.5 | Low | 72.7 | Confident | 51 Ų | 51 | 70.6 Ų | 70.6 | 26% | 0.262 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -54.3 | -42.1 | 177.5 | -64.7 | 176.7 | 0 | 0 | 0 | 111 | F300 G303 R309 G311 F314 | F300-I307 HydrophobicContact CD2-CD1 3.69Å; F300-I307 HydrophobicContact CE2-CD1 3.47Å; F300-I307 VanDerWaalsContact CE2-CD1 3.47Å; F300-I307 HydrophobicContact CZ-CD1 4.14Å; G303-I307 PolarHBondContact O-N 3.18Å; I307-R309 VanDerWaalsContact C-N 3.3Å; I307-R309 PolarHBondContact O-N 3.27Å; I307-G311 WeakPolarHBondContact O-CA 3.28Å; I307-G311 PolarHBondContact O-N 3.11Å; I307-G311 VanDerWaalsContact O-N 3.08Å; I307-F314 HydrophobicContact CD1-CD1 4.36Å; I307-F314 HydrophobicContact CD1-CD2 4.5Å; I307-F314 HydrophobicContact CD1-CE1 4.09Å; I307-F314 HydrophobicContact CD1-CE2 4.25Å; I307-F314 HydrophobicContact CD1-CZ 4Å; I307-F314 HydrophobicContact CG1-CB 4.11Å; I307-F314 HydrophobicContact CG1-CD1 3.64Å; I307-F314 HydrophobicContact CG1-CD2 3.85Å; I307-F314 HydrophobicContact CG1-CE1 3.88Å; I307-F314 HydrophobicContact CG1-CE2 4.1Å; I307-F314 HydrophobicContact CG1-CG 3.58Å; I307-F314 HydrophobicContact CG1-CZ 4.08Å |
| 308 | R | 61.8 | Low | 71.9 | Confident | 241 Ų | 241 | 68.3 Ų | 68.3 | 91% | 0.909 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -71.3 | -20.5 | -178.2 | -153.4 | 176.1 | -162.6 | 146.1 | 4.3 | 114.2 | Y306 | Y306-R308 PolarHBondContact O-N 2.96Å |
| 309 | R | 62.2 | Low | 71 | Confident | 217 Ų | 217 | 66.8 Ų | 66.8 | 82% | 0.819 | 31% | 0.306 | S | S | * | . | H | α-helix | trans | -102 | -33.2 | -177.8 | -73.1 | -175.3 | 174.7 | -175.6 | -2.3 | 113.3 | Y306 I307 | Y306-R309 PolarHBondContact O-N 3.39Å; I307-R309 VanDerWaalsContact C-N 3.3Å; I307-R309 PolarHBondContact O-N 3.27Å |
| 310 | E | 65.8 | Low | 70 | Confident | 88 Ų | 88 | 67.5 Ų | 67.5 | 41% | 0.411 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -127.4 | 1.2 | -166.2 | -57.7 | -72 | 156.4 | 0 | 0 | 113.2 | Y306 L312 A313 R317 | Y306-E310 PolarHBondContact O-N 2.92Å; E310-L312 PolarHBondContact O-N 3.04Å; E310-A313 HydrophobicContact CB-CB 4.47Å; E310-A313 WeakPolarHBondContact O-CB 3.28Å; E310-A313 PolarHBondContact O-N 2.01Å; E310-A313 VanDerWaalsContact O-N 3.13Å; E310-R317 HydrophobicContact CG-CG 4.41Å |
| 311 | G | 73.2 | Confident | 68.5 | Low | 36 Ų | 36 | 64 Ų | 64 | 37% | 0.371 | 30% | 0.303 | S | S | . | . | G | 310 helix | trans | 54 | -130.8 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | I307 A313 F314 | I307-G311 WeakPolarHBondContact O-CA 3.28Å; I307-G311 PolarHBondContact O-N 3.11Å; I307-G311 VanDerWaalsContact O-N 3.08Å; G311-A313 PolarHBondContact O-N 3.31Å; G311-A313 VanDerWaalsContact O-N 3.13Å; G311-F314 WeakPolarHBondContact O-CB 3.37Å; G311-F314 WeakPolarHBondContact O-CD1 3.29Å; G311-F314 PolarHBondContact O-N 2.94Å |
| 312 | L | 67.9 | Low | 67 | Low | 86 Ų | 86 | 57.8 Ų | 57.8 | 45% | 0.45 | 28% | 0.276 | S | S | . | . | G | 310 helix | trans | -68.8 | -7.5 | -177.8 | -55 | 174.7 | 0 | 0 | 0 | 114.4 | F50 W53 S54 E310 F314 | F50-L312 HydrophobicContact CE2-CB 4.5Å; F50-L312 HydrophobicContact CE2-CD2 3.95Å; F50-L312 HydrophobicContact CZ-CD2 4.11Å; W53-L312 HydrophobicContact CH2-CD1 4.16Å; W53-L312 HydrophobicContact CZ3-CB 4.34Å; W53-L312 HydrophobicContact CZ3-CD1 4.25Å; S54-L312 PolarHBondContact OG-O 3.07Å; E310-L312 PolarHBondContact O-N 3.04Å; L312-F314 VanDerWaalsContact C-N 3.29Å |
| 313 | A | 66.7 | Low | 65.3 | Low | 16 Ų | 16 | 57.6 Ų | 57.6 | 13% | 0.132 | 28% | 0.276 | C | S | . | . | G | 310 helix | trans | -84.6 | -1 | 174 | 0 | 0 | 0 | 0 | 0 | 113.1 | R58 E310 G311 M315 A316 R317 | R58-A313 HydrophobicContact CB-CB 4.4Å; E310-A313 HydrophobicContact CB-CB 4.47Å; E310-A313 WeakPolarHBondContact O-CB 3.28Å; E310-A313 PolarHBondContact O-N 2.01Å; E310-A313 VanDerWaalsContact O-N 3.13Å; G311-A313 PolarHBondContact O-N 3.31Å; G311-A313 VanDerWaalsContact O-N 3.13Å; A313-M315 VanDerWaalsContact C-N 3.26Å; A313-M315 PolarHBondContact O-N 3.21Å; A313-A316 PolarHBondContact O-N 3.29Å; A313-R317 PolarHBondContact O-N 3.49Å; A313-R317 VanDerWaalsContact O-N 3.14Å |
| 314 | F | 75.3 | Confident | 63.7 | Low | 8 Ų | 8 | 61 Ų | 61 | 4% | 0.035 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -60 | -33.7 | -172.6 | 86.9 | -90.8 | 0 | 0 | 0 | 113.1 | F50 F300 I307 G311 L312 R317 L318 | F50-F314 HydrophobicContact CE1-CE1 4.03Å; F50-F314 HydrophobicContact CZ-CE1 4.29Å; F300-F314 HydrophobicContact CD2-CZ 4.32Å; I307-F314 HydrophobicContact CD1-CD1 4.36Å; I307-F314 HydrophobicContact CD1-CD2 4.5Å; I307-F314 HydrophobicContact CD1-CE1 4.09Å; I307-F314 HydrophobicContact CD1-CE2 4.25Å; I307-F314 HydrophobicContact CD1-CZ 4Å; I307-F314 HydrophobicContact CG1-CB 4.11Å; I307-F314 HydrophobicContact CG1-CD1 3.64Å; I307-F314 HydrophobicContact CG1-CD2 3.85Å; I307-F314 HydrophobicContact CG1-CE1 3.88Å; I307-F314 HydrophobicContact CG1-CE2 4.1Å; I307-F314 HydrophobicContact CG1-CG 3.58Å; I307-F314 HydrophobicContact CG1-CZ 4.08Å; G311-F314 WeakPolarHBondContact O-CB 3.37Å; G311-F314 WeakPolarHBondContact O-CD1 3.29Å; G311-F314 PolarHBondContact O-N 2.94Å; L312-F314 VanDerWaalsContact C-N 3.29Å; F314-R317 PolarHBondContact O-N 3.08Å; F314-L318 WeakPolarHBondContact O-CB 3.48Å; F314-L318 PolarHBondContact O-N 3.16Å |
| 315 | M | 69.8 | Low | 62.1 | Low | 4 Ų | 4 | 57.8 Ų | 57.8 | 2% | 0.02 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -66.1 | -48.4 | 178.4 | -68.5 | -61.4 | -165.2 | 0 | 0 | 111.2 | F50 V51 Y299 A313 R317 L318 F319 | F50-M315 HydrophobicContact CE1-CE 4.39Å; F50-M315 HydrophobicContact CE1-CG 4.1Å; V51-M315 HydrophobicContact CG2-CE 4.38Å; Y299-M315 HydrophobicContact CG-CE 4.42Å; A313-M315 VanDerWaalsContact C-N 3.26Å; A313-M315 PolarHBondContact O-N 3.21Å; M315-R317 VanDerWaalsContact C-N 3.26Å; M315-R317 PolarHBondContact O-N 2.78Å; M315-L318 PolarHBondContact O-N 3.3Å; M315-L318 HydrophobicContact SD-CD2 4.48Å; M315-F319 HydrophobicContact CB-CE2 4.34Å; M315-F319 WeakPolarHBondContact O-CD2 3.34Å; M315-F319 PolarHBondContact O-N 3.32Å; M315-F319 HydrophobicContact SD-CE2 4.14Å |
| 316 | A | 67 | Low | 60.7 | Low | 2 Ų | 2 | 56.5 Ų | 56.5 | 2% | 0.017 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -55.3 | -44.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111 | R58 A59 A313 E320 | R58-A316 HydrophobicContact CB-CB 4.27Å; A59-A316 HydrophobicContact CB-CB 4.17Å; A313-A316 PolarHBondContact O-N 3.29Å; A316-E320 WeakPolarHBondContact O-CB 3.33Å; A316-E320 PolarHBondContact O-N 3.45Å |
| 317 | R | 68.6 | Low | 59.4 | Low | 84 Ų | 84 | 56.3 Ų | 56.3 | 32% | 0.317 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -73.6 | -37.5 | 178.7 | -67.7 | -57.9 | -161.7 | -178.9 | 8.7 | 114.5 | E310 A313 F314 M315 F319 E320 G321 | E310-R317 HydrophobicContact CG-CG 4.41Å; A313-R317 PolarHBondContact O-N 3.49Å; A313-R317 VanDerWaalsContact O-N 3.14Å; F314-R317 PolarHBondContact O-N 3.08Å; M315-R317 VanDerWaalsContact C-N 3.26Å; M315-R317 PolarHBondContact O-N 2.78Å; R317-F319 PolarHBondContact O-N 3Å; R317-E320 IonicContact CZ-OE2 3.82Å; R317-E320 IonicContact NH1-OE2 2.9Å; R317-E320 PolarHBondContact NH1-OE2 2.81Å; R317-E320 PolarHBondContact O-N 3Å; R317-G321 PolarHBondContact O-N 2.92Å |
| 318 | L | 70.8 | Confident | 57.9 | Low | 13 Ų | 13 | 62.9 Ų | 62.9 | 7% | 0.068 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -55.9 | -36.3 | 175.9 | 179.3 | 64.6 | 0 | 0 | 0 | 110.5 | L235 A302 Y306 F314 M315 T322 | L235-L318 HydrophobicContact CD2-CD2 4.28Å; A302-L318 HydrophobicContact CB-CD2 4.28Å; Y306-L318 HydrophobicContact CD2-CD1 4.15Å; Y306-L318 HydrophobicContact CE2-CD1 4.07Å; F314-L318 WeakPolarHBondContact O-CB 3.48Å; F314-L318 PolarHBondContact O-N 3.16Å; M315-L318 PolarHBondContact O-N 3.3Å; M315-L318 HydrophobicContact SD-CD2 4.48Å; L318-T322 WeakPolarHBondContact O-CG2 3.39Å |
| 319 | F | 67.3 | Low | 56.8 | Low | 4 Ų | 4 | 55.7 Ų | 55.7 | 2% | 0.018 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -95.2 | -32.3 | -179.3 | -55.5 | -52.9 | 0 | 0 | 0 | 113.6 | T65 I69 L235 Y299 M315 R317 T322 | T65-F319 HydrophobicContact CG2-CD1 4.33Å; I69-F319 HydrophobicContact CD1-CD1 3.24Å; I69-F319 HydrophobicContact CD1-CD2 3.93Å; I69-F319 HydrophobicContact CD1-CE1 3.18Å; I69-F319 HydrophobicContact CD1-CE2 3.89Å; I69-F319 HydrophobicContact CD1-CG 3.64Å; I69-F319 HydrophobicContact CD1-CZ 3.53Å; I69-F319 HydrophobicContact CG2-CE2 4.13Å; I69-F319 HydrophobicContact CG2-CZ 4.39Å; L235-F319 HydrophobicContact CD2-CE1 3.82Å; L235-F319 HydrophobicContact CD2-CZ 4.45Å; Y299-F319 HydrophobicContact CD1-CE1 4.36Å; Y299-F319 AromaticContact CD1-CZ 3.69Å; Y299-F319 HydrophobicContact CD1-CZ 3.69Å; Y299-F319 HydrophobicContact CE1-CZ 4.04Å; Y299-F319 HydrophobicContact CG-CZ 4.02Å; M315-F319 HydrophobicContact CB-CE2 4.34Å; M315-F319 WeakPolarHBondContact O-CD2 3.34Å; M315-F319 PolarHBondContact O-N 3.32Å; M315-F319 HydrophobicContact SD-CE2 4.14Å; R317-F319 PolarHBondContact O-N 3Å; F319-T322 WeakPolarHBondContact O-CB 3.09Å; F319-T322 PolarHBondContact O-N 3.02Å; F319-T322 PolarHBondContact O-OG1 3.14Å |
| 320 | E | 65.1 | Low | 55.9 | Low | 15 Ų | 15 | 49 Ų | 49 | 7% | 0.07 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -70.2 | -36.1 | 174.9 | -163.4 | -178.2 | -154.7 | 0 | 0 | 112.4 | A316 R317 T322 G323 L324 | A316-E320 WeakPolarHBondContact O-CB 3.33Å; A316-E320 PolarHBondContact O-N 3.45Å; R317-E320 IonicContact CZ-OE2 3.82Å; R317-E320 IonicContact NH1-OE2 2.9Å; R317-E320 PolarHBondContact NH1-OE2 2.81Å; R317-E320 PolarHBondContact O-N 3Å; E320-T322 PolarHBondContact O-N 3.34Å; E320-G323 PolarHBondContact O-N 3.28Å; E320-L324 HydrophobicContact CG-CD1 3.87Å; E320-L324 PolarHBondContact O-N 2.89Å |
| 321 | G | 53.3 | Low | 54.7 | Low | 32 Ų | 32 | 50.9 Ų | 50.9 | 33% | 0.33 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -60 | -17.1 | 171.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | R317 | R317-G321 PolarHBondContact O-N 2.92Å |
| 322 | T | 50 | Low | 53.1 | Low | 7 Ų | 7 | 54.7 Ų | 54.7 | 4% | 0.043 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -82.8 | -15.4 | 174.2 | 71.9 | 0 | 0 | 0 | 0 | 114.9 | T65 R127 S232 L318 F319 E320 | T65-T322 PolarHBondContact OG1-OG1 3.28Å; R127-T322 PolarHBondContact NH2-OG1 3.48Å; S232-T322 WeakPolarHBondContact OG-CG2 3.49Å; L318-T322 WeakPolarHBondContact O-CG2 3.39Å; F319-T322 WeakPolarHBondContact O-CB 3.09Å; F319-T322 PolarHBondContact O-N 3.02Å; F319-T322 PolarHBondContact O-OG1 3.14Å; E320-T322 PolarHBondContact O-N 3.34Å |
| 323 | G | 42.1 | Very low | 51.9 | Low | 16 Ų | 16 | 56 Ų | 56 | 17% | 0.165 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -97.9 | -36.3 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | E320 D325 S326 T327 | E320-G323 PolarHBondContact O-N 3.28Å; G323-D325 PolarHBondContact O-N 3.5Å; G323-S326 PolarHBondContact O-N 3.32Å; G323-T327 PolarHBondContact O-N 2.93Å; G323-T327 PolarHBondContact O-OG1 2.97Å |
| 324 | L | 37.2 | Very low | 50.9 | Low | 73 Ų | 73 | 57.3 Ų | 57.3 | 38% | 0.382 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -67 | -39.5 | -168.3 | -86.8 | 159.1 | 0 | 0 | 0 | 115.3 | E320 S326 T327 R328 | E320-L324 HydrophobicContact CG-CD1 3.87Å; E320-L324 PolarHBondContact O-N 2.89Å; L324-S326 PolarHBondContact O-N 3.4Å; L324-T327 PolarHBondContact O-N 3.41Å; L324-R328 VanDerWaalsContact O-CB 3.27Å; L324-R328 WeakPolarHBondContact O-CB 3.47Å; L324-R328 PolarHBondContact O-N 2.93Å |
| 325 | D | 40.6 | Very low | 49.7 | Very low | 79 Ų | 79 | 62.8 Ų | 62.8 | 42% | 0.422 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -75.2 | -8.1 | 179 | -22 | -57.8 | 0 | 0 | 0 | 114.2 | R229 G323 K329 | R229-D325 VanDerWaalsContact CZ-CB 3.48Å; R229-D325 IonicContact CZ-OD2 3.26Å; R229-D325 VanDerWaalsContact CZ-OD2 3.26Å; R229-D325 IonicContact NE-OD2 3.04Å; R229-D325 PolarHBondContact NE-OD2 3.2Å; R229-D325 VanDerWaalsContact NH2-N 3.19Å; R229-D325 IonicContact NH2-OD2 2.72Å; R229-D325 PolarHBondContact NH2-OD2 3.27Å; G323-D325 PolarHBondContact O-N 3.5Å; D325-K329 WeakPolarHBondContact O-CB 3.4Å; D325-K329 WeakPolarHBondContact O-CG 3.06Å; D325-K329 PolarHBondContact O-N 3.47Å |
| 326 | S | 37.8 | Very low | 48.7 | Very low | 28 Ų | 28 | 67.2 Ų | 67.2 | 20% | 0.196 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -81.2 | -46.9 | 169.4 | -122.1 | 0 | 0 | 0 | 0 | 110.6 | G323 L324 K329 S330 | G323-S326 PolarHBondContact O-N 3.32Å; L324-S326 PolarHBondContact O-N 3.4Å; S326-K329 PolarHBondContact O-N 2.94Å; S326-S330 WeakPolarHBondContact O-CB 3.48Å; S326-S330 PolarHBondContact O-N 3.49Å |
| 327 | T | 36.8 | Very low | 48.1 | Very low | 83 Ų | 83 | 69.9 Ų | 69.9 | 51% | 0.509 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -68 | -40.2 | 179.2 | -44.4 | 0 | 0 | 0 | 0 | 111.8 | G323 L324 K329 S330 Q331 | G323-T327 PolarHBondContact O-N 2.93Å; G323-T327 PolarHBondContact O-OG1 2.97Å; L324-T327 PolarHBondContact O-N 3.41Å; T327-K329 PolarHBondContact O-N 2.69Å; T327-S330 PolarHBondContact O-N 2.97Å; T327-Q331 PolarHBondContact O-N 3.4Å |
| 328 | R | 36.4 | Very low | 47.4 | Very low | 189 Ų | 189 | 73.4 Ų | 73.4 | 71% | 0.713 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -68.5 | -34.5 | 179.1 | -147.8 | 175.2 | -172.8 | -176.3 | 1 | 111.9 | L324 M332 | L324-R328 VanDerWaalsContact O-CB 3.27Å; L324-R328 WeakPolarHBondContact O-CB 3.47Å; L324-R328 PolarHBondContact O-N 2.93Å; R328-M332 WeakPolarHBondContact O-CB 3.39Å; R328-M332 PolarHBondContact O-N 2.86Å |
| 329 | K | 39.8 | Very low | 46.6 | Very low | 90 Ų | 90 | 76.4 Ų | 76.4 | 39% | 0.391 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -73.6 | -35.1 | 171.7 | -84.4 | -176.9 | 175.1 | 177 | 0 | 113.3 | D325 S326 T327 M332 N333 | D325-K329 WeakPolarHBondContact O-CB 3.4Å; D325-K329 WeakPolarHBondContact O-CG 3.06Å; D325-K329 PolarHBondContact O-N 3.47Å; S326-K329 PolarHBondContact O-N 2.94Å; T327-K329 PolarHBondContact O-N 2.69Å; K329-M332 PolarHBondContact O-N 3.49Å; K329-N333 VanDerWaalsContact O-CB 3.25Å; K329-N333 WeakPolarHBondContact O-CB 3.36Å; K329-N333 PolarHBondContact O-N 2.91Å |
| 330 | S | 42.5 | Very low | 46.1 | Very low | 75 Ų | 75 | 83.5 Ų | 83.5 | 52% | 0.524 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -64.3 | -43.1 | 174.2 | 179.4 | 0 | 0 | 0 | 0 | 111.6 | S326 T327 S334 | S326-S330 WeakPolarHBondContact O-CB 3.48Å; S326-S330 PolarHBondContact O-N 3.49Å; T327-S330 PolarHBondContact O-N 2.97Å; S330-S334 VanDerWaalsContact O-CB 3.31Å; S330-S334 WeakPolarHBondContact O-CB 3.2Å; S330-S334 PolarHBondContact O-N 2.96Å |
| 331 | Q | 39.9 | Very low | 45.7 | Very low | 128 Ų | 128 | 88.3 Ų | 88.3 | 60% | 0.598 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -67 | -45.1 | 174.2 | -81.2 | -178.9 | -50.3 | 0 | 0 | 111.1 | T327 N333 S334 Q335 | T327-Q331 PolarHBondContact O-N 3.4Å; Q331-N333 PolarHBondContact O-N 3.35Å; Q331-S334 PolarHBondContact O-N 3.44Å; Q331-Q335 VanDerWaalsContact O-CB 3.28Å; Q331-Q335 WeakPolarHBondContact O-CB 3.27Å; Q331-Q335 PolarHBondContact O-N 3.15Å |
| 332 | M | 39.6 | Very low | 45.9 | Very low | 117 Ų | 117 | 92.9 Ų | 92.9 | 58% | 0.576 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -67.5 | -33.6 | -179.7 | -158.2 | 157.4 | 82.1 | 0 | 0 | 113.2 | R328 K329 N336 | R328-M332 WeakPolarHBondContact O-CB 3.39Å; R328-M332 PolarHBondContact O-N 2.86Å; K329-M332 PolarHBondContact O-N 3.49Å; M332-N336 WeakPolarHBondContact O-CB 3.31Å; M332-N336 PolarHBondContact O-N 3.3Å |
| 333 | N | 43.2 | Very low | 46.3 | Very low | 113 Ų | 113 | 97.5 Ų | 97.5 | 60% | 0.604 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -73.2 | -35.3 | 172.6 | -83.4 | 5.4 | 0 | 0 | 0 | 112.7 | K329 Q331 Q335 S337 | K329-N333 VanDerWaalsContact O-CB 3.25Å; K329-N333 WeakPolarHBondContact O-CB 3.36Å; K329-N333 PolarHBondContact O-N 2.91Å; Q331-N333 PolarHBondContact O-N 3.35Å; N333-Q335 VanDerWaalsContact C-N 3.29Å; N333-S337 WeakPolarHBondContact O-CB 3.46Å; N333-S337 PolarHBondContact O-N 2.91Å; N333-S337 PolarHBondContact O-OG 3.47Å |
| 334 | S | 45.9 | Very low | 47.1 | Very low | 43 Ų | 43 | 99 Ų | 99 | 30% | 0.301 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -71.7 | -25.9 | 174.6 | 179.4 | 0 | 0 | 0 | 0 | 112.7 | S330 Q331 S337 R338 | S330-S334 VanDerWaalsContact O-CB 3.31Å; S330-S334 WeakPolarHBondContact O-CB 3.2Å; S330-S334 PolarHBondContact O-N 2.96Å; Q331-S334 PolarHBondContact O-N 3.44Å; S334-S337 WeakPolarHBondContact CA-OG 3.28Å; S334-S337 PolarHBondContact O-OG 3.45Å; S334-R338 PolarHBondContact O-N 3.27Å; S334-R338 PolarHBondContact O-NE 2.98Å; S334-R338 PolarHBondContact OG-NH2 2.99Å |
| 335 | Q | 50.7 | Low | 48 | Very low | 124 Ų | 124 | 101.8 Ų | 101.8 | 58% | 0.579 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -82 | -44.4 | 176.2 | -154.2 | 144.7 | -0.4 | 0 | 0 | 110.4 | Q331 N333 S337 R338 D339 | Q331-Q335 VanDerWaalsContact O-CB 3.28Å; Q331-Q335 WeakPolarHBondContact O-CB 3.27Å; Q331-Q335 PolarHBondContact O-N 3.15Å; N333-Q335 VanDerWaalsContact C-N 3.29Å; Q335-S337 VanDerWaalsContact C-N 3.29Å; Q335-S337 PolarHBondContact O-N 3.29Å; Q335-R338 PolarHBondContact O-N 3Å; Q335-R338 VanDerWaalsContact O-N 3.15Å; Q335-D339 PolarHBondContact O-N 3.25Å |
| 336 | N | 48.8 | Very low | 48.9 | Very low | 97 Ų | 97 | 101.8 Ų | 101.8 | 52% | 0.519 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62 | -30.4 | 170.6 | -92.7 | 6 | 0 | 0 | 0 | 113.9 | M332 K340 | M332-N336 WeakPolarHBondContact O-CB 3.31Å; M332-N336 PolarHBondContact O-N 3.3Å; N336-K340 WeakPolarHBondContact O-CB 3.15Å; N336-K340 WeakPolarHBondContact O-CG 3.34Å; N336-K340 PolarHBondContact O-N 3.18Å; N336-K340 VanDerWaalsContact O-N 3.16Å |
| 337 | S | 53.2 | Low | 49.9 | Very low | 58 Ų | 58 | 105.1 Ų | 105.1 | 41% | 0.406 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -73.4 | -38.2 | 174.2 | 66.3 | 0 | 0 | 0 | 0 | 111.7 | N333 S334 Q335 K340 D341 | N333-S337 WeakPolarHBondContact O-CB 3.46Å; N333-S337 PolarHBondContact O-N 2.91Å; N333-S337 PolarHBondContact O-OG 3.47Å; S334-S337 WeakPolarHBondContact CA-OG 3.28Å; S334-S337 PolarHBondContact O-OG 3.45Å; Q335-S337 VanDerWaalsContact C-N 3.29Å; Q335-S337 PolarHBondContact O-N 3.29Å; S337-K340 PolarHBondContact O-N 2.98Å; S337-D341 PolarHBondContact O-N 3.22Å |
| 338 | R | 53.8 | Low | 50.8 | Low | 157 Ų | 157 | 106.6 Ų | 106.6 | 59% | 0.592 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -70.7 | -35.8 | 176.7 | -87.7 | -176.2 | -93.5 | -168.2 | -11.2 | 113.1 | S334 Q335 K342 | S334-R338 PolarHBondContact O-N 3.27Å; S334-R338 PolarHBondContact O-NE 2.98Å; S334-R338 PolarHBondContact OG-NH2 2.99Å; Q335-R338 PolarHBondContact O-N 3Å; Q335-R338 VanDerWaalsContact O-N 3.15Å; R338-K342 WeakPolarHBondContact O-CG 3.32Å; R338-K342 PolarHBondContact O-N 3.38Å; R338-K342 VanDerWaalsContact O-N 3.13Å |
| 339 | D | 55.2 | Low | 51.7 | Low | 76 Ų | 76 | 104.1 Ų | 104.1 | 41% | 0.406 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -71.5 | -36.6 | 174.7 | -72.8 | -21.7 | 0 | 0 | 0 | 111.1 | Q335 K342 D343 | Q335-D339 PolarHBondContact O-N 3.25Å; D339-K342 PolarHBondContact O-N 3.28Å; D339-D343 WeakPolarHBondContact O-CB 3.49Å; D339-D343 PolarHBondContact O-N 2.85Å |
| 340 | K | 55.4 | Low | 52.4 | Low | 154 Ų | 154 | 105 Ų | 105 | 67% | 0.67 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -64.9 | -37.7 | 172.6 | -83 | -172.1 | 174.3 | -166.6 | 0 | 114.2 | N336 S337 A344 | N336-K340 WeakPolarHBondContact O-CB 3.15Å; N336-K340 WeakPolarHBondContact O-CG 3.34Å; N336-K340 PolarHBondContact O-N 3.18Å; N336-K340 VanDerWaalsContact O-N 3.16Å; S337-K340 PolarHBondContact O-N 2.98Å; K340-A344 WeakPolarHBondContact O-CB 3.5Å; K340-A344 PolarHBondContact O-N 2.91Å |
| 341 | D | 57.3 | Low | 52.9 | Low | 115 Ų | 115 | 108.1 Ų | 108.1 | 62% | 0.615 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -67.7 | -38.5 | 174.9 | -81 | -20.1 | 0 | 0 | 0 | 111 | S337 A344 E345 | S337-D341 PolarHBondContact O-N 3.22Å; D341-A344 PolarHBondContact O-N 2.84Å; D341-E345 WeakPolarHBondContact O-CB 3.33Å; D341-E345 PolarHBondContact O-N 3.44Å |
| 342 | K | 58.1 | Low | 53.5 | Low | 128 Ų | 128 | 107.5 Ų | 107.5 | 56% | 0.557 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -65.8 | -42.9 | 174.5 | -74.7 | 178.5 | 175.8 | -172.3 | 0 | 112.8 | R338 D339 A344 E345 V346 | R338-K342 WeakPolarHBondContact O-CG 3.32Å; R338-K342 PolarHBondContact O-N 3.38Å; R338-K342 VanDerWaalsContact O-N 3.13Å; D339-K342 PolarHBondContact O-N 3.28Å; K342-A344 VanDerWaalsContact C-N 3.31Å; K342-A344 PolarHBondContact O-N 2.95Å; K342-E345 PolarHBondContact O-N 3.38Å; K342-V346 VanDerWaalsContact O-CG2 3.28Å; K342-V346 WeakPolarHBondContact O-CG2 3.4Å; K342-V346 PolarHBondContact O-N 2.98Å |
| 343 | D | 57.9 | Low | 54 | Low | 104 Ų | 104 | 104.9 Ų | 104.9 | 56% | 0.556 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -65.7 | -36.1 | 177.1 | -67.9 | -25.1 | 0 | 0 | 0 | 111.2 | D339 V347 | D339-D343 WeakPolarHBondContact O-CB 3.49Å; D339-D343 PolarHBondContact O-N 2.85Å; D343-V347 WeakPolarHBondContact O-CB 3.36Å; D343-V347 WeakPolarHBondContact O-CG2 3.43Å; D343-V347 PolarHBondContact O-N 2.91Å; D343-V347 VanDerWaalsContact O-N 3.09Å |
| 344 | A | 58.8 | Low | 54.4 | Low | 49 Ų | 49 | 102.3 Ų | 102.3 | 41% | 0.405 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -69 | -37.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | K340 D341 K342 V347 L348 | K340-A344 WeakPolarHBondContact O-CB 3.5Å; K340-A344 PolarHBondContact O-N 2.91Å; D341-A344 PolarHBondContact O-N 2.84Å; K342-A344 VanDerWaalsContact C-N 3.31Å; K342-A344 PolarHBondContact O-N 2.95Å; A344-V347 PolarHBondContact O-N 3.45Å; A344-L348 WeakPolarHBondContact O-CD1 3.42Å; A344-L348 WeakPolarHBondContact O-CG 3.36Å; A344-L348 PolarHBondContact O-N 3.34Å; A344-L348 VanDerWaalsContact O-N 3.08Å |
| 345 | E | 55.8 | Low | 54.5 | Low | 130 Ų | 130 | 104.6 Ų | 104.6 | 61% | 0.607 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -69.3 | -37.8 | 177 | -164.5 | 169.1 | -172.9 | 0 | 0 | 112 | D341 K342 L348 Q349 | D341-E345 WeakPolarHBondContact O-CB 3.33Å; D341-E345 PolarHBondContact O-N 3.44Å; K342-E345 PolarHBondContact O-N 3.38Å; E345-L348 PolarHBondContact O-N 2.97Å; E345-Q349 PolarHBondContact O-N 3.06Å; E345-Q349 VanDerWaalsContact O-N 3.08Å |
| 346 | V | 60.3 | Low | 54.2 | Low | 80 Ų | 80 | 104.2 Ų | 104.2 | 49% | 0.485 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -67 | -40.7 | 173.3 | 173.4 | 0 | 0 | 0 | 0 | 111.6 | K342 L348 Q349 D350 | K342-V346 VanDerWaalsContact O-CG2 3.28Å; K342-V346 WeakPolarHBondContact O-CG2 3.4Å; K342-V346 PolarHBondContact O-N 2.98Å; V346-L348 VanDerWaalsContact C-N 3.31Å; V346-L348 PolarHBondContact O-N 2.88Å; V346-Q349 PolarHBondContact O-N 2.93Å; V346-D350 PolarHBondContact O-N 2.95Å |
| 347 | V | 58.6 | Low | 54.1 | Low | 97 Ų | 97 | 103 Ų | 103 | 59% | 0.588 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -67.3 | -31.2 | 176.9 | 170.6 | 0 | 0 | 0 | 0 | 112.3 | D343 A344 K351 | D343-V347 WeakPolarHBondContact O-CB 3.36Å; D343-V347 WeakPolarHBondContact O-CG2 3.43Å; D343-V347 PolarHBondContact O-N 2.91Å; D343-V347 VanDerWaalsContact O-N 3.09Å; A344-V347 PolarHBondContact O-N 3.45Å; V347-K351 WeakPolarHBondContact O-CB 3.45Å; V347-K351 PolarHBondContact O-N 2.93Å |
| 348 | L | 56.6 | Low | 53.7 | Low | 114 Ų | 114 | 105.9 Ų | 105.9 | 60% | 0.597 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -70.8 | -42 | 173.1 | -79.9 | 158 | 0 | 0 | 0 | 111.5 | A344 E345 V346 K351 D352 | A344-L348 WeakPolarHBondContact O-CD1 3.42Å; A344-L348 WeakPolarHBondContact O-CG 3.36Å; A344-L348 PolarHBondContact O-N 3.34Å; A344-L348 VanDerWaalsContact O-N 3.08Å; E345-L348 PolarHBondContact O-N 2.97Å; V346-L348 VanDerWaalsContact C-N 3.31Å; V346-L348 PolarHBondContact O-N 2.88Å; L348-K351 PolarHBondContact O-N 3.42Å; L348-D352 PolarHBondContact O-N 3.2Å |
| 349 | Q | 54.9 | Low | 53.2 | Low | 138 Ų | 138 | 101.7 Ų | 101.7 | 65% | 0.645 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -64.5 | -38.2 | 175.2 | -90.5 | -175.1 | -14.1 | 0 | 0 | 113.5 | E345 V346 K351 D352 S353 | E345-Q349 PolarHBondContact O-N 3.06Å; E345-Q349 VanDerWaalsContact O-N 3.08Å; V346-Q349 PolarHBondContact O-N 2.93Å; Q349-K351 VanDerWaalsContact C-N 3.27Å; Q349-K351 PolarHBondContact O-N 3.28Å; Q349-D352 PolarHBondContact O-N 3.35Å; Q349-S353 PolarHBondContact O-N 2.92Å; Q349-S353 VanDerWaalsContact O-N 3.13Å; Q349-S353 PolarHBondContact O-OG 3.25Å |
| 350 | D | 54.3 | Low | 52.8 | Low | 108 Ų | 108 | 104.3 Ų | 104.3 | 58% | 0.578 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -70 | -24.8 | 176.5 | -101.5 | -12.1 | 0 | 0 | 0 | 113.1 | V346 S353 S354 | V346-D350 PolarHBondContact O-N 2.95Å; D350-S353 WeakPolarHBondContact CA-OG 3.38Å; D350-S353 PolarHBondContact O-OG 3.31Å; D350-S354 WeakPolarHBondContact O-CB 2.94Å; D350-S354 PolarHBondContact O-N 3.06Å; D350-S354 PolarHBondContact O-OG 2.81Å |
| 351 | K | 53.3 | Low | 52.3 | Low | 140 Ų | 140 | 103.2 Ų | 103.2 | 61% | 0.609 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -77.8 | -32.5 | 176.9 | -147.7 | 171.9 | -174.3 | 178 | 0 | 112 | V347 L348 Q349 S354 T355 | V347-K351 WeakPolarHBondContact O-CB 3.45Å; V347-K351 PolarHBondContact O-N 2.93Å; L348-K351 PolarHBondContact O-N 3.42Å; Q349-K351 VanDerWaalsContact C-N 3.27Å; Q349-K351 PolarHBondContact O-N 3.28Å; K351-S354 PolarHBondContact O-OG 2.74Å; K351-T355 WeakPolarHBondContact O-CB 3.5Å; K351-T355 PolarHBondContact O-N 3.22Å; K351-T355 PolarHBondContact O-OG1 3.44Å |
| 352 | D | 51.6 | Low | 51.4 | Low | 115 Ų | 115 | 106.5 Ų | 106.5 | 62% | 0.615 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -75.6 | -35.2 | 175.1 | -72.7 | -19 | 0 | 0 | 0 | 112 | L348 Q349 N356 | L348-D352 PolarHBondContact O-N 3.2Å; Q349-D352 PolarHBondContact O-N 3.35Å; D352-N356 PolarHBondContact O-N 3.06Å |
| 353 | S | 51.1 | Low | 50.7 | Low | 62 Ų | 62 | 105.6 Ų | 105.6 | 43% | 0.434 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -70.9 | -36.7 | 176.3 | 65.6 | 0 | 0 | 0 | 0 | 113.3 | Q349 D350 S357 | Q349-S353 PolarHBondContact O-N 2.92Å; Q349-S353 VanDerWaalsContact O-N 3.13Å; Q349-S353 PolarHBondContact O-OG 3.25Å; D350-S353 WeakPolarHBondContact CA-OG 3.38Å; D350-S353 PolarHBondContact O-OG 3.31Å; S353-S357 PolarHBondContact O-N 2.95Å; S353-S357 PolarHBondContact O-OG 3.36Å; S353-S357 VanDerWaalsContact O-OG 3.12Å |
| 354 | S | 50.2 | Low | 50.1 | Low | 60 Ų | 60 | 104.9 Ų | 104.9 | 42% | 0.42 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -76.8 | -26 | 176.7 | 51.3 | 0 | 0 | 0 | 0 | 113.4 | D350 K351 | D350-S354 WeakPolarHBondContact O-CB 2.94Å; D350-S354 PolarHBondContact O-N 3.06Å; D350-S354 PolarHBondContact O-OG 2.81Å; K351-S354 PolarHBondContact O-OG 2.74Å |
| 355 | T | 48.2 | Very low | 49.6 | Very low | 91 Ų | 91 | 111.7 Ų | 111.7 | 56% | 0.558 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -73.1 | -34.8 | 173.6 | -55.9 | 0 | 0 | 0 | 0 | 111.8 | K351 S357 | K351-T355 WeakPolarHBondContact O-CB 3.5Å; K351-T355 PolarHBondContact O-N 3.22Å; K351-T355 PolarHBondContact O-OG1 3.44Å; T355-S357 PolarHBondContact O-N 2.86Å |
| 356 | N | 45.2 | Very low | 49.2 | Very low | 116 Ų | 116 | 112.3 Ų | 112.3 | 62% | 0.62 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -73.4 | -21.9 | 175.2 | -99.8 | -8.2 | 0 | 0 | 0 | 114.4 | D352 S359 | D352-N356 PolarHBondContact O-N 3.06Å; N356-S359 PolarHBondContact O-OG 3.28Å; N356-S359 VanDerWaalsContact O-OG 3.06Å |
| 357 | S | 46.9 | Very low | 48.3 | Very low | 71 Ų | 71 | 112.5 Ų | 112.5 | 50% | 0.497 | 64% | 0.643 | S | S | . | * | H | α-helix | trans | -82.2 | -26.2 | 178.3 | -59.1 | 0 | 0 | 0 | 0 | 112.8 | S353 T355 | S353-S357 PolarHBondContact O-N 2.95Å; S353-S357 PolarHBondContact O-OG 3.36Å; S353-S357 VanDerWaalsContact O-OG 3.12Å; T355-S357 PolarHBondContact O-N 2.86Å |
| 358 | N | 43.7 | Very low | 47.4 | Very low | 118 Ų | 118 | 121.5 Ų | 121.5 | 63% | 0.631 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -83.8 | -15 | 178.4 | -84.3 | -22.2 | 0 | 0 | 0 | 114.7 | ||
| 359 | S | 44.3 | Very low | 46.9 | Very low | 70 Ų | 70 | 121.9 Ų | 121.9 | 49% | 0.49 | 68% | 0.678 | S | S | . | * | H | α-helix | trans | -81.4 | -26.5 | 173.9 | 58 | 0 | 0 | 0 | 0 | 112.5 | N356 | N356-S359 PolarHBondContact O-OG 3.28Å; N356-S359 VanDerWaalsContact O-OG 3.06Å |
| 360 | I | 45.3 | Very low | 46.5 | Very low | 130 Ų | 130 | 121.1 Ų | 121.1 | 67% | 0.667 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -81.1 | -32.2 | -178.5 | -59.9 | 174.5 | 0 | 0 | 0 | 112.2 | ||
| 361 | I | 44.9 | Very low | 46.1 | Very low | 132 Ų | 132 | 121.8 Ų | 121.8 | 68% | 0.677 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -79.6 | -23.1 | -177.6 | -62.2 | 174.2 | 0 | 0 | 0 | 112.7 | ||
| 362 | K | 39.8 | Very low | 45.7 | Very low | 183 Ų | 183 | 120.7 Ų | 120.7 | 80% | 0.796 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.1 | -11.2 | 178.4 | -88.9 | -174.9 | 176.8 | 179.6 | 0 | 114.8 | ||
| 363 | S | 43.5 | Very low | 45.3 | Very low | 109 Ų | 109 | 121.1 Ų | 121.1 | 76% | 0.762 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.2 | -0.3 | -178.7 | -154.7 | 0 | 0 | 0 | 0 | 114.9 | ||
| 364 | A | 45.8 | Very low | 44.9 | Very low | 89 Ų | 89 | 125 Ų | 125 | 74% | 0.736 | 71% | 0.712 | S | S | * | * | S | Bend | trans | -108.5 | 9.7 | -175.7 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||
| 365 | K | 46.8 | Very low | 44.5 | Very low | 193 Ų | 193 | 129.6 Ų | 129.6 | 84% | 0.839 | 73% | 0.733 | S | S | * | * | S | Bend | trans | -133.6 | 44.8 | -174.4 | -114.5 | -175.7 | -173.9 | -179.8 | 0 | 114.4 | ||
| 366 | T | 47.5 | Very low | 44.2 | Very low | 142 Ų | 142 | 132.6 Ų | 132.6 | 87% | 0.871 | 75% | 0.746 | S | S | * | * | trans | -160.5 | 109.1 | 160.4 | 5.9 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 367 | G | 41.3 | Very low | 44.2 | Very low | 85 Ų | 85 | 134 Ų | 134 | 88% | 0.876 | 76% | 0.757 | S | S | * | * | trans | 168.8 | 67.1 | 179.8 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 368 | K | 40.3 | Very low | 43.9 | Very low | 286 Ų | 286 | 139.7 Ų | 139.7 | 100% | 1.243 | 78% | 0.781 | S | S | * | * | trans | -95.7 | 0 | 155.8 | -108 | -170.9 | 179.3 | -176.2 | 0 | 107.4 |
Retrieved 368 of 368 residues in 519.3 ms
(Link to these results)