| 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 | 59.2 | Low | 83.3 | Confident | 135 Ų | 135 | 79.5 Ų | 79.5 | 67% | 0.665 | 41% | 0.411 | S | S | * | . | 0 | 116.5 | 0 | -163.1 | 171 | -101.9 | 0 | 0 | 108.1 | F5 E92 W289 | M1-F5 HydrophobicContact CE-CD1 3.72Å; M1-F5 HydrophobicContact CE-CE1 3.53Å; M1-F5 HydrophobicContact CG-CB 4.36Å; M1-F5 HydrophobicContact CG-CD1 3.75Å; M1-F5 HydrophobicContact CG-CG 4.44Å; M1-F5 HydrophobicContact SD-CD1 3.65Å; M1-F5 HydrophobicContact SD-CE1 4.03Å; M1-E92 WeakPolarHBondContact CE-OE1 3.45Å; M1-W289 HydrophobicContact CE-CH2 3.69Å; M1-W289 HydrophobicContact CE-CZ3 3.63Å; M1-W289 HydrophobicContact CG-CH2 3.7Å; M1-W289 HydrophobicContact CG-CZ2 4.4Å; M1-W289 HydrophobicContact SD-CH2 4.46Å | |||
| 2 | S | 71.1 | Confident | 84.2 | Confident | 50 Ų | 50 | 72.8 Ų | 72.8 | 35% | 0.35 | 38% | 0.377 | S | S | . | . | trans | -69.2 | 145.9 | -176.3 | 64.9 | 0 | 0 | 0 | 0 | 110.9 | T4 F5 T6 R285 | S2-T4 WeakPolarHBondContact CB-OG1 2.84Å; S2-T4 PolarHBondContact O-N 3.39Å; S2-T4 PolarHBondContact OG-OG1 3.37Å; S2-F5 PolarHBondContact O-N 3.22Å; S2-T6 PolarHBondContact O-N 3.22Å; S2-R285 PolarHBondContact OG-NH2 2.76Å | ||
| 3 | L | 75 | Confident | 85.1 | Confident | 132 Ų | 132 | 72.7 Ų | 72.7 | 69% | 0.691 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -49.8 | -33.9 | 176.4 | -169.9 | 74.1 | 0 | 0 | 0 | 112.4 | F5 T6 I7 | L3-F5 PolarHBondContact O-N 3.4Å; L3-T6 PolarHBondContact O-N 2.83Å; L3-I7 HydrophobicContact CD1-CD1 4.12Å; L3-I7 HydrophobicContact CD1-CG1 4.37Å; L3-I7 HydrophobicContact CD2-CD1 4.17Å; L3-I7 HydrophobicContact CG-CD1 3.73Å; L3-I7 HydrophobicContact CG-CG1 4.32Å; L3-I7 PolarHBondContact O-N 3.03Å |
| 4 | T | 80.1 | Confident | 85.8 | Confident | 83 Ų | 83 | 70.4 Ų | 70.4 | 51% | 0.509 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -64.3 | -15.2 | 176.1 | 49.4 | 0 | 0 | 0 | 0 | 115.2 | S2 P8 F281 R285 | S2-T4 WeakPolarHBondContact CB-OG1 2.84Å; S2-T4 PolarHBondContact O-N 3.39Å; S2-T4 PolarHBondContact OG-OG1 3.37Å; T4-P8 WeakPolarHBondContact O-CD 3.45Å; T4-P8 WeakPolarHBondContact O-CG 3.45Å; T4-F281 WeakPolarHBondContact O-CE1 3.19Å; T4-R285 PolarHBondContact OG1-NH2 2.72Å |
| 5 | F | 83.2 | Confident | 86.4 | Confident | 2 Ų | 2 | 67.6 Ų | 67.6 | 1% | 0.009 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -99.3 | -40.9 | 173.7 | -175.8 | -94.3 | 0 | 0 | 0 | 111.9 | M1 S2 L3 I7 P8 K9 L282 R285 I286 W289 | M1-F5 HydrophobicContact CE-CD1 3.72Å; M1-F5 HydrophobicContact CE-CE1 3.53Å; M1-F5 HydrophobicContact CG-CB 4.36Å; M1-F5 HydrophobicContact CG-CD1 3.75Å; M1-F5 HydrophobicContact CG-CG 4.44Å; M1-F5 HydrophobicContact SD-CD1 3.65Å; M1-F5 HydrophobicContact SD-CE1 4.03Å; S2-F5 PolarHBondContact O-N 3.22Å; L3-F5 PolarHBondContact O-N 3.4Å; F5-I7 PolarHBondContact O-N 3.34Å; F5-P8 WeakPolarHBondContact O-CD 3.42Å; F5-K9 HydrophobicContact CE1-CD 4.1Å; F5-K9 WeakPolarHBondContact O-CB 3.2Å; F5-K9 PolarHBondContact O-N 3.39Å; F5-L282 HydrophobicContact CD2-CD2 3.95Å; F5-L282 HydrophobicContact CE2-CD2 3.66Å; F5-L282 HydrophobicContact CZ-CD2 4.08Å; F5-R285 HydrophobicContact CD2-CB 3.68Å; F5-R285 HydrophobicContact CD2-CG 4.26Å; F5-R285 HydrophobicContact CE2-CB 3.76Å; F5-I286 HydrophobicContact CE2-CG1 4.02Å; F5-I286 HydrophobicContact CZ-CG1 3.96Å; F5-W289 HydrophobicContact CB-CH2 4.09Å; F5-W289 HydrophobicContact CB-CZ2 4.32Å; F5-W289 AromaticContact CD1-CH2 3.43Å; F5-W289 HydrophobicContact CD1-CH2 3.43Å; F5-W289 VanDerWaalsContact CD1-CH2 3.43Å; F5-W289 HydrophobicContact CD1-CZ2 4.43Å; F5-W289 AromaticContact CD1-CZ3 3.96Å; F5-W289 HydrophobicContact CD1-CZ3 3.96Å; F5-W289 AromaticContact CD2-CH2 3.85Å; F5-W289 HydrophobicContact CD2-CH2 3.85Å; F5-W289 HydrophobicContact CD2-CZ2 4.33Å; F5-W289 HydrophobicContact CD2-CZ3 4.33Å; F5-W289 AromaticContact CE1-CH2 3.65Å; F5-W289 HydrophobicContact CE1-CH2 3.65Å; F5-W289 AromaticContact CE1-CZ3 3.66Å; F5-W289 HydrophobicContact CE1-CZ3 3.66Å; F5-W289 HydrophobicContact CE2-CH2 4.06Å; F5-W289 HydrophobicContact CE2-CZ3 4.07Å; F5-W289 AromaticContact CG-CH2 3.5Å; F5-W289 HydrophobicContact CG-CH2 3.5Å; F5-W289 VanDerWaalsContact CG-CH2 3.5Å; F5-W289 HydrophobicContact CG-CZ2 4.11Å; F5-W289 HydrophobicContact CG-CZ3 4.26Å; F5-W289 AromaticContact CZ-CH2 3.95Å; F5-W289 HydrophobicContact CZ-CH2 3.95Å; F5-W289 AromaticContact CZ-CZ3 3.7Å; F5-W289 HydrophobicContact CZ-CZ3 3.7Å |
| 6 | T | 87.8 | Confident | 87 | Confident | 62 Ų | 62 | 63.4 Ų | 63.4 | 38% | 0.38 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -66.9 | -38.8 | -176.1 | -50.9 | 0 | 0 | 0 | 0 | 112.7 | S2 L3 K9 F10 | S2-T6 PolarHBondContact O-N 3.22Å; L3-T6 PolarHBondContact O-N 2.83Å; T6-K9 PolarHBondContact O-N 3Å; T6-F10 WeakPolarHBondContact O-CB 3.36Å; T6-F10 PolarHBondContact O-N 3.29Å |
| 7 | I | 90.1 | Very high | 87.5 | Confident | 102 Ų | 102 | 65.9 Ų | 65.9 | 52% | 0.523 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -64.3 | -53.5 | -179.1 | -65.3 | 171 | 0 | 0 | 0 | 111.6 | L3 F5 K9 F10 F11 | L3-I7 HydrophobicContact CD1-CD1 4.12Å; L3-I7 HydrophobicContact CD1-CG1 4.37Å; L3-I7 HydrophobicContact CD2-CD1 4.17Å; L3-I7 HydrophobicContact CG-CD1 3.73Å; L3-I7 HydrophobicContact CG-CG1 4.32Å; L3-I7 PolarHBondContact O-N 3.03Å; F5-I7 PolarHBondContact O-N 3.34Å; I7-K9 VanDerWaalsContact C-N 3.28Å; I7-K9 PolarHBondContact O-N 3.49Å; I7-F10 PolarHBondContact O-N 2.93Å; I7-F11 PolarHBondContact O-N 3.42Å |
| 8 | P | 89.7 | Confident | 88 | Confident | 20 Ų | 20 | 67.7 Ų | 67.7 | 13% | 0.13 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -59.4 | -37.6 | 175.9 | -28 | 37.7 | 0 | 0 | 0 | 113.3 | T4 F5 F11 L12 L278 F281 L282 | T4-P8 WeakPolarHBondContact O-CD 3.45Å; T4-P8 WeakPolarHBondContact O-CG 3.45Å; F5-P8 WeakPolarHBondContact O-CD 3.42Å; P8-F11 PolarHBondContact O-N 3.16Å; P8-L12 WeakPolarHBondContact O-CB 3.33Å; P8-L12 PolarHBondContact O-N 3.11Å; P8-L278 HydrophobicContact CB-CD2 4Å; P8-F281 HydrophobicContact CB-CD1 4.11Å; P8-F281 HydrophobicContact CB-CE1 4.2Å; P8-F281 HydrophobicContact CG-CD1 4.14Å; P8-F281 HydrophobicContact CG-CE1 3.81Å; P8-L282 HydrophobicContact CB-CD2 4.28Å |
| 9 | K | 92.6 | Very high | 88.4 | Confident | 45 Ų | 45 | 66.1 Ų | 66.1 | 20% | 0.196 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -60 | -51.7 | 176.8 | -167.7 | -170.1 | -177.4 | 177.4 | 0 | 111 | F5 T6 I7 L12 F13 V89 E92 L282 | F5-K9 HydrophobicContact CE1-CD 4.1Å; F5-K9 WeakPolarHBondContact O-CB 3.2Å; F5-K9 PolarHBondContact O-N 3.39Å; T6-K9 PolarHBondContact O-N 3Å; I7-K9 VanDerWaalsContact C-N 3.28Å; I7-K9 PolarHBondContact O-N 3.49Å; K9-L12 PolarHBondContact O-N 3.04Å; K9-F13 WeakPolarHBondContact O-CB 3.28Å; K9-F13 PolarHBondContact O-N 3.21Å; K9-V89 HydrophobicContact CD-CG1 4.38Å; K9-V89 WeakPolarHBondContact CE-O 3.47Å; K9-V89 HydrophobicContact CG-CG1 3.44Å; K9-V89 VanDerWaalsContact CG-CG1 3.44Å; K9-V89 PolarHBondContact NZ-O 2.7Å; K9-V89 WeakPolarHBondContact O-CG1 3.26Å; K9-E92 IonicContact NZ-OE1 2.66Å; K9-E92 PolarHBondContact NZ-OE1 3.31Å; K9-L282 HydrophobicContact CB-CD2 4.26Å |
| 10 | F | 93.4 | Very high | 88.8 | Confident | 137 Ų | 137 | 63.8 Ų | 63.8 | 60% | 0.601 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -61.5 | -46.2 | 179.8 | -179.7 | -102.5 | 0 | 0 | 0 | 111.5 | T6 I7 F13 C14 | T6-F10 WeakPolarHBondContact O-CB 3.36Å; T6-F10 PolarHBondContact O-N 3.29Å; I7-F10 PolarHBondContact O-N 2.93Å; F10-F13 PolarHBondContact O-N 3.14Å; F10-C14 VanDerWaalsContact CZ-SG 3.51Å; F10-C14 PolarHBondContact O-N 3.15Å; F10-C14 PolarHBondContact O-SG 3.44Å; F10-C14 VanDerWaalsContact O-SG 3.35Å |
| 11 | F | 93.6 | Very high | 89.3 | Confident | 106 Ų | 106 | 64.8 Ų | 64.8 | 47% | 0.465 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -64.5 | -44.7 | -179.3 | -171.7 | -101.8 | 0 | 0 | 0 | 112.5 | I7 P8 F13 C14 L15 L278 | I7-F11 PolarHBondContact O-N 3.42Å; P8-F11 PolarHBondContact O-N 3.16Å; F11-F13 VanDerWaalsContact C-N 3.32Å; F11-F13 PolarHBondContact O-N 3.47Å; F11-C14 PolarHBondContact O-N 3.41Å; F11-L15 HydrophobicContact CD1-CD1 3.75Å; F11-L15 HydrophobicContact CD1-CG 4.24Å; F11-L15 HydrophobicContact CE1-CD1 3.25Å; F11-L15 HydrophobicContact CE1-CG 3.94Å; F11-L15 HydrophobicContact CZ-CD1 3.76Å; F11-L15 HydrophobicContact CZ-CD2 4.3Å; F11-L15 HydrophobicContact CZ-CG 4.09Å; F11-L15 WeakPolarHBondContact O-CG 3.48Å; F11-L15 PolarHBondContact O-N 3.18Å; F11-L278 HydrophobicContact CD1-CD1 3.52Å; F11-L278 HydrophobicContact CE1-CD1 3.89Å |
| 12 | L | 94.7 | Very high | 91.1 | Very high | 0 Ų | 0 | 62.4 Ų | 62.4 | 0% | 0 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -65 | -37.2 | 177.3 | -172.2 | 63 | 0 | 0 | 0 | 111.8 | P8 K9 N16 V89 L97 F100 T275 L278 L282 | P8-L12 WeakPolarHBondContact O-CB 3.33Å; P8-L12 PolarHBondContact O-N 3.11Å; K9-L12 PolarHBondContact O-N 3.04Å; L12-N16 WeakPolarHBondContact CD1-ND2 3.48Å; L12-N16 WeakPolarHBondContact O-CB 3.45Å; L12-N16 PolarHBondContact O-N 3.35Å; L12-N16 VanDerWaalsContact O-N 3.12Å; L12-N16 PolarHBondContact O-ND2 3.29Å; L12-V89 HydrophobicContact CB-CG2 4.29Å; L12-V89 HydrophobicContact CD2-CG2 3.65Å; L12-V89 HydrophobicContact CG-CG2 3.93Å; L12-L97 HydrophobicContact CD2-CD2 4.49Å; L12-F100 HydrophobicContact CD1-CE1 4.36Å; L12-T275 HydrophobicContact CD1-CG2 4.13Å; L12-L278 HydrophobicContact CD1-CB 4.3Å; L12-L282 HydrophobicContact CB-CD1 4.39Å; L12-L282 HydrophobicContact CD2-CD1 3.65Å |
| 13 | F | 95.7 | Very high | 92.4 | Very high | 71 Ų | 71 | 60 Ų | 60 | 31% | 0.311 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -62.4 | -50.8 | 173 | 177.9 | -100.4 | 0 | 0 | 0 | 111.4 | K9 F10 F11 L15 N16 F17 C86 V89 V90 | K9-F13 WeakPolarHBondContact O-CB 3.28Å; K9-F13 PolarHBondContact O-N 3.21Å; F10-F13 PolarHBondContact O-N 3.14Å; F11-F13 VanDerWaalsContact C-N 3.32Å; F11-F13 PolarHBondContact O-N 3.47Å; F13-L15 PolarHBondContact O-N 3.42Å; F13-N16 PolarHBondContact O-N 3.28Å; F13-F17 VanDerWaalsContact O-CB 3.28Å; F13-F17 WeakPolarHBondContact O-CB 3.33Å; F13-F17 PolarHBondContact O-N 2.96Å; F13-C86 HydrophobicContact CD2-CB 4.32Å; F13-C86 HydrophobicContact CE2-CB 4.25Å; F13-V89 HydrophobicContact CB-CG1 3.96Å; F13-V90 HydrophobicContact CD2-CG2 3.78Å; F13-V90 HydrophobicContact CE2-CG2 3.55Å |
| 14 | C | 95.7 | Very high | 93.5 | Very high | 40 Ų | 40 | 58.3 Ų | 58.3 | 27% | 0.27 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -60.2 | -44.5 | 180 | -71.8 | 0 | 0 | 0 | 0 | 112.4 | F10 F11 F17 L18 | F10-C14 VanDerWaalsContact CZ-SG 3.51Å; F10-C14 PolarHBondContact O-N 3.15Å; F10-C14 PolarHBondContact O-SG 3.44Å; F10-C14 VanDerWaalsContact O-SG 3.35Å; F11-C14 PolarHBondContact O-N 3.41Å; C14-F17 PolarHBondContact O-N 3.41Å; C14-L18 WeakPolarHBondContact O-CG 3.49Å; C14-L18 PolarHBondContact O-N 3.4Å |
| 15 | L | 94.5 | Very high | 94.3 | Very high | 29 Ų | 29 | 56.9 Ų | 56.9 | 15% | 0.152 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -60.8 | -50 | 177.6 | -76.4 | -177 | 0 | 0 | 0 | 111.8 | F11 F13 F17 L18 L19 L271 T275 | F11-L15 HydrophobicContact CD1-CD1 3.75Å; F11-L15 HydrophobicContact CD1-CG 4.24Å; F11-L15 HydrophobicContact CE1-CD1 3.25Å; F11-L15 HydrophobicContact CE1-CG 3.94Å; F11-L15 HydrophobicContact CZ-CD1 3.76Å; F11-L15 HydrophobicContact CZ-CD2 4.3Å; F11-L15 HydrophobicContact CZ-CG 4.09Å; F11-L15 WeakPolarHBondContact O-CG 3.48Å; F11-L15 PolarHBondContact O-N 3.18Å; F13-L15 PolarHBondContact O-N 3.42Å; L15-F17 VanDerWaalsContact C-N 3.31Å; L15-F17 PolarHBondContact O-N 2.91Å; L15-L18 PolarHBondContact O-N 3.37Å; L15-L19 WeakPolarHBondContact O-CG 3.25Å; L15-L19 PolarHBondContact O-N 3.46Å; L15-L271 HydrophobicContact CD1-CD1 4.01Å; L15-L271 HydrophobicContact CD2-CD1 4.17Å; L15-T275 HydrophobicContact CD1-CG2 3.74Å |
| 16 | N | 95.6 | Very high | 95 | Very high | 1 Ų | 1 | 59.8 Ų | 59.8 | 1% | 0.005 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -64.8 | -37.4 | 178.8 | -77.4 | -70 | 0 | 0 | 0 | 111.7 | L12 F13 L18 L19 V20 A82 C86 F100 | L12-N16 WeakPolarHBondContact CD1-ND2 3.48Å; L12-N16 WeakPolarHBondContact O-CB 3.45Å; L12-N16 PolarHBondContact O-N 3.35Å; L12-N16 VanDerWaalsContact O-N 3.12Å; L12-N16 PolarHBondContact O-ND2 3.29Å; F13-N16 PolarHBondContact O-N 3.28Å; N16-L18 VanDerWaalsContact C-N 3.35Å; N16-L18 PolarHBondContact O-N 3.44Å; N16-L19 WeakPolarHBondContact O-CB 3.38Å; N16-L19 PolarHBondContact O-N 3.5Å; N16-L19 VanDerWaalsContact O-N 3.15Å; N16-V20 WeakPolarHBondContact O-CG2 3.2Å; N16-V20 PolarHBondContact O-N 3.5Å; N16-A82 HydrophobicContact CB-CB 4.43Å; N16-A82 WeakPolarHBondContact O-CB 2.9Å; N16-C86 WeakPolarHBondContact CB-SG 3.37Å; N16-F100 WeakPolarHBondContact OD1-CE2 3.09Å; N16-F100 WeakPolarHBondContact OD1-CZ 3.4Å |
| 17 | F | 96.2 | Very high | 95.5 | Very high | 106 Ų | 106 | 59 Ų | 59 | 47% | 0.465 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -63.8 | -41.2 | 177.7 | -174.3 | -106.3 | 0 | 0 | 0 | 111.9 | F13 C14 L15 L19 V20 I21 C86 | F13-F17 VanDerWaalsContact O-CB 3.28Å; F13-F17 WeakPolarHBondContact O-CB 3.33Å; F13-F17 PolarHBondContact O-N 2.96Å; C14-F17 PolarHBondContact O-N 3.41Å; L15-F17 VanDerWaalsContact C-N 3.31Å; L15-F17 PolarHBondContact O-N 2.91Å; F17-L19 VanDerWaalsContact C-N 3.33Å; F17-L19 PolarHBondContact O-N 2.94Å; F17-V20 PolarHBondContact O-N 2.99Å; F17-I21 HydrophobicContact CD1-CD1 3.97Å; F17-I21 HydrophobicContact CE1-CD1 3.57Å; F17-I21 HydrophobicContact CE1-CG1 4.4Å; F17-I21 HydrophobicContact CZ-CD1 4.13Å; F17-I21 PolarHBondContact O-N 3.46Å; F17-I21 VanDerWaalsContact O-N 3.1Å; F17-C86 PolarHBondContact N-SG 3.32Å; F17-C86 VanDerWaalsContact N-SG 3.35Å |
| 18 | L | 96.2 | Very high | 95.9 | Very high | 98 Ų | 98 | 57 Ų | 57 | 51% | 0.513 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -62.2 | -40.5 | 172.4 | -71.4 | 172.6 | 0 | 0 | 0 | 111.8 | C14 L15 N16 V20 I21 I22 | C14-L18 WeakPolarHBondContact O-CG 3.49Å; C14-L18 PolarHBondContact O-N 3.4Å; L15-L18 PolarHBondContact O-N 3.37Å; N16-L18 VanDerWaalsContact C-N 3.35Å; N16-L18 PolarHBondContact O-N 3.44Å; L18-V20 VanDerWaalsContact C-N 3.34Å; L18-V20 PolarHBondContact O-N 3.42Å; L18-I21 PolarHBondContact O-N 2.89Å; L18-I22 VanDerWaalsContact O-CG1 3.31Å; L18-I22 WeakPolarHBondContact O-CG1 2.95Å; L18-I22 PolarHBondContact O-N 2.66Å |
| 19 | L | 95.1 | Very high | 96.2 | Very high | 36 Ų | 36 | 59.1 Ų | 59.1 | 19% | 0.188 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -64.6 | -36.1 | 176 | -67.8 | 177.4 | 0 | 0 | 0 | 112.5 | L15 N16 F17 I22 G23 L78 A82 | L15-L19 WeakPolarHBondContact O-CG 3.25Å; L15-L19 PolarHBondContact O-N 3.46Å; N16-L19 WeakPolarHBondContact O-CB 3.38Å; N16-L19 PolarHBondContact O-N 3.5Å; N16-L19 VanDerWaalsContact O-N 3.15Å; F17-L19 VanDerWaalsContact C-N 3.33Å; F17-L19 PolarHBondContact O-N 2.94Å; L19-I22 HydrophobicContact CD2-CD1 4.47Å; L19-I22 PolarHBondContact O-N 3.34Å; L19-G23 PolarHBondContact O-N 3.34Å; L19-L78 HydrophobicContact CB-CD1 4.18Å; L19-L78 HydrophobicContact CB-CG 4.38Å; L19-L78 HydrophobicContact CD1-CD1 4.47Å; L19-L78 HydrophobicContact CD2-CD1 4.28Å; L19-A82 HydrophobicContact CB-CB 3.72Å |
| 20 | V | 97.4 | Very high | 96.3 | Very high | 20 Ų | 20 | 57.1 Ų | 57.1 | 12% | 0.121 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -61 | -46.9 | 171.8 | 172.4 | 0 | 0 | 0 | 0 | 110.4 | N16 F17 L18 I22 G23 L24 A82 F83 | N16-V20 WeakPolarHBondContact O-CG2 3.2Å; N16-V20 PolarHBondContact O-N 3.5Å; F17-V20 PolarHBondContact O-N 2.99Å; L18-V20 VanDerWaalsContact C-N 3.34Å; L18-V20 PolarHBondContact O-N 3.42Å; V20-I22 PolarHBondContact O-N 3.16Å; V20-G23 PolarHBondContact O-N 3Å; V20-L24 HydrophobicContact CG1-CD1 4.06Å; V20-L24 HydrophobicContact CG1-CG 4.42Å; V20-L24 WeakPolarHBondContact O-CG 3.28Å; V20-L24 PolarHBondContact O-N 2.98Å; V20-A82 HydrophobicContact CG2-CB 3.6Å; V20-F83 HydrophobicContact CG2-CB 4.43Å |
| 21 | I | 97.9 | Very high | 96.5 | Very high | 85 Ų | 85 | 53 Ų | 53 | 44% | 0.436 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -60.7 | -45.8 | 178.1 | -66.9 | 172.1 | 0 | 0 | 0 | 110.8 | F17 L18 G23 L24 A25 | F17-I21 HydrophobicContact CD1-CD1 3.97Å; F17-I21 HydrophobicContact CE1-CD1 3.57Å; F17-I21 HydrophobicContact CE1-CG1 4.4Å; F17-I21 HydrophobicContact CZ-CD1 4.13Å; F17-I21 PolarHBondContact O-N 3.46Å; F17-I21 VanDerWaalsContact O-N 3.1Å; L18-I21 PolarHBondContact O-N 2.89Å; I21-G23 VanDerWaalsContact C-N 3.34Å; I21-G23 PolarHBondContact O-N 3.14Å; I21-L24 PolarHBondContact O-N 3.03Å; I21-A25 WeakPolarHBondContact O-CB 3.42Å; I21-A25 PolarHBondContact O-N 3.18Å |
| 22 | I | 96.9 | Very high | 96.6 | Very high | 86 Ų | 86 | 53.3 Ų | 53.3 | 44% | 0.441 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -60.8 | -45.2 | 177.1 | -68.7 | 165 | 0 | 0 | 0 | 110.4 | L18 L19 V20 L24 A25 L26 L78 | L18-I22 VanDerWaalsContact O-CG1 3.31Å; L18-I22 WeakPolarHBondContact O-CG1 2.95Å; L18-I22 PolarHBondContact O-N 2.66Å; L19-I22 HydrophobicContact CD2-CD1 4.47Å; L19-I22 PolarHBondContact O-N 3.34Å; V20-I22 PolarHBondContact O-N 3.16Å; I22-L24 PolarHBondContact O-N 3.25Å; I22-A25 WeakPolarHBondContact O-CB 3.45Å; I22-A25 PolarHBondContact O-N 3.02Å; I22-L26 HydrophobicContact CG2-CD1 4.19Å; I22-L26 HydrophobicContact CG2-CG 4.42Å; I22-L26 WeakPolarHBondContact O-CG 3.18Å; I22-L26 PolarHBondContact O-N 2.9Å; I22-L78 HydrophobicContact CB-CD2 4.4Å; I22-L78 HydrophobicContact CG2-CD2 4.03Å |
| 23 | G | 98 | Very high | 96.5 | Very high | 0 Ų | 0 | 54 Ų | 54 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -61.4 | -43 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | L19 V20 I21 L26 I27 | L19-G23 PolarHBondContact O-N 3.34Å; V20-G23 PolarHBondContact O-N 3Å; I21-G23 VanDerWaalsContact C-N 3.34Å; I21-G23 PolarHBondContact O-N 3.14Å; G23-L26 PolarHBondContact O-N 3.45Å; G23-I27 VanDerWaalsContact O-CG1 3.31Å; G23-I27 WeakPolarHBondContact O-CG1 3.5Å; G23-I27 PolarHBondContact O-N 3.05Å |
| 24 | L | 98.4 | Very high | 96.4 | Very high | 96 Ų | 96 | 52.8 Ų | 52.8 | 50% | 0.503 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -63.2 | -40.8 | 174.3 | -70.5 | 172.9 | 0 | 0 | 0 | 111.9 | V20 I21 I22 I27 A28 V79 | V20-L24 HydrophobicContact CG1-CD1 4.06Å; V20-L24 HydrophobicContact CG1-CG 4.42Å; V20-L24 WeakPolarHBondContact O-CG 3.28Å; V20-L24 PolarHBondContact O-N 2.98Å; I21-L24 PolarHBondContact O-N 3.03Å; I22-L24 PolarHBondContact O-N 3.25Å; L24-I27 PolarHBondContact O-N 3.47Å; L24-A28 WeakPolarHBondContact O-CB 3.32Å; L24-A28 PolarHBondContact O-N 3.38Å; L24-V79 HydrophobicContact CD2-CG2 4.07Å; L24-V79 HydrophobicContact CG-CG2 3.99Å |
| 25 | A | 98 | Very high | 96.3 | Very high | 52 Ų | 52 | 55.2 Ų | 55.2 | 43% | 0.43 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -63.2 | -41.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | I21 I22 A28 V29 | I21-A25 WeakPolarHBondContact O-CB 3.42Å; I21-A25 PolarHBondContact O-N 3.18Å; I22-A25 WeakPolarHBondContact O-CB 3.45Å; I22-A25 PolarHBondContact O-N 3.02Å; A25-A28 PolarHBondContact O-N 2.96Å; A25-V29 WeakPolarHBondContact O-CB 3.32Å; A25-V29 WeakPolarHBondContact O-CG2 3.28Å; A25-V29 PolarHBondContact O-N 3.32Å |
| 26 | L | 97.9 | Very high | 96.1 | Very high | 64 Ų | 64 | 57.4 Ų | 57.4 | 34% | 0.335 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -61.9 | -44.6 | 175.3 | -70.3 | 173.6 | 0 | 0 | 0 | 111.8 | I22 G23 A28 V29 G30 V71 L78 | I22-L26 HydrophobicContact CG2-CD1 4.19Å; I22-L26 HydrophobicContact CG2-CG 4.42Å; I22-L26 WeakPolarHBondContact O-CG 3.18Å; I22-L26 PolarHBondContact O-N 2.9Å; G23-L26 PolarHBondContact O-N 3.45Å; L26-A28 VanDerWaalsContact C-N 3.34Å; L26-A28 PolarHBondContact O-N 3.35Å; L26-V29 PolarHBondContact O-N 2.85Å; L26-G30 PolarHBondContact O-N 3.45Å; L26-V71 HydrophobicContact CB-CG1 4.08Å; L26-V71 HydrophobicContact CD2-CG1 4.11Å; L26-V71 WeakPolarHBondContact O-CG1 3.42Å; L26-L78 HydrophobicContact CD1-CD2 4.41Å |
| 27 | I | 98.3 | Very high | 95.7 | Very high | 45 Ų | 45 | 59.5 Ų | 59.5 | 23% | 0.231 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -61 | -45.4 | 175.7 | -65.2 | 163.5 | 0 | 0 | 0 | 110.4 | G23 L24 S31 V79 | G23-I27 VanDerWaalsContact O-CG1 3.31Å; G23-I27 WeakPolarHBondContact O-CG1 3.5Å; G23-I27 PolarHBondContact O-N 3.05Å; L24-I27 PolarHBondContact O-N 3.47Å; I27-S31 VanDerWaalsContact O-CB 3.23Å; I27-S31 WeakPolarHBondContact O-CB 3.48Å; I27-S31 PolarHBondContact O-N 3.1Å; I27-S31 PolarHBondContact O-OG 3.24Å; I27-V79 HydrophobicContact CD1-CG2 4.01Å |
| 28 | A | 97.7 | Very high | 95.1 | Very high | 61 Ų | 61 | 58.1 Ų | 58.1 | 50% | 0.504 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -61.7 | -48.8 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | L24 A25 L26 S31 W32 | L24-A28 WeakPolarHBondContact O-CB 3.32Å; L24-A28 PolarHBondContact O-N 3.38Å; A25-A28 PolarHBondContact O-N 2.96Å; L26-A28 VanDerWaalsContact C-N 3.34Å; L26-A28 PolarHBondContact O-N 3.35Å; A28-S31 PolarHBondContact O-N 3.3Å; A28-W32 PolarHBondContact O-N 3.14Å |
| 29 | V | 95.7 | Very high | 94.6 | Very high | 64 Ų | 64 | 54.1 Ų | 54.1 | 39% | 0.388 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -63.6 | -47.1 | 177.9 | 171.5 | 0 | 0 | 0 | 0 | 111.2 | A25 L26 S31 W32 V33 F40 | A25-V29 WeakPolarHBondContact O-CB 3.32Å; A25-V29 WeakPolarHBondContact O-CG2 3.28Å; A25-V29 PolarHBondContact O-N 3.32Å; L26-V29 PolarHBondContact O-N 2.85Å; V29-S31 VanDerWaalsContact C-N 3.3Å; V29-S31 PolarHBondContact O-N 3.36Å; V29-W32 WeakPolarHBondContact O-CB 3.37Å; V29-W32 PolarHBondContact O-N 3Å; V29-V33 WeakPolarHBondContact O-CG2 3.25Å; V29-V33 PolarHBondContact O-N 3.15Å; V29-F40 HydrophobicContact CG1-CE2 3.83Å; V29-F40 HydrophobicContact CG1-CZ 4.28Å |
| 30 | G | 96.1 | Very high | 94.3 | Very high | 2 Ų | 2 | 54 Ų | 54 | 2% | 0.021 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -63 | -36.9 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | L26 T34 | L26-G30 PolarHBondContact O-N 3.45Å; G30-T34 WeakPolarHBondContact O-CB 3.39Å; G30-T34 PolarHBondContact O-N 3.43Å; G30-T34 PolarHBondContact O-OG1 2.93Å |
| 31 | S | 96.7 | Very high | 93.6 | Very high | 52 Ų | 52 | 53 Ų | 53 | 36% | 0.364 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -67.2 | -40.6 | 175 | -58.3 | 0 | 0 | 0 | 0 | 111.5 | I27 A28 V29 T34 A35 | I27-S31 VanDerWaalsContact O-CB 3.23Å; I27-S31 WeakPolarHBondContact O-CB 3.48Å; I27-S31 PolarHBondContact O-N 3.1Å; I27-S31 PolarHBondContact O-OG 3.24Å; A28-S31 PolarHBondContact O-N 3.3Å; V29-S31 VanDerWaalsContact C-N 3.3Å; V29-S31 PolarHBondContact O-N 3.36Å; S31-T34 PolarHBondContact O-N 3.05Å; S31-A35 WeakPolarHBondContact O-CB 3.39Å; S31-A35 PolarHBondContact O-N 2.94Å |
| 32 | W | 95.5 | Very high | 92.8 | Very high | 111 Ų | 111 | 52.4 Ų | 52.4 | 42% | 0.42 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -59.8 | -53.5 | 174.1 | -173.3 | -3.1 | 0 | 0 | 0 | 111 | A28 V29 T34 A35 D36 T43 | A28-W32 PolarHBondContact O-N 3.14Å; V29-W32 WeakPolarHBondContact O-CB 3.37Å; V29-W32 PolarHBondContact O-N 3Å; W32-T34 PolarHBondContact O-N 3.12Å; W32-T34 VanDerWaalsContact O-N 3.14Å; W32-A35 PolarHBondContact O-N 3.45Å; W32-D36 CarbonylContact O-C 3.15Å; W32-D36 PolarHBondContact O-N 2.84Å; W32-T43 HydrophobicContact CH2-CG2 3.94Å |
| 33 | V | 92.9 | Very high | 92.3 | Very high | 14 Ų | 14 | 50.4 Ų | 50.4 | 9% | 0.085 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -56.2 | -36 | 178 | 177.7 | 0 | 0 | 0 | 0 | 111.9 | V29 D37 F40 L64 | V29-V33 WeakPolarHBondContact O-CG2 3.25Å; V29-V33 PolarHBondContact O-N 3.15Å; V33-D37 WeakPolarHBondContact O-CA 3.48Å; V33-D37 WeakPolarHBondContact O-CB 3.29Å; V33-D37 PolarHBondContact O-N 3.09Å; V33-F40 HydrophobicContact CG2-CB 4.16Å; V33-F40 HydrophobicContact CG2-CD1 3.59Å; V33-F40 HydrophobicContact CG2-CD2 3.76Å; V33-F40 HydrophobicContact CG2-CE1 3.78Å; V33-F40 HydrophobicContact CG2-CE2 3.96Å; V33-F40 HydrophobicContact CG2-CG 3.55Å; V33-F40 HydrophobicContact CG2-CZ 3.94Å; V33-L64 HydrophobicContact CG1-CD1 4.06Å; V33-L64 HydrophobicContact CG1-CD2 4.27Å; V33-L64 HydrophobicContact CG1-CG 3.88Å |
| 34 | T | 93.2 | Very high | 91.7 | Very high | 47 Ų | 47 | 53 Ų | 53 | 29% | 0.288 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -71.2 | -37.4 | 179.2 | -57.7 | 0 | 0 | 0 | 0 | 112.6 | G30 S31 W32 S68 Y69 | G30-T34 WeakPolarHBondContact O-CB 3.39Å; G30-T34 PolarHBondContact O-N 3.43Å; G30-T34 PolarHBondContact O-OG1 2.93Å; S31-T34 PolarHBondContact O-N 3.05Å; W32-T34 PolarHBondContact O-N 3.12Å; W32-T34 VanDerWaalsContact O-N 3.14Å; T34-S68 WeakPolarHBondContact OG1-CB 3.46Å; T34-S68 PolarHBondContact OG1-OG 3.12Å; T34-Y69 HydrophobicContact CG2-CD1 4.3Å; T34-Y69 HydrophobicContact CG2-CE1 3.49Å; T34-Y69 VanDerWaalsContact CG2-CE1 3.49Å |
| 35 | A | 93.7 | Very high | 90.7 | Very high | 90 Ų | 90 | 51.6 Ų | 51.6 | 74% | 0.744 | 30% | 0.302 | S | S | * | . | H | α-helix | trans | -83.3 | -37.4 | -176.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | S31 W32 | S31-A35 WeakPolarHBondContact O-CB 3.39Å; S31-A35 PolarHBondContact O-N 2.94Å; W32-A35 PolarHBondContact O-N 3.45Å |
| 36 | D | 91.3 | Very high | 89.9 | Confident | 76 Ų | 76 | 55.8 Ų | 55.8 | 41% | 0.406 | 32% | 0.317 | S | S | . | . | trans | -151.2 | 82.8 | -175.6 | -180 | 18.4 | 0 | 0 | 0 | 109.6 | W32 G39 F40 | W32-D36 CarbonylContact O-C 3.15Å; W32-D36 PolarHBondContact O-N 2.84Å; D36-G39 PolarHBondContact OD1-N 3.37Å; D36-G39 WeakPolarHBondContact OD2-CA 3.37Å; D36-F40 PolarHBondContact O-N 2.93Å | ||
| 37 | D | 86.2 | Confident | 89.2 | Confident | 45 Ų | 45 | 60.8 Ų | 60.8 | 24% | 0.241 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -65.5 | -42.9 | 178.8 | 65.4 | -24.6 | 0 | 0 | 0 | 111.1 | V33 G39 F40 I41 G60 L64 | V33-D37 WeakPolarHBondContact O-CA 3.48Å; V33-D37 WeakPolarHBondContact O-CB 3.29Å; V33-D37 PolarHBondContact O-N 3.09Å; D37-G39 PolarHBondContact O-N 3.48Å; D37-F40 WeakPolarHBondContact O-CB 3.34Å; D37-F40 PolarHBondContact O-N 3.32Å; D37-I41 VanDerWaalsContact O-CG1 3.31Å; D37-I41 WeakPolarHBondContact O-CG1 3.27Å; D37-I41 PolarHBondContact O-N 3.48Å; D37-G60 WeakPolarHBondContact OD2-CA 3.39Å; D37-G60 PolarHBondContact OD2-N 3.3Å; D37-L64 HydrophobicContact CB-CD2 3.92Å |
| 38 | Q | 83.6 | Confident | 87.8 | Confident | 77 Ų | 77 | 60.6 Ų | 60.6 | 36% | 0.36 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -53.9 | -54.1 | 175.1 | 177.4 | 71.9 | 68.6 | 0 | 0 | 111.8 | F40 I41 D42 | Q38-F40 VanDerWaalsContact C-N 3.26Å; Q38-F40 PolarHBondContact O-N 2.93Å; Q38-I41 PolarHBondContact O-N 3.31Å; Q38-I41 VanDerWaalsContact O-N 3.12Å; Q38-D42 PolarHBondContact NE2-OD1 3.38Å; Q38-D42 PolarHBondContact NE2-OD2 2.88Å; Q38-D42 PolarHBondContact O-N 2.91Å |
| 39 | G | 86.8 | Confident | 86 | Confident | 14 Ų | 14 | 64.3 Ų | 64.3 | 14% | 0.144 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -62 | -33.8 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | D36 D37 T43 | D36-G39 PolarHBondContact OD1-N 3.37Å; D36-G39 WeakPolarHBondContact OD2-CA 3.37Å; D37-G39 PolarHBondContact O-N 3.48Å; G39-T43 WeakPolarHBondContact O-CB 3.47Å; G39-T43 PolarHBondContact O-N 3.22Å; G39-T43 PolarHBondContact O-OG1 2.96Å |
| 40 | F | 87.4 | Confident | 84 | Confident | 32 Ų | 32 | 67 Ų | 67 | 14% | 0.14 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -65.1 | -47.8 | 172.5 | 175.5 | -99.3 | 0 | 0 | 0 | 112.2 | V29 V33 D36 D37 Q38 D42 T43 I44 L55 | V29-F40 HydrophobicContact CG1-CE2 3.83Å; V29-F40 HydrophobicContact CG1-CZ 4.28Å; V33-F40 HydrophobicContact CG2-CB 4.16Å; V33-F40 HydrophobicContact CG2-CD1 3.59Å; V33-F40 HydrophobicContact CG2-CD2 3.76Å; V33-F40 HydrophobicContact CG2-CE1 3.78Å; V33-F40 HydrophobicContact CG2-CE2 3.96Å; V33-F40 HydrophobicContact CG2-CG 3.55Å; V33-F40 HydrophobicContact CG2-CZ 3.94Å; D36-F40 PolarHBondContact O-N 2.93Å; D37-F40 WeakPolarHBondContact O-CB 3.34Å; D37-F40 PolarHBondContact O-N 3.32Å; Q38-F40 VanDerWaalsContact C-N 3.26Å; Q38-F40 PolarHBondContact O-N 2.93Å; F40-D42 VanDerWaalsContact C-N 3.35Å; F40-D42 PolarHBondContact O-N 2.7Å; F40-T43 PolarHBondContact O-N 3.37Å; F40-I44 HydrophobicContact CD1-CD1 4.41Å; F40-I44 HydrophobicContact CE1-CD1 3.58Å; F40-I44 HydrophobicContact CE1-CG1 4.31Å; F40-I44 HydrophobicContact CE2-CD1 3.87Å; F40-I44 HydrophobicContact CE2-CG1 4.25Å; F40-I44 HydrophobicContact CZ-CD1 3.27Å; F40-I44 HydrophobicContact CZ-CG1 4.08Å; F40-I44 PolarHBondContact O-N 3.42Å; F40-L55 HydrophobicContact CE1-CD2 4.13Å |
| 41 | I | 82.3 | Confident | 81.9 | Confident | 0 Ų | 0 | 70.5 Ų | 70.5 | 0% | 0 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -56.3 | -52.4 | 177.4 | -60.9 | -56 | 0 | 0 | 0 | 109.8 | D37 Q38 T43 I44 Q45 L55 Q56 Q59 | D37-I41 VanDerWaalsContact O-CG1 3.31Å; D37-I41 WeakPolarHBondContact O-CG1 3.27Å; D37-I41 PolarHBondContact O-N 3.48Å; Q38-I41 PolarHBondContact O-N 3.31Å; Q38-I41 VanDerWaalsContact O-N 3.12Å; I41-T43 VanDerWaalsContact C-N 3.3Å; I41-T43 PolarHBondContact O-N 3.31Å; I41-I44 PolarHBondContact O-N 3.32Å; I41-I44 VanDerWaalsContact O-N 3.13Å; I41-Q45 HydrophobicContact CG2-CG 4.33Å; I41-Q45 WeakPolarHBondContact O-CG 3.35Å; I41-Q45 PolarHBondContact O-N 2.96Å; I41-Q45 VanDerWaalsContact O-N 3.09Å; I41-L55 HydrophobicContact CD1-CB 3.97Å; I41-L55 HydrophobicContact CD1-CD1 4.46Å; I41-L55 HydrophobicContact CD1-CD2 3.23Å; I41-L55 HydrophobicContact CD1-CG 3.25Å; I41-Q56 HydrophobicContact CG2-CG 3.8Å; I41-Q59 HydrophobicContact CG1-CB 4.43Å; I41-Q59 HydrophobicContact CG1-CG 4.07Å |
| 42 | D | 82.9 | Confident | 79.9 | Confident | 72 Ų | 72 | 68.3 Ų | 68.3 | 39% | 0.385 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -59.3 | -41.7 | -176.8 | -68 | -18.6 | 0 | 0 | 0 | 111.8 | Q38 F40 Q45 L46 | Q38-D42 PolarHBondContact NE2-OD1 3.38Å; Q38-D42 PolarHBondContact NE2-OD2 2.88Å; Q38-D42 PolarHBondContact O-N 2.91Å; F40-D42 VanDerWaalsContact C-N 3.35Å; F40-D42 PolarHBondContact O-N 2.7Å; D42-Q45 PolarHBondContact O-N 3.44Å; D42-L46 PolarHBondContact O-N 3.22Å; D42-L46 VanDerWaalsContact O-N 3.14Å |
| 43 | T | 86.3 | Confident | 77.9 | Confident | 44 Ų | 44 | 63.4 Ų | 63.4 | 27% | 0.27 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -61.9 | -46.1 | 176 | -59.9 | 0 | 0 | 0 | 0 | 111.4 | W32 G39 F40 I41 Q45 L46 F47 | W32-T43 HydrophobicContact CH2-CG2 3.94Å; G39-T43 WeakPolarHBondContact O-CB 3.47Å; G39-T43 PolarHBondContact O-N 3.22Å; G39-T43 PolarHBondContact O-OG1 2.96Å; F40-T43 PolarHBondContact O-N 3.37Å; I41-T43 VanDerWaalsContact C-N 3.3Å; I41-T43 PolarHBondContact O-N 3.31Å; T43-Q45 PolarHBondContact O-N 2.97Å; T43-L46 WeakPolarHBondContact O-CB 3.31Å; T43-L46 PolarHBondContact O-N 3.1Å; T43-L46 VanDerWaalsContact O-N 3.12Å; T43-F47 HydrophobicContact CG2-CD2 3.69Å; T43-F47 HydrophobicContact CG2-CE2 3.81Å; T43-F47 VanDerWaalsContact O-CD2 3.31Å; T43-F47 WeakPolarHBondContact O-CD2 3.49Å; T43-F47 PolarHBondContact O-N 3.44Å; T43-F47 VanDerWaalsContact O-N 3.13Å |
| 44 | I | 84.6 | Confident | 76.5 | Confident | 56 Ų | 56 | 66.5 Ų | 66.5 | 29% | 0.287 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -61 | -36.5 | 177.3 | -73.7 | -161.4 | 0 | 0 | 0 | 111.4 | F40 I41 L46 F47 S48 L55 | F40-I44 HydrophobicContact CD1-CD1 4.41Å; F40-I44 HydrophobicContact CE1-CD1 3.58Å; F40-I44 HydrophobicContact CE1-CG1 4.31Å; F40-I44 HydrophobicContact CE2-CD1 3.87Å; F40-I44 HydrophobicContact CE2-CG1 4.25Å; F40-I44 HydrophobicContact CZ-CD1 3.27Å; F40-I44 HydrophobicContact CZ-CG1 4.08Å; F40-I44 PolarHBondContact O-N 3.42Å; I41-I44 PolarHBondContact O-N 3.32Å; I41-I44 VanDerWaalsContact O-N 3.13Å; I44-L46 VanDerWaalsContact C-N 3.27Å; I44-L46 PolarHBondContact O-N 3.48Å; I44-F47 PolarHBondContact O-N 3.28Å; I44-S48 WeakPolarHBondContact CG2-OG 3.46Å; I44-S48 WeakPolarHBondContact O-CB 3.49Å; I44-S48 PolarHBondContact O-N 2.91Å; I44-S48 PolarHBondContact O-OG 2.93Å; I44-L55 HydrophobicContact CD1-CD2 4.28Å; I44-L55 HydrophobicContact CG2-CD2 4.5Å |
| 45 | Q | 76.9 | Confident | 75.1 | Confident | 66 Ų | 66 | 66.8 Ų | 66.8 | 31% | 0.308 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -66.1 | -32.9 | 177.6 | -36.5 | -158.6 | -27.1 | 0 | 0 | 112.3 | I41 D42 T43 S52 | I41-Q45 HydrophobicContact CG2-CG 4.33Å; I41-Q45 WeakPolarHBondContact O-CG 3.35Å; I41-Q45 PolarHBondContact O-N 2.96Å; I41-Q45 VanDerWaalsContact O-N 3.09Å; D42-Q45 PolarHBondContact O-N 3.44Å; T43-Q45 PolarHBondContact O-N 2.97Å; Q45-S52 VanDerWaalsContact CG-OG 3.24Å; Q45-S52 WeakPolarHBondContact CG-OG 3.31Å; Q45-S52 PolarHBondContact NE2-OG 3.35Å |
| 46 | L | 82.4 | Confident | 73.7 | Confident | 139 Ų | 139 | 64.1 Ų | 64.1 | 73% | 0.728 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -70.9 | -42.6 | 178.6 | -173.1 | 69.1 | 0 | 0 | 0 | 111.9 | D42 T43 I44 | D42-L46 PolarHBondContact O-N 3.22Å; D42-L46 VanDerWaalsContact O-N 3.14Å; T43-L46 WeakPolarHBondContact O-CB 3.31Å; T43-L46 PolarHBondContact O-N 3.1Å; T43-L46 VanDerWaalsContact O-N 3.12Å; I44-L46 VanDerWaalsContact C-N 3.27Å; I44-L46 PolarHBondContact O-N 3.48Å |
| 47 | F | 82.7 | Confident | 72.3 | Confident | 170 Ų | 170 | 61.5 Ų | 61.5 | 75% | 0.746 | 32% | 0.321 | S | S | * | . | H | α-helix | trans | -91.5 | -21.4 | -173.5 | -74.3 | -74.8 | 0 | 0 | 0 | 114.4 | T43 I44 | T43-F47 HydrophobicContact CG2-CD2 3.69Å; T43-F47 HydrophobicContact CG2-CE2 3.81Å; T43-F47 VanDerWaalsContact O-CD2 3.31Å; T43-F47 WeakPolarHBondContact O-CD2 3.49Å; T43-F47 PolarHBondContact O-N 3.44Å; T43-F47 VanDerWaalsContact O-N 3.13Å; I44-F47 PolarHBondContact O-N 3.28Å |
| 48 | S | 69.4 | Low | 71.3 | Confident | 40 Ų | 40 | 63.9 Ų | 63.9 | 28% | 0.28 | 33% | 0.327 | S | S | . | . | trans | -113.5 | 130.6 | 179.4 | 75 | 0 | 0 | 0 | 0 | 110.3 | I44 Y50 | I44-S48 WeakPolarHBondContact CG2-OG 3.46Å; I44-S48 WeakPolarHBondContact O-CB 3.49Å; I44-S48 PolarHBondContact O-N 2.91Å; I44-S48 PolarHBondContact O-OG 2.93Å; S48-Y50 PolarHBondContact O-N 3.49Å; S48-Y50 VanDerWaalsContact OG-CB 3.31Å; S48-Y50 WeakPolarHBondContact OG-CB 3.46Å | ||
| 49 | S | 59.5 | Low | 70.6 | Confident | 140 Ų | 140 | 62.4 Ų | 62.4 | 98% | 0.979 | 32% | 0.32 | S | S | * | . | trans | -72.4 | 31.3 | 165.1 | -169.1 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 50 | Y | 53.8 | Low | 69.5 | Low | 120 Ų | 120 | 64.6 Ų | 64.6 | 47% | 0.471 | 34% | 0.342 | S | S | . | . | S | Bend | trans | -87.7 | 135.1 | 179.1 | -155.3 | -95.9 | 0 | 0 | 0 | 108.2 | S48 S52 R257 | S48-Y50 PolarHBondContact O-N 3.49Å; S48-Y50 VanDerWaalsContact OG-CB 3.31Å; S48-Y50 WeakPolarHBondContact OG-CB 3.46Å; Y50-S52 PolarHBondContact O-N 2.9Å; Y50-R257 PolarHBondContact OH-NH1 3.15Å |
| 51 | N | 52.4 | Low | 68.6 | Low | 76 Ų | 76 | 64.2 Ų | 64.2 | 41% | 0.406 | 34% | 0.343 | S | S | . | . | trans | -68.3 | 86.9 | 168.6 | -92.8 | -2.9 | 0 | 0 | 0 | 108.2 | I53 R217 | N51-I53 PolarHBondContact O-N 3.02Å; N51-R217 PolarHBondContact OD1-NH1 3.01Å; N51-R217 VanDerWaalsContact OD1-NH1 3.13Å | ||
| 52 | S | 54.8 | Low | 68.5 | Low | 6 Ų | 6 | 67.7 Ų | 67.7 | 4% | 0.042 | 37% | 0.367 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -66.8 | 6.5 | -179.7 | 50.4 | 0 | 0 | 0 | 0 | 114.4 | Q45 Y50 E54 L55 Q56 | Q45-S52 VanDerWaalsContact CG-OG 3.24Å; Q45-S52 WeakPolarHBondContact CG-OG 3.31Å; Q45-S52 PolarHBondContact NE2-OG 3.35Å; Y50-S52 PolarHBondContact O-N 2.9Å; S52-E54 PolarHBondContact O-N 3.46Å; S52-L55 WeakPolarHBondContact O-CA 3.46Å; S52-L55 WeakPolarHBondContact O-CB 3.36Å; S52-L55 PolarHBondContact O-N 3.32Å; S52-Q56 PolarHBondContact O-N 3.43Å |
| 53 | I | 53.5 | Low | 68.3 | Low | 7 Ų | 7 | 67.8 Ų | 67.8 | 4% | 0.036 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -56.2 | -39.9 | 176.2 | -54.6 | 172.5 | 0 | 0 | 0 | 110.2 | N51 L55 Q56 L57 R217 | N51-I53 PolarHBondContact O-N 3.02Å; I53-L55 VanDerWaalsContact C-N 3.28Å; I53-L55 PolarHBondContact O-N 3.26Å; I53-Q56 PolarHBondContact O-N 3.32Å; I53-L57 PolarHBondContact O-N 2.86Å; I53-R217 HydrophobicContact CD1-CG 3.31Å; I53-R217 HydrophobicContact CG1-CG 3.68Å |
| 54 | E | 61.8 | Low | 68.2 | Low | 80 Ų | 80 | 66.6 Ų | 66.6 | 37% | 0.374 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -59.9 | -39.5 | 175.5 | -67.8 | -176 | 164.2 | 0 | 0 | 111.4 | S52 L57 Y58 | S52-E54 PolarHBondContact O-N 3.46Å; E54-L57 WeakPolarHBondContact O-CB 3.36Å; E54-L57 PolarHBondContact O-N 2.87Å; E54-Y58 WeakPolarHBondContact O-CD2 3.5Å; E54-Y58 WeakPolarHBondContact O-CE2 3.3Å |
| 55 | L | 64.5 | Low | 68.3 | Low | 52 Ų | 52 | 70.6 Ų | 70.6 | 27% | 0.272 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -76.3 | -36.4 | -179.6 | -155.1 | 72.4 | 0 | 0 | 0 | 111.8 | F40 I41 I44 S52 I53 L57 Y58 Q59 | F40-L55 HydrophobicContact CE1-CD2 4.13Å; I41-L55 HydrophobicContact CD1-CB 3.97Å; I41-L55 HydrophobicContact CD1-CD1 4.46Å; I41-L55 HydrophobicContact CD1-CD2 3.23Å; I41-L55 HydrophobicContact CD1-CG 3.25Å; I44-L55 HydrophobicContact CD1-CD2 4.28Å; I44-L55 HydrophobicContact CG2-CD2 4.5Å; S52-L55 WeakPolarHBondContact O-CA 3.46Å; S52-L55 WeakPolarHBondContact O-CB 3.36Å; S52-L55 PolarHBondContact O-N 3.32Å; I53-L55 VanDerWaalsContact C-N 3.28Å; I53-L55 PolarHBondContact O-N 3.26Å; L55-L57 PolarHBondContact O-N 2.84Å; L55-Y58 PolarHBondContact O-N 3.44Å; L55-Q59 PolarHBondContact O-N 3.29Å |
| 56 | Q | 64.5 | Low | 68.9 | Low | 35 Ų | 35 | 74.8 Ų | 74.8 | 16% | 0.164 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -59.7 | -27.2 | 170.4 | -73.8 | -179.7 | -23.1 | 0 | 0 | 112.2 | I41 S52 I53 Y58 Q59 | I41-Q56 HydrophobicContact CG2-CG 3.8Å; S52-Q56 PolarHBondContact O-N 3.43Å; I53-Q56 PolarHBondContact O-N 3.32Å; Q56-Y58 PolarHBondContact O-N 3.4Å; Q56-Q59 WeakPolarHBondContact O-CB 3.46Å; Q56-Q59 PolarHBondContact O-N 3.43Å |
| 57 | L | 61.6 | Low | 69.2 | Low | 20 Ų | 20 | 74.1 Ų | 74.1 | 11% | 0.105 | 38% | 0.376 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -63.2 | -28.4 | 173.7 | -155.9 | 73.1 | 0 | 0 | 0 | 112.8 | I53 E54 L55 K159 K162 L163 | I53-L57 PolarHBondContact O-N 2.86Å; E54-L57 WeakPolarHBondContact O-CB 3.36Å; E54-L57 PolarHBondContact O-N 2.87Å; L55-L57 PolarHBondContact O-N 2.84Å; L57-K159 HydrophobicContact CD1-CB 3.9Å; L57-K159 HydrophobicContact CD1-CG 3.95Å; L57-K159 WeakPolarHBondContact CD1-O 3.43Å; L57-K159 HydrophobicContact CG-CB 4.07Å; L57-K159 HydrophobicContact CG-CG 4.05Å; L57-K159 WeakPolarHBondContact O-CD 3.21Å; L57-K159 WeakPolarHBondContact O-CE 3.43Å; L57-K159 WeakPolarHBondContact O-CG 3.43Å; L57-K162 HydrophobicContact CD1-CB 3.3Å; L57-K162 HydrophobicContact CD1-CD 3.63Å; L57-K162 HydrophobicContact CD1-CG 4.09Å; L57-L163 HydrophobicContact CD2-CB 4.4Å; L57-L163 HydrophobicContact CD2-CD1 4.33Å |
| 58 | Y | 66.3 | Low | 69.8 | Low | 96 Ų | 96 | 66.3 Ų | 66.3 | 38% | 0.376 | 34% | 0.342 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -96 | -8.7 | -179.1 | -61.8 | -68 | 0 | 0 | 0 | 112.5 | E54 L55 Q56 G60 T61 L63 L64 | E54-Y58 WeakPolarHBondContact O-CD2 3.5Å; E54-Y58 WeakPolarHBondContact O-CE2 3.3Å; L55-Y58 PolarHBondContact O-N 3.44Å; Q56-Y58 PolarHBondContact O-N 3.4Å; Y58-G60 PolarHBondContact O-N 2.85Å; Y58-T61 WeakPolarHBondContact O-CB 3.22Å; Y58-T61 WeakPolarHBondContact O-CG2 3.33Å; Y58-T61 PolarHBondContact O-N 3Å; Y58-T61 PolarHBondContact O-OG1 2.91Å; Y58-L63 HydrophobicContact CD1-CD2 3.76Å; Y58-L63 HydrophobicContact CE1-CD2 3.65Å; Y58-L64 VanDerWaalsContact O-CB 3.3Å; Y58-L64 WeakPolarHBondContact O-CB 3.17Å |
| 59 | Q | 67.7 | Low | 71 | Confident | 46 Ų | 46 | 68.7 Ų | 68.7 | 22% | 0.215 | 35% | 0.346 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -58.8 | 138.5 | 178.2 | -158.6 | -161.8 | -30.5 | 0 | 0 | 111.3 | I41 L55 Q56 T61 K159 | I41-Q59 HydrophobicContact CG1-CB 4.43Å; I41-Q59 HydrophobicContact CG1-CG 4.07Å; L55-Q59 PolarHBondContact O-N 3.29Å; Q56-Q59 WeakPolarHBondContact O-CB 3.46Å; Q56-Q59 PolarHBondContact O-N 3.43Å; Q59-T61 PolarHBondContact O-N 3.04Å; Q59-T61 VanDerWaalsContact O-N 3.08Å; Q59-K159 PolarHBondContact O-NZ 3.39Å |
| 60 | G | 64 | Low | 72.8 | Confident | 59 Ų | 59 | 64.3 Ų | 64.3 | 61% | 0.608 | 32% | 0.318 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 67.2 | 2.1 | -176.3 | 0 | 0 | 0 | 0 | 0 | 114.7 | D37 Y58 | D37-G60 WeakPolarHBondContact OD2-CA 3.39Å; D37-G60 PolarHBondContact OD2-N 3.3Å; Y58-G60 PolarHBondContact O-N 2.85Å |
| 61 | T | 69.4 | Low | 74.8 | Confident | 24 Ų | 24 | 61 Ų | 61 | 15% | 0.147 | 31% | 0.31 | C | S | . | . | trans | -82.6 | 146.4 | 177.7 | 62.9 | 0 | 0 | 0 | 0 | 112.1 | Y58 Q59 L63 L64 R65 K159 | Y58-T61 WeakPolarHBondContact O-CB 3.22Å; Y58-T61 WeakPolarHBondContact O-CG2 3.33Å; Y58-T61 PolarHBondContact O-N 3Å; Y58-T61 PolarHBondContact O-OG1 2.91Å; Q59-T61 PolarHBondContact O-N 3.04Å; Q59-T61 VanDerWaalsContact O-N 3.08Å; T61-L63 PolarHBondContact O-N 3.19Å; T61-L63 PolarHBondContact OG1-N 3.32Å; T61-L64 PolarHBondContact O-N 2.87Å; T61-L64 PolarHBondContact OG1-N 2.84Å; T61-R65 PolarHBondContact O-N 2.9Å; T61-K159 HydrophobicContact CG2-CD 3.94Å | ||
| 62 | S | 79.5 | Confident | 77 | Confident | 73 Ų | 73 | 59.4 Ų | 59.4 | 51% | 0.51 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -54.1 | -30.1 | 161.6 | 52.7 | 0 | 0 | 0 | 0 | 112.3 | R65 Y66 | S62-R65 PolarHBondContact O-N 2.91Å; S62-Y66 WeakPolarHBondContact O-CD2 3.36Å; S62-Y66 PolarHBondContact O-N 2.86Å |
| 63 | L | 78 | Confident | 79 | Confident | 74 Ų | 74 | 64.3 Ų | 64.3 | 39% | 0.387 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -64.3 | -49.9 | 178.5 | -174.3 | 64.2 | 0 | 0 | 0 | 112.5 | Y58 T61 R65 Y66 F67 | Y58-L63 HydrophobicContact CD1-CD2 3.76Å; Y58-L63 HydrophobicContact CE1-CD2 3.65Å; T61-L63 PolarHBondContact O-N 3.19Å; T61-L63 PolarHBondContact OG1-N 3.32Å; L63-R65 PolarHBondContact O-N 3.45Å; L63-Y66 PolarHBondContact O-N 2.64Å; L63-Y66 VanDerWaalsContact O-N 3.16Å; L63-F67 HydrophobicContact CD1-CD2 3.95Å; L63-F67 HydrophobicContact CD1-CE2 3.5Å; L63-F67 HydrophobicContact CD1-CZ 4.35Å; L63-F67 HydrophobicContact CD2-CE2 4.05Å; L63-F67 HydrophobicContact CG-CD2 3.79Å; L63-F67 HydrophobicContact CG-CE2 3.55Å; L63-F67 WeakPolarHBondContact O-CD2 3.42Å; L63-F67 PolarHBondContact O-N 3.43Å |
| 64 | L | 84.4 | Confident | 81 | Confident | 19 Ų | 19 | 69.5 Ų | 69.5 | 10% | 0.099 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -59.4 | -38.7 | 176.8 | -176 | 61.1 | 0 | 0 | 0 | 111 | V33 D37 Y58 T61 F67 S68 | V33-L64 HydrophobicContact CG1-CD1 4.06Å; V33-L64 HydrophobicContact CG1-CD2 4.27Å; V33-L64 HydrophobicContact CG1-CG 3.88Å; D37-L64 HydrophobicContact CB-CD2 3.92Å; Y58-L64 VanDerWaalsContact O-CB 3.3Å; Y58-L64 WeakPolarHBondContact O-CB 3.17Å; T61-L64 PolarHBondContact O-N 2.87Å; T61-L64 PolarHBondContact OG1-N 2.84Å; L64-F67 PolarHBondContact O-N 3.4Å; L64-S68 PolarHBondContact O-N 3.26Å |
| 65 | R | 86.6 | Confident | 82.7 | Confident | 140 Ų | 140 | 65.7 Ų | 65.7 | 53% | 0.528 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -68.5 | -36.9 | 176.6 | -150.1 | 171.4 | 86.1 | 178.9 | 6.6 | 113.2 | T61 S62 L63 S68 Y69 | T61-R65 PolarHBondContact O-N 2.9Å; S62-R65 PolarHBondContact O-N 2.91Å; L63-R65 PolarHBondContact O-N 3.45Å; R65-S68 WeakPolarHBondContact CA-OG 3.44Å; R65-S68 PolarHBondContact O-N 2.88Å; R65-S68 PolarHBondContact O-OG 2.87Å; R65-Y69 HydrophobicContact CG-CE1 4.46Å; R65-Y69 HydrophobicContact CG-CE2 3.93Å; R65-Y69 PolarHBondContact NE-OH 3.36Å; R65-Y69 WeakPolarHBondContact O-CD2 3.39Å; R65-Y69 VanDerWaalsContact O-CG 3.26Å; R65-Y69 PolarHBondContact O-N 3.42Å |
| 66 | Y | 89.9 | Confident | 84.3 | Confident | 154 Ų | 154 | 64.4 Ų | 64.4 | 60% | 0.604 | 33% | 0.333 | S | S | * | . | H | α-helix | trans | -67.1 | -39.7 | 172.9 | -66 | -43.4 | 0 | 0 | 0 | 111.7 | S62 L63 Y69 A70 | S62-Y66 WeakPolarHBondContact O-CD2 3.36Å; S62-Y66 PolarHBondContact O-N 2.86Å; L63-Y66 PolarHBondContact O-N 2.64Å; L63-Y66 VanDerWaalsContact O-N 3.16Å; Y66-Y69 HydrophobicContact CD1-CD2 4.43Å; Y66-Y69 PolarHBondContact O-N 2.96Å; Y66-A70 WeakPolarHBondContact O-CB 3.33Å; Y66-A70 PolarHBondContact O-N 2.99Å |
| 67 | F | 89.6 | Confident | 85.8 | Confident | 126 Ų | 126 | 67 Ų | 67 | 55% | 0.553 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -62.4 | -42.9 | 173 | -81.9 | -65 | 0 | 0 | 0 | 111.8 | L63 L64 Y69 A70 V71 | L63-F67 HydrophobicContact CD1-CD2 3.95Å; L63-F67 HydrophobicContact CD1-CE2 3.5Å; L63-F67 HydrophobicContact CD1-CZ 4.35Å; L63-F67 HydrophobicContact CD2-CE2 4.05Å; L63-F67 HydrophobicContact CG-CD2 3.79Å; L63-F67 HydrophobicContact CG-CE2 3.55Å; L63-F67 WeakPolarHBondContact O-CD2 3.42Å; L63-F67 PolarHBondContact O-N 3.43Å; L64-F67 PolarHBondContact O-N 3.4Å; F67-Y69 PolarHBondContact O-N 3.43Å; F67-A70 PolarHBondContact O-N 2.97Å; F67-V71 WeakPolarHBondContact O-CG2 3.47Å; F67-V71 PolarHBondContact O-N 3.35Å |
| 68 | S | 94.1 | Very high | 87.5 | Confident | 5 Ų | 5 | 68.1 Ų | 68.1 | 4% | 0.035 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -62.6 | -42.9 | 177.9 | 73.4 | 0 | 0 | 0 | 0 | 111.8 | T34 L64 R65 A70 V71 I72 | T34-S68 WeakPolarHBondContact OG1-CB 3.46Å; T34-S68 PolarHBondContact OG1-OG 3.12Å; L64-S68 PolarHBondContact O-N 3.26Å; R65-S68 WeakPolarHBondContact CA-OG 3.44Å; R65-S68 PolarHBondContact O-N 2.88Å; R65-S68 PolarHBondContact O-OG 2.87Å; S68-A70 PolarHBondContact O-N 3.23Å; S68-V71 PolarHBondContact O-N 3.4Å; S68-I72 VanDerWaalsContact O-CG1 3.3Å; S68-I72 WeakPolarHBondContact O-CG1 3.24Å; S68-I72 PolarHBondContact O-N 3.41Å |
| 69 | Y | 96 | Very high | 89 | Confident | 91 Ų | 91 | 65 Ų | 65 | 36% | 0.357 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -61.6 | -42.7 | 173.4 | -64.3 | -32.6 | 0 | 0 | 0 | 112.8 | T34 R65 Y66 F67 V71 I72 I73 | T34-Y69 HydrophobicContact CG2-CD1 4.3Å; T34-Y69 HydrophobicContact CG2-CE1 3.49Å; T34-Y69 VanDerWaalsContact CG2-CE1 3.49Å; R65-Y69 HydrophobicContact CG-CE1 4.46Å; R65-Y69 HydrophobicContact CG-CE2 3.93Å; R65-Y69 PolarHBondContact NE-OH 3.36Å; R65-Y69 WeakPolarHBondContact O-CD2 3.39Å; R65-Y69 VanDerWaalsContact O-CG 3.26Å; R65-Y69 PolarHBondContact O-N 3.42Å; Y66-Y69 HydrophobicContact CD1-CD2 4.43Å; Y66-Y69 PolarHBondContact O-N 2.96Å; F67-Y69 PolarHBondContact O-N 3.43Å; Y69-V71 VanDerWaalsContact C-N 3.33Å; Y69-V71 PolarHBondContact O-N 2.97Å; Y69-I72 HydrophobicContact CD1-CD1 4.44Å; Y69-I72 PolarHBondContact O-N 3.17Å; Y69-I73 VanDerWaalsContact O-CG1 3.31Å; Y69-I73 WeakPolarHBondContact O-CG1 3.46Å; Y69-I73 PolarHBondContact O-N 2.93Å |
| 70 | A | 96.1 | Very high | 90.3 | Very high | 47 Ų | 47 | 67 Ų | 67 | 39% | 0.388 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -61.1 | -42.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | Y66 F67 S68 I73 M74 | Y66-A70 WeakPolarHBondContact O-CB 3.33Å; Y66-A70 PolarHBondContact O-N 2.99Å; F67-A70 PolarHBondContact O-N 2.97Å; S68-A70 PolarHBondContact O-N 3.23Å; A70-I73 PolarHBondContact O-N 3.22Å; A70-M74 WeakPolarHBondContact O-CB 3.47Å; A70-M74 VanDerWaalsContact O-CG 3.27Å; A70-M74 WeakPolarHBondContact O-CG 3.4Å; A70-M74 PolarHBondContact O-N 3.05Å |
| 71 | V | 96.4 | Very high | 91.9 | Very high | 51 Ų | 51 | 65 Ų | 65 | 31% | 0.309 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -62.6 | -42.2 | 176.5 | 170.8 | 0 | 0 | 0 | 0 | 111.6 | L26 F67 S68 Y69 G75 | L26-V71 HydrophobicContact CB-CG1 4.08Å; L26-V71 HydrophobicContact CD2-CG1 4.11Å; L26-V71 WeakPolarHBondContact O-CG1 3.42Å; F67-V71 WeakPolarHBondContact O-CG2 3.47Å; F67-V71 PolarHBondContact O-N 3.35Å; S68-V71 PolarHBondContact O-N 3.4Å; Y69-V71 VanDerWaalsContact C-N 3.33Å; Y69-V71 PolarHBondContact O-N 2.97Å; V71-G75 PolarHBondContact O-N 3.35Å |
| 72 | I | 98.1 | Very high | 93.2 | Very high | 43 Ų | 43 | 63.9 Ų | 63.9 | 22% | 0.221 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -61.5 | -47.6 | 176.1 | -66.9 | 165.1 | 0 | 0 | 0 | 110.7 | S68 Y69 G75 G76 | S68-I72 VanDerWaalsContact O-CG1 3.3Å; S68-I72 WeakPolarHBondContact O-CG1 3.24Å; S68-I72 PolarHBondContact O-N 3.41Å; Y69-I72 HydrophobicContact CD1-CD1 4.44Å; Y69-I72 PolarHBondContact O-N 3.17Å; I72-G75 PolarHBondContact O-N 2.91Å; I72-G76 PolarHBondContact O-N 3.47Å |
| 73 | I | 97.5 | Very high | 93.9 | Very high | 108 Ų | 108 | 65.7 Ų | 65.7 | 55% | 0.554 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -63.1 | -47.1 | -179.2 | -67.8 | 165.6 | 0 | 0 | 0 | 110.4 | Y69 A70 G75 G76 L77 | Y69-I73 VanDerWaalsContact O-CG1 3.31Å; Y69-I73 WeakPolarHBondContact O-CG1 3.46Å; Y69-I73 PolarHBondContact O-N 2.93Å; A70-I73 PolarHBondContact O-N 3.22Å; I73-G75 PolarHBondContact O-N 3.47Å; I73-G76 PolarHBondContact O-N 3.41Å; I73-L77 HydrophobicContact CG2-CD1 4.24Å; I73-L77 WeakPolarHBondContact O-CG 3.43Å; I73-L77 PolarHBondContact O-N 2.83Å |
| 74 | M | 95.2 | Very high | 94.8 | Very high | 116 Ų | 116 | 63.5 Ų | 63.5 | 57% | 0.571 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -62.2 | -42.6 | 177.7 | -72.6 | -60.7 | -62.5 | 0 | 0 | 111.8 | A70 L77 L78 | A70-M74 WeakPolarHBondContact O-CB 3.47Å; A70-M74 VanDerWaalsContact O-CG 3.27Å; A70-M74 WeakPolarHBondContact O-CG 3.4Å; A70-M74 PolarHBondContact O-N 3.05Å; M74-L77 PolarHBondContact O-N 3.46Å; M74-L78 WeakPolarHBondContact O-CB 3.36Å; M74-L78 PolarHBondContact O-N 3.48Å |
| 75 | G | 97.7 | Very high | 95.3 | Very high | 0 Ų | 0 | 62.6 Ų | 62.6 | 0% | 0 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -61.1 | -43.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | V71 I72 I73 L78 V79 | V71-G75 PolarHBondContact O-N 3.35Å; I72-G75 PolarHBondContact O-N 2.91Å; I73-G75 PolarHBondContact O-N 3.47Å; G75-L78 PolarHBondContact O-N 3.25Å; G75-V79 WeakPolarHBondContact O-CG2 3.38Å; G75-V79 PolarHBondContact O-N 3.31Å |
| 76 | G | 97.9 | Very high | 95.8 | Very high | 25 Ų | 25 | 56.5 Ų | 56.5 | 26% | 0.258 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -60.5 | -48.6 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113 | I72 I73 L78 V79 V80 | I72-G76 PolarHBondContact O-N 3.47Å; I73-G76 PolarHBondContact O-N 3.41Å; G76-L78 VanDerWaalsContact C-N 3.31Å; G76-L78 PolarHBondContact O-N 2.84Å; G76-V79 PolarHBondContact O-N 2.94Å; G76-V80 WeakPolarHBondContact O-CG2 3.49Å; G76-V80 PolarHBondContact O-N 2.95Å |
| 77 | L | 96.1 | Very high | 96 | Very high | 91 Ų | 91 | 55.5 Ų | 55.5 | 48% | 0.476 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -59.9 | -42.6 | 175.5 | -70.4 | 173.7 | 0 | 0 | 0 | 111.4 | I73 M74 V80 I81 | I73-L77 HydrophobicContact CG2-CD1 4.24Å; I73-L77 WeakPolarHBondContact O-CG 3.43Å; I73-L77 PolarHBondContact O-N 2.83Å; M74-L77 PolarHBondContact O-N 3.46Å; L77-V80 PolarHBondContact O-N 3.06Å; L77-I81 VanDerWaalsContact O-CG1 3.27Å; L77-I81 WeakPolarHBondContact O-CG1 3.14Å; L77-I81 PolarHBondContact O-N 3.35Å |
| 78 | L | 96 | Very high | 96.2 | Very high | 43 Ų | 43 | 49.5 Ų | 49.5 | 23% | 0.225 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -61.6 | -45.4 | 178 | -172.8 | 63.4 | 0 | 0 | 0 | 111.8 | L19 I22 L26 M74 G75 G76 A82 | L19-L78 HydrophobicContact CB-CD1 4.18Å; L19-L78 HydrophobicContact CB-CG 4.38Å; L19-L78 HydrophobicContact CD1-CD1 4.47Å; L19-L78 HydrophobicContact CD2-CD1 4.28Å; I22-L78 HydrophobicContact CB-CD2 4.4Å; I22-L78 HydrophobicContact CG2-CD2 4.03Å; L26-L78 HydrophobicContact CD1-CD2 4.41Å; M74-L78 WeakPolarHBondContact O-CB 3.36Å; M74-L78 PolarHBondContact O-N 3.48Å; G75-L78 PolarHBondContact O-N 3.25Å; G76-L78 VanDerWaalsContact C-N 3.31Å; G76-L78 PolarHBondContact O-N 2.84Å; L78-A82 WeakPolarHBondContact O-CB 3.08Å; L78-A82 PolarHBondContact O-N 3.4Å |
| 79 | V | 98 | Very high | 96.3 | Very high | 29 Ų | 29 | 49.4 Ų | 49.4 | 18% | 0.176 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -59.7 | -47.8 | 176.2 | 170.6 | 0 | 0 | 0 | 0 | 110.8 | L24 I27 G75 G76 F83 | L24-V79 HydrophobicContact CD2-CG2 4.07Å; L24-V79 HydrophobicContact CG-CG2 3.99Å; I27-V79 HydrophobicContact CD1-CG2 4.01Å; G75-V79 WeakPolarHBondContact O-CG2 3.38Å; G75-V79 PolarHBondContact O-N 3.31Å; G76-V79 PolarHBondContact O-N 2.94Å; V79-F83 WeakPolarHBondContact O-CB 3.33Å; V79-F83 PolarHBondContact O-N 2.76Å |
| 80 | V | 96.8 | Very high | 96.2 | Very high | 88 Ų | 88 | 49 Ų | 49 | 53% | 0.533 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -61.9 | -50.7 | -178.3 | 171.3 | 0 | 0 | 0 | 0 | 111.1 | G76 L77 F83 V84 | G76-V80 WeakPolarHBondContact O-CG2 3.49Å; G76-V80 PolarHBondContact O-N 2.95Å; L77-V80 PolarHBondContact O-N 3.06Å; V80-F83 PolarHBondContact O-N 3.4Å; V80-V84 WeakPolarHBondContact O-CG2 3.35Å; V80-V84 PolarHBondContact O-N 2.95Å |
| 81 | I | 96.2 | Very high | 96 | Very high | 17 Ų | 17 | 50.9 Ų | 50.9 | 9% | 0.087 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -63.2 | -48.1 | -177.6 | -65.4 | 169.8 | 0 | 0 | 0 | 110.3 | L77 F83 V84 G85 F100 L103 M104 L107 | L77-I81 VanDerWaalsContact O-CG1 3.27Å; L77-I81 WeakPolarHBondContact O-CG1 3.14Å; L77-I81 PolarHBondContact O-N 3.35Å; I81-F83 VanDerWaalsContact C-N 3.35Å; I81-F83 PolarHBondContact O-N 3.46Å; I81-V84 PolarHBondContact O-N 3.26Å; I81-G85 PolarHBondContact O-N 3.29Å; I81-F100 HydrophobicContact CG2-CD2 4.03Å; I81-F100 HydrophobicContact CG2-CE2 4.04Å; I81-F100 WeakPolarHBondContact O-CD2 3.32Å; I81-L103 HydrophobicContact CD1-CB 4.48Å; I81-L103 HydrophobicContact CG1-CB 4.24Å; I81-L103 HydrophobicContact CG1-CD1 4.19Å; I81-L103 HydrophobicContact CG2-CB 4.32Å; I81-M104 HydrophobicContact CG2-CG 4.29Å; I81-M104 HydrophobicContact CG2-SD 3.79Å; I81-L107 HydrophobicContact CD1-CD1 3.62Å; I81-L107 HydrophobicContact CD1-CD2 4.45Å; I81-L107 HydrophobicContact CD1-CG 4.14Å |
| 82 | A | 96.3 | Very high | 95.8 | Very high | 1 Ų | 1 | 51.1 Ų | 51.1 | 1% | 0.008 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -69.1 | -32.4 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | N16 L19 V20 L78 G85 C86 | N16-A82 HydrophobicContact CB-CB 4.43Å; N16-A82 WeakPolarHBondContact O-CB 2.9Å; L19-A82 HydrophobicContact CB-CB 3.72Å; V20-A82 HydrophobicContact CG2-CB 3.6Å; L78-A82 WeakPolarHBondContact O-CB 3.08Å; L78-A82 PolarHBondContact O-N 3.4Å; A82-G85 PolarHBondContact O-N 2.98Å; A82-C86 PolarHBondContact O-N 3.47Å; A82-C86 PolarHBondContact O-SG 3.08Å |
| 83 | F | 96.1 | Very high | 95.6 | Very high | 112 Ų | 112 | 52.3 Ų | 52.3 | 49% | 0.491 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -66.2 | -44 | 174.1 | -177.6 | -99.9 | 0 | 0 | 0 | 111.6 | V20 V79 V80 I81 G85 C86 W87 | V20-F83 HydrophobicContact CG2-CB 4.43Å; V79-F83 WeakPolarHBondContact O-CB 3.33Å; V79-F83 PolarHBondContact O-N 2.76Å; V80-F83 PolarHBondContact O-N 3.4Å; I81-F83 VanDerWaalsContact C-N 3.35Å; I81-F83 PolarHBondContact O-N 3.46Å; F83-G85 VanDerWaalsContact C-N 3.27Å; F83-G85 PolarHBondContact O-N 3.36Å; F83-C86 PolarHBondContact O-N 2.97Å; F83-W87 HydrophobicContact CD1-CE3 4.29Å; F83-W87 HydrophobicContact CE1-CD2 4.37Å; F83-W87 AromaticContact CE1-CE3 3.55Å; F83-W87 HydrophobicContact CE1-CE3 3.55Å; F83-W87 HydrophobicContact CE1-CZ3 4.02Å; F83-W87 HydrophobicContact CZ-CE3 4.24Å; F83-W87 VanDerWaalsContact O-CB 3.31Å; F83-W87 WeakPolarHBondContact O-CB 3.27Å; F83-W87 PolarHBondContact O-N 2.95Å |
| 84 | V | 96.1 | Very high | 95.4 | Very high | 28 Ų | 28 | 50.4 Ų | 50.4 | 17% | 0.17 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -59.6 | -40.6 | 173.2 | 174.3 | 0 | 0 | 0 | 0 | 110.7 | V80 I81 G88 L96 A99 F100 | V80-V84 WeakPolarHBondContact O-CG2 3.35Å; V80-V84 PolarHBondContact O-N 2.95Å; I81-V84 PolarHBondContact O-N 3.26Å; V84-G88 PolarHBondContact O-N 3Å; V84-L96 HydrophobicContact CG1-CD2 4.39Å; V84-A99 HydrophobicContact CG1-CB 4.45Å; V84-F100 HydrophobicContact CG1-CB 4.19Å |
| 85 | G | 95.2 | Very high | 95.4 | Very high | 0 Ų | 0 | 46.9 Ų | 46.9 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -60.2 | -52.3 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | I81 A82 F83 W87 G88 V89 | I81-G85 PolarHBondContact O-N 3.29Å; A82-G85 PolarHBondContact O-N 2.98Å; F83-G85 VanDerWaalsContact C-N 3.27Å; F83-G85 PolarHBondContact O-N 3.36Å; G85-W87 PolarHBondContact O-N 3.29Å; G85-G88 PolarHBondContact O-N 3.44Å; G85-V89 VanDerWaalsContact O-CG2 3.29Å; G85-V89 WeakPolarHBondContact O-CG2 3.35Å; G85-V89 PolarHBondContact O-N 2.86Å |
| 86 | C | 95.7 | Very high | 95.3 | Very high | 11 Ų | 11 | 48.9 Ų | 48.9 | 7% | 0.074 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -57.2 | -48.9 | 176.7 | -69.3 | 0 | 0 | 0 | 0 | 111.5 | F13 N16 F17 A82 F83 V89 V90 | F13-C86 HydrophobicContact CD2-CB 4.32Å; F13-C86 HydrophobicContact CE2-CB 4.25Å; N16-C86 WeakPolarHBondContact CB-SG 3.37Å; F17-C86 PolarHBondContact N-SG 3.32Å; F17-C86 VanDerWaalsContact N-SG 3.35Å; A82-C86 PolarHBondContact O-N 3.47Å; A82-C86 PolarHBondContact O-SG 3.08Å; F83-C86 PolarHBondContact O-N 2.97Å; C86-V89 PolarHBondContact O-N 2.93Å; C86-V90 VanDerWaalsContact O-CG2 3.32Å; C86-V90 WeakPolarHBondContact O-CG2 3.35Å; C86-V90 PolarHBondContact O-N 2.93Å |
| 87 | W | 95.3 | Very high | 95.2 | Very high | 133 Ų | 133 | 47.7 Ų | 47.7 | 50% | 0.504 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -62.8 | -49.2 | -177.8 | -166.9 | 0.9 | 0 | 0 | 0 | 110.5 | F83 G85 V89 V90 I91 L96 | F83-W87 HydrophobicContact CD1-CE3 4.29Å; F83-W87 HydrophobicContact CE1-CD2 4.37Å; F83-W87 AromaticContact CE1-CE3 3.55Å; F83-W87 HydrophobicContact CE1-CE3 3.55Å; F83-W87 HydrophobicContact CE1-CZ3 4.02Å; F83-W87 HydrophobicContact CZ-CE3 4.24Å; F83-W87 VanDerWaalsContact O-CB 3.31Å; F83-W87 WeakPolarHBondContact O-CB 3.27Å; F83-W87 PolarHBondContact O-N 2.95Å; G85-W87 PolarHBondContact O-N 3.29Å; W87-V89 PolarHBondContact O-N 3.36Å; W87-V90 PolarHBondContact O-N 3.32Å; W87-V90 VanDerWaalsContact O-N 3.1Å; W87-I91 VanDerWaalsContact O-CG1 3.25Å; W87-I91 WeakPolarHBondContact O-CG1 3.38Å; W87-I91 PolarHBondContact O-N 3.36Å; W87-L96 HydrophobicContact CB-CD1 4.16Å; W87-L96 HydrophobicContact CD2-CD1 4.03Å; W87-L96 HydrophobicContact CG-CD1 3.81Å |
| 88 | G | 94.5 | Very high | 95.3 | Very high | 0 Ų | 0 | 47.6 Ų | 47.6 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -56.4 | -37.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | V84 G85 E92 N93 | V84-G88 PolarHBondContact O-N 3Å; G85-G88 PolarHBondContact O-N 3.44Å; G88-E92 WeakPolarHBondContact O-CA 3.3Å; G88-E92 PolarHBondContact O-N 3.34Å; G88-E92 VanDerWaalsContact O-N 3.14Å; G88-N93 PolarHBondContact O-N 3.29Å; G88-N93 VanDerWaalsContact O-N 3.12Å |
| 89 | V | 94.5 | Very high | 95.3 | Very high | 4 Ų | 4 | 47.6 Ų | 47.6 | 2% | 0.024 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -69.5 | -46.9 | 174.6 | 174.2 | 0 | 0 | 0 | 0 | 111.9 | K9 L12 F13 G85 C86 W87 E92 L97 L282 | K9-V89 HydrophobicContact CD-CG1 4.38Å; K9-V89 WeakPolarHBondContact CE-O 3.47Å; K9-V89 HydrophobicContact CG-CG1 3.44Å; K9-V89 VanDerWaalsContact CG-CG1 3.44Å; K9-V89 PolarHBondContact NZ-O 2.7Å; K9-V89 WeakPolarHBondContact O-CG1 3.26Å; L12-V89 HydrophobicContact CB-CG2 4.29Å; L12-V89 HydrophobicContact CD2-CG2 3.65Å; L12-V89 HydrophobicContact CG-CG2 3.93Å; F13-V89 HydrophobicContact CB-CG1 3.96Å; G85-V89 VanDerWaalsContact O-CG2 3.29Å; G85-V89 WeakPolarHBondContact O-CG2 3.35Å; G85-V89 PolarHBondContact O-N 2.86Å; C86-V89 PolarHBondContact O-N 2.93Å; W87-V89 PolarHBondContact O-N 3.36Å; V89-E92 PolarHBondContact O-N 3.4Å; V89-L97 HydrophobicContact CG2-CD2 3.89Å; V89-L282 HydrophobicContact CG2-CD1 4.33Å |
| 90 | V | 93.8 | Very high | 95.2 | Very high | 83 Ų | 83 | 46.2 Ų | 46.2 | 50% | 0.503 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -62.3 | -50 | -176.7 | 169.4 | 0 | 0 | 0 | 0 | 111.3 | F13 C86 W87 E92 | F13-V90 HydrophobicContact CD2-CG2 3.78Å; F13-V90 HydrophobicContact CE2-CG2 3.55Å; C86-V90 VanDerWaalsContact O-CG2 3.32Å; C86-V90 WeakPolarHBondContact O-CG2 3.35Å; C86-V90 PolarHBondContact O-N 2.93Å; W87-V90 PolarHBondContact O-N 3.32Å; W87-V90 VanDerWaalsContact O-N 3.1Å; V90-E92 VanDerWaalsContact C-N 3.28Å; V90-E92 PolarHBondContact O-N 2.99Å |
| 91 | I | 93.3 | Very high | 95.2 | Very high | 85 Ų | 85 | 42.5 Ų | 42.5 | 44% | 0.436 | 22% | 0.224 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -86.1 | 1.6 | -177.4 | 66.3 | 159.3 | 0 | 0 | 0 | 113.6 | W87 N93 L96 | W87-I91 VanDerWaalsContact O-CG1 3.25Å; W87-I91 WeakPolarHBondContact O-CG1 3.38Å; W87-I91 PolarHBondContact O-N 3.36Å; I91-N93 HydrophobicContact CD1-CB 3.38Å; I91-N93 HydrophobicContact CG1-CB 3.53Å; I91-N93 PolarHBondContact O-N 3.44Å; I91-N93 VanDerWaalsContact O-N 3.15Å; I91-L96 HydrophobicContact CD1-CD1 3.59Å; I91-L96 HydrophobicContact CG1-CD1 4.02Å |
| 92 | E | 92.4 | Very high | 95.3 | Very high | 56 Ų | 56 | 44.1 Ų | 44.1 | 26% | 0.262 | 24% | 0.24 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 51.9 | 35.5 | -177.4 | -57.4 | -173.9 | 175.3 | 0 | 0 | 112.9 | M1 K9 G88 V89 V90 I286 | M1-E92 WeakPolarHBondContact CE-OE1 3.45Å; K9-E92 IonicContact NZ-OE1 2.66Å; K9-E92 PolarHBondContact NZ-OE1 3.31Å; G88-E92 WeakPolarHBondContact O-CA 3.3Å; G88-E92 PolarHBondContact O-N 3.34Å; G88-E92 VanDerWaalsContact O-N 3.14Å; V89-E92 PolarHBondContact O-N 3.4Å; V90-E92 VanDerWaalsContact C-N 3.28Å; V90-E92 PolarHBondContact O-N 2.99Å; E92-I286 HydrophobicContact CB-CD1 4.19Å |
| 93 | N | 92.7 | Very high | 95.3 | Very high | 69 Ų | 69 | 47.4 Ų | 47.4 | 37% | 0.369 | 26% | 0.257 | S | S | . | . | trans | -90.1 | 115.7 | -176.4 | -175.7 | -61.2 | 0 | 0 | 0 | 110.8 | G88 I91 G95 L96 L97 | G88-N93 PolarHBondContact O-N 3.29Å; G88-N93 VanDerWaalsContact O-N 3.12Å; I91-N93 HydrophobicContact CD1-CB 3.38Å; I91-N93 HydrophobicContact CG1-CB 3.53Å; I91-N93 PolarHBondContact O-N 3.44Å; I91-N93 VanDerWaalsContact O-N 3.15Å; N93-G95 VanDerWaalsContact C-N 3.31Å; N93-G95 PolarHBondContact O-N 2.86Å; N93-G95 VanDerWaalsContact OD1-CA 3.3Å; N93-G95 WeakPolarHBondContact OD1-CA 3.32Å; N93-G95 PolarHBondContact OD1-N 3.01Å; N93-L96 HydrophobicContact CB-CB 4.31Å; N93-L96 HydrophobicContact CB-CD1 4.23Å; N93-L96 HydrophobicContact CB-CG 4.23Å; N93-L96 PolarHBondContact O-N 3.27Å; N93-L96 PolarHBondContact OD1-N 3.25Å; N93-L97 PolarHBondContact O-N 3.3Å; N93-L97 VanDerWaalsContact O-N 3.09Å | ||
| 94 | R | 93.7 | Very high | 95.2 | Very high | 68 Ų | 68 | 42.6 Ų | 42.6 | 26% | 0.257 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -61.7 | -37 | -179.7 | -65.6 | 178.5 | 63.7 | -146 | -12.3 | 113 | L97 I98 I283 I286 K287 D290 | R94-L97 PolarHBondContact O-N 3.41Å; R94-I98 WeakPolarHBondContact O-CB 3.3Å; R94-I98 WeakPolarHBondContact O-CD1 3.31Å; R94-I98 WeakPolarHBondContact O-CG1 3.42Å; R94-I98 PolarHBondContact O-N 3.12Å; R94-I283 PolarHBondContact NE-O 2.61Å; R94-I286 HydrophobicContact CG-CB 3.75Å; R94-I286 HydrophobicContact CG-CD1 4.39Å; R94-I286 HydrophobicContact CG-CG2 3.49Å; R94-I286 VanDerWaalsContact CG-CG2 3.49Å; R94-K287 VanDerWaalsContact CZ-CG 3.49Å; R94-D290 WeakPolarHBondContact CD-OD2 3.43Å; R94-D290 IonicContact NH1-OD2 2.8Å; R94-D290 PolarHBondContact NH1-OD2 3.02Å |
| 95 | G | 95.6 | Very high | 95.3 | Very high | 42 Ų | 42 | 44.9 Ų | 44.9 | 43% | 0.433 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -61.9 | -46.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | N93 I98 A99 | N93-G95 VanDerWaalsContact C-N 3.31Å; N93-G95 PolarHBondContact O-N 2.86Å; N93-G95 VanDerWaalsContact OD1-CA 3.3Å; N93-G95 WeakPolarHBondContact OD1-CA 3.32Å; N93-G95 PolarHBondContact OD1-N 3.01Å; G95-I98 PolarHBondContact O-N 3Å; G95-A99 WeakPolarHBondContact O-CB 3.47Å; G95-A99 PolarHBondContact O-N 3.43Å |
| 96 | L | 95.7 | Very high | 95.3 | Very high | 41 Ų | 41 | 48.4 Ų | 48.4 | 22% | 0.215 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -64.5 | -41.3 | 176.1 | -69.7 | -177.2 | 0 | 0 | 0 | 112.1 | V84 W87 I91 N93 I98 A99 F100 | V84-L96 HydrophobicContact CG1-CD2 4.39Å; W87-L96 HydrophobicContact CB-CD1 4.16Å; W87-L96 HydrophobicContact CD2-CD1 4.03Å; W87-L96 HydrophobicContact CG-CD1 3.81Å; I91-L96 HydrophobicContact CD1-CD1 3.59Å; I91-L96 HydrophobicContact CG1-CD1 4.02Å; N93-L96 HydrophobicContact CB-CB 4.31Å; N93-L96 HydrophobicContact CB-CD1 4.23Å; N93-L96 HydrophobicContact CB-CG 4.23Å; N93-L96 PolarHBondContact O-N 3.27Å; N93-L96 PolarHBondContact OD1-N 3.25Å; L96-I98 VanDerWaalsContact C-N 3.35Å; L96-A99 PolarHBondContact O-N 3.49Å; L96-F100 WeakPolarHBondContact O-CB 3.38Å; L96-F100 PolarHBondContact O-N 3.14Å |
| 97 | L | 96 | Very high | 95.2 | Very high | 1 Ų | 1 | 49.9 Ų | 49.9 | 1% | 0.005 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -65.5 | -38.2 | 176.1 | -71.5 | 171.2 | 0 | 0 | 0 | 112 | L12 V89 N93 R94 F100 T101 S279 L282 I283 I286 | L12-L97 HydrophobicContact CD2-CD2 4.49Å; V89-L97 HydrophobicContact CG2-CD2 3.89Å; N93-L97 PolarHBondContact O-N 3.3Å; N93-L97 VanDerWaalsContact O-N 3.09Å; R94-L97 PolarHBondContact O-N 3.41Å; L97-F100 PolarHBondContact O-N 3.32Å; L97-T101 WeakPolarHBondContact O-CB 3.34Å; L97-T101 PolarHBondContact O-N 3.13Å; L97-T101 PolarHBondContact O-OG1 2.66Å; L97-S279 PolarHBondContact O-OG 2.94Å; L97-L282 HydrophobicContact CD1-CB 4.2Å; L97-I283 HydrophobicContact CB-CD1 3.83Å; L97-I283 HydrophobicContact CB-CG1 3.46Å; L97-I283 VanDerWaalsContact CB-CG1 3.46Å; L97-I283 HydrophobicContact CD1-CG1 4.14Å; L97-I283 HydrophobicContact CG-CG1 4.43Å; L97-I286 HydrophobicContact CD1-CD1 3.57Å |
| 98 | I | 97 | Very high | 95.2 | Very high | 89 Ų | 89 | 44.7 Ų | 44.7 | 46% | 0.456 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -63.3 | -45.2 | 173.8 | -70.8 | 163.9 | 0 | 0 | 0 | 110.1 | R94 G95 L96 T101 A102 I283 | R94-I98 WeakPolarHBondContact O-CB 3.3Å; R94-I98 WeakPolarHBondContact O-CD1 3.31Å; R94-I98 WeakPolarHBondContact O-CG1 3.42Å; R94-I98 PolarHBondContact O-N 3.12Å; G95-I98 PolarHBondContact O-N 3Å; L96-I98 VanDerWaalsContact C-N 3.35Å; I98-T101 PolarHBondContact O-N 2.87Å; I98-A102 WeakPolarHBondContact O-CB 3.39Å; I98-A102 PolarHBondContact O-N 3.46Å; I98-I283 HydrophobicContact CG1-CD1 3.93Å; I98-I283 HydrophobicContact CG1-CG1 4.44Å; I98-I283 HydrophobicContact CG1-CG2 4.25Å |
| 99 | A | 96.5 | Very high | 95.2 | Very high | 42 Ų | 42 | 50.4 Ų | 50.4 | 35% | 0.347 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -60.8 | -47.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | V84 G95 L96 T101 A102 L103 | V84-A99 HydrophobicContact CG1-CB 4.45Å; G95-A99 WeakPolarHBondContact O-CB 3.47Å; G95-A99 PolarHBondContact O-N 3.43Å; L96-A99 PolarHBondContact O-N 3.49Å; A99-T101 VanDerWaalsContact C-N 3.33Å; A99-T101 PolarHBondContact O-N 2.89Å; A99-A102 PolarHBondContact O-N 2.89Å; A99-L103 WeakPolarHBondContact O-CG 3.46Å; A99-L103 PolarHBondContact O-N 2.98Å |
| 100 | F | 96.7 | Very high | 95.2 | Very high | 0 Ų | 0 | 55.6 Ų | 55.6 | 0% | 0 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -55.9 | -47.6 | 173.3 | 168.6 | -105.4 | 0 | 0 | 0 | 111.6 | L12 N16 I81 V84 L96 L97 A102 L103 M104 | L12-F100 HydrophobicContact CD1-CE1 4.36Å; N16-F100 WeakPolarHBondContact OD1-CE2 3.09Å; N16-F100 WeakPolarHBondContact OD1-CZ 3.4Å; I81-F100 HydrophobicContact CG2-CD2 4.03Å; I81-F100 HydrophobicContact CG2-CE2 4.04Å; I81-F100 WeakPolarHBondContact O-CD2 3.32Å; V84-F100 HydrophobicContact CG1-CB 4.19Å; L96-F100 WeakPolarHBondContact O-CB 3.38Å; L96-F100 PolarHBondContact O-N 3.14Å; L97-F100 PolarHBondContact O-N 3.32Å; F100-A102 VanDerWaalsContact C-N 3.35Å; F100-A102 PolarHBondContact O-N 3.49Å; F100-L103 PolarHBondContact O-N 2.83Å; F100-M104 HydrophobicContact CD2-CG 4.06Å; F100-M104 HydrophobicContact CE1-CG 4.09Å; F100-M104 HydrophobicContact CE2-CG 3.6Å; F100-M104 HydrophobicContact CE2-SD 3.98Å; F100-M104 HydrophobicContact CZ-CE 4.35Å; F100-M104 HydrophobicContact CZ-CG 3.62Å; F100-M104 HydrophobicContact CZ-SD 4.18Å; F100-M104 VanDerWaalsContact O-CG 3.3Å; F100-M104 WeakPolarHBondContact O-CG 3.31Å; F100-M104 PolarHBondContact O-N 3.23Å |
| 101 | T | 96.6 | Very high | 95 | Very high | 11 Ų | 11 | 54.9 Ų | 54.9 | 7% | 0.067 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -62.6 | -42.9 | -179.8 | -52 | 0 | 0 | 0 | 0 | 111.2 | L97 I98 A99 M104 I105 I276 S279 I280 | L97-T101 WeakPolarHBondContact O-CB 3.34Å; L97-T101 PolarHBondContact O-N 3.13Å; L97-T101 PolarHBondContact O-OG1 2.66Å; I98-T101 PolarHBondContact O-N 2.87Å; A99-T101 VanDerWaalsContact C-N 3.33Å; A99-T101 PolarHBondContact O-N 2.89Å; T101-M104 PolarHBondContact O-N 2.86Å; T101-I105 HydrophobicContact CG2-CD1 4.01Å; T101-I105 VanDerWaalsContact O-CG1 3.3Å; T101-I105 WeakPolarHBondContact O-CG1 3.33Å; T101-I105 PolarHBondContact O-N 3.44Å; T101-I276 HydrophobicContact CG2-CG2 4.16Å; T101-S279 WeakPolarHBondContact OG1-CB 3.27Å; T101-S279 PolarHBondContact OG1-OG 3.33Å; T101-I280 HydrophobicContact CG2-CD1 4.18Å; T101-I280 HydrophobicContact CG2-CG1 3.84Å |
| 102 | A | 97.1 | Very high | 94.8 | Very high | 51 Ų | 51 | 52.6 Ų | 52.6 | 42% | 0.421 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -61.8 | -45.6 | 177 | 0 | 0 | 0 | 0 | 0 | 111.4 | I98 A99 F100 M104 I105 T106 | I98-A102 WeakPolarHBondContact O-CB 3.39Å; I98-A102 PolarHBondContact O-N 3.46Å; A99-A102 PolarHBondContact O-N 2.89Å; F100-A102 VanDerWaalsContact C-N 3.35Å; F100-A102 PolarHBondContact O-N 3.49Å; A102-M104 PolarHBondContact O-N 3.3Å; A102-I105 PolarHBondContact O-N 3.31Å; A102-T106 PolarHBondContact O-N 2.93Å; A102-T106 PolarHBondContact O-OG1 3.37Å; A102-T106 VanDerWaalsContact O-OG1 3.08Å |
| 103 | L | 96.3 | Very high | 94.8 | Very high | 70 Ų | 70 | 52 Ų | 52 | 37% | 0.366 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -60.6 | -43.7 | 176.6 | -70.4 | 166.9 | 0 | 0 | 0 | 111.9 | I81 A99 F100 T106 L107 | I81-L103 HydrophobicContact CD1-CB 4.48Å; I81-L103 HydrophobicContact CG1-CB 4.24Å; I81-L103 HydrophobicContact CG1-CD1 4.19Å; I81-L103 HydrophobicContact CG2-CB 4.32Å; A99-L103 WeakPolarHBondContact O-CG 3.46Å; A99-L103 PolarHBondContact O-N 2.98Å; F100-L103 PolarHBondContact O-N 2.83Å; L103-T106 WeakPolarHBondContact O-CB 3.32Å; L103-T106 PolarHBondContact O-N 2.89Å; L103-L107 PolarHBondContact O-N 3.29Å |
| 104 | M | 95.5 | Very high | 94.6 | Very high | 10 Ų | 10 | 51.1 Ų | 51.1 | 5% | 0.049 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -65.8 | -39.7 | 177.5 | -68.6 | -65.5 | -77.1 | 0 | 0 | 112.3 | I81 F100 T101 A102 T106 L107 V108 Q272 T275 I276 | I81-M104 HydrophobicContact CG2-CG 4.29Å; I81-M104 HydrophobicContact CG2-SD 3.79Å; F100-M104 HydrophobicContact CD2-CG 4.06Å; F100-M104 HydrophobicContact CE1-CG 4.09Å; F100-M104 HydrophobicContact CE2-CG 3.6Å; F100-M104 HydrophobicContact CE2-SD 3.98Å; F100-M104 HydrophobicContact CZ-CE 4.35Å; F100-M104 HydrophobicContact CZ-CG 3.62Å; F100-M104 HydrophobicContact CZ-SD 4.18Å; F100-M104 VanDerWaalsContact O-CG 3.3Å; F100-M104 WeakPolarHBondContact O-CG 3.31Å; F100-M104 PolarHBondContact O-N 3.23Å; T101-M104 PolarHBondContact O-N 2.86Å; A102-M104 PolarHBondContact O-N 3.3Å; M104-T106 VanDerWaalsContact C-N 3.32Å; M104-T106 PolarHBondContact O-N 3.48Å; M104-L107 PolarHBondContact O-N 3.37Å; M104-L107 HydrophobicContact SD-CD1 4.21Å; M104-V108 WeakPolarHBondContact O-CG2 3.34Å; M104-V108 PolarHBondContact O-N 3.34Å; M104-Q272 HydrophobicContact CE-CB 4.04Å; M104-Q272 HydrophobicContact CE-CG 3.75Å; M104-T275 VanDerWaalsContact CE-OG1 3.22Å; M104-T275 WeakPolarHBondContact CE-OG1 3.31Å; M104-I276 HydrophobicContact CB-CD1 3.89Å; M104-I276 HydrophobicContact CB-CG1 3.58Å |
| 105 | I | 96.6 | Very high | 94.2 | Very high | 76 Ų | 76 | 50.7 Ų | 50.7 | 39% | 0.39 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -62.1 | -42.6 | 173.6 | -70.7 | 167.3 | 0 | 0 | 0 | 110.4 | T101 A102 L107 V108 L109 I276 | T101-I105 HydrophobicContact CG2-CD1 4.01Å; T101-I105 VanDerWaalsContact O-CG1 3.3Å; T101-I105 WeakPolarHBondContact O-CG1 3.33Å; T101-I105 PolarHBondContact O-N 3.44Å; A102-I105 PolarHBondContact O-N 3.31Å; I105-L107 VanDerWaalsContact C-N 3.32Å; I105-L107 PolarHBondContact O-N 2.86Å; I105-V108 PolarHBondContact O-N 2.93Å; I105-L109 HydrophobicContact CG2-CD1 4.05Å; I105-L109 HydrophobicContact CG2-CG 4.42Å; I105-L109 VanDerWaalsContact O-CG 3.32Å; I105-L109 WeakPolarHBondContact O-CG 3.42Å; I105-L109 PolarHBondContact O-N 3.03Å; I105-I276 HydrophobicContact CG1-CD1 4.08Å; I105-I276 HydrophobicContact CG1-CG2 4.49Å |
| 106 | T | 95.8 | Very high | 93.8 | Very high | 75 Ų | 75 | 51 Ų | 51 | 46% | 0.46 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -59.9 | -42 | 175.5 | -57.5 | 0 | 0 | 0 | 0 | 111.7 | A102 L103 M104 L109 L110 | A102-T106 PolarHBondContact O-N 2.93Å; A102-T106 PolarHBondContact O-OG1 3.37Å; A102-T106 VanDerWaalsContact O-OG1 3.08Å; L103-T106 WeakPolarHBondContact O-CB 3.32Å; L103-T106 PolarHBondContact O-N 2.89Å; M104-T106 VanDerWaalsContact C-N 3.32Å; M104-T106 PolarHBondContact O-N 3.48Å; T106-L109 PolarHBondContact O-N 3.45Å; T106-L110 HydrophobicContact CG2-CD1 4.15Å; T106-L110 HydrophobicContact CG2-CG 4.45Å; T106-L110 WeakPolarHBondContact O-CG 3.43Å; T106-L110 PolarHBondContact O-N 3.43Å |
| 107 | L | 94.2 | Very high | 93.4 | Very high | 42 Ų | 42 | 51.8 Ų | 51.8 | 22% | 0.22 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -61.3 | -47.5 | 175.2 | -73.5 | -178.9 | 0 | 0 | 0 | 112.3 | I81 L103 M104 I105 L109 L110 E111 | I81-L107 HydrophobicContact CD1-CD1 3.62Å; I81-L107 HydrophobicContact CD1-CD2 4.45Å; I81-L107 HydrophobicContact CD1-CG 4.14Å; L103-L107 PolarHBondContact O-N 3.29Å; M104-L107 PolarHBondContact O-N 3.37Å; M104-L107 HydrophobicContact SD-CD1 4.21Å; I105-L107 VanDerWaalsContact C-N 3.32Å; I105-L107 PolarHBondContact O-N 2.86Å; L107-L109 VanDerWaalsContact C-N 3.26Å; L107-L109 PolarHBondContact O-N 3.43Å; L107-L110 PolarHBondContact O-N 2.95Å; L107-L110 VanDerWaalsContact O-N 3.12Å; L107-E111 WeakPolarHBondContact O-CB 3.47Å; L107-E111 WeakPolarHBondContact O-CG 3.45Å; L107-E111 PolarHBondContact O-N 3.37Å |
| 108 | V | 94.6 | Very high | 92.8 | Very high | 23 Ų | 23 | 57.8 Ų | 57.8 | 14% | 0.139 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -57.2 | -41.8 | 177.3 | 169.8 | 0 | 0 | 0 | 0 | 111.3 | M104 I105 G112 F269 Q272 I273 I276 | M104-V108 WeakPolarHBondContact O-CG2 3.34Å; M104-V108 PolarHBondContact O-N 3.34Å; I105-V108 PolarHBondContact O-N 2.93Å; V108-G112 PolarHBondContact O-N 3.2Å; V108-F269 HydrophobicContact CG1-CD2 4.33Å; V108-F269 HydrophobicContact CG1-CE2 3.65Å; V108-F269 HydrophobicContact CG1-CZ 4.37Å; V108-Q272 HydrophobicContact CG2-CB 3.85Å; V108-I273 HydrophobicContact CG1-CD1 4.32Å; V108-I273 HydrophobicContact CG2-CD1 4.38Å; V108-I276 HydrophobicContact CG2-CD1 3.85Å |
| 109 | L | 94.8 | Very high | 92.1 | Very high | 121 Ų | 121 | 56 Ų | 56 | 63% | 0.634 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -68.1 | -39.3 | 177.6 | -68.3 | 173.5 | 0 | 0 | 0 | 112.3 | I105 T106 L107 G113 | I105-L109 HydrophobicContact CG2-CD1 4.05Å; I105-L109 HydrophobicContact CG2-CG 4.42Å; I105-L109 VanDerWaalsContact O-CG 3.32Å; I105-L109 WeakPolarHBondContact O-CG 3.42Å; I105-L109 PolarHBondContact O-N 3.03Å; T106-L109 PolarHBondContact O-N 3.45Å; L107-L109 VanDerWaalsContact C-N 3.26Å; L107-L109 PolarHBondContact O-N 3.43Å; L109-G113 WeakPolarHBondContact O-CA 3.33Å; L109-G113 PolarHBondContact O-N 3.02Å |
| 110 | L | 93.5 | Very high | 91.5 | Very high | 113 Ų | 113 | 57.1 Ų | 57.1 | 59% | 0.592 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -66.9 | -45.6 | 176.1 | -73.1 | 173.7 | 0 | 0 | 0 | 111.6 | T106 L107 G113 A114 | T106-L110 HydrophobicContact CG2-CD1 4.15Å; T106-L110 HydrophobicContact CG2-CG 4.45Å; T106-L110 WeakPolarHBondContact O-CG 3.43Å; T106-L110 PolarHBondContact O-N 3.43Å; L107-L110 PolarHBondContact O-N 2.95Å; L107-L110 VanDerWaalsContact O-N 3.12Å; L110-G113 PolarHBondContact O-N 3.4Å; L110-A114 VanDerWaalsContact O-CB 3.27Å; L110-A114 WeakPolarHBondContact O-CB 3.31Å; L110-A114 PolarHBondContact O-N 2.88Å |
| 111 | E | 90.9 | Very high | 90.9 | Very high | 67 Ų | 67 | 59.1 Ų | 59.1 | 31% | 0.313 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -64 | -49.2 | 178 | -72.8 | 179.3 | -169 | 0 | 0 | 111.3 | L107 G113 A114 A115 Q272 | L107-E111 WeakPolarHBondContact O-CB 3.47Å; L107-E111 WeakPolarHBondContact O-CG 3.45Å; L107-E111 PolarHBondContact O-N 3.37Å; E111-G113 PolarHBondContact O-N 2.83Å; E111-A114 PolarHBondContact O-N 3.05Å; E111-A115 WeakPolarHBondContact O-CB 3.41Å; E111-A115 PolarHBondContact O-N 3.34Å; E111-Q272 PolarHBondContact OE1-NE2 3.5Å; E111-Q272 PolarHBondContact OE2-NE2 2.85Å; E111-Q272 PolarHBondContact OE2-OE1 2.89Å |
| 112 | G | 89.6 | Confident | 90.2 | Very high | 38 Ų | 38 | 64.6 Ų | 64.6 | 39% | 0.392 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -63.4 | -40.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | V108 G116 | V108-G112 PolarHBondContact O-N 3.2Å; G112-G116 PolarHBondContact O-N 3.08Å |
| 113 | G | 90.7 | Very high | 89.4 | Confident | 44 Ų | 44 | 66.4 Ų | 66.4 | 45% | 0.454 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -64.6 | -44.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | L109 L110 E111 G116 A117 | L109-G113 WeakPolarHBondContact O-CA 3.33Å; L109-G113 PolarHBondContact O-N 3.02Å; L110-G113 PolarHBondContact O-N 3.4Å; E111-G113 PolarHBondContact O-N 2.83Å; G113-G116 PolarHBondContact O-N 3.34Å; G113-A117 VanDerWaalsContact O-CB 3.28Å; G113-A117 WeakPolarHBondContact O-CB 3.31Å; G113-A117 PolarHBondContact O-N 3.12Å |
| 114 | A | 88.7 | Confident | 88.8 | Confident | 50 Ų | 50 | 68 Ų | 68 | 41% | 0.413 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -64.2 | -45.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | L110 E111 A117 M118 | L110-A114 VanDerWaalsContact O-CB 3.27Å; L110-A114 WeakPolarHBondContact O-CB 3.31Å; L110-A114 PolarHBondContact O-N 2.88Å; E111-A114 PolarHBondContact O-N 3.05Å; A114-A117 PolarHBondContact O-N 2.95Å; A114-M118 HydrophobicContact CB-CE 4.48Å; A114-M118 WeakPolarHBondContact O-CB 3.29Å; A114-M118 WeakPolarHBondContact O-CG 3.4Å; A114-M118 PolarHBondContact O-N 3.04Å |
| 115 | A | 86.5 | Confident | 88.1 | Confident | 59 Ų | 59 | 76.1 Ų | 76.1 | 49% | 0.488 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -61.8 | -44.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | E111 M118 G119 | E111-A115 WeakPolarHBondContact O-CB 3.41Å; E111-A115 PolarHBondContact O-N 3.34Å; A115-M118 PolarHBondContact O-N 3.49Å; A115-G119 PolarHBondContact O-N 3.31Å |
| 116 | G | 86.6 | Confident | 87.5 | Confident | 49 Ų | 49 | 77.2 Ų | 77.2 | 51% | 0.505 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -63.2 | -44.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | G112 G113 G120 | G112-G116 PolarHBondContact O-N 3.08Å; G113-G116 PolarHBondContact O-N 3.34Å; G116-G120 PolarHBondContact O-N 2.9Å |
| 117 | A | 87.4 | Confident | 87 | Confident | 56 Ų | 56 | 80 Ų | 80 | 46% | 0.463 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -62.4 | -49.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | G113 A114 G119 G120 T121 | G113-A117 VanDerWaalsContact O-CB 3.28Å; G113-A117 WeakPolarHBondContact O-CB 3.31Å; G113-A117 PolarHBondContact O-N 3.12Å; A114-A117 PolarHBondContact O-N 2.95Å; A117-G119 PolarHBondContact O-N 2.86Å; A117-G120 PolarHBondContact O-N 3.39Å; A117-T121 WeakPolarHBondContact O-CB 3.46Å; A117-T121 PolarHBondContact O-N 2.93Å; A117-T121 PolarHBondContact O-OG1 3.36Å |
| 118 | M | 83.1 | Confident | 86.6 | Confident | 128 Ų | 128 | 83.2 Ų | 83.2 | 63% | 0.631 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -60.6 | -43.5 | 178.8 | -74 | -171.9 | -69.2 | 0 | 0 | 112 | A114 A115 Q122 | A114-M118 HydrophobicContact CB-CE 4.48Å; A114-M118 WeakPolarHBondContact O-CB 3.29Å; A114-M118 WeakPolarHBondContact O-CG 3.4Å; A114-M118 PolarHBondContact O-N 3.04Å; A115-M118 PolarHBondContact O-N 3.49Å; M118-Q122 WeakPolarHBondContact O-CA 3.42Å; M118-Q122 WeakPolarHBondContact O-CB 3.48Å; M118-Q122 PolarHBondContact O-N 3.04Å; M118-Q122 VanDerWaalsContact O-N 3.1Å |
| 119 | G | 83.1 | Confident | 86.1 | Confident | 50 Ų | 50 | 88.7 Ų | 88.7 | 52% | 0.515 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -65.5 | -43.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113 | A115 A117 T121 | A115-G119 PolarHBondContact O-N 3.31Å; A117-G119 PolarHBondContact O-N 2.86Å; G119-T121 VanDerWaalsContact C-N 3.33Å; G119-T121 PolarHBondContact O-N 2.88Å |
| 120 | G | 83.9 | Confident | 85.8 | Confident | 67 Ų | 67 | 85.6 Ų | 85.6 | 69% | 0.691 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -72.8 | -22.3 | -177.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | G116 A117 | G116-G120 PolarHBondContact O-N 2.9Å; A117-G120 PolarHBondContact O-N 3.39Å |
| 121 | T | 84.3 | Confident | 85.5 | Confident | 42 Ų | 42 | 87.1 Ų | 87.1 | 26% | 0.258 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -116.4 | 7.4 | -175.2 | 58 | 0 | 0 | 0 | 0 | 113.6 | A117 G119 S123 L124 W125 | A117-T121 WeakPolarHBondContact O-CB 3.46Å; A117-T121 PolarHBondContact O-N 2.93Å; A117-T121 PolarHBondContact O-OG1 3.36Å; G119-T121 VanDerWaalsContact C-N 3.33Å; G119-T121 PolarHBondContact O-N 2.88Å; T121-S123 PolarHBondContact O-N 3.21Å; T121-L124 WeakPolarHBondContact O-CB 3.23Å; T121-L124 PolarHBondContact O-N 2.73Å; T121-W125 VanDerWaalsContact CB-CD1 3.43Å; T121-W125 VanDerWaalsContact O-CD1 3.26Å; T121-W125 PolarHBondContact O-N 3.36Å; T121-W125 VanDerWaalsContact O-N 3.12Å; T121-W125 PolarHBondContact OG1-NE1 3.47Å |
| 122 | Q | 81.5 | Confident | 85.4 | Confident | 126 Ų | 126 | 87.8 Ų | 87.8 | 59% | 0.589 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -48.2 | -41.4 | -172.4 | -172.2 | -176.6 | -18.8 | 0 | 0 | 114.1 | M118 K126 | M118-Q122 WeakPolarHBondContact O-CA 3.42Å; M118-Q122 WeakPolarHBondContact O-CB 3.48Å; M118-Q122 PolarHBondContact O-N 3.04Å; M118-Q122 VanDerWaalsContact O-N 3.1Å; Q122-K126 WeakPolarHBondContact O-CB 3.33Å; Q122-K126 PolarHBondContact O-N 3.24Å |
| 123 | S | 80.7 | Confident | 85.3 | Confident | 89 Ų | 89 | 87.8 Ų | 87.8 | 62% | 0.622 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -66.8 | -40.5 | 179.5 | 55.8 | 0 | 0 | 0 | 0 | 113.1 | T121 Q127 | T121-S123 PolarHBondContact O-N 3.21Å; S123-Q127 PolarHBondContact O-N 2.93Å; S123-Q127 VanDerWaalsContact O-N 3.1Å |
| 124 | L | 82.8 | Confident | 85.3 | Confident | 104 Ų | 104 | 86.8 Ų | 86.8 | 55% | 0.545 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -66.6 | -50 | 179.1 | -62.6 | 172.7 | 0 | 0 | 0 | 110.5 | T121 K126 Q127 D128 | T121-L124 WeakPolarHBondContact O-CB 3.23Å; T121-L124 PolarHBondContact O-N 2.73Å; L124-K126 VanDerWaalsContact C-N 3.32Å; L124-K126 PolarHBondContact O-N 3.25Å; L124-Q127 PolarHBondContact O-N 2.77Å; L124-D128 PolarHBondContact O-N 3.13Å |
| 125 | W | 80.7 | Confident | 85.3 | Confident | 180 Ų | 180 | 88.4 Ų | 88.4 | 68% | 0.682 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63.4 | -39.5 | 178.7 | -71.9 | 86.8 | 0 | 0 | 0 | 112 | T121 Y129 | T121-W125 VanDerWaalsContact CB-CD1 3.43Å; T121-W125 VanDerWaalsContact O-CD1 3.26Å; T121-W125 PolarHBondContact O-N 3.36Å; T121-W125 VanDerWaalsContact O-N 3.12Å; T121-W125 PolarHBondContact OG1-NE1 3.47Å; W125-Y129 WeakPolarHBondContact O-CB 3.38Å; W125-Y129 PolarHBondContact O-N 2.97Å |
| 126 | K | 83.2 | Confident | 85.4 | Confident | 99 Ų | 99 | 92.2 Ų | 92.2 | 43% | 0.43 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.7 | -49.9 | 177 | -178.3 | 178.8 | 174.6 | -177.1 | 0 | 110.7 | Q122 L124 Y129 E130 | Q122-K126 WeakPolarHBondContact O-CB 3.33Å; Q122-K126 PolarHBondContact O-N 3.24Å; L124-K126 VanDerWaalsContact C-N 3.32Å; L124-K126 PolarHBondContact O-N 3.25Å; K126-Y129 PolarHBondContact O-N 3.29Å; K126-E130 WeakPolarHBondContact CE-OE1 3.23Å; K126-E130 HydrophobicContact CG-CG 4.28Å; K126-E130 IonicContact NZ-OE1 2.7Å; K126-E130 WeakPolarHBondContact O-CB 3.36Å; K126-E130 VanDerWaalsContact O-CG 3.26Å; K126-E130 WeakPolarHBondContact O-CG 3.48Å; K126-E130 PolarHBondContact O-N 3.21Å |
| 127 | Q | 85.3 | Confident | 85.6 | Confident | 132 Ų | 132 | 90.1 Ų | 90.1 | 62% | 0.617 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -63.5 | -46.5 | -177.8 | -172.4 | 176.3 | 31.5 | 0 | 0 | 112.2 | S123 L124 Y129 E130 K131 | S123-Q127 PolarHBondContact O-N 2.93Å; S123-Q127 VanDerWaalsContact O-N 3.1Å; L124-Q127 PolarHBondContact O-N 2.77Å; Q127-Y129 VanDerWaalsContact C-N 3.33Å; Q127-Y129 PolarHBondContact O-N 3.09Å; Q127-E130 PolarHBondContact O-N 3.39Å; Q127-K131 WeakPolarHBondContact O-CB 3.42Å; Q127-K131 PolarHBondContact O-N 3.37Å |
| 128 | D | 86.5 | Confident | 85.7 | Confident | 110 Ų | 110 | 89.5 Ų | 89.5 | 59% | 0.588 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -65.1 | -38.5 | 178.5 | -83.5 | -14 | 0 | 0 | 0 | 111.9 | L124 S132 | L124-D128 PolarHBondContact O-N 3.13Å; D128-S132 WeakPolarHBondContact O-CB 3.04Å; D128-S132 PolarHBondContact O-N 3.05Å |
| 129 | Y | 84.9 | Confident | 85.9 | Confident | 138 Ų | 138 | 86.1 Ų | 86.1 | 54% | 0.541 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -64.8 | -50.4 | 176 | 179.5 | -95.1 | 0 | 0 | 0 | 112.1 | W125 K126 Q127 K131 S132 M133 L247 | W125-Y129 WeakPolarHBondContact O-CB 3.38Å; W125-Y129 PolarHBondContact O-N 2.97Å; K126-Y129 PolarHBondContact O-N 3.29Å; Q127-Y129 VanDerWaalsContact C-N 3.33Å; Q127-Y129 PolarHBondContact O-N 3.09Å; Y129-K131 VanDerWaalsContact C-N 3.3Å; Y129-K131 PolarHBondContact O-N 2.99Å; Y129-S132 PolarHBondContact O-N 2.97Å; Y129-M133 HydrophobicContact CE1-CE 4.21Å; Y129-M133 HydrophobicContact CE2-CE 3.73Å; Y129-M133 VanDerWaalsContact CZ-CE 3.48Å; Y129-M133 VanDerWaalsContact O-CB 3.31Å; Y129-M133 WeakPolarHBondContact O-CB 3.5Å; Y129-M133 PolarHBondContact O-N 2.86Å; Y129-M133 VanDerWaalsContact OH-CE 3.3Å; Y129-M133 WeakPolarHBondContact OH-CE 3.46Å; Y129-L247 HydrophobicContact CE1-CD2 4.39Å |
| 130 | E | 87.5 | Confident | 86.1 | Confident | 57 Ų | 57 | 87 Ų | 87 | 27% | 0.266 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -59.9 | -43 | 179.3 | -71.8 | -178.8 | 166 | 0 | 0 | 110.8 | K126 Q127 T134 L247 | K126-E130 WeakPolarHBondContact CE-OE1 3.23Å; K126-E130 HydrophobicContact CG-CG 4.28Å; K126-E130 IonicContact NZ-OE1 2.7Å; K126-E130 WeakPolarHBondContact O-CB 3.36Å; K126-E130 VanDerWaalsContact O-CG 3.26Å; K126-E130 WeakPolarHBondContact O-CG 3.48Å; K126-E130 PolarHBondContact O-N 3.21Å; Q127-E130 PolarHBondContact O-N 3.39Å; E130-T134 WeakPolarHBondContact O-CB 3.34Å; E130-T134 PolarHBondContact O-N 3.13Å; E130-T134 PolarHBondContact O-OG1 2.69Å; E130-L247 HydrophobicContact CB-CD1 3.97Å; E130-L247 HydrophobicContact CG-CD1 3.89Å; E130-L247 HydrophobicContact CG-CD2 4.37Å |
| 131 | K | 88.2 | Confident | 86.3 | Confident | 145 Ų | 145 | 84 Ų | 84 | 63% | 0.63 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -63.4 | -49.3 | 176.2 | -175.9 | -179.8 | 178.6 | -176.5 | 0 | 112.1 | Q127 Y129 M133 T134 V135 | Q127-K131 WeakPolarHBondContact O-CB 3.42Å; Q127-K131 PolarHBondContact O-N 3.37Å; Y129-K131 VanDerWaalsContact C-N 3.3Å; Y129-K131 PolarHBondContact O-N 2.99Å; K131-M133 VanDerWaalsContact C-N 3.32Å; K131-M133 PolarHBondContact O-N 2.73Å; K131-T134 PolarHBondContact O-N 2.79Å; K131-V135 WeakPolarHBondContact O-CG2 3.24Å; K131-V135 PolarHBondContact O-N 2.98Å |
| 132 | S | 88.8 | Confident | 86.5 | Confident | 81 Ų | 81 | 87.2 Ų | 87.2 | 57% | 0.566 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -60.7 | -43.1 | 179.3 | -176.4 | 0 | 0 | 0 | 0 | 111.5 | D128 Y129 V135 R136 | D128-S132 WeakPolarHBondContact O-CB 3.04Å; D128-S132 PolarHBondContact O-N 3.05Å; Y129-S132 PolarHBondContact O-N 2.97Å; S132-V135 PolarHBondContact O-N 3.29Å; S132-R136 WeakPolarHBondContact O-CB 3.42Å; S132-R136 PolarHBondContact O-N 3.29Å |
| 133 | M | 87.7 | Confident | 86.7 | Confident | 38 Ų | 38 | 81.3 Ų | 81.3 | 19% | 0.187 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -66.2 | -41.1 | 177.9 | -160.7 | 60.8 | 70.1 | 0 | 0 | 111.8 | Y129 K131 R136 F137 L172 | Y129-M133 HydrophobicContact CE1-CE 4.21Å; Y129-M133 HydrophobicContact CE2-CE 3.73Å; Y129-M133 VanDerWaalsContact CZ-CE 3.48Å; Y129-M133 VanDerWaalsContact O-CB 3.31Å; Y129-M133 WeakPolarHBondContact O-CB 3.5Å; Y129-M133 PolarHBondContact O-N 2.86Å; Y129-M133 VanDerWaalsContact OH-CE 3.3Å; Y129-M133 WeakPolarHBondContact OH-CE 3.46Å; K131-M133 VanDerWaalsContact C-N 3.32Å; K131-M133 PolarHBondContact O-N 2.73Å; M133-R136 PolarHBondContact O-N 3.05Å; M133-F137 WeakPolarHBondContact O-CB 3.34Å; M133-F137 PolarHBondContact O-N 2.91Å; M133-L172 HydrophobicContact CB-CD1 4.07Å; M133-L172 HydrophobicContact CG-CD1 3.65Å; M133-L172 HydrophobicContact CG-CD2 4.24Å; M133-L172 WeakPolarHBondContact O-CD1 3.46Å |
| 134 | T | 89.6 | Confident | 86.7 | Confident | 22 Ų | 22 | 78.1 Ų | 78.1 | 14% | 0.135 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -58.2 | -50.7 | 174.9 | -57.2 | 0 | 0 | 0 | 0 | 111.2 | E130 K131 R136 F137 E138 N173 | E130-T134 WeakPolarHBondContact O-CB 3.34Å; E130-T134 PolarHBondContact O-N 3.13Å; E130-T134 PolarHBondContact O-OG1 2.69Å; K131-T134 PolarHBondContact O-N 2.79Å; T134-R136 VanDerWaalsContact C-N 3.31Å; T134-R136 PolarHBondContact O-N 3Å; T134-F137 PolarHBondContact O-N 3.43Å; T134-E138 HydrophobicContact CG2-CG 4.39Å; T134-E138 WeakPolarHBondContact O-CG 3.37Å; T134-E138 PolarHBondContact O-N 2.85Å; T134-N173 WeakPolarHBondContact CG2-ND2 3.46Å; T134-N173 PolarHBondContact OG1-ND2 2.96Å |
| 135 | V | 89.2 | Confident | 86.3 | Confident | 85 Ų | 85 | 73.7 Ų | 73.7 | 52% | 0.515 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -60.3 | -41.7 | 177.5 | 171.9 | 0 | 0 | 0 | 0 | 111.5 | K131 S132 S139 | K131-V135 WeakPolarHBondContact O-CG2 3.24Å; K131-V135 PolarHBondContact O-N 2.98Å; S132-V135 PolarHBondContact O-N 3.29Å; V135-S139 VanDerWaalsContact O-CB 3.31Å; V135-S139 WeakPolarHBondContact O-CB 3.27Å; V135-S139 PolarHBondContact O-N 3.4Å; V135-S139 PolarHBondContact O-OG 2.88Å |
| 136 | R | 88.1 | Confident | 85.1 | Confident | 138 Ų | 138 | 65.6 Ų | 65.6 | 52% | 0.521 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -65.9 | -41.4 | 178.2 | -166.7 | 175.6 | -175.9 | -169.9 | 0.7 | 111.9 | S132 M133 T134 S139 N140 Y156 | S132-R136 WeakPolarHBondContact O-CB 3.42Å; S132-R136 PolarHBondContact O-N 3.29Å; M133-R136 PolarHBondContact O-N 3.05Å; T134-R136 VanDerWaalsContact C-N 3.31Å; T134-R136 PolarHBondContact O-N 3Å; R136-S139 WeakPolarHBondContact CA-OG 3.3Å; R136-S139 PolarHBondContact O-N 2.93Å; R136-S139 PolarHBondContact O-OG 3.45Å; R136-S139 VanDerWaalsContact O-OG 3.11Å; R136-N140 WeakPolarHBondContact CG-ND2 3.33Å; R136-N140 WeakPolarHBondContact O-CB 3.38Å; R136-N140 PolarHBondContact O-N 2.98Å; R136-N140 PolarHBondContact O-ND2 3.35Å; R136-Y156 HydrophobicContact CG-CE2 4.5Å |
| 137 | F | 90.5 | Very high | 83.5 | Confident | 5 Ų | 5 | 61.8 Ų | 61.8 | 2% | 0.022 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -64.1 | -52.1 | 176.8 | 179 | -97.6 | 0 | 0 | 0 | 111.2 | M133 T134 S139 N140 Y141 Y156 M160 L172 D177 F178 | M133-F137 WeakPolarHBondContact O-CB 3.34Å; M133-F137 PolarHBondContact O-N 2.91Å; T134-F137 PolarHBondContact O-N 3.43Å; F137-S139 VanDerWaalsContact C-N 3.26Å; F137-S139 PolarHBondContact O-N 2.95Å; F137-N140 PolarHBondContact O-N 3.19Å; F137-Y141 HydrophobicContact CD2-CG 4.25Å; F137-Y141 HydrophobicContact CE1-CD1 4.34Å; F137-Y141 HydrophobicContact CE1-CG 4.47Å; F137-Y141 HydrophobicContact CE2-CD1 4.12Å; F137-Y141 AromaticContact CE2-CD2 3.84Å; F137-Y141 HydrophobicContact CE2-CD2 3.84Å; F137-Y141 HydrophobicContact CE2-CE2 4.47Å; F137-Y141 AromaticContact CE2-CG 3.62Å; F137-Y141 HydrophobicContact CE2-CG 3.62Å; F137-Y141 AromaticContact CZ-CD1 3.75Å; F137-Y141 HydrophobicContact CZ-CD1 3.75Å; F137-Y141 HydrophobicContact CZ-CD2 4.27Å; F137-Y141 HydrophobicContact CZ-CE1 4.28Å; F137-Y141 AromaticContact CZ-CG 3.74Å; F137-Y141 HydrophobicContact CZ-CG 3.74Å; F137-Y141 WeakPolarHBondContact O-CB 3.47Å; F137-Y141 PolarHBondContact O-N 3.36Å; F137-Y156 VanDerWaalsContact CA-OH 3.28Å; F137-Y156 WeakPolarHBondContact CA-OH 3.38Å; F137-Y156 PolarHBondContact N-OH 2.91Å; F137-M160 HydrophobicContact CD2-CB 4.47Å; F137-M160 HydrophobicContact CD2-CG 3.95Å; F137-M160 HydrophobicContact CD2-SD 4.06Å; F137-M160 HydrophobicContact CE2-CB 4.02Å; F137-M160 HydrophobicContact CE2-CG 4.01Å; F137-M160 HydrophobicContact CE2-SD 4.34Å; F137-L172 HydrophobicContact CB-CD1 3.31Å; F137-L172 HydrophobicContact CB-CG 3.94Å; F137-L172 HydrophobicContact CD1-CD1 4.41Å; F137-L172 HydrophobicContact CD1-CG 4.28Å; F137-L172 HydrophobicContact CD2-CD1 4.37Å; F137-L172 HydrophobicContact CD2-CG 4.13Å; F137-L172 HydrophobicContact CG-CD1 3.81Å; F137-L172 HydrophobicContact CG-CG 3.86Å; F137-D177 HydrophobicContact CD1-CB 4.44Å; F137-D177 HydrophobicContact CE1-CB 4.09Å; F137-F178 AromaticContact CE1-CE1 3.78Å; F137-F178 HydrophobicContact CE1-CE1 3.78Å; F137-F178 HydrophobicContact CE1-CZ 4.02Å; F137-F178 AromaticContact CZ-CE1 3.62Å; F137-F178 HydrophobicContact CZ-CE1 3.62Å; F137-F178 AromaticContact CZ-CZ 3.66Å; F137-F178 HydrophobicContact CZ-CZ 3.66Å |
| 138 | E | 89.7 | Confident | 81.8 | Confident | 43 Ų | 43 | 57.4 Ų | 57.4 | 20% | 0.201 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -57.2 | -41 | 178.1 | -69.9 | -178.9 | 157.1 | 0 | 0 | 111.8 | T134 N180 S183 S184 | T134-E138 HydrophobicContact CG2-CG 4.39Å; T134-E138 WeakPolarHBondContact O-CG 3.37Å; T134-E138 PolarHBondContact O-N 2.85Å; E138-N180 PolarHBondContact OE1-ND2 2.84Å; E138-N180 PolarHBondContact OE2-ND2 3.34Å; E138-N180 VanDerWaalsContact OE2-ND2 3.16Å; E138-S183 CarbonylContact O-C 3.04Å; E138-S183 WeakPolarHBondContact O-CA 3.43Å; E138-S184 PolarHBondContact O-N 3Å |
| 139 | S | 87.9 | Confident | 80.1 | Confident | 57 Ų | 57 | 57.2 Ų | 57.2 | 40% | 0.399 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -77.4 | -28 | -177.8 | 54 | 0 | 0 | 0 | 0 | 114.7 | V135 R136 F137 S184 | V135-S139 VanDerWaalsContact O-CB 3.31Å; V135-S139 WeakPolarHBondContact O-CB 3.27Å; V135-S139 PolarHBondContact O-N 3.4Å; V135-S139 PolarHBondContact O-OG 2.88Å; R136-S139 WeakPolarHBondContact CA-OG 3.3Å; R136-S139 PolarHBondContact O-N 2.93Å; R136-S139 PolarHBondContact O-OG 3.45Å; R136-S139 VanDerWaalsContact O-OG 3.11Å; F137-S139 VanDerWaalsContact C-N 3.26Å; F137-S139 PolarHBondContact O-N 2.95Å; S139-S184 WeakPolarHBondContact O-CB 3.39Å; S139-S184 PolarHBondContact O-OG 3.45Å |
| 140 | N | 86.1 | Confident | 77.9 | Confident | 69 Ų | 69 | 55.9 Ų | 55.9 | 37% | 0.369 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -111.9 | -30.3 | -172.2 | -63.5 | -80.4 | 0 | 0 | 0 | 113.9 | R136 F137 R142 Y156 | R136-N140 WeakPolarHBondContact CG-ND2 3.33Å; R136-N140 WeakPolarHBondContact O-CB 3.38Å; R136-N140 PolarHBondContact O-N 2.98Å; R136-N140 PolarHBondContact O-ND2 3.35Å; F137-N140 PolarHBondContact O-N 3.19Å; N140-R142 PolarHBondContact O-N 3.48Å; N140-Y156 HydrophobicContact CB-CD1 3.51Å; N140-Y156 HydrophobicContact CB-CE1 3.57Å; N140-Y156 HydrophobicContact CB-CG 4.09Å |
| 141 | Y | 89.5 | Confident | 75.5 | Confident | 3 Ų | 3 | 57.5 Ų | 57.5 | 1% | 0.012 | 31% | 0.312 | C | S | . | . | trans | -69.8 | 125.3 | -177 | -178.7 | -100.8 | 0 | 0 | 0 | 111 | F137 G143 M160 D161 M164 F178 S184 W185 P204 | F137-Y141 HydrophobicContact CD2-CG 4.25Å; F137-Y141 HydrophobicContact CE1-CD1 4.34Å; F137-Y141 HydrophobicContact CE1-CG 4.47Å; F137-Y141 HydrophobicContact CE2-CD1 4.12Å; F137-Y141 AromaticContact CE2-CD2 3.84Å; F137-Y141 HydrophobicContact CE2-CD2 3.84Å; F137-Y141 HydrophobicContact CE2-CE2 4.47Å; F137-Y141 AromaticContact CE2-CG 3.62Å; F137-Y141 HydrophobicContact CE2-CG 3.62Å; F137-Y141 AromaticContact CZ-CD1 3.75Å; F137-Y141 HydrophobicContact CZ-CD1 3.75Å; F137-Y141 HydrophobicContact CZ-CD2 4.27Å; F137-Y141 HydrophobicContact CZ-CE1 4.28Å; F137-Y141 AromaticContact CZ-CG 3.74Å; F137-Y141 HydrophobicContact CZ-CG 3.74Å; F137-Y141 WeakPolarHBondContact O-CB 3.47Å; F137-Y141 PolarHBondContact O-N 3.36Å; Y141-G143 WeakPolarHBondContact OH-CA 3.22Å; Y141-M160 HydrophobicContact CD2-CB 3.57Å; Y141-M160 HydrophobicContact CD2-CG 4.21Å; Y141-M160 HydrophobicContact CE2-CB 3.79Å; Y141-D161 VanDerWaalsContact CE2-OD1 3.26Å; Y141-D161 WeakPolarHBondContact CE2-OD1 3.11Å; Y141-D161 VanDerWaalsContact CZ-OD1 3.29Å; Y141-D161 PolarHBondContact OH-OD1 3.42Å; Y141-M164 HydrophobicContact CE1-CE 4.42Å; Y141-M164 HydrophobicContact CE2-CE 3.7Å; Y141-M164 WeakPolarHBondContact OH-CE 3.47Å; Y141-F178 HydrophobicContact CD1-CD1 4.48Å; Y141-F178 AromaticContact CD1-CE1 3.69Å; Y141-F178 HydrophobicContact CD1-CE1 3.69Å; Y141-F178 HydrophobicContact CE1-CD1 4.27Å; Y141-F178 AromaticContact CE1-CE1 3.41Å; Y141-F178 HydrophobicContact CE1-CE1 3.41Å; Y141-F178 VanDerWaalsContact CE1-CE1 3.41Å; Y141-F178 HydrophobicContact CE1-CZ 4.15Å; Y141-S184 CarbonylContact O-C 3.32Å; Y141-S184 VanDerWaalsContact O-CB 3.27Å; Y141-S184 WeakPolarHBondContact O-CB 3.27Å; Y141-W185 HydrophobicContact CD1-CB 3.91Å; Y141-W185 HydrophobicContact CD1-CG 4.19Å; Y141-W185 HydrophobicContact CE1-CB 4.24Å; Y141-W185 AromaticContact CE1-CD1 3.67Å; Y141-W185 HydrophobicContact CE1-CG 4.01Å; Y141-W185 WeakPolarHBondContact O-CB 3.3Å; Y141-W185 PolarHBondContact O-N 3.02Å; Y141-P204 HydrophobicContact CE1-CB 4.35Å; Y141-P204 HydrophobicContact CE1-CG 3.72Å; Y141-P204 WeakPolarHBondContact OH-CB 3.34Å; Y141-P204 WeakPolarHBondContact OH-CG 3.48Å | ||
| 142 | R | 87.5 | Confident | 73.5 | Confident | 111 Ų | 111 | 59.2 Ų | 59.2 | 42% | 0.419 | 32% | 0.322 | S | S | . | . | trans | -124.3 | -8.3 | 178.7 | -69.5 | 173.9 | 177.8 | -178.2 | 2.7 | 113.2 | N140 A147 F148 S157 W185 V188 | N140-R142 PolarHBondContact O-N 3.48Å; R142-A147 WeakPolarHBondContact O-CB 3.28Å; R142-F148 HydrophobicContact CB-CE2 3.6Å; R142-F148 HydrophobicContact CB-CZ 3.74Å; R142-S157 PolarHBondContact N-OG 2.92Å; R142-W185 VanDerWaalsContact O-CD1 3.27Å; R142-V188 HydrophobicContact CB-CG2 4.31Å; R142-V188 HydrophobicContact CG-CG1 3.99Å; R142-V188 HydrophobicContact CG-CG2 4.5Å | ||
| 143 | G | 86.2 | Confident | 71.8 | Confident | 2 Ų | 2 | 62.1 Ų | 62.1 | 2% | 0.021 | 33% | 0.325 | C | S | . | . | trans | 72.5 | 125 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113 | Y141 A147 F148 S157 | Y141-G143 WeakPolarHBondContact OH-CA 3.22Å; G143-A147 WeakPolarHBondContact O-CB 3.38Å; G143-F148 WeakPolarHBondContact O-CD2 3.4Å; G143-F148 VanDerWaalsContact O-CE2 3.27Å; G143-F148 WeakPolarHBondContact O-CE2 3.45Å; G143-S157 PolarHBondContact N-OG 3.12Å | ||
| 144 | T | 81.3 | Confident | 70.8 | Confident | 22 Ų | 22 | 62.3 Ų | 62.3 | 14% | 0.135 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -88.5 | -45.6 | -171.1 | -40.9 | 0 | 0 | 0 | 0 | 111.6 | G146 S157 L158 D161 | T144-G146 PolarHBondContact O-N 3.5Å; T144-S157 WeakPolarHBondContact OG1-CB 3.33Å; T144-S157 PolarHBondContact OG1-O 3.03Å; T144-L158 HydrophobicContact CG2-CB 4.22Å; T144-L158 HydrophobicContact CG2-CD1 4.2Å; T144-L158 WeakPolarHBondContact OG1-CA 3.5Å; T144-L158 PolarHBondContact OG1-N 3.32Å; T144-D161 WeakPolarHBondContact CA-OD2 3.47Å; T144-D161 WeakPolarHBondContact CB-OD2 3.4Å; T144-D161 PolarHBondContact N-OD2 2.77Å; T144-D161 PolarHBondContact OG1-OD2 2.95Å |
| 145 | F | 73.7 | Confident | 70 | Confident | 10 Ų | 10 | 64.5 Ų | 64.5 | 4% | 0.044 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -77.3 | 95.2 | -179.8 | -50.5 | -41.7 | 0 | 0 | 0 | 108.2 | L158 D161 I165 P205 L216 Y221 F224 | F145-L158 HydrophobicContact CE1-CD1 4.04Å; F145-L158 HydrophobicContact CZ-CD1 3.87Å; F145-D161 HydrophobicContact CD2-CB 3.97Å; F145-D161 HydrophobicContact CE2-CB 3.56Å; F145-D161 HydrophobicContact CZ-CB 4.23Å; F145-I165 HydrophobicContact CD2-CD1 4.17Å; F145-I165 HydrophobicContact CE2-CD1 3.58Å; F145-P205 HydrophobicContact CB-CB 4.17Å; F145-P205 HydrophobicContact CB-CG 4.17Å; F145-P205 WeakPolarHBondContact O-CD 3.27Å; F145-P205 WeakPolarHBondContact O-CG 3.38Å; F145-L216 HydrophobicContact CE2-CD2 4.32Å; F145-L216 HydrophobicContact CZ-CD2 3.97Å; F145-Y221 AromaticContact CE1-CD1 3.52Å; F145-Y221 HydrophobicContact CE1-CD1 3.52Å; F145-Y221 HydrophobicContact CE1-CE1 4.44Å; F145-Y221 AromaticContact CE1-CG 3.7Å; F145-Y221 HydrophobicContact CE1-CG 3.7Å; F145-Y221 AromaticContact CZ-CD1 3.69Å; F145-Y221 HydrophobicContact CZ-CD1 3.69Å; F145-Y221 HydrophobicContact CZ-CE1 4.31Å; F145-Y221 HydrophobicContact CZ-CG 4.34Å; F145-F224 HydrophobicContact CB-CD1 4.09Å; F145-F224 HydrophobicContact CB-CD2 4.23Å; F145-F224 HydrophobicContact CB-CE1 4.03Å; F145-F224 HydrophobicContact CB-CE2 4.22Å; F145-F224 HydrophobicContact CB-CG 4.17Å; F145-F224 HydrophobicContact CB-CZ 4.09Å; F145-F224 HydrophobicContact CG-CD1 4.44Å; F145-F224 HydrophobicContact CG-CG 4.37Å |
| 146 | G | 54.9 | Low | 69.6 | Low | 10 Ų | 10 | 62 Ų | 62 | 10% | 0.103 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | 114.7 | -28.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 116.2 | T144 K191 | T144-G146 PolarHBondContact O-N 3.5Å; G146-K191 CarbonylContact C-O 3.45Å; G146-K191 CarbonylContact O-C 3.46Å |
| 147 | A | 50.4 | Low | 69.5 | Low | 19 Ų | 19 | 55.5 Ų | 55.5 | 16% | 0.157 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -93.5 | -19.8 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | R142 G143 | R142-A147 WeakPolarHBondContact O-CB 3.28Å; G143-A147 WeakPolarHBondContact O-CB 3.38Å |
| 148 | F | 50.7 | Low | 69.2 | Low | 40 Ų | 40 | 55.6 Ų | 55.6 | 18% | 0.175 | 30% | 0.295 | C | S | . | . | trans | -114.5 | 24.1 | -166.3 | -76.6 | -97.4 | 0 | 0 | 0 | 116.3 | R142 G143 I150 S151 E152 D154 | R142-F148 HydrophobicContact CB-CE2 3.6Å; R142-F148 HydrophobicContact CB-CZ 3.74Å; G143-F148 WeakPolarHBondContact O-CD2 3.4Å; G143-F148 VanDerWaalsContact O-CE2 3.27Å; G143-F148 WeakPolarHBondContact O-CE2 3.45Å; F148-I150 PolarHBondContact O-N 2.91Å; F148-S151 VanDerWaalsContact CD1-O 3.29Å; F148-S151 WeakPolarHBondContact CD1-O 3.31Å; F148-E152 WeakPolarHBondContact CD1-O 3.44Å; F148-E152 WeakPolarHBondContact CE1-O 3.47Å; F148-D154 HydrophobicContact CE1-CB 3.65Å; F148-D154 HydrophobicContact CE2-CB 4.29Å; F148-D154 HydrophobicContact CZ-CB 3.47Å; F148-D154 VanDerWaalsContact CZ-CB 3.47Å | ||
| 149 | S | 49.7 | Very low | 68.8 | Low | 106 Ų | 106 | 54.6 Ų | 54.6 | 74% | 0.741 | 29% | 0.29 | S | S | * | . | S | Bend | trans | -66.3 | 2.2 | 160.7 | 53.4 | 0 | 0 | 0 | 0 | 112.9 | ||
| 150 | I | 39.6 | Very low | 68.8 | Low | 111 Ų | 111 | 53.1 Ų | 53.1 | 57% | 0.569 | 28% | 0.278 | S | S | * | . | S | Bend | trans | -128.9 | -15.6 | -161.4 | -45.2 | -179.3 | 0 | 0 | 0 | 115.4 | F148 K191 | F148-I150 PolarHBondContact O-N 2.91Å; I150-K191 HydrophobicContact CD1-CD 4.23Å |
| 151 | S | 36.9 | Very low | 69 | Low | 90 Ų | 90 | 49.9 Ų | 49.9 | 63% | 0.629 | 26% | 0.26 | S | S | * | . | S | Bend | trans | -166.1 | 174.2 | 170.4 | 67.6 | 0 | 0 | 0 | 0 | 112.8 | F148 | F148-S151 VanDerWaalsContact CD1-O 3.29Å; F148-S151 WeakPolarHBondContact CD1-O 3.31Å |
| 152 | E | 46 | Very low | 68.9 | Low | 182 Ų | 182 | 50.5 Ų | 50.5 | 85% | 0.85 | 26% | 0.263 | S | S | * | . | trans | -43.9 | 135.8 | -165.5 | -73.1 | -179 | 156 | 0 | 0 | 116.5 | F148 D154 | F148-E152 WeakPolarHBondContact CD1-O 3.44Å; F148-E152 WeakPolarHBondContact CE1-O 3.47Å; E152-D154 PolarHBondContact O-N 3.45Å; E152-D154 VanDerWaalsContact O-N 3.07Å | ||
| 153 | F | 52 | Low | 69 | Low | 142 Ų | 142 | 47 Ų | 47 | 62% | 0.623 | 25% | 0.252 | S | S | * | . | trans | -37.2 | 102.8 | 173.4 | -150 | -93.1 | 0 | 0 | 0 | 112.6 | D155 L158 | F153-D155 PolarHBondContact O-N 2.93Å; F153-L158 HydrophobicContact CE1-CD2 3.49Å; F153-L158 VanDerWaalsContact CE1-CD2 3.49Å; F153-L158 HydrophobicContact CE2-CD2 4.44Å; F153-L158 HydrophobicContact CZ-CD2 3.39Å | ||
| 154 | D | 67.7 | Low | 69.3 | Low | 41 Ų | 41 | 47 Ų | 47 | 22% | 0.219 | 25% | 0.252 | C | S | . | . | trans | -84.4 | 91.7 | 170.6 | -179.8 | 18.1 | 0 | 0 | 0 | 109.5 | F148 E152 Y156 S157 L158 | F148-D154 HydrophobicContact CE1-CB 3.65Å; F148-D154 HydrophobicContact CE2-CB 4.29Å; F148-D154 HydrophobicContact CZ-CB 3.47Å; F148-D154 VanDerWaalsContact CZ-CB 3.47Å; E152-D154 PolarHBondContact O-N 3.45Å; E152-D154 VanDerWaalsContact O-N 3.07Å; D154-Y156 PolarHBondContact O-N 3.4Å; D154-Y156 PolarHBondContact OD1-N 3.35Å; D154-S157 WeakPolarHBondContact O-CB 3.35Å; D154-S157 PolarHBondContact O-N 2.87Å; D154-S157 PolarHBondContact OD2-OG 2.9Å; D154-L158 PolarHBondContact O-N 3.43Å; D154-L158 VanDerWaalsContact O-N 3.16Å | ||
| 155 | D | 73.3 | Confident | 69.8 | Low | 68 Ų | 68 | 46 Ų | 46 | 36% | 0.364 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -47.4 | -34.6 | 178.8 | 179.1 | 60.9 | 0 | 0 | 0 | 113 | F153 K159 | F153-D155 PolarHBondContact O-N 2.93Å; D155-K159 WeakPolarHBondContact O-CD 3.31Å; D155-K159 VanDerWaalsContact O-CG 3.23Å; D155-K159 WeakPolarHBondContact O-CG 3.48Å; D155-K159 PolarHBondContact O-N 2.92Å; D155-K159 VanDerWaalsContact O-N 3.16Å; D155-K159 WeakPolarHBondContact OD1-CE 3.34Å; D155-K159 IonicContact OD1-NZ 2.8Å; D155-K159 PolarHBondContact OD1-NZ 2.85Å; D155-K159 WeakPolarHBondContact OD2-CE 3.25Å; D155-K159 IonicContact OD2-NZ 3.42Å; D155-K159 PolarHBondContact OD2-NZ 3.04Å |
| 156 | Y | 80.2 | Confident | 70.5 | Confident | 34 Ų | 34 | 47.5 Ų | 47.5 | 13% | 0.133 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -67 | -46.7 | 177 | -176.7 | -95.9 | 0 | 0 | 0 | 112.2 | R136 F137 N140 D154 L158 K159 M160 | R136-Y156 HydrophobicContact CG-CE2 4.5Å; F137-Y156 VanDerWaalsContact CA-OH 3.28Å; F137-Y156 WeakPolarHBondContact CA-OH 3.38Å; F137-Y156 PolarHBondContact N-OH 2.91Å; N140-Y156 HydrophobicContact CB-CD1 3.51Å; N140-Y156 HydrophobicContact CB-CE1 3.57Å; N140-Y156 HydrophobicContact CB-CG 4.09Å; D154-Y156 PolarHBondContact O-N 3.4Å; D154-Y156 PolarHBondContact OD1-N 3.35Å; Y156-L158 VanDerWaalsContact C-N 3.32Å; Y156-L158 PolarHBondContact O-N 3.44Å; Y156-K159 PolarHBondContact O-N 3.49Å; Y156-M160 HydrophobicContact CD1-CG 4.22Å; Y156-M160 HydrophobicContact CD2-CE 4.46Å; Y156-M160 HydrophobicContact CE1-CE 4.31Å; Y156-M160 HydrophobicContact CE1-CG 3.79Å; Y156-M160 HydrophobicContact CE2-CE 3.58Å; Y156-M160 HydrophobicContact CE2-CG 4.5Å; Y156-M160 VanDerWaalsContact CZ-CE 3.5Å; Y156-M160 WeakPolarHBondContact O-CG 3.45Å; Y156-M160 PolarHBondContact O-N 2.98Å; Y156-M160 WeakPolarHBondContact OH-CE 3.33Å |
| 157 | S | 86.6 | Confident | 72.2 | Confident | 0 Ų | 0 | 48.1 Ų | 48.1 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -62.1 | -40.5 | 179 | -69.9 | 0 | 0 | 0 | 0 | 111.5 | R142 G143 T144 D154 K159 M160 D161 | R142-S157 PolarHBondContact N-OG 2.92Å; G143-S157 PolarHBondContact N-OG 3.12Å; T144-S157 WeakPolarHBondContact OG1-CB 3.33Å; T144-S157 PolarHBondContact OG1-O 3.03Å; D154-S157 WeakPolarHBondContact O-CB 3.35Å; D154-S157 PolarHBondContact O-N 2.87Å; D154-S157 PolarHBondContact OD2-OG 2.9Å; S157-K159 VanDerWaalsContact C-N 3.31Å; S157-K159 PolarHBondContact O-N 3.36Å; S157-M160 PolarHBondContact O-N 3.14Å; S157-D161 WeakPolarHBondContact O-CB 3.06Å; S157-D161 VanDerWaalsContact O-CG 3.25Å; S157-D161 PolarHBondContact O-N 3.29Å |
| 158 | L | 83.5 | Confident | 74.3 | Confident | 8 Ų | 8 | 52.1 Ų | 52.1 | 4% | 0.042 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -65.1 | -39 | 178.6 | 177.7 | 61.6 | 0 | 0 | 0 | 111.4 | T144 F145 F153 D154 Y156 D161 K162 Y221 | T144-L158 HydrophobicContact CG2-CB 4.22Å; T144-L158 HydrophobicContact CG2-CD1 4.2Å; T144-L158 WeakPolarHBondContact OG1-CA 3.5Å; T144-L158 PolarHBondContact OG1-N 3.32Å; F145-L158 HydrophobicContact CE1-CD1 4.04Å; F145-L158 HydrophobicContact CZ-CD1 3.87Å; F153-L158 HydrophobicContact CE1-CD2 3.49Å; F153-L158 VanDerWaalsContact CE1-CD2 3.49Å; F153-L158 HydrophobicContact CE2-CD2 4.44Å; F153-L158 HydrophobicContact CZ-CD2 3.39Å; D154-L158 PolarHBondContact O-N 3.43Å; D154-L158 VanDerWaalsContact O-N 3.16Å; Y156-L158 VanDerWaalsContact C-N 3.32Å; Y156-L158 PolarHBondContact O-N 3.44Å; L158-D161 PolarHBondContact O-N 3.37Å; L158-K162 HydrophobicContact CD1-CG 4.47Å; L158-K162 HydrophobicContact CG-CD 4.46Å; L158-K162 WeakPolarHBondContact O-CB 3.2Å; L158-K162 WeakPolarHBondContact O-CG 3.48Å; L158-K162 PolarHBondContact O-N 2.74Å; L158-Y221 HydrophobicContact CD1-CD1 4.23Å; L158-Y221 HydrophobicContact CD1-CE1 3.86Å; L158-Y221 HydrophobicContact CD1-CE2 4.24Å; L158-Y221 HydrophobicContact CD2-CE2 4.09Å |
| 159 | K | 82.3 | Confident | 76.5 | Confident | 22 Ų | 22 | 50.2 Ų | 50.2 | 10% | 0.096 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -66.9 | -42.1 | 177.6 | -72.6 | 168 | -178.5 | 172.1 | 0 | 111.3 | L57 Q59 T61 D155 Y156 S157 D161 K162 L163 | L57-K159 HydrophobicContact CD1-CB 3.9Å; L57-K159 HydrophobicContact CD1-CG 3.95Å; L57-K159 WeakPolarHBondContact CD1-O 3.43Å; L57-K159 HydrophobicContact CG-CB 4.07Å; L57-K159 HydrophobicContact CG-CG 4.05Å; L57-K159 WeakPolarHBondContact O-CD 3.21Å; L57-K159 WeakPolarHBondContact O-CE 3.43Å; L57-K159 WeakPolarHBondContact O-CG 3.43Å; Q59-K159 PolarHBondContact O-NZ 3.39Å; T61-K159 HydrophobicContact CG2-CD 3.94Å; D155-K159 WeakPolarHBondContact O-CD 3.31Å; D155-K159 VanDerWaalsContact O-CG 3.23Å; D155-K159 WeakPolarHBondContact O-CG 3.48Å; D155-K159 PolarHBondContact O-N 2.92Å; D155-K159 VanDerWaalsContact O-N 3.16Å; D155-K159 WeakPolarHBondContact OD1-CE 3.34Å; D155-K159 IonicContact OD1-NZ 2.8Å; D155-K159 PolarHBondContact OD1-NZ 2.85Å; D155-K159 WeakPolarHBondContact OD2-CE 3.25Å; D155-K159 IonicContact OD2-NZ 3.42Å; D155-K159 PolarHBondContact OD2-NZ 3.04Å; Y156-K159 PolarHBondContact O-N 3.49Å; S157-K159 VanDerWaalsContact C-N 3.31Å; S157-K159 PolarHBondContact O-N 3.36Å; K159-D161 VanDerWaalsContact C-N 3.33Å; K159-D161 PolarHBondContact O-N 3.25Å; K159-K162 PolarHBondContact O-N 3.08Å; K159-L163 VanDerWaalsContact O-CB 3.3Å; K159-L163 WeakPolarHBondContact O-CB 3.49Å; K159-L163 PolarHBondContact O-N 3.06Å |
| 160 | M | 87.5 | Confident | 78.7 | Confident | 26 Ų | 26 | 45.2 Ų | 45.2 | 13% | 0.128 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -66.7 | -36.6 | 175.4 | -69.8 | -57.2 | 162.5 | 0 | 0 | 112.5 | F137 Y141 Y156 S157 L163 M164 | F137-M160 HydrophobicContact CD2-CB 4.47Å; F137-M160 HydrophobicContact CD2-CG 3.95Å; F137-M160 HydrophobicContact CD2-SD 4.06Å; F137-M160 HydrophobicContact CE2-CB 4.02Å; F137-M160 HydrophobicContact CE2-CG 4.01Å; F137-M160 HydrophobicContact CE2-SD 4.34Å; Y141-M160 HydrophobicContact CD2-CB 3.57Å; Y141-M160 HydrophobicContact CD2-CG 4.21Å; Y141-M160 HydrophobicContact CE2-CB 3.79Å; Y156-M160 HydrophobicContact CD1-CG 4.22Å; Y156-M160 HydrophobicContact CD2-CE 4.46Å; Y156-M160 HydrophobicContact CE1-CE 4.31Å; Y156-M160 HydrophobicContact CE1-CG 3.79Å; Y156-M160 HydrophobicContact CE2-CE 3.58Å; Y156-M160 HydrophobicContact CE2-CG 4.5Å; Y156-M160 VanDerWaalsContact CZ-CE 3.5Å; Y156-M160 WeakPolarHBondContact O-CG 3.45Å; Y156-M160 PolarHBondContact O-N 2.98Å; Y156-M160 WeakPolarHBondContact OH-CE 3.33Å; S157-M160 PolarHBondContact O-N 3.14Å; M160-L163 WeakPolarHBondContact O-CB 3.42Å; M160-L163 PolarHBondContact O-N 3.34Å; M160-L163 HydrophobicContact SD-CD2 3.95Å; M160-M164 HydrophobicContact CB-CE 4.45Å; M160-M164 WeakPolarHBondContact O-CB 3.26Å; M160-M164 WeakPolarHBondContact O-CE 3.42Å; M160-M164 WeakPolarHBondContact O-CG 3.38Å; M160-M164 PolarHBondContact O-N 3.3Å |
| 161 | D | 90.1 | Very high | 81.3 | Confident | 1 Ų | 1 | 40 Ų | 40 | 1% | 0.005 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -64.4 | -47.7 | 174.9 | -72.3 | -24.8 | 0 | 0 | 0 | 112.2 | Y141 T144 F145 S157 L158 K159 L163 M164 I165 A206 | Y141-D161 VanDerWaalsContact CE2-OD1 3.26Å; Y141-D161 WeakPolarHBondContact CE2-OD1 3.11Å; Y141-D161 VanDerWaalsContact CZ-OD1 3.29Å; Y141-D161 PolarHBondContact OH-OD1 3.42Å; T144-D161 WeakPolarHBondContact CA-OD2 3.47Å; T144-D161 WeakPolarHBondContact CB-OD2 3.4Å; T144-D161 PolarHBondContact N-OD2 2.77Å; T144-D161 PolarHBondContact OG1-OD2 2.95Å; F145-D161 HydrophobicContact CD2-CB 3.97Å; F145-D161 HydrophobicContact CE2-CB 3.56Å; F145-D161 HydrophobicContact CZ-CB 4.23Å; S157-D161 WeakPolarHBondContact O-CB 3.06Å; S157-D161 VanDerWaalsContact O-CG 3.25Å; S157-D161 PolarHBondContact O-N 3.29Å; L158-D161 PolarHBondContact O-N 3.37Å; K159-D161 VanDerWaalsContact C-N 3.33Å; K159-D161 PolarHBondContact O-N 3.25Å; D161-L163 VanDerWaalsContact C-N 3.31Å; D161-L163 PolarHBondContact O-N 3.38Å; D161-M164 PolarHBondContact O-N 3.06Å; D161-I165 VanDerWaalsContact O-CG1 3.28Å; D161-I165 WeakPolarHBondContact O-CG1 3.19Å; D161-I165 PolarHBondContact O-N 3.02Å; D161-A206 HydrophobicContact CB-CB 3.73Å; D161-A206 VanDerWaalsContact OD1-CB 3.24Å; D161-A206 WeakPolarHBondContact OD1-CB 3.3Å |
| 162 | K | 86.9 | Confident | 84 | Confident | 15 Ų | 15 | 36 Ų | 36 | 7% | 0.065 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -57.8 | -44.7 | 173.9 | -80.4 | 178.7 | 176.7 | -170.2 | 0 | 111.5 | L57 L158 K159 I165 E166 L216 Y221 | L57-K162 HydrophobicContact CD1-CB 3.3Å; L57-K162 HydrophobicContact CD1-CD 3.63Å; L57-K162 HydrophobicContact CD1-CG 4.09Å; L158-K162 HydrophobicContact CD1-CG 4.47Å; L158-K162 HydrophobicContact CG-CD 4.46Å; L158-K162 WeakPolarHBondContact O-CB 3.2Å; L158-K162 WeakPolarHBondContact O-CG 3.48Å; L158-K162 PolarHBondContact O-N 2.74Å; K159-K162 PolarHBondContact O-N 3.08Å; K162-I165 PolarHBondContact O-N 2.95Å; K162-E166 VanDerWaalsContact O-CB 3.25Å; K162-E166 WeakPolarHBondContact O-CB 3.45Å; K162-E166 PolarHBondContact O-N 3.12Å; K162-L216 HydrophobicContact CG-CD2 4.04Å; K162-Y221 WeakPolarHBondContact CE-OH 3.23Å; K162-Y221 PolarHBondContact NZ-OH 3.48Å |
| 163 | L | 89.1 | Confident | 86.3 | Confident | 38 Ų | 38 | 31.2 Ų | 31.2 | 20% | 0.199 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -58 | -49.6 | 176.9 | -175.6 | 74.9 | 0 | 0 | 0 | 111.1 | L57 K159 M160 D161 I165 E166 L167 C246 | L57-L163 HydrophobicContact CD2-CB 4.4Å; L57-L163 HydrophobicContact CD2-CD1 4.33Å; K159-L163 VanDerWaalsContact O-CB 3.3Å; K159-L163 WeakPolarHBondContact O-CB 3.49Å; K159-L163 PolarHBondContact O-N 3.06Å; M160-L163 WeakPolarHBondContact O-CB 3.42Å; M160-L163 PolarHBondContact O-N 3.34Å; M160-L163 HydrophobicContact SD-CD2 3.95Å; D161-L163 VanDerWaalsContact C-N 3.31Å; D161-L163 PolarHBondContact O-N 3.38Å; L163-I165 PolarHBondContact O-N 3.32Å; L163-E166 PolarHBondContact O-N 2.99Å; L163-L167 HydrophobicContact CD1-CD1 3.45Å; L163-L167 VanDerWaalsContact CD1-CD1 3.45Å; L163-L167 HydrophobicContact CD1-CG 4.05Å; L163-L167 HydrophobicContact CG-CD1 3.86Å; L163-L167 HydrophobicContact CG-CG 4.46Å; L163-L167 VanDerWaalsContact O-CB 3.26Å; L163-L167 WeakPolarHBondContact O-CB 3.46Å; L163-L167 WeakPolarHBondContact O-CG 3.5Å; L163-L167 PolarHBondContact O-N 3.25Å; L163-C246 HydrophobicContact CD2-CB 4.45Å |
| 164 | M | 93.1 | Very high | 88.3 | Confident | 2 Ų | 2 | 24.5 Ų | 24.5 | 1% | 0.01 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -60.7 | -42.8 | 179.4 | -78.8 | -173.9 | -74.9 | 0 | 0 | 112.4 | Y141 M160 D161 E168 C169 G171 F178 A206 C246 | Y141-M164 HydrophobicContact CE1-CE 4.42Å; Y141-M164 HydrophobicContact CE2-CE 3.7Å; Y141-M164 WeakPolarHBondContact OH-CE 3.47Å; M160-M164 HydrophobicContact CB-CE 4.45Å; M160-M164 WeakPolarHBondContact O-CB 3.26Å; M160-M164 WeakPolarHBondContact O-CE 3.42Å; M160-M164 WeakPolarHBondContact O-CG 3.38Å; M160-M164 PolarHBondContact O-N 3.3Å; D161-M164 PolarHBondContact O-N 3.06Å; M164-E168 WeakPolarHBondContact O-CA 3Å; M164-E168 PolarHBondContact O-N 3.41Å; M164-C169 WeakPolarHBondContact CB-O 3.24Å; M164-C169 PolarHBondContact O-N 2.89Å; M164-G171 PolarHBondContact SD-N 2.96Å; M164-G171 VanDerWaalsContact SD-N 3.4Å; M164-F178 HydrophobicContact CE-CZ 4.37Å; M164-F178 HydrophobicContact SD-CE2 4.47Å; M164-F178 HydrophobicContact SD-CZ 3.92Å; M164-A206 HydrophobicContact CB-CB 4.03Å; M164-A206 HydrophobicContact CE-CB 3.84Å; M164-C246 VanDerWaalsContact CG-SG 3.57Å |
| 165 | I | 92.3 | Very high | 89.5 | Confident | 2 Ų | 2 | 26.2 Ų | 26.2 | 1% | 0.01 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -70.3 | -42.9 | 179.6 | -64.1 | 165.1 | 0 | 0 | 0 | 111.4 | F145 D161 K162 L163 E168 A206 Y210 K213 F215 L216 | F145-I165 HydrophobicContact CD2-CD1 4.17Å; F145-I165 HydrophobicContact CE2-CD1 3.58Å; D161-I165 VanDerWaalsContact O-CG1 3.28Å; D161-I165 WeakPolarHBondContact O-CG1 3.19Å; D161-I165 PolarHBondContact O-N 3.02Å; K162-I165 PolarHBondContact O-N 2.95Å; L163-I165 PolarHBondContact O-N 3.32Å; I165-E168 PolarHBondContact O-N 3.34Å; I165-A206 HydrophobicContact CD1-CB 4.2Å; I165-A206 HydrophobicContact CG1-CB 4.02Å; I165-A206 WeakPolarHBondContact CG1-O 3.47Å; I165-Y210 HydrophobicContact CD1-CE2 3.97Å; I165-Y210 HydrophobicContact CG1-CD2 4.33Å; I165-Y210 HydrophobicContact CG1-CE2 3.77Å; I165-Y210 HydrophobicContact CG2-CD2 4Å; I165-Y210 HydrophobicContact CG2-CE2 4.27Å; I165-K213 HydrophobicContact CG2-CD 3.87Å; I165-K213 HydrophobicContact CG2-CG 3.95Å; I165-K213 WeakPolarHBondContact O-CE 3.4Å; I165-K213 PolarHBondContact O-NZ 3.37Å; I165-F215 HydrophobicContact CD1-CZ 4.13Å; I165-L216 HydrophobicContact CB-CD1 3.85Å; I165-L216 HydrophobicContact CD1-CD1 4.12Å; I165-L216 HydrophobicContact CD1-CD2 4.13Å; I165-L216 HydrophobicContact CG2-CD1 3.52Å |
| 166 | E | 88.4 | Confident | 90.4 | Very high | 40 Ų | 40 | 27.8 Ų | 27.8 | 19% | 0.187 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -74.7 | -36.2 | -175.4 | -165.6 | 61.8 | -156.2 | 0 | 0 | 112.6 | K162 L163 | K162-E166 VanDerWaalsContact O-CB 3.25Å; K162-E166 WeakPolarHBondContact O-CB 3.45Å; K162-E166 PolarHBondContact O-N 3.12Å; L163-E166 PolarHBondContact O-N 2.99Å |
| 167 | L | 90.4 | Very high | 91 | Very high | 24 Ų | 24 | 26.8 Ų | 26.8 | 13% | 0.126 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -88 | -6.1 | 176.5 | -63.4 | -174.3 | 0 | 0 | 0 | 113.7 | L163 C169 A249 V250 K253 | L163-L167 HydrophobicContact CD1-CD1 3.45Å; L163-L167 VanDerWaalsContact CD1-CD1 3.45Å; L163-L167 HydrophobicContact CD1-CG 4.05Å; L163-L167 HydrophobicContact CG-CD1 3.86Å; L163-L167 HydrophobicContact CG-CG 4.46Å; L163-L167 VanDerWaalsContact O-CB 3.26Å; L163-L167 WeakPolarHBondContact O-CB 3.46Å; L163-L167 WeakPolarHBondContact O-CG 3.5Å; L163-L167 PolarHBondContact O-N 3.25Å; L167-C169 VanDerWaalsContact C-N 3.34Å; L167-C169 VanDerWaalsContact CB-SG 3.53Å; L167-C169 PolarHBondContact O-N 2.87Å; L167-A249 HydrophobicContact CB-CB 4.34Å; L167-V250 HydrophobicContact CD1-CG2 3.34Å; L167-K253 HydrophobicContact CD2-CD 3.51Å; L167-K253 VanDerWaalsContact CD2-CE 3.43Å; L167-K253 HydrophobicContact CD2-CG 4.33Å |
| 168 | E | 94.1 | Very high | 91.2 | Very high | 103 Ų | 103 | 26.9 Ų | 26.9 | 48% | 0.481 | 13% | 0.128 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 53.8 | 52 | -177 | -58.4 | -174.8 | 169.4 | 0 | 0 | 111.6 | M164 I165 K213 N241 | M164-E168 WeakPolarHBondContact O-CA 3Å; M164-E168 PolarHBondContact O-N 3.41Å; I165-E168 PolarHBondContact O-N 3.34Å; E168-K213 VanDerWaalsContact CG-NZ 3.31Å; E168-K213 IonicContact OE1-NZ 3.74Å; E168-K213 PolarHBondContact OE1-NZ 3.43Å; E168-N241 WeakPolarHBondContact CA-ND2 3.4Å; E168-N241 VanDerWaalsContact O-CB 3.3Å; E168-N241 WeakPolarHBondContact O-CB 3.47Å |
| 169 | C | 96.4 | Very high | 91.5 | Very high | 0 Ų | 0 | 30 Ų | 30 | 0% | 0 | 15% | 0.15 | C | C | . | . | trans | -130.1 | 171 | -179.9 | 58 | 0 | 0 | 0 | 0 | 110.8 | M164 L167 V244 C246 A249 | M164-C169 WeakPolarHBondContact CB-O 3.24Å; M164-C169 PolarHBondContact O-N 2.89Å; L167-C169 VanDerWaalsContact C-N 3.34Å; L167-C169 VanDerWaalsContact CB-SG 3.53Å; L167-C169 PolarHBondContact O-N 2.87Å; C169-V244 CarbonylContact C-O 3.56Å; C169-V244 WeakPolarHBondContact CA-O 3.01Å; C169-V244 HydrophobicContact CB-CG1 4.19Å; C169-V244 WeakPolarHBondContact CB-O 3.41Å; C169-C246 HydrophobicContact CB-CB 3.94Å; C169-C246 WeakPolarHBondContact CB-SG 3.11Å; C169-C246 WeakPolarHBondContact SG-CA 3.43Å; C169-C246 WeakPolarHBondContact SG-CB 3.19Å; C169-C246 CovalentContact SG-SG 2.03Å; C169-C246 PolarHBondContact SG-SG 3.26Å; C169-A249 HydrophobicContact CB-CB 4Å | ||
| 170 | C | 96.2 | Very high | 91.7 | Very high | 0 Ų | 0 | 30.3 Ų | 30.3 | 0% | 0 | 15% | 0.153 | C | C | . | . | trans | -143.1 | 119.8 | -179.3 | -176.1 | 0 | 0 | 0 | 0 | 110.2 | G174 F178 C207 N241 V244 | C170-G174 CarbonylContact O-C 3.41Å; C170-G174 WeakPolarHBondContact O-CA 3.05Å; C170-G174 PolarHBondContact O-N 3.49Å; C170-F178 VanDerWaalsContact SG-CE2 3.54Å; C170-C207 WeakPolarHBondContact CA-SG 3.1Å; C170-C207 HydrophobicContact CB-CB 3.6Å; C170-C207 WeakPolarHBondContact CB-SG 3.05Å; C170-C207 WeakPolarHBondContact SG-CB 3.19Å; C170-C207 CovalentContact SG-SG 2.04Å; C170-C207 PolarHBondContact SG-SG 3.19Å; C170-N241 VanDerWaalsContact CB-O 3.31Å; C170-N241 WeakPolarHBondContact CB-O 3.37Å; C170-V244 PolarHBondContact N-O 2.03Å | ||
| 171 | G | 94.7 | Very high | 91.7 | Very high | 1 Ų | 1 | 33 Ų | 33 | 1% | 0.01 | 17% | 0.171 | C | C | . | . | S | Bend | trans | 65.5 | 173.6 | -171 | 0 | 0 | 0 | 0 | 0 | 111.9 | M164 C246 | M164-G171 PolarHBondContact SD-N 2.96Å; M164-G171 VanDerWaalsContact SD-N 3.4Å; G171-C246 WeakPolarHBondContact O-CB 3.31Å; G171-C246 PolarHBondContact O-N 3.48Å; G171-C246 PolarHBondContact O-SG 3.02Å |
| 172 | L | 94.1 | Very high | 91.5 | Very high | 7 Ų | 7 | 42.5 Ų | 42.5 | 4% | 0.037 | 21% | 0.207 | C | C | . | . | S | Bend | trans | -74.6 | -43.3 | 174.6 | -73.1 | -179.6 | 0 | 0 | 0 | 111.6 | M133 F137 D177 G245 C246 L247 | M133-L172 HydrophobicContact CB-CD1 4.07Å; M133-L172 HydrophobicContact CG-CD1 3.65Å; M133-L172 HydrophobicContact CG-CD2 4.24Å; M133-L172 WeakPolarHBondContact O-CD1 3.46Å; F137-L172 HydrophobicContact CB-CD1 3.31Å; F137-L172 HydrophobicContact CB-CG 3.94Å; F137-L172 HydrophobicContact CD1-CD1 4.41Å; F137-L172 HydrophobicContact CD1-CG 4.28Å; F137-L172 HydrophobicContact CD2-CD1 4.37Å; F137-L172 HydrophobicContact CD2-CG 4.13Å; F137-L172 HydrophobicContact CG-CD1 3.81Å; F137-L172 HydrophobicContact CG-CG 3.86Å; L172-D177 WeakPolarHBondContact CA-OD2 3.36Å; L172-D177 PolarHBondContact N-OD2 3.23Å; L172-G245 CarbonylContact O-C 3.52Å; L172-G245 VanDerWaalsContact O-C 3.32Å; L172-G245 WeakPolarHBondContact O-CA 3.04Å; L172-C246 HydrophobicContact CD2-CB 4.4Å; L172-C246 PolarHBondContact O-N 3.07Å; L172-L247 HydrophobicContact CB-CD1 3.95Å; L172-L247 HydrophobicContact CB-CG 4.05Å; L172-L247 HydrophobicContact CD2-CD2 4.38Å; L172-L247 HydrophobicContact CD2-CG 4.21Å; L172-L247 WeakPolarHBondContact O-CB 3.21Å; L172-L247 PolarHBondContact O-N 3.4Å |
| 173 | N | 93.2 | Very high | 91.7 | Very high | 81 Ų | 81 | 42 Ų | 42 | 43% | 0.433 | 21% | 0.205 | S | C | . | . | S | Bend | trans | -105.6 | -6.8 | -179.6 | -56.9 | -68.8 | 0 | 0 | 0 | 113.3 | T134 D177 | T134-N173 WeakPolarHBondContact CG2-ND2 3.46Å; T134-N173 PolarHBondContact OG1-ND2 2.96Å; N173-D177 PolarHBondContact N-OD2 2.92Å; N173-D177 PolarHBondContact ND2-OD1 3.47Å |
| 174 | G | 94 | Very high | 91.7 | Very high | 1 Ų | 1 | 40.9 Ų | 40.9 | 1% | 0.01 | 20% | 0.201 | C | C | . | . | trans | 133.7 | -179.4 | -174.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | C170 Q176 D177 | C170-G174 CarbonylContact O-C 3.41Å; C170-G174 WeakPolarHBondContact O-CA 3.05Å; C170-G174 PolarHBondContact O-N 3.49Å; G174-Q176 PolarHBondContact O-N 2.85Å; G174-D177 PolarHBondContact O-N 3.04Å | ||
| 175 | Y | 93 | Very high | 91.6 | Very high | 78 Ų | 78 | 41.2 Ų | 41.2 | 31% | 0.306 | 20% | 0.202 | S | C | . | . | G | 310 helix | trans | -60.1 | -19.6 | -179.8 | 80.2 | -82.3 | 0 | 0 | 0 | 114.5 | D177 F178 M242 | Y175-D177 PolarHBondContact O-N 3.43Å; Y175-F178 WeakPolarHBondContact O-CB 3.49Å; Y175-F178 PolarHBondContact O-N 2.8Å; Y175-M242 WeakPolarHBondContact CB-O 3.23Å; Y175-M242 HydrophobicContact CD1-CB 4.37Å; Y175-M242 HydrophobicContact CD1-CE 3.56Å; Y175-M242 HydrophobicContact CD1-CG 4.37Å; Y175-M242 WeakPolarHBondContact CD1-O 3.31Å; Y175-M242 HydrophobicContact CD2-CE 3.49Å; Y175-M242 VanDerWaalsContact CD2-CE 3.49Å; Y175-M242 HydrophobicContact CE1-CE 3.82Å; Y175-M242 HydrophobicContact CE2-CE 3.77Å; Y175-M242 HydrophobicContact CG-CB 4.28Å; Y175-M242 HydrophobicContact CG-CE 3.37Å; Y175-M242 PolarHBondContact N-O 3.08Å |
| 176 | Q | 92.5 | Very high | 91.5 | Very high | 101 Ų | 101 | 44 Ų | 44 | 47% | 0.472 | 21% | 0.213 | S | C | . | . | G | 310 helix | trans | -60.9 | -25.9 | 179.7 | -59.7 | 87.6 | -15.3 | 0 | 0 | 112.2 | G174 F178 S179 | G174-Q176 PolarHBondContact O-N 2.85Å; Q176-F178 PolarHBondContact O-N 2.81Å; Q176-F178 VanDerWaalsContact O-N 3.17Å; Q176-S179 WeakPolarHBondContact O-CB 3.47Å; Q176-S179 PolarHBondContact O-N 2.93Å |
| 177 | D | 92.1 | Very high | 91.5 | Very high | 12 Ų | 12 | 48 Ų | 48 | 6% | 0.064 | 24% | 0.235 | C | C | . | . | G | 310 helix | trans | -59.2 | -26.8 | 175.3 | -65.4 | -15.8 | 0 | 0 | 0 | 111.7 | F137 L172 N173 G174 Y175 | F137-D177 HydrophobicContact CD1-CB 4.44Å; F137-D177 HydrophobicContact CE1-CB 4.09Å; L172-D177 WeakPolarHBondContact CA-OD2 3.36Å; L172-D177 PolarHBondContact N-OD2 3.23Å; N173-D177 PolarHBondContact N-OD2 2.92Å; N173-D177 PolarHBondContact ND2-OD1 3.47Å; G174-D177 PolarHBondContact O-N 3.04Å; Y175-D177 PolarHBondContact O-N 3.43Å |
| 178 | F | 92.1 | Very high | 91.4 | Very high | 3 Ų | 3 | 49.4 Ų | 49.4 | 1% | 0.013 | 24% | 0.244 | C | C | . | . | G | 310 helix | trans | -87.8 | -13.2 | 178.7 | -58.6 | -58.6 | 0 | 0 | 0 | 114.1 | F137 Y141 M164 C170 Y175 Q176 N180 W185 P204 C207 | F137-F178 AromaticContact CE1-CE1 3.78Å; F137-F178 HydrophobicContact CE1-CE1 3.78Å; F137-F178 HydrophobicContact CE1-CZ 4.02Å; F137-F178 AromaticContact CZ-CE1 3.62Å; F137-F178 HydrophobicContact CZ-CE1 3.62Å; F137-F178 AromaticContact CZ-CZ 3.66Å; F137-F178 HydrophobicContact CZ-CZ 3.66Å; Y141-F178 HydrophobicContact CD1-CD1 4.48Å; Y141-F178 AromaticContact CD1-CE1 3.69Å; Y141-F178 HydrophobicContact CD1-CE1 3.69Å; Y141-F178 HydrophobicContact CE1-CD1 4.27Å; Y141-F178 AromaticContact CE1-CE1 3.41Å; Y141-F178 HydrophobicContact CE1-CE1 3.41Å; Y141-F178 VanDerWaalsContact CE1-CE1 3.41Å; Y141-F178 HydrophobicContact CE1-CZ 4.15Å; M164-F178 HydrophobicContact CE-CZ 4.37Å; M164-F178 HydrophobicContact SD-CE2 4.47Å; M164-F178 HydrophobicContact SD-CZ 3.92Å; C170-F178 VanDerWaalsContact SG-CE2 3.54Å; Y175-F178 WeakPolarHBondContact O-CB 3.49Å; Y175-F178 PolarHBondContact O-N 2.8Å; Q176-F178 PolarHBondContact O-N 2.81Å; Q176-F178 VanDerWaalsContact O-N 3.17Å; F178-N180 VanDerWaalsContact C-N 3.3Å; F178-W185 HydrophobicContact CB-CE3 3.79Å; F178-W185 HydrophobicContact CB-CH2 4.33Å; F178-W185 HydrophobicContact CB-CZ3 3.58Å; F178-W185 AromaticContact CD1-CD2 4Å; F178-W185 HydrophobicContact CD1-CD2 4Å; F178-W185 AromaticContact CD1-CE3 3.84Å; F178-W185 HydrophobicContact CD1-CE3 3.84Å; F178-W185 HydrophobicContact CD1-CG 4.34Å; F178-W185 HydrophobicContact CD1-CZ3 4.34Å; F178-W185 HydrophobicContact CG-CE3 4.21Å; F178-W185 HydrophobicContact CG-CZ3 4.27Å; F178-W185 WeakPolarHBondContact O-CZ3 3.46Å; F178-P204 HydrophobicContact CD1-CG 3.73Å; F178-P204 HydrophobicContact CD2-CG 4.29Å; F178-P204 HydrophobicContact CE1-CG 3.45Å; F178-P204 VanDerWaalsContact CE1-CG 3.45Å; F178-P204 HydrophobicContact CE2-CG 4.03Å; F178-P204 HydrophobicContact CG-CG 4.15Å; F178-P204 HydrophobicContact CZ-CG 3.59Å; F178-C207 VanDerWaalsContact CE2-SG 3.51Å |
| 179 | S | 89.5 | Confident | 91 | Very high | 72 Ų | 72 | 45.8 Ų | 45.8 | 50% | 0.503 | 23% | 0.234 | S | C | . | . | S | Bend | trans | -83.1 | -10.2 | 172.1 | -57.3 | 0 | 0 | 0 | 0 | 112.1 | Q176 T181 | Q176-S179 WeakPolarHBondContact O-CB 3.47Å; Q176-S179 PolarHBondContact O-N 2.93Å; S179-T181 PolarHBondContact O-N 3.48Å |
| 180 | N | 85.8 | Confident | 90.7 | Very high | 30 Ų | 30 | 46.7 Ų | 46.7 | 16% | 0.16 | 24% | 0.238 | C | C | . | . | trans | -72.3 | 109.7 | 178.1 | -175.8 | -8.3 | 0 | 0 | 0 | 110.2 | E138 F178 R182 S183 Y186 | E138-N180 PolarHBondContact OE1-ND2 2.84Å; E138-N180 PolarHBondContact OE2-ND2 3.34Å; E138-N180 VanDerWaalsContact OE2-ND2 3.16Å; F178-N180 VanDerWaalsContact C-N 3.3Å; N180-R182 PolarHBondContact O-N 3.07Å; N180-R182 VanDerWaalsContact O-N 3.09Å; N180-R182 WeakPolarHBondContact OD1-CB 3.44Å; N180-R182 PolarHBondContact OD1-N 3.35Å; N180-S183 WeakPolarHBondContact O-CB 2.94Å; N180-S183 PolarHBondContact O-N 3.34Å; N180-S183 PolarHBondContact O-OG 2.95Å; N180-Y186 WeakPolarHBondContact O-CB 3.33Å | ||
| 181 | T | 87.6 | Confident | 90.2 | Very high | 81 Ų | 81 | 51.4 Ų | 51.4 | 50% | 0.497 | 26% | 0.258 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.5 | -14.9 | -178.9 | 59.7 | 0 | 0 | 0 | 0 | 114.1 | S179 Y186 | S179-T181 PolarHBondContact O-N 3.48Å; T181-Y186 HydrophobicContact CG2-CD1 4.38Å; T181-Y186 HydrophobicContact CG2-CD2 4.5Å; T181-Y186 HydrophobicContact CG2-CE1 3.91Å; T181-Y186 HydrophobicContact CG2-CE2 4.03Å |
| 182 | R | 87.1 | Confident | 89.8 | Confident | 201 Ų | 201 | 52.1 Ų | 52.1 | 76% | 0.758 | 26% | 0.261 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.8 | -8.3 | 174.9 | -62 | -174.7 | -71.6 | 173.2 | -3 | 113.4 | N180 | N180-R182 PolarHBondContact O-N 3.07Å; N180-R182 VanDerWaalsContact O-N 3.09Å; N180-R182 WeakPolarHBondContact OD1-CB 3.44Å; N180-R182 PolarHBondContact OD1-N 3.35Å |
| 183 | S | 90 | Very high | 89.3 | Confident | 4 Ų | 4 | 54.9 Ų | 54.9 | 3% | 0.028 | 28% | 0.279 | C | S | . | . | S | Bend | trans | -69.8 | 145.3 | 177.7 | 69.5 | 0 | 0 | 0 | 0 | 111.1 | E138 N180 W185 Y186 L187 | E138-S183 CarbonylContact O-C 3.04Å; E138-S183 WeakPolarHBondContact O-CA 3.43Å; N180-S183 WeakPolarHBondContact O-CB 2.94Å; N180-S183 PolarHBondContact O-N 3.34Å; N180-S183 PolarHBondContact O-OG 2.95Å; S183-W185 PolarHBondContact O-N 3.1Å; S183-Y186 PolarHBondContact O-N 3.12Å; S183-Y186 VanDerWaalsContact O-N 3.12Å; S183-Y186 WeakPolarHBondContact OG-CB 3.12Å; S183-Y186 PolarHBondContact OG-N 2.92Å; S183-L187 VanDerWaalsContact O-CG 3.31Å; S183-L187 WeakPolarHBondContact O-CG 2.99Å; S183-L187 PolarHBondContact O-N 2.68Å |
| 184 | S | 90.1 | Very high | 88.9 | Confident | 15 Ų | 15 | 54.9 Ų | 54.9 | 11% | 0.105 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -55.4 | -40.5 | 175.9 | -95.9 | 0 | 0 | 0 | 0 | 111.9 | E138 S139 Y141 Y186 L187 V188 | E138-S184 PolarHBondContact O-N 3Å; S139-S184 WeakPolarHBondContact O-CB 3.39Å; S139-S184 PolarHBondContact O-OG 3.45Å; Y141-S184 CarbonylContact O-C 3.32Å; Y141-S184 VanDerWaalsContact O-CB 3.27Å; Y141-S184 WeakPolarHBondContact O-CB 3.27Å; S184-Y186 VanDerWaalsContact C-N 3.35Å; S184-Y186 PolarHBondContact O-N 2.6Å; S184-L187 PolarHBondContact O-N 3.06Å; S184-V188 WeakPolarHBondContact O-CG1 3.21Å; S184-V188 WeakPolarHBondContact O-CG2 3.5Å; S184-V188 PolarHBondContact O-N 2.94Å |
| 185 | W | 89.9 | Confident | 88.4 | Confident | 10 Ų | 10 | 58 Ų | 58 | 4% | 0.038 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -59.4 | -42.7 | 176.6 | -176.5 | 79.9 | 0 | 0 | 0 | 112.8 | Y141 R142 F178 S183 V188 R190 I201 P204 | Y141-W185 HydrophobicContact CD1-CB 3.91Å; Y141-W185 HydrophobicContact CD1-CG 4.19Å; Y141-W185 HydrophobicContact CE1-CB 4.24Å; Y141-W185 AromaticContact CE1-CD1 3.67Å; Y141-W185 HydrophobicContact CE1-CG 4.01Å; Y141-W185 WeakPolarHBondContact O-CB 3.3Å; Y141-W185 PolarHBondContact O-N 3.02Å; R142-W185 VanDerWaalsContact O-CD1 3.27Å; F178-W185 HydrophobicContact CB-CE3 3.79Å; F178-W185 HydrophobicContact CB-CH2 4.33Å; F178-W185 HydrophobicContact CB-CZ3 3.58Å; F178-W185 AromaticContact CD1-CD2 4Å; F178-W185 HydrophobicContact CD1-CD2 4Å; F178-W185 AromaticContact CD1-CE3 3.84Å; F178-W185 HydrophobicContact CD1-CE3 3.84Å; F178-W185 HydrophobicContact CD1-CG 4.34Å; F178-W185 HydrophobicContact CD1-CZ3 4.34Å; F178-W185 HydrophobicContact CG-CE3 4.21Å; F178-W185 HydrophobicContact CG-CZ3 4.27Å; F178-W185 WeakPolarHBondContact O-CZ3 3.46Å; S183-W185 PolarHBondContact O-N 3.1Å; W185-V188 VanDerWaalsContact O-CG2 3.3Å; W185-V188 WeakPolarHBondContact O-CG2 3.13Å; W185-R190 HydrophobicContact CD2-CG 3.81Å; W185-R190 HydrophobicContact CE3-CG 3.59Å; W185-R190 HydrophobicContact CH2-CB 4.01Å; W185-R190 HydrophobicContact CH2-CG 3.49Å; W185-R190 VanDerWaalsContact CH2-CG 3.49Å; W185-R190 HydrophobicContact CZ2-CB 3.94Å; W185-R190 HydrophobicContact CZ2-CG 3.69Å; W185-R190 HydrophobicContact CZ3-CB 4.43Å; W185-R190 HydrophobicContact CZ3-CG 3.42Å; W185-R190 VanDerWaalsContact CZ3-CG 3.42Å; W185-I201 HydrophobicContact CH2-CG2 4.16Å; W185-I201 HydrophobicContact CZ2-CG2 3.87Å; W185-P204 HydrophobicContact CD2-CG 4.33Å; W185-P204 HydrophobicContact CZ2-CB 4.47Å; W185-P204 HydrophobicContact CZ2-CG 3.94Å |
| 186 | Y | 90.1 | Very high | 88.3 | Confident | 61 Ų | 61 | 55.5 Ų | 55.5 | 24% | 0.239 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -65.6 | -44.9 | 175.4 | -161.8 | -77.3 | 0 | 0 | 0 | 111 | N180 T181 S183 S184 V188 G189 R190 | N180-Y186 WeakPolarHBondContact O-CB 3.33Å; T181-Y186 HydrophobicContact CG2-CD1 4.38Å; T181-Y186 HydrophobicContact CG2-CD2 4.5Å; T181-Y186 HydrophobicContact CG2-CE1 3.91Å; T181-Y186 HydrophobicContact CG2-CE2 4.03Å; S183-Y186 PolarHBondContact O-N 3.12Å; S183-Y186 VanDerWaalsContact O-N 3.12Å; S183-Y186 WeakPolarHBondContact OG-CB 3.12Å; S183-Y186 PolarHBondContact OG-N 2.92Å; S184-Y186 VanDerWaalsContact C-N 3.35Å; S184-Y186 PolarHBondContact O-N 2.6Å; Y186-V188 PolarHBondContact O-N 3.05Å; Y186-G189 PolarHBondContact O-N 3.22Å; Y186-G189 VanDerWaalsContact O-N 3.13Å; Y186-R190 VanDerWaalsContact CE2-CZ 3.45Å; Y186-R190 VanDerWaalsContact CZ-NH2 3.29Å; Y186-R190 PolarHBondContact OH-NH2 2.93Å |
| 187 | L | 89.2 | Confident | 88.2 | Confident | 124 Ų | 124 | 53.8 Ų | 53.8 | 65% | 0.649 | 30% | 0.303 | S | S | * | . | H | α-helix | trans | -67 | -30.9 | -176.3 | -67 | 174 | 0 | 0 | 0 | 113.8 | S183 S184 G189 | S183-L187 VanDerWaalsContact O-CG 3.31Å; S183-L187 WeakPolarHBondContact O-CG 2.99Å; S183-L187 PolarHBondContact O-N 2.68Å; S184-L187 PolarHBondContact O-N 3.06Å; L187-G189 PolarHBondContact O-N 3.48Å |
| 188 | V | 86.8 | Confident | 88.1 | Confident | 52 Ų | 52 | 54 Ų | 54 | 32% | 0.315 | 31% | 0.309 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.7 | -3.2 | 175.6 | -61.4 | 0 | 0 | 0 | 0 | 113.5 | R142 S184 W185 Y186 | R142-V188 HydrophobicContact CB-CG2 4.31Å; R142-V188 HydrophobicContact CG-CG1 3.99Å; R142-V188 HydrophobicContact CG-CG2 4.5Å; S184-V188 WeakPolarHBondContact O-CG1 3.21Å; S184-V188 WeakPolarHBondContact O-CG2 3.5Å; S184-V188 PolarHBondContact O-N 2.94Å; W185-V188 VanDerWaalsContact O-CG2 3.3Å; W185-V188 WeakPolarHBondContact O-CG2 3.13Å; Y186-V188 PolarHBondContact O-N 3.05Å |
| 189 | G | 87.2 | Confident | 88.1 | Confident | 27 Ų | 27 | 59.4 Ų | 59.4 | 28% | 0.278 | 34% | 0.338 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 92.6 | 11.6 | 168.9 | 0 | 0 | 0 | 0 | 0 | 115.8 | Y186 L187 K191 G198 | Y186-G189 PolarHBondContact O-N 3.22Å; Y186-G189 VanDerWaalsContact O-N 3.13Å; L187-G189 PolarHBondContact O-N 3.48Å; G189-K191 PolarHBondContact O-N 2.82Å; G189-G198 PolarHBondContact O-N 3.3Å |
| 190 | R | 89.9 | Confident | 88.2 | Confident | 20 Ų | 20 | 61.6 Ų | 61.6 | 8% | 0.075 | 34% | 0.34 | C | S | . | . | trans | 50.5 | 56.9 | 170.1 | -57.8 | 172.7 | -80.8 | 170.7 | -5 | 113.2 | W185 Y186 S197 G198 D199 I201 | W185-R190 HydrophobicContact CD2-CG 3.81Å; W185-R190 HydrophobicContact CE3-CG 3.59Å; W185-R190 HydrophobicContact CH2-CB 4.01Å; W185-R190 HydrophobicContact CH2-CG 3.49Å; W185-R190 VanDerWaalsContact CH2-CG 3.49Å; W185-R190 HydrophobicContact CZ2-CB 3.94Å; W185-R190 HydrophobicContact CZ2-CG 3.69Å; W185-R190 HydrophobicContact CZ3-CB 4.43Å; W185-R190 HydrophobicContact CZ3-CG 3.42Å; W185-R190 VanDerWaalsContact CZ3-CG 3.42Å; Y186-R190 VanDerWaalsContact CE2-CZ 3.45Å; Y186-R190 VanDerWaalsContact CZ-NH2 3.29Å; Y186-R190 PolarHBondContact OH-NH2 2.93Å; R190-S197 WeakPolarHBondContact O-CA 3.18Å; R190-G198 PolarHBondContact NE-O 3.32Å; R190-G198 PolarHBondContact NH1-O 2.6Å; R190-G198 PolarHBondContact O-N 3.35Å; R190-D199 IonicContact CZ-OD1 3.19Å; R190-D199 IonicContact NH1-OD1 2.82Å; R190-D199 PolarHBondContact NH1-OD1 3.4Å; R190-D199 IonicContact NH2-OD1 2.67Å; R190-D199 PolarHBondContact NH2-OD1 3.04Å; R190-I201 HydrophobicContact CB-CB 4.12Å; R190-I201 HydrophobicContact CB-CG2 4.31Å; R190-I201 VanDerWaalsContact O-CG1 3.31Å; R190-I201 WeakPolarHBondContact O-CG1 3.43Å | ||
| 191 | K | 84.5 | Confident | 88.5 | Confident | 99 Ų | 99 | 60.3 Ų | 60.3 | 43% | 0.43 | 33% | 0.333 | S | S | . | . | trans | -80.1 | 148 | -175.9 | -60.5 | 179.4 | -176.2 | 177.3 | 0 | 111.7 | G146 I150 G189 | G146-K191 CarbonylContact C-O 3.45Å; G146-K191 CarbonylContact O-C 3.46Å; I150-K191 HydrophobicContact CD1-CD 4.23Å; G189-K191 PolarHBondContact O-N 2.82Å | ||
| 192 | Y | 86.6 | Confident | 88.8 | Confident | 15 Ų | 15 | 61.8 Ų | 61.8 | 6% | 0.059 | 33% | 0.333 | C | S | . | . | trans | -131 | 151 | 174.1 | -165.6 | -118.3 | 0 | 0 | 0 | 110.9 | D194 G195 T196 I201 P205 F224 Q225 V234 | Y192-D194 HydrophobicContact CD1-CB 4.24Å; Y192-D194 WeakPolarHBondContact CD1-OD1 3.49Å; Y192-D194 PolarHBondContact O-N 3.37Å; Y192-D194 VanDerWaalsContact O-N 3.1Å; Y192-G195 PolarHBondContact O-N 3.18Å; Y192-T196 PolarHBondContact N-O 3.47Å; Y192-I201 HydrophobicContact CD1-CD1 4.42Å; Y192-I201 HydrophobicContact CG-CD1 4.07Å; Y192-P205 HydrophobicContact CD2-CG 3.9Å; Y192-P205 HydrophobicContact CE2-CB 4.4Å; Y192-P205 HydrophobicContact CE2-CG 3.57Å; Y192-F224 AromaticContact CE2-CE2 3.84Å; Y192-F224 HydrophobicContact CE2-CE2 3.84Å; Y192-F224 AromaticContact CE2-CZ 3.77Å; Y192-F224 HydrophobicContact CE2-CZ 3.77Å; Y192-Q225 PolarHBondContact OH-NE2 2.82Å; Y192-V234 HydrophobicContact CD1-CG2 4.07Å; Y192-V234 HydrophobicContact CD2-CG1 4.38Å; Y192-V234 HydrophobicContact CD2-CG2 4.22Å; Y192-V234 HydrophobicContact CE1-CG2 3.99Å; Y192-V234 HydrophobicContact CE2-CG1 3.98Å; Y192-V234 HydrophobicContact CE2-CG2 4.15Å; Y192-V234 HydrophobicContact CG-CG2 4.21Å | ||
| 193 | P | 83.6 | Confident | 89.1 | Confident | 66 Ų | 66 | 52.2 Ų | 52.2 | 43% | 0.429 | 30% | 0.297 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.1 | -16.2 | -171.1 | -23.4 | 34.7 | 0 | 0 | 0 | 115.7 | G195 F224 | P193-G195 PolarHBondContact O-N 2.86Å; P193-F224 HydrophobicContact CG-CE1 4.19Å; P193-F224 HydrophobicContact CG-CZ 4.04Å |
| 194 | D | 85.2 | Confident | 89.2 | Confident | 81 Ų | 81 | 52.1 Ų | 52.1 | 43% | 0.433 | 30% | 0.296 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.2 | 2.6 | 175.4 | 72.7 | -7.4 | 0 | 0 | 0 | 113.5 | Y192 T196 K235 | Y192-D194 HydrophobicContact CD1-CB 4.24Å; Y192-D194 WeakPolarHBondContact CD1-OD1 3.49Å; Y192-D194 PolarHBondContact O-N 3.37Å; Y192-D194 VanDerWaalsContact O-N 3.1Å; D194-T196 VanDerWaalsContact OD1-CB 3.31Å; D194-T196 WeakPolarHBondContact OD1-CB 3.18Å; D194-T196 WeakPolarHBondContact OD1-CG2 3.28Å; D194-T196 PolarHBondContact OD1-N 3.09Å; D194-T196 PolarHBondContact OD1-OG1 3.08Å; D194-T196 PolarHBondContact OD2-OG1 2.95Å; D194-K235 WeakPolarHBondContact OD2-CE 3.42Å; D194-K235 IonicContact OD2-NZ 2.68Å; D194-K235 PolarHBondContact OD2-NZ 3.48Å |
| 195 | G | 84.8 | Confident | 89.4 | Confident | 67 Ų | 67 | 51.7 Ų | 51.7 | 69% | 0.691 | 29% | 0.293 | S | S | * | . | S | Bend | trans | 91.3 | -7.8 | -178.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | Y192 P193 | Y192-G195 PolarHBondContact O-N 3.18Å; P193-G195 PolarHBondContact O-N 2.86Å |
| 196 | T | 89.6 | Confident | 89.5 | Confident | 24 Ų | 24 | 51.2 Ų | 51.2 | 15% | 0.147 | 29% | 0.291 | C | S | . | . | trans | -72.2 | 149.2 | 174.1 | 59.1 | 0 | 0 | 0 | 0 | 111.6 | Y192 D194 E200 I201 K235 | Y192-T196 PolarHBondContact N-O 3.47Å; D194-T196 VanDerWaalsContact OD1-CB 3.31Å; D194-T196 WeakPolarHBondContact OD1-CB 3.18Å; D194-T196 WeakPolarHBondContact OD1-CG2 3.28Å; D194-T196 PolarHBondContact OD1-N 3.09Å; D194-T196 PolarHBondContact OD1-OG1 3.08Å; D194-T196 PolarHBondContact OD2-OG1 2.95Å; T196-E200 VanDerWaalsContact CG2-OE2 3.27Å; T196-E200 WeakPolarHBondContact CG2-OE2 3.45Å; T196-I201 WeakPolarHBondContact OG1-CD1 3.37Å; T196-K235 WeakPolarHBondContact OG1-CE 3.24Å | ||
| 197 | S | 90.6 | Very high | 89.8 | Confident | 65 Ų | 65 | 48.3 Ų | 48.3 | 46% | 0.455 | 28% | 0.279 | S | S | . | . | trans | -155.4 | 171.2 | -178.1 | 61.9 | 0 | 0 | 0 | 0 | 112.1 | R190 | R190-S197 WeakPolarHBondContact O-CA 3.18Š| ||
| 198 | G | 90.2 | Very high | 90.2 | Very high | 18 Ų | 18 | 42.4 Ų | 42.4 | 19% | 0.186 | 25% | 0.249 | C | C | . | . | G | 310 helix | trans | 68.2 | -137.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | G189 R190 E200 I201 | G189-G198 PolarHBondContact O-N 3.3Å; R190-G198 PolarHBondContact NE-O 3.32Å; R190-G198 PolarHBondContact NH1-O 2.6Å; R190-G198 PolarHBondContact O-N 3.35Å; G198-E200 PolarHBondContact O-N 3Å; G198-I201 PolarHBondContact O-N 2.85Å; G198-I201 VanDerWaalsContact O-N 3.08Å |
| 199 | D | 90.9 | Very high | 90.7 | Very high | 116 Ų | 116 | 43.5 Ų | 43.5 | 62% | 0.62 | 25% | 0.249 | S | C | * | . | G | 310 helix | trans | -69 | -15 | -171.8 | -67.1 | -40.4 | 0 | 0 | 0 | 114.6 | R190 I201 | R190-D199 IonicContact CZ-OD1 3.19Å; R190-D199 IonicContact NH1-OD1 2.82Å; R190-D199 PolarHBondContact NH1-OD1 3.4Å; R190-D199 IonicContact NH2-OD1 2.67Å; R190-D199 PolarHBondContact NH2-OD1 3.04Å; D199-I201 PolarHBondContact O-N 3.16Å |
| 200 | E | 92 | Very high | 91 | Very high | 118 Ų | 118 | 43 Ų | 43 | 55% | 0.551 | 24% | 0.239 | S | C | * | . | G | 310 helix | trans | -67 | -26.2 | 171.4 | -66.3 | -171.6 | 176.9 | 0 | 0 | 112.1 | T196 G198 K235 | T196-E200 VanDerWaalsContact CG2-OE2 3.27Å; T196-E200 WeakPolarHBondContact CG2-OE2 3.45Å; G198-E200 PolarHBondContact O-N 3Å; E200-K235 WeakPolarHBondContact O-CA 3.32Å |
| 201 | I | 92.6 | Very high | 91.3 | Very high | 3 Ų | 3 | 46.6 Ų | 46.6 | 2% | 0.015 | 26% | 0.263 | C | S | . | . | trans | -97.9 | 103.7 | 176.9 | -57 | -56.3 | 0 | 0 | 0 | 108.8 | W185 R190 Y192 T196 G198 D199 V234 K235 | W185-I201 HydrophobicContact CH2-CG2 4.16Å; W185-I201 HydrophobicContact CZ2-CG2 3.87Å; R190-I201 HydrophobicContact CB-CB 4.12Å; R190-I201 HydrophobicContact CB-CG2 4.31Å; R190-I201 VanDerWaalsContact O-CG1 3.31Å; R190-I201 WeakPolarHBondContact O-CG1 3.43Å; Y192-I201 HydrophobicContact CD1-CD1 4.42Å; Y192-I201 HydrophobicContact CG-CD1 4.07Å; T196-I201 WeakPolarHBondContact OG1-CD1 3.37Å; G198-I201 PolarHBondContact O-N 2.85Å; G198-I201 VanDerWaalsContact O-N 3.08Å; D199-I201 PolarHBondContact O-N 3.16Å; I201-V234 HydrophobicContact CD1-CB 4.34Å; I201-V234 HydrophobicContact CD1-CG2 3.75Å; I201-V234 HydrophobicContact CG2-CB 4.5Å; I201-K235 HydrophobicContact CD1-CG 4.18Å | ||
| 202 | K | 93.1 | Very high | 91.6 | Very high | 112 Ų | 112 | 43.5 Ų | 43.5 | 49% | 0.487 | 25% | 0.254 | S | S | . | . | trans | -83.9 | -34.2 | -175.6 | -64.5 | -175.8 | -175.1 | 158.2 | 0 | 113.1 | V234 K235 T237 | K202-V234 PolarHBondContact N-O 2.98Å; K202-K235 WeakPolarHBondContact CD-O 3.35Å; K202-K235 WeakPolarHBondContact CE-O 2.95Å; K202-K235 PolarHBondContact NZ-O 2.93Å; K202-K235 VanDerWaalsContact NZ-O 3.09Å; K202-T237 HydrophobicContact CB-CG2 3.94Å; K202-T237 HydrophobicContact CD-CG2 4.09Å | ||
| 203 | I | 94.1 | Very high | 91.8 | Very high | 0 Ų | 0 | 44.9 Ų | 44.9 | 0% | 0 | 26% | 0.26 | C | S | . | . | S | Bend | trans | -142 | 152.7 | -178.9 | 57.6 | 179 | 0 | 0 | 0 | 110.4 | C207 V234 T237 | I203-C207 HydrophobicContact CB-CB 4.11Å; I203-C207 HydrophobicContact CD1-CB 3.81Å; I203-C207 HydrophobicContact CG1-CB 4.24Å; I203-V234 PolarHBondContact N-O 3.28Å; I203-T237 HydrophobicContact CD1-CG2 3.95Å; I203-T237 HydrophobicContact CG1-CG2 4.2Å; I203-T237 HydrophobicContact CG2-CG2 4.35Å |
| 204 | P | 93.2 | Very high | 91.9 | Very high | 1 Ų | 1 | 45.9 Ų | 45.9 | 1% | 0.006 | 26% | 0.262 | C | S | . | . | trans | -63.5 | 154 | 171.8 | -15 | 25.7 | 0 | 0 | 0 | 111.9 | Y141 F178 W185 A206 C207 | Y141-P204 HydrophobicContact CE1-CB 4.35Å; Y141-P204 HydrophobicContact CE1-CG 3.72Å; Y141-P204 WeakPolarHBondContact OH-CB 3.34Å; Y141-P204 WeakPolarHBondContact OH-CG 3.48Å; F178-P204 HydrophobicContact CD1-CG 3.73Å; F178-P204 HydrophobicContact CD2-CG 4.29Å; F178-P204 HydrophobicContact CE1-CG 3.45Å; F178-P204 VanDerWaalsContact CE1-CG 3.45Å; F178-P204 HydrophobicContact CE2-CG 4.03Å; F178-P204 HydrophobicContact CG-CG 4.15Å; F178-P204 HydrophobicContact CZ-CG 3.59Å; W185-P204 HydrophobicContact CD2-CG 4.33Å; W185-P204 HydrophobicContact CZ2-CB 4.47Å; W185-P204 HydrophobicContact CZ2-CG 3.94Å; P204-A206 PolarHBondContact O-N 3.37Å; P204-A206 VanDerWaalsContact O-N 3.11Å; P204-C207 WeakPolarHBondContact O-CB 3.2Å; P204-C207 PolarHBondContact O-N 3.34Å | ||
| 205 | P | 93.3 | Very high | 91.9 | Very high | 6 Ų | 6 | 42.4 Ų | 42.4 | 4% | 0.039 | 24% | 0.243 | C | C | . | . | G | 310 helix | trans | -61.7 | -23.8 | 178.8 | -23.6 | 35.4 | 0 | 0 | 0 | 114.2 | F145 Y192 C207 C208 Y210 F224 V234 | F145-P205 HydrophobicContact CB-CB 4.17Å; F145-P205 HydrophobicContact CB-CG 4.17Å; F145-P205 WeakPolarHBondContact O-CD 3.27Å; F145-P205 WeakPolarHBondContact O-CG 3.38Å; Y192-P205 HydrophobicContact CD2-CG 3.9Å; Y192-P205 HydrophobicContact CE2-CB 4.4Å; Y192-P205 HydrophobicContact CE2-CG 3.57Å; P205-C207 PolarHBondContact O-N 3.33Å; P205-C208 WeakPolarHBondContact O-CB 3.34Å; P205-C208 PolarHBondContact O-N 3.46Å; P205-Y210 PolarHBondContact O-OH 2.78Å; P205-F224 HydrophobicContact CB-CD2 3.88Å; P205-F224 HydrophobicContact CB-CE2 3.47Å; P205-F224 VanDerWaalsContact CB-CE2 3.47Å; P205-F224 HydrophobicContact CB-CZ 4.35Å; P205-F224 HydrophobicContact CG-CE2 3.78Å; P205-F224 HydrophobicContact CG-CZ 4.22Å; P205-V234 HydrophobicContact CB-CG1 4.09Å; P205-V234 HydrophobicContact CG-CG1 3.84Å |
| 206 | A | 93.1 | Very high | 91.8 | Very high | 0 Ų | 0 | 39.2 Ų | 39.2 | 0% | 0 | 21% | 0.21 | C | C | . | . | G | 310 helix | trans | -63.5 | -22.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | D161 M164 I165 P204 C208 | D161-A206 HydrophobicContact CB-CB 3.73Å; D161-A206 VanDerWaalsContact OD1-CB 3.24Å; D161-A206 WeakPolarHBondContact OD1-CB 3.3Å; M164-A206 HydrophobicContact CB-CB 4.03Å; M164-A206 HydrophobicContact CE-CB 3.84Å; I165-A206 HydrophobicContact CD1-CB 4.2Å; I165-A206 HydrophobicContact CG1-CB 4.02Å; I165-A206 WeakPolarHBondContact CG1-O 3.47Å; P204-A206 PolarHBondContact O-N 3.37Å; P204-A206 VanDerWaalsContact O-N 3.11Å; A206-C208 VanDerWaalsContact C-N 3.28Å; A206-C208 PolarHBondContact O-N 2.95Å |
| 207 | C | 96.3 | Very high | 91 | Very high | 0 Ų | 0 | 43.6 Ų | 43.6 | 0% | 0 | 22% | 0.224 | C | C | . | . | G | 310 helix | trans | -77.3 | -12 | 174.2 | -71.2 | 0 | 0 | 0 | 0 | 114 | C170 F178 I203 P204 P205 N241 | C170-C207 WeakPolarHBondContact CA-SG 3.1Å; C170-C207 HydrophobicContact CB-CB 3.6Å; C170-C207 WeakPolarHBondContact CB-SG 3.05Å; C170-C207 WeakPolarHBondContact SG-CB 3.19Å; C170-C207 CovalentContact SG-SG 2.04Å; C170-C207 PolarHBondContact SG-SG 3.19Å; F178-C207 VanDerWaalsContact CE2-SG 3.51Å; I203-C207 HydrophobicContact CB-CB 4.11Å; I203-C207 HydrophobicContact CD1-CB 3.81Å; I203-C207 HydrophobicContact CG1-CB 4.24Å; P204-C207 WeakPolarHBondContact O-CB 3.2Å; P204-C207 PolarHBondContact O-N 3.34Å; P205-C207 PolarHBondContact O-N 3.33Å; C207-N241 PolarHBondContact O-N 3.3Å |
| 208 | C | 96.8 | Very high | 90.4 | Very high | 1 Ų | 1 | 46.5 Ų | 46.5 | 1% | 0.007 | 23% | 0.234 | C | C | . | . | B | Isolated β-bridge | trans | -81.5 | 156.9 | -177.9 | -66.1 | 0 | 0 | 0 | 0 | 112 | P205 A206 Y210 L228 C233 | P205-C208 WeakPolarHBondContact O-CB 3.34Å; P205-C208 PolarHBondContact O-N 3.46Å; A206-C208 VanDerWaalsContact C-N 3.28Å; A206-C208 PolarHBondContact O-N 2.95Å; C208-Y210 WeakPolarHBondContact O-CD2 3.5Å; C208-Y210 WeakPolarHBondContact O-CE2 2.81Å; C208-L228 HydrophobicContact CB-CD2 3.37Å; C208-C233 WeakPolarHBondContact CA-SG 2.99Å; C208-C233 HydrophobicContact CB-CB 3.83Å; C208-C233 WeakPolarHBondContact CB-SG 3.32Å; C208-C233 WeakPolarHBondContact SG-CB 2.95Å; C208-C233 CovalentContact SG-SG 2.03Å; C208-C233 PolarHBondContact SG-SG 2.76Å |
| 209 | K | 97.2 | Very high | 89.8 | Confident | 75 Ų | 75 | 48.3 Ų | 48.3 | 33% | 0.326 | 25% | 0.248 | S | C | . | . | trans | -82.1 | 141.5 | 172.4 | -64.7 | 176.2 | -176.4 | 177.4 | 0 | 110.4 | K229 E239 S240 N241 | K209-K229 HydrophobicContact CB-CB 4.47Å; K209-K229 HydrophobicContact CB-CD 3.98Å; K209-K229 HydrophobicContact CB-CG 4.3Å; K209-K229 PolarHBondContact O-N 3.26Å; K209-E239 WeakPolarHBondContact CB-O 3.36Å; K209-E239 VanDerWaalsContact CG-O 3.24Å; K209-E239 WeakPolarHBondContact CG-O 3.3Å; K209-E239 PolarHBondContact N-O 3.13Å; K209-S240 WeakPolarHBondContact CE-O 3.4Å; K209-N241 VanDerWaalsContact CE-OD1 3.27Å; K209-N241 WeakPolarHBondContact CE-OD1 3.37Å | ||
| 210 | Y | 94.4 | Very high | 89.3 | Confident | 16 Ų | 16 | 45.6 Ų | 45.6 | 6% | 0.063 | 23% | 0.233 | C | C | . | . | B | Isolated β-bridge | trans | -111.4 | 147.5 | -179.6 | -68.1 | -96.9 | 0 | 0 | 0 | 111.3 | I165 P205 C208 S212 F215 F224 N227 L228 | I165-Y210 HydrophobicContact CD1-CE2 3.97Å; I165-Y210 HydrophobicContact CG1-CD2 4.33Å; I165-Y210 HydrophobicContact CG1-CE2 3.77Å; I165-Y210 HydrophobicContact CG2-CD2 4Å; I165-Y210 HydrophobicContact CG2-CE2 4.27Å; P205-Y210 PolarHBondContact O-OH 2.78Å; C208-Y210 WeakPolarHBondContact O-CD2 3.5Å; C208-Y210 WeakPolarHBondContact O-CE2 2.81Å; Y210-S212 WeakPolarHBondContact CB-O 3.26Å; Y210-F215 AromaticContact CD1-CE1 3.41Å; Y210-F215 HydrophobicContact CD1-CE1 3.41Å; Y210-F215 VanDerWaalsContact CD1-CE1 3.41Å; Y210-F215 AromaticContact CD1-CZ 3.68Å; Y210-F215 HydrophobicContact CD1-CZ 3.68Å; Y210-F215 AromaticContact CE1-CE1 3.69Å; Y210-F215 HydrophobicContact CE1-CE1 3.69Å; Y210-F215 HydrophobicContact CE1-CE2 4.49Å; Y210-F215 AromaticContact CE1-CZ 3.45Å; Y210-F215 HydrophobicContact CE1-CZ 3.45Å; Y210-F215 VanDerWaalsContact CE1-CZ 3.45Å; Y210-F215 HydrophobicContact CG-CE1 4.03Å; Y210-F215 HydrophobicContact CG-CZ 4.31Å; Y210-F215 AromaticContact CZ-CZ 3.96Å; Y210-F224 HydrophobicContact CE1-CB 4.08Å; Y210-F224 HydrophobicContact CE1-CD2 4.44Å; Y210-F224 WeakPolarHBondContact CE1-O 3.19Å; Y210-N227 CarbonylContact C-O 3.25Å; Y210-N227 WeakPolarHBondContact CA-O 3.49Å; Y210-N227 WeakPolarHBondContact CB-O 3.3Å; Y210-N227 HydrophobicContact CD1-CB 3.86Å; Y210-N227 WeakPolarHBondContact CD1-O 3.47Å; Y210-L228 HydrophobicContact CD1-CD2 4.26Å; Y210-L228 HydrophobicContact CE1-CD2 3.7Å; Y210-L228 HydrophobicContact CE1-CG 4.14Å; Y210-L228 HydrophobicContact CE2-CD2 4.2Å |
| 211 | T | 94.7 | Very high | 88.8 | Confident | 96 Ų | 96 | 42.3 Ų | 42.3 | 59% | 0.589 | 22% | 0.216 | S | C | * | . | S | Bend | trans | -74.8 | -39.6 | 171.3 | 50.8 | 0 | 0 | 0 | 0 | 111.1 | N227 K229 | T211-N227 PolarHBondContact N-O 3.31Å; T211-N227 PolarHBondContact OG1-O 3.06Å; T211-N227 VanDerWaalsContact OG1-O 3.13Å; T211-K229 HydrophobicContact CG2-CG 3.75Å |
| 212 | S | 92.1 | Very high | 88.2 | Confident | 33 Ų | 33 | 45.1 Ų | 45.1 | 23% | 0.231 | 25% | 0.246 | C | C | . | . | trans | -137 | 147.1 | 168.2 | 172.5 | 0 | 0 | 0 | 0 | 110.5 | Y210 D214 F215 N227 | Y210-S212 WeakPolarHBondContact CB-O 3.26Å; S212-D214 WeakPolarHBondContact OG-CB 3.41Å; S212-D214 PolarHBondContact OG-N 2.89Å; S212-D214 VanDerWaalsContact OG-N 3.08Å; S212-D214 PolarHBondContact OG-OD2 3.42Å; S212-F215 WeakPolarHBondContact O-CE1 3.04Å; S212-N227 WeakPolarHBondContact O-CB 3.24Å | ||
| 213 | K | 90 | Very high | 87.8 | Confident | 45 Ų | 45 | 44.8 Ų | 44.8 | 20% | 0.196 | 25% | 0.245 | C | C | . | . | trans | -103.8 | 7.2 | 174.9 | -58.9 | 177.7 | -172.5 | -178.6 | 0 | 112.4 | I165 E168 F215 L216 | I165-K213 HydrophobicContact CG2-CD 3.87Å; I165-K213 HydrophobicContact CG2-CG 3.95Å; I165-K213 WeakPolarHBondContact O-CE 3.4Å; I165-K213 PolarHBondContact O-NZ 3.37Å; E168-K213 VanDerWaalsContact CG-NZ 3.31Å; E168-K213 IonicContact OE1-NZ 3.74Å; E168-K213 PolarHBondContact OE1-NZ 3.43Å; K213-F215 PolarHBondContact O-N 3.38Å; K213-F215 VanDerWaalsContact O-N 3.12Å; K213-L216 WeakPolarHBondContact O-CB 3.48Å; K213-L216 PolarHBondContact O-N 2.89Å | ||
| 214 | D | 86.2 | Confident | 87.5 | Confident | 86 Ų | 86 | 45.2 Ų | 45.2 | 46% | 0.46 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -61.4 | -26.4 | -173.8 | -65 | -36.8 | 0 | 0 | 0 | 113.1 | S212 L216 R217 N218 | S212-D214 WeakPolarHBondContact OG-CB 3.41Å; S212-D214 PolarHBondContact OG-N 2.89Å; S212-D214 VanDerWaalsContact OG-N 3.08Å; S212-D214 PolarHBondContact OG-OD2 3.42Å; D214-L216 PolarHBondContact O-N 2.83Å; D214-R217 WeakPolarHBondContact O-CB 3.29Å; D214-R217 PolarHBondContact O-N 3.5Å; D214-N218 PolarHBondContact O-N 3Å; D214-N218 PolarHBondContact O-ND2 2.8Å |
| 215 | F | 85.1 | Confident | 87.3 | Confident | 8 Ų | 8 | 48 Ų | 48 | 4% | 0.035 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -59.8 | -29.4 | 174.2 | 73.5 | -88.7 | 0 | 0 | 0 | 112.7 | I165 Y210 S212 K213 A219 D220 K223 F224 N227 | I165-F215 HydrophobicContact CD1-CZ 4.13Å; Y210-F215 AromaticContact CD1-CE1 3.41Å; Y210-F215 HydrophobicContact CD1-CE1 3.41Å; Y210-F215 VanDerWaalsContact CD1-CE1 3.41Å; Y210-F215 AromaticContact CD1-CZ 3.68Å; Y210-F215 HydrophobicContact CD1-CZ 3.68Å; Y210-F215 AromaticContact CE1-CE1 3.69Å; Y210-F215 HydrophobicContact CE1-CE1 3.69Å; Y210-F215 HydrophobicContact CE1-CE2 4.49Å; Y210-F215 AromaticContact CE1-CZ 3.45Å; Y210-F215 HydrophobicContact CE1-CZ 3.45Å; Y210-F215 VanDerWaalsContact CE1-CZ 3.45Å; Y210-F215 HydrophobicContact CG-CE1 4.03Å; Y210-F215 HydrophobicContact CG-CZ 4.31Å; Y210-F215 AromaticContact CZ-CZ 3.96Å; S212-F215 WeakPolarHBondContact O-CE1 3.04Å; K213-F215 PolarHBondContact O-N 3.38Å; K213-F215 VanDerWaalsContact O-N 3.12Å; F215-A219 PolarHBondContact O-N 2.98Å; F215-D220 PolarHBondContact O-N 2.03Å; F215-K223 HydrophobicContact CB-CB 4.45Å; F215-F224 HydrophobicContact CD2-CB 4.11Å; F215-F224 HydrophobicContact CE2-CB 3.68Å; F215-F224 HydrophobicContact CZ-CB 4.03Å; F215-N227 HydrophobicContact CD1-CB 4.11Å; F215-N227 HydrophobicContact CE1-CB 4.21Å |
| 216 | L | 81.6 | Confident | 87.2 | Confident | 1 Ų | 1 | 53 Ų | 53 | 1% | 0.005 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -69.6 | -39 | 173.9 | -67.2 | -177.6 | 0 | 0 | 0 | 111.9 | F145 K162 I165 K213 D214 A219 Y221 | F145-L216 HydrophobicContact CE2-CD2 4.32Å; F145-L216 HydrophobicContact CZ-CD2 3.97Å; K162-L216 HydrophobicContact CG-CD2 4.04Å; I165-L216 HydrophobicContact CB-CD1 3.85Å; I165-L216 HydrophobicContact CD1-CD1 4.12Å; I165-L216 HydrophobicContact CD1-CD2 4.13Å; I165-L216 HydrophobicContact CG2-CD1 3.52Å; K213-L216 WeakPolarHBondContact O-CB 3.48Å; K213-L216 PolarHBondContact O-N 2.89Å; D214-L216 PolarHBondContact O-N 2.83Å; L216-A219 PolarHBondContact O-N 3.37Å; L216-Y221 HydrophobicContact CD2-CD1 4.17Å; L216-Y221 HydrophobicContact CD2-CE1 4.01Å |
| 217 | R | 74.5 | Confident | 87.2 | Confident | 116 Ų | 116 | 54.5 Ų | 54.5 | 44% | 0.438 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -67.9 | -42.2 | 179.4 | -65.4 | -176.8 | 71 | 166 | 5.5 | 111.6 | N51 I53 D214 A219 | N51-R217 PolarHBondContact OD1-NH1 3.01Å; N51-R217 VanDerWaalsContact OD1-NH1 3.13Å; I53-R217 HydrophobicContact CD1-CG 3.31Å; I53-R217 HydrophobicContact CG1-CG 3.68Å; D214-R217 WeakPolarHBondContact O-CB 3.29Å; D214-R217 PolarHBondContact O-N 3.5Å; R217-A219 PolarHBondContact O-N 3.46Å |
| 218 | N | 78 | Confident | 87.1 | Confident | 125 Ų | 125 | 55 Ų | 55 | 67% | 0.668 | 30% | 0.296 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.6 | 2.6 | -177.5 | -61.7 | -29.6 | 0 | 0 | 0 | 113 | D214 D220 | D214-N218 PolarHBondContact O-N 3Å; D214-N218 PolarHBondContact O-ND2 2.8Å; N218-D220 HydrophobicContact CB-CB 4.36Å; N218-D220 PolarHBondContact O-N 2.92Å |
| 219 | A | 76.9 | Confident | 87 | Confident | 57 Ų | 57 | 60.5 Ų | 60.5 | 47% | 0.471 | 32% | 0.32 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 51.8 | 25.5 | -172.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | F215 L216 R217 Y221 | F215-A219 PolarHBondContact O-N 2.98Å; L216-A219 PolarHBondContact O-N 3.37Å; R217-A219 PolarHBondContact O-N 3.46Å; A219-Y221 HydrophobicContact CB-CE2 4Å; A219-Y221 WeakPolarHBondContact O-CD2 3.39Å; A219-Y221 PolarHBondContact O-N 3.16Å; A219-Y221 VanDerWaalsContact O-N 3.1Å |
| 220 | D | 81.1 | Confident | 87 | Confident | 59 Ų | 59 | 58.8 Ų | 58.8 | 32% | 0.316 | 32% | 0.315 | S | S | . | . | trans | -91.2 | 57.7 | -178.7 | -166.4 | -5.2 | 0 | 0 | 0 | 110 | F215 N218 G222 K223 | F215-D220 PolarHBondContact O-N 2.03Å; N218-D220 HydrophobicContact CB-CB 4.36Å; N218-D220 PolarHBondContact O-N 2.92Å; D220-G222 PolarHBondContact O-N 3.32Å; D220-K223 PolarHBondContact O-N 3.07Å; D220-K223 WeakPolarHBondContact OD2-CD 3.08Å; D220-K223 WeakPolarHBondContact OD2-CE 3.39Å; D220-K223 IonicContact OD2-NZ 2.66Å; D220-K223 PolarHBondContact OD2-NZ 2.87Å | ||
| 221 | Y | 80.8 | Confident | 86.9 | Confident | 48 Ų | 48 | 64.5 Ų | 64.5 | 19% | 0.188 | 34% | 0.34 | C | S | . | . | G | 310 helix | trans | -60.7 | -21.7 | -170.4 | -58.7 | -55.5 | 0 | 0 | 0 | 113.7 | F145 L158 K162 L216 A219 K223 F224 | F145-Y221 AromaticContact CE1-CD1 3.52Å; F145-Y221 HydrophobicContact CE1-CD1 3.52Å; F145-Y221 HydrophobicContact CE1-CE1 4.44Å; F145-Y221 AromaticContact CE1-CG 3.7Å; F145-Y221 HydrophobicContact CE1-CG 3.7Å; F145-Y221 AromaticContact CZ-CD1 3.69Å; F145-Y221 HydrophobicContact CZ-CD1 3.69Å; F145-Y221 HydrophobicContact CZ-CE1 4.31Å; F145-Y221 HydrophobicContact CZ-CG 4.34Å; L158-Y221 HydrophobicContact CD1-CD1 4.23Å; L158-Y221 HydrophobicContact CD1-CE1 3.86Å; L158-Y221 HydrophobicContact CD1-CE2 4.24Å; L158-Y221 HydrophobicContact CD2-CE2 4.09Å; K162-Y221 WeakPolarHBondContact CE-OH 3.23Å; K162-Y221 PolarHBondContact NZ-OH 3.48Å; L216-Y221 HydrophobicContact CD2-CD1 4.17Å; L216-Y221 HydrophobicContact CD2-CE1 4.01Å; A219-Y221 HydrophobicContact CB-CE2 4Å; A219-Y221 WeakPolarHBondContact O-CD2 3.39Å; A219-Y221 PolarHBondContact O-N 3.16Å; A219-Y221 VanDerWaalsContact O-N 3.1Å; Y221-K223 PolarHBondContact O-N 3.25Å; Y221-F224 VanDerWaalsContact O-CD1 3.29Å; Y221-F224 WeakPolarHBondContact O-CD1 2.97Å; Y221-F224 PolarHBondContact O-N 3.36Å |
| 222 | G | 79.8 | Confident | 86.9 | Confident | 63 Ų | 63 | 64 Ų | 64 | 65% | 0.649 | 33% | 0.334 | S | S | * | . | G | 310 helix | trans | -63.1 | -26.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | D220 F224 | D220-G222 PolarHBondContact O-N 3.32Å; G222-F224 VanDerWaalsContact C-N 3.28Å; G222-F224 PolarHBondContact O-N 2.85Å |
| 223 | K | 84.4 | Confident | 87 | Confident | 104 Ų | 104 | 62.5 Ų | 62.5 | 45% | 0.452 | 32% | 0.323 | S | S | . | . | G | 310 helix | trans | -84.3 | 6.8 | -178.8 | -67.8 | -171.3 | -176.1 | 148.3 | 0 | 114.6 | F215 D220 Y221 Q225 D226 N227 | F215-K223 HydrophobicContact CB-CB 4.45Å; D220-K223 PolarHBondContact O-N 3.07Å; D220-K223 WeakPolarHBondContact OD2-CD 3.08Å; D220-K223 WeakPolarHBondContact OD2-CE 3.39Å; D220-K223 IonicContact OD2-NZ 2.66Å; D220-K223 PolarHBondContact OD2-NZ 2.87Å; Y221-K223 PolarHBondContact O-N 3.25Å; K223-Q225 PolarHBondContact O-N 2.98Å; K223-D226 PolarHBondContact O-N 3.3Å; K223-N227 PolarHBondContact O-ND2 3.1Å |
| 224 | F | 88.4 | Confident | 87.2 | Confident | 9 Ų | 9 | 60.3 Ų | 60.3 | 4% | 0.039 | 31% | 0.314 | C | S | . | . | G | 310 helix | trans | -57.6 | -39.1 | -178.7 | 85.1 | -87.7 | 0 | 0 | 0 | 111.6 | F145 Y192 P193 P205 Y210 F215 Y221 G222 D226 N227 L228 | F145-F224 HydrophobicContact CB-CD1 4.09Å; F145-F224 HydrophobicContact CB-CD2 4.23Å; F145-F224 HydrophobicContact CB-CE1 4.03Å; F145-F224 HydrophobicContact CB-CE2 4.22Å; F145-F224 HydrophobicContact CB-CG 4.17Å; F145-F224 HydrophobicContact CB-CZ 4.09Å; F145-F224 HydrophobicContact CG-CD1 4.44Å; F145-F224 HydrophobicContact CG-CG 4.37Å; Y192-F224 AromaticContact CE2-CE2 3.84Å; Y192-F224 HydrophobicContact CE2-CE2 3.84Å; Y192-F224 AromaticContact CE2-CZ 3.77Å; Y192-F224 HydrophobicContact CE2-CZ 3.77Å; P193-F224 HydrophobicContact CG-CE1 4.19Å; P193-F224 HydrophobicContact CG-CZ 4.04Å; P205-F224 HydrophobicContact CB-CD2 3.88Å; P205-F224 HydrophobicContact CB-CE2 3.47Å; P205-F224 VanDerWaalsContact CB-CE2 3.47Å; P205-F224 HydrophobicContact CB-CZ 4.35Å; P205-F224 HydrophobicContact CG-CE2 3.78Å; P205-F224 HydrophobicContact CG-CZ 4.22Å; Y210-F224 HydrophobicContact CE1-CB 4.08Å; Y210-F224 HydrophobicContact CE1-CD2 4.44Å; Y210-F224 WeakPolarHBondContact CE1-O 3.19Å; F215-F224 HydrophobicContact CD2-CB 4.11Å; F215-F224 HydrophobicContact CE2-CB 3.68Å; F215-F224 HydrophobicContact CZ-CB 4.03Å; Y221-F224 VanDerWaalsContact O-CD1 3.29Å; Y221-F224 WeakPolarHBondContact O-CD1 2.97Å; Y221-F224 PolarHBondContact O-N 3.36Å; G222-F224 VanDerWaalsContact C-N 3.28Å; G222-F224 PolarHBondContact O-N 2.85Å; F224-D226 VanDerWaalsContact C-N 3.31Å; F224-D226 PolarHBondContact O-N 3.1Å; F224-N227 PolarHBondContact O-N 3.37Å; F224-N227 VanDerWaalsContact O-N 3.09Å; F224-L228 HydrophobicContact CD2-CD1 4.46Å; F224-L228 HydrophobicContact CE2-CD1 4.35Å; F224-L228 PolarHBondContact O-N 3.41Å |
| 225 | Q | 89 | Confident | 87.6 | Confident | 61 Ų | 61 | 58.8 Ų | 58.8 | 29% | 0.285 | 30% | 0.303 | S | S | . | . | G | 310 helix | trans | -62.9 | -36.9 | -177.4 | -64.6 | -171.1 | -42.2 | 0 | 0 | 113 | Y192 K223 N227 L228 | Y192-Q225 PolarHBondContact OH-NE2 2.82Å; K223-Q225 PolarHBondContact O-N 2.98Å; Q225-N227 PolarHBondContact O-N 3.05Å; Q225-L228 PolarHBondContact O-N 2.87Å |
| 226 | D | 90.3 | Very high | 88.1 | Confident | 111 Ų | 111 | 60.9 Ų | 60.9 | 59% | 0.594 | 32% | 0.317 | S | S | * | . | G | 310 helix | trans | -70.3 | -22.6 | 179.3 | -64.2 | -32.3 | 0 | 0 | 0 | 112.3 | K223 F224 | K223-D226 PolarHBondContact O-N 3.3Å; F224-D226 VanDerWaalsContact C-N 3.31Å; F224-D226 PolarHBondContact O-N 3.1Å |
| 227 | N | 92.8 | Very high | 88.7 | Confident | 31 Ų | 31 | 62.3 Ų | 62.3 | 17% | 0.166 | 33% | 0.325 | C | S | . | . | G | 310 helix | trans | -98.3 | -0.9 | -178.2 | -69.8 | -79.3 | 0 | 0 | 0 | 113.1 | Y210 T211 S212 F215 K223 F224 Q225 K229 | Y210-N227 CarbonylContact C-O 3.25Å; Y210-N227 WeakPolarHBondContact CA-O 3.49Å; Y210-N227 WeakPolarHBondContact CB-O 3.3Å; Y210-N227 HydrophobicContact CD1-CB 3.86Å; Y210-N227 WeakPolarHBondContact CD1-O 3.47Å; T211-N227 PolarHBondContact N-O 3.31Å; T211-N227 PolarHBondContact OG1-O 3.06Å; T211-N227 VanDerWaalsContact OG1-O 3.13Å; S212-N227 WeakPolarHBondContact O-CB 3.24Å; F215-N227 HydrophobicContact CD1-CB 4.11Å; F215-N227 HydrophobicContact CE1-CB 4.21Å; K223-N227 PolarHBondContact O-ND2 3.1Å; F224-N227 PolarHBondContact O-N 3.37Å; F224-N227 VanDerWaalsContact O-N 3.09Å; Q225-N227 PolarHBondContact O-N 3.05Å; N227-K229 PolarHBondContact O-N 3.42Å |
| 228 | L | 94 | Very high | 89.8 | Confident | 9 Ų | 9 | 61.4 Ų | 61.4 | 5% | 0.047 | 33% | 0.329 | C | S | . | . | B | Isolated β-bridge | trans | -67.2 | 131 | 173.7 | -72.8 | 171 | 0 | 0 | 0 | 110.3 | C208 Y210 F224 Q225 N230 | C208-L228 HydrophobicContact CB-CD2 3.37Å; Y210-L228 HydrophobicContact CD1-CD2 4.26Å; Y210-L228 HydrophobicContact CE1-CD2 3.7Å; Y210-L228 HydrophobicContact CE1-CG 4.14Å; Y210-L228 HydrophobicContact CE2-CD2 4.2Å; F224-L228 HydrophobicContact CD2-CD1 4.46Å; F224-L228 HydrophobicContact CE2-CD1 4.35Å; F224-L228 PolarHBondContact O-N 3.41Å; Q225-L228 PolarHBondContact O-N 2.87Å; L228-N230 PolarHBondContact O-N 3.35Å |
| 229 | K | 96.4 | Very high | 90.7 | Very high | 117 Ų | 117 | 59.9 Ų | 59.9 | 51% | 0.509 | 32% | 0.318 | S | S | . | . | S | Bend | trans | -60.8 | -35 | 171.2 | -76.1 | -165.4 | 177 | -174.4 | 0 | 112 | K209 T211 N227 E239 | K209-K229 HydrophobicContact CB-CB 4.47Å; K209-K229 HydrophobicContact CB-CD 3.98Å; K209-K229 HydrophobicContact CB-CG 4.3Å; K209-K229 PolarHBondContact O-N 3.26Å; T211-K229 HydrophobicContact CG2-CG 3.75Å; N227-K229 PolarHBondContact O-N 3.42Å; K229-E239 HydrophobicContact CB-CB 4.15Å; K229-E239 HydrophobicContact CB-CG 4.35Å |
| 230 | N | 95.8 | Very high | 91.6 | Very high | 40 Ų | 40 | 58 Ų | 58 | 21% | 0.214 | 30% | 0.302 | C | S | . | . | S | Bend | trans | -132.2 | 117.4 | 173.8 | -176.7 | -20.4 | 0 | 0 | 0 | 109.3 | L228 D232 C233 N238 E239 | L228-N230 PolarHBondContact O-N 3.35Å; N230-D232 PolarHBondContact O-N 3.25Å; N230-D232 PolarHBondContact OD1-N 3.36Å; N230-C233 HydrophobicContact CB-CB 4.22Å; N230-C233 WeakPolarHBondContact O-CB 3.48Å; N230-C233 PolarHBondContact O-N 3.27Å; N230-C233 VanDerWaalsContact O-N 3.08Å; N230-N238 WeakPolarHBondContact ND2-CB 3.15Å; N230-E239 HydrophobicContact CB-CB 3.97Å; N230-E239 HydrophobicContact CB-CG 4.21Å |
| 231 | K | 93 | Very high | 92.3 | Very high | 135 Ų | 135 | 56.1 Ų | 56.1 | 59% | 0.587 | 29% | 0.291 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.7 | -24.9 | -178.8 | -65.8 | -168.2 | 174.9 | -166.8 | 0 | 113.3 | ||
| 232 | D | 93.9 | Very high | 93 | Very high | 86 Ų | 86 | 55.1 Ų | 55.1 | 46% | 0.46 | 29% | 0.289 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -95.3 | 10.1 | 176.8 | -63.1 | -48.8 | 0 | 0 | 0 | 113 | N230 V234 K235 T236 | N230-D232 PolarHBondContact O-N 3.25Å; N230-D232 PolarHBondContact OD1-N 3.36Å; D232-V234 PolarHBondContact O-N 2.66Å; D232-K235 PolarHBondContact O-N 2.8Å; D232-T236 HydrophobicContact CB-CG2 4Å; D232-T236 PolarHBondContact O-N 3.16Å; D232-T236 PolarHBondContact O-OG1 3.35Å |
| 233 | C | 95.8 | Very high | 93.7 | Very high | 1 Ų | 1 | 58.5 Ų | 58.5 | 1% | 0.007 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -54.3 | -39.3 | -178.1 | 163.8 | 0 | 0 | 0 | 0 | 112.7 | C208 N230 K235 T236 T237 N238 | C208-C233 WeakPolarHBondContact CA-SG 2.99Å; C208-C233 HydrophobicContact CB-CB 3.83Å; C208-C233 WeakPolarHBondContact CB-SG 3.32Å; C208-C233 WeakPolarHBondContact SG-CB 2.95Å; C208-C233 CovalentContact SG-SG 2.03Å; C208-C233 PolarHBondContact SG-SG 2.76Å; N230-C233 HydrophobicContact CB-CB 4.22Å; N230-C233 WeakPolarHBondContact O-CB 3.48Å; N230-C233 PolarHBondContact O-N 3.27Å; N230-C233 VanDerWaalsContact O-N 3.08Å; C233-K235 PolarHBondContact O-N 3.46Å; C233-T236 PolarHBondContact O-N 3.37Å; C233-T237 WeakPolarHBondContact O-CA 3.39Å; C233-T237 PolarHBondContact O-N 2.88Å; C233-N238 VanDerWaalsContact CB-O 3.32Å; C233-N238 WeakPolarHBondContact CB-O 3.46Å; C233-N238 PolarHBondContact SG-O 3.11Å |
| 234 | V | 94.2 | Very high | 94.2 | Very high | 0 Ų | 0 | 56.8 Ų | 56.8 | 0% | 0 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -63.4 | -25.2 | -179.6 | -59.9 | 0 | 0 | 0 | 0 | 113.3 | Y192 I201 K202 I203 P205 D232 | Y192-V234 HydrophobicContact CD1-CG2 4.07Å; Y192-V234 HydrophobicContact CD2-CG1 4.38Å; Y192-V234 HydrophobicContact CD2-CG2 4.22Å; Y192-V234 HydrophobicContact CE1-CG2 3.99Å; Y192-V234 HydrophobicContact CE2-CG1 3.98Å; Y192-V234 HydrophobicContact CE2-CG2 4.15Å; Y192-V234 HydrophobicContact CG-CG2 4.21Å; I201-V234 HydrophobicContact CD1-CB 4.34Å; I201-V234 HydrophobicContact CD1-CG2 3.75Å; I201-V234 HydrophobicContact CG2-CB 4.5Å; K202-V234 PolarHBondContact N-O 2.98Å; I203-V234 PolarHBondContact N-O 3.28Å; P205-V234 HydrophobicContact CB-CG1 4.09Å; P205-V234 HydrophobicContact CG-CG1 3.84Å; D232-V234 PolarHBondContact O-N 2.66Å |
| 235 | K | 94.3 | Very high | 94.5 | Very high | 54 Ų | 54 | 56.7 Ų | 56.7 | 24% | 0.235 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -98 | -40.6 | -179.7 | -51 | -178.5 | -175.7 | 168 | 0 | 112.2 | D194 T196 E200 I201 K202 D232 C233 | D194-K235 WeakPolarHBondContact OD2-CE 3.42Å; D194-K235 IonicContact OD2-NZ 2.68Å; D194-K235 PolarHBondContact OD2-NZ 3.48Å; T196-K235 WeakPolarHBondContact OG1-CE 3.24Å; E200-K235 WeakPolarHBondContact O-CA 3.32Å; I201-K235 HydrophobicContact CD1-CG 4.18Å; K202-K235 WeakPolarHBondContact CD-O 3.35Å; K202-K235 WeakPolarHBondContact CE-O 2.95Å; K202-K235 PolarHBondContact NZ-O 2.93Å; K202-K235 VanDerWaalsContact NZ-O 3.09Å; D232-K235 PolarHBondContact O-N 2.8Å; C233-K235 PolarHBondContact O-N 3.46Å |
| 236 | T | 95.3 | Very high | 94.8 | Very high | 52 Ų | 52 | 53.9 Ų | 53.9 | 32% | 0.319 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -95.1 | -21.2 | -173.4 | 62 | 0 | 0 | 0 | 0 | 113.3 | D232 C233 N238 | D232-T236 HydrophobicContact CB-CG2 4Å; D232-T236 PolarHBondContact O-N 3.16Å; D232-T236 PolarHBondContact O-OG1 3.35Å; C233-T236 PolarHBondContact O-N 3.37Å; T236-N238 PolarHBondContact O-N 3.3Å; T236-N238 PolarHBondContact OG1-N 2.98Å |
| 237 | T | 94.9 | Very high | 94.9 | Very high | 31 Ų | 31 | 49.7 Ų | 49.7 | 19% | 0.19 | 26% | 0.256 | C | S | . | . | trans | 61.8 | 6.2 | -169 | 66 | 0 | 0 | 0 | 0 | 115.3 | K202 I203 C233 S240 M242 | K202-T237 HydrophobicContact CB-CG2 3.94Å; K202-T237 HydrophobicContact CD-CG2 4.09Å; I203-T237 HydrophobicContact CD1-CG2 3.95Å; I203-T237 HydrophobicContact CG1-CG2 4.2Å; I203-T237 HydrophobicContact CG2-CG2 4.35Å; C233-T237 WeakPolarHBondContact O-CA 3.39Å; C233-T237 PolarHBondContact O-N 2.88Å; T237-S240 VanDerWaalsContact O-CB 3.23Å; T237-S240 WeakPolarHBondContact O-CB 3.43Å; T237-S240 PolarHBondContact O-OG 3.26Å; T237-M242 VanDerWaalsContact CB-SD 3.51Å; T237-M242 HydrophobicContact CG2-CE 3.97Å; T237-M242 HydrophobicContact CG2-SD 4.08Å | ||
| 238 | N | 96.4 | Very high | 94.8 | Very high | 96 Ų | 96 | 51.3 Ų | 51.3 | 51% | 0.513 | 27% | 0.274 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.7 | 145.2 | 174.3 | -71.1 | -21 | 0 | 0 | 0 | 110.7 | N230 C233 T236 S240 | N230-N238 WeakPolarHBondContact ND2-CB 3.15Å; C233-N238 VanDerWaalsContact CB-O 3.32Å; C233-N238 WeakPolarHBondContact CB-O 3.46Å; C233-N238 PolarHBondContact SG-O 3.11Å; T236-N238 PolarHBondContact O-N 3.3Å; T236-N238 PolarHBondContact OG1-N 2.98Å; N238-S240 VanDerWaalsContact C-N 3.27Å; N238-S240 PolarHBondContact O-N 3.43Å |
| 239 | E | 96.6 | Very high | 94.7 | Very high | 94 Ų | 94 | 51.4 Ų | 51.4 | 44% | 0.439 | 28% | 0.276 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 53.3 | 42.9 | -174.1 | -64.9 | -61.4 | 146.4 | 0 | 0 | 112.9 | K209 K229 N230 | K209-E239 WeakPolarHBondContact CB-O 3.36Å; K209-E239 VanDerWaalsContact CG-O 3.24Å; K209-E239 WeakPolarHBondContact CG-O 3.3Å; K209-E239 PolarHBondContact N-O 3.13Å; K229-E239 HydrophobicContact CB-CB 4.15Å; K229-E239 HydrophobicContact CB-CG 4.35Å; N230-E239 HydrophobicContact CB-CB 3.97Å; N230-E239 HydrophobicContact CB-CG 4.21Å |
| 240 | S | 96.8 | Very high | 94.3 | Very high | 18 Ų | 18 | 48.4 Ų | 48.4 | 13% | 0.126 | 27% | 0.268 | C | S | . | . | B | Isolated β-bridge | trans | -115.8 | 168.7 | 177.2 | 75.6 | 0 | 0 | 0 | 0 | 112.7 | K209 T237 N238 M242 | K209-S240 WeakPolarHBondContact CE-O 3.4Å; T237-S240 VanDerWaalsContact O-CB 3.23Å; T237-S240 WeakPolarHBondContact O-CB 3.43Å; T237-S240 PolarHBondContact O-OG 3.26Å; N238-S240 VanDerWaalsContact C-N 3.27Å; N238-S240 PolarHBondContact O-N 3.43Å; S240-M242 WeakPolarHBondContact OG-CB 3.41Å; S240-M242 PolarHBondContact OG-N 3.44Å |
| 241 | N | 96.3 | Very high | 93.8 | Very high | 18 Ų | 18 | 49.9 Ų | 49.9 | 10% | 0.096 | 28% | 0.275 | C | S | . | . | trans | -102.3 | 26.1 | 172.4 | -60.1 | -44.7 | 0 | 0 | 0 | 111.9 | E168 C170 C207 K209 N243 V244 | E168-N241 WeakPolarHBondContact CA-ND2 3.4Å; E168-N241 VanDerWaalsContact O-CB 3.3Å; E168-N241 WeakPolarHBondContact O-CB 3.47Å; C170-N241 VanDerWaalsContact CB-O 3.31Å; C170-N241 WeakPolarHBondContact CB-O 3.37Å; C207-N241 PolarHBondContact O-N 3.3Å; K209-N241 VanDerWaalsContact CE-OD1 3.27Å; K209-N241 WeakPolarHBondContact CE-OD1 3.37Å; N241-N243 PolarHBondContact O-N 2.87Å; N241-V244 PolarHBondContact O-N 3.29Å | ||
| 242 | M | 95.4 | Very high | 93.5 | Very high | 28 Ų | 28 | 47.9 Ų | 47.9 | 14% | 0.138 | 27% | 0.271 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -57.4 | -26.6 | -169.2 | 78.8 | 179.1 | -60.1 | 0 | 0 | 114.8 | Y175 T237 S240 | Y175-M242 WeakPolarHBondContact CB-O 3.23Å; Y175-M242 HydrophobicContact CD1-CB 4.37Å; Y175-M242 HydrophobicContact CD1-CE 3.56Å; Y175-M242 HydrophobicContact CD1-CG 4.37Å; Y175-M242 WeakPolarHBondContact CD1-O 3.31Å; Y175-M242 HydrophobicContact CD2-CE 3.49Å; Y175-M242 VanDerWaalsContact CD2-CE 3.49Å; Y175-M242 HydrophobicContact CE1-CE 3.82Å; Y175-M242 HydrophobicContact CE2-CE 3.77Å; Y175-M242 HydrophobicContact CG-CB 4.28Å; Y175-M242 HydrophobicContact CG-CE 3.37Å; Y175-M242 PolarHBondContact N-O 3.08Å; T237-M242 VanDerWaalsContact CB-SD 3.51Å; T237-M242 HydrophobicContact CG2-CE 3.97Å; T237-M242 HydrophobicContact CG2-SD 4.08Å; S240-M242 WeakPolarHBondContact OG-CB 3.41Å; S240-M242 PolarHBondContact OG-N 3.44Å |
| 243 | N | 93.5 | Very high | 92.9 | Very high | 134 Ų | 134 | 47.6 Ų | 47.6 | 72% | 0.717 | 27% | 0.266 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.4 | -1.9 | -176.2 | -62.9 | -40.2 | 0 | 0 | 0 | 113.8 | N241 | N241-N243 PolarHBondContact O-N 2.87Š|
| 244 | V | 94.9 | Very high | 92.2 | Very high | 67 Ų | 67 | 51.8 Ų | 51.8 | 41% | 0.406 | 29% | 0.287 | S | S | . | . | trans | -113.2 | 107.7 | -177.9 | -177 | 0 | 0 | 0 | 0 | 108.7 | C169 C170 N241 A249 | C169-V244 CarbonylContact C-O 3.56Å; C169-V244 WeakPolarHBondContact CA-O 3.01Å; C169-V244 HydrophobicContact CB-CG1 4.19Å; C169-V244 WeakPolarHBondContact CB-O 3.41Å; C170-V244 PolarHBondContact N-O 2.03Å; N241-V244 PolarHBondContact O-N 3.29Å; V244-A249 HydrophobicContact CG1-CB 4.16Å | ||
| 245 | G | 95.1 | Very high | 91.5 | Very high | 8 Ų | 8 | 57.3 Ų | 57.3 | 8% | 0.082 | 31% | 0.313 | C | S | . | . | trans | -73.4 | 141.9 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | L172 L247 A248 A249 | L172-G245 CarbonylContact O-C 3.52Å; L172-G245 VanDerWaalsContact O-C 3.32Å; L172-G245 WeakPolarHBondContact O-CA 3.04Å; G245-L247 VanDerWaalsContact C-N 3.31Å; G245-L247 PolarHBondContact O-N 2.66Å; G245-A248 PolarHBondContact O-N 3.42Å; G245-A249 PolarHBondContact O-N 3.39Å | ||
| 246 | C | 94.9 | Very high | 90.9 | Very high | 2 Ų | 2 | 61.5 Ų | 61.5 | 1% | 0.014 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -65.8 | -29.7 | -177.8 | -64 | 0 | 0 | 0 | 0 | 113.6 | L163 M164 C169 G171 L172 A248 A249 V250 | L163-C246 HydrophobicContact CD2-CB 4.45Å; M164-C246 VanDerWaalsContact CG-SG 3.57Å; C169-C246 HydrophobicContact CB-CB 3.94Å; C169-C246 WeakPolarHBondContact CB-SG 3.11Å; C169-C246 WeakPolarHBondContact SG-CA 3.43Å; C169-C246 WeakPolarHBondContact SG-CB 3.19Å; C169-C246 CovalentContact SG-SG 2.03Å; C169-C246 PolarHBondContact SG-SG 3.26Å; G171-C246 WeakPolarHBondContact O-CB 3.31Å; G171-C246 PolarHBondContact O-N 3.48Å; G171-C246 PolarHBondContact O-SG 3.02Å; L172-C246 HydrophobicContact CD2-CB 4.4Å; L172-C246 PolarHBondContact O-N 3.07Å; C246-A248 VanDerWaalsContact C-N 3.34Å; C246-A248 PolarHBondContact O-N 3.5Å; C246-A249 PolarHBondContact O-N 2.84Å; C246-V250 WeakPolarHBondContact O-CB 3.47Å; C246-V250 VanDerWaalsContact O-CG2 3.24Å; C246-V250 WeakPolarHBondContact O-CG2 3.43Å; C246-V250 PolarHBondContact O-N 3.35Å |
| 247 | L | 91.9 | Very high | 90.1 | Very high | 23 Ų | 23 | 66.5 Ų | 66.5 | 12% | 0.12 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -62.5 | -43.2 | 174.9 | -69.9 | 169.2 | 0 | 0 | 0 | 111.3 | Y129 E130 L172 G245 N251 | Y129-L247 HydrophobicContact CE1-CD2 4.39Å; E130-L247 HydrophobicContact CB-CD1 3.97Å; E130-L247 HydrophobicContact CG-CD1 3.89Å; E130-L247 HydrophobicContact CG-CD2 4.37Å; L172-L247 HydrophobicContact CB-CD1 3.95Å; L172-L247 HydrophobicContact CB-CG 4.05Å; L172-L247 HydrophobicContact CD2-CD2 4.38Å; L172-L247 HydrophobicContact CD2-CG 4.21Å; L172-L247 WeakPolarHBondContact O-CB 3.21Å; L172-L247 PolarHBondContact O-N 3.4Å; G245-L247 VanDerWaalsContact C-N 3.31Å; G245-L247 PolarHBondContact O-N 2.66Å; L247-N251 WeakPolarHBondContact O-CB 3.46Å; L247-N251 PolarHBondContact O-N 3.07Å; L247-N251 VanDerWaalsContact O-N 3.07Å |
| 248 | A | 91 | Very high | 89.3 | Confident | 64 Ų | 64 | 65.8 Ų | 65.8 | 53% | 0.529 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -68.1 | -41.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | G245 C246 N251 N252 | G245-A248 PolarHBondContact O-N 3.42Å; C246-A248 VanDerWaalsContact C-N 3.34Å; C246-A248 PolarHBondContact O-N 3.5Å; A248-N251 PolarHBondContact O-N 2.04Å; A248-N252 WeakPolarHBondContact O-CB 3.34Å; A248-N252 PolarHBondContact O-N 3.37Å |
| 249 | A | 91.9 | Very high | 88.7 | Confident | 12 Ų | 12 | 67.9 Ų | 67.9 | 10% | 0.099 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -62.7 | -45.5 | 178 | 0 | 0 | 0 | 0 | 0 | 112.3 | L167 C169 V244 G245 C246 N252 K253 | L167-A249 HydrophobicContact CB-CB 4.34Å; C169-A249 HydrophobicContact CB-CB 4Å; V244-A249 HydrophobicContact CG1-CB 4.16Å; G245-A249 PolarHBondContact O-N 3.39Å; C246-A249 PolarHBondContact O-N 2.84Å; A249-N252 PolarHBondContact O-N 3.22Å; A249-K253 PolarHBondContact O-N 2.85Å |
| 250 | V | 88.2 | Confident | 88 | Confident | 54 Ų | 54 | 66.6 Ų | 66.6 | 33% | 0.327 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -58.4 | -50.2 | 174 | 169 | 0 | 0 | 0 | 0 | 110.2 | L167 C246 N252 K253 I254 | L167-V250 HydrophobicContact CD1-CG2 3.34Å; C246-V250 WeakPolarHBondContact O-CB 3.47Å; C246-V250 VanDerWaalsContact O-CG2 3.24Å; C246-V250 WeakPolarHBondContact O-CG2 3.43Å; C246-V250 PolarHBondContact O-N 3.35Å; V250-N252 VanDerWaalsContact C-N 3.3Å; V250-N252 PolarHBondContact O-N 3.03Å; V250-K253 PolarHBondContact O-N 3.45Å; V250-I254 HydrophobicContact CG1-CD1 3.58Å; V250-I254 HydrophobicContact CG1-CG1 4.21Å; V250-I254 WeakPolarHBondContact O-CG1 3.04Å; V250-I254 PolarHBondContact O-N 3.4Å |
| 251 | N | 85.5 | Confident | 87.2 | Confident | 71 Ų | 71 | 72.8 Ų | 72.8 | 38% | 0.38 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -60 | -41.2 | -179.3 | -175.3 | 61.7 | 0 | 0 | 0 | 111.8 | L247 A248 I254 Q255 | L247-N251 WeakPolarHBondContact O-CB 3.46Å; L247-N251 PolarHBondContact O-N 3.07Å; L247-N251 VanDerWaalsContact O-N 3.07Å; A248-N251 PolarHBondContact O-N 2.04Å; N251-I254 PolarHBondContact O-N 3.03Å; N251-Q255 WeakPolarHBondContact O-CB 3.36Å; N251-Q255 WeakPolarHBondContact O-CG 3.5Å; N251-Q255 PolarHBondContact O-N 3Å |
| 252 | N | 86.4 | Confident | 86.5 | Confident | 92 Ų | 92 | 77 Ų | 77 | 49% | 0.492 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -64.7 | -44.5 | 176.3 | -167 | 3 | 0 | 0 | 0 | 111.8 | A248 A249 V250 I254 Q255 Q256 | A248-N252 WeakPolarHBondContact O-CB 3.34Å; A248-N252 PolarHBondContact O-N 3.37Å; A249-N252 PolarHBondContact O-N 3.22Å; V250-N252 VanDerWaalsContact C-N 3.3Å; V250-N252 PolarHBondContact O-N 3.03Å; N252-I254 PolarHBondContact O-N 3.01Å; N252-Q255 PolarHBondContact O-N 2.73Å; N252-Q256 WeakPolarHBondContact O-CG 3.49Å; N252-Q256 PolarHBondContact O-N 2.71Å; N252-Q256 PolarHBondContact OD1-NE2 3.48Å |
| 253 | K | 82.3 | Confident | 86.1 | Confident | 80 Ų | 80 | 78.4 Ų | 78.4 | 35% | 0.348 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -61.6 | -41.4 | 175.1 | -81.1 | -150 | -175.5 | -174.3 | 0 | 112.5 | L167 A249 V250 Q256 R257 | L167-K253 HydrophobicContact CD2-CD 3.51Å; L167-K253 VanDerWaalsContact CD2-CE 3.43Å; L167-K253 HydrophobicContact CD2-CG 4.33Å; A249-K253 PolarHBondContact O-N 2.85Å; V250-K253 PolarHBondContact O-N 3.45Å; K253-Q256 PolarHBondContact O-N 3.3Å; K253-R257 PolarHBondContact O-N 3.48Å |
| 254 | I | 81.2 | Confident | 86 | Confident | 89 Ų | 89 | 76.7 Ų | 76.7 | 46% | 0.456 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -62.5 | -47.3 | 176.7 | -70.2 | 172.2 | 0 | 0 | 0 | 110.2 | V250 N251 N252 Q256 R257 A258 | V250-I254 HydrophobicContact CG1-CD1 3.58Å; V250-I254 HydrophobicContact CG1-CG1 4.21Å; V250-I254 WeakPolarHBondContact O-CG1 3.04Å; V250-I254 PolarHBondContact O-N 3.4Å; N251-I254 PolarHBondContact O-N 3.03Å; N252-I254 PolarHBondContact O-N 3.01Å; I254-Q256 VanDerWaalsContact C-N 3.3Å; I254-Q256 PolarHBondContact O-N 3.48Å; I254-R257 CarbonylContact O-C 3.36Å; I254-R257 VanDerWaalsContact O-C 3.25Å; I254-R257 PolarHBondContact O-N 2.91Å; I254-A258 WeakPolarHBondContact O-CA 3.12Å; I254-A258 WeakPolarHBondContact O-CB 3.32Å; I254-A258 PolarHBondContact O-N 3.17Å |
| 255 | Q | 79.3 | Confident | 85.7 | Confident | 116 Ų | 116 | 76.8 Ų | 76.8 | 54% | 0.542 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -60.3 | -40.2 | 179.7 | -72.1 | -68 | -27.6 | 0 | 0 | 112 | N251 N252 R257 A258 | N251-Q255 WeakPolarHBondContact O-CB 3.36Å; N251-Q255 WeakPolarHBondContact O-CG 3.5Å; N251-Q255 PolarHBondContact O-N 3Å; N252-Q255 PolarHBondContact O-N 2.73Å; Q255-R257 VanDerWaalsContact C-N 3.25Å; Q255-R257 PolarHBondContact O-N 3.05Å; Q255-A258 WeakPolarHBondContact O-CB 3.26Å; Q255-A258 PolarHBondContact O-N 3.41Å |
| 256 | Q | 80.4 | Confident | 85.5 | Confident | 143 Ų | 143 | 80.9 Ų | 80.9 | 67% | 0.668 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -66.5 | -26.8 | 176.5 | -70.6 | 177.4 | 20.9 | 0 | 0 | 113.3 | N252 K253 I254 | N252-Q256 WeakPolarHBondContact O-CG 3.49Å; N252-Q256 PolarHBondContact O-N 2.71Å; N252-Q256 PolarHBondContact OD1-NE2 3.48Å; K253-Q256 PolarHBondContact O-N 3.3Å; I254-Q256 VanDerWaalsContact C-N 3.3Å; I254-Q256 PolarHBondContact O-N 3.48Å |
| 257 | R | 79 | Confident | 85.4 | Confident | 156 Ų | 156 | 85.3 Ų | 85.3 | 59% | 0.589 | 45% | 0.451 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -111.4 | 22.3 | 179 | -63.1 | -170 | 176.5 | -150.4 | 0.3 | 112.8 | Y50 K253 I254 Q255 L259 P260 F261 | Y50-R257 PolarHBondContact OH-NH1 3.15Å; K253-R257 PolarHBondContact O-N 3.48Å; I254-R257 CarbonylContact O-C 3.36Å; I254-R257 VanDerWaalsContact O-C 3.25Å; I254-R257 PolarHBondContact O-N 2.91Å; Q255-R257 VanDerWaalsContact C-N 3.25Å; Q255-R257 PolarHBondContact O-N 3.05Å; R257-L259 VanDerWaalsContact C-N 3.31Å; R257-L259 PolarHBondContact O-N 3.04Å; R257-P260 VanDerWaalsContact O-CD 3.31Å; R257-P260 WeakPolarHBondContact O-CD 3.36Å; R257-F261 VanDerWaalsContact O-CD2 3.29Å; R257-F261 WeakPolarHBondContact O-CD2 3.19Å |
| 258 | A | 79.4 | Confident | 85.4 | Confident | 17 Ų | 17 | 87.7 Ų | 87.7 | 14% | 0.14 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -73.3 | -21.7 | -173.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | I254 Q255 F261 I262 | I254-A258 WeakPolarHBondContact O-CA 3.12Å; I254-A258 WeakPolarHBondContact O-CB 3.32Å; I254-A258 PolarHBondContact O-N 3.17Å; Q255-A258 WeakPolarHBondContact O-CB 3.26Å; Q255-A258 PolarHBondContact O-N 3.41Å; A258-F261 WeakPolarHBondContact O-CB 3.39Å; A258-F261 PolarHBondContact O-N 3.37Å; A258-I262 HydrophobicContact CB-CD1 4.31Å; A258-I262 PolarHBondContact O-N 2.82Å; A258-I262 VanDerWaalsContact O-N 3.08Å |
| 259 | L | 82.5 | Confident | 85.5 | Confident | 139 Ų | 139 | 88.5 Ų | 88.5 | 73% | 0.728 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -53.7 | -49.1 | -173.1 | -82.5 | 167.6 | 0 | 0 | 0 | 114.1 | R257 F261 I262 S263 | R257-L259 VanDerWaalsContact C-N 3.31Å; R257-L259 PolarHBondContact O-N 3.04Å; L259-F261 VanDerWaalsContact C-N 3.33Å; L259-F261 PolarHBondContact O-N 3.16Å; L259-I262 PolarHBondContact O-N 2.95Å; L259-S263 WeakPolarHBondContact O-CB 3.28Å; L259-S263 PolarHBondContact O-N 3.3Å; L259-S263 PolarHBondContact O-OG 3.33Å |
| 260 | P | 82.2 | Confident | 85.5 | Confident | 67 Ų | 67 | 93.1 Ų | 93.1 | 44% | 0.435 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -61.1 | -40.2 | 175 | -23.1 | 34.9 | 0 | 0 | 0 | 112.9 | R257 I262 S263 I264 | R257-P260 VanDerWaalsContact O-CD 3.31Å; R257-P260 WeakPolarHBondContact O-CD 3.36Å; P260-I262 VanDerWaalsContact C-N 3.26Å; P260-I262 PolarHBondContact O-N 3.06Å; P260-S263 WeakPolarHBondContact CA-OG 3.33Å; P260-S263 PolarHBondContact O-N 2.71Å; P260-S263 PolarHBondContact O-OG 2.87Å; P260-I264 HydrophobicContact CB-CD1 4.18Å; P260-I264 WeakPolarHBondContact O-CB 3.43Å; P260-I264 WeakPolarHBondContact O-CD1 3.43Å; P260-I264 VanDerWaalsContact O-CG1 3.26Å; P260-I264 WeakPolarHBondContact O-CG1 3.44Å; P260-I264 PolarHBondContact O-N 2.91Å |
| 261 | F | 79.9 | Confident | 85.8 | Confident | 148 Ų | 148 | 93.8 Ų | 93.8 | 65% | 0.649 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -66.3 | -27.5 | -178.4 | -64.8 | -77.9 | 0 | 0 | 0 | 113.2 | R257 A258 L259 P265 | R257-F261 VanDerWaalsContact O-CD2 3.29Å; R257-F261 WeakPolarHBondContact O-CD2 3.19Å; A258-F261 WeakPolarHBondContact O-CB 3.39Å; A258-F261 PolarHBondContact O-N 3.37Å; L259-F261 VanDerWaalsContact C-N 3.33Å; L259-F261 PolarHBondContact O-N 3.16Å; F261-P265 WeakPolarHBondContact O-CD 3.35Å; F261-P265 VanDerWaalsContact O-CG 3.23Å; F261-P265 WeakPolarHBondContact O-CG 3.13Å |
| 262 | I | 82.7 | Confident | 86.3 | Confident | 106 Ų | 106 | 91 Ų | 91 | 54% | 0.544 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -88.2 | -42.4 | 175.9 | -61.6 | 170.8 | 0 | 0 | 0 | 110.8 | A258 L259 P260 I266 | A258-I262 HydrophobicContact CB-CD1 4.31Å; A258-I262 PolarHBondContact O-N 2.82Å; A258-I262 VanDerWaalsContact O-N 3.08Å; L259-I262 PolarHBondContact O-N 2.95Å; P260-I262 VanDerWaalsContact C-N 3.26Å; P260-I262 PolarHBondContact O-N 3.06Å; I262-I266 HydrophobicContact CG2-CD1 3.96Å; I262-I266 WeakPolarHBondContact O-CD1 3.14Å; I262-I266 WeakPolarHBondContact O-CG1 3.15Å |
| 263 | S | 86.9 | Confident | 86.7 | Confident | 59 Ų | 59 | 90.5 Ų | 90.5 | 41% | 0.413 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -72 | -41.2 | -174 | 53.9 | 0 | 0 | 0 | 0 | 113.5 | L259 P260 I266 V267 | L259-S263 WeakPolarHBondContact O-CB 3.28Å; L259-S263 PolarHBondContact O-N 3.3Å; L259-S263 PolarHBondContact O-OG 3.33Å; P260-S263 WeakPolarHBondContact CA-OG 3.33Å; P260-S263 PolarHBondContact O-N 2.71Å; P260-S263 PolarHBondContact O-OG 2.87Å; S263-I266 PolarHBondContact O-N 2.52Å; S263-V267 WeakPolarHBondContact O-CG2 3.35Å; S263-V267 PolarHBondContact O-N 2.85Å |
| 264 | I | 90 | Very high | 87.3 | Confident | 98 Ų | 98 | 89 Ų | 89 | 50% | 0.503 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -60.4 | -50.5 | -177.4 | -67.9 | 166.4 | 0 | 0 | 0 | 111.7 | P260 I266 V267 I268 | P260-I264 HydrophobicContact CB-CD1 4.18Å; P260-I264 WeakPolarHBondContact O-CB 3.43Å; P260-I264 WeakPolarHBondContact O-CD1 3.43Å; P260-I264 VanDerWaalsContact O-CG1 3.26Å; P260-I264 WeakPolarHBondContact O-CG1 3.44Å; P260-I264 PolarHBondContact O-N 2.91Å; I264-I266 VanDerWaalsContact C-N 3.31Å; I264-I266 PolarHBondContact O-N 2.7Å; I264-V267 PolarHBondContact O-N 3.03Å; I264-I268 HydrophobicContact CG2-CD1 3.69Å; I264-I268 HydrophobicContact CG2-CG1 4.41Å; I264-I268 WeakPolarHBondContact O-CG1 3.43Å; I264-I268 PolarHBondContact O-N 3.18Å |
| 265 | P | 89.2 | Confident | 87.9 | Confident | 69 Ų | 69 | 84.8 Ų | 84.8 | 45% | 0.448 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -60.2 | -37.9 | 177.8 | -26 | 35.9 | 0 | 0 | 0 | 113.6 | F261 I268 F269 | F261-P265 WeakPolarHBondContact O-CD 3.35Å; F261-P265 VanDerWaalsContact O-CG 3.23Å; F261-P265 WeakPolarHBondContact O-CG 3.13Å; P265-I268 PolarHBondContact O-N 3.37Å; P265-F269 WeakPolarHBondContact O-CB 3.35Å; P265-F269 PolarHBondContact O-N 2.83Å |
| 266 | I | 90.2 | Very high | 88.8 | Confident | 93 Ų | 93 | 80.1 Ų | 80.1 | 48% | 0.477 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -64.4 | -44.2 | 178 | -66 | 170.3 | 0 | 0 | 0 | 110.6 | I262 S263 I264 I268 F269 L270 | I262-I266 HydrophobicContact CG2-CD1 3.96Å; I262-I266 WeakPolarHBondContact O-CD1 3.14Å; I262-I266 WeakPolarHBondContact O-CG1 3.15Å; S263-I266 PolarHBondContact O-N 2.52Å; I264-I266 VanDerWaalsContact C-N 3.31Å; I264-I266 PolarHBondContact O-N 2.7Å; I266-I268 VanDerWaalsContact C-N 3.34Å; I266-F269 PolarHBondContact O-N 2.85Å; I266-L270 HydrophobicContact CG2-CD1 4.12Å; I266-L270 HydrophobicContact CG2-CG 4.49Å; I266-L270 WeakPolarHBondContact O-CG 3.29Å; I266-L270 PolarHBondContact O-N 3.28Å |
| 267 | V | 93.1 | Very high | 89.5 | Confident | 96 Ų | 96 | 75.2 Ų | 75.2 | 58% | 0.582 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -63.2 | -42.8 | 177.5 | 172.9 | 0 | 0 | 0 | 0 | 110.8 | S263 I264 L270 L271 | S263-V267 WeakPolarHBondContact O-CG2 3.35Å; S263-V267 PolarHBondContact O-N 2.85Å; I264-V267 PolarHBondContact O-N 3.03Å; V267-L270 PolarHBondContact O-N 3.27Å; V267-L271 WeakPolarHBondContact O-CB 3.27Å; V267-L271 PolarHBondContact O-N 3.21Å |
| 268 | I | 92.1 | Very high | 90.3 | Very high | 72 Ų | 72 | 69.6 Ų | 69.6 | 37% | 0.369 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -61 | -48 | 176.1 | -68.4 | 169 | 0 | 0 | 0 | 110.5 | I264 P265 I266 L270 L271 Q272 | I264-I268 HydrophobicContact CG2-CD1 3.69Å; I264-I268 HydrophobicContact CG2-CG1 4.41Å; I264-I268 WeakPolarHBondContact O-CG1 3.43Å; I264-I268 PolarHBondContact O-N 3.18Å; P265-I268 PolarHBondContact O-N 3.37Å; I266-I268 VanDerWaalsContact C-N 3.34Å; I268-L270 PolarHBondContact O-N 3.22Å; I268-L271 WeakPolarHBondContact O-CB 3.05Å; I268-L271 PolarHBondContact O-N 2.82Å; I268-Q272 HydrophobicContact CG2-CG 4.42Å; I268-Q272 WeakPolarHBondContact O-CG 3.39Å; I268-Q272 PolarHBondContact O-N 2.8Å |
| 269 | F | 92.4 | Very high | 91.1 | Very high | 82 Ų | 82 | 68.8 Ų | 68.8 | 36% | 0.36 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -58.3 | -47.2 | 178.2 | 179.9 | -93.1 | 0 | 0 | 0 | 111.9 | V108 P265 I266 L271 Q272 I273 | V108-F269 HydrophobicContact CG1-CD2 4.33Å; V108-F269 HydrophobicContact CG1-CE2 3.65Å; V108-F269 HydrophobicContact CG1-CZ 4.37Å; P265-F269 WeakPolarHBondContact O-CB 3.35Å; P265-F269 PolarHBondContact O-N 2.83Å; I266-F269 PolarHBondContact O-N 2.85Å; F269-L271 VanDerWaalsContact C-N 3.32Å; F269-L271 PolarHBondContact O-N 3Å; F269-Q272 WeakPolarHBondContact O-CB 3.39Å; F269-Q272 PolarHBondContact O-N 2.74Å; F269-I273 HydrophobicContact CD1-CG1 4.29Å; F269-I273 HydrophobicContact CE1-CG1 3.94Å; F269-I273 HydrophobicContact CZ-CD1 4.29Å; F269-I273 HydrophobicContact CZ-CG1 4.21Å; F269-I273 WeakPolarHBondContact O-CG1 3.43Å; F269-I273 PolarHBondContact O-N 3.36Å |
| 270 | L | 93.8 | Very high | 91.8 | Very high | 109 Ų | 109 | 65.8 Ų | 65.8 | 57% | 0.571 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -62.6 | -39.1 | 177.2 | -69.5 | 174.3 | 0 | 0 | 0 | 112.2 | I266 V267 I268 I273 A274 | I266-L270 HydrophobicContact CG2-CD1 4.12Å; I266-L270 HydrophobicContact CG2-CG 4.49Å; I266-L270 WeakPolarHBondContact O-CG 3.29Å; I266-L270 PolarHBondContact O-N 3.28Å; V267-L270 PolarHBondContact O-N 3.27Å; I268-L270 PolarHBondContact O-N 3.22Å; L270-I273 PolarHBondContact O-N 3.3Å; L270-A274 WeakPolarHBondContact O-CB 3.38Å; L270-A274 PolarHBondContact O-N 2.9Å |
| 271 | L | 93.9 | Very high | 92.4 | Very high | 67 Ų | 67 | 66.4 Ų | 66.4 | 35% | 0.351 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -65.1 | -39 | 175.3 | -173.8 | 67 | 0 | 0 | 0 | 111.7 | L15 V267 I268 F269 A274 T275 | L15-L271 HydrophobicContact CD1-CD1 4.01Å; L15-L271 HydrophobicContact CD2-CD1 4.17Å; V267-L271 WeakPolarHBondContact O-CB 3.27Å; V267-L271 PolarHBondContact O-N 3.21Å; I268-L271 WeakPolarHBondContact O-CB 3.05Å; I268-L271 PolarHBondContact O-N 2.82Å; F269-L271 VanDerWaalsContact C-N 3.32Å; F269-L271 PolarHBondContact O-N 3Å; L271-A274 PolarHBondContact O-N 3.49Å; L271-T275 WeakPolarHBondContact O-CG2 3.47Å; L271-T275 PolarHBondContact O-N 2.98Å; L271-T275 PolarHBondContact O-OG1 3.11Å |
| 272 | Q | 94.9 | Very high | 93.1 | Very high | 14 Ų | 14 | 59.5 Ų | 59.5 | 7% | 0.065 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -63.2 | -45.2 | 174.4 | -71.9 | 178 | 1.2 | 0 | 0 | 111.6 | M104 V108 E111 I268 F269 A274 T275 I276 | M104-Q272 HydrophobicContact CE-CB 4.04Å; M104-Q272 HydrophobicContact CE-CG 3.75Å; V108-Q272 HydrophobicContact CG2-CB 3.85Å; E111-Q272 PolarHBondContact OE1-NE2 3.5Å; E111-Q272 PolarHBondContact OE2-NE2 2.85Å; E111-Q272 PolarHBondContact OE2-OE1 2.89Å; I268-Q272 HydrophobicContact CG2-CG 4.42Å; I268-Q272 WeakPolarHBondContact O-CG 3.39Å; I268-Q272 PolarHBondContact O-N 2.8Å; F269-Q272 WeakPolarHBondContact O-CB 3.39Å; F269-Q272 PolarHBondContact O-N 2.74Å; Q272-A274 VanDerWaalsContact C-N 3.34Å; Q272-A274 PolarHBondContact O-N 3.26Å; Q272-T275 WeakPolarHBondContact CA-OG1 3.06Å; Q272-T275 PolarHBondContact O-N 3.44Å; Q272-T275 PolarHBondContact O-OG1 3.2Å; Q272-I276 WeakPolarHBondContact O-CB 3.36Å; Q272-I276 WeakPolarHBondContact O-CD1 3.31Å; Q272-I276 VanDerWaalsContact O-CG1 3.24Å; Q272-I276 WeakPolarHBondContact O-CG1 3.37Å; Q272-I276 PolarHBondContact O-N 3.22Å |
| 273 | I | 95.2 | Very high | 93.7 | Very high | 81 Ų | 81 | 55.4 Ų | 55.4 | 42% | 0.415 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -62 | -43 | 176.3 | -63.3 | -59.5 | 0 | 0 | 0 | 111.2 | V108 F269 L270 I276 G277 | V108-I273 HydrophobicContact CG1-CD1 4.32Å; V108-I273 HydrophobicContact CG2-CD1 4.38Å; F269-I273 HydrophobicContact CD1-CG1 4.29Å; F269-I273 HydrophobicContact CE1-CG1 3.94Å; F269-I273 HydrophobicContact CZ-CD1 4.29Å; F269-I273 HydrophobicContact CZ-CG1 4.21Å; F269-I273 WeakPolarHBondContact O-CG1 3.43Å; F269-I273 PolarHBondContact O-N 3.36Å; L270-I273 PolarHBondContact O-N 3.3Å; I273-I276 PolarHBondContact O-N 3.04Å; I273-G277 PolarHBondContact O-N 3.07Å |
| 274 | A | 94.6 | Very high | 94 | Very high | 47 Ų | 47 | 56.1 Ų | 56.1 | 39% | 0.388 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -62.1 | -44.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | L270 L271 Q272 G277 L278 | L270-A274 WeakPolarHBondContact O-CB 3.38Å; L270-A274 PolarHBondContact O-N 2.9Å; L271-A274 PolarHBondContact O-N 3.49Å; Q272-A274 VanDerWaalsContact C-N 3.34Å; Q272-A274 PolarHBondContact O-N 3.26Å; A274-G277 PolarHBondContact O-N 3.1Å; A274-L278 VanDerWaalsContact O-CG 3.28Å; A274-L278 WeakPolarHBondContact O-CG 3.46Å; A274-L278 PolarHBondContact O-N 3.35Å |
| 275 | T | 95.3 | Very high | 94.1 | Very high | 2 Ų | 2 | 54.8 Ų | 54.8 | 1% | 0.012 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -67.3 | -38.9 | 178.7 | 47.7 | 0 | 0 | 0 | 0 | 112.5 | L12 L15 M104 L271 Q272 L278 S279 | L12-T275 HydrophobicContact CD1-CG2 4.13Å; L15-T275 HydrophobicContact CD1-CG2 3.74Å; M104-T275 VanDerWaalsContact CE-OG1 3.22Å; M104-T275 WeakPolarHBondContact CE-OG1 3.31Å; L271-T275 WeakPolarHBondContact O-CG2 3.47Å; L271-T275 PolarHBondContact O-N 2.98Å; L271-T275 PolarHBondContact O-OG1 3.11Å; Q272-T275 WeakPolarHBondContact CA-OG1 3.06Å; Q272-T275 PolarHBondContact O-N 3.44Å; Q272-T275 PolarHBondContact O-OG1 3.2Å; T275-L278 PolarHBondContact O-N 3.01Å; T275-S279 WeakPolarHBondContact O-CB 3.33Å; T275-S279 PolarHBondContact O-N 3.05Å |
| 276 | I | 96.6 | Very high | 94.2 | Very high | 17 Ų | 17 | 52 Ų | 52 | 9% | 0.087 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -59.3 | -49.6 | 171 | -72 | 164.2 | 0 | 0 | 0 | 110.3 | T101 M104 I105 V108 Q272 I273 L278 S279 I280 | T101-I276 HydrophobicContact CG2-CG2 4.16Å; M104-I276 HydrophobicContact CB-CD1 3.89Å; M104-I276 HydrophobicContact CB-CG1 3.58Å; I105-I276 HydrophobicContact CG1-CD1 4.08Å; I105-I276 HydrophobicContact CG1-CG2 4.49Å; V108-I276 HydrophobicContact CG2-CD1 3.85Å; Q272-I276 WeakPolarHBondContact O-CB 3.36Å; Q272-I276 WeakPolarHBondContact O-CD1 3.31Å; Q272-I276 VanDerWaalsContact O-CG1 3.24Å; Q272-I276 WeakPolarHBondContact O-CG1 3.37Å; Q272-I276 PolarHBondContact O-N 3.22Å; I273-I276 PolarHBondContact O-N 3.04Å; I276-L278 PolarHBondContact O-N 3.06Å; I276-S279 PolarHBondContact O-N 3.44Å; I276-I280 HydrophobicContact CG2-CD1 3.72Å; I276-I280 HydrophobicContact CG2-CG1 4.43Å; I276-I280 WeakPolarHBondContact O-CG1 3.21Å; I276-I280 PolarHBondContact O-N 3.48Å |
| 277 | G | 96 | Very high | 94.2 | Very high | 40 Ų | 40 | 52.5 Ų | 52.5 | 41% | 0.412 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -59.7 | -44.1 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | I273 A274 I280 F281 | I273-G277 PolarHBondContact O-N 3.07Å; A274-G277 PolarHBondContact O-N 3.1Å; G277-I280 PolarHBondContact O-N 2.88Å; G277-F281 WeakPolarHBondContact O-CB 3.31Å; G277-F281 PolarHBondContact O-N 3.41Å |
| 278 | L | 95.2 | Very high | 94.1 | Very high | 38 Ų | 38 | 53 Ų | 53 | 20% | 0.199 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -64.6 | -41.4 | 175.7 | -70.5 | 167.4 | 0 | 0 | 0 | 112.4 | P8 F11 L12 A274 T275 I276 F281 L282 | P8-L278 HydrophobicContact CB-CD2 4Å; F11-L278 HydrophobicContact CD1-CD1 3.52Å; F11-L278 HydrophobicContact CE1-CD1 3.89Å; L12-L278 HydrophobicContact CD1-CB 4.3Å; A274-L278 VanDerWaalsContact O-CG 3.28Å; A274-L278 WeakPolarHBondContact O-CG 3.46Å; A274-L278 PolarHBondContact O-N 3.35Å; T275-L278 PolarHBondContact O-N 3.01Å; I276-L278 PolarHBondContact O-N 3.06Å; L278-F281 WeakPolarHBondContact O-CB 3.47Å; L278-F281 PolarHBondContact O-N 2.7Å; L278-L282 WeakPolarHBondContact O-CG 3.22Å; L278-L282 PolarHBondContact O-N 3.08Å |
| 279 | S | 96.4 | Very high | 93.8 | Very high | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -62.2 | -48.4 | 176.4 | -178.4 | 0 | 0 | 0 | 0 | 111.4 | L97 T101 T275 I276 F281 L282 I283 | L97-S279 PolarHBondContact O-OG 2.94Å; T101-S279 WeakPolarHBondContact OG1-CB 3.27Å; T101-S279 PolarHBondContact OG1-OG 3.33Å; T275-S279 WeakPolarHBondContact O-CB 3.33Å; T275-S279 PolarHBondContact O-N 3.05Å; I276-S279 PolarHBondContact O-N 3.44Å; S279-F281 VanDerWaalsContact C-N 3.31Å; S279-F281 PolarHBondContact O-N 2.56Å; S279-L282 PolarHBondContact O-N 2.86Å; S279-L282 VanDerWaalsContact O-N 3.16Å; S279-I283 VanDerWaalsContact O-CG1 3.27Å; S279-I283 WeakPolarHBondContact O-CG1 3.35Å; S279-I283 PolarHBondContact O-N 2.87Å |
| 280 | I | 96.3 | Very high | 93.4 | Very high | 77 Ų | 77 | 52 Ų | 52 | 40% | 0.395 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -59.6 | -42.8 | 176.6 | -67.7 | 170.4 | 0 | 0 | 0 | 110.8 | T101 I276 G277 L282 I283 C284 | T101-I280 HydrophobicContact CG2-CD1 4.18Å; T101-I280 HydrophobicContact CG2-CG1 3.84Å; I276-I280 HydrophobicContact CG2-CD1 3.72Å; I276-I280 HydrophobicContact CG2-CG1 4.43Å; I276-I280 WeakPolarHBondContact O-CG1 3.21Å; I276-I280 PolarHBondContact O-N 3.48Å; G277-I280 PolarHBondContact O-N 2.88Å; I280-L282 PolarHBondContact O-N 3.3Å; I280-I283 PolarHBondContact O-N 2.76Å; I280-C284 WeakPolarHBondContact O-CB 3.44Å; I280-C284 PolarHBondContact O-N 2.98Å; I280-C284 PolarHBondContact O-SG 3.17Å; I280-C284 VanDerWaalsContact O-SG 3.38Å |
| 281 | F | 95.1 | Very high | 93 | Very high | 79 Ų | 79 | 50.5 Ų | 50.5 | 35% | 0.346 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -57.3 | -48.4 | 175.3 | 174.9 | -95.1 | 0 | 0 | 0 | 111.6 | T4 P8 G277 L278 S279 C284 R285 | T4-F281 WeakPolarHBondContact O-CE1 3.19Å; P8-F281 HydrophobicContact CB-CD1 4.11Å; P8-F281 HydrophobicContact CB-CE1 4.2Å; P8-F281 HydrophobicContact CG-CD1 4.14Å; P8-F281 HydrophobicContact CG-CE1 3.81Å; G277-F281 WeakPolarHBondContact O-CB 3.31Å; G277-F281 PolarHBondContact O-N 3.41Å; L278-F281 WeakPolarHBondContact O-CB 3.47Å; L278-F281 PolarHBondContact O-N 2.7Å; S279-F281 VanDerWaalsContact C-N 3.31Å; S279-F281 PolarHBondContact O-N 2.56Å; F281-C284 PolarHBondContact O-N 2.68Å; F281-R285 HydrophobicContact CD1-CG 4.28Å; F281-R285 HydrophobicContact CE1-CG 3.87Å; F281-R285 HydrophobicContact CE2-CG 4.14Å; F281-R285 HydrophobicContact CZ-CG 3.8Å; F281-R285 VanDerWaalsContact O-CG 3.28Å; F281-R285 WeakPolarHBondContact O-CG 3.34Å; F281-R285 PolarHBondContact O-N 3.02Å |
| 282 | L | 94.6 | Very high | 92.7 | Very high | 3 Ų | 3 | 52.5 Ų | 52.5 | 2% | 0.016 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -63.4 | -43.4 | 177.6 | -69.8 | 174.1 | 0 | 0 | 0 | 111.9 | F5 P8 K9 L12 V89 L97 L278 S279 I280 C284 R285 I286 | F5-L282 HydrophobicContact CD2-CD2 3.95Å; F5-L282 HydrophobicContact CE2-CD2 3.66Å; F5-L282 HydrophobicContact CZ-CD2 4.08Å; P8-L282 HydrophobicContact CB-CD2 4.28Å; K9-L282 HydrophobicContact CB-CD2 4.26Å; L12-L282 HydrophobicContact CB-CD1 4.39Å; L12-L282 HydrophobicContact CD2-CD1 3.65Å; V89-L282 HydrophobicContact CG2-CD1 4.33Å; L97-L282 HydrophobicContact CD1-CB 4.2Å; L278-L282 WeakPolarHBondContact O-CG 3.22Å; L278-L282 PolarHBondContact O-N 3.08Å; S279-L282 PolarHBondContact O-N 2.86Å; S279-L282 VanDerWaalsContact O-N 3.16Å; I280-L282 PolarHBondContact O-N 3.3Å; L282-C284 VanDerWaalsContact C-N 3.3Å; L282-C284 PolarHBondContact O-N 3.09Å; L282-R285 PolarHBondContact O-N 2.79Å; L282-R285 VanDerWaalsContact O-N 3.14Å; L282-I286 WeakPolarHBondContact O-CD1 3.27Å; L282-I286 VanDerWaalsContact O-CG1 3.25Å; L282-I286 WeakPolarHBondContact O-CG1 3.47Å; L282-I286 PolarHBondContact O-N 3.37Å |
| 283 | I | 95.2 | Very high | 91.9 | Very high | 20 Ų | 20 | 58.7 Ų | 58.7 | 10% | 0.103 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -55.8 | -45.9 | 176.2 | -68.5 | 162.1 | 0 | 0 | 0 | 110.9 | R94 L97 I98 S279 I280 K287 | R94-I283 PolarHBondContact NE-O 2.61Å; L97-I283 HydrophobicContact CB-CD1 3.83Å; L97-I283 HydrophobicContact CB-CG1 3.46Å; L97-I283 VanDerWaalsContact CB-CG1 3.46Å; L97-I283 HydrophobicContact CD1-CG1 4.14Å; L97-I283 HydrophobicContact CG-CG1 4.43Å; I98-I283 HydrophobicContact CG1-CD1 3.93Å; I98-I283 HydrophobicContact CG1-CG1 4.44Å; I98-I283 HydrophobicContact CG1-CG2 4.25Å; S279-I283 VanDerWaalsContact O-CG1 3.27Å; S279-I283 WeakPolarHBondContact O-CG1 3.35Å; S279-I283 PolarHBondContact O-N 2.87Å; I280-I283 PolarHBondContact O-N 2.76Å; I283-K287 WeakPolarHBondContact O-CB 3.33Å; I283-K287 PolarHBondContact O-N 3.23Å |
| 284 | C | 94 | Very high | 90.7 | Very high | 75 Ų | 75 | 64.1 Ų | 64.1 | 51% | 0.507 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -66 | -37.9 | 179 | -73.6 | 0 | 0 | 0 | 0 | 112.3 | I280 F281 L282 K288 | I280-C284 WeakPolarHBondContact O-CB 3.44Å; I280-C284 PolarHBondContact O-N 2.98Å; I280-C284 PolarHBondContact O-SG 3.17Å; I280-C284 VanDerWaalsContact O-SG 3.38Å; F281-C284 PolarHBondContact O-N 2.68Å; L282-C284 VanDerWaalsContact C-N 3.3Å; L282-C284 PolarHBondContact O-N 3.09Å; C284-K288 PolarHBondContact O-N 3.42Å |
| 285 | R | 92 | Very high | 88.9 | Confident | 69 Ų | 69 | 74.2 Ų | 74.2 | 26% | 0.26 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -70.9 | -43.3 | 178.6 | -66.5 | -68.7 | -87.8 | -175.8 | -4.1 | 111.9 | S2 T4 F5 F281 L282 K287 K288 W289 | S2-R285 PolarHBondContact OG-NH2 2.76Å; T4-R285 PolarHBondContact OG1-NH2 2.72Å; F5-R285 HydrophobicContact CD2-CB 3.68Å; F5-R285 HydrophobicContact CD2-CG 4.26Å; F5-R285 HydrophobicContact CE2-CB 3.76Å; F281-R285 HydrophobicContact CD1-CG 4.28Å; F281-R285 HydrophobicContact CE1-CG 3.87Å; F281-R285 HydrophobicContact CE2-CG 4.14Å; F281-R285 HydrophobicContact CZ-CG 3.8Å; F281-R285 VanDerWaalsContact O-CG 3.28Å; F281-R285 WeakPolarHBondContact O-CG 3.34Å; F281-R285 PolarHBondContact O-N 3.02Å; L282-R285 PolarHBondContact O-N 2.79Å; L282-R285 VanDerWaalsContact O-N 3.14Å; R285-K287 VanDerWaalsContact C-N 3.32Å; R285-K287 PolarHBondContact O-N 3.03Å; R285-K288 WeakPolarHBondContact O-CB 3.39Å; R285-K288 PolarHBondContact O-N 3.16Å; R285-K288 VanDerWaalsContact O-N 3.16Å; R285-W289 PolarHBondContact O-N 3.13Å; R285-W289 VanDerWaalsContact O-N 3.14Å |
| 286 | I | 90.5 | Very high | 88.6 | Confident | 10 Ų | 10 | 77.8 Ų | 77.8 | 5% | 0.051 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -63.2 | -42.2 | 176.3 | -59 | 159.4 | 0 | 0 | 0 | 109.7 | F5 E92 R94 L97 L282 K288 W289 D290 | F5-I286 HydrophobicContact CE2-CG1 4.02Å; F5-I286 HydrophobicContact CZ-CG1 3.96Å; E92-I286 HydrophobicContact CB-CD1 4.19Å; R94-I286 HydrophobicContact CG-CB 3.75Å; R94-I286 HydrophobicContact CG-CD1 4.39Å; R94-I286 HydrophobicContact CG-CG2 3.49Å; R94-I286 VanDerWaalsContact CG-CG2 3.49Å; L97-I286 HydrophobicContact CD1-CD1 3.57Å; L282-I286 WeakPolarHBondContact O-CD1 3.27Å; L282-I286 VanDerWaalsContact O-CG1 3.25Å; L282-I286 WeakPolarHBondContact O-CG1 3.47Å; L282-I286 PolarHBondContact O-N 3.37Å; I286-K288 VanDerWaalsContact C-N 3.25Å; I286-K288 PolarHBondContact O-N 3.44Å; I286-W289 PolarHBondContact O-N 3.36Å; I286-W289 VanDerWaalsContact O-N 3.15Å; I286-D290 PolarHBondContact O-N 3.49Å |
| 287 | K | 91.9 | Very high | 88.2 | Confident | 104 Ų | 104 | 81 Ų | 81 | 45% | 0.452 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -54 | -43.6 | 174 | -173.5 | 176.6 | -174.6 | -179.1 | 0 | 112.4 | R94 I283 R285 D290 N291 | R94-K287 VanDerWaalsContact CZ-CG 3.49Å; I283-K287 WeakPolarHBondContact O-CB 3.33Å; I283-K287 PolarHBondContact O-N 3.23Å; R285-K287 VanDerWaalsContact C-N 3.32Å; R285-K287 PolarHBondContact O-N 3.03Å; K287-D290 PolarHBondContact O-N 2.97Å; K287-N291 VanDerWaalsContact O-CG 3.26Å; K287-N291 PolarHBondContact O-N 3.44Å; K287-N291 PolarHBondContact O-OD1 3.12Å |
| 288 | K | 89.1 | Confident | 87.7 | Confident | 107 Ų | 107 | 83.3 Ų | 83.3 | 47% | 0.465 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -64.8 | -42.9 | -178.4 | -177.1 | 174.5 | 170.8 | 171.9 | 0 | 110.8 | C284 R285 I286 N291 E292 | C284-K288 PolarHBondContact O-N 3.42Å; R285-K288 WeakPolarHBondContact O-CB 3.39Å; R285-K288 PolarHBondContact O-N 3.16Å; R285-K288 VanDerWaalsContact O-N 3.16Å; I286-K288 VanDerWaalsContact C-N 3.25Å; I286-K288 PolarHBondContact O-N 3.44Å; K288-N291 PolarHBondContact O-N 2.92Å; K288-E292 WeakPolarHBondContact CE-OE1 3.31Å; K288-E292 IonicContact NZ-OE1 3.78Å; K288-E292 WeakPolarHBondContact O-CG 3.43Å; K288-E292 PolarHBondContact O-N 3.32Å |
| 289 | W | 85.9 | Confident | 87.3 | Confident | 72 Ų | 72 | 85.9 Ų | 85.9 | 27% | 0.273 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -66.8 | -41 | 175.9 | -71.6 | -14.6 | 0 | 0 | 0 | 113.2 | M1 F5 R285 I286 N291 E292 L293 | M1-W289 HydrophobicContact CE-CH2 3.69Å; M1-W289 HydrophobicContact CE-CZ3 3.63Å; M1-W289 HydrophobicContact CG-CH2 3.7Å; M1-W289 HydrophobicContact CG-CZ2 4.4Å; M1-W289 HydrophobicContact SD-CH2 4.46Å; F5-W289 HydrophobicContact CB-CH2 4.09Å; F5-W289 HydrophobicContact CB-CZ2 4.32Å; F5-W289 AromaticContact CD1-CH2 3.43Å; F5-W289 HydrophobicContact CD1-CH2 3.43Å; F5-W289 VanDerWaalsContact CD1-CH2 3.43Å; F5-W289 HydrophobicContact CD1-CZ2 4.43Å; F5-W289 AromaticContact CD1-CZ3 3.96Å; F5-W289 HydrophobicContact CD1-CZ3 3.96Å; F5-W289 AromaticContact CD2-CH2 3.85Å; F5-W289 HydrophobicContact CD2-CH2 3.85Å; F5-W289 HydrophobicContact CD2-CZ2 4.33Å; F5-W289 HydrophobicContact CD2-CZ3 4.33Å; F5-W289 AromaticContact CE1-CH2 3.65Å; F5-W289 HydrophobicContact CE1-CH2 3.65Å; F5-W289 AromaticContact CE1-CZ3 3.66Å; F5-W289 HydrophobicContact CE1-CZ3 3.66Å; F5-W289 HydrophobicContact CE2-CH2 4.06Å; F5-W289 HydrophobicContact CE2-CZ3 4.07Å; F5-W289 AromaticContact CG-CH2 3.5Å; F5-W289 HydrophobicContact CG-CH2 3.5Å; F5-W289 VanDerWaalsContact CG-CH2 3.5Å; F5-W289 HydrophobicContact CG-CZ2 4.11Å; F5-W289 HydrophobicContact CG-CZ3 4.26Å; F5-W289 AromaticContact CZ-CH2 3.95Å; F5-W289 HydrophobicContact CZ-CH2 3.95Å; F5-W289 AromaticContact CZ-CZ3 3.7Å; F5-W289 HydrophobicContact CZ-CZ3 3.7Å; R285-W289 PolarHBondContact O-N 3.13Å; R285-W289 VanDerWaalsContact O-N 3.14Å; I286-W289 PolarHBondContact O-N 3.36Å; I286-W289 VanDerWaalsContact O-N 3.15Å; W289-N291 VanDerWaalsContact C-N 3.29Å; W289-N291 PolarHBondContact O-N 3.43Å; W289-E292 PolarHBondContact O-N 2.67Å; W289-L293 PolarHBondContact O-N 3.36Å |
| 290 | D | 84.1 | Confident | 86.7 | Confident | 60 Ų | 60 | 91.3 Ų | 91.3 | 32% | 0.321 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -54.9 | -51.4 | 173.7 | -66.4 | -23.6 | 0 | 0 | 0 | 109.2 | R94 I286 K287 E292 L293 Y294 | R94-D290 WeakPolarHBondContact CD-OD2 3.43Å; R94-D290 IonicContact NH1-OD2 2.8Å; R94-D290 PolarHBondContact NH1-OD2 3.02Å; I286-D290 PolarHBondContact O-N 3.49Å; K287-D290 PolarHBondContact O-N 2.97Å; D290-E292 PolarHBondContact O-N 2.82Å; D290-L293 WeakPolarHBondContact O-CB 3.45Å; D290-L293 PolarHBondContact O-N 2.95Å; D290-L293 VanDerWaalsContact O-N 3.11Å; D290-Y294 WeakPolarHBondContact O-CD2 3.4Å; D290-Y294 PolarHBondContact O-N 3.21Å |
| 291 | N | 86.7 | Confident | 86.1 | Confident | 78 Ų | 78 | 92.3 Ų | 92.3 | 42% | 0.417 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -60.7 | -44.5 | -179.7 | -70.6 | -4.1 | 0 | 0 | 0 | 112.4 | K287 K288 W289 L293 Y294 Y295 | K287-N291 VanDerWaalsContact O-CG 3.26Å; K287-N291 PolarHBondContact O-N 3.44Å; K287-N291 PolarHBondContact O-OD1 3.12Å; K288-N291 PolarHBondContact O-N 2.92Å; W289-N291 VanDerWaalsContact C-N 3.29Å; W289-N291 PolarHBondContact O-N 3.43Å; N291-L293 PolarHBondContact O-N 3.09Å; N291-Y294 PolarHBondContact O-N 2.99Å; N291-Y295 WeakPolarHBondContact O-CD2 3.3Å; N291-Y295 PolarHBondContact O-N 3.19Å |
| 292 | E | 86.5 | Confident | 85.5 | Confident | 109 Ų | 109 | 93.2 Ų | 93.2 | 51% | 0.509 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -64.1 | -22.5 | 177.6 | -75 | 173.1 | 176.7 | 0 | 0 | 113.1 | K288 W289 D290 | K288-E292 WeakPolarHBondContact CE-OE1 3.31Å; K288-E292 IonicContact NZ-OE1 3.78Å; K288-E292 WeakPolarHBondContact O-CG 3.43Å; K288-E292 PolarHBondContact O-N 3.32Å; W289-E292 PolarHBondContact O-N 2.67Å; D290-E292 PolarHBondContact O-N 2.82Å |
| 293 | L | 79.4 | Confident | 84.7 | Confident | 145 Ų | 145 | 100.2 Ų | 100.2 | 76% | 0.759 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -79.8 | -22.2 | 176.3 | -132.4 | 95.4 | 0 | 0 | 0 | 113.3 | W289 D290 N291 | W289-L293 PolarHBondContact O-N 3.36Å; D290-L293 WeakPolarHBondContact O-CB 3.45Å; D290-L293 PolarHBondContact O-N 2.95Å; D290-L293 VanDerWaalsContact O-N 3.11Å; N291-L293 PolarHBondContact O-N 3.09Å |
| 294 | Y | 69.8 | Low | 83.9 | Confident | 194 Ų | 194 | 106.8 Ų | 106.8 | 76% | 0.761 | 48% | 0.483 | S | S | * | . | trans | -99.7 | -0.6 | -177 | -67.7 | -67.7 | 0 | 0 | 0 | 113.8 | D290 N291 | D290-Y294 WeakPolarHBondContact O-CD2 3.4Å; D290-Y294 PolarHBondContact O-N 3.21Å; N291-Y294 PolarHBondContact O-N 2.99Å | ||
| 295 | Y | 56.7 | Low | 83 | Confident | 259 Ų | 259 | 109.7 Ų | 109.7 | 100% | 1.016 | 48% | 0.48 | S | S | * | . | trans | -113.7 | 0 | 173.3 | -75.9 | -70.1 | 0 | 0 | 0 | 110.7 | N291 | N291-Y295 WeakPolarHBondContact O-CD2 3.3Å; N291-Y295 PolarHBondContact O-N 3.19Å |
Retrieved 295 of 295 residues in 62.9 ms
(Link to these results)