| 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 | 56 | Low | 80.6 | Confident | 62 Ų | 62 | 55.2 Ų | 55.2 | 31% | 0.305 | 33% | 0.334 | S | S | . | . | 0 | 162.5 | 0 | -76.7 | 178.4 | 72.2 | 0 | 0 | 108.6 | R218 F221 | M1-R218 HydrophobicContact CE-CG 4.28Å; M1-R218 HydrophobicContact CG-CG 4.36Å; M1-R218 VanDerWaalsContact SD-CA 3.58Å; M1-R218 HydrophobicContact SD-CB 4.45Å; M1-R218 HydrophobicContact SD-CG 4.21Å; M1-F221 HydrophobicContact CE-CB 4.46Å; M1-F221 HydrophobicContact CG-CD2 4.26Å; M1-F221 HydrophobicContact CG-CE2 4.31Å; M1-F221 HydrophobicContact SD-CB 3.95Å; M1-F221 HydrophobicContact SD-CD2 3.16Å; M1-F221 WeakPolarHBondContact SD-CD2 3.34Å; M1-F221 HydrophobicContact SD-CE2 3.76Å; M1-F221 HydrophobicContact SD-CG 3.66Å | |||
| 2 | T | 72.9 | Confident | 81.5 | Confident | 101 Ų | 101 | 58.3 Ų | 58.3 | 62% | 0.62 | 35% | 0.346 | S | S | * | . | trans | -75.5 | 152.4 | 169 | 51 | 0 | 0 | 0 | 0 | 110.3 | L4 G5 | T2-L4 PolarHBondContact O-N 2.72Å; T2-L4 VanDerWaalsContact O-N 3.13Å; T2-G5 PolarHBondContact O-N 3.23Å | ||
| 3 | C | 72.5 | Confident | 82.2 | Confident | 49 Ų | 49 | 53.8 Ų | 53.8 | 33% | 0.331 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -46 | -40.1 | 172.4 | 170.8 | 0 | 0 | 0 | 0 | 112.5 | G5 G6 V7 Y205 | C3-G5 VanDerWaalsContact C-N 3.3Å; C3-G5 PolarHBondContact O-N 2.98Å; C3-G6 PolarHBondContact O-N 2.77Å; C3-G6 VanDerWaalsContact O-N 3.15Å; C3-V7 WeakPolarHBondContact O-CG2 3.15Å; C3-V7 PolarHBondContact O-N 3.16Å; C3-Y205 HydrophobicContact CB-CD1 4.41Å; C3-Y205 HydrophobicContact CB-CE1 4.1Å; C3-Y205 WeakPolarHBondContact SG-CE1 3.4Å; C3-Y205 VanDerWaalsContact SG-CZ 3.56Å |
| 4 | L | 80.9 | Confident | 83 | Confident | 139 Ų | 139 | 52.1 Ų | 52.1 | 73% | 0.728 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -57.4 | -38.8 | 177.7 | -175.4 | 64.3 | 0 | 0 | 0 | 113.3 | T2 V7 G8 | T2-L4 PolarHBondContact O-N 2.72Å; T2-L4 VanDerWaalsContact O-N 3.13Å; L4-V7 PolarHBondContact O-N 3.2Å; L4-G8 PolarHBondContact O-N 2.7Å |
| 5 | G | 79.7 | Confident | 83.8 | Confident | 21 Ų | 21 | 50.5 Ų | 50.5 | 22% | 0.216 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -67.2 | -40.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | T2 C3 G8 C9 | T2-G5 PolarHBondContact O-N 3.23Å; C3-G5 VanDerWaalsContact C-N 3.3Å; C3-G5 PolarHBondContact O-N 2.98Å; G5-G8 PolarHBondContact O-N 3.47Å; G5-C9 WeakPolarHBondContact O-CB 3.43Å; G5-C9 PolarHBondContact O-N 3.09Å; G5-C9 PolarHBondContact O-SG 2.61Å |
| 6 | G | 81.2 | Confident | 84.4 | Confident | 0 Ų | 0 | 49.7 Ų | 49.7 | 0% | 0 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -65.7 | -39.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | C3 C9 T10 | C3-G6 PolarHBondContact O-N 2.77Å; C3-G6 VanDerWaalsContact O-N 3.15Å; G6-C9 PolarHBondContact O-N 2.89Å; G6-T10 WeakPolarHBondContact O-CB 3.31Å; G6-T10 PolarHBondContact O-N 3.29Å; G6-T10 PolarHBondContact O-OG1 3.38Å |
| 7 | V | 87.6 | Confident | 84.9 | Confident | 55 Ų | 55 | 46.8 Ų | 46.8 | 33% | 0.333 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -62.6 | -48.8 | 173.1 | 172.9 | 0 | 0 | 0 | 0 | 110.8 | C3 L4 C9 T10 L11 L201 | C3-V7 WeakPolarHBondContact O-CG2 3.15Å; C3-V7 PolarHBondContact O-N 3.16Å; L4-V7 PolarHBondContact O-N 3.2Å; V7-C9 VanDerWaalsContact C-N 3.33Å; V7-C9 PolarHBondContact O-N 3.14Å; V7-T10 WeakPolarHBondContact O-CB 3.5Å; V7-T10 PolarHBondContact O-N 3.19Å; V7-T10 VanDerWaalsContact O-N 3.11Å; V7-L11 HydrophobicContact CG1-CD1 3.78Å; V7-L11 WeakPolarHBondContact O-CD1 3.21Å; V7-L11 PolarHBondContact O-N 2.81Å; V7-L201 HydrophobicContact CG2-CD1 3.82Å |
| 8 | G | 88.8 | Confident | 85.3 | Confident | 31 Ų | 31 | 48.6 Ų | 48.6 | 32% | 0.32 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -58.9 | -42.7 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | L4 G5 T10 L11 I12 | L4-G8 PolarHBondContact O-N 2.7Å; G5-G8 PolarHBondContact O-N 3.47Å; G8-T10 VanDerWaalsContact C-N 3.34Å; G8-T10 PolarHBondContact O-N 3.14Å; G8-L11 PolarHBondContact O-N 3.29Å; G8-I12 WeakPolarHBondContact O-CG1 3.22Å; G8-I12 PolarHBondContact O-N 3.11Å; G8-I12 VanDerWaalsContact O-N 3.08Å |
| 9 | C | 87.5 | Confident | 85.9 | Confident | 7 Ų | 7 | 51.2 Ų | 51.2 | 5% | 0.047 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -59.6 | -43.1 | 173.6 | -74.9 | 0 | 0 | 0 | 0 | 112.1 | G5 G6 V7 L11 I12 G13 S225 | G5-C9 WeakPolarHBondContact O-CB 3.43Å; G5-C9 PolarHBondContact O-N 3.09Å; G5-C9 PolarHBondContact O-SG 2.61Å; G6-C9 PolarHBondContact O-N 2.89Å; V7-C9 VanDerWaalsContact C-N 3.33Å; V7-C9 PolarHBondContact O-N 3.14Å; C9-L11 PolarHBondContact O-N 3.35Å; C9-I12 WeakPolarHBondContact O-CB 2.88Å; C9-I12 PolarHBondContact O-N 3.35Å; C9-G13 PolarHBondContact O-N 3.33Å; C9-G13 VanDerWaalsContact O-N 3.08Å; C9-S225 WeakPolarHBondContact CB-OG 3.31Å; C9-S225 WeakPolarHBondContact O-CB 3.2Å; C9-S225 PolarHBondContact O-OG 2.75Å; C9-S225 VanDerWaalsContact O-OG 3.1Å |
| 10 | T | 88.8 | Confident | 86.3 | Confident | 29 Ų | 29 | 51.3 Ų | 51.3 | 18% | 0.178 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -61.2 | -44.1 | 175.8 | -64.9 | 0 | 0 | 0 | 0 | 112.3 | G6 V7 G8 I12 G13 V14 | G6-T10 WeakPolarHBondContact O-CB 3.31Å; G6-T10 PolarHBondContact O-N 3.29Å; G6-T10 PolarHBondContact O-OG1 3.38Å; V7-T10 WeakPolarHBondContact O-CB 3.5Å; V7-T10 PolarHBondContact O-N 3.19Å; V7-T10 VanDerWaalsContact O-N 3.11Å; G8-T10 VanDerWaalsContact C-N 3.34Å; G8-T10 PolarHBondContact O-N 3.14Å; T10-I12 VanDerWaalsContact C-N 3.32Å; T10-I12 PolarHBondContact O-N 3Å; T10-G13 PolarHBondContact O-N 3.42Å; T10-V14 HydrophobicContact CG2-CG2 4.29Å; T10-V14 WeakPolarHBondContact O-CG2 3.33Å; T10-V14 PolarHBondContact O-N 3.45Å |
| 11 | L | 91 | Very high | 86.7 | Confident | 113 Ų | 113 | 51.2 Ų | 51.2 | 59% | 0.592 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -62 | -38.3 | 176.7 | -82.9 | 137.9 | 0 | 0 | 0 | 112.2 | V7 G8 C9 G15 | V7-L11 HydrophobicContact CG1-CD1 3.78Å; V7-L11 WeakPolarHBondContact O-CD1 3.21Å; V7-L11 PolarHBondContact O-N 2.81Å; G8-L11 PolarHBondContact O-N 3.29Å; C9-L11 PolarHBondContact O-N 3.35Å; L11-G15 WeakPolarHBondContact O-CA 3.47Å; L11-G15 PolarHBondContact O-N 2.93Å |
| 12 | I | 91.2 | Very high | 88.5 | Confident | 93 Ų | 93 | 52.8 Ų | 52.8 | 48% | 0.477 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -62.2 | -44.9 | 174.6 | -67.9 | 164.9 | 0 | 0 | 0 | 110.5 | G8 C9 T10 L222 | G8-I12 WeakPolarHBondContact O-CG1 3.22Å; G8-I12 PolarHBondContact O-N 3.11Å; G8-I12 VanDerWaalsContact O-N 3.08Å; C9-I12 WeakPolarHBondContact O-CB 2.88Å; C9-I12 PolarHBondContact O-N 3.35Å; T10-I12 VanDerWaalsContact C-N 3.32Å; T10-I12 PolarHBondContact O-N 3Å; I12-L222 HydrophobicContact CD1-CD2 4.26Å |
| 13 | G | 90 | Very high | 89.4 | Confident | 0 Ų | 0 | 51.8 Ų | 51.8 | 0% | 0 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -64.3 | -46.4 | 179 | 0 | 0 | 0 | 0 | 0 | 113.5 | C9 T10 G15 | C9-G13 PolarHBondContact O-N 3.33Å; C9-G13 VanDerWaalsContact O-N 3.08Å; T10-G13 PolarHBondContact O-N 3.42Å; G13-G15 VanDerWaalsContact C-N 3.34Å |
| 14 | V | 94.2 | Very high | 90.2 | Very high | 30 Ų | 30 | 52 Ų | 52 | 18% | 0.182 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -75.5 | -22.6 | -177.5 | 176.1 | 0 | 0 | 0 | 0 | 112.5 | T10 C17 L18 C193 | T10-V14 HydrophobicContact CG2-CG2 4.29Å; T10-V14 WeakPolarHBondContact O-CG2 3.33Å; T10-V14 PolarHBondContact O-N 3.45Å; V14-C17 PolarHBondContact O-N 3.42Å; V14-C17 VanDerWaalsContact O-N 3.08Å; V14-L18 HydrophobicContact CG1-CB 4.3Å; V14-L18 PolarHBondContact O-N 3.3Å; V14-C193 VanDerWaalsContact CA-SG 3.55Å; V14-C193 WeakPolarHBondContact CG2-SG 3.5Å |
| 15 | G | 94.3 | Very high | 90.7 | Very high | 28 Ų | 28 | 45.4 Ų | 45.4 | 29% | 0.289 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -46.5 | -55.4 | -172.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | L11 G13 C17 L18 I19 | L11-G15 WeakPolarHBondContact O-CA 3.47Å; L11-G15 PolarHBondContact O-N 2.93Å; G13-G15 VanDerWaalsContact C-N 3.34Å; G15-C17 PolarHBondContact O-N 3.23Å; G15-L18 PolarHBondContact O-N 2.97Å; G15-L18 VanDerWaalsContact O-N 3.14Å; G15-I19 PolarHBondContact O-N 3.36Å |
| 16 | P | 93.5 | Very high | 91.3 | Very high | 37 Ų | 37 | 46.6 Ų | 46.6 | 24% | 0.24 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -62.8 | -35.1 | -179.7 | -30.4 | 41.4 | 0 | 0 | 0 | 114.5 | I19 L20 M229 M233 | P16-I19 VanDerWaalsContact O-CG2 3.26Å; P16-I19 WeakPolarHBondContact O-CG2 3.41Å; P16-L20 WeakPolarHBondContact O-CB 2.92Å; P16-L20 VanDerWaalsContact O-CG 3.28Å; P16-L20 WeakPolarHBondContact O-CG 3.41Å; P16-L20 PolarHBondContact O-N 2.97Å; P16-M229 HydrophobicContact CB-CG 4.45Å; P16-M229 HydrophobicContact CG-CG 3.66Å; P16-M229 HydrophobicContact CG-SD 3.72Å; P16-M233 HydrophobicContact CB-CE 3.92Å; P16-M233 HydrophobicContact CB-CG 4.34Å; P16-M233 HydrophobicContact CB-SD 4.07Å |
| 17 | C | 93.6 | Very high | 91.7 | Very high | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -68.9 | -40.5 | 173.9 | -71 | 0 | 0 | 0 | 0 | 111.1 | V14 G15 L20 F21 L186 L190 S232 M233 | V14-C17 PolarHBondContact O-N 3.42Å; V14-C17 VanDerWaalsContact O-N 3.08Å; G15-C17 PolarHBondContact O-N 3.23Å; C17-L20 PolarHBondContact O-N 3.29Å; C17-F21 WeakPolarHBondContact O-CB 3.33Å; C17-F21 PolarHBondContact O-N 2.91Å; C17-L186 HydrophobicContact CB-CD1 4.39Å; C17-L190 HydrophobicContact CB-CB 4.38Å; C17-S232 VanDerWaalsContact SG-CB 3.59Å; C17-M233 HydrophobicContact CB-CE 4.3Å; C17-M233 WeakPolarHBondContact SG-CE 3.45Å |
| 18 | L | 92.6 | Very high | 91.9 | Very high | 80 Ų | 80 | 52.1 Ų | 52.1 | 42% | 0.419 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -67.7 | -42.2 | -178.8 | -172.3 | 64.6 | 0 | 0 | 0 | 112 | V14 G15 F21 L22 | V14-L18 HydrophobicContact CG1-CB 4.3Å; V14-L18 PolarHBondContact O-N 3.3Å; G15-L18 PolarHBondContact O-N 2.97Å; G15-L18 VanDerWaalsContact O-N 3.14Å; L18-F21 WeakPolarHBondContact O-CB 3.41Å; L18-F21 PolarHBondContact O-N 3.36Å; L18-L22 HydrophobicContact CG-CD1 4.22Å; L18-L22 WeakPolarHBondContact O-CG 3.34Å; L18-L22 PolarHBondContact O-N 3.19Å |
| 19 | I | 96 | Very high | 92.1 | Very high | 98 Ų | 98 | 55.6 Ų | 55.6 | 50% | 0.503 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -65 | -41.6 | 177.2 | -169 | 64.6 | 0 | 0 | 0 | 111.3 | G15 P16 F21 L22 C23 | G15-I19 PolarHBondContact O-N 3.36Å; P16-I19 VanDerWaalsContact O-CG2 3.26Å; P16-I19 WeakPolarHBondContact O-CG2 3.41Å; I19-F21 VanDerWaalsContact C-N 3.32Å; I19-F21 PolarHBondContact O-N 2.95Å; I19-L22 PolarHBondContact O-N 3.08Å; I19-C23 WeakPolarHBondContact O-CB 3.42Å; I19-C23 PolarHBondContact O-N 3.17Å; I19-C23 PolarHBondContact O-SG 2.61Å; I19-C23 VanDerWaalsContact O-SG 3.41Å |
| 20 | L | 93.4 | Very high | 92.3 | Very high | 53 Ų | 53 | 60.5 Ų | 60.5 | 28% | 0.277 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -62.9 | -38.9 | 176.1 | -76.2 | -171.6 | 0 | 0 | 0 | 112.2 | P16 C17 T24 Y182 L186 M233 | P16-L20 WeakPolarHBondContact O-CB 2.92Å; P16-L20 VanDerWaalsContact O-CG 3.28Å; P16-L20 WeakPolarHBondContact O-CG 3.41Å; P16-L20 PolarHBondContact O-N 2.97Å; C17-L20 PolarHBondContact O-N 3.29Å; L20-T24 VanDerWaalsContact O-CB 3.24Å; L20-T24 WeakPolarHBondContact O-CB 3.27Å; L20-T24 PolarHBondContact O-N 3.23Å; L20-T24 PolarHBondContact O-OG1 2.92Å; L20-Y182 WeakPolarHBondContact CB-OH 3.47Å; L20-Y182 HydrophobicContact CD1-CE2 4.3Å; L20-L186 HydrophobicContact CB-CD1 3.92Å; L20-L186 HydrophobicContact CB-CD2 4.18Å; L20-L186 HydrophobicContact CD1-CD1 4.29Å; L20-M233 HydrophobicContact CD1-CE 3.99Å; L20-M233 HydrophobicContact CD1-SD 4.03Å |
| 21 | F | 94.3 | Very high | 92.5 | Very high | 49 Ų | 49 | 61.9 Ų | 61.9 | 22% | 0.215 | 35% | 0.353 | C | S | . | . | I | π-helix | trans | -62.8 | -52.2 | 174.3 | 170.7 | -103.7 | 0 | 0 | 0 | 112 | C17 L18 I19 V25 A26 L35 L186 | C17-F21 WeakPolarHBondContact O-CB 3.33Å; C17-F21 PolarHBondContact O-N 2.91Å; L18-F21 WeakPolarHBondContact O-CB 3.41Å; L18-F21 PolarHBondContact O-N 3.36Å; I19-F21 VanDerWaalsContact C-N 3.32Å; I19-F21 PolarHBondContact O-N 2.95Å; F21-V25 HydrophobicContact CD2-CB 3.86Å; F21-V25 HydrophobicContact CD2-CG1 3.9Å; F21-V25 HydrophobicContact CE2-CB 4.28Å; F21-V25 HydrophobicContact CE2-CG1 3.92Å; F21-V25 WeakPolarHBondContact O-CA 3.24Å; F21-V25 WeakPolarHBondContact O-CB 3.38Å; F21-V25 PolarHBondContact O-N 3.33Å; F21-A26 PolarHBondContact O-N 3.11Å; F21-L35 HydrophobicContact CD2-CD1 3.93Å; F21-L35 HydrophobicContact CD2-CD2 4.48Å; F21-L35 HydrophobicContact CE2-CD2 4.49Å; F21-L186 HydrophobicContact CB-CD2 4.29Å |
| 22 | L | 94.1 | Very high | 92.7 | Very high | 96 Ų | 96 | 58.7 Ų | 58.7 | 50% | 0.503 | 34% | 0.338 | S | S | . | . | I | π-helix | trans | -65.4 | -41.9 | -177.2 | -68.2 | 175.2 | 0 | 0 | 0 | 112.4 | L18 I19 | L18-L22 HydrophobicContact CG-CD1 4.22Å; L18-L22 WeakPolarHBondContact O-CG 3.34Å; L18-L22 PolarHBondContact O-N 3.19Å; I19-L22 PolarHBondContact O-N 3.08Å |
| 23 | C | 92.5 | Very high | 92.9 | Very high | 80 Ų | 80 | 59.5 Ų | 59.5 | 54% | 0.541 | 34% | 0.342 | S | S | . | . | I | π-helix | trans | -74.1 | -38.2 | -179.1 | -68.7 | 0 | 0 | 0 | 0 | 113.1 | I19 N27 | I19-C23 WeakPolarHBondContact O-CB 3.42Å; I19-C23 PolarHBondContact O-N 3.17Å; I19-C23 PolarHBondContact O-SG 2.61Å; I19-C23 VanDerWaalsContact O-SG 3.41Å; C23-N27 PolarHBondContact O-ND2 2.93Å |
| 24 | T | 89.9 | Confident | 93 | Very high | 53 Ų | 53 | 61 Ų | 61 | 33% | 0.325 | 35% | 0.349 | S | S | . | . | I | π-helix | trans | -109.4 | -38.3 | -166.1 | -45.6 | 0 | 0 | 0 | 0 | 113.8 | L20 Y182 | L20-T24 VanDerWaalsContact O-CB 3.24Å; L20-T24 WeakPolarHBondContact O-CB 3.27Å; L20-T24 PolarHBondContact O-N 3.23Å; L20-T24 PolarHBondContact O-OG1 2.92Å; T24-Y182 HydrophobicContact CG2-CD1 4.37Å; T24-Y182 HydrophobicContact CG2-CE1 3.56Å; T24-Y182 PolarHBondContact OG1-OH 3.35Å |
| 25 | V | 91 | Very high | 93.1 | Very high | 0 Ų | 0 | 59.9 Ų | 59.9 | 0% | 0 | 34% | 0.343 | C | S | . | . | I | π-helix | trans | -100.5 | -37.6 | -168.4 | 176.4 | 0 | 0 | 0 | 0 | 112.6 | F21 N27 C28 K31 V32 L35 V183 L186 | F21-V25 HydrophobicContact CD2-CB 3.86Å; F21-V25 HydrophobicContact CD2-CG1 3.9Å; F21-V25 HydrophobicContact CE2-CB 4.28Å; F21-V25 HydrophobicContact CE2-CG1 3.92Å; F21-V25 WeakPolarHBondContact O-CA 3.24Å; F21-V25 WeakPolarHBondContact O-CB 3.38Å; F21-V25 PolarHBondContact O-N 3.33Å; V25-N27 PolarHBondContact O-N 3.48Å; V25-C28 PolarHBondContact O-N 3.25Å; V25-C28 VanDerWaalsContact O-N 3.08Å; V25-K31 HydrophobicContact CG1-CB 3.83Å; V25-V32 HydrophobicContact CG1-CG2 3.95Å; V25-L35 HydrophobicContact CG1-CB 4.43Å; V25-L35 HydrophobicContact CG1-CD1 4.1Å; V25-L35 HydrophobicContact CG2-CD1 4.27Å; V25-V183 HydrophobicContact CG2-CG1 4.5Å; V25-V183 HydrophobicContact CG2-CG2 4.03Å; V25-L186 HydrophobicContact CG2-CD2 3.77Å |
| 26 | A | 90.8 | Very high | 93.2 | Very high | 46 Ų | 46 | 62.3 Ų | 62.3 | 38% | 0.38 | 35% | 0.352 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.8 | -25.9 | -174.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | F21 C28 | F21-A26 PolarHBondContact O-N 3.11Å; A26-C28 VanDerWaalsContact C-N 3.28Å; A26-C28 PolarHBondContact O-N 2.93Å |
| 27 | N | 90.9 | Very high | 93.3 | Very high | 135 Ų | 135 | 62.4 Ų | 62.4 | 72% | 0.722 | 36% | 0.356 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.6 | -8 | -178.6 | -63 | -37.8 | 0 | 0 | 0 | 114.4 | C23 V25 | C23-N27 PolarHBondContact O-ND2 2.93Å; V25-N27 PolarHBondContact O-N 3.48Å |
| 28 | C | 90.7 | Very high | 93.5 | Very high | 37 Ų | 37 | 62.4 Ų | 62.4 | 25% | 0.25 | 36% | 0.356 | C | S | . | . | trans | -139.1 | 112 | -172.3 | -164.3 | 0 | 0 | 0 | 0 | 112 | V25 A26 I30 K31 V32 | V25-C28 PolarHBondContact O-N 3.25Å; V25-C28 VanDerWaalsContact O-N 3.08Å; A26-C28 VanDerWaalsContact C-N 3.28Å; A26-C28 PolarHBondContact O-N 2.93Å; C28-I30 VanDerWaalsContact C-N 3.3Å; C28-I30 PolarHBondContact O-N 3.1Å; C28-I30 WeakPolarHBondContact SG-CG2 3.47Å; C28-K31 HydrophobicContact CB-CB 4.21Å; C28-K31 HydrophobicContact CB-CD 3.84Å; C28-K31 HydrophobicContact CB-CG 3.85Å; C28-K31 WeakPolarHBondContact O-CB 3.45Å; C28-K31 PolarHBondContact O-N 3.39Å; C28-V32 PolarHBondContact O-N 3.4Å | ||
| 29 | P | 93.8 | Very high | 93.7 | Very high | 104 Ų | 104 | 58.6 Ų | 58.6 | 68% | 0.675 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -63.6 | -32.9 | -173.2 | 23.8 | -33.3 | 0 | 0 | 0 | 113.2 | K31 V32 I33 | P29-K31 VanDerWaalsContact C-N 3.3Å; P29-K31 PolarHBondContact O-N 2.85Å; P29-V32 WeakPolarHBondContact O-CB 2.73Å; P29-V32 PolarHBondContact O-N 3.33Å; P29-V32 VanDerWaalsContact O-N 3.17Å; P29-I33 PolarHBondContact O-N 3Å |
| 30 | I | 91.2 | Very high | 93.8 | Very high | 110 Ų | 110 | 59.9 Ų | 59.9 | 56% | 0.564 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -63.1 | -36.5 | 175.3 | -177.9 | 58.6 | 0 | 0 | 0 | 111.8 | C28 I33 L34 | C28-I30 VanDerWaalsContact C-N 3.3Å; C28-I30 PolarHBondContact O-N 3.1Å; C28-I30 WeakPolarHBondContact SG-CG2 3.47Å; I30-I33 HydrophobicContact CD1-CD1 3.62Å; I30-I33 HydrophobicContact CD1-CG1 3.89Å; I30-I33 WeakPolarHBondContact O-CG1 3.07Å; I30-L34 WeakPolarHBondContact O-CB 3.31Å; I30-L34 PolarHBondContact O-N 3.41Å; I30-L34 VanDerWaalsContact O-N 3.1Å |
| 31 | K | 93.9 | Very high | 93.9 | Very high | 58 Ų | 58 | 59.4 Ų | 59.4 | 25% | 0.252 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -69.4 | -37 | 174.7 | -59.6 | -175.8 | -172.7 | -176.8 | 0 | 111.1 | V25 C28 P29 L34 L35 T179 V183 | V25-K31 HydrophobicContact CG1-CB 3.83Å; C28-K31 HydrophobicContact CB-CB 4.21Å; C28-K31 HydrophobicContact CB-CD 3.84Å; C28-K31 HydrophobicContact CB-CG 3.85Å; C28-K31 WeakPolarHBondContact O-CB 3.45Å; C28-K31 PolarHBondContact O-N 3.39Å; P29-K31 VanDerWaalsContact C-N 3.3Å; P29-K31 PolarHBondContact O-N 2.85Å; K31-L34 PolarHBondContact O-N 2.69Å; K31-L35 VanDerWaalsContact O-CB 3.28Å; K31-L35 WeakPolarHBondContact O-CB 3.38Å; K31-L35 PolarHBondContact O-N 3.29Å; K31-T179 HydrophobicContact CD-CG2 4.2Å; K31-V183 HydrophobicContact CB-CG1 4.14Å; K31-V183 HydrophobicContact CB-CG2 4.09Å; K31-V183 HydrophobicContact CD-CG2 4.12Å; K31-V183 HydrophobicContact CG-CG2 4.18Å; K31-V183 WeakPolarHBondContact O-CG1 3.47Å |
| 32 | V | 95.5 | Very high | 94 | Very high | 46 Ų | 46 | 57.5 Ų | 57.5 | 28% | 0.279 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -63.5 | -44.8 | 176.8 | 178.3 | 0 | 0 | 0 | 0 | 111.4 | V25 C28 P29 L35 T36 | V25-V32 HydrophobicContact CG1-CG2 3.95Å; C28-V32 PolarHBondContact O-N 3.4Å; P29-V32 WeakPolarHBondContact O-CB 2.73Å; P29-V32 PolarHBondContact O-N 3.33Å; P29-V32 VanDerWaalsContact O-N 3.17Å; V32-L35 PolarHBondContact O-N 3.24Å; V32-T36 WeakPolarHBondContact O-CB 3.29Å; V32-T36 PolarHBondContact O-N 2.95Å; V32-T36 PolarHBondContact O-OG1 3.31Å |
| 33 | I | 94.3 | Very high | 94.2 | Very high | 109 Ų | 109 | 56.1 Ų | 56.1 | 56% | 0.559 | 32% | 0.318 | S | S | * | . | H | α-helix | trans | -66.9 | -38.8 | 177.6 | 70.5 | 170.6 | 0 | 0 | 0 | 111.7 | P29 I30 T36 A37 | P29-I33 PolarHBondContact O-N 3Å; I30-I33 HydrophobicContact CD1-CD1 3.62Å; I30-I33 HydrophobicContact CD1-CG1 3.89Å; I30-I33 WeakPolarHBondContact O-CG1 3.07Å; I33-T36 PolarHBondContact O-N 3.43Å; I33-A37 WeakPolarHBondContact O-CB 3.46Å; I33-A37 PolarHBondContact O-N 3.15Å |
| 34 | L | 93.3 | Very high | 94.4 | Very high | 31 Ų | 31 | 54.1 Ų | 54.1 | 16% | 0.162 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -63.3 | -44.4 | 177.2 | -177.4 | 72.4 | 0 | 0 | 0 | 111.1 | I30 K31 A37 S38 F81 I85 V180 V183 | I30-L34 WeakPolarHBondContact O-CB 3.31Å; I30-L34 PolarHBondContact O-N 3.41Å; I30-L34 VanDerWaalsContact O-N 3.1Å; K31-L34 PolarHBondContact O-N 2.69Å; L34-A37 PolarHBondContact O-N 3.08Å; L34-S38 PolarHBondContact O-N 3.39Å; L34-F81 HydrophobicContact CD1-CE1 4.35Å; L34-F81 HydrophobicContact CD1-CZ 3.89Å; L34-I85 HydrophobicContact CD1-CD1 3.84Å; L34-I85 HydrophobicContact CD1-CG1 3.92Å; L34-V180 HydrophobicContact CD2-CB 4.2Å; L34-V180 HydrophobicContact CD2-CG1 3.92Å; L34-V180 HydrophobicContact CD2-CG2 4.28Å; L34-V183 HydrophobicContact CB-CG1 4.06Å; L34-V183 HydrophobicContact CD2-CB 3.91Å; L34-V183 HydrophobicContact CD2-CG1 3.81Å; L34-V183 HydrophobicContact CG-CG1 4.11Å |
| 35 | L | 95.8 | Very high | 94.7 | Very high | 8 Ų | 8 | 51.6 Ų | 51.6 | 4% | 0.042 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -61.4 | -44.3 | 175.5 | 179.4 | 142.1 | 0 | 0 | 0 | 111.8 | F21 V25 K31 V32 S38 G39 V183 L186 | F21-L35 HydrophobicContact CD2-CD1 3.93Å; F21-L35 HydrophobicContact CD2-CD2 4.48Å; F21-L35 HydrophobicContact CE2-CD2 4.49Å; V25-L35 HydrophobicContact CG1-CB 4.43Å; V25-L35 HydrophobicContact CG1-CD1 4.1Å; V25-L35 HydrophobicContact CG2-CD1 4.27Å; K31-L35 VanDerWaalsContact O-CB 3.28Å; K31-L35 WeakPolarHBondContact O-CB 3.38Å; K31-L35 PolarHBondContact O-N 3.29Å; V32-L35 PolarHBondContact O-N 3.24Å; L35-S38 PolarHBondContact O-N 2.8Å; L35-S38 PolarHBondContact O-OG 3.39Å; L35-S38 VanDerWaalsContact O-OG 3.14Å; L35-G39 PolarHBondContact O-N 3.11Å; L35-V183 HydrophobicContact CB-CG1 3.8Å; L35-L186 HydrophobicContact CD1-CB 4.1Å; L35-L186 HydrophobicContact CD1-CD2 3.73Å; L35-L186 HydrophobicContact CD1-CG 3.79Å |
| 36 | T | 95.5 | Very high | 94.8 | Very high | 79 Ų | 79 | 54.4 Ų | 54.4 | 49% | 0.485 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -65.8 | -42 | 179.6 | -55.3 | 0 | 0 | 0 | 0 | 110.8 | V32 I33 G39 F40 | V32-T36 WeakPolarHBondContact O-CB 3.29Å; V32-T36 PolarHBondContact O-N 2.95Å; V32-T36 PolarHBondContact O-OG1 3.31Å; I33-T36 PolarHBondContact O-N 3.43Å; T36-G39 PolarHBondContact O-N 2.91Å; T36-F40 PolarHBondContact O-N 3.48Å |
| 37 | A | 97 | Very high | 95 | Very high | 38 Ų | 38 | 57.5 Ų | 57.5 | 31% | 0.314 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -63.3 | -45.3 | 177 | 0 | 0 | 0 | 0 | 0 | 111.8 | I33 L34 G39 F40 F41 F81 | I33-A37 WeakPolarHBondContact O-CB 3.46Å; I33-A37 PolarHBondContact O-N 3.15Å; L34-A37 PolarHBondContact O-N 3.08Å; A37-G39 PolarHBondContact O-N 2.91Å; A37-F40 WeakPolarHBondContact O-CB 3.17Å; A37-F40 PolarHBondContact O-N 2.8Å; A37-F41 VanDerWaalsContact O-CD2 3.3Å; A37-F41 WeakPolarHBondContact O-CD2 3.46Å; A37-F41 PolarHBondContact O-N 3.41Å; A37-F81 HydrophobicContact CB-CE2 3.85Å; A37-F81 HydrophobicContact CB-CZ 4.16Å |
| 38 | S | 97.2 | Very high | 95.2 | Very high | 0 Ų | 0 | 54.6 Ų | 54.6 | 0% | 0 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -65.1 | -40.4 | 178.4 | 80.7 | 0 | 0 | 0 | 0 | 111.8 | L34 L35 F40 F41 W42 S184 G187 Y188 | L34-S38 PolarHBondContact O-N 3.39Å; L35-S38 PolarHBondContact O-N 2.8Å; L35-S38 PolarHBondContact O-OG 3.39Å; L35-S38 VanDerWaalsContact O-OG 3.14Å; S38-F40 VanDerWaalsContact C-N 3.33Å; S38-F40 PolarHBondContact O-N 3.49Å; S38-F41 PolarHBondContact O-N 3.39Å; S38-W42 PolarHBondContact O-N 3.21Å; S38-S184 WeakPolarHBondContact CB-O 3.37Å; S38-S184 PolarHBondContact OG-O 2.93Å; S38-G187 WeakPolarHBondContact OG-CA 3.26Å; S38-Y188 VanDerWaalsContact O-CD2 3.3Å; S38-Y188 WeakPolarHBondContact O-CD2 3.3Å; S38-Y188 WeakPolarHBondContact O-CE2 3.34Å |
| 39 | G | 96.8 | Very high | 95.3 | Very high | 0 Ų | 0 | 53.8 Ų | 53.8 | 0% | 0 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -60.6 | -40 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | L35 T36 A37 W42 L43 M191 | L35-G39 PolarHBondContact O-N 3.11Å; T36-G39 PolarHBondContact O-N 2.91Å; A37-G39 PolarHBondContact O-N 2.91Å; G39-W42 PolarHBondContact O-N 3.47Å; G39-L43 PolarHBondContact O-N 2.86Å; G39-M191 VanDerWaalsContact CA-CG 3.44Å |
| 40 | F | 97.3 | Very high | 95.1 | Very high | 126 Ų | 126 | 52.4 Ų | 52.4 | 55% | 0.553 | 28% | 0.282 | S | S | * | . | H | α-helix | trans | -63.4 | -45 | 173.8 | 176.9 | -101.9 | 0 | 0 | 0 | 112 | T36 A37 S38 W42 L43 V44 | T36-F40 PolarHBondContact O-N 3.48Å; A37-F40 WeakPolarHBondContact O-CB 3.17Å; A37-F40 PolarHBondContact O-N 2.8Å; S38-F40 VanDerWaalsContact C-N 3.33Å; S38-F40 PolarHBondContact O-N 3.49Å; F40-W42 PolarHBondContact O-N 3.38Å; F40-L43 WeakPolarHBondContact O-CB 3.2Å; F40-L43 PolarHBondContact O-N 3.24Å; F40-V44 HydrophobicContact CD1-CG2 4.01Å; F40-V44 HydrophobicContact CE1-CG2 3.54Å; F40-V44 HydrophobicContact CE2-CG2 4.11Å; F40-V44 HydrophobicContact CG-CG2 4.49Å; F40-V44 HydrophobicContact CZ-CG2 3.59Å; F40-V44 WeakPolarHBondContact O-CG2 3.47Å; F40-V44 PolarHBondContact O-N 3.39Å |
| 41 | F | 97.2 | Very high | 95.1 | Very high | 42 Ų | 42 | 50.8 Ų | 50.8 | 18% | 0.184 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -60.8 | -35.2 | 176.5 | -89.9 | -110.6 | 0 | 0 | 0 | 112.3 | A37 S38 V44 S45 L77 L80 F81 L84 Y188 | A37-F41 VanDerWaalsContact O-CD2 3.3Å; A37-F41 WeakPolarHBondContact O-CD2 3.46Å; A37-F41 PolarHBondContact O-N 3.41Å; S38-F41 PolarHBondContact O-N 3.39Å; F41-V44 PolarHBondContact O-N 3.3Å; F41-S45 PolarHBondContact O-N 2.86Å; F41-L77 HydrophobicContact CD1-CD1 3.91Å; F41-L77 HydrophobicContact CE1-CD1 4.46Å; F41-L80 HydrophobicContact CE1-CD2 4.25Å; F41-L80 HydrophobicContact CE1-CG 4.41Å; F41-F81 HydrophobicContact CB-CD2 4.48Å; F41-F81 HydrophobicContact CD1-CB 4.1Å; F41-F81 HydrophobicContact CD1-CD2 4.25Å; F41-F81 AromaticContact CD2-CD2 3.93Å; F41-F81 HydrophobicContact CD2-CD2 3.93Å; F41-F81 HydrophobicContact CD2-CE2 4.4Å; F41-F81 HydrophobicContact CE2-CD2 4.23Å; F41-F81 HydrophobicContact CG-CB 4.37Å; F41-F81 AromaticContact CG-CD2 3.95Å; F41-F81 HydrophobicContact CG-CD2 3.95Å; F41-F81 HydrophobicContact CG-CG 4.47Å; F41-L84 HydrophobicContact CE1-CD1 3.52Å; F41-L84 HydrophobicContact CE2-CD1 4.29Å; F41-L84 HydrophobicContact CZ-CD1 3.27Å; F41-Y188 HydrophobicContact CB-CE2 4.38Å |
| 42 | W | 96.5 | Very high | 94.7 | Very high | 10 Ų | 10 | 51.6 Ų | 51.6 | 4% | 0.038 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -65.4 | -42.4 | 171.5 | -174.2 | 80.9 | 0 | 0 | 0 | 112.2 | S38 G39 F40 V44 S45 L46 Y188 M191 S192 I195 | S38-W42 PolarHBondContact O-N 3.21Å; G39-W42 PolarHBondContact O-N 3.47Å; F40-W42 PolarHBondContact O-N 3.38Å; W42-V44 PolarHBondContact O-N 3.37Å; W42-S45 WeakPolarHBondContact O-CB 3.36Å; W42-S45 PolarHBondContact O-N 3.37Å; W42-S45 VanDerWaalsContact O-N 3.14Å; W42-S45 PolarHBondContact O-OG 3.46Å; W42-L46 HydrophobicContact CE3-CD1 4.48Å; W42-L46 HydrophobicContact CH2-CD1 3.24Å; W42-L46 HydrophobicContact CH2-CG 3.93Å; W42-L46 HydrophobicContact CZ2-CD1 3.83Å; W42-L46 HydrophobicContact CZ2-CD2 4.34Å; W42-L46 HydrophobicContact CZ2-CG 4.08Å; W42-L46 HydrophobicContact CZ3-CD1 3.65Å; W42-L46 HydrophobicContact CZ3-CG 4.26Å; W42-L46 PolarHBondContact O-N 3.19Å; W42-Y188 HydrophobicContact CB-CD1 3.8Å; W42-Y188 HydrophobicContact CB-CD2 4.18Å; W42-Y188 HydrophobicContact CB-CE1 3.85Å; W42-Y188 HydrophobicContact CB-CE2 4.23Å; W42-Y188 HydrophobicContact CB-CG 3.95Å; W42-Y188 AromaticContact CD1-CD1 3.28Å; W42-Y188 AromaticContact CD1-CE1 3.57Å; W42-Y188 AromaticContact CG-CD1 3.84Å; W42-Y188 HydrophobicContact CG-CD1 3.84Å; W42-Y188 HydrophobicContact CG-CE1 4.11Å; W42-Y188 HydrophobicContact CG-CG 4.26Å; W42-M191 HydrophobicContact CD2-CB 4.42Å; W42-M191 HydrophobicContact CE3-CB 3.62Å; W42-M191 HydrophobicContact CZ3-CB 4.13Å; W42-M191 WeakPolarHBondContact CZ3-O 3.35Å; W42-S192 VanDerWaalsContact CZ2-CB 3.41Å; W42-I195 HydrophobicContact CH2-CB 3.95Å; W42-I195 HydrophobicContact CH2-CG1 4.17Å; W42-I195 HydrophobicContact CH2-CG2 4.31Å; W42-I195 HydrophobicContact CZ3-CB 4.01Å; W42-I195 HydrophobicContact CZ3-CG1 3.69Å |
| 43 | L | 96.5 | Very high | 94.1 | Very high | 67 Ų | 67 | 54.3 Ų | 54.3 | 35% | 0.351 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -63.4 | -41.4 | 174.3 | -69.5 | 176.3 | 0 | 0 | 0 | 112.6 | G39 F40 S45 L46 L47 I195 | G39-L43 PolarHBondContact O-N 2.86Å; F40-L43 WeakPolarHBondContact O-CB 3.2Å; F40-L43 PolarHBondContact O-N 3.24Å; L43-S45 PolarHBondContact O-N 3.49Å; L43-L46 PolarHBondContact O-N 3.35Å; L43-L46 VanDerWaalsContact O-N 3.13Å; L43-L47 PolarHBondContact O-N 2.9Å; L43-I195 HydrophobicContact CD2-CD1 4.1Å; L43-I195 HydrophobicContact CD2-CG1 3.79Å |
| 44 | V | 97.6 | Very high | 93.7 | Very high | 38 Ų | 38 | 56.4 Ų | 56.4 | 23% | 0.23 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -58.7 | -37.5 | 173.6 | 170.8 | 0 | 0 | 0 | 0 | 110.7 | F40 F41 W42 L46 L47 I48 L77 | F40-V44 HydrophobicContact CD1-CG2 4.01Å; F40-V44 HydrophobicContact CE1-CG2 3.54Å; F40-V44 HydrophobicContact CE2-CG2 4.11Å; F40-V44 HydrophobicContact CG-CG2 4.49Å; F40-V44 HydrophobicContact CZ-CG2 3.59Å; F40-V44 WeakPolarHBondContact O-CG2 3.47Å; F40-V44 PolarHBondContact O-N 3.39Å; F41-V44 PolarHBondContact O-N 3.3Å; W42-V44 PolarHBondContact O-N 3.37Å; V44-L46 VanDerWaalsContact C-N 3.35Å; V44-L46 PolarHBondContact O-N 2.84Å; V44-L47 WeakPolarHBondContact O-CB 3.23Å; V44-L47 PolarHBondContact O-N 3.25Å; V44-I48 HydrophobicContact CG1-CD1 3.79Å; V44-I48 HydrophobicContact CG1-CG1 4.28Å; V44-I48 WeakPolarHBondContact O-CG1 3.48Å; V44-I48 PolarHBondContact O-N 3.24Å; V44-L77 HydrophobicContact CG1-CD1 4.32Å |
| 45 | S | 96.5 | Very high | 93.3 | Very high | 0 Ų | 0 | 60.3 Ų | 60.3 | 0% | 0 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -61.9 | -40.6 | 176 | 84 | 0 | 0 | 0 | 0 | 112.4 | F41 W42 L43 T49 Q74 | F41-S45 PolarHBondContact O-N 2.86Å; W42-S45 WeakPolarHBondContact O-CB 3.36Å; W42-S45 PolarHBondContact O-N 3.37Å; W42-S45 VanDerWaalsContact O-N 3.14Å; W42-S45 PolarHBondContact O-OG 3.46Å; L43-S45 PolarHBondContact O-N 3.49Å; S45-T49 WeakPolarHBondContact O-CB 3.44Å; S45-T49 PolarHBondContact O-N 3.41Å; S45-T49 PolarHBondContact O-OG1 3.4Å; S45-Q74 WeakPolarHBondContact OG-CG 3.37Å |
| 46 | L | 92.4 | Very high | 92.5 | Very high | 58 Ų | 58 | 61.4 Ų | 61.4 | 30% | 0.304 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -69.1 | -37 | 174.4 | -70.9 | -166.6 | 0 | 0 | 0 | 112.3 | W42 L43 V44 T49 S50 I195 | W42-L46 HydrophobicContact CE3-CD1 4.48Å; W42-L46 HydrophobicContact CH2-CD1 3.24Å; W42-L46 HydrophobicContact CH2-CG 3.93Å; W42-L46 HydrophobicContact CZ2-CD1 3.83Å; W42-L46 HydrophobicContact CZ2-CD2 4.34Å; W42-L46 HydrophobicContact CZ2-CG 4.08Å; W42-L46 HydrophobicContact CZ3-CD1 3.65Å; W42-L46 HydrophobicContact CZ3-CG 4.26Å; W42-L46 PolarHBondContact O-N 3.19Å; L43-L46 PolarHBondContact O-N 3.35Å; L43-L46 VanDerWaalsContact O-N 3.13Å; V44-L46 VanDerWaalsContact C-N 3.35Å; V44-L46 PolarHBondContact O-N 2.84Å; L46-T49 WeakPolarHBondContact O-CB 3.28Å; L46-T49 PolarHBondContact O-N 2.88Å; L46-S50 WeakPolarHBondContact O-CB 3.44Å; L46-S50 PolarHBondContact O-N 3.28Å; L46-I195 HydrophobicContact CD1-CG2 4.08Å |
| 47 | L | 95 | Very high | 91.4 | Very high | 112 Ų | 112 | 61.7 Ų | 61.7 | 59% | 0.586 | 32% | 0.322 | S | S | * | . | H | α-helix | trans | -60.7 | -51.1 | 175.6 | 178.8 | 66.2 | 0 | 0 | 0 | 111 | L43 V44 T49 S50 V51 | L43-L47 PolarHBondContact O-N 2.9Å; V44-L47 WeakPolarHBondContact O-CB 3.23Å; V44-L47 PolarHBondContact O-N 3.25Å; L47-T49 VanDerWaalsContact C-N 3.28Å; L47-T49 PolarHBondContact O-N 3.24Å; L47-S50 WeakPolarHBondContact O-CB 3.37Å; L47-S50 PolarHBondContact O-N 3.42Å; L47-V51 WeakPolarHBondContact O-CG2 3.47Å; L47-V51 PolarHBondContact O-N 3.34Å |
| 48 | I | 94.6 | Very high | 90.1 | Very high | 74 Ų | 74 | 64.7 Ų | 64.7 | 38% | 0.379 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -61.5 | -40.7 | 177.6 | -63.3 | 168.2 | 0 | 0 | 0 | 110.2 | V44 S50 V51 M52 I73 L77 | V44-I48 HydrophobicContact CG1-CD1 3.79Å; V44-I48 HydrophobicContact CG1-CG1 4.28Å; V44-I48 WeakPolarHBondContact O-CG1 3.48Å; V44-I48 PolarHBondContact O-N 3.24Å; I48-S50 VanDerWaalsContact C-N 3.33Å; I48-S50 PolarHBondContact O-N 3.47Å; I48-V51 PolarHBondContact O-N 2.97Å; I48-M52 WeakPolarHBondContact O-CB 3.26Å; I48-M52 PolarHBondContact O-N 3.05Å; I48-I73 HydrophobicContact CB-CG2 4.16Å; I48-I73 HydrophobicContact CG2-CD1 3.97Å; I48-I73 HydrophobicContact CG2-CG2 4.17Å; I48-L77 HydrophobicContact CD1-CD2 4.42Å |
| 49 | T | 92.8 | Very high | 88.6 | Confident | 19 Ų | 19 | 68 Ų | 68 | 12% | 0.117 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -59.7 | -43.6 | 176 | -57.9 | 0 | 0 | 0 | 0 | 111.7 | S45 L46 L47 M52 W53 G70 | S45-T49 WeakPolarHBondContact O-CB 3.44Å; S45-T49 PolarHBondContact O-N 3.41Å; S45-T49 PolarHBondContact O-OG1 3.4Å; L46-T49 WeakPolarHBondContact O-CB 3.28Å; L46-T49 PolarHBondContact O-N 2.88Å; L47-T49 VanDerWaalsContact C-N 3.28Å; L47-T49 PolarHBondContact O-N 3.24Å; T49-M52 PolarHBondContact O-N 3.41Å; T49-W53 WeakPolarHBondContact O-CB 3.37Å; T49-W53 PolarHBondContact O-N 3.41Å; T49-G70 VanDerWaalsContact CG2-CA 3.45Å; T49-G70 WeakPolarHBondContact OG1-CA 3.46Å |
| 50 | S | 91.1 | Very high | 87.2 | Confident | 75 Ų | 75 | 73.6 Ų | 73.6 | 52% | 0.524 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -65 | -44.3 | 177.7 | -174.6 | 0 | 0 | 0 | 0 | 112 | L46 L47 I48 M52 W53 F54 | L46-S50 WeakPolarHBondContact O-CB 3.44Å; L46-S50 PolarHBondContact O-N 3.28Å; L47-S50 WeakPolarHBondContact O-CB 3.37Å; L47-S50 PolarHBondContact O-N 3.42Å; I48-S50 VanDerWaalsContact C-N 3.33Å; I48-S50 PolarHBondContact O-N 3.47Å; S50-M52 VanDerWaalsContact C-N 3.33Å; S50-M52 PolarHBondContact O-N 3.27Å; S50-W53 PolarHBondContact O-N 3.45Å; S50-F54 WeakPolarHBondContact O-CB 3.47Å; S50-F54 PolarHBondContact O-N 2.97Å |
| 51 | V | 90.9 | Very high | 85.7 | Confident | 77 Ų | 77 | 71.8 Ų | 71.8 | 47% | 0.467 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -60.7 | -43.9 | 174.7 | 172.9 | 0 | 0 | 0 | 0 | 110.8 | L47 I48 F54 I55 | L47-V51 WeakPolarHBondContact O-CG2 3.47Å; L47-V51 PolarHBondContact O-N 3.34Å; I48-V51 PolarHBondContact O-N 2.97Å; V51-F54 WeakPolarHBondContact O-CB 3.49Å; V51-F54 PolarHBondContact O-N 3Å; V51-I55 HydrophobicContact CG1-CD1 3.91Å; V51-I55 WeakPolarHBondContact O-CG1 3.44Å; V51-I55 PolarHBondContact O-N 3.36Å; V51-I55 VanDerWaalsContact O-N 3.07Å |
| 52 | M | 86.1 | Confident | 84.7 | Confident | 74 Ų | 74 | 77.7 Ų | 77.7 | 37% | 0.365 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -65.3 | -41.8 | 178.6 | -169.6 | 59.9 | -172.5 | 0 | 0 | 111.8 | I48 T49 S50 F54 I55 V56 I69 | I48-M52 WeakPolarHBondContact O-CB 3.26Å; I48-M52 PolarHBondContact O-N 3.05Å; T49-M52 PolarHBondContact O-N 3.41Å; S50-M52 VanDerWaalsContact C-N 3.33Å; S50-M52 PolarHBondContact O-N 3.27Å; M52-F54 VanDerWaalsContact C-N 3.26Å; M52-F54 PolarHBondContact O-N 2.89Å; M52-I55 PolarHBondContact O-N 2.79Å; M52-V56 HydrophobicContact CE-CG2 3.71Å; M52-V56 WeakPolarHBondContact O-CG2 3.45Å; M52-V56 PolarHBondContact O-N 3.5Å; M52-V56 HydrophobicContact SD-CG2 4.39Å; M52-I69 HydrophobicContact CB-CG2 4.39Å; M52-I69 HydrophobicContact CG-CG2 3.97Å |
| 53 | W | 82.6 | Confident | 83.7 | Confident | 103 Ų | 103 | 82 Ų | 82 | 39% | 0.39 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -64.4 | -31 | 175.1 | -172.2 | 83.8 | 0 | 0 | 0 | 112.6 | T49 S50 R60 | T49-W53 WeakPolarHBondContact O-CB 3.37Å; T49-W53 PolarHBondContact O-N 3.41Å; S50-W53 PolarHBondContact O-N 3.45Å; W53-R60 HydrophobicContact CD2-CG 4.42Å; W53-R60 HydrophobicContact CH2-CG 4.48Å; W53-R60 HydrophobicContact CZ2-CB 4Å; W53-R60 HydrophobicContact CZ2-CG 3.95Å |
| 54 | F | 84.8 | Confident | 82.8 | Confident | 154 Ų | 154 | 81.4 Ų | 81.4 | 68% | 0.675 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -70.7 | -41.5 | 175 | -175.2 | -100 | 0 | 0 | 0 | 112.9 | S50 V51 M52 | S50-F54 WeakPolarHBondContact O-CB 3.47Å; S50-F54 PolarHBondContact O-N 2.97Å; V51-F54 WeakPolarHBondContact O-CB 3.49Å; V51-F54 PolarHBondContact O-N 3Å; M52-F54 VanDerWaalsContact C-N 3.26Å; M52-F54 PolarHBondContact O-N 2.89Å |
| 55 | I | 85.5 | Confident | 82.1 | Confident | 113 Ų | 113 | 82.3 Ų | 82.3 | 58% | 0.579 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -68.3 | -38.8 | -179.7 | -65.2 | 164 | 0 | 0 | 0 | 111.3 | V51 M52 T57 | V51-I55 HydrophobicContact CG1-CD1 3.91Å; V51-I55 WeakPolarHBondContact O-CG1 3.44Å; V51-I55 PolarHBondContact O-N 3.36Å; V51-I55 VanDerWaalsContact O-N 3.07Å; M52-I55 PolarHBondContact O-N 2.79Å; I55-T57 PolarHBondContact O-N 3.19Å; I55-T57 VanDerWaalsContact O-N 3.07Å |
| 56 | V | 79.2 | Confident | 81.4 | Confident | 30 Ų | 30 | 83 Ų | 83 | 18% | 0.182 | 44% | 0.443 | C | S | . | . | trans | -86.4 | 77.8 | -176.5 | -171.1 | 0 | 0 | 0 | 0 | 110.8 | M52 L59 R60 F65 | M52-V56 HydrophobicContact CE-CG2 3.71Å; M52-V56 WeakPolarHBondContact O-CG2 3.45Å; M52-V56 PolarHBondContact O-N 3.5Å; M52-V56 HydrophobicContact SD-CG2 4.39Å; V56-L59 HydrophobicContact CG1-CB 3.86Å; V56-L59 HydrophobicContact CG1-CD1 4.49Å; V56-L59 HydrophobicContact CG1-CD2 4.47Å; V56-L59 HydrophobicContact CG1-CG 4.5Å; V56-R60 WeakPolarHBondContact O-CG 3.39Å; V56-F65 HydrophobicContact CB-CE1 4.32Å; V56-F65 HydrophobicContact CG1-CE1 4Å; V56-F65 HydrophobicContact CG2-CE1 4.4Å | ||
| 57 | T | 72.3 | Confident | 81.1 | Confident | 85 Ų | 85 | 82.4 Ų | 82.4 | 52% | 0.521 | 44% | 0.44 | S | S | . | . | trans | -65.1 | -39.3 | -176.9 | 54.9 | 0 | 0 | 0 | 0 | 116.6 | I55 R60 | I55-T57 PolarHBondContact O-N 3.19Å; I55-T57 VanDerWaalsContact O-N 3.07Å; T57-R60 PolarHBondContact O-NE 2.82Å | ||
| 58 | P | 69.4 | Low | 80.8 | Confident | 102 Ų | 102 | 81.4 Ų | 81.4 | 66% | 0.662 | 43% | 0.434 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.8 | -22.3 | -173.8 | 29.3 | -33.5 | 0 | 0 | 0 | 113.8 | ||
| 59 | L | 66.3 | Low | 80.6 | Confident | 68 Ų | 68 | 79.5 Ų | 79.5 | 36% | 0.356 | 42% | 0.424 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -92.7 | 0.8 | -178.3 | -86.4 | 64.1 | 0 | 0 | 0 | 113.6 | V56 A61 Y62 F65 | V56-L59 HydrophobicContact CG1-CB 3.86Å; V56-L59 HydrophobicContact CG1-CD1 4.49Å; V56-L59 HydrophobicContact CG1-CD2 4.47Å; V56-L59 HydrophobicContact CG1-CG 4.5Å; L59-A61 PolarHBondContact O-N 3.08Å; L59-A61 VanDerWaalsContact O-N 3.07Å; L59-Y62 PolarHBondContact O-N 2.78Å; L59-F65 HydrophobicContact CB-CD1 4.06Å; L59-F65 HydrophobicContact CB-CE1 4.43Å; L59-F65 HydrophobicContact CB-CG 4.38Å; L59-F65 HydrophobicContact CD2-CD1 4.16Å; L59-F65 HydrophobicContact CD2-CD2 3.87Å; L59-F65 HydrophobicContact CD2-CE1 4.17Å; L59-F65 HydrophobicContact CD2-CE2 3.89Å; L59-F65 HydrophobicContact CD2-CG 4.01Å; L59-F65 HydrophobicContact CD2-CZ 4.04Å |
| 60 | R | 66.1 | Low | 80.6 | Confident | 118 Ų | 118 | 78.8 Ų | 78.8 | 45% | 0.445 | 42% | 0.421 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60 | -21.4 | 179.6 | -65.5 | -170.6 | -62.2 | 174 | 1.5 | 113.7 | W53 V56 T57 Y62 | W53-R60 HydrophobicContact CD2-CG 4.42Å; W53-R60 HydrophobicContact CH2-CG 4.48Å; W53-R60 HydrophobicContact CZ2-CB 4Å; W53-R60 HydrophobicContact CZ2-CG 3.95Å; V56-R60 WeakPolarHBondContact O-CG 3.39Å; T57-R60 PolarHBondContact O-NE 2.82Å; R60-Y62 PolarHBondContact O-N 3.41Å |
| 61 | A | 67 | Low | 80.7 | Confident | 88 Ų | 88 | 75.4 Ų | 75.4 | 73% | 0.727 | 40% | 0.397 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.7 | -26.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | L59 | L59-A61 PolarHBondContact O-N 3.08Å; L59-A61 VanDerWaalsContact O-N 3.07Å |
| 62 | Y | 75 | Confident | 80.9 | Confident | 166 Ų | 166 | 75.7 Ų | 75.7 | 65% | 0.651 | 40% | 0.396 | S | S | * | . | trans | -101.9 | 91.4 | 179.4 | -57.3 | -75.1 | 0 | 0 | 0 | 109.7 | L59 R60 A64 F65 | L59-Y62 PolarHBondContact O-N 2.78Å; R60-Y62 PolarHBondContact O-N 3.41Å; Y62-A64 PolarHBondContact O-N 3.16Å; Y62-F65 WeakPolarHBondContact O-CB 3.4Å; Y62-F65 PolarHBondContact O-N 3.44Å | ||
| 63 | L | 75.9 | Confident | 81.4 | Confident | 102 Ų | 102 | 73.2 Ų | 73.2 | 53% | 0.534 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -53 | -31.1 | 176.5 | -173.2 | 62.6 | 0 | 0 | 0 | 112.3 | F65 G66 I67 L269 | L63-F65 PolarHBondContact O-N 3.24Å; L63-G66 PolarHBondContact O-N 3.36Å; L63-G66 VanDerWaalsContact O-N 3.16Å; L63-I67 HydrophobicContact CG-CD1 4.49Å; L63-I67 PolarHBondContact O-N 3.17Å; L63-L269 HydrophobicContact CB-CD2 4Å; L63-L269 HydrophobicContact CD2-CD2 3.64Å; L63-L269 HydrophobicContact CG-CD2 3.69Å |
| 64 | A | 78.5 | Confident | 82 | Confident | 54 Ų | 54 | 69.3 Ų | 69.3 | 45% | 0.446 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -53.6 | -38.2 | 173.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | Y62 I67 L68 L269 | Y62-A64 PolarHBondContact O-N 3.16Å; A64-I67 PolarHBondContact O-N 3.18Å; A64-L68 WeakPolarHBondContact O-CB 3.25Å; A64-L68 PolarHBondContact O-N 3.37Å; A64-L269 HydrophobicContact CB-CD1 3.77Å |
| 65 | F | 81.1 | Confident | 82.6 | Confident | 57 Ų | 57 | 62.2 Ų | 62.2 | 25% | 0.25 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -65.1 | -43.7 | 178.8 | 179.8 | -103.8 | 0 | 0 | 0 | 111.7 | V56 L59 Y62 L63 I67 L68 I69 | V56-F65 HydrophobicContact CB-CE1 4.32Å; V56-F65 HydrophobicContact CG1-CE1 4Å; V56-F65 HydrophobicContact CG2-CE1 4.4Å; L59-F65 HydrophobicContact CB-CD1 4.06Å; L59-F65 HydrophobicContact CB-CE1 4.43Å; L59-F65 HydrophobicContact CB-CG 4.38Å; L59-F65 HydrophobicContact CD2-CD1 4.16Å; L59-F65 HydrophobicContact CD2-CD2 3.87Å; L59-F65 HydrophobicContact CD2-CE1 4.17Å; L59-F65 HydrophobicContact CD2-CE2 3.89Å; L59-F65 HydrophobicContact CD2-CG 4.01Å; L59-F65 HydrophobicContact CD2-CZ 4.04Å; Y62-F65 WeakPolarHBondContact O-CB 3.4Å; Y62-F65 PolarHBondContact O-N 3.44Å; L63-F65 PolarHBondContact O-N 3.24Å; F65-I67 VanDerWaalsContact C-N 3.34Å; F65-I67 PolarHBondContact O-N 3.27Å; F65-L68 PolarHBondContact O-N 3.33Å; F65-I69 HydrophobicContact CD1-CG1 4.43Å; F65-I69 HydrophobicContact CD2-CG1 4.35Å; F65-I69 HydrophobicContact CE1-CG1 3.99Å; F65-I69 HydrophobicContact CE2-CD1 4.22Å; F65-I69 HydrophobicContact CE2-CG1 3.91Å; F65-I69 HydrophobicContact CZ-CD1 4.15Å; F65-I69 HydrophobicContact CZ-CG1 3.71Å; F65-I69 WeakPolarHBondContact O-CG1 3.27Å; F65-I69 PolarHBondContact O-N 3.32Å |
| 66 | G | 83 | Confident | 83.1 | Confident | 13 Ų | 13 | 61.2 Ų | 61.2 | 13% | 0.134 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -62.7 | -41 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | L63 G70 | L63-G66 PolarHBondContact O-N 3.36Å; L63-G66 VanDerWaalsContact O-N 3.16Å; G66-G70 PolarHBondContact O-N 2.82Å |
| 67 | I | 86.5 | Confident | 84 | Confident | 47 Ų | 47 | 60.6 Ų | 60.6 | 24% | 0.241 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -67.5 | -43.7 | 177 | -65.9 | -176.2 | 0 | 0 | 0 | 111.4 | L63 A64 F65 I69 G70 V71 A265 L269 | L63-I67 HydrophobicContact CG-CD1 4.49Å; L63-I67 PolarHBondContact O-N 3.17Å; A64-I67 PolarHBondContact O-N 3.18Å; F65-I67 VanDerWaalsContact C-N 3.34Å; F65-I67 PolarHBondContact O-N 3.27Å; I67-I69 PolarHBondContact O-N 2.87Å; I67-G70 PolarHBondContact O-N 3.43Å; I67-V71 HydrophobicContact CG2-CG2 4.4Å; I67-V71 WeakPolarHBondContact O-CG2 3.43Å; I67-V71 PolarHBondContact O-N 2.96Å; I67-A265 HydrophobicContact CG2-CB 3.57Å; I67-L269 HydrophobicContact CD1-CD1 4.12Å; I67-L269 HydrophobicContact CD1-CD2 3.33Å; I67-L269 HydrophobicContact CD1-CG 3.55Å; I67-L269 HydrophobicContact CG1-CD2 4.42Å |
| 68 | L | 88.2 | Confident | 85.1 | Confident | 91 Ų | 91 | 56.6 Ų | 56.6 | 48% | 0.476 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -59.4 | -49.4 | 178.5 | -173.4 | 78.7 | 0 | 0 | 0 | 111.3 | A64 F65 G70 V71 L72 F262 | A64-L68 WeakPolarHBondContact O-CB 3.25Å; A64-L68 PolarHBondContact O-N 3.37Å; F65-L68 PolarHBondContact O-N 3.33Å; L68-G70 VanDerWaalsContact C-N 3.3Å; L68-G70 PolarHBondContact O-N 3.49Å; L68-V71 PolarHBondContact O-N 3.47Å; L68-L72 WeakPolarHBondContact O-CB 3.39Å; L68-L72 PolarHBondContact O-N 3.43Å; L68-F262 HydrophobicContact CD1-CD1 3.42Å; L68-F262 VanDerWaalsContact CD1-CD1 3.42Å; L68-F262 HydrophobicContact CD1-CE1 3.29Å; L68-F262 HydrophobicContact CD1-CG 4.49Å; L68-F262 HydrophobicContact CD1-CZ 4.29Å; L68-F262 HydrophobicContact CG-CD1 4.48Å; L68-F262 HydrophobicContact CG-CE1 3.95Å; L68-F262 WeakPolarHBondContact O-CE1 3.45Å |
| 69 | I | 89.9 | Confident | 86.4 | Confident | 33 Ų | 33 | 55.7 Ų | 55.7 | 17% | 0.169 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -62.7 | -40 | 176.4 | -68.4 | -60.8 | 0 | 0 | 0 | 110.8 | M52 F65 I67 L72 I73 | M52-I69 HydrophobicContact CB-CG2 4.39Å; M52-I69 HydrophobicContact CG-CG2 3.97Å; F65-I69 HydrophobicContact CD1-CG1 4.43Å; F65-I69 HydrophobicContact CD2-CG1 4.35Å; F65-I69 HydrophobicContact CE1-CG1 3.99Å; F65-I69 HydrophobicContact CE2-CD1 4.22Å; F65-I69 HydrophobicContact CE2-CG1 3.91Å; F65-I69 HydrophobicContact CZ-CD1 4.15Å; F65-I69 HydrophobicContact CZ-CG1 3.71Å; F65-I69 WeakPolarHBondContact O-CG1 3.27Å; F65-I69 PolarHBondContact O-N 3.32Å; I67-I69 PolarHBondContact O-N 2.87Å; I69-L72 PolarHBondContact O-N 3.26Å; I69-I73 HydrophobicContact CG2-CD1 3.5Å; I69-I73 HydrophobicContact CG2-CG1 4.27Å; I69-I73 WeakPolarHBondContact O-CB 3.4Å; I69-I73 VanDerWaalsContact O-CG1 3.25Å; I69-I73 WeakPolarHBondContact O-CG1 3.04Å; I69-I73 PolarHBondContact O-N 3.48Å |
| 70 | G | 92.2 | Very high | 87.9 | Confident | 4 Ų | 4 | 56.1 Ų | 56.1 | 4% | 0.041 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -63.1 | -41.9 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | T49 G66 I67 L68 Q74 | T49-G70 VanDerWaalsContact CG2-CA 3.45Å; T49-G70 WeakPolarHBondContact OG1-CA 3.46Å; G66-G70 PolarHBondContact O-N 2.82Å; I67-G70 PolarHBondContact O-N 3.43Å; L68-G70 VanDerWaalsContact C-N 3.3Å; L68-G70 PolarHBondContact O-N 3.49Å; G70-Q74 WeakPolarHBondContact O-CB 3.39Å; G70-Q74 VanDerWaalsContact O-CG 3.27Å; G70-Q74 WeakPolarHBondContact O-CG 3.43Å; G70-Q74 PolarHBondContact O-N 2.98Å; G70-Q74 PolarHBondContact O-NE2 3.28Å |
| 71 | V | 94.7 | Very high | 89.3 | Confident | 5 Ų | 5 | 51 Ų | 51 | 3% | 0.03 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -65.5 | -45 | 174.2 | 171.5 | 0 | 0 | 0 | 0 | 110.4 | I67 L68 I73 Q74 E75 H261 F262 A265 | I67-V71 HydrophobicContact CG2-CG2 4.4Å; I67-V71 WeakPolarHBondContact O-CG2 3.43Å; I67-V71 PolarHBondContact O-N 2.96Å; L68-V71 PolarHBondContact O-N 3.47Å; V71-I73 PolarHBondContact O-N 3.46Å; V71-Q74 WeakPolarHBondContact O-CB 3.46Å; V71-Q74 PolarHBondContact O-N 3.02Å; V71-E75 WeakPolarHBondContact O-CG 3.48Å; V71-E75 PolarHBondContact O-N 2.99Å; V71-H261 HydrophobicContact CG1-CB 4.26Å; V71-F262 HydrophobicContact CB-CD1 3.94Å; V71-F262 HydrophobicContact CB-CE1 3.7Å; V71-F262 HydrophobicContact CB-CZ 4.3Å; V71-F262 HydrophobicContact CG1-CD1 3.62Å; V71-F262 HydrophobicContact CG1-CD2 4.21Å; V71-F262 HydrophobicContact CG1-CE1 3.55Å; V71-F262 HydrophobicContact CG1-CE2 4.12Å; V71-F262 HydrophobicContact CG1-CG 3.97Å; V71-F262 HydrophobicContact CG1-CZ 3.81Å; V71-A265 HydrophobicContact CG2-CB 3.38Å |
| 72 | L | 95.2 | Very high | 90.6 | Very high | 82 Ų | 82 | 47.6 Ų | 47.6 | 43% | 0.429 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -59.8 | -46.7 | 179.3 | -177.1 | 63.2 | 0 | 0 | 0 | 111.7 | L68 I69 E75 I76 F262 | L68-L72 WeakPolarHBondContact O-CB 3.39Å; L68-L72 PolarHBondContact O-N 3.43Å; I69-L72 PolarHBondContact O-N 3.26Å; L72-E75 PolarHBondContact O-N 3.36Å; L72-I76 HydrophobicContact CD1-CD1 4.27Å; L72-I76 HydrophobicContact CG-CD1 3.97Å; L72-I76 VanDerWaalsContact O-CG1 3.29Å; L72-I76 WeakPolarHBondContact O-CG1 3.37Å; L72-I76 PolarHBondContact O-N 3.34Å; L72-F262 HydrophobicContact CB-CZ 4.2Å; L72-F262 HydrophobicContact CD1-CZ 4.49Å |
| 73 | I | 95.8 | Very high | 91.6 | Very high | 22 Ų | 22 | 43.4 Ų | 43.4 | 11% | 0.113 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -63.9 | -42.1 | 176.9 | -65.5 | 164 | 0 | 0 | 0 | 110.2 | I48 I69 V71 E75 I76 L77 | I48-I73 HydrophobicContact CB-CG2 4.16Å; I48-I73 HydrophobicContact CG2-CD1 3.97Å; I48-I73 HydrophobicContact CG2-CG2 4.17Å; I69-I73 HydrophobicContact CG2-CD1 3.5Å; I69-I73 HydrophobicContact CG2-CG1 4.27Å; I69-I73 WeakPolarHBondContact O-CB 3.4Å; I69-I73 VanDerWaalsContact O-CG1 3.25Å; I69-I73 WeakPolarHBondContact O-CG1 3.04Å; I69-I73 PolarHBondContact O-N 3.48Å; V71-I73 PolarHBondContact O-N 3.46Å; I73-E75 VanDerWaalsContact C-N 3.31Å; I73-E75 PolarHBondContact O-N 2.76Å; I73-I76 PolarHBondContact O-N 3.41Å; I73-L77 HydrophobicContact CG2-CD2 3.82Å; I73-L77 HydrophobicContact CG2-CG 4.47Å; I73-L77 WeakPolarHBondContact O-CB 3.35Å; I73-L77 VanDerWaalsContact O-CD2 3.31Å; I73-L77 WeakPolarHBondContact O-CD2 3.39Å; I73-L77 PolarHBondContact O-N 3Å |
| 74 | Q | 95.9 | Very high | 92.5 | Very high | 21 Ų | 21 | 42.1 Ų | 42.1 | 10% | 0.098 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -56.9 | -43.4 | 175.9 | -82.3 | 173.3 | 71.2 | 0 | 0 | 112.6 | S45 G70 V71 R78 | S45-Q74 WeakPolarHBondContact OG-CG 3.37Å; G70-Q74 WeakPolarHBondContact O-CB 3.39Å; G70-Q74 VanDerWaalsContact O-CG 3.27Å; G70-Q74 WeakPolarHBondContact O-CG 3.43Å; G70-Q74 PolarHBondContact O-N 2.98Å; G70-Q74 PolarHBondContact O-NE2 3.28Å; V71-Q74 WeakPolarHBondContact O-CB 3.46Å; V71-Q74 PolarHBondContact O-N 3.02Å; Q74-R78 WeakPolarHBondContact O-CB 3.4Å; Q74-R78 PolarHBondContact O-N 2.97Å |
| 75 | E | 96.1 | Very high | 93.1 | Very high | 5 Ų | 5 | 40.2 Ų | 40.2 | 2% | 0.023 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -71.8 | -37.9 | 178.8 | -65.5 | -50.6 | 136.4 | 0 | 0 | 113.2 | V71 L72 I73 R78 F79 L242 Y258 H261 | V71-E75 WeakPolarHBondContact O-CG 3.48Å; V71-E75 PolarHBondContact O-N 2.99Å; L72-E75 PolarHBondContact O-N 3.36Å; I73-E75 VanDerWaalsContact C-N 3.31Å; I73-E75 PolarHBondContact O-N 2.76Å; E75-R78 PolarHBondContact O-N 3.32Å; E75-R78 IonicContact OE1-CZ 3.3Å; E75-R78 IonicContact OE1-NH1 3.33Å; E75-R78 PolarHBondContact OE1-NH1 3.03Å; E75-R78 IonicContact OE1-NH2 2.86Å; E75-R78 PolarHBondContact OE1-NH2 2.89Å; E75-R78 IonicContact OE2-CZ 2.96Å; E75-R78 IonicContact OE2-NH1 2.71Å; E75-R78 PolarHBondContact OE2-NH1 2.91Å; E75-F79 PolarHBondContact O-N 3.48Å; E75-L242 WeakPolarHBondContact OE2-CD1 3.43Å; E75-Y258 HydrophobicContact CB-CD1 4.35Å; E75-Y258 HydrophobicContact CB-CE1 3.84Å; E75-Y258 HydrophobicContact CG-CD1 3.85Å; E75-Y258 HydrophobicContact CG-CE1 3.77Å; E75-Y258 WeakPolarHBondContact OE2-CE1 3.37Å; E75-H261 IonicContact OE1-CE1 3.5Å; E75-H261 PolarHBondContact OE1-CE1 3.02Å; E75-H261 VanDerWaalsContact OE1-CE1 3.26Å; E75-H261 IonicContact OE1-CG 3.84Å; E75-H261 IonicContact OE1-ND1 3.51Å; E75-H261 PolarHBondContact OE1-ND1 3.27Å |
| 76 | I | 96.9 | Very high | 93.5 | Very high | 93 Ų | 93 | 40.1 Ų | 40.1 | 48% | 0.477 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -61.6 | -46 | 173.6 | -69.9 | 167.2 | 0 | 0 | 0 | 110.3 | L72 I73 R78 F79 L80 | L72-I76 HydrophobicContact CD1-CD1 4.27Å; L72-I76 HydrophobicContact CG-CD1 3.97Å; L72-I76 VanDerWaalsContact O-CG1 3.29Å; L72-I76 WeakPolarHBondContact O-CG1 3.37Å; L72-I76 PolarHBondContact O-N 3.34Å; I73-I76 PolarHBondContact O-N 3.41Å; I76-R78 VanDerWaalsContact C-N 3.3Å; I76-R78 PolarHBondContact O-N 3.42Å; I76-F79 PolarHBondContact O-N 2.93Å; I76-L80 WeakPolarHBondContact O-CB 3.21Å; I76-L80 PolarHBondContact O-N 3.08Å |
| 77 | L | 97.7 | Very high | 93.9 | Very high | 17 Ų | 17 | 46.8 Ų | 46.8 | 9% | 0.089 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -66.8 | -33 | 179 | -85.4 | -75.4 | 0 | 0 | 0 | 111.4 | F41 V44 I48 I73 L80 F81 | F41-L77 HydrophobicContact CD1-CD1 3.91Å; F41-L77 HydrophobicContact CE1-CD1 4.46Å; V44-L77 HydrophobicContact CG1-CD1 4.32Å; I48-L77 HydrophobicContact CD1-CD2 4.42Å; I73-L77 HydrophobicContact CG2-CD2 3.82Å; I73-L77 HydrophobicContact CG2-CG 4.47Å; I73-L77 WeakPolarHBondContact O-CB 3.35Å; I73-L77 VanDerWaalsContact O-CD2 3.31Å; I73-L77 WeakPolarHBondContact O-CD2 3.39Å; I73-L77 PolarHBondContact O-N 3Å; L77-L80 HydrophobicContact CD1-CD2 4.31Å; L77-L80 PolarHBondContact O-N 2.88Å; L77-F81 VanDerWaalsContact O-CB 3.32Å; L77-F81 WeakPolarHBondContact O-CB 3.39Å; L77-F81 PolarHBondContact O-N 3.14Å |
| 78 | R | 96.2 | Very high | 94.1 | Very high | 0 Ų | 0 | 47.7 Ų | 47.7 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -65.9 | -42.6 | 174 | -169.9 | -179 | -62.3 | 140.7 | 13.4 | 111.6 | Q74 E75 I76 F81 F82 Y188 S239 F243 | Q74-R78 WeakPolarHBondContact O-CB 3.4Å; Q74-R78 PolarHBondContact O-N 2.97Å; E75-R78 PolarHBondContact O-N 3.32Å; E75-R78 IonicContact OE1-CZ 3.3Å; E75-R78 IonicContact OE1-NH1 3.33Å; E75-R78 PolarHBondContact OE1-NH1 3.03Å; E75-R78 IonicContact OE1-NH2 2.86Å; E75-R78 PolarHBondContact OE1-NH2 2.89Å; E75-R78 IonicContact OE2-CZ 2.96Å; E75-R78 IonicContact OE2-NH1 2.71Å; E75-R78 PolarHBondContact OE2-NH1 2.91Å; I76-R78 VanDerWaalsContact C-N 3.3Å; I76-R78 PolarHBondContact O-N 3.42Å; R78-F81 PolarHBondContact O-N 3.03Å; R78-F82 PolarHBondContact O-N 3.07Å; R78-Y188 WeakPolarHBondContact CA-OH 3.39Å; R78-Y188 HydrophobicContact CB-CE1 4.2Å; R78-Y188 PolarHBondContact N-OH 2.77Å; R78-S239 PolarHBondContact NE-OG 3.46Å; R78-F243 HydrophobicContact CG-CE2 4.06Å |
| 79 | F | 96.4 | Very high | 94 | Very high | 83 Ų | 83 | 45.2 Ų | 45.2 | 36% | 0.364 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -66.5 | -41.3 | 174.1 | 177.1 | -110.5 | 0 | 0 | 0 | 112.1 | E75 I76 F81 F82 L83 F246 | E75-F79 PolarHBondContact O-N 3.48Å; I76-F79 PolarHBondContact O-N 2.93Å; F79-F81 VanDerWaalsContact C-N 3.31Å; F79-F81 PolarHBondContact O-N 3.14Å; F79-F82 HydrophobicContact CD2-CD1 4.32Å; F79-F82 HydrophobicContact CE2-CD1 4.3Å; F79-F82 WeakPolarHBondContact O-CB 3.37Å; F79-F82 PolarHBondContact O-N 3.46Å; F79-L83 HydrophobicContact CD1-CD1 4.1Å; F79-L83 HydrophobicContact CD1-CG 4.5Å; F79-L83 HydrophobicContact CE1-CD1 3.5Å; F79-L83 VanDerWaalsContact CE1-CD1 3.5Å; F79-L83 HydrophobicContact CE1-CG 4.07Å; F79-L83 HydrophobicContact CE2-CD2 4.26Å; F79-L83 HydrophobicContact CE2-CG 4.24Å; F79-L83 HydrophobicContact CZ-CD1 3.74Å; F79-L83 HydrophobicContact CZ-CD2 3.99Å; F79-L83 HydrophobicContact CZ-CG 3.92Å; F79-L83 WeakPolarHBondContact O-CG 3.39Å; F79-L83 PolarHBondContact O-N 3.16Å; F79-F246 HydrophobicContact CB-CE2 4.43Å; F79-F246 HydrophobicContact CB-CZ 4.25Å; F79-F246 HydrophobicContact CD2-CD1 4.25Å; F79-F246 HydrophobicContact CD2-CD2 4.21Å; F79-F246 AromaticContact CD2-CE1 3.99Å; F79-F246 HydrophobicContact CD2-CE1 3.99Å; F79-F246 AromaticContact CD2-CE2 3.95Å; F79-F246 HydrophobicContact CD2-CE2 3.95Å; F79-F246 HydrophobicContact CD2-CG 4.37Å; F79-F246 AromaticContact CD2-CZ 3.84Å; F79-F246 HydrophobicContact CD2-CZ 3.84Å; F79-F246 HydrophobicContact CE2-CD1 4.49Å; F79-F246 HydrophobicContact CG-CZ 4.5Å |
| 80 | L | 96.9 | Very high | 93.8 | Very high | 78 Ų | 78 | 47.3 Ų | 47.3 | 41% | 0.408 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -60.8 | -42.1 | 174.8 | -178.8 | 62.5 | 0 | 0 | 0 | 111.5 | F41 I76 L77 L83 L84 | F41-L80 HydrophobicContact CE1-CD2 4.25Å; F41-L80 HydrophobicContact CE1-CG 4.41Å; I76-L80 WeakPolarHBondContact O-CB 3.21Å; I76-L80 PolarHBondContact O-N 3.08Å; L77-L80 HydrophobicContact CD1-CD2 4.31Å; L77-L80 PolarHBondContact O-N 2.88Å; L80-L83 PolarHBondContact O-N 2.87Å; L80-L84 HydrophobicContact CG-CD1 4.39Å; L80-L84 WeakPolarHBondContact O-CG 3.35Å; L80-L84 PolarHBondContact O-N 3.06Å |
| 81 | F | 96.4 | Very high | 93.5 | Very high | 9 Ų | 9 | 48.9 Ų | 48.9 | 4% | 0.039 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -64 | -42.3 | 176.1 | -174.4 | -112.3 | 0 | 0 | 0 | 112 | L34 A37 F41 L77 R78 F79 L83 L84 I85 S184 F243 | L34-F81 HydrophobicContact CD1-CE1 4.35Å; L34-F81 HydrophobicContact CD1-CZ 3.89Å; A37-F81 HydrophobicContact CB-CE2 3.85Å; A37-F81 HydrophobicContact CB-CZ 4.16Å; F41-F81 HydrophobicContact CB-CD2 4.48Å; F41-F81 HydrophobicContact CD1-CB 4.1Å; F41-F81 HydrophobicContact CD1-CD2 4.25Å; F41-F81 AromaticContact CD2-CD2 3.93Å; F41-F81 HydrophobicContact CD2-CD2 3.93Å; F41-F81 HydrophobicContact CD2-CE2 4.4Å; F41-F81 HydrophobicContact CE2-CD2 4.23Å; F41-F81 HydrophobicContact CG-CB 4.37Å; F41-F81 AromaticContact CG-CD2 3.95Å; F41-F81 HydrophobicContact CG-CD2 3.95Å; F41-F81 HydrophobicContact CG-CG 4.47Å; L77-F81 VanDerWaalsContact O-CB 3.32Å; L77-F81 WeakPolarHBondContact O-CB 3.39Å; L77-F81 PolarHBondContact O-N 3.14Å; R78-F81 PolarHBondContact O-N 3.03Å; F79-F81 VanDerWaalsContact C-N 3.31Å; F79-F81 PolarHBondContact O-N 3.14Å; F81-L83 PolarHBondContact O-N 3.5Å; F81-L84 PolarHBondContact O-N 3.12Å; F81-I85 HydrophobicContact CD1-CD1 3.72Å; F81-I85 HydrophobicContact CE1-CD1 3.37Å; F81-I85 HydrophobicContact CE1-CG1 4.18Å; F81-I85 HydrophobicContact CG-CD1 4.45Å; F81-I85 HydrophobicContact CZ-CD1 3.84Å; F81-I85 HydrophobicContact CZ-CG1 4.19Å; F81-I85 WeakPolarHBondContact O-CG1 3.5Å; F81-I85 PolarHBondContact O-N 2.79Å; F81-S184 WeakPolarHBondContact CD1-OG 3.16Å; F81-S184 VanDerWaalsContact CE1-OG 3.22Å; F81-S184 WeakPolarHBondContact CE1-OG 3.43Å; F81-F243 HydrophobicContact CD1-CZ 4.15Å |
| 82 | F | 94.9 | Very high | 92.7 | Very high | 17 Ų | 17 | 54 Ų | 54 | 8% | 0.075 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -55 | -49 | 170.3 | 167.7 | -92.4 | 0 | 0 | 0 | 111.6 | R78 F79 L84 I85 F86 F243 F246 V247 | R78-F82 PolarHBondContact O-N 3.07Å; F79-F82 HydrophobicContact CD2-CD1 4.32Å; F79-F82 HydrophobicContact CE2-CD1 4.3Å; F79-F82 WeakPolarHBondContact O-CB 3.37Å; F79-F82 PolarHBondContact O-N 3.46Å; F82-L84 VanDerWaalsContact C-N 3.29Å; F82-L84 PolarHBondContact O-N 3.33Å; F82-I85 PolarHBondContact O-N 3.03Å; F82-F86 HydrophobicContact CD1-CD2 4.45Å; F82-F86 AromaticContact CD2-CD2 3.8Å; F82-F86 HydrophobicContact CD2-CD2 3.8Å; F82-F86 AromaticContact CD2-CE2 3.57Å; F82-F86 HydrophobicContact CD2-CE2 3.57Å; F82-F86 HydrophobicContact CE1-CD2 4.13Å; F82-F86 HydrophobicContact CE1-CE2 4.4Å; F82-F86 AromaticContact CE2-CD2 3.47Å; F82-F86 HydrophobicContact CE2-CD2 3.47Å; F82-F86 VanDerWaalsContact CE2-CD2 3.47Å; F82-F86 AromaticContact CE2-CE2 2.99Å; F82-F86 HydrophobicContact CE2-CE2 2.99Å; F82-F86 HydrophobicContact CE2-CG 4.5Å; F82-F86 AromaticContact CE2-CZ 3.7Å; F82-F86 HydrophobicContact CE2-CZ 3.7Å; F82-F86 HydrophobicContact CG-CD2 4.28Å; F82-F86 HydrophobicContact CG-CE2 4.47Å; F82-F86 AromaticContact CZ-CD2 3.62Å; F82-F86 HydrophobicContact CZ-CD2 3.62Å; F82-F86 AromaticContact CZ-CE2 3.47Å; F82-F86 HydrophobicContact CZ-CE2 3.47Å; F82-F86 VanDerWaalsContact CZ-CE2 3.47Å; F82-F86 HydrophobicContact CZ-CG 4.26Å; F82-F86 AromaticContact CZ-CZ 3.96Å; F82-F86 HydrophobicContact CZ-CZ 3.96Å; F82-F86 WeakPolarHBondContact O-CD2 3.37Å; F82-F86 PolarHBondContact O-N 3Å; F82-F86 VanDerWaalsContact O-N 3.11Å; F82-F243 HydrophobicContact CB-CD2 4.38Å; F82-F243 HydrophobicContact CB-CE1 4.39Å; F82-F243 HydrophobicContact CB-CE2 3.91Å; F82-F243 HydrophobicContact CB-CZ 3.91Å; F82-F243 HydrophobicContact CD2-CB 4.33Å; F82-F243 AromaticContact CD2-CD1 3.9Å; F82-F243 HydrophobicContact CD2-CD1 3.9Å; F82-F243 HydrophobicContact CD2-CD2 4.16Å; F82-F243 HydrophobicContact CD2-CE1 4.2Å; F82-F243 HydrophobicContact CD2-CE2 4.42Å; F82-F243 AromaticContact CD2-CG 3.87Å; F82-F243 HydrophobicContact CD2-CG 3.87Å; F82-F243 HydrophobicContact CD2-CZ 4.44Å; F82-F246 HydrophobicContact CB-CD2 4.19Å; F82-F246 HydrophobicContact CB-CE2 4.48Å; F82-F246 HydrophobicContact CD1-CB 4.19Å; F82-F246 AromaticContact CD1-CD2 3.96Å; F82-F246 HydrophobicContact CD1-CD2 3.96Å; F82-F246 HydrophobicContact CD1-CG 4.35Å; F82-F246 HydrophobicContact CD2-CB 4.31Å; F82-F246 AromaticContact CD2-CD2 3.93Å; F82-F246 HydrophobicContact CD2-CD2 3.93Å; F82-F246 HydrophobicContact CE1-CB 3.7Å; F82-F246 HydrophobicContact CE1-CD2 4.34Å; F82-F246 HydrophobicContact CE1-CG 4.33Å; F82-F246 HydrophobicContact CE2-CB 3.79Å; F82-F246 HydrophobicContact CE2-CD2 4.27Å; F82-F246 HydrophobicContact CG-CB 4.48Å; F82-F246 AromaticContact CG-CD2 3.75Å; F82-F246 HydrophobicContact CG-CD2 3.75Å; F82-F246 HydrophobicContact CG-CE2 4.49Å; F82-F246 HydrophobicContact CZ-CB 3.48Å; F82-F246 VanDerWaalsContact CZ-CB 3.48Å; F82-F246 HydrophobicContact CZ-CD2 4.49Å; F82-F246 HydrophobicContact CZ-CG 4.44Å; F82-V247 HydrophobicContact CE2-CG2 3.96Å; F82-V247 HydrophobicContact CZ-CG2 4.07Å |
| 83 | L | 94.6 | Very high | 91.9 | Very high | 78 Ų | 78 | 56 Ų | 56 | 41% | 0.408 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -61.8 | -36.8 | 178.2 | -69.8 | -179.8 | 0 | 0 | 0 | 112.7 | F79 L80 F81 K87 | F79-L83 HydrophobicContact CD1-CD1 4.1Å; F79-L83 HydrophobicContact CD1-CG 4.5Å; F79-L83 HydrophobicContact CE1-CD1 3.5Å; F79-L83 VanDerWaalsContact CE1-CD1 3.5Å; F79-L83 HydrophobicContact CE1-CG 4.07Å; F79-L83 HydrophobicContact CE2-CD2 4.26Å; F79-L83 HydrophobicContact CE2-CG 4.24Å; F79-L83 HydrophobicContact CZ-CD1 3.74Å; F79-L83 HydrophobicContact CZ-CD2 3.99Å; F79-L83 HydrophobicContact CZ-CG 3.92Å; F79-L83 WeakPolarHBondContact O-CG 3.39Å; F79-L83 PolarHBondContact O-N 3.16Å; L80-L83 PolarHBondContact O-N 2.87Å; F81-L83 PolarHBondContact O-N 3.5Å; L83-K87 VanDerWaalsContact O-CB 3.26Å; L83-K87 WeakPolarHBondContact O-CB 3.35Å; L83-K87 PolarHBondContact O-N 3.46Å |
| 84 | L | 95 | Very high | 91.2 | Very high | 76 Ų | 76 | 60.8 Ų | 60.8 | 40% | 0.398 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -65.6 | -41.4 | 177.1 | -75.2 | 169.3 | 0 | 0 | 0 | 112 | F41 L80 F81 F82 K87 A88 | F41-L84 HydrophobicContact CE1-CD1 3.52Å; F41-L84 HydrophobicContact CE2-CD1 4.29Å; F41-L84 HydrophobicContact CZ-CD1 3.27Å; L80-L84 HydrophobicContact CG-CD1 4.39Å; L80-L84 WeakPolarHBondContact O-CG 3.35Å; L80-L84 PolarHBondContact O-N 3.06Å; F81-L84 PolarHBondContact O-N 3.12Å; F82-L84 VanDerWaalsContact C-N 3.29Å; F82-L84 PolarHBondContact O-N 3.33Å; L84-K87 PolarHBondContact O-N 3.09Å; L84-A88 WeakPolarHBondContact O-CB 3.39Å; L84-A88 PolarHBondContact O-N 3.06Å |
| 85 | I | 92.4 | Very high | 90.5 | Very high | 14 Ų | 14 | 65 Ų | 65 | 7% | 0.072 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -59.8 | -52.8 | 175.1 | -70.9 | 165.8 | 0 | 0 | 0 | 110.4 | L34 F81 F82 K87 A88 E89 V180 F243 | L34-I85 HydrophobicContact CD1-CD1 3.84Å; L34-I85 HydrophobicContact CD1-CG1 3.92Å; F81-I85 HydrophobicContact CD1-CD1 3.72Å; F81-I85 HydrophobicContact CE1-CD1 3.37Å; F81-I85 HydrophobicContact CE1-CG1 4.18Å; F81-I85 HydrophobicContact CG-CD1 4.45Å; F81-I85 HydrophobicContact CZ-CD1 3.84Å; F81-I85 HydrophobicContact CZ-CG1 4.19Å; F81-I85 WeakPolarHBondContact O-CG1 3.5Å; F81-I85 PolarHBondContact O-N 2.79Å; F82-I85 PolarHBondContact O-N 3.03Å; I85-K87 VanDerWaalsContact C-N 3.28Å; I85-K87 PolarHBondContact O-N 3.13Å; I85-A88 WeakPolarHBondContact O-CA 3.47Å; I85-A88 WeakPolarHBondContact O-CB 3.24Å; I85-A88 PolarHBondContact O-N 3.3Å; I85-E89 PolarHBondContact O-N 3.5Å; I85-V180 HydrophobicContact CD1-CG1 3.92Å; I85-V180 HydrophobicContact CG2-CG1 3.61Å; I85-F243 HydrophobicContact CD1-CE1 3.71Å; I85-F243 HydrophobicContact CD1-CZ 4.13Å |
| 86 | F | 88.6 | Confident | 89.7 | Confident | 54 Ų | 54 | 67.7 Ų | 67.7 | 24% | 0.237 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -65.6 | -32.9 | -178.3 | -84.7 | -98.1 | 0 | 0 | 0 | 112.4 | F82 S90 H177 V247 | F82-F86 HydrophobicContact CD1-CD2 4.45Å; F82-F86 AromaticContact CD2-CD2 3.8Å; F82-F86 HydrophobicContact CD2-CD2 3.8Å; F82-F86 AromaticContact CD2-CE2 3.57Å; F82-F86 HydrophobicContact CD2-CE2 3.57Å; F82-F86 HydrophobicContact CE1-CD2 4.13Å; F82-F86 HydrophobicContact CE1-CE2 4.4Å; F82-F86 AromaticContact CE2-CD2 3.47Å; F82-F86 HydrophobicContact CE2-CD2 3.47Å; F82-F86 VanDerWaalsContact CE2-CD2 3.47Å; F82-F86 AromaticContact CE2-CE2 2.99Å; F82-F86 HydrophobicContact CE2-CE2 2.99Å; F82-F86 HydrophobicContact CE2-CG 4.5Å; F82-F86 AromaticContact CE2-CZ 3.7Å; F82-F86 HydrophobicContact CE2-CZ 3.7Å; F82-F86 HydrophobicContact CG-CD2 4.28Å; F82-F86 HydrophobicContact CG-CE2 4.47Å; F82-F86 AromaticContact CZ-CD2 3.62Å; F82-F86 HydrophobicContact CZ-CD2 3.62Å; F82-F86 AromaticContact CZ-CE2 3.47Å; F82-F86 HydrophobicContact CZ-CE2 3.47Å; F82-F86 VanDerWaalsContact CZ-CE2 3.47Å; F82-F86 HydrophobicContact CZ-CG 4.26Å; F82-F86 AromaticContact CZ-CZ 3.96Å; F82-F86 HydrophobicContact CZ-CZ 3.96Å; F82-F86 WeakPolarHBondContact O-CD2 3.37Å; F82-F86 PolarHBondContact O-N 3Å; F82-F86 VanDerWaalsContact O-N 3.11Å; F86-S90 WeakPolarHBondContact O-CB 3.33Å; F86-S90 PolarHBondContact O-N 2.94Å; F86-S90 PolarHBondContact O-OG 2.95Å; F86-H177 AromaticContact CZ-ND1 3.83Å; F86-V247 HydrophobicContact CE1-CG2 4.12Å; F86-V247 HydrophobicContact CE2-CG2 4.26Å; F86-V247 HydrophobicContact CZ-CG2 3.48Å; F86-V247 VanDerWaalsContact CZ-CG2 3.48Å |
| 87 | K | 91.1 | Very high | 88.7 | Confident | 154 Ų | 154 | 67.1 Ų | 67.1 | 67% | 0.67 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -63 | -43.6 | 170.8 | -170.3 | 96.2 | 78.4 | 73.9 | 0 | 110.9 | L83 L84 I85 S90 G91 | L83-K87 VanDerWaalsContact O-CB 3.26Å; L83-K87 WeakPolarHBondContact O-CB 3.35Å; L83-K87 PolarHBondContact O-N 3.46Å; L84-K87 PolarHBondContact O-N 3.09Å; I85-K87 VanDerWaalsContact C-N 3.28Å; I85-K87 PolarHBondContact O-N 3.13Å; K87-S90 PolarHBondContact O-N 3.36Å; K87-G91 PolarHBondContact O-N 3.48Å |
| 88 | A | 90.7 | Very high | 87.4 | Confident | 66 Ų | 66 | 69.8 Ų | 69.8 | 55% | 0.545 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -65.8 | -41.6 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | L84 I85 G91 L92 | L84-A88 WeakPolarHBondContact O-CB 3.39Å; L84-A88 PolarHBondContact O-N 3.06Å; I85-A88 WeakPolarHBondContact O-CA 3.47Å; I85-A88 WeakPolarHBondContact O-CB 3.24Å; I85-A88 PolarHBondContact O-N 3.3Å; A88-G91 PolarHBondContact O-N 3.23Å; A88-L92 PolarHBondContact O-N 3.46Å |
| 89 | E | 86.6 | Confident | 86 | Confident | 39 Ų | 39 | 73.4 Ų | 73.4 | 18% | 0.182 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -60.7 | -48.3 | 174.7 | -72.3 | 179.2 | -179.9 | 0 | 0 | 111.6 | I85 G91 L92 Q93 H177 | I85-E89 PolarHBondContact O-N 3.5Å; E89-G91 VanDerWaalsContact C-N 3.28Å; E89-G91 PolarHBondContact O-N 3.03Å; E89-L92 PolarHBondContact O-N 3.29Å; E89-L92 VanDerWaalsContact O-N 3.14Å; E89-Q93 WeakPolarHBondContact O-CG 3.43Å; E89-Q93 PolarHBondContact O-N 3.13Å; E89-H177 IonicContact OE2-CE1 3.26Å; E89-H177 IonicContact OE2-ND1 3.13Å |
| 90 | S | 85.5 | Confident | 84.2 | Confident | 76 Ų | 76 | 73.9 Ų | 73.9 | 53% | 0.531 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -60.3 | -40.3 | 177.7 | -57 | 0 | 0 | 0 | 0 | 111.7 | F86 K87 Q93 L94 | F86-S90 WeakPolarHBondContact O-CB 3.33Å; F86-S90 PolarHBondContact O-N 2.94Å; F86-S90 PolarHBondContact O-OG 2.95Å; K87-S90 PolarHBondContact O-N 3.36Å; S90-Q93 PolarHBondContact O-N 2.73Å; S90-L94 PolarHBondContact O-N 2.97Å |
| 91 | G | 85.6 | Confident | 82 | Confident | 37 Ų | 37 | 75 Ų | 75 | 38% | 0.381 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -63.8 | -39.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | K87 A88 E89 I95 | K87-G91 PolarHBondContact O-N 3.48Å; A88-G91 PolarHBondContact O-N 3.23Å; E89-G91 VanDerWaalsContact C-N 3.28Å; E89-G91 PolarHBondContact O-N 3.03Å; G91-I95 WeakPolarHBondContact O-CG1 3.42Å |
| 92 | L | 78.7 | Confident | 79.9 | Confident | 113 Ų | 113 | 78.9 Ų | 78.9 | 59% | 0.592 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -70 | -40.2 | 178.2 | -172.8 | 59.9 | 0 | 0 | 0 | 111.9 | A88 E89 L94 I95 V96 | A88-L92 PolarHBondContact O-N 3.46Å; E89-L92 PolarHBondContact O-N 3.29Å; E89-L92 VanDerWaalsContact O-N 3.14Å; L92-L94 VanDerWaalsContact C-N 3.33Å; L92-L94 PolarHBondContact O-N 3.44Å; L92-I95 PolarHBondContact O-N 2.84Å; L92-V96 WeakPolarHBondContact O-CG2 3.49Å; L92-V96 PolarHBondContact O-N 2.94Å |
| 93 | Q | 77.9 | Confident | 77.8 | Confident | 123 Ų | 123 | 84.3 Ų | 84.3 | 58% | 0.575 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -60.9 | -40.6 | 177.9 | -71.2 | 174.6 | 20.8 | 0 | 0 | 112.1 | E89 S90 I95 V96 S97 | E89-Q93 WeakPolarHBondContact O-CG 3.43Å; E89-Q93 PolarHBondContact O-N 3.13Å; S90-Q93 PolarHBondContact O-N 2.73Å; Q93-I95 VanDerWaalsContact C-N 3.3Å; Q93-I95 PolarHBondContact O-N 3.43Å; Q93-V96 PolarHBondContact O-N 3.5Å; Q93-S97 PolarHBondContact O-N 3.25Å; Q93-S97 PolarHBondContact O-OG 3.01Å |
| 94 | L | 82.1 | Confident | 75.7 | Confident | 123 Ų | 123 | 85 Ų | 85 | 64% | 0.644 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -57.3 | -42.9 | 175.6 | -174 | 79.6 | 0 | 0 | 0 | 112 | S90 L92 S98 | S90-L94 PolarHBondContact O-N 2.97Å; L92-L94 VanDerWaalsContact C-N 3.33Å; L92-L94 PolarHBondContact O-N 3.44Å; L94-S98 WeakPolarHBondContact O-CB 3.13Å; L94-S98 PolarHBondContact O-N 3.23Å; L94-S98 PolarHBondContact O-OG 3.14Å |
| 95 | I | 79.7 | Confident | 73.2 | Confident | 111 Ų | 111 | 89.9 Ų | 89.9 | 57% | 0.569 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -69.1 | -41.5 | -179.2 | -61.8 | 164.3 | 0 | 0 | 0 | 110.3 | G91 L92 Q93 S98 S99 | G91-I95 WeakPolarHBondContact O-CG1 3.42Å; L92-I95 PolarHBondContact O-N 2.84Å; Q93-I95 VanDerWaalsContact C-N 3.3Å; Q93-I95 PolarHBondContact O-N 3.43Å; I95-S98 PolarHBondContact O-N 3.11Å; I95-S99 PolarHBondContact O-N 3.45Å; I95-S99 VanDerWaalsContact O-N 3.1Å; I95-S99 PolarHBondContact O-OG 3.25Å |
| 96 | V | 79.5 | Confident | 70.8 | Confident | 61 Ų | 61 | 94.6 Ų | 94.6 | 37% | 0.37 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -62.1 | -49.2 | 177.3 | 173.9 | 0 | 0 | 0 | 0 | 110.5 | L92 Q93 S98 S99 T100 | L92-V96 WeakPolarHBondContact O-CG2 3.49Å; L92-V96 PolarHBondContact O-N 2.94Å; Q93-V96 PolarHBondContact O-N 3.5Å; V96-S98 PolarHBondContact O-N 3.02Å; V96-S99 PolarHBondContact O-N 2.95Å; V96-S99 PolarHBondContact O-OG 2.95Å; V96-T100 PolarHBondContact O-N 3.2Å; V96-T100 PolarHBondContact O-OG1 3.34Å |
| 97 | S | 76.7 | Confident | 68.8 | Low | 81 Ų | 81 | 99.3 Ų | 99.3 | 57% | 0.566 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -62.4 | -42.5 | 177.4 | -59.5 | 0 | 0 | 0 | 0 | 112.4 | Q93 S99 T100 T101 | Q93-S97 PolarHBondContact O-N 3.25Å; Q93-S97 PolarHBondContact O-OG 3.01Å; S97-S99 VanDerWaalsContact C-N 3.34Å; S97-S99 PolarHBondContact O-N 3.48Å; S97-T100 PolarHBondContact O-N 3.45Å; S97-T100 VanDerWaalsContact O-N 3.08Å; S97-T101 PolarHBondContact O-N 3.4Å |
| 98 | S | 71.1 | Confident | 66.8 | Low | 72 Ų | 72 | 97.9 Ų | 97.9 | 50% | 0.503 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -61.4 | -41.3 | 179.7 | -58.7 | 0 | 0 | 0 | 0 | 112.5 | L94 I95 V96 T100 T101 | L94-S98 WeakPolarHBondContact O-CB 3.13Å; L94-S98 PolarHBondContact O-N 3.23Å; L94-S98 PolarHBondContact O-OG 3.14Å; I95-S98 PolarHBondContact O-N 3.11Å; V96-S98 PolarHBondContact O-N 3.02Å; S98-T100 PolarHBondContact O-N 3.43Å; S98-T101 WeakPolarHBondContact O-CB 3.04Å; S98-T101 PolarHBondContact O-N 2.99Å; S98-T101 PolarHBondContact O-OG1 3.45Å |
| 99 | S | 66.3 | Low | 64.7 | Low | 76 Ų | 76 | 101.1 Ų | 101.1 | 53% | 0.531 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -67.8 | -19 | 177.6 | 70.6 | 0 | 0 | 0 | 0 | 114.1 | I95 V96 S97 | I95-S99 PolarHBondContact O-N 3.45Å; I95-S99 VanDerWaalsContact O-N 3.1Å; I95-S99 PolarHBondContact O-OG 3.25Å; V96-S99 PolarHBondContact O-N 2.95Å; V96-S99 PolarHBondContact O-OG 2.95Å; S97-S99 VanDerWaalsContact C-N 3.34Å; S97-S99 PolarHBondContact O-N 3.48Å |
| 100 | T | 57.5 | Low | 63 | Low | 94 Ų | 94 | 104.9 Ų | 104.9 | 58% | 0.577 | 61% | 0.605 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.2 | 4.2 | -179.9 | -31.5 | 0 | 0 | 0 | 0 | 111.7 | V96 S97 S98 P102 | V96-T100 PolarHBondContact O-N 3.2Å; V96-T100 PolarHBondContact O-OG1 3.34Å; S97-T100 PolarHBondContact O-N 3.45Å; S97-T100 VanDerWaalsContact O-N 3.08Å; S98-T100 PolarHBondContact O-N 3.43Å; T100-P102 WeakPolarHBondContact O-CD 3.45Å |
| 101 | T | 51.1 | Low | 61.1 | Low | 101 Ų | 101 | 104.4 Ų | 104.4 | 62% | 0.62 | 61% | 0.612 | S | S | * | * | trans | -65.4 | 102.8 | 163.5 | -41 | 0 | 0 | 0 | 0 | 105.2 | S97 S98 V103 | S97-T101 PolarHBondContact O-N 3.4Å; S98-T101 WeakPolarHBondContact O-CB 3.04Å; S98-T101 PolarHBondContact O-N 2.99Å; S98-T101 PolarHBondContact O-OG1 3.45Å; T101-V103 PolarHBondContact O-N 2.9Å | ||
| 102 | P | 51.8 | Low | 59.2 | Low | 91 Ų | 91 | 110.1 Ų | 110.1 | 59% | 0.591 | 63% | 0.632 | S | S | * | * | trans | -54.8 | 136.2 | 166.3 | 27.2 | -32.5 | 0 | 0 | 0 | 104.3 | T100 S104 | T100-P102 WeakPolarHBondContact O-CD 3.45Å; P102-S104 PolarHBondContact O-N 3.05Å | ||
| 103 | V | 52.2 | Low | 57.2 | Low | 130 Ų | 130 | 111.2 Ų | 111.2 | 79% | 0.788 | 64% | 0.639 | S | S | * | * | trans | -58.6 | 85 | 158.4 | 175.3 | 0 | 0 | 0 | 0 | 104.1 | T101 R105 | T101-V103 PolarHBondContact O-N 2.9Å; V103-R105 HydrophobicContact CG1-CB 4.06Å; V103-R105 PolarHBondContact O-N 3.28Å | ||
| 104 | S | 50.3 | Low | 55.4 | Low | 94 Ų | 94 | 111.8 Ų | 111.8 | 66% | 0.657 | 65% | 0.646 | S | S | * | * | trans | -63.4 | 66.8 | 149.4 | -56.9 | 0 | 0 | 0 | 0 | 103.8 | P102 P106 | P102-S104 PolarHBondContact O-N 3.05Å; S104-P106 VanDerWaalsContact C-N 3.28Å; S104-P106 WeakPolarHBondContact O-CD 3.07Å | ||
| 105 | R | 41.4 | Very low | 53.7 | Low | 177 Ų | 177 | 112.8 Ų | 112.8 | 67% | 0.668 | 65% | 0.652 | S | S | * | * | trans | -44.6 | 115.5 | 137.5 | 179.4 | 177.5 | -67.1 | 162.6 | -0.4 | 101.6 | V103 Q107 | V103-R105 HydrophobicContact CG1-CB 4.06Å; V103-R105 PolarHBondContact O-N 3.28Å; R105-Q107 PolarHBondContact O-N 3.12Å | ||
| 106 | P | 43.6 | Very low | 51.7 | Low | 113 Ų | 113 | 115.2 Ų | 115.2 | 73% | 0.734 | 67% | 0.666 | S | S | * | * | trans | -50.7 | 106.7 | 168.9 | -18.6 | 30.5 | 0 | 0 | 0 | 103.2 | S104 L108 | S104-P106 VanDerWaalsContact C-N 3.28Å; S104-P106 WeakPolarHBondContact O-CD 3.07Å; P106-L108 PolarHBondContact O-N 3.2Å | ||
| 107 | Q | 45.9 | Very low | 49.8 | Very low | 154 Ų | 154 | 118.9 Ų | 118.9 | 72% | 0.72 | 68% | 0.682 | S | S | * | * | trans | -66.6 | 87.5 | 160.1 | -69 | -73 | -15.5 | 0 | 0 | 100 | R105 V109 | R105-Q107 PolarHBondContact O-N 3.12Å; Q107-V109 PolarHBondContact O-N 3.09Å | ||
| 108 | L | 47.9 | Very low | 48 | Very low | 124 Ų | 124 | 121.5 Ų | 121.5 | 65% | 0.649 | 69% | 0.688 | S | S | * | * | trans | -49 | 108.2 | 155.9 | 178.9 | 67.9 | 0 | 0 | 0 | 102.2 | P106 D110 | P106-L108 PolarHBondContact O-N 3.2Å; L108-D110 WeakPolarHBondContact CD2-OD2 3.29Å; L108-D110 PolarHBondContact O-N 3.32Å | ||
| 109 | V | 47.9 | Very low | 46.9 | Very low | 133 Ų | 133 | 124.9 Ų | 124.9 | 81% | 0.806 | 70% | 0.701 | S | S | * | * | trans | -68 | 70.3 | 175.1 | 178.4 | 0 | 0 | 0 | 0 | 105.2 | Q107 G111 | Q107-V109 PolarHBondContact O-N 3.09Å; V109-G111 PolarHBondContact O-N 3.49Å | ||
| 110 | D | 50.7 | Low | 45.4 | Very low | 119 Ų | 119 | 127.9 Ų | 127.9 | 64% | 0.636 | 71% | 0.711 | S | S | * | * | trans | -85.2 | 88.9 | 161.9 | -78.3 | -9.7 | 0 | 0 | 0 | 103.9 | L108 I112 | L108-D110 WeakPolarHBondContact CD2-OD2 3.29Å; L108-D110 PolarHBondContact O-N 3.32Å; D110-I112 PolarHBondContact O-N 2.83Å | ||
| 111 | G | 45.8 | Very low | 44.6 | Very low | 66 Ų | 66 | 132.4 Ų | 132.4 | 68% | 0.68 | 73% | 0.725 | S | S | * | * | trans | -55.5 | 107.6 | 167.4 | 0 | 0 | 0 | 0 | 0 | 108.7 | V109 | V109-G111 PolarHBondContact O-N 3.49Š| ||
| 112 | I | 45.3 | Very low | 44.3 | Very low | 156 Ų | 156 | 132.2 Ų | 132.2 | 80% | 0.8 | 73% | 0.728 | S | S | * | * | trans | -130.2 | 97.4 | 154.7 | -61.8 | -178.8 | 0 | 0 | 0 | 106.2 | D110 | D110-I112 PolarHBondContact O-N 2.83Š| ||
| 113 | N | 36.2 | Very low | 44 | Very low | 136 Ų | 136 | 136.8 Ų | 136.8 | 73% | 0.727 | 74% | 0.741 | S | S | * | * | trans | -54.2 | 145.9 | 161.9 | -72.8 | -42.9 | 0 | 0 | 0 | 109.9 | ||||
| 114 | N | 39.4 | Very low | 43.7 | Very low | 135 Ų | 135 | 134 Ų | 134 | 72% | 0.722 | 74% | 0.738 | S | S | * | * | trans | 72.5 | 108.7 | 159.5 | -48.4 | -22.2 | 0 | 0 | 0 | 115 | ||||
| 115 | D | 48.3 | Very low | 43.3 | Very low | 144 Ų | 144 | 140.3 Ų | 140.3 | 77% | 0.77 | 75% | 0.748 | S | S | * | * | -174.3 | 134.3 | 96.6 | -83.8 | -26.8 | 0 | 0 | 0 | 110.7 | I117 | D115-I117 PolarHBondContact O-N 3.41Å; D115-I117 VanDerWaalsContact O-N 3.16Å | |||
| 116 | N | 37.6 | Very low | 43.6 | Very low | 162 Ų | 162 | 137.3 Ų | 137.3 | 87% | 0.866 | 74% | 0.741 | S | S | * | * | trans | -63.7 | 108.2 | 173.2 | -57.2 | -54.2 | 0 | 0 | 0 | 109 | ||||
| 117 | I | 38.1 | Very low | 43.7 | Very low | 138 Ų | 138 | 135.1 Ų | 135.1 | 71% | 0.708 | 73% | 0.733 | S | S | * | * | trans | -124.3 | 114 | 163.9 | -63.6 | -177.6 | 0 | 0 | 0 | 109.1 | D115 D119 | D115-I117 PolarHBondContact O-N 3.41Å; D115-I117 VanDerWaalsContact O-N 3.16Å; I117-D119 PolarHBondContact O-N 3.36Å | ||
| 118 | I | 39.4 | Very low | 43.6 | Very low | 136 Ų | 136 | 135 Ų | 135 | 70% | 0.697 | 73% | 0.733 | S | S | * | * | trans | -81.6 | 100.5 | -179.9 | -62.9 | 161.8 | 0 | 0 | 0 | 107.3 | ||||
| 119 | D | 48.2 | Very low | 43.2 | Very low | 144 Ų | 144 | 138.3 Ų | 138.3 | 77% | 0.77 | 74% | 0.736 | S | S | * | * | trans | -119.3 | 85.6 | 168.1 | -70.8 | -17.5 | 0 | 0 | 0 | 109.9 | I117 H121 | I117-D119 PolarHBondContact O-N 3.36Å; D119-H121 PolarHBondContact O-N 2.84Å | ||
| 120 | N | 35.7 | Very low | 43 | Very low | 139 Ų | 139 | 135.4 Ų | 135.4 | 74% | 0.743 | 72% | 0.716 | S | S | * | * | trans | -73.2 | 95.8 | 167.7 | -72.3 | -43 | 0 | 0 | 0 | 109.9 | ||||
| 121 | H | 39.9 | Very low | 42.6 | Very low | 189 Ų | 189 | 135.8 Ų | 135.8 | 88% | 0.875 | 71% | 0.714 | S | S | * | * | trans | -166.3 | 75.3 | 160.7 | -127.8 | -74.1 | 0 | 0 | 0 | 116.8 | D119 | D119-H121 PolarHBondContact O-N 2.84Š| ||
| 122 | S | 45 | Very low | 42.6 | Very low | 97 Ų | 97 | 137 Ų | 137 | 68% | 0.678 | 71% | 0.709 | S | S | * | * | trans | -173.7 | 63.1 | 153.1 | 43.3 | 0 | 0 | 0 | 0 | 113.9 | G124 | S122-G124 VanDerWaalsContact C-N 3.34Å; S122-G124 PolarHBondContact O-N 2.91Å | ||
| 123 | H | 44.5 | Very low | 42.3 | Very low | 187 Ų | 187 | 131.6 Ų | 131.6 | 87% | 0.866 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.3 | 4.4 | -175.6 | -105 | -53.7 | 0 | 0 | 0 | 116.8 | ||
| 124 | G | 45.8 | Very low | 42.4 | Very low | 71 Ų | 71 | 128.7 Ų | 128.7 | 73% | 0.732 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.5 | -22.5 | -168.5 | 0 | 0 | 0 | 0 | 0 | 117.8 | S122 | S122-G124 VanDerWaalsContact C-N 3.34Å; S122-G124 PolarHBondContact O-N 2.91Å |
| 125 | R | 43 | Very low | 42.4 | Very low | 227 Ų | 227 | 127.1 Ų | 127.1 | 86% | 0.857 | 66% | 0.66 | S | S | * | * | S | Bend | trans | -114.7 | -6 | -175 | -87.1 | -169.2 | -83.7 | -161.9 | -5.1 | 114.9 | ||
| 126 | E | 46.6 | Very low | 42 | Very low | 113 Ų | 113 | 124.5 Ų | 124.5 | 53% | 0.528 | 65% | 0.649 | S | S | . | * | H | α-helix | trans | -85.7 | -29.2 | -178.5 | -164.7 | 153.9 | -164.6 | 0 | 0 | 112.2 | E128 R129 N130 | E126-E128 PolarHBondContact O-N 2.91Å; E126-R129 PolarHBondContact O-N 3.44Å; E126-N130 VanDerWaalsContact O-CB 3.29Å; E126-N130 WeakPolarHBondContact O-CB 3.44Å; E126-N130 PolarHBondContact O-N 2.8Å; E126-N130 PolarHBondContact O-ND2 3.29Å; E126-N130 PolarHBondContact O-OD1 2.91Å |
| 127 | A | 47 | Very low | 41.7 | Very low | 68 Ų | 68 | 123.8 Ų | 123.8 | 56% | 0.562 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -61.6 | -44.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113 | N130 E131 | A127-N130 PolarHBondContact O-N 2.97Å; A127-E131 PolarHBondContact O-N 3.26Å |
| 128 | E | 43.3 | Very low | 41.4 | Very low | 152 Ų | 152 | 122.5 Ų | 122.5 | 71% | 0.71 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -72.3 | -37 | -179.5 | -163.2 | -179.8 | 142.1 | 0 | 0 | 112.1 | E126 N130 E131 V132 | E126-E128 PolarHBondContact O-N 2.91Å; E128-N130 VanDerWaalsContact C-N 3.26Å; E128-N130 PolarHBondContact O-N 3.35Å; E128-E131 PolarHBondContact O-N 3.46Å; E128-V132 PolarHBondContact O-N 2.86Å; E128-V132 VanDerWaalsContact O-N 3.14Å |
| 129 | R | 39.6 | Very low | 41.1 | Very low | 192 Ų | 192 | 125.1 Ų | 125.1 | 73% | 0.725 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -63.4 | -36.6 | 172.5 | -168 | -175 | -64.8 | -91 | 1.4 | 110.9 | E126 S133 | E126-R129 PolarHBondContact O-N 3.44Å; R129-S133 VanDerWaalsContact O-CB 3.31Å; R129-S133 WeakPolarHBondContact O-CB 3.32Å; R129-S133 PolarHBondContact O-N 2.86Å |
| 130 | N | 43 | Very low | 40.5 | Very low | 72 Ų | 72 | 123.5 Ų | 123.5 | 39% | 0.385 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -70.2 | -38.7 | 177.9 | -71.6 | -17.3 | 0 | 0 | 0 | 112 | E126 A127 E128 S133 N134 | E126-N130 VanDerWaalsContact O-CB 3.29Å; E126-N130 WeakPolarHBondContact O-CB 3.44Å; E126-N130 PolarHBondContact O-N 2.8Å; E126-N130 PolarHBondContact O-ND2 3.29Å; E126-N130 PolarHBondContact O-OD1 2.91Å; A127-N130 PolarHBondContact O-N 2.97Å; E128-N130 VanDerWaalsContact C-N 3.26Å; E128-N130 PolarHBondContact O-N 3.35Å; N130-S133 CarbonylContact O-C 3.56Å; N130-S133 PolarHBondContact O-N 3.28Å; N130-S133 PolarHBondContact O-OG 2.98Å; N130-N134 VanDerWaalsContact O-CB 3.26Å; N130-N134 WeakPolarHBondContact O-CB 3.37Å; N130-N134 PolarHBondContact O-N 2.99Å; N130-N134 PolarHBondContact O-ND2 3.4Å; N130-N134 VanDerWaalsContact O-ND2 3.16Å |
| 131 | E | 42.8 | Very low | 40.2 | Very low | 127 Ų | 127 | 121.1 Ų | 121.1 | 59% | 0.593 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -66.5 | -45.1 | 178 | -163.7 | 172.9 | 179.4 | 0 | 0 | 112.1 | A127 E128 S133 N134 L135 | A127-E131 PolarHBondContact O-N 3.26Å; E128-E131 PolarHBondContact O-N 3.46Å; E131-S133 VanDerWaalsContact C-N 3.3Å; E131-S133 PolarHBondContact O-N 3.44Å; E131-N134 PolarHBondContact O-N 2.97Å; E131-N134 VanDerWaalsContact O-N 3.08Å; E131-L135 HydrophobicContact CG-CD1 4.01Å; E131-L135 WeakPolarHBondContact O-CD1 3.44Å; E131-L135 PolarHBondContact O-N 3.26Å |
| 132 | V | 45.5 | Very low | 39.8 | Very low | 93 Ų | 93 | 117.2 Ų | 117.2 | 56% | 0.564 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -63 | -38.1 | 172.9 | 179.4 | 0 | 0 | 0 | 0 | 111.1 | E128 N134 T136 | E128-V132 PolarHBondContact O-N 2.86Å; E128-V132 VanDerWaalsContact O-N 3.14Å; V132-N134 VanDerWaalsContact C-N 3.31Å; V132-N134 PolarHBondContact O-N 3.42Å; V132-T136 WeakPolarHBondContact O-CB 3.35Å; V132-T136 PolarHBondContact O-N 2.85Å; V132-T136 VanDerWaalsContact O-N 3.07Å; V132-T136 PolarHBondContact O-OG1 3.42Å |
| 133 | S | 40 | Very low | 39.5 | Very low | 41 Ų | 41 | 117.6 Ų | 117.6 | 29% | 0.287 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -64.3 | -36.5 | 173.7 | 96.1 | 0 | 0 | 0 | 0 | 112 | R129 N130 E131 T136 R137 | R129-S133 VanDerWaalsContact O-CB 3.31Å; R129-S133 WeakPolarHBondContact O-CB 3.32Å; R129-S133 PolarHBondContact O-N 2.86Å; N130-S133 CarbonylContact O-C 3.56Å; N130-S133 PolarHBondContact O-N 3.28Å; N130-S133 PolarHBondContact O-OG 2.98Å; E131-S133 VanDerWaalsContact C-N 3.3Å; E131-S133 PolarHBondContact O-N 3.44Å; S133-T136 PolarHBondContact O-N 3.44Å; S133-R137 WeakPolarHBondContact O-CB 3.22Å; S133-R137 PolarHBondContact O-N 3.05Å; S133-R137 PolarHBondContact OG-NH1 3.29Å |
| 134 | N | 37.8 | Very low | 39.2 | Very low | 75 Ų | 75 | 111.9 Ų | 111.9 | 40% | 0.401 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -77.3 | -36.8 | -177.1 | -75.7 | -25.8 | 0 | 0 | 0 | 111.8 | N130 E131 V132 T136 R137 N138 | N130-N134 VanDerWaalsContact O-CB 3.26Å; N130-N134 WeakPolarHBondContact O-CB 3.37Å; N130-N134 PolarHBondContact O-N 2.99Å; N130-N134 PolarHBondContact O-ND2 3.4Å; N130-N134 VanDerWaalsContact O-ND2 3.16Å; E131-N134 PolarHBondContact O-N 2.97Å; E131-N134 VanDerWaalsContact O-N 3.08Å; V132-N134 VanDerWaalsContact C-N 3.31Å; V132-N134 PolarHBondContact O-N 3.42Å; N134-T136 VanDerWaalsContact C-N 3.31Å; N134-T136 PolarHBondContact O-N 3.23Å; N134-R137 PolarHBondContact O-N 3.44Å; N134-R137 PolarHBondContact OD1-NH1 3.46Å; N134-N138 WeakPolarHBondContact O-CB 3.43Å; N134-N138 PolarHBondContact O-N 3.1Å |
| 135 | L | 39.3 | Very low | 38.4 | Very low | 103 Ų | 103 | 114.6 Ų | 114.6 | 54% | 0.539 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -64.2 | -38.2 | 169.5 | -92.3 | 109 | 0 | 0 | 0 | 111.7 | E131 R139 | E131-L135 HydrophobicContact CG-CD1 4.01Å; E131-L135 WeakPolarHBondContact O-CD1 3.44Å; E131-L135 PolarHBondContact O-N 3.26Å; L135-R139 WeakPolarHBondContact O-CB 3.39Å; L135-R139 PolarHBondContact O-N 3.01Å; L135-R139 VanDerWaalsContact O-N 3.08Å |
| 136 | T | 40.6 | Very low | 37.9 | Very low | 88 Ų | 88 | 109.6 Ų | 109.6 | 54% | 0.54 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -70.5 | -38.3 | 176.3 | -50 | 0 | 0 | 0 | 0 | 111.3 | V132 S133 N134 K140 | V132-T136 WeakPolarHBondContact O-CB 3.35Å; V132-T136 PolarHBondContact O-N 2.85Å; V132-T136 VanDerWaalsContact O-N 3.07Å; V132-T136 PolarHBondContact O-OG1 3.42Å; S133-T136 PolarHBondContact O-N 3.44Å; N134-T136 VanDerWaalsContact C-N 3.31Å; N134-T136 PolarHBondContact O-N 3.23Å; T136-K140 PolarHBondContact O-N 3.17Å |
| 137 | R | 31.9 | Very low | 37.1 | Very low | 148 Ų | 148 | 111 Ų | 111 | 56% | 0.558 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -66.6 | -44.6 | 176.1 | -175.5 | 178.5 | -86.2 | 111.9 | -4.4 | 111.7 | S133 N134 K140 I141 | S133-R137 WeakPolarHBondContact O-CB 3.22Å; S133-R137 PolarHBondContact O-N 3.05Å; S133-R137 PolarHBondContact OG-NH1 3.29Å; N134-R137 PolarHBondContact O-N 3.44Å; N134-R137 PolarHBondContact OD1-NH1 3.46Å; R137-K140 WeakPolarHBondContact O-CB 3.19Å; R137-K140 PolarHBondContact O-N 3.32Å; R137-K140 VanDerWaalsContact O-N 3.16Å; R137-I141 WeakPolarHBondContact O-CG1 3.49Å; R137-I141 PolarHBondContact O-N 2.98Å |
| 138 | N | 30.9 | Very low | 36.5 | Very low | 110 Ų | 110 | 114 Ų | 114 | 59% | 0.588 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -70.6 | -32.2 | 178.6 | -84.8 | -22.2 | 0 | 0 | 0 | 113.2 | N134 K140 I141 | N134-N138 WeakPolarHBondContact O-CB 3.43Å; N134-N138 PolarHBondContact O-N 3.1Å; N138-K140 VanDerWaalsContact C-N 3.27Å; N138-K140 PolarHBondContact O-N 3.43Å; N138-I141 PolarHBondContact O-N 2.95Å |
| 139 | R | 32.7 | Very low | 36.2 | Very low | 192 Ų | 192 | 112.1 Ų | 112.1 | 73% | 0.725 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -67.6 | -30.3 | 171.2 | -163 | -178.7 | -64.7 | 156.5 | 0.8 | 111.9 | L135 | L135-R139 WeakPolarHBondContact O-CB 3.39Å; L135-R139 PolarHBondContact O-N 3.01Å; L135-R139 VanDerWaalsContact O-N 3.08Å |
| 140 | K | 35.2 | Very low | 35.9 | Very low | 110 Ų | 110 | 110 Ų | 110 | 48% | 0.478 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -72.3 | -32 | 176.6 | -126.4 | -179.1 | -166.1 | -162.1 | 0 | 113.3 | T136 R137 N138 S142 S143 S144 | T136-K140 PolarHBondContact O-N 3.17Å; R137-K140 WeakPolarHBondContact O-CB 3.19Å; R137-K140 PolarHBondContact O-N 3.32Å; R137-K140 VanDerWaalsContact O-N 3.16Å; N138-K140 VanDerWaalsContact C-N 3.27Å; N138-K140 PolarHBondContact O-N 3.43Å; K140-S142 PolarHBondContact O-N 3.47Å; K140-S143 PolarHBondContact O-N 3.44Å; K140-S144 PolarHBondContact O-N 3.04Å |
| 141 | I | 30.5 | Very low | 35.7 | Very low | 89 Ų | 89 | 113.2 Ų | 113.2 | 46% | 0.456 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -65.4 | -30 | 177.6 | -67.6 | 165.9 | 0 | 0 | 0 | 111.4 | R137 N138 S143 N145 | R137-I141 WeakPolarHBondContact O-CG1 3.49Å; R137-I141 PolarHBondContact O-N 2.98Å; N138-I141 PolarHBondContact O-N 2.95Å; I141-S143 VanDerWaalsContact C-N 3.26Å; I141-S143 PolarHBondContact O-N 3.47Å; I141-N145 PolarHBondContact O-OD1 3.48Å |
| 142 | S | 31.1 | Very low | 35.6 | Very low | 107 Ų | 107 | 117.6 Ų | 117.6 | 75% | 0.748 | 61% | 0.614 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.2 | -9.8 | -179.7 | -158.7 | 0 | 0 | 0 | 0 | 114.7 | K140 | K140-S142 PolarHBondContact O-N 3.47Š|
| 143 | S | 37.8 | Very low | 35.2 | Very low | 104 Ų | 104 | 119.9 Ų | 119.9 | 73% | 0.727 | 62% | 0.623 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -131.8 | 5.7 | 179.3 | -60.2 | 0 | 0 | 0 | 0 | 114.9 | K140 I141 | K140-S143 PolarHBondContact O-N 3.44Å; I141-S143 VanDerWaalsContact C-N 3.26Å; I141-S143 PolarHBondContact O-N 3.47Å |
| 144 | S | 38.1 | Very low | 35.4 | Very low | 68 Ų | 68 | 125.6 Ų | 125.6 | 48% | 0.476 | 64% | 0.644 | S | S | . | * | trans | -158.5 | 77.7 | 177.3 | -54 | 0 | 0 | 0 | 0 | 110.9 | K140 I146 | K140-S144 PolarHBondContact O-N 3.04Å; S144-I146 PolarHBondContact O-N 3.17Å | ||
| 145 | N | 30.4 | Very low | 35.6 | Very low | 127 Ų | 127 | 128.9 Ų | 128.9 | 68% | 0.679 | 66% | 0.662 | S | S | * | * | trans | -74.6 | 71.1 | 160.5 | -76.5 | -18.7 | 0 | 0 | 0 | 108.7 | I141 | I141-N145 PolarHBondContact O-OD1 3.48Š| ||
| 146 | I | 32.7 | Very low | 36.1 | Very low | 122 Ų | 122 | 131 Ų | 131 | 63% | 0.626 | 67% | 0.672 | S | S | * | * | trans | -118.1 | 82.4 | 169.3 | -60.4 | 176.8 | 0 | 0 | 0 | 105.7 | S144 I148 | S144-I146 PolarHBondContact O-N 3.17Å; I146-I148 HydrophobicContact CG2-CD1 4.45Å; I146-I148 HydrophobicContact CG2-CG1 3.95Å | ||
| 147 | I | 28.6 | Very low | 36.5 | Very low | 143 Ų | 143 | 134.2 Ų | 134.2 | 73% | 0.733 | 69% | 0.685 | S | S | * | * | trans | -91 | 99 | 167.9 | -57.5 | 178.7 | 0 | 0 | 0 | 105.3 | T149 | I147-T149 VanDerWaalsContact C-N 3.32Å; I147-T149 HydrophobicContact CG2-CG2 3.63Å; I147-T149 PolarHBondContact O-N 3.08Å; I147-T149 VanDerWaalsContact O-N 3.14Å | ||
| 148 | I | 34.5 | Very low | 37.5 | Very low | 131 Ų | 131 | 131 Ų | 131 | 67% | 0.672 | 68% | 0.679 | S | S | * | * | trans | -77.2 | 92.7 | 165.1 | -59.8 | -166.1 | 0 | 0 | 0 | 105.9 | I146 N150 | I146-I148 HydrophobicContact CG2-CD1 4.45Å; I146-I148 HydrophobicContact CG2-CG1 3.95Å; I148-N150 PolarHBondContact O-N 3.36Å | ||
| 149 | T | 37.5 | Very low | 38.6 | Very low | 112 Ų | 112 | 131.4 Ų | 131.4 | 69% | 0.687 | 68% | 0.681 | S | S | * | * | trans | -73.8 | 101.2 | 164.9 | 55.2 | 0 | 0 | 0 | 0 | 107.2 | I147 D151 | I147-T149 VanDerWaalsContact C-N 3.32Å; I147-T149 HydrophobicContact CG2-CG2 3.63Å; I147-T149 PolarHBondContact O-N 3.08Å; I147-T149 VanDerWaalsContact O-N 3.14Å; T149-D151 VanDerWaalsContact C-N 3.27Å; T149-D151 PolarHBondContact O-N 2.91Å; T149-D151 VanDerWaalsContact O-N 3.09Å | ||
| 150 | N | 33.4 | Very low | 39.5 | Very low | 148 Ų | 148 | 127.1 Ų | 127.1 | 79% | 0.791 | 67% | 0.673 | S | S | * | * | trans | -70.9 | 90.6 | 159.8 | -73 | -30.8 | 0 | 0 | 0 | 106.7 | I148 | I148-N150 PolarHBondContact O-N 3.36Š| ||
| 151 | D | 38.3 | Very low | 40.5 | Very low | 140 Ų | 140 | 126 Ų | 126 | 75% | 0.749 | 67% | 0.672 | S | S | * | * | trans | -121.7 | 107.6 | 165 | -148.7 | -3.7 | 0 | 0 | 0 | 107.9 | T149 D153 | T149-D151 VanDerWaalsContact C-N 3.27Å; T149-D151 PolarHBondContact O-N 2.91Å; T149-D151 VanDerWaalsContact O-N 3.09Å; D151-D153 PolarHBondContact O-N 3.28Å | ||
| 152 | Y | 42.1 | Very low | 41.7 | Very low | 219 Ų | 219 | 124 Ų | 124 | 86% | 0.859 | 67% | 0.666 | S | S | * | * | trans | -73.2 | 96.5 | 169.1 | -98 | -102.8 | 0 | 0 | 0 | 105.6 | ||||
| 153 | D | 35.5 | Very low | 43.1 | Very low | 141 Ų | 141 | 120.1 Ų | 120.1 | 75% | 0.754 | 64% | 0.643 | S | S | * | * | trans | -179.4 | 139.4 | 144.7 | -87.8 | -27.6 | 0 | 0 | 0 | 111.5 | D151 | D151-D153 PolarHBondContact O-N 3.28Š| ||
| 154 | H | 44.8 | Very low | 44.2 | Very low | 160 Ų | 160 | 118 Ų | 118 | 74% | 0.741 | 62% | 0.624 | S | S | * | * | trans | 77.6 | 77.6 | 175.2 | -66.3 | -73.7 | 0 | 0 | 0 | 119.8 | I156 | H154-I156 PolarHBondContact O-N 2.93Å; H154-I156 VanDerWaalsContact O-N 3.14Å | ||
| 155 | N | 42.1 | Very low | 45.4 | Very low | 144 Ų | 144 | 118.4 Ų | 118.4 | 77% | 0.77 | 62% | 0.62 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.7 | 26.4 | 179 | -76.6 | -22.5 | 0 | 0 | 0 | 118.2 | ||
| 156 | I | 49.2 | Very low | 47.3 | Very low | 149 Ų | 149 | 116.3 Ų | 116.3 | 76% | 0.764 | 61% | 0.608 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -132.4 | -30.2 | 175.1 | -58.6 | -178.4 | 0 | 0 | 0 | 113.3 | H154 | H154-I156 PolarHBondContact O-N 2.93Å; H154-I156 VanDerWaalsContact O-N 3.14Å |
| 157 | L | 50.3 | Low | 48.9 | Very low | 154 Ų | 154 | 113.6 Ų | 113.6 | 81% | 0.806 | 60% | 0.595 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.3 | -13.5 | 174.1 | -135.9 | 81.5 | 0 | 0 | 0 | 112.9 | ||
| 158 | N | 51.4 | Low | 50.8 | Low | 82 Ų | 82 | 111.7 Ų | 111.7 | 44% | 0.439 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -86.9 | -18.8 | -175.1 | -163.6 | 25.7 | 0 | 0 | 0 | 113.9 | N160 N161 S162 | N158-N160 VanDerWaalsContact C-N 3.28Å; N158-N160 PolarHBondContact O-N 3.39Å; N158-N161 PolarHBondContact O-N 2.97Å; N158-S162 VanDerWaalsContact O-CB 3.22Å; N158-S162 WeakPolarHBondContact O-CB 3.24Å; N158-S162 PolarHBondContact O-N 3.06Å |
| 159 | D | 54.2 | Low | 52.6 | Low | 117 Ų | 117 | 108.3 Ų | 108.3 | 63% | 0.626 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -63.2 | -37.8 | -179.8 | -77.6 | -11.5 | 0 | 0 | 0 | 111.7 | G163 | D159-G163 PolarHBondContact O-N 3.3Å |
| 160 | N | 52.7 | Low | 54.3 | Low | 103 Ų | 103 | 107.6 Ų | 107.6 | 55% | 0.551 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -65.9 | -46.5 | 177.2 | -66.4 | -23.6 | 0 | 0 | 0 | 111.5 | N158 G163 D164 | N158-N160 VanDerWaalsContact C-N 3.28Å; N158-N160 PolarHBondContact O-N 3.39Å; N160-G163 PolarHBondContact O-N 3.49Å; N160-D164 PolarHBondContact O-N 2.92Å; N160-D164 VanDerWaalsContact O-N 3.08Å |
| 161 | N | 54.9 | Low | 55.9 | Low | 86 Ų | 86 | 104.5 Ų | 104.5 | 46% | 0.46 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -69.1 | -41.5 | -179.4 | -168.9 | 30.3 | 0 | 0 | 0 | 112 | N158 G163 D164 I165 | N158-N161 PolarHBondContact O-N 2.97Å; N161-G163 VanDerWaalsContact C-N 3.3Å; N161-G163 PolarHBondContact O-N 3.34Å; N161-D164 WeakPolarHBondContact O-CA 3.33Å; N161-D164 WeakPolarHBondContact O-CB 3.1Å; N161-D164 PolarHBondContact O-N 2.86Å; N161-I165 WeakPolarHBondContact O-CG1 3.33Å; N161-I165 PolarHBondContact O-N 2.88Å |
| 162 | S | 56.3 | Low | 57.5 | Low | 48 Ų | 48 | 100.5 Ų | 100.5 | 34% | 0.336 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -61.5 | -40.5 | 175 | -174.1 | 0 | 0 | 0 | 0 | 111.3 | N158 D164 N166 | N158-S162 VanDerWaalsContact O-CB 3.22Å; N158-S162 WeakPolarHBondContact O-CB 3.24Å; N158-S162 PolarHBondContact O-N 3.06Å; S162-D164 VanDerWaalsContact C-N 3.27Å; S162-D164 PolarHBondContact O-N 3.34Å; S162-N166 WeakPolarHBondContact O-CB 3.34Å; S162-N166 VanDerWaalsContact O-CG 3.24Å; S162-N166 PolarHBondContact O-N 3.46Å; S162-N166 PolarHBondContact O-ND2 2.86Å |
| 163 | G | 60.1 | Low | 58.9 | Low | 25 Ų | 25 | 94.5 Ų | 94.5 | 26% | 0.258 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.2 | -33.6 | 170.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | D159 N160 N161 N167 K310 | D159-G163 PolarHBondContact O-N 3.3Å; N160-G163 PolarHBondContact O-N 3.49Å; N161-G163 VanDerWaalsContact C-N 3.3Å; N161-G163 PolarHBondContact O-N 3.34Å; G163-N167 WeakPolarHBondContact O-CB 3.25Å; G163-N167 VanDerWaalsContact O-CG 3.28Å; G163-N167 PolarHBondContact O-N 2.94Å; G163-N167 VanDerWaalsContact O-N 3.17Å; G163-K310 PolarHBondContact O-NZ 3.48Å |
| 164 | D | 60.9 | Low | 60.7 | Low | 60 Ų | 60 | 91 Ų | 91 | 32% | 0.321 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -74.6 | -44.9 | -177.8 | -85.5 | -42.1 | 0 | 0 | 0 | 110 | N160 N161 S162 N167 N168 K310 | N160-D164 PolarHBondContact O-N 2.92Å; N160-D164 VanDerWaalsContact O-N 3.08Å; N161-D164 WeakPolarHBondContact O-CA 3.33Å; N161-D164 WeakPolarHBondContact O-CB 3.1Å; N161-D164 PolarHBondContact O-N 2.86Å; S162-D164 VanDerWaalsContact C-N 3.27Å; S162-D164 PolarHBondContact O-N 3.34Å; D164-N167 PolarHBondContact O-N 3.49Å; D164-N168 WeakPolarHBondContact O-CB 3.26Å; D164-N168 PolarHBondContact O-N 3.28Å; D164-N168 PolarHBondContact O-ND2 2.86Å; D164-K310 VanDerWaalsContact OD1-CD 3.27Å; D164-K310 WeakPolarHBondContact OD1-CD 3.45Å; D164-K310 WeakPolarHBondContact OD1-CE 3.42Å; D164-K310 IonicContact OD1-NZ 2.61Å; D164-K310 PolarHBondContact OD1-NZ 3.13Å; D164-K310 IonicContact OD2-NZ 3.58Å |
| 165 | I | 62.8 | Low | 62.2 | Low | 76 Ų | 76 | 87.3 Ų | 87.3 | 39% | 0.39 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -60.5 | -48.5 | 174.8 | -65.1 | 164.6 | 0 | 0 | 0 | 110.5 | N161 N167 N168 N169 | N161-I165 WeakPolarHBondContact O-CG1 3.33Å; N161-I165 PolarHBondContact O-N 2.88Å; I165-N167 VanDerWaalsContact C-N 3.34Å; I165-N167 PolarHBondContact O-N 3.37Å; I165-N168 PolarHBondContact O-N 2.92Å; I165-N169 WeakPolarHBondContact O-CB 3.21Å; I165-N169 PolarHBondContact O-N 3.31Å; I165-N169 PolarHBondContact O-ND2 2.9Å; I165-N169 PolarHBondContact O-OD1 3.44Å |
| 166 | N | 70.6 | Confident | 64.2 | Low | 82 Ų | 82 | 85 Ų | 85 | 44% | 0.439 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -62.1 | -40.4 | 179.7 | -74.1 | -25.5 | 0 | 0 | 0 | 112.3 | S162 N169 N170 | S162-N166 WeakPolarHBondContact O-CB 3.34Å; S162-N166 VanDerWaalsContact O-CG 3.24Å; S162-N166 PolarHBondContact O-N 3.46Å; S162-N166 PolarHBondContact O-ND2 2.86Å; N166-N169 PolarHBondContact O-N 3.27Å; N166-N170 WeakPolarHBondContact O-CB 3.14Å; N166-N170 PolarHBondContact O-N 3.47Å; N166-N170 PolarHBondContact O-ND2 3Å; N166-N170 VanDerWaalsContact O-ND2 3.11Å |
| 167 | N | 66.1 | Low | 66 | Low | 65 Ų | 65 | 80.4 Ų | 80.4 | 35% | 0.348 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -67.6 | -40.9 | 175.9 | -76.7 | -8.1 | 0 | 0 | 0 | 112.3 | G163 D164 I165 N169 N170 H171 | G163-N167 WeakPolarHBondContact O-CB 3.25Å; G163-N167 VanDerWaalsContact O-CG 3.28Å; G163-N167 PolarHBondContact O-N 2.94Å; G163-N167 VanDerWaalsContact O-N 3.17Å; D164-N167 PolarHBondContact O-N 3.49Å; I165-N167 VanDerWaalsContact C-N 3.34Å; I165-N167 PolarHBondContact O-N 3.37Å; N167-N169 VanDerWaalsContact C-N 3.32Å; N167-N169 PolarHBondContact O-N 3.36Å; N167-N170 PolarHBondContact O-N 3Å; N167-H171 VanDerWaalsContact O-CB 3.24Å; N167-H171 WeakPolarHBondContact O-CB 3.32Å; N167-H171 PolarHBondContact O-N 3.49Å |
| 168 | N | 69 | Low | 67.9 | Low | 103 Ų | 103 | 75.5 Ų | 75.5 | 55% | 0.551 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -62.5 | -40.6 | 175.3 | -69.8 | -19.8 | 0 | 0 | 0 | 111.3 | D164 I165 H171 A172 | D164-N168 WeakPolarHBondContact O-CB 3.26Å; D164-N168 PolarHBondContact O-N 3.28Å; D164-N168 PolarHBondContact O-ND2 2.86Å; I165-N168 PolarHBondContact O-N 2.92Å; N168-H171 PolarHBondContact O-N 3.24Å; N168-A172 VanDerWaalsContact O-CB 3.23Å; N168-A172 WeakPolarHBondContact O-CB 3.32Å; N168-A172 PolarHBondContact O-N 3.48Å |
| 169 | N | 73 | Confident | 69.8 | Low | 61 Ų | 61 | 73.7 Ų | 73.7 | 33% | 0.326 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -64.9 | -47.6 | 176.1 | -66.1 | -17 | 0 | 0 | 0 | 111.4 | I165 N166 N167 H171 A172 I173 | I165-N169 WeakPolarHBondContact O-CB 3.21Å; I165-N169 PolarHBondContact O-N 3.31Å; I165-N169 PolarHBondContact O-ND2 2.9Å; I165-N169 PolarHBondContact O-OD1 3.44Å; N166-N169 PolarHBondContact O-N 3.27Å; N167-N169 VanDerWaalsContact C-N 3.32Å; N167-N169 PolarHBondContact O-N 3.36Å; N169-H171 VanDerWaalsContact C-N 3.32Å; N169-H171 PolarHBondContact O-N 2.91Å; N169-A172 PolarHBondContact O-N 2.98Å; N169-I173 WeakPolarHBondContact O-CB 3.44Å; N169-I173 WeakPolarHBondContact O-CD1 3.43Å; N169-I173 WeakPolarHBondContact O-CG1 3.33Å; N169-I173 PolarHBondContact O-N 3.33Å |
| 170 | N | 72.6 | Confident | 71.6 | Confident | 97 Ų | 97 | 69 Ų | 69 | 52% | 0.519 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -60.7 | -42.7 | 177 | -69.9 | -27.9 | 0 | 0 | 0 | 111.6 | N166 N167 I173 Q174 | N166-N170 WeakPolarHBondContact O-CB 3.14Å; N166-N170 PolarHBondContact O-N 3.47Å; N166-N170 PolarHBondContact O-ND2 3Å; N166-N170 VanDerWaalsContact O-ND2 3.11Å; N167-N170 PolarHBondContact O-N 3Å; N170-I173 PolarHBondContact O-N 3.24Å; N170-Q174 WeakPolarHBondContact O-CB 3.48Å; N170-Q174 PolarHBondContact O-N 3.2Å |
| 171 | H | 66.1 | Low | 73.6 | Confident | 83 Ų | 83 | 64.1 Ų | 64.1 | 38% | 0.384 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -66.7 | -41.3 | 177.1 | -170.4 | -97.6 | 0 | 0 | 0 | 111.6 | N167 N168 N169 Q174 L175 | N167-H171 VanDerWaalsContact O-CB 3.24Å; N167-H171 WeakPolarHBondContact O-CB 3.32Å; N167-H171 PolarHBondContact O-N 3.49Å; N168-H171 PolarHBondContact O-N 3.24Å; N169-H171 VanDerWaalsContact C-N 3.32Å; N169-H171 PolarHBondContact O-N 2.91Å; H171-Q174 PolarHBondContact O-N 2.99Å; H171-L175 VanDerWaalsContact CE1-CD1 3.48Å; H171-L175 WeakPolarHBondContact CE1-CD1 3.47Å; H171-L175 WeakPolarHBondContact ND1-CD1 3.47Å; H171-L175 WeakPolarHBondContact O-CB 3.44Å; H171-L175 VanDerWaalsContact O-CG 3.28Å; H171-L175 WeakPolarHBondContact O-CG 3.28Å; H171-L175 PolarHBondContact O-N 3.44Å |
| 172 | A | 72.2 | Confident | 75.5 | Confident | 55 Ų | 55 | 62 Ų | 62 | 46% | 0.455 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -62.8 | -44.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112 | N168 N169 Q174 L175 D176 | N168-A172 VanDerWaalsContact O-CB 3.23Å; N168-A172 WeakPolarHBondContact O-CB 3.32Å; N168-A172 PolarHBondContact O-N 3.48Å; N169-A172 PolarHBondContact O-N 2.98Å; A172-Q174 PolarHBondContact O-N 3Å; A172-L175 PolarHBondContact O-N 3.01Å; A172-D176 PolarHBondContact O-N 3.47Å |
| 173 | I | 72 | Confident | 77.4 | Confident | 94 Ų | 94 | 59.8 Ų | 59.8 | 48% | 0.482 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -61.3 | -44.5 | 175.8 | -69.4 | 164.1 | 0 | 0 | 0 | 110.5 | N169 N170 L175 D176 H177 | N169-I173 WeakPolarHBondContact O-CB 3.44Å; N169-I173 WeakPolarHBondContact O-CD1 3.43Å; N169-I173 WeakPolarHBondContact O-CG1 3.33Å; N169-I173 PolarHBondContact O-N 3.33Å; N170-I173 PolarHBondContact O-N 3.24Å; I173-L175 PolarHBondContact O-N 3.14Å; I173-D176 PolarHBondContact O-N 2.99Å; I173-H177 WeakPolarHBondContact CG2-NE2 3.43Å; I173-H177 PolarHBondContact O-CD2 2.81Å; I173-H177 PolarHBondContact O-N 2.89Å; I173-H177 VanDerWaalsContact O-N 3.09Å |
| 174 | Q | 72.7 | Confident | 79.1 | Confident | 68 Ų | 68 | 58.6 Ų | 58.6 | 32% | 0.318 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -64.2 | -41.1 | 178.2 | -176 | 176.1 | 15.7 | 0 | 0 | 112.9 | N170 H171 A172 D176 H177 L178 | N170-Q174 WeakPolarHBondContact O-CB 3.48Å; N170-Q174 PolarHBondContact O-N 3.2Å; H171-Q174 PolarHBondContact O-N 2.99Å; A172-Q174 PolarHBondContact O-N 3Å; Q174-D176 VanDerWaalsContact C-N 3.28Å; Q174-D176 PolarHBondContact O-N 3.01Å; Q174-H177 PolarHBondContact O-N 2.95Å; Q174-L178 WeakPolarHBondContact O-CB 3.23Å; Q174-L178 PolarHBondContact O-N 3.44Å |
| 175 | L | 76.8 | Confident | 80.9 | Confident | 82 Ų | 82 | 55.7 Ų | 55.7 | 43% | 0.429 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -64 | -34 | 175 | -74.7 | 171.3 | 0 | 0 | 0 | 112.1 | H171 A172 I173 L178 T179 | H171-L175 VanDerWaalsContact CE1-CD1 3.48Å; H171-L175 WeakPolarHBondContact CE1-CD1 3.47Å; H171-L175 WeakPolarHBondContact ND1-CD1 3.47Å; H171-L175 WeakPolarHBondContact O-CB 3.44Å; H171-L175 VanDerWaalsContact O-CG 3.28Å; H171-L175 WeakPolarHBondContact O-CG 3.28Å; H171-L175 PolarHBondContact O-N 3.44Å; A172-L175 PolarHBondContact O-N 3.01Å; I173-L175 PolarHBondContact O-N 3.14Å; L175-L178 PolarHBondContact O-N 3.33Å; L175-T179 WeakPolarHBondContact O-CB 3.29Å; L175-T179 PolarHBondContact O-N 3.44Å; L175-T179 PolarHBondContact O-OG1 2.7Å |
| 176 | D | 85.1 | Confident | 82.5 | Confident | 94 Ų | 94 | 52.1 Ų | 52.1 | 50% | 0.503 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -67.4 | -49 | 176.6 | -163.6 | 34.1 | 0 | 0 | 0 | 110.8 | A172 I173 Q174 L178 T179 V180 | A172-D176 PolarHBondContact O-N 3.47Å; I173-D176 PolarHBondContact O-N 2.99Å; Q174-D176 VanDerWaalsContact C-N 3.28Å; Q174-D176 PolarHBondContact O-N 3.01Å; D176-L178 VanDerWaalsContact C-N 3.27Å; D176-L178 PolarHBondContact O-N 2.97Å; D176-T179 WeakPolarHBondContact O-CA 3.36Å; D176-T179 WeakPolarHBondContact O-CB 3.31Å; D176-T179 PolarHBondContact O-N 3.4Å; D176-V180 WeakPolarHBondContact O-CG2 3.48Å; D176-V180 PolarHBondContact O-N 2.9Å |
| 177 | H | 86.6 | Confident | 83.8 | Confident | 53 Ų | 53 | 48.2 Ų | 48.2 | 25% | 0.245 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -60 | -36.8 | 174 | -62.9 | -55.2 | 0 | 0 | 0 | 112.7 | F86 E89 I173 Q174 V180 A181 | F86-H177 AromaticContact CZ-ND1 3.83Å; E89-H177 IonicContact OE2-CE1 3.26Å; E89-H177 IonicContact OE2-ND1 3.13Å; I173-H177 WeakPolarHBondContact CG2-NE2 3.43Å; I173-H177 PolarHBondContact O-CD2 2.81Å; I173-H177 PolarHBondContact O-N 2.89Å; I173-H177 VanDerWaalsContact O-N 3.09Å; Q174-H177 PolarHBondContact O-N 2.95Å; H177-V180 PolarHBondContact O-N 2.93Å; H177-A181 WeakPolarHBondContact O-CB 3.4Å; H177-A181 PolarHBondContact O-N 3.23Å |
| 178 | L | 89.8 | Confident | 85.2 | Confident | 52 Ų | 52 | 45.1 Ų | 45.1 | 27% | 0.272 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -64.9 | -40.8 | 174.6 | -175.1 | 66.7 | 0 | 0 | 0 | 111.7 | Q174 L175 D176 A181 Y182 L240 F300 | Q174-L178 WeakPolarHBondContact O-CB 3.23Å; Q174-L178 PolarHBondContact O-N 3.44Å; L175-L178 PolarHBondContact O-N 3.33Å; D176-L178 VanDerWaalsContact C-N 3.27Å; D176-L178 PolarHBondContact O-N 2.97Å; L178-A181 PolarHBondContact O-N 2.63Å; L178-Y182 WeakPolarHBondContact O-CB 3.3Å; L178-Y182 PolarHBondContact O-N 2.94Å; L178-L240 HydrophobicContact CD1-CD1 3.38Å; L178-L240 HydrophobicContact CD1-CD2 4.38Å; L178-L240 HydrophobicContact CD1-CG 3.88Å; L178-L240 HydrophobicContact CG-CD1 4.16Å; L178-F300 HydrophobicContact CD1-CD1 4.1Å; L178-F300 HydrophobicContact CD1-CE1 3.41Å; L178-F300 VanDerWaalsContact CD1-CE1 3.41Å; L178-F300 HydrophobicContact CD1-CE2 4.11Å; L178-F300 HydrophobicContact CD1-CZ 3.43Å; L178-F300 VanDerWaalsContact CD1-CZ 3.43Å |
| 179 | T | 91.5 | Very high | 86.5 | Confident | 43 Ų | 43 | 40.2 Ų | 40.2 | 26% | 0.264 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -63.6 | -45.6 | 176.4 | -61.1 | 0 | 0 | 0 | 0 | 110.6 | K31 L175 D176 A181 Y182 V183 | K31-T179 HydrophobicContact CD-CG2 4.2Å; L175-T179 WeakPolarHBondContact O-CB 3.29Å; L175-T179 PolarHBondContact O-N 3.44Å; L175-T179 PolarHBondContact O-OG1 2.7Å; D176-T179 WeakPolarHBondContact O-CA 3.36Å; D176-T179 WeakPolarHBondContact O-CB 3.31Å; D176-T179 PolarHBondContact O-N 3.4Å; T179-A181 PolarHBondContact O-N 2.77Å; T179-Y182 PolarHBondContact O-N 2.96Å; T179-V183 HydrophobicContact CG2-CG2 4.31Å; T179-V183 WeakPolarHBondContact O-CB 3.43Å; T179-V183 WeakPolarHBondContact O-CG2 3.45Å; T179-V183 PolarHBondContact O-N 2.74Å |
| 180 | V | 92.9 | Very high | 87.6 | Confident | 18 Ų | 18 | 38.4 Ų | 38.4 | 11% | 0.109 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -60.2 | -45 | 176.5 | 169.8 | 0 | 0 | 0 | 0 | 111.2 | L34 I85 D176 H177 V183 S184 | L34-V180 HydrophobicContact CD2-CB 4.2Å; L34-V180 HydrophobicContact CD2-CG1 3.92Å; L34-V180 HydrophobicContact CD2-CG2 4.28Å; I85-V180 HydrophobicContact CD1-CG1 3.92Å; I85-V180 HydrophobicContact CG2-CG1 3.61Å; D176-V180 WeakPolarHBondContact O-CG2 3.48Å; D176-V180 PolarHBondContact O-N 2.9Å; H177-V180 PolarHBondContact O-N 2.93Å; V180-V183 PolarHBondContact O-N 3.42Å; V180-S184 VanDerWaalsContact O-CB 3.26Å; V180-S184 WeakPolarHBondContact O-CB 3.13Å; V180-S184 PolarHBondContact O-N 3.16Å |
| 181 | A | 94.4 | Very high | 88.7 | Confident | 2 Ų | 2 | 36 Ų | 36 | 2% | 0.017 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -62.1 | -44.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113 | H177 L178 T179 G185 L240 F243 | H177-A181 WeakPolarHBondContact O-CB 3.4Å; H177-A181 PolarHBondContact O-N 3.23Å; L178-A181 PolarHBondContact O-N 2.63Å; T179-A181 PolarHBondContact O-N 2.77Å; A181-G185 PolarHBondContact O-N 3.26Å; A181-L240 HydrophobicContact CB-CD1 4.12Å; A181-F243 VanDerWaalsContact CA-CD1 3.47Å; A181-F243 HydrophobicContact CB-CB 3.42Å; A181-F243 VanDerWaalsContact CB-CB 3.42Å; A181-F243 HydrophobicContact CB-CD1 3.62Å; A181-F243 HydrophobicContact CB-CG 3.74Å |
| 182 | Y | 95.1 | Very high | 90 | Very high | 42 Ų | 42 | 32.1 Ų | 32.1 | 17% | 0.165 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -61 | -50.3 | 176.6 | 165.7 | -103.4 | 0 | 0 | 0 | 111.9 | L20 T24 L178 T179 S184 G185 L186 V236 | L20-Y182 WeakPolarHBondContact CB-OH 3.47Å; L20-Y182 HydrophobicContact CD1-CE2 4.3Å; T24-Y182 HydrophobicContact CG2-CD1 4.37Å; T24-Y182 HydrophobicContact CG2-CE1 3.56Å; T24-Y182 PolarHBondContact OG1-OH 3.35Å; L178-Y182 WeakPolarHBondContact O-CB 3.3Å; L178-Y182 PolarHBondContact O-N 2.94Å; T179-Y182 PolarHBondContact O-N 2.96Å; Y182-S184 VanDerWaalsContact C-N 3.34Å; Y182-S184 PolarHBondContact O-N 2.84Å; Y182-G185 PolarHBondContact O-N 3.23Å; Y182-L186 WeakPolarHBondContact O-CB 3.34Å; Y182-L186 PolarHBondContact O-N 2.71Å; Y182-V236 HydrophobicContact CD2-CG1 3.83Å; Y182-V236 HydrophobicContact CE2-CG1 4.01Å |
| 183 | V | 96 | Very high | 91.1 | Very high | 0 Ų | 0 | 29.5 Ų | 29.5 | 0% | 0 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -64.7 | -40.5 | -178.6 | 174 | 0 | 0 | 0 | 0 | 111 | V25 K31 L34 L35 T179 V180 L186 G187 | V25-V183 HydrophobicContact CG2-CG1 4.5Å; V25-V183 HydrophobicContact CG2-CG2 4.03Å; K31-V183 HydrophobicContact CB-CG1 4.14Å; K31-V183 HydrophobicContact CB-CG2 4.09Å; K31-V183 HydrophobicContact CD-CG2 4.12Å; K31-V183 HydrophobicContact CG-CG2 4.18Å; K31-V183 WeakPolarHBondContact O-CG1 3.47Å; L34-V183 HydrophobicContact CB-CG1 4.06Å; L34-V183 HydrophobicContact CD2-CB 3.91Å; L34-V183 HydrophobicContact CD2-CG1 3.81Å; L34-V183 HydrophobicContact CG-CG1 4.11Å; L35-V183 HydrophobicContact CB-CG1 3.8Å; T179-V183 HydrophobicContact CG2-CG2 4.31Å; T179-V183 WeakPolarHBondContact O-CB 3.43Å; T179-V183 WeakPolarHBondContact O-CG2 3.45Å; T179-V183 PolarHBondContact O-N 2.74Å; V180-V183 PolarHBondContact O-N 3.42Å; V183-L186 PolarHBondContact O-N 3.37Å; V183-G187 PolarHBondContact O-N 3.46Å; V183-G187 VanDerWaalsContact O-N 3.1Å |
| 184 | S | 95.8 | Very high | 92.1 | Very high | 0 Ų | 0 | 28.3 Ų | 28.3 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -58 | -49.3 | 173.1 | 173.8 | 0 | 0 | 0 | 0 | 111.5 | S38 F81 V180 Y182 L186 G187 Y188 F243 | S38-S184 WeakPolarHBondContact CB-O 3.37Å; S38-S184 PolarHBondContact OG-O 2.93Å; F81-S184 WeakPolarHBondContact CD1-OG 3.16Å; F81-S184 VanDerWaalsContact CE1-OG 3.22Å; F81-S184 WeakPolarHBondContact CE1-OG 3.43Å; V180-S184 VanDerWaalsContact O-CB 3.26Å; V180-S184 WeakPolarHBondContact O-CB 3.13Å; V180-S184 PolarHBondContact O-N 3.16Å; Y182-S184 VanDerWaalsContact C-N 3.34Å; Y182-S184 PolarHBondContact O-N 2.84Å; S184-L186 VanDerWaalsContact C-N 3.34Å; S184-L186 PolarHBondContact O-N 3.47Å; S184-G187 PolarHBondContact O-N 3.35Å; S184-Y188 PolarHBondContact O-N 3.03Å; S184-Y188 VanDerWaalsContact O-N 3.16Å; S184-F243 WeakPolarHBondContact OG-CZ 3.41Å |
| 185 | G | 96.9 | Very high | 93.1 | Very high | 0 Ų | 0 | 28.3 Ų | 28.3 | 0% | 0 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -62.5 | -39.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | A181 Y182 G187 Y188 G189 S239 | A181-G185 PolarHBondContact O-N 3.26Å; Y182-G185 PolarHBondContact O-N 3.23Å; G185-G187 VanDerWaalsContact C-N 3.34Å; G185-G187 PolarHBondContact O-N 3.25Å; G185-Y188 PolarHBondContact O-N 3.3Å; G185-G189 PolarHBondContact O-N 3.1Å; G185-S239 WeakPolarHBondContact CA-OG 3.26Å |
| 186 | L | 97.1 | Very high | 93.8 | Very high | 0 Ų | 0 | 27.2 Ų | 27.2 | 0% | 0 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -61.9 | -39.9 | 175.7 | -174.2 | 62.6 | 0 | 0 | 0 | 111.9 | C17 L20 F21 V25 L35 Y182 V183 S184 G189 L190 V236 | C17-L186 HydrophobicContact CB-CD1 4.39Å; L20-L186 HydrophobicContact CB-CD1 3.92Å; L20-L186 HydrophobicContact CB-CD2 4.18Å; L20-L186 HydrophobicContact CD1-CD1 4.29Å; F21-L186 HydrophobicContact CB-CD2 4.29Å; V25-L186 HydrophobicContact CG2-CD2 3.77Å; L35-L186 HydrophobicContact CD1-CB 4.1Å; L35-L186 HydrophobicContact CD1-CD2 3.73Å; L35-L186 HydrophobicContact CD1-CG 3.79Å; Y182-L186 WeakPolarHBondContact O-CB 3.34Å; Y182-L186 PolarHBondContact O-N 2.71Å; V183-L186 PolarHBondContact O-N 3.37Å; S184-L186 VanDerWaalsContact C-N 3.34Å; S184-L186 PolarHBondContact O-N 3.47Å; L186-G189 PolarHBondContact O-N 2.89Å; L186-L190 WeakPolarHBondContact O-CB 3.37Å; L186-L190 PolarHBondContact O-N 3.36Å; L186-V236 HydrophobicContact CD1-CG2 4.28Å |
| 187 | G | 97.2 | Very high | 94 | Very high | 0 Ų | 0 | 23 Ų | 23 | 0% | 0 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -66.7 | -42.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | S38 V183 S184 G185 M191 | S38-G187 WeakPolarHBondContact OG-CA 3.26Å; V183-G187 PolarHBondContact O-N 3.46Å; V183-G187 VanDerWaalsContact O-N 3.1Å; S184-G187 PolarHBondContact O-N 3.35Å; G185-G187 VanDerWaalsContact C-N 3.34Å; G185-G187 PolarHBondContact O-N 3.25Å; G187-M191 PolarHBondContact O-N 3.41Å |
| 188 | Y | 96.5 | Very high | 94.1 | Very high | 0 Ų | 0 | 24.4 Ų | 24.4 | 0% | 0 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -57.5 | -50.5 | 170.9 | -96.8 | -112.7 | 0 | 0 | 0 | 111 | S38 F41 W42 R78 S184 G185 S192 | S38-Y188 VanDerWaalsContact O-CD2 3.3Å; S38-Y188 WeakPolarHBondContact O-CD2 3.3Å; S38-Y188 WeakPolarHBondContact O-CE2 3.34Å; F41-Y188 HydrophobicContact CB-CE2 4.38Å; W42-Y188 HydrophobicContact CB-CD1 3.8Å; W42-Y188 HydrophobicContact CB-CD2 4.18Å; W42-Y188 HydrophobicContact CB-CE1 3.85Å; W42-Y188 HydrophobicContact CB-CE2 4.23Å; W42-Y188 HydrophobicContact CB-CG 3.95Å; W42-Y188 AromaticContact CD1-CD1 3.28Å; W42-Y188 AromaticContact CD1-CE1 3.57Å; W42-Y188 AromaticContact CG-CD1 3.84Å; W42-Y188 HydrophobicContact CG-CD1 3.84Å; W42-Y188 HydrophobicContact CG-CE1 4.11Å; W42-Y188 HydrophobicContact CG-CG 4.26Å; R78-Y188 WeakPolarHBondContact CA-OH 3.39Å; R78-Y188 HydrophobicContact CB-CE1 4.2Å; R78-Y188 PolarHBondContact N-OH 2.77Å; S184-Y188 PolarHBondContact O-N 3.03Å; S184-Y188 VanDerWaalsContact O-N 3.16Å; G185-Y188 PolarHBondContact O-N 3.3Å; Y188-S192 VanDerWaalsContact O-CB 3.25Å; Y188-S192 WeakPolarHBondContact O-CB 3.47Å; Y188-S192 PolarHBondContact O-N 2.84Å; Y188-S192 PolarHBondContact O-OG 3.07Å |
| 189 | G | 96.7 | Very high | 93.9 | Very high | 0 Ų | 0 | 29.3 Ų | 29.3 | 0% | 0 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -60.6 | -47.4 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | G185 L186 S192 C193 S232 | G185-G189 PolarHBondContact O-N 3.1Å; L186-G189 PolarHBondContact O-N 2.89Å; G189-S192 PolarHBondContact O-N 2.8Å; G189-S192 PolarHBondContact O-OG 3.22Å; G189-C193 WeakPolarHBondContact O-CB 3.45Å; G189-C193 PolarHBondContact O-N 2.88Å; G189-S232 WeakPolarHBondContact CA-O 3.35Å; G189-S232 WeakPolarHBondContact O-CB 3.18Å |
| 190 | L | 95.3 | Very high | 93.5 | Very high | 23 Ų | 23 | 28 Ų | 28 | 12% | 0.12 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -63.6 | -49.1 | -179 | -170.9 | 163.3 | 0 | 0 | 0 | 111.4 | C17 L186 S192 C193 I194 | C17-L190 HydrophobicContact CB-CB 4.38Å; L186-L190 WeakPolarHBondContact O-CB 3.37Å; L186-L190 PolarHBondContact O-N 3.36Å; L190-S192 VanDerWaalsContact C-N 3.32Å; L190-S192 PolarHBondContact O-N 3.1Å; L190-C193 WeakPolarHBondContact O-CB 3.25Å; L190-C193 PolarHBondContact O-N 3.05Å; L190-C193 VanDerWaalsContact O-N 3.14Å; L190-I194 HydrophobicContact CD2-CD1 3.4Å; L190-I194 VanDerWaalsContact CD2-CD1 3.4Å; L190-I194 HydrophobicContact CD2-CG1 4.08Å; L190-I194 WeakPolarHBondContact O-CG1 3.24Å; L190-I194 PolarHBondContact O-N 3.41Å |
| 191 | M | 95.4 | Very high | 93.1 | Very high | 47 Ų | 47 | 28.9 Ų | 28.9 | 23% | 0.232 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -65.4 | -38.3 | 177.9 | -69.1 | -57.5 | 156.2 | 0 | 0 | 111.9 | G39 W42 G187 C193 I194 I195 | G39-M191 VanDerWaalsContact CA-CG 3.44Å; W42-M191 HydrophobicContact CD2-CB 4.42Å; W42-M191 HydrophobicContact CE3-CB 3.62Å; W42-M191 HydrophobicContact CZ3-CB 4.13Å; W42-M191 WeakPolarHBondContact CZ3-O 3.35Å; G187-M191 PolarHBondContact O-N 3.41Å; M191-C193 VanDerWaalsContact C-N 3.27Å; M191-C193 PolarHBondContact O-N 2.96Å; M191-I194 PolarHBondContact O-N 3.27Å; M191-I194 HydrophobicContact SD-CD1 4.42Å; M191-I195 WeakPolarHBondContact O-CG1 3.47Å; M191-I195 PolarHBondContact O-N 3.33Å |
| 192 | S | 94 | Very high | 92.6 | Very high | 1 Ų | 1 | 34 Ų | 34 | 1% | 0.007 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -60.4 | -39 | 172.9 | 81.6 | 0 | 0 | 0 | 0 | 112.4 | W42 Y188 G189 L190 Q196 | W42-S192 VanDerWaalsContact CZ2-CB 3.41Å; Y188-S192 VanDerWaalsContact O-CB 3.25Å; Y188-S192 WeakPolarHBondContact O-CB 3.47Å; Y188-S192 PolarHBondContact O-N 2.84Å; Y188-S192 PolarHBondContact O-OG 3.07Å; G189-S192 PolarHBondContact O-N 2.8Å; G189-S192 PolarHBondContact O-OG 3.22Å; L190-S192 VanDerWaalsContact C-N 3.32Å; L190-S192 PolarHBondContact O-N 3.1Å; S192-Q196 VanDerWaalsContact O-CB 3.29Å; S192-Q196 WeakPolarHBondContact O-CB 3.34Å; S192-Q196 WeakPolarHBondContact O-CG 3.45Å; S192-Q196 PolarHBondContact O-N 3.39Å; S192-Q196 PolarHBondContact O-NE2 3.21Å |
| 193 | C | 94.7 | Very high | 91.8 | Very high | 0 Ų | 0 | 34.6 Ų | 34.6 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -66.4 | -48.8 | 178.1 | -167.7 | 0 | 0 | 0 | 0 | 110.7 | V14 G189 L190 M191 I195 Q196 S197 C228 | V14-C193 VanDerWaalsContact CA-SG 3.55Å; V14-C193 WeakPolarHBondContact CG2-SG 3.5Å; G189-C193 WeakPolarHBondContact O-CB 3.45Å; G189-C193 PolarHBondContact O-N 2.88Å; L190-C193 WeakPolarHBondContact O-CB 3.25Å; L190-C193 PolarHBondContact O-N 3.05Å; L190-C193 VanDerWaalsContact O-N 3.14Å; M191-C193 VanDerWaalsContact C-N 3.27Å; M191-C193 PolarHBondContact O-N 2.96Å; C193-I195 PolarHBondContact O-N 3.49Å; C193-Q196 PolarHBondContact O-N 2.92Å; C193-S197 VanDerWaalsContact O-CB 3.28Å; C193-S197 WeakPolarHBondContact O-CB 3.24Å; C193-S197 PolarHBondContact O-N 3.38Å; C193-S197 PolarHBondContact O-OG 2.94Å; C193-S197 VanDerWaalsContact O-OG 3.1Å; C193-C228 PolarHBondContact SG-SG 3.49Å |
| 194 | I | 93.8 | Very high | 90.9 | Very high | 70 Ų | 70 | 34.8 Ų | 34.8 | 36% | 0.359 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -57.8 | -51.4 | 179.2 | -68.7 | 177.5 | 0 | 0 | 0 | 110.9 | L190 M191 Q196 S197 L198 | L190-I194 HydrophobicContact CD2-CD1 3.4Å; L190-I194 VanDerWaalsContact CD2-CD1 3.4Å; L190-I194 HydrophobicContact CD2-CG1 4.08Å; L190-I194 WeakPolarHBondContact O-CG1 3.24Å; L190-I194 PolarHBondContact O-N 3.41Å; M191-I194 PolarHBondContact O-N 3.27Å; M191-I194 HydrophobicContact SD-CD1 4.42Å; I194-Q196 PolarHBondContact O-N 2.86Å; I194-S197 PolarHBondContact O-N 2.92Å; I194-L198 WeakPolarHBondContact O-CG 3.36Å; I194-L198 PolarHBondContact O-N 3.4Å |
| 195 | I | 93.2 | Very high | 89.9 | Confident | 67 Ų | 67 | 41.9 Ų | 41.9 | 34% | 0.344 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -64.9 | -38.7 | -178.2 | -64 | -53.4 | 0 | 0 | 0 | 111.9 | W42 L43 L46 M191 C193 L198 | W42-I195 HydrophobicContact CH2-CB 3.95Å; W42-I195 HydrophobicContact CH2-CG1 4.17Å; W42-I195 HydrophobicContact CH2-CG2 4.31Å; W42-I195 HydrophobicContact CZ3-CB 4.01Å; W42-I195 HydrophobicContact CZ3-CG1 3.69Å; L43-I195 HydrophobicContact CD2-CD1 4.1Å; L43-I195 HydrophobicContact CD2-CG1 3.79Å; L46-I195 HydrophobicContact CD1-CG2 4.08Å; M191-I195 WeakPolarHBondContact O-CG1 3.47Å; M191-I195 PolarHBondContact O-N 3.33Å; C193-I195 PolarHBondContact O-N 3.49Å; I195-L198 HydrophobicContact CD1-CD1 3.92Å; I195-L198 WeakPolarHBondContact O-CB 3.44Å; I195-L198 PolarHBondContact O-N 3.3Å |
| 196 | Q | 90.9 | Very high | 88.5 | Confident | 60 Ų | 60 | 43.3 Ų | 43.3 | 28% | 0.28 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -68.4 | -37.8 | 175.3 | -74.4 | 173.4 | 89.6 | 0 | 0 | 112.2 | S192 C193 I194 L198 R199 | S192-Q196 VanDerWaalsContact O-CB 3.29Å; S192-Q196 WeakPolarHBondContact O-CB 3.34Å; S192-Q196 WeakPolarHBondContact O-CG 3.45Å; S192-Q196 PolarHBondContact O-N 3.39Å; S192-Q196 PolarHBondContact O-NE2 3.21Å; C193-Q196 PolarHBondContact O-N 2.92Å; I194-Q196 PolarHBondContact O-N 2.86Å; Q196-L198 VanDerWaalsContact C-N 3.31Å; Q196-L198 PolarHBondContact O-N 2.92Å; Q196-R199 WeakPolarHBondContact O-CB 3.26Å; Q196-R199 PolarHBondContact O-N 3.47Å |
| 197 | S | 89.8 | Confident | 86.8 | Confident | 4 Ų | 4 | 49.8 Ų | 49.8 | 3% | 0.028 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -66.7 | -31.6 | 175.7 | -72.8 | 0 | 0 | 0 | 0 | 112.9 | C193 I194 R199 I200 L201 | C193-S197 VanDerWaalsContact O-CB 3.28Å; C193-S197 WeakPolarHBondContact O-CB 3.24Å; C193-S197 PolarHBondContact O-N 3.38Å; C193-S197 PolarHBondContact O-OG 2.94Å; C193-S197 VanDerWaalsContact O-OG 3.1Å; I194-S197 PolarHBondContact O-N 2.92Å; S197-R199 PolarHBondContact O-N 2.85Å; S197-I200 WeakPolarHBondContact O-CB 3.28Å; S197-I200 PolarHBondContact O-N 3.34Å; S197-I200 VanDerWaalsContact O-N 3.15Å; S197-L201 WeakPolarHBondContact O-CB 3.38Å; S197-L201 PolarHBondContact O-N 2.98Å |
| 198 | L | 89.7 | Confident | 84.7 | Confident | 83 Ų | 83 | 51.1 Ų | 51.1 | 44% | 0.435 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -57.9 | -38.8 | 172.9 | -71.9 | 176 | 0 | 0 | 0 | 111.7 | I194 I195 Q196 L201 I202 | I194-L198 WeakPolarHBondContact O-CG 3.36Å; I194-L198 PolarHBondContact O-N 3.4Å; I195-L198 HydrophobicContact CD1-CD1 3.92Å; I195-L198 WeakPolarHBondContact O-CB 3.44Å; I195-L198 PolarHBondContact O-N 3.3Å; Q196-L198 VanDerWaalsContact C-N 3.31Å; Q196-L198 PolarHBondContact O-N 2.92Å; L198-L201 PolarHBondContact O-N 3.44Å; L198-I202 WeakPolarHBondContact O-CD1 3.43Å; L198-I202 VanDerWaalsContact O-CG1 3.24Å; L198-I202 WeakPolarHBondContact O-CG1 3.34Å; L198-I202 PolarHBondContact O-N 2.93Å |
| 199 | R | 84.5 | Confident | 82.7 | Confident | 155 Ų | 155 | 54.6 Ų | 54.6 | 59% | 0.585 | 29% | 0.285 | S | S | * | . | H | α-helix | trans | -60.9 | -46.4 | 176.1 | 171.5 | 59.1 | -168.6 | -75.6 | -6.3 | 111.5 | Q196 S197 L201 I202 D203 | Q196-R199 WeakPolarHBondContact O-CB 3.26Å; Q196-R199 PolarHBondContact O-N 3.47Å; S197-R199 PolarHBondContact O-N 2.85Å; R199-L201 VanDerWaalsContact C-N 3.28Å; R199-L201 PolarHBondContact O-N 3.25Å; R199-I202 PolarHBondContact O-N 3.34Å; R199-D203 IonicContact CZ-OD2 2.63Å; R199-D203 IonicContact NE-OD1 2.77Å; R199-D203 PolarHBondContact NE-OD1 2.93Å; R199-D203 IonicContact NE-OD2 3.46Å; R199-D203 PolarHBondContact NE-OD2 3.3Å; R199-D203 IonicContact NH2-OD2 3.8Å; R199-D203 PolarHBondContact NH2-OD2 2.67Å; R199-D203 PolarHBondContact O-N 3.44Å; R199-D203 VanDerWaalsContact O-N 3.08Å |
| 200 | I | 83.4 | Confident | 80.5 | Confident | 15 Ų | 15 | 61.1 Ų | 61.1 | 8% | 0.077 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -61.4 | -41.4 | 177.5 | -59.2 | 173.9 | 0 | 0 | 0 | 110.3 | S197 D203 S204 F221 | S197-I200 WeakPolarHBondContact O-CB 3.28Å; S197-I200 PolarHBondContact O-N 3.34Å; S197-I200 VanDerWaalsContact O-N 3.15Å; I200-D203 PolarHBondContact O-N 2.87Å; I200-S204 PolarHBondContact O-N 2.96Å; I200-F221 HydrophobicContact CG2-CD1 3.57Å; I200-F221 HydrophobicContact CG2-CE1 4.12Å; I200-F221 WeakPolarHBondContact O-CE1 3.39Å |
| 201 | L | 84.6 | Confident | 78.3 | Confident | 37 Ų | 37 | 66.3 Ų | 66.3 | 19% | 0.194 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -66.3 | -43.7 | -179.3 | -171.7 | 66.5 | 0 | 0 | 0 | 111.6 | V7 S197 L198 R199 D203 S204 Y205 | V7-L201 HydrophobicContact CG2-CD1 3.82Å; S197-L201 WeakPolarHBondContact O-CB 3.38Å; S197-L201 PolarHBondContact O-N 2.98Å; L198-L201 PolarHBondContact O-N 3.44Å; R199-L201 VanDerWaalsContact C-N 3.28Å; R199-L201 PolarHBondContact O-N 3.25Å; L201-D203 VanDerWaalsContact C-N 3.35Å; L201-D203 PolarHBondContact O-N 3.49Å; L201-S204 WeakPolarHBondContact O-CA 3.26Å; L201-S204 WeakPolarHBondContact O-CB 3.33Å; L201-S204 PolarHBondContact O-N 3.04Å; L201-S204 VanDerWaalsContact O-N 3.08Å; L201-S204 PolarHBondContact O-OG 3.13Å; L201-Y205 HydrophobicContact CD1-CD2 4.28Å; L201-Y205 HydrophobicContact CD1-CE2 3.71Å; L201-Y205 HydrophobicContact CD2-CE2 3.85Å; L201-Y205 HydrophobicContact CG-CD2 3.87Å; L201-Y205 HydrophobicContact CG-CE2 3.45Å; L201-Y205 VanDerWaalsContact CG-CE2 3.45Å; L201-Y205 WeakPolarHBondContact O-CD2 3.34Å; L201-Y205 PolarHBondContact O-N 3.14Å |
| 202 | I | 84.6 | Confident | 76 | Confident | 111 Ų | 111 | 71.2 Ų | 71.2 | 57% | 0.569 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -59.6 | -46.3 | 175.7 | -69 | 159.9 | 0 | 0 | 0 | 110.7 | L198 R199 S204 Y205 G206 | L198-I202 WeakPolarHBondContact O-CD1 3.43Å; L198-I202 VanDerWaalsContact O-CG1 3.24Å; L198-I202 WeakPolarHBondContact O-CG1 3.34Å; L198-I202 PolarHBondContact O-N 2.93Å; R199-I202 PolarHBondContact O-N 3.34Å; I202-S204 PolarHBondContact O-N 3.06Å; I202-Y205 PolarHBondContact O-N 3.34Å; I202-Y205 VanDerWaalsContact O-N 3.11Å; I202-G206 PolarHBondContact O-N 3.22Å |
| 203 | D | 77.8 | Confident | 73.9 | Confident | 53 Ų | 53 | 77 Ų | 77 | 28% | 0.283 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -64.4 | -23.9 | 178.3 | -68.3 | -13.5 | 0 | 0 | 0 | 111.9 | R199 I200 L201 F221 | R199-D203 IonicContact CZ-OD2 2.63Å; R199-D203 IonicContact NE-OD1 2.77Å; R199-D203 PolarHBondContact NE-OD1 2.93Å; R199-D203 IonicContact NE-OD2 3.46Å; R199-D203 PolarHBondContact NE-OD2 3.3Å; R199-D203 IonicContact NH2-OD2 3.8Å; R199-D203 PolarHBondContact NH2-OD2 2.67Å; R199-D203 PolarHBondContact O-N 3.44Å; R199-D203 VanDerWaalsContact O-N 3.08Å; I200-D203 PolarHBondContact O-N 2.87Å; L201-D203 VanDerWaalsContact C-N 3.35Å; L201-D203 PolarHBondContact O-N 3.49Å; D203-F221 HydrophobicContact CB-CE1 4.3Å; D203-F221 HydrophobicContact CB-CZ 4.36Å |
| 204 | S | 75.7 | Confident | 71.8 | Confident | 4 Ų | 4 | 81.7 Ų | 81.7 | 3% | 0.028 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -82.8 | -25.8 | 175.2 | 82.8 | 0 | 0 | 0 | 0 | 114.4 | I200 L201 I202 | I200-S204 PolarHBondContact O-N 2.96Å; L201-S204 WeakPolarHBondContact O-CA 3.26Å; L201-S204 WeakPolarHBondContact O-CB 3.33Å; L201-S204 PolarHBondContact O-N 3.04Å; L201-S204 VanDerWaalsContact O-N 3.08Å; L201-S204 PolarHBondContact O-OG 3.13Å; I202-S204 PolarHBondContact O-N 3.06Å |
| 205 | Y | 75.8 | Confident | 69.6 | Low | 149 Ų | 149 | 83.2 Ų | 83.2 | 58% | 0.584 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -80.8 | -24.5 | 175.9 | -82.1 | -67.7 | 0 | 0 | 0 | 112.8 | C3 L201 I202 | C3-Y205 HydrophobicContact CB-CD1 4.41Å; C3-Y205 HydrophobicContact CB-CE1 4.1Å; C3-Y205 WeakPolarHBondContact SG-CE1 3.4Å; C3-Y205 VanDerWaalsContact SG-CZ 3.56Å; L201-Y205 HydrophobicContact CD1-CD2 4.28Å; L201-Y205 HydrophobicContact CD1-CE2 3.71Å; L201-Y205 HydrophobicContact CD2-CE2 3.85Å; L201-Y205 HydrophobicContact CG-CD2 3.87Å; L201-Y205 HydrophobicContact CG-CE2 3.45Å; L201-Y205 VanDerWaalsContact CG-CE2 3.45Å; L201-Y205 WeakPolarHBondContact O-CD2 3.34Å; L201-Y205 PolarHBondContact O-N 3.14Å; I202-Y205 PolarHBondContact O-N 3.34Å; I202-Y205 VanDerWaalsContact O-N 3.11Å |
| 206 | G | 67 | Low | 67.8 | Low | 31 Ų | 31 | 83.9 Ų | 83.9 | 32% | 0.32 | 44% | 0.443 | S | S | . | . | S | Bend | trans | -59.2 | 154.8 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | I202 G208 | I202-G206 PolarHBondContact O-N 3.22Å; G206-G208 WeakPolarHBondContact O-CA 3.25Å; G206-G208 PolarHBondContact O-N 3.32Å |
| 207 | P | 61.8 | Low | 66.4 | Low | 135 Ų | 135 | 82.6 Ų | 82.6 | 88% | 0.877 | 44% | 0.441 | S | S | * | . | S | Bend | trans | -54.4 | 107.9 | 170.1 | 24.2 | -31.9 | 0 | 0 | 0 | 106.7 | I209 | P207-I209 PolarHBondContact O-N 3.49Š|
| 208 | G | 53.7 | Low | 65.2 | Low | 28 Ų | 28 | 89.8 Ų | 89.8 | 29% | 0.289 | 47% | 0.467 | S | S | . | . | trans | -49.1 | 128.3 | -157.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | G206 T210 | G206-G208 WeakPolarHBondContact O-CA 3.25Å; G206-G208 PolarHBondContact O-N 3.32Å; G208-T210 VanDerWaalsContact C-N 3.34Å; G208-T210 WeakPolarHBondContact O-CG2 3.49Å; G208-T210 PolarHBondContact O-N 3.4Å | ||
| 209 | I | 53.6 | Low | 64.4 | Low | 73 Ų | 73 | 88.1 Ų | 88.1 | 37% | 0.374 | 46% | 0.461 | S | S | . | . | trans | -35.9 | 93 | -178.3 | 47 | 157.5 | 0 | 0 | 0 | 112 | P207 | P207-I209 PolarHBondContact O-N 3.49Š| ||
| 210 | T | 51.3 | Low | 64 | Low | 137 Ų | 137 | 84.5 Ų | 84.5 | 84% | 0.84 | 45% | 0.449 | S | S | * | . | trans | -81.7 | -11.8 | 172.8 | 49.4 | 0 | 0 | 0 | 0 | 110.6 | G208 Y212 | G208-T210 VanDerWaalsContact C-N 3.34Å; G208-T210 WeakPolarHBondContact O-CG2 3.49Å; G208-T210 PolarHBondContact O-N 3.4Å; T210-Y212 PolarHBondContact O-N 3.45Å | ||
| 211 | I | 48.7 | Very low | 63.8 | Low | 132 Ų | 132 | 84 Ų | 84 | 68% | 0.677 | 45% | 0.447 | S | S | * | . | S | Bend | trans | -83.8 | -11.3 | -165.7 | -154.1 | 65.7 | 0 | 0 | 0 | 114.8 | ||
| 212 | Y | 47.4 | Very low | 63.8 | Low | 151 Ų | 151 | 86.5 Ų | 86.5 | 59% | 0.592 | 46% | 0.46 | S | S | * | . | trans | -112.9 | 84 | 174.8 | -61.5 | -68.1 | 0 | 0 | 0 | 110.5 | T210 T214 | T210-Y212 PolarHBondContact O-N 3.45Å; Y212-T214 PolarHBondContact O-N 2.96Å; Y212-T214 VanDerWaalsContact O-N 3.07Å | ||
| 213 | S | 49.4 | Very low | 63.8 | Low | 121 Ų | 121 | 84.2 Ų | 84.2 | 85% | 0.846 | 45% | 0.446 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.8 | 0.9 | 175.5 | 59.5 | 0 | 0 | 0 | 0 | 114.8 | ||
| 214 | T | 51.9 | Low | 64.1 | Low | 100 Ų | 100 | 82.6 Ų | 82.6 | 61% | 0.613 | 44% | 0.439 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -103 | -26 | -178.1 | 58.7 | 0 | 0 | 0 | 0 | 113.9 | Y212 | Y212-T214 PolarHBondContact O-N 2.96Å; Y212-T214 VanDerWaalsContact O-N 3.07Å |
| 215 | W | 46.7 | Very low | 64.8 | Low | 101 Ų | 101 | 82.4 Ų | 82.4 | 38% | 0.383 | 44% | 0.437 | S | S | . | . | S | Bend | trans | -108.7 | 118.7 | -178.1 | -50.6 | 102 | 0 | 0 | 0 | 107.9 | S217 S275 | W215-S217 VanDerWaalsContact C-N 3.27Å; W215-S217 PolarHBondContact O-N 2.87Å; W215-S275 WeakPolarHBondContact CH2-O 3.33Å; W215-S275 WeakPolarHBondContact CH2-OG 3.28Å; W215-S275 WeakPolarHBondContact CZ3-OG 3.45Å |
| 216 | N | 56.3 | Low | 65.5 | Low | 82 Ų | 82 | 76.9 Ų | 76.9 | 44% | 0.439 | 42% | 0.42 | S | S | . | . | trans | -55.6 | 100.3 | 167.8 | 179 | -2.7 | 0 | 0 | 0 | 106.4 | R218 T219 | N216-R218 PolarHBondContact ND2-NH2 3.19Å; N216-R218 CarbonylContact O-C 3.59Å; N216-R218 PolarHBondContact O-N 2.57Å; N216-R218 WeakPolarHBondContact OD1-CB 3.36Å; N216-R218 WeakPolarHBondContact OD1-CG 3.41Å; N216-R218 PolarHBondContact OD1-NE 3.2Å; N216-T219 PolarHBondContact O-N 3.33Å; N216-T219 PolarHBondContact O-OG1 2.88Å | ||
| 217 | S | 61.4 | Low | 66.6 | Low | 32 Ų | 32 | 76.3 Ų | 76.3 | 22% | 0.224 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -43.2 | -33.1 | -170.8 | 51.7 | 0 | 0 | 0 | 0 | 112.8 | W215 T219 F220 F221 | W215-S217 VanDerWaalsContact C-N 3.27Å; W215-S217 PolarHBondContact O-N 2.87Å; S217-T219 PolarHBondContact O-N 2.9Å; S217-F220 PolarHBondContact O-N 3.42Å; S217-F221 VanDerWaalsContact O-CD2 3.26Å; S217-F221 WeakPolarHBondContact O-CD2 3.48Å; S217-F221 PolarHBondContact O-N 2.91Å |
| 218 | R | 64.1 | Low | 68 | Low | 155 Ų | 155 | 70 Ų | 70 | 59% | 0.585 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -49 | -43.2 | 172.5 | -62.5 | -174.8 | -79.4 | -173.6 | -2.9 | 115.3 | M1 N216 L222 | M1-R218 HydrophobicContact CE-CG 4.28Å; M1-R218 HydrophobicContact CG-CG 4.36Å; M1-R218 VanDerWaalsContact SD-CA 3.58Å; M1-R218 HydrophobicContact SD-CB 4.45Å; M1-R218 HydrophobicContact SD-CG 4.21Å; N216-R218 PolarHBondContact ND2-NH2 3.19Å; N216-R218 CarbonylContact O-C 3.59Å; N216-R218 PolarHBondContact O-N 2.57Å; N216-R218 WeakPolarHBondContact OD1-CB 3.36Å; N216-R218 WeakPolarHBondContact OD1-CG 3.41Å; N216-R218 PolarHBondContact OD1-NE 3.2Å; R218-L222 PolarHBondContact O-N 2.73Å |
| 219 | T | 73 | Confident | 69.9 | Low | 49 Ų | 49 | 70.9 Ų | 70.9 | 30% | 0.301 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -72.4 | -37.4 | -177.2 | 59.8 | 0 | 0 | 0 | 0 | 111.6 | N216 S217 F221 L222 F223 | N216-T219 PolarHBondContact O-N 3.33Å; N216-T219 PolarHBondContact O-OG1 2.88Å; S217-T219 PolarHBondContact O-N 2.9Å; T219-F221 PolarHBondContact O-N 3.49Å; T219-L222 PolarHBondContact O-N 3.34Å; T219-F223 WeakPolarHBondContact O-CD2 3.39Å; T219-F223 WeakPolarHBondContact O-CG 3.27Å; T219-F223 PolarHBondContact O-N 3.43Å |
| 220 | F | 75.1 | Confident | 71.8 | Confident | 78 Ų | 78 | 67.4 Ų | 67.4 | 34% | 0.342 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -59.4 | -44.2 | 178.5 | 176.9 | -99 | 0 | 0 | 0 | 112.7 | S217 S224 | S217-F220 PolarHBondContact O-N 3.42Å; F220-S224 WeakPolarHBondContact O-CB 3.13Å; F220-S224 PolarHBondContact O-N 3.05Å; F220-S224 PolarHBondContact O-OG 2.81Å |
| 221 | F | 81 | Confident | 73.8 | Confident | 5 Ų | 5 | 61.9 Ų | 61.9 | 2% | 0.022 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -65.6 | -38.1 | 177.1 | -76.1 | -91.6 | 0 | 0 | 0 | 112.1 | M1 I200 D203 S217 T219 S225 | M1-F221 HydrophobicContact CE-CB 4.46Å; M1-F221 HydrophobicContact CG-CD2 4.26Å; M1-F221 HydrophobicContact CG-CE2 4.31Å; M1-F221 HydrophobicContact SD-CB 3.95Å; M1-F221 HydrophobicContact SD-CD2 3.16Å; M1-F221 WeakPolarHBondContact SD-CD2 3.34Å; M1-F221 HydrophobicContact SD-CE2 3.76Å; M1-F221 HydrophobicContact SD-CG 3.66Å; I200-F221 HydrophobicContact CG2-CD1 3.57Å; I200-F221 HydrophobicContact CG2-CE1 4.12Å; I200-F221 WeakPolarHBondContact O-CE1 3.39Å; D203-F221 HydrophobicContact CB-CE1 4.3Å; D203-F221 HydrophobicContact CB-CZ 4.36Å; S217-F221 VanDerWaalsContact O-CD2 3.26Å; S217-F221 WeakPolarHBondContact O-CD2 3.48Å; S217-F221 PolarHBondContact O-N 2.91Å; T219-F221 PolarHBondContact O-N 3.49Å; F221-S225 WeakPolarHBondContact O-CB 3.27Å; F221-S225 PolarHBondContact O-N 2.92Å; F221-S225 PolarHBondContact O-OG 3.18Å |
| 222 | L | 83.4 | Confident | 76 | Confident | 90 Ų | 90 | 55.6 Ų | 55.6 | 47% | 0.471 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -66.8 | -46.1 | 176.8 | -73.7 | 174.1 | 0 | 0 | 0 | 112.1 | I12 R218 T219 S224 S225 C226 | I12-L222 HydrophobicContact CD1-CD2 4.26Å; R218-L222 PolarHBondContact O-N 2.73Å; T219-L222 PolarHBondContact O-N 3.34Å; L222-S224 VanDerWaalsContact C-N 3.33Å; L222-S224 PolarHBondContact O-N 2.85Å; L222-S225 WeakPolarHBondContact O-CB 3.39Å; L222-S225 PolarHBondContact O-N 2.86Å; L222-S225 VanDerWaalsContact O-N 3.17Å; L222-C226 PolarHBondContact O-N 3.35Å |
| 223 | F | 84.7 | Confident | 78.2 | Confident | 62 Ų | 62 | 49.4 Ų | 49.4 | 27% | 0.272 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -63 | -40.3 | 176.5 | -68.3 | -54.3 | 0 | 0 | 0 | 111.9 | T219 S225 C226 Q227 E279 C282 | T219-F223 WeakPolarHBondContact O-CD2 3.39Å; T219-F223 WeakPolarHBondContact O-CG 3.27Å; T219-F223 PolarHBondContact O-N 3.43Å; F223-S225 VanDerWaalsContact C-N 3.29Å; F223-S225 PolarHBondContact O-N 3.44Å; F223-C226 PolarHBondContact O-N 2.95Å; F223-Q227 WeakPolarHBondContact O-CB 3.33Å; F223-Q227 PolarHBondContact O-N 3.11Å; F223-E279 HydrophobicContact CD2-CG 4.09Å; F223-E279 HydrophobicContact CE1-CG 4.39Å; F223-E279 HydrophobicContact CE2-CG 3.57Å; F223-E279 HydrophobicContact CZ-CB 4.46Å; F223-E279 HydrophobicContact CZ-CG 3.75Å; F223-C282 HydrophobicContact CD1-CB 4.41Å |
| 224 | S | 85.1 | Confident | 80.4 | Confident | 19 Ų | 19 | 43.7 Ų | 43.7 | 13% | 0.133 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -61.5 | -37.7 | 174.3 | -59.4 | 0 | 0 | 0 | 0 | 112.2 | F220 L222 Q227 C228 | F220-S224 WeakPolarHBondContact O-CB 3.13Å; F220-S224 PolarHBondContact O-N 3.05Å; F220-S224 PolarHBondContact O-OG 2.81Å; L222-S224 VanDerWaalsContact C-N 3.33Å; L222-S224 PolarHBondContact O-N 2.85Å; S224-Q227 PolarHBondContact O-N 3.38Å; S224-C228 WeakPolarHBondContact O-CB 3.36Å; S224-C228 PolarHBondContact O-N 3.48Å |
| 225 | S | 89.4 | Confident | 82.5 | Confident | 0 Ų | 0 | 39.1 Ų | 39.1 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -69.3 | -41.5 | 177.2 | -55.1 | 0 | 0 | 0 | 0 | 112 | C9 F221 L222 F223 Q227 C228 M229 | C9-S225 WeakPolarHBondContact CB-OG 3.31Å; C9-S225 WeakPolarHBondContact O-CB 3.2Å; C9-S225 PolarHBondContact O-OG 2.75Å; C9-S225 VanDerWaalsContact O-OG 3.1Å; F221-S225 WeakPolarHBondContact O-CB 3.27Å; F221-S225 PolarHBondContact O-N 2.92Å; F221-S225 PolarHBondContact O-OG 3.18Å; L222-S225 WeakPolarHBondContact O-CB 3.39Å; L222-S225 PolarHBondContact O-N 2.86Å; L222-S225 VanDerWaalsContact O-N 3.17Å; F223-S225 VanDerWaalsContact C-N 3.29Å; F223-S225 PolarHBondContact O-N 3.44Å; S225-Q227 VanDerWaalsContact C-N 3.34Å; S225-C228 WeakPolarHBondContact O-CB 3.48Å; S225-C228 PolarHBondContact O-N 3.32Å; S225-M229 WeakPolarHBondContact O-CB 3.15Å; S225-M229 PolarHBondContact O-N 2.97Å |
| 226 | C | 90.4 | Very high | 84.8 | Confident | 33 Ų | 33 | 34.4 Ų | 34.4 | 22% | 0.223 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -62.2 | -42.1 | 173.1 | -172.4 | 0 | 0 | 0 | 0 | 111.2 | L222 F223 C228 M229 C230 C282 | L222-C226 PolarHBondContact O-N 3.35Å; F223-C226 PolarHBondContact O-N 2.95Å; C226-C228 PolarHBondContact O-N 3.01Å; C226-M229 WeakPolarHBondContact O-CB 3.25Å; C226-M229 PolarHBondContact O-N 3.43Å; C226-C230 PolarHBondContact O-N 3.14Å; C226-C230 PolarHBondContact O-SG 3.48Å; C226-C282 VanDerWaalsContact CB-SG 3.6Å |
| 227 | Q | 89.6 | Confident | 86.7 | Confident | 20 Ų | 20 | 32.7 Ų | 32.7 | 9% | 0.093 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -60.1 | -44.6 | 174.1 | -174.7 | -176.8 | -35.4 | 0 | 0 | 111.8 | F223 S224 S225 M229 C230 I231 N271 Y285 | F223-Q227 WeakPolarHBondContact O-CB 3.33Å; F223-Q227 PolarHBondContact O-N 3.11Å; S224-Q227 PolarHBondContact O-N 3.38Å; S225-Q227 VanDerWaalsContact C-N 3.34Å; Q227-M229 VanDerWaalsContact C-N 3.34Å; Q227-M229 PolarHBondContact O-N 3Å; Q227-C230 PolarHBondContact O-N 2.97Å; Q227-I231 PolarHBondContact O-N 3.34Å; Q227-N271 PolarHBondContact OE1-ND2 3.34Å; Q227-Y285 HydrophobicContact CG-CD1 3.68Å; Q227-Y285 HydrophobicContact CG-CE1 3.55Å; Q227-Y285 HydrophobicContact CG-CG 4.46Å |
| 228 | C | 91.6 | Very high | 88.3 | Confident | 3 Ų | 3 | 31.2 Ų | 31.2 | 2% | 0.02 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -60.4 | -43.6 | 176.5 | -171.6 | 0 | 0 | 0 | 0 | 111.7 | C193 S224 S225 C226 C230 S232 | C193-C228 PolarHBondContact SG-SG 3.49Å; S224-C228 WeakPolarHBondContact O-CB 3.36Å; S224-C228 PolarHBondContact O-N 3.48Å; S225-C228 WeakPolarHBondContact O-CB 3.48Å; S225-C228 PolarHBondContact O-N 3.32Å; C226-C228 PolarHBondContact O-N 3.01Å; C228-C230 PolarHBondContact O-N 3.43Å; C228-S232 VanDerWaalsContact O-CB 3.31Å; C228-S232 WeakPolarHBondContact O-CB 3.5Å; C228-S232 PolarHBondContact O-N 2.85Å; C228-S232 PolarHBondContact O-OG 3.26Å |
| 229 | M | 93.2 | Very high | 89.8 | Confident | 46 Ų | 46 | 23.8 Ų | 23.8 | 23% | 0.227 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -59.7 | -45 | 173.8 | -174 | -175.2 | 72.2 | 0 | 0 | 111.7 | P16 S225 C226 Q227 S232 M233 M286 | P16-M229 HydrophobicContact CB-CG 4.45Å; P16-M229 HydrophobicContact CG-CG 3.66Å; P16-M229 HydrophobicContact CG-SD 3.72Å; S225-M229 WeakPolarHBondContact O-CB 3.15Å; S225-M229 PolarHBondContact O-N 2.97Å; C226-M229 WeakPolarHBondContact O-CB 3.25Å; C226-M229 PolarHBondContact O-N 3.43Å; Q227-M229 VanDerWaalsContact C-N 3.34Å; Q227-M229 PolarHBondContact O-N 3Å; M229-S232 PolarHBondContact O-OG 2.9Å; M229-M233 WeakPolarHBondContact O-CB 3.47Å; M229-M233 WeakPolarHBondContact O-CG 3.44Å; M229-M233 PolarHBondContact O-N 3.29Å; M229-M233 VanDerWaalsContact O-N 3.11Å; M229-M286 HydrophobicContact CE-SD 4.29Å |
| 230 | C | 94 | Very high | 90.8 | Very high | 0 Ų | 0 | 22.3 Ų | 22.3 | 0% | 0 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -64.6 | -51.1 | -179.8 | -66.4 | 0 | 0 | 0 | 0 | 112.3 | C226 Q227 C228 S232 M233 L234 Y285 M286 L289 | C226-C230 PolarHBondContact O-N 3.14Å; C226-C230 PolarHBondContact O-SG 3.48Å; Q227-C230 PolarHBondContact O-N 2.97Å; C228-C230 PolarHBondContact O-N 3.43Å; C230-S232 VanDerWaalsContact C-N 3.35Å; C230-S232 PolarHBondContact O-N 3.38Å; C230-M233 PolarHBondContact O-N 2.85Å; C230-L234 WeakPolarHBondContact O-CB 3.49Å; C230-L234 VanDerWaalsContact O-CG 3.31Å; C230-L234 WeakPolarHBondContact O-CG 3.46Å; C230-L234 PolarHBondContact O-N 3.25Å; C230-Y285 HydrophobicContact CB-CD1 4.35Å; C230-M286 PolarHBondContact SG-SD 3.36Å; C230-L289 HydrophobicContact CB-CD1 4.3Å |
| 231 | I | 93.6 | Very high | 91.7 | Very high | 20 Ų | 20 | 18.7 Ų | 18.7 | 10% | 0.103 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -62.5 | -44.1 | -179.4 | -73.7 | -55.9 | 0 | 0 | 0 | 110.8 | Q227 M233 L234 Q235 L264 Y285 | Q227-I231 PolarHBondContact O-N 3.34Å; I231-M233 PolarHBondContact O-N 2.87Å; I231-L234 HydrophobicContact CD1-CD1 4.17Å; I231-L234 WeakPolarHBondContact O-CB 3.35Å; I231-L234 PolarHBondContact O-N 3.39Å; I231-Q235 HydrophobicContact CG2-CG 4.39Å; I231-Q235 VanDerWaalsContact O-CG 3.31Å; I231-Q235 WeakPolarHBondContact O-CG 3.32Å; I231-Q235 PolarHBondContact O-N 3.07Å; I231-L264 HydrophobicContact CD1-CB 4.49Å; I231-L264 HydrophobicContact CD1-CD1 4.31Å; I231-Y285 HydrophobicContact CD1-CD1 3.51Å; I231-Y285 HydrophobicContact CD1-CE1 3.27Å; I231-Y285 HydrophobicContact CG1-CD1 3.58Å; I231-Y285 HydrophobicContact CG1-CE1 3.33Å |
| 232 | S | 94.6 | Very high | 92.4 | Very high | 0 Ų | 0 | 18.4 Ų | 18.4 | 0% | 0 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -61.7 | -42.7 | 179.9 | 61.2 | 0 | 0 | 0 | 0 | 112.2 | C17 G189 C228 M229 C230 Q235 V236 | C17-S232 VanDerWaalsContact SG-CB 3.59Å; G189-S232 WeakPolarHBondContact CA-O 3.35Å; G189-S232 WeakPolarHBondContact O-CB 3.18Å; C228-S232 VanDerWaalsContact O-CB 3.31Å; C228-S232 WeakPolarHBondContact O-CB 3.5Å; C228-S232 PolarHBondContact O-N 2.85Å; C228-S232 PolarHBondContact O-OG 3.26Å; M229-S232 PolarHBondContact O-OG 2.9Å; C230-S232 VanDerWaalsContact C-N 3.35Å; C230-S232 PolarHBondContact O-N 3.38Å; S232-Q235 WeakPolarHBondContact O-CB 3.31Å; S232-Q235 PolarHBondContact O-N 3.35Å; S232-V236 WeakPolarHBondContact O-CG2 3.44Å; S232-V236 PolarHBondContact O-N 3.18Å |
| 233 | M | 94.1 | Very high | 93 | Very high | 22 Ų | 22 | 14.4 Ų | 14.4 | 11% | 0.108 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -66.1 | -39.7 | 172.9 | -73.8 | -63.2 | 103.3 | 0 | 0 | 112.8 | P16 C17 L20 M229 C230 I231 Q235 V236 F237 L289 | P16-M233 HydrophobicContact CB-CE 3.92Å; P16-M233 HydrophobicContact CB-CG 4.34Å; P16-M233 HydrophobicContact CB-SD 4.07Å; C17-M233 HydrophobicContact CB-CE 4.3Å; C17-M233 WeakPolarHBondContact SG-CE 3.45Å; L20-M233 HydrophobicContact CD1-CE 3.99Å; L20-M233 HydrophobicContact CD1-SD 4.03Å; M229-M233 WeakPolarHBondContact O-CB 3.47Å; M229-M233 WeakPolarHBondContact O-CG 3.44Å; M229-M233 PolarHBondContact O-N 3.29Å; M229-M233 VanDerWaalsContact O-N 3.11Å; C230-M233 PolarHBondContact O-N 2.85Å; I231-M233 PolarHBondContact O-N 2.87Å; M233-Q235 VanDerWaalsContact C-N 3.3Å; M233-Q235 PolarHBondContact O-N 3.07Å; M233-V236 HydrophobicContact CE-CG2 4.29Å; M233-V236 WeakPolarHBondContact O-CB 3.5Å; M233-V236 PolarHBondContact O-N 2.87Å; M233-F237 VanDerWaalsContact O-CD2 3.24Å; M233-F237 WeakPolarHBondContact O-CD2 3.31Å; M233-F237 PolarHBondContact O-N 3.39Å; M233-F237 VanDerWaalsContact O-N 3.1Å; M233-L289 HydrophobicContact CB-CD1 3.57Å; M233-L289 HydrophobicContact CG-CD1 4.24Å |
| 234 | L | 95.7 | Very high | 93.2 | Very high | 1 Ų | 1 | 12.3 Ų | 12.3 | 1% | 0.005 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -60.7 | -38.6 | 174.9 | -80.9 | 163.3 | 0 | 0 | 0 | 111.8 | C230 I231 V236 F237 W238 L264 C288 L289 M292 | C230-L234 WeakPolarHBondContact O-CB 3.49Å; C230-L234 VanDerWaalsContact O-CG 3.31Å; C230-L234 WeakPolarHBondContact O-CG 3.46Å; C230-L234 PolarHBondContact O-N 3.25Å; I231-L234 HydrophobicContact CD1-CD1 4.17Å; I231-L234 WeakPolarHBondContact O-CB 3.35Å; I231-L234 PolarHBondContact O-N 3.39Å; L234-V236 PolarHBondContact O-N 2.96Å; L234-F237 PolarHBondContact O-N 3.47Å; L234-W238 HydrophobicContact CB-CD2 4.34Å; L234-W238 HydrophobicContact CB-CE3 4.42Å; L234-W238 HydrophobicContact CB-CH2 4.34Å; L234-W238 HydrophobicContact CB-CZ2 4.29Å; L234-W238 HydrophobicContact CB-CZ3 4.41Å; L234-W238 HydrophobicContact CD2-CZ2 4.31Å; L234-W238 VanDerWaalsContact O-CB 3.25Å; L234-W238 WeakPolarHBondContact O-CB 3.43Å; L234-W238 PolarHBondContact O-N 3.36Å; L234-L264 HydrophobicContact CD1-CD1 3.48Å; L234-L264 VanDerWaalsContact CD1-CD1 3.48Å; L234-C288 HydrophobicContact CD1-CB 4.49Å; L234-L289 HydrophobicContact CD2-CB 4.46Å; L234-L289 HydrophobicContact CG-CB 4.26Å; L234-M292 HydrophobicContact CD2-CB 3.96Å; L234-M292 HydrophobicContact CD2-CG 3.57Å |
| 235 | Q | 95.4 | Very high | 93.5 | Very high | 3 Ų | 3 | 11.4 Ų | 11.4 | 1% | 0.014 | 6% | 0.06 | C | C | . | . | H | α-helix | trans | -59 | -37 | 173.4 | -67.4 | -67.2 | -8 | 0 | 0 | 112 | I231 S232 M233 S239 | I231-Q235 HydrophobicContact CG2-CG 4.39Å; I231-Q235 VanDerWaalsContact O-CG 3.31Å; I231-Q235 WeakPolarHBondContact O-CG 3.32Å; I231-Q235 PolarHBondContact O-N 3.07Å; S232-Q235 WeakPolarHBondContact O-CB 3.31Å; S232-Q235 PolarHBondContact O-N 3.35Å; M233-Q235 VanDerWaalsContact C-N 3.3Å; M233-Q235 PolarHBondContact O-N 3.07Å; Q235-S239 WeakPolarHBondContact O-CB 3.5Å; Q235-S239 PolarHBondContact O-N 2.97Å; Q235-S239 PolarHBondContact O-OG 3.16Å |
| 236 | V | 96 | Very high | 93.7 | Very high | 3 Ų | 3 | 12.7 Ų | 12.7 | 2% | 0.018 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -63.8 | -54.3 | 174.8 | -172.9 | 0 | 0 | 0 | 0 | 110.6 | Y182 L186 S232 M233 L234 W238 S239 L240 | Y182-V236 HydrophobicContact CD2-CG1 3.83Å; Y182-V236 HydrophobicContact CE2-CG1 4.01Å; L186-V236 HydrophobicContact CD1-CG2 4.28Å; S232-V236 WeakPolarHBondContact O-CG2 3.44Å; S232-V236 PolarHBondContact O-N 3.18Å; M233-V236 HydrophobicContact CE-CG2 4.29Å; M233-V236 WeakPolarHBondContact O-CB 3.5Å; M233-V236 PolarHBondContact O-N 2.87Å; L234-V236 PolarHBondContact O-N 2.96Å; V236-W238 PolarHBondContact O-N 3.32Å; V236-S239 PolarHBondContact O-N 2.94Å; V236-L240 WeakPolarHBondContact O-CB 3.2Å; V236-L240 PolarHBondContact O-N 3.45Å |
| 237 | F | 95.7 | Very high | 93.6 | Very high | 45 Ų | 45 | 14.5 Ų | 14.5 | 20% | 0.197 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -66.7 | -37.9 | -177.5 | -71.4 | -67.5 | 0 | 0 | 0 | 113 | M233 L234 L240 I241 M292 I293 A296 | M233-F237 VanDerWaalsContact O-CD2 3.24Å; M233-F237 WeakPolarHBondContact O-CD2 3.31Å; M233-F237 PolarHBondContact O-N 3.39Å; M233-F237 VanDerWaalsContact O-N 3.1Å; L234-F237 PolarHBondContact O-N 3.47Å; F237-L240 HydrophobicContact CD1-CD2 4.41Å; F237-L240 WeakPolarHBondContact O-CB 3.37Å; F237-L240 PolarHBondContact O-N 3.46Å; F237-I241 WeakPolarHBondContact O-CD1 3.37Å; F237-I241 WeakPolarHBondContact O-CG1 3.48Å; F237-I241 PolarHBondContact O-N 3Å; F237-M292 HydrophobicContact CB-CB 4.42Å; F237-I293 HydrophobicContact CD2-CG1 3.98Å; F237-I293 HydrophobicContact CE1-CG1 4.14Å; F237-I293 HydrophobicContact CE2-CD1 3.91Å; F237-I293 HydrophobicContact CE2-CG1 3.42Å; F237-I293 VanDerWaalsContact CE2-CG1 3.42Å; F237-I293 HydrophobicContact CZ-CD1 4.13Å; F237-I293 HydrophobicContact CZ-CG1 3.53Å; F237-A296 HydrophobicContact CD1-CB 4.08Å |
| 238 | W | 95.7 | Very high | 93.5 | Very high | 1 Ų | 1 | 18 Ų | 18 | 0% | 0.004 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -61.7 | -44.9 | 173.8 | -72.6 | -21.1 | 0 | 0 | 0 | 111.9 | L234 V236 L240 I241 L242 V257 M260 H261 L264 | L234-W238 HydrophobicContact CB-CD2 4.34Å; L234-W238 HydrophobicContact CB-CE3 4.42Å; L234-W238 HydrophobicContact CB-CH2 4.34Å; L234-W238 HydrophobicContact CB-CZ2 4.29Å; L234-W238 HydrophobicContact CB-CZ3 4.41Å; L234-W238 HydrophobicContact CD2-CZ2 4.31Å; L234-W238 VanDerWaalsContact O-CB 3.25Å; L234-W238 WeakPolarHBondContact O-CB 3.43Å; L234-W238 PolarHBondContact O-N 3.36Å; V236-W238 PolarHBondContact O-N 3.32Å; W238-L240 VanDerWaalsContact C-N 3.34Å; W238-L240 PolarHBondContact O-N 3.21Å; W238-I241 PolarHBondContact O-N 3.34Å; W238-L242 VanDerWaalsContact O-CB 3.25Å; W238-L242 WeakPolarHBondContact O-CB 3.45Å; W238-L242 VanDerWaalsContact O-CG 3.24Å; W238-L242 WeakPolarHBondContact O-CG 3.36Å; W238-L242 PolarHBondContact O-N 2.87Å; W238-V257 HydrophobicContact CB-CG1 3.64Å; W238-V257 HydrophobicContact CD2-CG1 4.31Å; W238-V257 HydrophobicContact CG-CG1 3.58Å; W238-M260 HydrophobicContact CZ2-CB 4.14Å; W238-H261 HydrophobicContact CE3-CB 4.22Å; W238-H261 HydrophobicContact CH2-CB 3.82Å; W238-H261 AromaticContact CH2-CD2 3.65Å; W238-H261 AromaticContact CH2-CG 3.89Å; W238-H261 HydrophobicContact CZ2-CB 4.22Å; W238-H261 HydrophobicContact CZ3-CB 3.83Å; W238-H261 AromaticContact CZ3-CD2 3.27Å; W238-H261 WeakPolarHBondContact CZ3-CD2 3.37Å; W238-H261 AromaticContact CZ3-CG 3.48Å; W238-H261 VanDerWaalsContact CZ3-CG 3.48Å; W238-H261 AromaticContact CZ3-NE2 3.82Å; W238-L264 HydrophobicContact CH2-CB 4.42Å; W238-L264 HydrophobicContact CH2-CD1 3.82Å; W238-L264 HydrophobicContact CZ2-CD1 3.7Å |
| 239 | S | 95.6 | Very high | 93.4 | Very high | 0 Ų | 0 | 26.8 Ų | 26.8 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -64.8 | -40.3 | 176.9 | -57.5 | 0 | 0 | 0 | 0 | 111.7 | R78 G185 Q235 V236 I241 L242 F243 | R78-S239 PolarHBondContact NE-OG 3.46Å; G185-S239 WeakPolarHBondContact CA-OG 3.26Å; Q235-S239 WeakPolarHBondContact O-CB 3.5Å; Q235-S239 PolarHBondContact O-N 2.97Å; Q235-S239 PolarHBondContact O-OG 3.16Å; V236-S239 PolarHBondContact O-N 2.94Å; S239-I241 PolarHBondContact O-N 3.18Å; S239-L242 PolarHBondContact O-N 3.4Å; S239-F243 WeakPolarHBondContact O-CB 3.45Å; S239-F243 WeakPolarHBondContact O-CD2 3.48Å; S239-F243 PolarHBondContact O-N 3.43Å |
| 240 | L | 94.1 | Very high | 93.3 | Very high | 18 Ų | 18 | 26 Ų | 26 | 9% | 0.094 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -57.7 | -47.5 | 175.9 | -164.6 | 71 | 0 | 0 | 0 | 112.1 | L178 A181 V236 F237 W238 S244 F300 | L178-L240 HydrophobicContact CD1-CD1 3.38Å; L178-L240 HydrophobicContact CD1-CD2 4.38Å; L178-L240 HydrophobicContact CD1-CG 3.88Å; L178-L240 HydrophobicContact CG-CD1 4.16Å; A181-L240 HydrophobicContact CB-CD1 4.12Å; V236-L240 WeakPolarHBondContact O-CB 3.2Å; V236-L240 PolarHBondContact O-N 3.45Å; F237-L240 HydrophobicContact CD1-CD2 4.41Å; F237-L240 WeakPolarHBondContact O-CB 3.37Å; F237-L240 PolarHBondContact O-N 3.46Å; W238-L240 VanDerWaalsContact C-N 3.34Å; W238-L240 PolarHBondContact O-N 3.21Å; L240-S244 WeakPolarHBondContact O-CB 3.49Å; L240-S244 PolarHBondContact O-N 3.47Å; L240-F300 HydrophobicContact CD2-CD2 4.42Å; L240-F300 HydrophobicContact CD2-CE2 3.54Å; L240-F300 HydrophobicContact CD2-CZ 4.08Å; L240-F300 HydrophobicContact CG-CE2 3.84Å; L240-F300 HydrophobicContact CG-CZ 3.85Å |
| 241 | I | 94 | Very high | 93.2 | Very high | 1 Ų | 1 | 33.3 Ų | 33.3 | 1% | 0.005 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -72.8 | -42.4 | -179.3 | -67.8 | 161 | 0 | 0 | 0 | 111 | F237 W238 S239 S244 A245 Q253 V257 M292 F295 A296 | F237-I241 WeakPolarHBondContact O-CD1 3.37Å; F237-I241 WeakPolarHBondContact O-CG1 3.48Å; F237-I241 PolarHBondContact O-N 3Å; W238-I241 PolarHBondContact O-N 3.34Å; S239-I241 PolarHBondContact O-N 3.18Å; I241-S244 PolarHBondContact O-N 3.34Å; I241-A245 VanDerWaalsContact O-CB 3.24Å; I241-A245 WeakPolarHBondContact O-CB 3.44Å; I241-A245 PolarHBondContact O-N 3.34Å; I241-Q253 HydrophobicContact CG2-CB 4.19Å; I241-V257 HydrophobicContact CB-CG2 4.26Å; I241-V257 HydrophobicContact CG2-CG2 3.81Å; I241-M292 HydrophobicContact CD1-CE 3.15Å; I241-F295 HydrophobicContact CD1-CD1 3.85Å; I241-F295 HydrophobicContact CD1-CE1 4.25Å; I241-F295 HydrophobicContact CG2-CE1 4.33Å; I241-A296 HydrophobicContact CD1-CB 4.26Å |
| 242 | L | 95.4 | Very high | 93.2 | Very high | 0 Ų | 0 | 35.1 Ų | 35.1 | 0% | 0 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -63.8 | -45.5 | -179.3 | -79.1 | 168.7 | 0 | 0 | 0 | 112.1 | E75 W238 S239 S244 A245 F246 I254 V257 Y258 | E75-L242 WeakPolarHBondContact OE2-CD1 3.43Å; W238-L242 VanDerWaalsContact O-CB 3.25Å; W238-L242 WeakPolarHBondContact O-CB 3.45Å; W238-L242 VanDerWaalsContact O-CG 3.24Å; W238-L242 WeakPolarHBondContact O-CG 3.36Å; W238-L242 PolarHBondContact O-N 2.87Å; S239-L242 PolarHBondContact O-N 3.4Å; L242-S244 VanDerWaalsContact C-N 3.33Å; L242-S244 PolarHBondContact O-N 2.89Å; L242-A245 CarbonylContact O-C 3.56Å; L242-A245 PolarHBondContact O-N 3.27Å; L242-A245 VanDerWaalsContact O-N 3.14Å; L242-F246 HydrophobicContact CB-CE2 3.99Å; L242-F246 HydrophobicContact CB-CZ 4.18Å; L242-F246 HydrophobicContact CD2-CE1 4.35Å; L242-F246 HydrophobicContact CD2-CZ 4.05Å; L242-F246 WeakPolarHBondContact O-CD2 3.35Å; L242-F246 WeakPolarHBondContact O-CG 3.46Å; L242-F246 PolarHBondContact O-N 2.89Å; L242-I254 HydrophobicContact CD2-CB 4.37Å; L242-I254 HydrophobicContact CD2-CG1 4.43Å; L242-I254 HydrophobicContact CD2-CG2 4.08Å; L242-V257 HydrophobicContact CD1-CG1 3.66Å; L242-V257 HydrophobicContact CD2-CB 4.05Å; L242-V257 HydrophobicContact CD2-CG1 4.11Å; L242-V257 HydrophobicContact CG-CB 4.11Å; L242-V257 HydrophobicContact CG-CG1 3.74Å; L242-V257 HydrophobicContact CG-CG2 4.41Å; L242-Y258 HydrophobicContact CD1-CE1 3.99Å; L242-Y258 HydrophobicContact CD2-CD1 4.21Å; L242-Y258 HydrophobicContact CD2-CE1 3.68Å |
| 243 | F | 94.5 | Very high | 93.1 | Very high | 6 Ų | 6 | 36.6 Ų | 36.6 | 3% | 0.026 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -62.9 | -43.9 | 179.3 | -83.2 | -140.7 | 0 | 0 | 0 | 110.8 | R78 F81 F82 I85 A181 S184 S239 A245 F246 V247 | R78-F243 HydrophobicContact CG-CE2 4.06Å; F81-F243 HydrophobicContact CD1-CZ 4.15Å; F82-F243 HydrophobicContact CB-CD2 4.38Å; F82-F243 HydrophobicContact CB-CE1 4.39Å; F82-F243 HydrophobicContact CB-CE2 3.91Å; F82-F243 HydrophobicContact CB-CZ 3.91Å; F82-F243 HydrophobicContact CD2-CB 4.33Å; F82-F243 AromaticContact CD2-CD1 3.9Å; F82-F243 HydrophobicContact CD2-CD1 3.9Å; F82-F243 HydrophobicContact CD2-CD2 4.16Å; F82-F243 HydrophobicContact CD2-CE1 4.2Å; F82-F243 HydrophobicContact CD2-CE2 4.42Å; F82-F243 AromaticContact CD2-CG 3.87Å; F82-F243 HydrophobicContact CD2-CG 3.87Å; F82-F243 HydrophobicContact CD2-CZ 4.44Å; I85-F243 HydrophobicContact CD1-CE1 3.71Å; I85-F243 HydrophobicContact CD1-CZ 4.13Å; A181-F243 VanDerWaalsContact CA-CD1 3.47Å; A181-F243 HydrophobicContact CB-CB 3.42Å; A181-F243 VanDerWaalsContact CB-CB 3.42Å; A181-F243 HydrophobicContact CB-CD1 3.62Å; A181-F243 HydrophobicContact CB-CG 3.74Å; S184-F243 WeakPolarHBondContact OG-CZ 3.41Å; S239-F243 WeakPolarHBondContact O-CB 3.45Å; S239-F243 WeakPolarHBondContact O-CD2 3.48Å; S239-F243 PolarHBondContact O-N 3.43Å; F243-A245 VanDerWaalsContact C-N 3.31Å; F243-A245 PolarHBondContact O-N 3.18Å; F243-F246 HydrophobicContact CD2-CD2 4.47Å; F243-F246 PolarHBondContact O-N 3.39Å; F243-V247 WeakPolarHBondContact O-CG2 3.37Å; F243-V247 PolarHBondContact O-N 3.14Å; F243-V247 VanDerWaalsContact O-N 3.12Å |
| 244 | S | 89.9 | Confident | 93.1 | Very high | 17 Ų | 17 | 36.6 Ų | 36.6 | 12% | 0.119 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -59.2 | -42.2 | 173.2 | -176.3 | 0 | 0 | 0 | 0 | 112 | L240 I241 L242 Q248 | L240-S244 WeakPolarHBondContact O-CB 3.49Å; L240-S244 PolarHBondContact O-N 3.47Å; I241-S244 PolarHBondContact O-N 3.34Å; L242-S244 VanDerWaalsContact C-N 3.33Å; L242-S244 PolarHBondContact O-N 2.89Å; S244-Q248 WeakPolarHBondContact O-CB 3.49Å; S244-Q248 WeakPolarHBondContact O-CG 3.48Å; S244-Q248 PolarHBondContact O-N 3.45Å; S244-Q248 PolarHBondContact OG-NE2 3.35Å |
| 245 | A | 91.8 | Very high | 93.1 | Very high | 0 Ų | 0 | 42.1 Ų | 42.1 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -70.6 | -34.1 | 179 | 0 | 0 | 0 | 0 | 0 | 113.2 | I241 L242 F243 R249 A250 Q253 I254 | I241-A245 VanDerWaalsContact O-CB 3.24Å; I241-A245 WeakPolarHBondContact O-CB 3.44Å; I241-A245 PolarHBondContact O-N 3.34Å; L242-A245 CarbonylContact O-C 3.56Å; L242-A245 PolarHBondContact O-N 3.27Å; L242-A245 VanDerWaalsContact O-N 3.14Å; F243-A245 VanDerWaalsContact C-N 3.31Å; F243-A245 PolarHBondContact O-N 3.18Å; A245-R249 CarbonylContact O-C 3.55Å; A245-R249 VanDerWaalsContact O-CA 3.27Å; A245-R249 WeakPolarHBondContact O-CA 3.42Å; A245-R249 PolarHBondContact O-N 2.94Å; A245-A250 HydrophobicContact CB-CB 4.47Å; A245-A250 PolarHBondContact O-N 3.03Å; A245-Q253 HydrophobicContact CB-CB 3.84Å; A245-I254 HydrophobicContact CB-CD1 4.42Å; A245-I254 HydrophobicContact CB-CG1 3.71Å |
| 246 | F | 92.8 | Very high | 93.1 | Very high | 28 Ų | 28 | 44.6 Ų | 44.6 | 12% | 0.123 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -66.3 | -42.6 | 174.7 | -65.1 | -35.2 | 0 | 0 | 0 | 111.5 | F79 F82 L242 F243 R249 I254 | F79-F246 HydrophobicContact CB-CE2 4.43Å; F79-F246 HydrophobicContact CB-CZ 4.25Å; F79-F246 HydrophobicContact CD2-CD1 4.25Å; F79-F246 HydrophobicContact CD2-CD2 4.21Å; F79-F246 AromaticContact CD2-CE1 3.99Å; F79-F246 HydrophobicContact CD2-CE1 3.99Å; F79-F246 AromaticContact CD2-CE2 3.95Å; F79-F246 HydrophobicContact CD2-CE2 3.95Å; F79-F246 HydrophobicContact CD2-CG 4.37Å; F79-F246 AromaticContact CD2-CZ 3.84Å; F79-F246 HydrophobicContact CD2-CZ 3.84Å; F79-F246 HydrophobicContact CE2-CD1 4.49Å; F79-F246 HydrophobicContact CG-CZ 4.5Å; F82-F246 HydrophobicContact CB-CD2 4.19Å; F82-F246 HydrophobicContact CB-CE2 4.48Å; F82-F246 HydrophobicContact CD1-CB 4.19Å; F82-F246 AromaticContact CD1-CD2 3.96Å; F82-F246 HydrophobicContact CD1-CD2 3.96Å; F82-F246 HydrophobicContact CD1-CG 4.35Å; F82-F246 HydrophobicContact CD2-CB 4.31Å; F82-F246 AromaticContact CD2-CD2 3.93Å; F82-F246 HydrophobicContact CD2-CD2 3.93Å; F82-F246 HydrophobicContact CE1-CB 3.7Å; F82-F246 HydrophobicContact CE1-CD2 4.34Å; F82-F246 HydrophobicContact CE1-CG 4.33Å; F82-F246 HydrophobicContact CE2-CB 3.79Å; F82-F246 HydrophobicContact CE2-CD2 4.27Å; F82-F246 HydrophobicContact CG-CB 4.48Å; F82-F246 AromaticContact CG-CD2 3.75Å; F82-F246 HydrophobicContact CG-CD2 3.75Å; F82-F246 HydrophobicContact CG-CE2 4.49Å; F82-F246 HydrophobicContact CZ-CB 3.48Å; F82-F246 VanDerWaalsContact CZ-CB 3.48Å; F82-F246 HydrophobicContact CZ-CD2 4.49Å; F82-F246 HydrophobicContact CZ-CG 4.44Å; L242-F246 HydrophobicContact CB-CE2 3.99Å; L242-F246 HydrophobicContact CB-CZ 4.18Å; L242-F246 HydrophobicContact CD2-CE1 4.35Å; L242-F246 HydrophobicContact CD2-CZ 4.05Å; L242-F246 WeakPolarHBondContact O-CD2 3.35Å; L242-F246 WeakPolarHBondContact O-CG 3.46Å; L242-F246 PolarHBondContact O-N 2.89Å; F243-F246 HydrophobicContact CD2-CD2 4.47Å; F243-F246 PolarHBondContact O-N 3.39Å; F246-R249 PolarHBondContact O-N 3.28Å; F246-I254 HydrophobicContact CD1-CD1 3.68Å; F246-I254 HydrophobicContact CD1-CG1 4.23Å; F246-I254 HydrophobicContact CE1-CD1 3.86Å; F246-I254 HydrophobicContact CE1-CG1 4.15Å; F246-I254 HydrophobicContact CE1-CG2 4.19Å |
| 247 | V | 89.3 | Confident | 93 | Very high | 71 Ų | 71 | 44.4 Ų | 44.4 | 43% | 0.43 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -63.9 | -47.1 | 175.9 | 174.9 | 0 | 0 | 0 | 0 | 110.9 | F82 F86 F243 R249 | F82-V247 HydrophobicContact CE2-CG2 3.96Å; F82-V247 HydrophobicContact CZ-CG2 4.07Å; F86-V247 HydrophobicContact CE1-CG2 4.12Å; F86-V247 HydrophobicContact CE2-CG2 4.26Å; F86-V247 HydrophobicContact CZ-CG2 3.48Å; F86-V247 VanDerWaalsContact CZ-CG2 3.48Å; F243-V247 WeakPolarHBondContact O-CG2 3.37Å; F243-V247 PolarHBondContact O-N 3.14Å; F243-V247 VanDerWaalsContact O-N 3.12Å; V247-R249 VanDerWaalsContact C-N 3.3Å; V247-R249 PolarHBondContact O-N 3.05Å |
| 248 | Q | 87.4 | Confident | 93 | Very high | 92 Ų | 92 | 45.3 Ų | 45.3 | 43% | 0.43 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -85.4 | -1 | -175.8 | -63.5 | 179.8 | 45.8 | 0 | 0 | 113.8 | S244 A250 | S244-Q248 WeakPolarHBondContact O-CB 3.49Å; S244-Q248 WeakPolarHBondContact O-CG 3.48Å; S244-Q248 PolarHBondContact O-N 3.45Å; S244-Q248 PolarHBondContact OG-NE2 3.35Å; Q248-A250 PolarHBondContact O-N 3.04Å |
| 249 | R | 89.4 | Confident | 92.9 | Very high | 188 Ų | 188 | 52.6 Ų | 52.6 | 71% | 0.709 | 26% | 0.259 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.2 | 33.6 | -173.9 | -55.9 | -174.2 | 179.3 | -170.5 | 0.2 | 113.7 | A245 F246 V247 Y251 | A245-R249 CarbonylContact O-C 3.55Å; A245-R249 VanDerWaalsContact O-CA 3.27Å; A245-R249 WeakPolarHBondContact O-CA 3.42Å; A245-R249 PolarHBondContact O-N 2.94Å; F246-R249 PolarHBondContact O-N 3.28Å; V247-R249 VanDerWaalsContact C-N 3.3Å; V247-R249 PolarHBondContact O-N 3.05Å; R249-Y251 HydrophobicContact CB-CE2 4.41Å; R249-Y251 VanDerWaalsContact O-CD2 3.25Å; R249-Y251 WeakPolarHBondContact O-CD2 3.36Å; R249-Y251 WeakPolarHBondContact O-CE2 3.21Å; R249-Y251 PolarHBondContact O-N 3.2Å |
| 250 | A | 89.7 | Confident | 92.8 | Very high | 29 Ų | 29 | 55.9 Ų | 55.9 | 24% | 0.24 | 28% | 0.275 | C | S | . | . | trans | -82 | 80.2 | -179.5 | 0 | 0 | 0 | 0 | 0 | 110.7 | A245 Q248 G252 Q253 | A245-A250 HydrophobicContact CB-CB 4.47Å; A245-A250 PolarHBondContact O-N 3.03Å; Q248-A250 PolarHBondContact O-N 3.04Å; A250-G252 PolarHBondContact O-N 2.94Å; A250-G252 VanDerWaalsContact O-N 3.13Å; A250-Q253 PolarHBondContact O-N 3.3Å | ||
| 251 | Y | 93.1 | Very high | 92.8 | Very high | 155 Ų | 155 | 55.6 Ų | 55.6 | 61% | 0.608 | 27% | 0.274 | S | S | * | . | H | α-helix | trans | -55.6 | -32.8 | -174.5 | -60.9 | -73.8 | 0 | 0 | 0 | 114.3 | R249 Q253 I254 I255 | R249-Y251 HydrophobicContact CB-CE2 4.41Å; R249-Y251 VanDerWaalsContact O-CD2 3.25Å; R249-Y251 WeakPolarHBondContact O-CD2 3.36Å; R249-Y251 WeakPolarHBondContact O-CE2 3.21Å; R249-Y251 PolarHBondContact O-N 3.2Å; Y251-Q253 VanDerWaalsContact C-N 3.29Å; Y251-Q253 PolarHBondContact O-N 3Å; Y251-I254 HydrophobicContact CD1-CD1 4.34Å; Y251-I254 PolarHBondContact O-N 2.89Å; Y251-I255 WeakPolarHBondContact O-CG1 3.47Å; Y251-I255 PolarHBondContact O-N 3.49Å |
| 252 | G | 93.2 | Very high | 92.8 | Very high | 57 Ų | 57 | 58.6 Ų | 58.6 | 59% | 0.588 | 29% | 0.286 | S | S | * | . | H | α-helix | trans | -59.5 | -36.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | A250 L256 | A250-G252 PolarHBondContact O-N 2.94Å; A250-G252 VanDerWaalsContact O-N 3.13Å; G252-L256 WeakPolarHBondContact O-CB 3.29Å; G252-L256 PolarHBondContact O-N 2.96Å; G252-L256 VanDerWaalsContact O-N 3.12Å |
| 253 | Q | 92.5 | Very high | 92.5 | Very high | 32 Ų | 32 | 60.5 Ų | 60.5 | 15% | 0.15 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -73.8 | -35 | 178.6 | -68.1 | 176.2 | 10.3 | 0 | 0 | 111.7 | I241 A245 A250 Y251 L256 V257 F295 | I241-Q253 HydrophobicContact CG2-CB 4.19Å; A245-Q253 HydrophobicContact CB-CB 3.84Å; A250-Q253 PolarHBondContact O-N 3.3Å; Y251-Q253 VanDerWaalsContact C-N 3.29Å; Y251-Q253 PolarHBondContact O-N 3Å; Q253-L256 PolarHBondContact O-N 3.46Å; Q253-V257 WeakPolarHBondContact O-CG2 3.46Å; Q253-V257 PolarHBondContact O-N 3.29Å; Q253-V257 VanDerWaalsContact O-N 3.09Å; Q253-F295 HydrophobicContact CG-CZ 4.25Å |
| 254 | I | 94.5 | Very high | 92.4 | Very high | 21 Ų | 21 | 60.6 Ų | 60.6 | 11% | 0.108 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -63.6 | -49.5 | 176.3 | -56.5 | 173.1 | 0 | 0 | 0 | 109.8 | L242 A245 F246 Y251 L256 V257 Y258 | L242-I254 HydrophobicContact CD2-CB 4.37Å; L242-I254 HydrophobicContact CD2-CG1 4.43Å; L242-I254 HydrophobicContact CD2-CG2 4.08Å; A245-I254 HydrophobicContact CB-CD1 4.42Å; A245-I254 HydrophobicContact CB-CG1 3.71Å; F246-I254 HydrophobicContact CD1-CD1 3.68Å; F246-I254 HydrophobicContact CD1-CG1 4.23Å; F246-I254 HydrophobicContact CE1-CD1 3.86Å; F246-I254 HydrophobicContact CE1-CG1 4.15Å; F246-I254 HydrophobicContact CE1-CG2 4.19Å; Y251-I254 HydrophobicContact CD1-CD1 4.34Å; Y251-I254 PolarHBondContact O-N 2.89Å; I254-L256 VanDerWaalsContact C-N 3.35Å; I254-L256 PolarHBondContact O-N 2.89Å; I254-V257 PolarHBondContact O-N 2.95Å; I254-Y258 HydrophobicContact CG2-CD2 4.08Å; I254-Y258 HydrophobicContact CG2-CE1 4.31Å; I254-Y258 HydrophobicContact CG2-CE2 3.66Å; I254-Y258 PolarHBondContact O-N 3.03Å |
| 255 | I | 95.4 | Very high | 92.4 | Very high | 117 Ų | 117 | 60.5 Ų | 60.5 | 60% | 0.6 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -60.9 | -43.8 | 179.4 | -65 | 165.9 | 0 | 0 | 0 | 110.9 | Y251 Y258 F259 | Y251-I255 WeakPolarHBondContact O-CG1 3.47Å; Y251-I255 PolarHBondContact O-N 3.49Å; I255-Y258 PolarHBondContact O-N 3.4Å; I255-F259 VanDerWaalsContact O-CB 3.32Å; I255-F259 WeakPolarHBondContact O-CB 3.36Å; I255-F259 PolarHBondContact O-N 3.37Å |
| 256 | L | 94.4 | Very high | 92.2 | Very high | 55 Ų | 55 | 61.9 Ų | 61.9 | 29% | 0.288 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -56.4 | -53.2 | 176.8 | -172.6 | -178.7 | 0 | 0 | 0 | 111.1 | G252 Q253 I254 Y258 F259 M260 M292 F295 | G252-L256 WeakPolarHBondContact O-CB 3.29Å; G252-L256 PolarHBondContact O-N 2.96Å; G252-L256 VanDerWaalsContact O-N 3.12Å; Q253-L256 PolarHBondContact O-N 3.46Å; I254-L256 VanDerWaalsContact C-N 3.35Å; I254-L256 PolarHBondContact O-N 2.89Å; L256-Y258 PolarHBondContact O-N 3.29Å; L256-F259 PolarHBondContact O-N 3.08Å; L256-M260 HydrophobicContact CD2-CG 3.68Å; L256-M260 WeakPolarHBondContact O-CG 3.48Å; L256-M260 PolarHBondContact O-N 2.97Å; L256-M292 HydrophobicContact CD2-SD 4.33Å; L256-F295 HydrophobicContact CD1-CE1 4.21Å; L256-F295 HydrophobicContact CD1-CE2 4.33Å; L256-F295 HydrophobicContact CD1-CZ 3.99Å |
| 257 | V | 95.3 | Very high | 91.8 | Very high | 0 Ų | 0 | 62.3 Ų | 62.3 | 0% | 0 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -63.2 | -43.1 | -176.1 | 171.9 | 0 | 0 | 0 | 0 | 111.2 | W238 I241 L242 Q253 I254 M260 H261 M292 | W238-V257 HydrophobicContact CB-CG1 3.64Å; W238-V257 HydrophobicContact CD2-CG1 4.31Å; W238-V257 HydrophobicContact CG-CG1 3.58Å; I241-V257 HydrophobicContact CB-CG2 4.26Å; I241-V257 HydrophobicContact CG2-CG2 3.81Å; L242-V257 HydrophobicContact CD1-CG1 3.66Å; L242-V257 HydrophobicContact CD2-CB 4.05Å; L242-V257 HydrophobicContact CD2-CG1 4.11Å; L242-V257 HydrophobicContact CG-CB 4.11Å; L242-V257 HydrophobicContact CG-CG1 3.74Å; L242-V257 HydrophobicContact CG-CG2 4.41Å; Q253-V257 WeakPolarHBondContact O-CG2 3.46Å; Q253-V257 PolarHBondContact O-N 3.29Å; Q253-V257 VanDerWaalsContact O-N 3.09Å; I254-V257 PolarHBondContact O-N 2.95Å; V257-M260 PolarHBondContact O-N 3.2Å; V257-H261 PolarHBondContact O-N 3.22Å; V257-M292 HydrophobicContact CG2-CE 4.47Å |
| 258 | Y | 95.1 | Very high | 91.5 | Very high | 64 Ų | 64 | 61.1 Ų | 61.1 | 25% | 0.251 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -63.1 | -44.5 | 177 | -69.6 | -4 | 0 | 0 | 0 | 111.5 | E75 L242 I254 I255 L256 M260 H261 F262 | E75-Y258 HydrophobicContact CB-CD1 4.35Å; E75-Y258 HydrophobicContact CB-CE1 3.84Å; E75-Y258 HydrophobicContact CG-CD1 3.85Å; E75-Y258 HydrophobicContact CG-CE1 3.77Å; E75-Y258 WeakPolarHBondContact OE2-CE1 3.37Å; L242-Y258 HydrophobicContact CD1-CE1 3.99Å; L242-Y258 HydrophobicContact CD2-CD1 4.21Å; L242-Y258 HydrophobicContact CD2-CE1 3.68Å; I254-Y258 HydrophobicContact CG2-CD2 4.08Å; I254-Y258 HydrophobicContact CG2-CE1 4.31Å; I254-Y258 HydrophobicContact CG2-CE2 3.66Å; I254-Y258 PolarHBondContact O-N 3.03Å; I255-Y258 PolarHBondContact O-N 3.4Å; L256-Y258 PolarHBondContact O-N 3.29Å; Y258-M260 VanDerWaalsContact C-N 3.32Å; Y258-M260 PolarHBondContact O-N 3.17Å; Y258-H261 PolarHBondContact O-N 3.35Å; Y258-F262 WeakPolarHBondContact O-CD2 3.49Å; Y258-F262 PolarHBondContact O-N 2.94Å |
| 259 | F | 94.2 | Very high | 91 | Very high | 154 Ų | 154 | 58.6 Ų | 58.6 | 68% | 0.675 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -59.2 | -43.7 | 175.9 | -178.3 | -99.9 | 0 | 0 | 0 | 111.9 | I255 L256 G263 | I255-F259 VanDerWaalsContact O-CB 3.32Å; I255-F259 WeakPolarHBondContact O-CB 3.36Å; I255-F259 PolarHBondContact O-N 3.37Å; L256-F259 PolarHBondContact O-N 3.08Å; F259-G263 PolarHBondContact O-N 3.14Å |
| 260 | M | 93.3 | Very high | 90.2 | Very high | 69 Ų | 69 | 53 Ų | 53 | 34% | 0.34 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -65.3 | -39 | 176.4 | -75.8 | -66.8 | -171.6 | 0 | 0 | 112.6 | W238 L256 V257 Y258 G263 L264 | W238-M260 HydrophobicContact CZ2-CB 4.14Å; L256-M260 HydrophobicContact CD2-CG 3.68Å; L256-M260 WeakPolarHBondContact O-CG 3.48Å; L256-M260 PolarHBondContact O-N 2.97Å; V257-M260 PolarHBondContact O-N 3.2Å; Y258-M260 VanDerWaalsContact C-N 3.32Å; Y258-M260 PolarHBondContact O-N 3.17Å; M260-G263 PolarHBondContact O-N 3.26Å; M260-L264 WeakPolarHBondContact O-CB 3.48Å; M260-L264 WeakPolarHBondContact O-CG 3Å; M260-L264 PolarHBondContact O-N 3.09Å |
| 261 | H | 94.6 | Very high | 89.3 | Confident | 12 Ų | 12 | 53.2 Ų | 53.2 | 6% | 0.056 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -67.2 | -45.8 | 177.8 | -167.6 | -174.7 | 0 | 0 | 0 | 111.5 | V71 E75 W238 V257 Y258 G263 A265 | V71-H261 HydrophobicContact CG1-CB 4.26Å; E75-H261 IonicContact OE1-CE1 3.5Å; E75-H261 PolarHBondContact OE1-CE1 3.02Å; E75-H261 VanDerWaalsContact OE1-CE1 3.26Å; E75-H261 IonicContact OE1-CG 3.84Å; E75-H261 IonicContact OE1-ND1 3.51Å; E75-H261 PolarHBondContact OE1-ND1 3.27Å; W238-H261 HydrophobicContact CE3-CB 4.22Å; W238-H261 HydrophobicContact CH2-CB 3.82Å; W238-H261 AromaticContact CH2-CD2 3.65Å; W238-H261 AromaticContact CH2-CG 3.89Å; W238-H261 HydrophobicContact CZ2-CB 4.22Å; W238-H261 HydrophobicContact CZ3-CB 3.83Å; W238-H261 AromaticContact CZ3-CD2 3.27Å; W238-H261 WeakPolarHBondContact CZ3-CD2 3.37Å; W238-H261 AromaticContact CZ3-CG 3.48Å; W238-H261 VanDerWaalsContact CZ3-CG 3.48Å; W238-H261 AromaticContact CZ3-NE2 3.82Å; V257-H261 PolarHBondContact O-N 3.22Å; Y258-H261 PolarHBondContact O-N 3.35Å; H261-G263 PolarHBondContact O-N 2.89Å; H261-A265 WeakPolarHBondContact O-CB 3.29Å; H261-A265 PolarHBondContact O-N 3.48Å |
| 262 | F | 92.4 | Very high | 88.2 | Confident | 63 Ų | 63 | 51.2 Ų | 51.2 | 28% | 0.276 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -61.4 | -42.9 | 173.5 | -80.7 | -64.9 | 0 | 0 | 0 | 112.2 | L68 V71 L72 Y258 A265 G266 | L68-F262 HydrophobicContact CD1-CD1 3.42Å; L68-F262 VanDerWaalsContact CD1-CD1 3.42Å; L68-F262 HydrophobicContact CD1-CE1 3.29Å; L68-F262 HydrophobicContact CD1-CG 4.49Å; L68-F262 HydrophobicContact CD1-CZ 4.29Å; L68-F262 HydrophobicContact CG-CD1 4.48Å; L68-F262 HydrophobicContact CG-CE1 3.95Å; L68-F262 WeakPolarHBondContact O-CE1 3.45Å; V71-F262 HydrophobicContact CB-CD1 3.94Å; V71-F262 HydrophobicContact CB-CE1 3.7Å; V71-F262 HydrophobicContact CB-CZ 4.3Å; V71-F262 HydrophobicContact CG1-CD1 3.62Å; V71-F262 HydrophobicContact CG1-CD2 4.21Å; V71-F262 HydrophobicContact CG1-CE1 3.55Å; V71-F262 HydrophobicContact CG1-CE2 4.12Å; V71-F262 HydrophobicContact CG1-CG 3.97Å; V71-F262 HydrophobicContact CG1-CZ 3.81Å; L72-F262 HydrophobicContact CB-CZ 4.2Å; L72-F262 HydrophobicContact CD1-CZ 4.49Å; Y258-F262 WeakPolarHBondContact O-CD2 3.49Å; Y258-F262 PolarHBondContact O-N 2.94Å; F262-A265 PolarHBondContact O-N 2.94Å; F262-G266 PolarHBondContact O-N 2.9Å |
| 263 | G | 90.9 | Very high | 86.8 | Confident | 41 Ų | 41 | 55.9 Ų | 55.9 | 42% | 0.423 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -61.2 | -48.6 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | F259 M260 H261 G266 M267 | F259-G263 PolarHBondContact O-N 3.14Å; M260-G263 PolarHBondContact O-N 3.26Å; H261-G263 PolarHBondContact O-N 2.89Å; G263-G266 PolarHBondContact O-N 3.35Å; G263-M267 WeakPolarHBondContact O-CB 3.3Å; G263-M267 PolarHBondContact O-N 3.26Å |
| 264 | L | 91.4 | Very high | 85.2 | Confident | 7 Ų | 7 | 59.2 Ų | 59.2 | 4% | 0.037 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -68.9 | -36.5 | 177.4 | -72.7 | -179.3 | 0 | 0 | 0 | 112.5 | I231 L234 W238 M260 G266 M267 S268 I284 Y285 C288 | I231-L264 HydrophobicContact CD1-CB 4.49Å; I231-L264 HydrophobicContact CD1-CD1 4.31Å; L234-L264 HydrophobicContact CD1-CD1 3.48Å; L234-L264 VanDerWaalsContact CD1-CD1 3.48Å; W238-L264 HydrophobicContact CH2-CB 4.42Å; W238-L264 HydrophobicContact CH2-CD1 3.82Å; W238-L264 HydrophobicContact CZ2-CD1 3.7Å; M260-L264 WeakPolarHBondContact O-CB 3.48Å; M260-L264 WeakPolarHBondContact O-CG 3Å; M260-L264 PolarHBondContact O-N 3.09Å; L264-G266 VanDerWaalsContact C-N 3.31Å; L264-G266 PolarHBondContact O-N 3Å; L264-M267 WeakPolarHBondContact O-CB 3.5Å; L264-M267 PolarHBondContact O-N 3.05Å; L264-S268 PolarHBondContact O-N 3.46Å; L264-I284 HydrophobicContact CD2-CG2 4.31Å; L264-Y285 HydrophobicContact CD2-CD2 3.73Å; L264-Y285 HydrophobicContact CD2-CE2 3.8Å; L264-Y285 HydrophobicContact CD2-CG 4.22Å; L264-Y285 PolarHBondContact O-OH 2.92Å; L264-C288 HydrophobicContact CD1-CB 4.04Å; L264-C288 HydrophobicContact CD2-CB 4.31Å |
| 265 | A | 90.7 | Very high | 83.3 | Confident | 15 Ų | 15 | 59.3 Ų | 59.3 | 12% | 0.124 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -63.9 | -39.4 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | I67 V71 H261 F262 S268 | I67-A265 HydrophobicContact CG2-CB 3.57Å; V71-A265 HydrophobicContact CG2-CB 3.38Å; H261-A265 WeakPolarHBondContact O-CB 3.29Å; H261-A265 PolarHBondContact O-N 3.48Å; F262-A265 PolarHBondContact O-N 2.94Å; A265-S268 WeakPolarHBondContact O-CB 3.47Å; A265-S268 PolarHBondContact O-N 3.43Å |
| 266 | G | 86 | Confident | 81.7 | Confident | 29 Ų | 29 | 57.7 Ų | 57.7 | 30% | 0.299 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -64.2 | -40.5 | 170.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | F262 G263 L264 S268 L269 | F262-G266 PolarHBondContact O-N 2.9Å; G263-G266 PolarHBondContact O-N 3.35Å; L264-G266 VanDerWaalsContact C-N 3.31Å; L264-G266 PolarHBondContact O-N 3Å; G266-S268 PolarHBondContact O-N 3.42Å; G266-L269 VanDerWaalsContact O-CB 3.31Å; G266-L269 WeakPolarHBondContact O-CB 3.4Å; G266-L269 PolarHBondContact O-N 3.07Å |
| 267 | M | 84.8 | Confident | 80.5 | Confident | 38 Ų | 38 | 56.8 Ų | 56.8 | 19% | 0.187 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -61.9 | -31.6 | 176.5 | -162.3 | 69.2 | -158.2 | 0 | 0 | 112.1 | G263 L264 L269 I270 N271 V281 I284 Y285 | G263-M267 WeakPolarHBondContact O-CB 3.3Å; G263-M267 PolarHBondContact O-N 3.26Å; L264-M267 WeakPolarHBondContact O-CB 3.5Å; L264-M267 PolarHBondContact O-N 3.05Å; M267-L269 PolarHBondContact O-N 3.24Å; M267-I270 HydrophobicContact CE-CB 4.4Å; M267-I270 HydrophobicContact CE-CD1 4.46Å; M267-I270 HydrophobicContact CE-CG2 4.22Å; M267-I270 PolarHBondContact O-N 3.43Å; M267-I270 VanDerWaalsContact O-N 3.11Å; M267-I270 HydrophobicContact SD-CD1 3.9Å; M267-N271 PolarHBondContact O-N 3.1Å; M267-V281 HydrophobicContact CE-CB 4.43Å; M267-V281 HydrophobicContact CE-CG2 3.49Å; M267-V281 VanDerWaalsContact CE-CG2 3.49Å; M267-V281 HydrophobicContact CG-CG1 4.19Å; M267-V281 HydrophobicContact CG-CG2 4.16Å; M267-I284 HydrophobicContact CE-CD1 3.53Å; M267-I284 HydrophobicContact SD-CD1 4.13Å; M267-Y285 HydrophobicContact CB-CE2 4.02Å; M267-Y285 HydrophobicContact CG-CE2 4.02Å |
| 268 | S | 82.9 | Confident | 79.4 | Confident | 45 Ų | 45 | 57.4 Ų | 57.4 | 32% | 0.315 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -63.3 | -24 | 173.9 | -166.2 | 0 | 0 | 0 | 0 | 113.7 | L264 A265 G266 N271 Y285 | L264-S268 PolarHBondContact O-N 3.46Å; A265-S268 WeakPolarHBondContact O-CB 3.47Å; A265-S268 PolarHBondContact O-N 3.43Å; G266-S268 PolarHBondContact O-N 3.42Å; S268-N271 WeakPolarHBondContact O-CB 3.28Å; S268-Y285 WeakPolarHBondContact CA-OH 3.38Å; S268-Y285 WeakPolarHBondContact CB-OH 3.49Å; S268-Y285 PolarHBondContact N-OH 2.97Å |
| 269 | L | 77.6 | Confident | 78.6 | Confident | 39 Ų | 39 | 58.3 Ų | 58.3 | 20% | 0.204 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -73 | -38.7 | 173.5 | -67.9 | 160.8 | 0 | 0 | 0 | 110.9 | L63 A64 I67 G266 M267 N271 T272 | L63-L269 HydrophobicContact CB-CD2 4Å; L63-L269 HydrophobicContact CD2-CD2 3.64Å; L63-L269 HydrophobicContact CG-CD2 3.69Å; A64-L269 HydrophobicContact CB-CD1 3.77Å; I67-L269 HydrophobicContact CD1-CD1 4.12Å; I67-L269 HydrophobicContact CD1-CD2 3.33Å; I67-L269 HydrophobicContact CD1-CG 3.55Å; I67-L269 HydrophobicContact CG1-CD2 4.42Å; G266-L269 VanDerWaalsContact O-CB 3.31Å; G266-L269 WeakPolarHBondContact O-CB 3.4Å; G266-L269 PolarHBondContact O-N 3.07Å; M267-L269 PolarHBondContact O-N 3.24Å; L269-N271 PolarHBondContact O-N 3.21Å; L269-T272 WeakPolarHBondContact O-CG2 3.38Å; L269-T272 PolarHBondContact O-N 2.8Å; L269-T272 VanDerWaalsContact O-N 3.1Å; L269-T272 PolarHBondContact O-OG1 3.21Å |
| 270 | I | 73.1 | Confident | 78.1 | Confident | 71 Ų | 71 | 55.1 Ų | 55.1 | 36% | 0.364 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -67.6 | -19.5 | -179 | -57.4 | 171.7 | 0 | 0 | 0 | 110.4 | M267 T272 Y273 | M267-I270 HydrophobicContact CE-CB 4.4Å; M267-I270 HydrophobicContact CE-CD1 4.46Å; M267-I270 HydrophobicContact CE-CG2 4.22Å; M267-I270 PolarHBondContact O-N 3.43Å; M267-I270 VanDerWaalsContact O-N 3.11Å; M267-I270 HydrophobicContact SD-CD1 3.9Å; I270-T272 PolarHBondContact O-N 3.31Å; I270-Y273 HydrophobicContact CB-CD2 4.28Å; I270-Y273 HydrophobicContact CB-CE2 4.5Å; I270-Y273 HydrophobicContact CG2-CD2 3.73Å; I270-Y273 HydrophobicContact CG2-CE2 4.18Å; I270-Y273 VanDerWaalsContact O-CD2 3.28Å; I270-Y273 WeakPolarHBondContact O-CD2 3.31Å; I270-Y273 PolarHBondContact O-N 3.44Å; I270-Y273 VanDerWaalsContact O-N 3.08Å |
| 271 | N | 70.7 | Confident | 77.7 | Confident | 34 Ų | 34 | 51.8 Ų | 51.8 | 18% | 0.182 | 30% | 0.302 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -60.6 | -9.8 | 171.2 | -163 | 25.5 | 0 | 0 | 0 | 113.9 | Q227 M267 S268 L269 S278 V281 | Q227-N271 PolarHBondContact OE1-ND2 3.34Å; M267-N271 PolarHBondContact O-N 3.1Å; S268-N271 WeakPolarHBondContact O-CB 3.28Å; L269-N271 PolarHBondContact O-N 3.21Å; N271-S278 VanDerWaalsContact OD1-CA 3.28Å; N271-S278 WeakPolarHBondContact OD1-CA 3.46Å; N271-S278 WeakPolarHBondContact OD1-CB 3.38Å; N271-S278 PolarHBondContact OD1-OG 3.27Å; N271-V281 HydrophobicContact CB-CG1 4.39Å; N271-V281 HydrophobicContact CB-CG2 4.3Å |
| 272 | T | 68.5 | Low | 77.4 | Confident | 112 Ų | 112 | 51.6 Ų | 51.6 | 69% | 0.687 | 30% | 0.302 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.4 | -15.3 | 173.3 | 62.1 | 0 | 0 | 0 | 0 | 114 | L269 I270 | L269-T272 WeakPolarHBondContact O-CG2 3.38Å; L269-T272 PolarHBondContact O-N 2.8Å; L269-T272 VanDerWaalsContact O-N 3.1Å; L269-T272 PolarHBondContact O-OG1 3.21Å; I270-T272 PolarHBondContact O-N 3.31Å |
| 273 | Y | 64.2 | Low | 77.2 | Confident | 155 Ų | 155 | 50.9 Ų | 50.9 | 61% | 0.608 | 31% | 0.308 | S | S | * | . | S | Bend | trans | -74.1 | 155.7 | 179.5 | -69 | -70.9 | 0 | 0 | 0 | 112 | I270 | I270-Y273 HydrophobicContact CB-CD2 4.28Å; I270-Y273 HydrophobicContact CB-CE2 4.5Å; I270-Y273 HydrophobicContact CG2-CD2 3.73Å; I270-Y273 HydrophobicContact CG2-CE2 4.18Å; I270-Y273 VanDerWaalsContact O-CD2 3.28Å; I270-Y273 WeakPolarHBondContact O-CD2 3.31Å; I270-Y273 PolarHBondContact O-N 3.44Å; I270-Y273 VanDerWaalsContact O-N 3.08Å |
| 274 | S | 58.8 | Low | 77.3 | Confident | 102 Ų | 102 | 51.6 Ų | 51.6 | 71% | 0.713 | 30% | 0.301 | S | S | * | . | S | Bend | trans | -51.3 | 140.8 | 175.1 | -58.4 | 0 | 0 | 0 | 0 | 111.3 | C277 | S274-C277 PolarHBondContact O-SG 3.1Å; S274-C277 VanDerWaalsContact O-SG 3.41Å |
| 275 | S | 55.5 | Low | 77.3 | Confident | 23 Ų | 23 | 51.4 Ų | 51.4 | 16% | 0.161 | 30% | 0.3 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -68.4 | 144.7 | -179.7 | 162 | 0 | 0 | 0 | 0 | 110.4 | W215 C277 | W215-S275 WeakPolarHBondContact CH2-O 3.33Å; W215-S275 WeakPolarHBondContact CH2-OG 3.28Å; W215-S275 WeakPolarHBondContact CZ3-OG 3.45Å; S275-C277 VanDerWaalsContact CA-N 3.31Å |
| 276 | P | 61 | Low | 77.3 | Confident | 83 Ų | 83 | 54.5 Ų | 54.5 | 54% | 0.539 | 31% | 0.313 | S | S | . | . | T | Hydrogen-bonded Turn | cis | -83.1 | 3.7 | 32.2 | 32.9 | -37.6 | 0 | 0 | 0 | 117.9 | S278 E279 I280 | P276-S278 VanDerWaalsContact C-N 3.34Å; P276-S278 PolarHBondContact O-N 2.91Å; P276-E279 PolarHBondContact O-N 3.03Å; P276-I280 HydrophobicContact CB-CD1 4.06Å; P276-I280 HydrophobicContact CG-CD1 4.13Å; P276-I280 WeakPolarHBondContact O-CG1 3.1Å; P276-I280 PolarHBondContact O-N 3.35Å; P276-I280 VanDerWaalsContact O-N 3.15Å |
| 277 | C | 68.8 | Low | 77.7 | Confident | 37 Ų | 37 | 58.4 Ų | 58.4 | 25% | 0.25 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -52.6 | -42.3 | -176.9 | -67.6 | 0 | 0 | 0 | 0 | 114.7 | S274 S275 E279 I280 V281 | S274-C277 PolarHBondContact O-SG 3.1Å; S274-C277 VanDerWaalsContact O-SG 3.41Å; S275-C277 VanDerWaalsContact CA-N 3.31Å; C277-E279 PolarHBondContact O-N 3.08Å; C277-I280 PolarHBondContact O-N 3.11Å; C277-V281 WeakPolarHBondContact O-CB 3.46Å; C277-V281 WeakPolarHBondContact O-CG2 3.47Å; C277-V281 PolarHBondContact O-N 3.47Å |
| 278 | S | 72.2 | Confident | 78.2 | Confident | 13 Ų | 13 | 57.9 Ų | 57.9 | 9% | 0.091 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -65.3 | -39.6 | -177.7 | -165.8 | 0 | 0 | 0 | 0 | 113.3 | N271 P276 V281 C282 | N271-S278 VanDerWaalsContact OD1-CA 3.28Å; N271-S278 WeakPolarHBondContact OD1-CA 3.46Å; N271-S278 WeakPolarHBondContact OD1-CB 3.38Å; N271-S278 PolarHBondContact OD1-OG 3.27Å; P276-S278 VanDerWaalsContact C-N 3.34Å; P276-S278 PolarHBondContact O-N 2.91Å; S278-V281 PolarHBondContact O-N 3.21Å; S278-C282 PolarHBondContact O-N 3.37Å |
| 279 | E | 78.9 | Confident | 78.8 | Confident | 82 Ų | 82 | 56.8 Ų | 56.8 | 38% | 0.383 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -67 | -41.6 | 177.4 | -56.1 | -174.5 | -170.2 | 0 | 0 | 110.6 | F223 P276 C277 C282 A283 | F223-E279 HydrophobicContact CD2-CG 4.09Å; F223-E279 HydrophobicContact CE1-CG 4.39Å; F223-E279 HydrophobicContact CE2-CG 3.57Å; F223-E279 HydrophobicContact CZ-CB 4.46Å; F223-E279 HydrophobicContact CZ-CG 3.75Å; P276-E279 PolarHBondContact O-N 3.03Å; C277-E279 PolarHBondContact O-N 3.08Å; E279-C282 PolarHBondContact O-N 3.31Å; E279-A283 WeakPolarHBondContact O-CB 3.49Å; E279-A283 PolarHBondContact O-N 3.46Å |
| 280 | I | 84.2 | Confident | 79.6 | Confident | 87 Ų | 87 | 59 Ų | 59 | 45% | 0.446 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -63.6 | -43.2 | 175.7 | -64 | 165.9 | 0 | 0 | 0 | 110.7 | P276 C277 A283 I284 | P276-I280 HydrophobicContact CB-CD1 4.06Å; P276-I280 HydrophobicContact CG-CD1 4.13Å; P276-I280 WeakPolarHBondContact O-CG1 3.1Å; P276-I280 PolarHBondContact O-N 3.35Å; P276-I280 VanDerWaalsContact O-N 3.15Å; C277-I280 PolarHBondContact O-N 3.11Å; I280-A283 PolarHBondContact O-N 2.99Å; I280-I284 HydrophobicContact CG2-CD1 3.83Å; I280-I284 HydrophobicContact CG2-CG1 4.48Å; I280-I284 VanDerWaalsContact O-CG1 3.3Å; I280-I284 WeakPolarHBondContact O-CG1 3.5Å; I280-I284 PolarHBondContact O-N 3.3Å |
| 281 | V | 85.6 | Confident | 80.7 | Confident | 0 Ų | 0 | 57.4 Ų | 57.4 | 0% | 0 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -58.3 | -50.3 | 175.2 | 171.4 | 0 | 0 | 0 | 0 | 109.6 | M267 N271 C277 S278 A283 I284 Y285 | M267-V281 HydrophobicContact CE-CB 4.43Å; M267-V281 HydrophobicContact CE-CG2 3.49Å; M267-V281 VanDerWaalsContact CE-CG2 3.49Å; M267-V281 HydrophobicContact CG-CG1 4.19Å; M267-V281 HydrophobicContact CG-CG2 4.16Å; N271-V281 HydrophobicContact CB-CG1 4.39Å; N271-V281 HydrophobicContact CB-CG2 4.3Å; C277-V281 WeakPolarHBondContact O-CB 3.46Å; C277-V281 WeakPolarHBondContact O-CG2 3.47Å; C277-V281 PolarHBondContact O-N 3.47Å; S278-V281 PolarHBondContact O-N 3.21Å; V281-A283 VanDerWaalsContact C-N 3.31Å; V281-A283 PolarHBondContact O-N 3.45Å; V281-I284 PolarHBondContact O-N 2.83Å; V281-Y285 HydrophobicContact CG1-CD2 3.95Å; V281-Y285 HydrophobicContact CG1-CE2 3.46Å; V281-Y285 VanDerWaalsContact CG1-CE2 3.46Å; V281-Y285 WeakPolarHBondContact O-CD2 3.41Å; V281-Y285 PolarHBondContact O-N 3.33Å |
| 282 | C | 87.8 | Confident | 81.8 | Confident | 7 Ų | 7 | 56.2 Ų | 56.2 | 5% | 0.047 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -60.4 | -40.2 | 178.5 | -168.9 | 0 | 0 | 0 | 0 | 112.3 | F223 C226 S278 E279 Y285 M286 | F223-C282 HydrophobicContact CD1-CB 4.41Å; C226-C282 VanDerWaalsContact CB-SG 3.6Å; S278-C282 PolarHBondContact O-N 3.37Å; E279-C282 PolarHBondContact O-N 3.31Å; C282-Y285 PolarHBondContact O-N 3.41Å; C282-M286 WeakPolarHBondContact O-CG 3.46Å; C282-M286 PolarHBondContact O-N 3.01Å; C282-M286 VanDerWaalsContact O-N 3.09Å |
| 283 | A | 88.4 | Confident | 83 | Confident | 49 Ų | 49 | 53.8 Ų | 53.8 | 41% | 0.405 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -63.5 | -42 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | E279 I280 V281 Y285 M286 I287 | E279-A283 WeakPolarHBondContact O-CB 3.49Å; E279-A283 PolarHBondContact O-N 3.46Å; I280-A283 PolarHBondContact O-N 2.99Å; V281-A283 VanDerWaalsContact C-N 3.31Å; V281-A283 PolarHBondContact O-N 3.45Å; A283-Y285 VanDerWaalsContact C-N 3.29Å; A283-Y285 PolarHBondContact O-N 2.86Å; A283-M286 PolarHBondContact O-N 3.29Å; A283-I287 VanDerWaalsContact O-CG1 3.29Å; A283-I287 WeakPolarHBondContact O-CG1 3.32Å; A283-I287 PolarHBondContact O-N 3.46Å |
| 284 | I | 91.5 | Very high | 84.5 | Confident | 55 Ų | 55 | 50.9 Ų | 50.9 | 28% | 0.282 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -60.3 | -41.1 | 175.2 | -71.5 | 162.3 | 0 | 0 | 0 | 110.7 | L264 M267 I280 V281 M286 I287 C288 | L264-I284 HydrophobicContact CD2-CG2 4.31Å; M267-I284 HydrophobicContact CE-CD1 3.53Å; M267-I284 HydrophobicContact SD-CD1 4.13Å; I280-I284 HydrophobicContact CG2-CD1 3.83Å; I280-I284 HydrophobicContact CG2-CG1 4.48Å; I280-I284 VanDerWaalsContact O-CG1 3.3Å; I280-I284 WeakPolarHBondContact O-CG1 3.5Å; I280-I284 PolarHBondContact O-N 3.3Å; V281-I284 PolarHBondContact O-N 2.83Å; I284-M286 VanDerWaalsContact C-N 3.35Å; I284-M286 PolarHBondContact O-N 2.97Å; I284-I287 PolarHBondContact O-N 2.94Å; I284-C288 WeakPolarHBondContact O-CB 3.45Å; I284-C288 PolarHBondContact O-N 3.08Å; I284-C288 PolarHBondContact O-SG 3.26Å; I284-C288 VanDerWaalsContact O-SG 3.34Å |
| 285 | Y | 91.9 | Very high | 86.1 | Confident | 3 Ų | 3 | 49.2 Ų | 49.2 | 1% | 0.012 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -65.4 | -40 | 179.3 | -79.3 | -133.8 | 0 | 0 | 0 | 111.5 | Q227 C230 I231 L264 M267 S268 V281 C282 A283 C288 L289 | Q227-Y285 HydrophobicContact CG-CD1 3.68Å; Q227-Y285 HydrophobicContact CG-CE1 3.55Å; Q227-Y285 HydrophobicContact CG-CG 4.46Å; C230-Y285 HydrophobicContact CB-CD1 4.35Å; I231-Y285 HydrophobicContact CD1-CD1 3.51Å; I231-Y285 HydrophobicContact CD1-CE1 3.27Å; I231-Y285 HydrophobicContact CG1-CD1 3.58Å; I231-Y285 HydrophobicContact CG1-CE1 3.33Å; L264-Y285 HydrophobicContact CD2-CD2 3.73Å; L264-Y285 HydrophobicContact CD2-CE2 3.8Å; L264-Y285 HydrophobicContact CD2-CG 4.22Å; L264-Y285 PolarHBondContact O-OH 2.92Å; M267-Y285 HydrophobicContact CB-CE2 4.02Å; M267-Y285 HydrophobicContact CG-CE2 4.02Å; S268-Y285 WeakPolarHBondContact CA-OH 3.38Å; S268-Y285 WeakPolarHBondContact CB-OH 3.49Å; S268-Y285 PolarHBondContact N-OH 2.97Å; V281-Y285 HydrophobicContact CG1-CD2 3.95Å; V281-Y285 HydrophobicContact CG1-CE2 3.46Å; V281-Y285 VanDerWaalsContact CG1-CE2 3.46Å; V281-Y285 WeakPolarHBondContact O-CD2 3.41Å; V281-Y285 PolarHBondContact O-N 3.33Å; C282-Y285 PolarHBondContact O-N 3.41Å; A283-Y285 VanDerWaalsContact C-N 3.29Å; A283-Y285 PolarHBondContact O-N 2.86Å; Y285-C288 PolarHBondContact O-N 3.38Å; Y285-L289 WeakPolarHBondContact O-CB 3.32Å; Y285-L289 PolarHBondContact O-N 3.17Å |
| 286 | M | 92 | Very high | 87.8 | Confident | 80 Ų | 80 | 48.3 Ų | 48.3 | 39% | 0.394 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -63 | -43 | 173.6 | -71.8 | -66.8 | -66.6 | 0 | 0 | 111.8 | M229 C230 C282 A283 I284 L289 I290 | M229-M286 HydrophobicContact CE-SD 4.29Å; C230-M286 PolarHBondContact SG-SD 3.36Å; C282-M286 WeakPolarHBondContact O-CG 3.46Å; C282-M286 PolarHBondContact O-N 3.01Å; C282-M286 VanDerWaalsContact O-N 3.09Å; A283-M286 PolarHBondContact O-N 3.29Å; I284-M286 VanDerWaalsContact C-N 3.35Å; I284-M286 PolarHBondContact O-N 2.97Å; M286-L289 PolarHBondContact O-N 3.08Å; M286-I290 WeakPolarHBondContact O-CG2 3.45Å; M286-I290 PolarHBondContact O-N 3.1Å |
| 287 | I | 94 | Very high | 89.2 | Confident | 112 Ų | 112 | 51.7 Ų | 51.7 | 57% | 0.574 | 28% | 0.275 | S | S | * | . | H | α-helix | trans | -63.2 | -42.6 | 176.6 | -67.2 | 163.2 | 0 | 0 | 0 | 110.7 | A283 I284 I290 G291 | A283-I287 VanDerWaalsContact O-CG1 3.29Å; A283-I287 WeakPolarHBondContact O-CG1 3.32Å; A283-I287 PolarHBondContact O-N 3.46Å; I284-I287 PolarHBondContact O-N 2.94Å; I287-I290 WeakPolarHBondContact O-CG2 3.48Å; I287-G291 PolarHBondContact O-N 3.15Å |
| 288 | C | 94.5 | Very high | 90.3 | Very high | 26 Ų | 26 | 52.8 Ų | 52.8 | 18% | 0.176 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -64.5 | -41.9 | 175.1 | -71.8 | 0 | 0 | 0 | 0 | 111.6 | L234 L264 I284 Y285 G291 M292 | L234-C288 HydrophobicContact CD1-CB 4.49Å; L264-C288 HydrophobicContact CD1-CB 4.04Å; L264-C288 HydrophobicContact CD2-CB 4.31Å; I284-C288 WeakPolarHBondContact O-CB 3.45Å; I284-C288 PolarHBondContact O-N 3.08Å; I284-C288 PolarHBondContact O-SG 3.26Å; I284-C288 VanDerWaalsContact O-SG 3.34Å; Y285-C288 PolarHBondContact O-N 3.38Å; C288-G291 PolarHBondContact O-N 3.3Å; C288-M292 WeakPolarHBondContact O-CB 3.5Å; C288-M292 VanDerWaalsContact O-CG 3.26Å; C288-M292 WeakPolarHBondContact O-CG 3.43Å; C288-M292 PolarHBondContact O-N 3.26Å |
| 289 | L | 94.9 | Very high | 91 | Very high | 22 Ų | 22 | 54.2 Ų | 54.2 | 12% | 0.115 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -60.6 | -51.4 | 176.7 | 177.2 | 151 | 0 | 0 | 0 | 111.3 | C230 M233 L234 Y285 M286 G291 M292 I293 | C230-L289 HydrophobicContact CB-CD1 4.3Å; M233-L289 HydrophobicContact CB-CD1 3.57Å; M233-L289 HydrophobicContact CG-CD1 4.24Å; L234-L289 HydrophobicContact CD2-CB 4.46Å; L234-L289 HydrophobicContact CG-CB 4.26Å; Y285-L289 WeakPolarHBondContact O-CB 3.32Å; Y285-L289 PolarHBondContact O-N 3.17Å; M286-L289 PolarHBondContact O-N 3.08Å; L289-G291 VanDerWaalsContact C-N 3.29Å; L289-G291 PolarHBondContact O-N 2.86Å; L289-M292 PolarHBondContact O-N 2.91Å; L289-I293 HydrophobicContact CD2-CD1 3.43Å; L289-I293 VanDerWaalsContact CD2-CD1 3.43Å; L289-I293 HydrophobicContact CD2-CG1 4.34Å; L289-I293 HydrophobicContact CG-CD1 4.18Å; L289-I293 WeakPolarHBondContact O-CG1 3.38Å; L289-I293 PolarHBondContact O-N 3.38Å |
| 290 | I | 95.6 | Very high | 91.3 | Very high | 87 Ų | 87 | 52 Ų | 52 | 45% | 0.446 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -64 | -38.5 | 179.6 | -168.4 | 63.3 | 0 | 0 | 0 | 111 | M286 I287 M292 I293 I294 | M286-I290 WeakPolarHBondContact O-CG2 3.45Å; M286-I290 PolarHBondContact O-N 3.1Å; I287-I290 WeakPolarHBondContact O-CG2 3.48Å; I290-M292 PolarHBondContact O-N 3.15Å; I290-I293 PolarHBondContact O-N 3.32Å; I290-I294 HydrophobicContact CG1-CD1 3.99Å; I290-I294 HydrophobicContact CG1-CG1 4.49Å; I290-I294 VanDerWaalsContact O-CG1 3.26Å; I290-I294 WeakPolarHBondContact O-CG1 3.35Å; I290-I294 PolarHBondContact O-N 2.91Å |
| 291 | G | 95.2 | Very high | 91.3 | Very high | 37 Ų | 37 | 51.4 Ų | 51.4 | 38% | 0.381 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -60 | -43.8 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | I287 C288 L289 I294 F295 | I287-G291 PolarHBondContact O-N 3.15Å; C288-G291 PolarHBondContact O-N 3.3Å; L289-G291 VanDerWaalsContact C-N 3.29Å; L289-G291 PolarHBondContact O-N 2.86Å; G291-I294 PolarHBondContact O-N 3.33Å; G291-F295 VanDerWaalsContact O-CB 3.29Å; G291-F295 WeakPolarHBondContact O-CB 3.16Å; G291-F295 PolarHBondContact O-N 3.42Å |
| 292 | M | 93.8 | Very high | 90.9 | Very high | 9 Ų | 9 | 54.3 Ų | 54.3 | 4% | 0.044 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -69.9 | -35 | 177.3 | -69.6 | -53.4 | -53.2 | 0 | 0 | 112.6 | L234 F237 I241 L256 V257 C288 L289 I290 F295 A296 | L234-M292 HydrophobicContact CD2-CB 3.96Å; L234-M292 HydrophobicContact CD2-CG 3.57Å; F237-M292 HydrophobicContact CB-CB 4.42Å; I241-M292 HydrophobicContact CD1-CE 3.15Å; L256-M292 HydrophobicContact CD2-SD 4.33Å; V257-M292 HydrophobicContact CG2-CE 4.47Å; C288-M292 WeakPolarHBondContact O-CB 3.5Å; C288-M292 VanDerWaalsContact O-CG 3.26Å; C288-M292 WeakPolarHBondContact O-CG 3.43Å; C288-M292 PolarHBondContact O-N 3.26Å; L289-M292 PolarHBondContact O-N 2.91Å; I290-M292 PolarHBondContact O-N 3.15Å; M292-F295 HydrophobicContact CE-CD1 4.34Å; M292-A296 VanDerWaalsContact O-CB 3.23Å; M292-A296 WeakPolarHBondContact O-CB 3.19Å; M292-A296 PolarHBondContact O-N 3.08Å |
| 293 | I | 94.2 | Very high | 90.1 | Very high | 61 Ų | 61 | 55 Ų | 55 | 31% | 0.313 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -62.9 | -49.4 | 173 | -70.2 | 174.7 | 0 | 0 | 0 | 110.4 | F237 L289 I290 F295 A296 Y297 | F237-I293 HydrophobicContact CD2-CG1 3.98Å; F237-I293 HydrophobicContact CE1-CG1 4.14Å; F237-I293 HydrophobicContact CE2-CD1 3.91Å; F237-I293 HydrophobicContact CE2-CG1 3.42Å; F237-I293 VanDerWaalsContact CE2-CG1 3.42Å; F237-I293 HydrophobicContact CZ-CD1 4.13Å; F237-I293 HydrophobicContact CZ-CG1 3.53Å; L289-I293 HydrophobicContact CD2-CD1 3.43Å; L289-I293 VanDerWaalsContact CD2-CD1 3.43Å; L289-I293 HydrophobicContact CD2-CG1 4.34Å; L289-I293 HydrophobicContact CG-CD1 4.18Å; L289-I293 WeakPolarHBondContact O-CG1 3.38Å; L289-I293 PolarHBondContact O-N 3.38Å; I290-I293 PolarHBondContact O-N 3.32Å; I293-F295 VanDerWaalsContact C-N 3.35Å; I293-F295 PolarHBondContact O-N 2.97Å; I293-A296 PolarHBondContact O-N 3.11Å; I293-Y297 WeakPolarHBondContact O-CB 3.28Å; I293-Y297 PolarHBondContact O-N 3.47Å |
| 294 | I | 95 | Very high | 89 | Confident | 93 Ų | 93 | 57.5 Ų | 57.5 | 48% | 0.477 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -61.4 | -46.1 | 178.5 | -66.9 | 165.6 | 0 | 0 | 0 | 109.8 | I290 G291 A296 Y297 C298 | I290-I294 HydrophobicContact CG1-CD1 3.99Å; I290-I294 HydrophobicContact CG1-CG1 4.49Å; I290-I294 VanDerWaalsContact O-CG1 3.26Å; I290-I294 WeakPolarHBondContact O-CG1 3.35Å; I290-I294 PolarHBondContact O-N 2.91Å; G291-I294 PolarHBondContact O-N 3.33Å; I294-A296 PolarHBondContact O-N 2.96Å; I294-Y297 PolarHBondContact O-N 3.39Å; I294-C298 WeakPolarHBondContact O-CB 3.37Å; I294-C298 PolarHBondContact O-N 3.47Å; I294-C298 PolarHBondContact O-SG 2.82Å |
| 295 | F | 93.6 | Very high | 87.5 | Confident | 68 Ų | 68 | 59.4 Ų | 59.4 | 30% | 0.298 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -61.6 | -45.6 | 178.5 | -178.4 | -103.2 | 0 | 0 | 0 | 112.1 | I241 Q253 L256 G291 M292 I293 C298 R299 | I241-F295 HydrophobicContact CD1-CD1 3.85Å; I241-F295 HydrophobicContact CD1-CE1 4.25Å; I241-F295 HydrophobicContact CG2-CE1 4.33Å; Q253-F295 HydrophobicContact CG-CZ 4.25Å; L256-F295 HydrophobicContact CD1-CE1 4.21Å; L256-F295 HydrophobicContact CD1-CE2 4.33Å; L256-F295 HydrophobicContact CD1-CZ 3.99Å; G291-F295 VanDerWaalsContact O-CB 3.29Å; G291-F295 WeakPolarHBondContact O-CB 3.16Å; G291-F295 PolarHBondContact O-N 3.42Å; M292-F295 HydrophobicContact CE-CD1 4.34Å; I293-F295 VanDerWaalsContact C-N 3.35Å; I293-F295 PolarHBondContact O-N 2.97Å; F295-C298 PolarHBondContact O-N 3.41Å; F295-R299 WeakPolarHBondContact O-CB 2.83Å; F295-R299 PolarHBondContact O-N 3.22Å |
| 296 | A | 91.1 | Very high | 85.8 | Confident | 4 Ų | 4 | 64.4 Ų | 64.4 | 3% | 0.033 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -60.2 | -46.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | F237 I241 M292 I293 I294 R299 F300 | F237-A296 HydrophobicContact CD1-CB 4.08Å; I241-A296 HydrophobicContact CD1-CB 4.26Å; M292-A296 VanDerWaalsContact O-CB 3.23Å; M292-A296 WeakPolarHBondContact O-CB 3.19Å; M292-A296 PolarHBondContact O-N 3.08Å; I293-A296 PolarHBondContact O-N 3.11Å; I294-A296 PolarHBondContact O-N 2.96Å; A296-R299 WeakPolarHBondContact O-CB 2.98Å; A296-R299 PolarHBondContact O-N 2.75Å; A296-F300 HydrophobicContact CB-CD2 4.42Å; A296-F300 HydrophobicContact CB-CE2 4.32Å; A296-F300 WeakPolarHBondContact O-CD2 3.04Å; A296-F300 PolarHBondContact O-N 2.91Å |
| 297 | Y | 91 | Very high | 83.7 | Confident | 153 Ų | 153 | 65.5 Ų | 65.5 | 60% | 0.6 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -58.6 | -53.8 | 177 | 178.6 | -98.5 | 0 | 0 | 0 | 111.6 | I293 I294 R299 F300 H301 | I293-Y297 WeakPolarHBondContact O-CB 3.28Å; I293-Y297 PolarHBondContact O-N 3.47Å; I294-Y297 PolarHBondContact O-N 3.39Å; Y297-R299 PolarHBondContact O-N 2.98Å; Y297-F300 PolarHBondContact O-N 3.42Å; Y297-H301 WeakPolarHBondContact O-CB 3.33Å; Y297-H301 PolarHBondContact O-N 3.18Å |
| 298 | C | 91.4 | Very high | 81.5 | Confident | 61 Ų | 61 | 62.8 Ų | 62.8 | 41% | 0.412 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -57.4 | -39.4 | 178.2 | -69.3 | 0 | 0 | 0 | 0 | 112.1 | I294 F295 S302 | I294-C298 WeakPolarHBondContact O-CB 3.37Å; I294-C298 PolarHBondContact O-N 3.47Å; I294-C298 PolarHBondContact O-SG 2.82Å; F295-C298 PolarHBondContact O-N 3.41Å; C298-S302 WeakPolarHBondContact O-CB 3.47Å; C298-S302 PolarHBondContact O-N 3.47Å; C298-S302 PolarHBondContact O-OG 2.97Å |
| 299 | R | 86.6 | Confident | 79.3 | Confident | 42 Ų | 42 | 70.2 Ų | 70.2 | 16% | 0.158 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -65.4 | -50.8 | -179.7 | 174.2 | 58.8 | 175.7 | 118.2 | -1.1 | 112.4 | F295 A296 Y297 S302 Q303 | F295-R299 WeakPolarHBondContact O-CB 2.83Å; F295-R299 PolarHBondContact O-N 3.22Å; A296-R299 WeakPolarHBondContact O-CB 2.98Å; A296-R299 PolarHBondContact O-N 2.75Å; Y297-R299 PolarHBondContact O-N 2.98Å; R299-S302 PolarHBondContact O-N 3.41Å; R299-Q303 PolarHBondContact O-N 3.42Å |
| 300 | F | 85.1 | Confident | 77.1 | Confident | 36 Ų | 36 | 71.2 Ų | 71.2 | 16% | 0.158 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -73.4 | -34.6 | -179.8 | -68.3 | -62.9 | 0 | 0 | 0 | 111.6 | L178 L240 A296 Y297 S302 Q303 L304 | L178-F300 HydrophobicContact CD1-CD1 4.1Å; L178-F300 HydrophobicContact CD1-CE1 3.41Å; L178-F300 VanDerWaalsContact CD1-CE1 3.41Å; L178-F300 HydrophobicContact CD1-CE2 4.11Å; L178-F300 HydrophobicContact CD1-CZ 3.43Å; L178-F300 VanDerWaalsContact CD1-CZ 3.43Å; L240-F300 HydrophobicContact CD2-CD2 4.42Å; L240-F300 HydrophobicContact CD2-CE2 3.54Å; L240-F300 HydrophobicContact CD2-CZ 4.08Å; L240-F300 HydrophobicContact CG-CE2 3.84Å; L240-F300 HydrophobicContact CG-CZ 3.85Å; A296-F300 HydrophobicContact CB-CD2 4.42Å; A296-F300 HydrophobicContact CB-CE2 4.32Å; A296-F300 WeakPolarHBondContact O-CD2 3.04Å; A296-F300 PolarHBondContact O-N 2.91Å; Y297-F300 PolarHBondContact O-N 3.42Å; F300-S302 VanDerWaalsContact C-N 3.33Å; F300-S302 PolarHBondContact O-N 2.73Å; F300-Q303 WeakPolarHBondContact O-CB 3.24Å; F300-Q303 PolarHBondContact O-N 2.93Å; F300-Q303 VanDerWaalsContact O-N 3.13Å; F300-L304 PolarHBondContact O-N 3.21Å |
| 301 | H | 83.7 | Confident | 74.7 | Confident | 74 Ų | 74 | 72.6 Ų | 72.6 | 34% | 0.343 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -62.3 | -40.3 | 173.4 | -177.9 | -110.5 | 0 | 0 | 0 | 112.1 | Y297 Q303 L304 I305 | Y297-H301 WeakPolarHBondContact O-CB 3.33Å; Y297-H301 PolarHBondContact O-N 3.18Å; H301-Q303 PolarHBondContact O-N 3.25Å; H301-L304 WeakPolarHBondContact O-CA 3.44Å; H301-L304 WeakPolarHBondContact O-CB 3.5Å; H301-L304 PolarHBondContact O-N 3.08Å; H301-I305 WeakPolarHBondContact CE1-CD1 3.36Å; H301-I305 WeakPolarHBondContact ND1-CD1 3.16Å; H301-I305 PolarHBondContact O-N 3.06Å |
| 302 | S | 78.4 | Confident | 72.3 | Confident | 61 Ų | 61 | 73.7 Ų | 73.7 | 43% | 0.427 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -62.1 | -30.5 | 175.2 | -61.2 | 0 | 0 | 0 | 0 | 112.7 | C298 R299 F300 L304 T306 | C298-S302 WeakPolarHBondContact O-CB 3.47Å; C298-S302 PolarHBondContact O-N 3.47Å; C298-S302 PolarHBondContact O-OG 2.97Å; R299-S302 PolarHBondContact O-N 3.41Å; F300-S302 VanDerWaalsContact C-N 3.33Å; F300-S302 PolarHBondContact O-N 2.73Å; S302-L304 VanDerWaalsContact C-N 3.32Å; S302-T306 WeakPolarHBondContact O-CB 3.48Å; S302-T306 WeakPolarHBondContact O-CG2 3.43Å; S302-T306 PolarHBondContact O-N 3.13Å; S302-T306 PolarHBondContact O-OG1 3.47Å |
| 303 | Q | 69.5 | Low | 69.9 | Low | 23 Ų | 23 | 75.6 Ų | 75.6 | 11% | 0.107 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -70.4 | -30 | 174 | -65.6 | 175.6 | -1.1 | 0 | 0 | 112.1 | R299 F300 H301 T306 N307 | R299-Q303 PolarHBondContact O-N 3.42Å; F300-Q303 WeakPolarHBondContact O-CB 3.24Å; F300-Q303 PolarHBondContact O-N 2.93Å; F300-Q303 VanDerWaalsContact O-N 3.13Å; H301-Q303 PolarHBondContact O-N 3.25Å; Q303-T306 PolarHBondContact O-OG1 3.42Å; Q303-N307 PolarHBondContact O-ND2 3.11Å |
| 304 | L | 66 | Low | 67.7 | Low | 100 Ų | 100 | 75.6 Ų | 75.6 | 52% | 0.524 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -73.2 | -44.1 | 172.7 | -60.8 | 173.3 | 0 | 0 | 0 | 111.5 | F300 H301 S302 N307 | F300-L304 PolarHBondContact O-N 3.21Å; H301-L304 WeakPolarHBondContact O-CA 3.44Å; H301-L304 WeakPolarHBondContact O-CB 3.5Å; H301-L304 PolarHBondContact O-N 3.08Å; S302-L304 VanDerWaalsContact C-N 3.32Å; L304-N307 PolarHBondContact O-N 3.19Å |
| 305 | I | 59.7 | Low | 65.3 | Low | 96 Ų | 96 | 76 Ų | 76 | 49% | 0.492 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -79.9 | -11.3 | -179.4 | -49.4 | 167 | 0 | 0 | 0 | 114.2 | H301 N307 P308 | H301-I305 WeakPolarHBondContact CE1-CD1 3.36Å; H301-I305 WeakPolarHBondContact ND1-CD1 3.16Å; H301-I305 PolarHBondContact O-N 3.06Å; I305-N307 VanDerWaalsContact C-N 3.29Å; I305-P308 HydrophobicContact CG2-CG 4.35Å; I305-P308 WeakPolarHBondContact O-CD 3.16Å; I305-P308 WeakPolarHBondContact O-CG 3.26Å |
| 306 | T | 55.8 | Low | 63.1 | Low | 107 Ų | 107 | 79.9 Ų | 79.9 | 66% | 0.656 | 42% | 0.42 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.8 | -13.2 | 170.7 | 42.6 | 0 | 0 | 0 | 0 | 112.4 | S302 Q303 | S302-T306 WeakPolarHBondContact O-CB 3.48Å; S302-T306 WeakPolarHBondContact O-CG2 3.43Å; S302-T306 PolarHBondContact O-N 3.13Å; S302-T306 PolarHBondContact O-OG1 3.47Å; Q303-T306 PolarHBondContact O-OG1 3.42Å |
| 307 | N | 49.4 | Very low | 61.1 | Low | 104 Ų | 104 | 84.4 Ų | 84.4 | 56% | 0.556 | 44% | 0.443 | S | S | * | . | S | Bend | trans | -102.2 | 23.7 | 174.7 | -83.6 | -62 | 0 | 0 | 0 | 118.4 | Q303 L304 I305 | Q303-N307 PolarHBondContact O-ND2 3.11Å; L304-N307 PolarHBondContact O-N 3.19Å; I305-N307 VanDerWaalsContact C-N 3.29Å |
| 308 | P | 47.2 | Very low | 59.2 | Low | 55 Ų | 55 | 83 Ų | 83 | 36% | 0.357 | 45% | 0.446 | S | S | . | . | trans | -94.4 | -7.8 | -177.1 | 38.1 | -38 | 0 | 0 | 0 | 113.2 | I305 K310 N311 S312 | I305-P308 HydrophobicContact CG2-CG 4.35Å; I305-P308 WeakPolarHBondContact O-CD 3.16Å; I305-P308 WeakPolarHBondContact O-CG 3.26Å; P308-K310 PolarHBondContact O-N 3.48Å; P308-N311 PolarHBondContact O-N 3.28Å; P308-S312 PolarHBondContact O-N 3.04Å | ||
| 309 | K | 47.7 | Very low | 57.6 | Low | 181 Ų | 181 | 88.1 Ų | 88.1 | 79% | 0.787 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -55 | -15.5 | 179 | -80.6 | -169.4 | 177.5 | -176.3 | 0 | 112.8 | S312 A313 | K309-S312 PolarHBondContact O-OG 2.66Å; K309-A313 PolarHBondContact O-N 2.99Å |
| 310 | K | 48.7 | Very low | 55.7 | Low | 43 Ų | 43 | 96.9 Ų | 96.9 | 19% | 0.187 | 51% | 0.506 | C | S | . | . | H | α-helix | trans | -76.4 | -44.4 | 173.1 | -161 | 165.6 | -159.1 | 179.6 | 0 | 114.7 | G163 D164 P308 S312 A313 V314 | G163-K310 PolarHBondContact O-NZ 3.48Å; D164-K310 VanDerWaalsContact OD1-CD 3.27Å; D164-K310 WeakPolarHBondContact OD1-CD 3.45Å; D164-K310 WeakPolarHBondContact OD1-CE 3.42Å; D164-K310 IonicContact OD1-NZ 2.61Å; D164-K310 PolarHBondContact OD1-NZ 3.13Å; D164-K310 IonicContact OD2-NZ 3.58Å; P308-K310 PolarHBondContact O-N 3.48Å; K310-S312 VanDerWaalsContact C-N 3.31Å; K310-S312 PolarHBondContact O-N 3.15Å; K310-A313 PolarHBondContact O-N 3.25Å; K310-V314 WeakPolarHBondContact O-CG2 3.39Å; K310-V314 PolarHBondContact O-N 2.78Å; K310-V314 VanDerWaalsContact O-N 3.11Å |
| 311 | N | 45.5 | Very low | 54.2 | Low | 116 Ų | 116 | 100 Ų | 100 | 62% | 0.62 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -70.4 | -31.9 | -176.8 | -68.1 | -1.3 | 0 | 0 | 0 | 111.6 | P308 N315 | P308-N311 PolarHBondContact O-N 3.28Å; N311-N315 PolarHBondContact O-N 3.3Å |
| 312 | S | 44.6 | Very low | 52.7 | Low | 60 Ų | 60 | 101.3 Ų | 101.3 | 42% | 0.42 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -71.6 | -35.9 | 174.2 | 57.1 | 0 | 0 | 0 | 0 | 112.6 | P308 K309 K310 V314 N315 F316 | P308-S312 PolarHBondContact O-N 3.04Å; K309-S312 PolarHBondContact O-OG 2.66Å; K310-S312 VanDerWaalsContact C-N 3.31Å; K310-S312 PolarHBondContact O-N 3.15Å; S312-V314 VanDerWaalsContact C-N 3.32Å; S312-N315 PolarHBondContact O-N 3.04Å; S312-F316 WeakPolarHBondContact O-CD2 3.5Å; S312-F316 PolarHBondContact O-N 2.82Å |
| 313 | A | 44.3 | Very low | 51.2 | Low | 49 Ų | 49 | 103.6 Ų | 103.6 | 41% | 0.405 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -63.7 | -40.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | K309 K310 F316 I317 | K309-A313 PolarHBondContact O-N 2.99Å; K310-A313 PolarHBondContact O-N 3.25Å; A313-F316 PolarHBondContact O-N 3.49Å; A313-I317 VanDerWaalsContact O-CG1 3.31Å; A313-I317 WeakPolarHBondContact O-CG1 3.43Å; A313-I317 PolarHBondContact O-N 2.74Å; A313-I317 VanDerWaalsContact O-N 3.11Å |
| 314 | V | 47 | Very low | 50.2 | Low | 62 Ų | 62 | 108.3 Ų | 108.3 | 38% | 0.376 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -65.5 | -40.7 | 174.7 | 176 | 0 | 0 | 0 | 0 | 111.7 | K310 S312 I317 N318 | K310-V314 WeakPolarHBondContact O-CG2 3.39Å; K310-V314 PolarHBondContact O-N 2.78Å; K310-V314 VanDerWaalsContact O-N 3.11Å; S312-V314 VanDerWaalsContact C-N 3.32Å; V314-I317 PolarHBondContact O-N 2.9Å; V314-N318 PolarHBondContact O-N 2.7Å |
| 315 | N | 44.9 | Very low | 49.2 | Very low | 102 Ų | 102 | 108.8 Ų | 108.8 | 55% | 0.545 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -69.3 | -33 | 177.1 | -78.4 | -12.2 | 0 | 0 | 0 | 113.5 | N311 S312 Q319 | N311-N315 PolarHBondContact O-N 3.3Å; S312-N315 PolarHBondContact O-N 3.04Å; N315-Q319 PolarHBondContact O-N 2.8Å |
| 316 | F | 46.9 | Very low | 48.5 | Very low | 148 Ų | 148 | 109.7 Ų | 109.7 | 65% | 0.649 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -68.1 | -37.6 | 173.4 | -97.3 | -78.5 | 0 | 0 | 0 | 111.9 | S312 A313 Q319 Q320 | S312-F316 WeakPolarHBondContact O-CD2 3.5Å; S312-F316 PolarHBondContact O-N 2.82Å; A313-F316 PolarHBondContact O-N 3.49Å; F316-Q319 PolarHBondContact O-N 2.94Å; F316-Q320 PolarHBondContact O-N 3.07Å |
| 317 | I | 50 | Low | 48 | Very low | 100 Ų | 100 | 109.9 Ų | 109.9 | 51% | 0.513 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -70.2 | -37.5 | 176.5 | -65.7 | 164.9 | 0 | 0 | 0 | 111 | A313 V314 Q319 Q320 | A313-I317 VanDerWaalsContact O-CG1 3.31Å; A313-I317 WeakPolarHBondContact O-CG1 3.43Å; A313-I317 PolarHBondContact O-N 2.74Å; A313-I317 VanDerWaalsContact O-N 3.11Å; V314-I317 PolarHBondContact O-N 2.9Å; I317-Q319 PolarHBondContact O-N 3.47Å; I317-Q320 PolarHBondContact O-N 3.2Å |
| 318 | N | 51.7 | Low | 47.9 | Very low | 124 Ų | 124 | 110.3 Ų | 110.3 | 66% | 0.663 | 57% | 0.566 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.7 | -7 | 176.7 | -71.4 | -17 | 0 | 0 | 0 | 114 | V314 | V314-N318 PolarHBondContact O-N 2.7Š|
| 319 | Q | 56.1 | Low | 47.9 | Very low | 168 Ų | 168 | 114.9 Ų | 114.9 | 79% | 0.785 | 58% | 0.584 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104 | -3 | 174.4 | -79.4 | -171.9 | -13.6 | 0 | 0 | 113.7 | N315 F316 I317 | N315-Q319 PolarHBondContact O-N 2.8Å; F316-Q319 PolarHBondContact O-N 2.94Å; I317-Q319 PolarHBondContact O-N 3.47Å |
| 320 | Q | 47.7 | Very low | 47.9 | Very low | 226 Ų | 226 | 108.9 Ų | 108.9 | 100% | 1.056 | 57% | 0.565 | S | S | * | * | trans | -111 | 0 | -177.5 | -155.5 | 173.3 | -14.8 | 0 | 0 | 111.1 | F316 I317 | F316-Q320 PolarHBondContact O-N 3.07Å; I317-Q320 PolarHBondContact O-N 3.2Å |
Retrieved 320 of 320 residues in 147.8 ms
(Link to these results)