| 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 | 60.6 | Low | 79.9 | Confident | 202 Ų | 202 | 80.6 Ų | 80.6 | 100% | 0.995 | 44% | 0.437 | S | S | * | . | 0 | -44.5 | 0 | -76.1 | -171.4 | -80.6 | 0 | 0 | 111.8 | L3 V4 V5 | M1-L3 PolarHBondContact O-N 2.81Å; M1-V4 PolarHBondContact O-N 2.85Å; M1-V5 WeakPolarHBondContact O-CG2 3.31Å; M1-V5 PolarHBondContact O-N 3.36Å; M1-V5 VanDerWaalsContact O-N 3.12Å | |||
| 2 | E | 77.6 | Confident | 80.6 | Confident | 175 Ų | 175 | 81.8 Ų | 81.8 | 82% | 0.818 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -59 | -42.7 | -178.5 | -61.5 | -173.4 | 155.4 | 0 | 0 | 114.5 | V4 V5 A6 | E2-V4 PolarHBondContact O-N 3.22Å; E2-V5 PolarHBondContact O-N 3.31Å; E2-A6 WeakPolarHBondContact O-CB 3.21Å; E2-A6 PolarHBondContact O-N 3.13Å |
| 3 | L | 76.8 | Confident | 81.2 | Confident | 56 Ų | 56 | 77.5 Ų | 77.5 | 29% | 0.293 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -64 | -39 | 178.7 | -166.8 | 77.3 | 0 | 0 | 0 | 112.9 | M1 A6 K7 E194 L199 | M1-L3 PolarHBondContact O-N 2.81Å; L3-A6 PolarHBondContact O-N 3.49Å; L3-K7 WeakPolarHBondContact O-CG 3.2Å; L3-K7 PolarHBondContact O-N 3.46Å; L3-E194 WeakPolarHBondContact CD2-O 3.29Å; L3-L199 HydrophobicContact CD1-CD2 3.89Å |
| 4 | V | 81.1 | Confident | 81.7 | Confident | 79 Ų | 79 | 72.1 Ų | 72.1 | 48% | 0.479 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -68.1 | -41.9 | 178.4 | 176.4 | 0 | 0 | 0 | 0 | 110.2 | M1 E2 A6 K7 V8 M250 | M1-V4 PolarHBondContact O-N 2.85Å; E2-V4 PolarHBondContact O-N 3.22Å; V4-A6 VanDerWaalsContact C-N 3.33Å; V4-A6 PolarHBondContact O-N 3.12Å; V4-K7 PolarHBondContact O-N 3.15Å; V4-V8 WeakPolarHBondContact O-CG2 3.44Å; V4-V8 PolarHBondContact O-N 2.94Å; V4-M250 HydrophobicContact CG1-CE 4.14Å |
| 5 | V | 84.4 | Confident | 82.5 | Confident | 85 Ų | 85 | 70.8 Ų | 70.8 | 52% | 0.515 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -61.5 | -43.1 | 174.2 | 175 | 0 | 0 | 0 | 0 | 110.7 | M1 E2 K7 V8 L9 | M1-V5 WeakPolarHBondContact O-CG2 3.31Å; M1-V5 PolarHBondContact O-N 3.36Å; M1-V5 VanDerWaalsContact O-N 3.12Å; E2-V5 PolarHBondContact O-N 3.31Å; V5-K7 PolarHBondContact O-N 3.12Å; V5-V8 PolarHBondContact O-N 3.27Å; V5-L9 HydrophobicContact CG1-CD1 4.13Å; V5-L9 HydrophobicContact CG1-CG 4.45Å; V5-L9 WeakPolarHBondContact O-CG 3.43Å; V5-L9 PolarHBondContact O-N 3.44Å |
| 6 | A | 80.3 | Confident | 83.2 | Confident | 42 Ų | 42 | 70.7 Ų | 70.7 | 35% | 0.347 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -60.3 | -43.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | E2 L3 V4 V8 L9 C10 L199 | E2-A6 WeakPolarHBondContact O-CB 3.21Å; E2-A6 PolarHBondContact O-N 3.13Å; L3-A6 PolarHBondContact O-N 3.49Å; V4-A6 VanDerWaalsContact C-N 3.33Å; V4-A6 PolarHBondContact O-N 3.12Å; A6-V8 PolarHBondContact O-N 3.5Å; A6-L9 PolarHBondContact O-N 3.42Å; A6-C10 VanDerWaalsContact O-CB 3.22Å; A6-C10 WeakPolarHBondContact O-CB 3.47Å; A6-C10 PolarHBondContact O-N 3.31Å; A6-L199 HydrophobicContact CB-CD2 4.39Å |
| 7 | K | 82.8 | Confident | 83.7 | Confident | 10 Ų | 10 | 71.1 Ų | 71.1 | 4% | 0.043 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -62.8 | -38.9 | 175.5 | -72.6 | -177.6 | 177.9 | -177.2 | 0 | 112.4 | L3 V4 V5 C10 L11 G191 Q193 L199 M250 | L3-K7 WeakPolarHBondContact O-CG 3.2Å; L3-K7 PolarHBondContact O-N 3.46Å; V4-K7 PolarHBondContact O-N 3.15Å; V5-K7 PolarHBondContact O-N 3.12Å; K7-C10 WeakPolarHBondContact O-CB 3.45Å; K7-C10 PolarHBondContact O-N 3.39Å; K7-L11 WeakPolarHBondContact O-CB 3.28Å; K7-L11 PolarHBondContact O-N 3.46Å; K7-G191 PolarHBondContact NZ-O 3.01Å; K7-Q193 WeakPolarHBondContact CE-O 3.3Å; K7-Q193 PolarHBondContact NZ-O 2.83Å; K7-L199 HydrophobicContact CG-CD2 3.71Å; K7-M250 HydrophobicContact CB-SD 3.95Å; K7-M250 HydrophobicContact CD-CE 4.38Å; K7-M250 HydrophobicContact CD-CG 3.78Å; K7-M250 HydrophobicContact CD-SD 3.82Å; K7-M250 HydrophobicContact CG-SD 4.48Å |
| 8 | V | 84.9 | Confident | 84.3 | Confident | 72 Ų | 72 | 67.3 Ų | 67.3 | 44% | 0.436 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -68.5 | -42.5 | 176.4 | 172.5 | 0 | 0 | 0 | 0 | 111.7 | V4 V5 A6 C10 L11 L12 | V4-V8 WeakPolarHBondContact O-CG2 3.44Å; V4-V8 PolarHBondContact O-N 2.94Å; V5-V8 PolarHBondContact O-N 3.27Å; A6-V8 PolarHBondContact O-N 3.5Å; V8-C10 VanDerWaalsContact C-N 3.33Å; V8-L11 WeakPolarHBondContact O-CB 3.44Å; V8-L11 PolarHBondContact O-N 3.02Å; V8-L12 HydrophobicContact CG1-CD1 4.4Å; V8-L12 WeakPolarHBondContact O-CG 3.35Å; V8-L12 PolarHBondContact O-N 3.19Å |
| 9 | L | 85.1 | Confident | 84.8 | Confident | 111 Ų | 111 | 65.7 Ų | 65.7 | 58% | 0.581 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -63.7 | -40.7 | 174.9 | -71.7 | 174.2 | 0 | 0 | 0 | 111.6 | V5 A6 L12 G13 | V5-L9 HydrophobicContact CG1-CD1 4.13Å; V5-L9 HydrophobicContact CG1-CG 4.45Å; V5-L9 WeakPolarHBondContact O-CG 3.43Å; V5-L9 PolarHBondContact O-N 3.44Å; A6-L9 PolarHBondContact O-N 3.42Å; L9-L12 PolarHBondContact O-N 2.61Å; L9-G13 PolarHBondContact O-N 2.76Å |
| 10 | C | 80.4 | Confident | 85.3 | Confident | 7 Ų | 7 | 65.3 Ų | 65.3 | 5% | 0.047 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -57 | -48.6 | 173.1 | 157.5 | 0 | 0 | 0 | 0 | 111.3 | A6 K7 V8 L12 G13 V14 F203 | A6-C10 VanDerWaalsContact O-CB 3.22Å; A6-C10 WeakPolarHBondContact O-CB 3.47Å; A6-C10 PolarHBondContact O-N 3.31Å; K7-C10 WeakPolarHBondContact O-CB 3.45Å; K7-C10 PolarHBondContact O-N 3.39Å; V8-C10 VanDerWaalsContact C-N 3.33Å; C10-L12 PolarHBondContact O-N 3.29Å; C10-G13 PolarHBondContact O-N 3.37Å; C10-V14 PolarHBondContact O-N 3.38Å; C10-F203 HydrophobicContact CB-CD2 3.62Å; C10-F203 HydrophobicContact CB-CE2 3.52Å; C10-F203 HydrophobicContact CB-CG 4.26Å; C10-F203 HydrophobicContact CB-CZ 4.19Å; C10-F203 WeakPolarHBondContact O-CE2 3.45Å; C10-F203 WeakPolarHBondContact SG-CD2 3.16Å; C10-F203 WeakPolarHBondContact SG-CE2 3.15Å |
| 11 | L | 85.4 | Confident | 85.6 | Confident | 48 Ų | 48 | 62.4 Ų | 62.4 | 25% | 0.251 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -56.8 | -49.5 | 177.6 | -174.4 | 158.6 | 0 | 0 | 0 | 111.9 | K7 V8 F15 P243 I246 | K7-L11 WeakPolarHBondContact O-CB 3.28Å; K7-L11 PolarHBondContact O-N 3.46Å; V8-L11 WeakPolarHBondContact O-CB 3.44Å; V8-L11 PolarHBondContact O-N 3.02Å; L11-F15 VanDerWaalsContact O-CB 3.28Å; L11-F15 WeakPolarHBondContact O-CB 3.34Å; L11-F15 PolarHBondContact O-N 3.11Å; L11-F15 VanDerWaalsContact O-N 3.07Å; L11-P243 HydrophobicContact CD1-CB 3.79Å; L11-P243 HydrophobicContact CD2-CB 3.73Å; L11-P243 HydrophobicContact CD2-CG 3.93Å; L11-P243 HydrophobicContact CG-CB 3.51Å; L11-P243 HydrophobicContact CG-CG 3.85Å; L11-I246 HydrophobicContact CB-CD1 4.49Å |
| 12 | L | 88.1 | Confident | 87.1 | Confident | 95 Ų | 95 | 52.8 Ų | 52.8 | 50% | 0.497 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -66.6 | -40.5 | 179.8 | -68.7 | 174.4 | 0 | 0 | 0 | 112.3 | V8 L9 C10 S16 | V8-L12 HydrophobicContact CG1-CD1 4.4Å; V8-L12 WeakPolarHBondContact O-CG 3.35Å; V8-L12 PolarHBondContact O-N 3.19Å; L9-L12 PolarHBondContact O-N 2.61Å; C10-L12 PolarHBondContact O-N 3.29Å; L12-S16 WeakPolarHBondContact O-CB 3.47Å; L12-S16 PolarHBondContact O-N 3.07Å; L12-S16 VanDerWaalsContact O-N 3.09Å; L12-S16 PolarHBondContact O-OG 3.41Å |
| 13 | G | 88.4 | Confident | 87.8 | Confident | 26 Ų | 26 | 46.1 Ų | 46.1 | 27% | 0.268 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -63.2 | -52.8 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112 | L9 C10 S16 L17 | L9-G13 PolarHBondContact O-N 2.76Å; C10-G13 PolarHBondContact O-N 3.37Å; G13-S16 PolarHBondContact O-N 3.36Å; G13-L17 WeakPolarHBondContact O-CB 3.38Å; G13-L17 VanDerWaalsContact O-CG 3.31Å; G13-L17 WeakPolarHBondContact O-CG 3.49Å; G13-L17 PolarHBondContact O-N 3.06Å |
| 14 | V | 88.4 | Confident | 88.5 | Confident | 1 Ų | 1 | 48.4 Ų | 48.4 | 1% | 0.006 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -64.8 | -43.2 | 180 | 163.5 | 0 | 0 | 0 | 0 | 111.5 | C10 S16 L17 M18 F203 I242 | C10-V14 PolarHBondContact O-N 3.38Å; V14-S16 VanDerWaalsContact C-N 3.27Å; V14-S16 PolarHBondContact O-N 2.94Å; V14-L17 PolarHBondContact O-N 3.4Å; V14-M18 HydrophobicContact CG1-CG 4.08Å; V14-M18 HydrophobicContact CG1-SD 3.78Å; V14-M18 WeakPolarHBondContact O-CB 3.44Å; V14-M18 VanDerWaalsContact O-CG 3.26Å; V14-M18 WeakPolarHBondContact O-CG 3.4Å; V14-M18 PolarHBondContact O-N 3.34Å; V14-F203 HydrophobicContact CB-CE2 4.43Å; V14-F203 HydrophobicContact CG2-CD2 4.06Å; V14-F203 HydrophobicContact CG2-CE2 3.36Å; V14-F203 HydrophobicContact CG2-CZ 4.15Å; V14-I242 HydrophobicContact CG1-CB 4.03Å; V14-I242 HydrophobicContact CG1-CD1 3.54Å; V14-I242 HydrophobicContact CG1-CG1 4.31Å; V14-I242 HydrophobicContact CG1-CG2 3.92Å |
| 15 | F | 92.9 | Very high | 88.8 | Confident | 53 Ų | 53 | 45.3 Ų | 45.3 | 23% | 0.232 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -54.8 | -46.2 | 175.1 | 175.5 | -95.4 | 0 | 0 | 0 | 111.8 | L11 L19 S239 L240 P243 | L11-F15 VanDerWaalsContact O-CB 3.28Å; L11-F15 WeakPolarHBondContact O-CB 3.34Å; L11-F15 PolarHBondContact O-N 3.11Å; L11-F15 VanDerWaalsContact O-N 3.07Å; F15-L19 HydrophobicContact CE1-CD2 4.12Å; F15-L19 HydrophobicContact CZ-CD2 4.16Å; F15-L19 VanDerWaalsContact O-CB 3.29Å; F15-L19 WeakPolarHBondContact O-CB 3.43Å; F15-L19 PolarHBondContact O-N 2.86Å; F15-S239 WeakPolarHBondContact CD2-O 3.42Å; F15-L240 HydrophobicContact CD2-CD2 4.17Å; F15-L240 HydrophobicContact CD2-CG 4.46Å; F15-L240 HydrophobicContact CE2-CD2 3.89Å; F15-L240 HydrophobicContact CE2-CG 3.97Å; F15-P243 HydrophobicContact CB-CG 4.17Å; F15-P243 HydrophobicContact CD2-CG 4.43Å |
| 16 | S | 93.1 | Very high | 88.9 | Confident | 69 Ų | 69 | 41.3 Ų | 41.3 | 48% | 0.483 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -68.1 | -43.4 | -179 | -56.5 | 0 | 0 | 0 | 0 | 112.1 | L12 G13 V14 L19 A20 | L12-S16 WeakPolarHBondContact O-CB 3.47Å; L12-S16 PolarHBondContact O-N 3.07Å; L12-S16 VanDerWaalsContact O-N 3.09Å; L12-S16 PolarHBondContact O-OG 3.41Å; G13-S16 PolarHBondContact O-N 3.36Å; V14-S16 VanDerWaalsContact C-N 3.27Å; V14-S16 PolarHBondContact O-N 2.94Å; S16-L19 PolarHBondContact O-N 2.8Å; S16-A20 VanDerWaalsContact O-CB 3.27Å; S16-A20 WeakPolarHBondContact O-CB 3.09Å; S16-A20 PolarHBondContact O-N 3.48Å |
| 17 | L | 92.8 | Very high | 89.3 | Confident | 78 Ų | 78 | 45.7 Ų | 45.7 | 41% | 0.408 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -63.7 | -44.9 | 178.4 | -74.9 | 172.7 | 0 | 0 | 0 | 111.9 | G13 V14 A20 G21 | G13-L17 WeakPolarHBondContact O-CB 3.38Å; G13-L17 VanDerWaalsContact O-CG 3.31Å; G13-L17 WeakPolarHBondContact O-CG 3.49Å; G13-L17 PolarHBondContact O-N 3.06Å; V14-L17 PolarHBondContact O-N 3.4Å; L17-A20 PolarHBondContact O-N 3.37Å; L17-G21 PolarHBondContact O-N 2.84Å |
| 18 | M | 93.4 | Very high | 89.4 | Confident | 2 Ų | 2 | 49.2 Ų | 49.2 | 1% | 0.01 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -63.2 | -47.8 | 176.7 | -72.1 | -175.4 | 76 | 0 | 0 | 111.8 | V14 A20 G21 I22 E210 A214 V238 S239 I242 | V14-M18 HydrophobicContact CG1-CG 4.08Å; V14-M18 HydrophobicContact CG1-SD 3.78Å; V14-M18 WeakPolarHBondContact O-CB 3.44Å; V14-M18 VanDerWaalsContact O-CG 3.26Å; V14-M18 WeakPolarHBondContact O-CG 3.4Å; V14-M18 PolarHBondContact O-N 3.34Å; M18-A20 VanDerWaalsContact C-N 3.31Å; M18-A20 PolarHBondContact O-N 2.87Å; M18-G21 PolarHBondContact O-N 3.2Å; M18-I22 WeakPolarHBondContact O-CG1 3.5Å; M18-I22 PolarHBondContact O-N 3.03Å; M18-E210 HydrophobicContact CE-CG 3.77Å; M18-E210 WeakPolarHBondContact CE-OE1 3.38Å; M18-E210 HydrophobicContact CG-CG 3.55Å; M18-E210 HydrophobicContact SD-CG 3.49Å; M18-E210 WeakPolarHBondContact SD-CG 3.05Å; M18-A214 HydrophobicContact CB-CB 4.36Å; M18-A214 WeakPolarHBondContact O-CB 3.33Å; M18-V238 HydrophobicContact CE-CG1 3.81Å; M18-S239 WeakPolarHBondContact CB-OG 3.12Å; M18-I242 HydrophobicContact SD-CD1 3.77Å; M18-I242 HydrophobicContact SD-CG1 4.21Å |
| 19 | L | 94.4 | Very high | 89 | Confident | 37 Ų | 37 | 47.6 Ų | 47.6 | 19% | 0.194 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -63.1 | -42 | -179 | -172.6 | 63.9 | 0 | 0 | 0 | 111 | F15 S16 I22 L23 V236 S239 | F15-L19 HydrophobicContact CE1-CD2 4.12Å; F15-L19 HydrophobicContact CZ-CD2 4.16Å; F15-L19 VanDerWaalsContact O-CB 3.29Å; F15-L19 WeakPolarHBondContact O-CB 3.43Å; F15-L19 PolarHBondContact O-N 2.86Å; S16-L19 PolarHBondContact O-N 2.8Å; L19-I22 PolarHBondContact O-N 3.37Å; L19-L23 HydrophobicContact CD1-CD1 3.86Å; L19-L23 HydrophobicContact CD1-CG 4.17Å; L19-L23 HydrophobicContact CG-CD1 3.9Å; L19-L23 HydrophobicContact CG-CG 4.45Å; L19-L23 WeakPolarHBondContact O-CB 3.4Å; L19-L23 VanDerWaalsContact O-CG 3.28Å; L19-L23 WeakPolarHBondContact O-CG 3.35Å; L19-L23 PolarHBondContact O-N 3.07Å; L19-V236 HydrophobicContact CD1-CG2 4.06Å; L19-S239 PolarHBondContact N-OG 3.3Å |
| 20 | A | 94.1 | Very high | 88.4 | Confident | 57 Ų | 57 | 47.3 Ų | 47.3 | 47% | 0.471 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -63.1 | -45.3 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | S16 L17 M18 I22 L23 L24 | S16-A20 VanDerWaalsContact O-CB 3.27Å; S16-A20 WeakPolarHBondContact O-CB 3.09Å; S16-A20 PolarHBondContact O-N 3.48Å; L17-A20 PolarHBondContact O-N 3.37Å; M18-A20 VanDerWaalsContact C-N 3.31Å; M18-A20 PolarHBondContact O-N 2.87Å; A20-I22 VanDerWaalsContact C-N 3.3Å; A20-I22 PolarHBondContact O-N 3.41Å; A20-L23 PolarHBondContact O-N 3.25Å; A20-L24 WeakPolarHBondContact O-CB 3.21Å; A20-L24 PolarHBondContact O-N 3Å |
| 21 | G | 92 | Very high | 88.1 | Confident | 5 Ų | 5 | 53.5 Ų | 53.5 | 5% | 0.052 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -58.5 | -38.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113 | L17 M18 P25 V215 | L17-G21 PolarHBondContact O-N 2.84Å; M18-G21 PolarHBondContact O-N 3.2Å; G21-P25 WeakPolarHBondContact O-CD 3.43Å; G21-P25 VanDerWaalsContact O-CG 3.28Å; G21-P25 WeakPolarHBondContact O-CG 3.45Å; G21-V215 VanDerWaalsContact O-CA 3.32Å; G21-V215 WeakPolarHBondContact O-CA 3.49Å |
| 22 | I | 92.4 | Very high | 87.6 | Confident | 0 Ų | 0 | 53.5 Ų | 53.5 | 0% | 0 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -76.4 | -46 | 177.4 | -64.4 | 166.5 | 0 | 0 | 0 | 111.4 | M18 L19 A20 V26 A214 L217 G218 V238 | M18-I22 WeakPolarHBondContact O-CG1 3.5Å; M18-I22 PolarHBondContact O-N 3.03Å; L19-I22 PolarHBondContact O-N 3.37Å; A20-I22 VanDerWaalsContact C-N 3.3Å; A20-I22 PolarHBondContact O-N 3.41Å; I22-V26 VanDerWaalsContact O-CG2 3.31Å; I22-V26 WeakPolarHBondContact O-CG2 3.35Å; I22-A214 WeakPolarHBondContact CA-O 2.93Å; I22-A214 HydrophobicContact CD1-CB 4.47Å; I22-A214 HydrophobicContact CG1-CB 3.84Å; I22-A214 WeakPolarHBondContact CG1-O 3.31Å; I22-L217 HydrophobicContact CD1-CD2 3.85Å; I22-L217 HydrophobicContact CG1-CD2 4.21Å; I22-L217 HydrophobicContact CG1-CG 4.5Å; I22-G218 VanDerWaalsContact O-CA 3.31Å; I22-G218 WeakPolarHBondContact O-CA 3.44Å; I22-V238 HydrophobicContact CD1-CB 4.33Å; I22-V238 HydrophobicContact CD1-CG1 4.47Å |
| 23 | L | 93.3 | Very high | 86.4 | Confident | 35 Ų | 35 | 54.1 Ų | 54.1 | 18% | 0.183 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -77.9 | -30.9 | -171.6 | -66.9 | -178.2 | 0 | 0 | 0 | 113.8 | L19 A20 V26 R27 M228 I232 | L19-L23 HydrophobicContact CD1-CD1 3.86Å; L19-L23 HydrophobicContact CD1-CG 4.17Å; L19-L23 HydrophobicContact CG-CD1 3.9Å; L19-L23 HydrophobicContact CG-CG 4.45Å; L19-L23 WeakPolarHBondContact O-CB 3.4Å; L19-L23 VanDerWaalsContact O-CG 3.28Å; L19-L23 WeakPolarHBondContact O-CG 3.35Å; L19-L23 PolarHBondContact O-N 3.07Å; A20-L23 PolarHBondContact O-N 3.25Å; L23-V26 PolarHBondContact O-N 2.97Å; L23-R27 WeakPolarHBondContact O-CB 3.26Å; L23-R27 WeakPolarHBondContact O-CG 3.16Å; L23-R27 PolarHBondContact O-N 3.31Å; L23-M228 HydrophobicContact CD2-SD 4.27Å; L23-I232 HydrophobicContact CD1-CG1 4.27Å; L23-I232 HydrophobicContact CD2-CG1 3.74Å |
| 24 | L | 91.1 | Very high | 84.9 | Confident | 105 Ų | 105 | 62.8 Ų | 62.8 | 55% | 0.55 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -62.4 | -51.1 | -177.5 | 178.4 | 69.3 | 0 | 0 | 0 | 112 | A20 V26 R27 L28 | A20-L24 WeakPolarHBondContact O-CB 3.21Å; A20-L24 PolarHBondContact O-N 3Å; L24-V26 VanDerWaalsContact C-N 3.3Å; L24-V26 PolarHBondContact O-N 2.88Å; L24-R27 PolarHBondContact O-N 3.31Å; L24-L28 HydrophobicContact CD1-CD1 4.15Å; L24-L28 HydrophobicContact CD1-CG 4.26Å; L24-L28 HydrophobicContact CG-CD1 4.04Å; L24-L28 WeakPolarHBondContact O-CB 3.43Å; L24-L28 VanDerWaalsContact O-CG 3.27Å; L24-L28 WeakPolarHBondContact O-CG 3.39Å; L24-L28 PolarHBondContact O-N 3.45Å |
| 25 | P | 86.6 | Confident | 83.6 | Confident | 13 Ų | 13 | 71.6 Ų | 71.6 | 8% | 0.084 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -58.5 | -39.1 | 174.9 | -24 | 33.8 | 0 | 0 | 0 | 113.3 | G21 M29 V215 V219 | G21-P25 WeakPolarHBondContact O-CD 3.43Å; G21-P25 VanDerWaalsContact O-CG 3.28Å; G21-P25 WeakPolarHBondContact O-CG 3.45Å; P25-M29 WeakPolarHBondContact O-CB 3.42Å; P25-M29 PolarHBondContact O-N 3.13Å; P25-V215 HydrophobicContact CG-CG1 4.08Å; P25-V219 HydrophobicContact CB-CG2 3.83Å; P25-V219 HydrophobicContact CG-CG2 4.3Å |
| 26 | V | 87.4 | Confident | 82.5 | Confident | 1 Ų | 1 | 75.6 Ų | 75.6 | 1% | 0.006 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -67 | -44.5 | 179.9 | -177.2 | 0 | 0 | 0 | 0 | 110.9 | I22 L23 L24 M29 I30 G218 V221 A222 M228 A231 | I22-V26 VanDerWaalsContact O-CG2 3.31Å; I22-V26 WeakPolarHBondContact O-CG2 3.35Å; L23-V26 PolarHBondContact O-N 2.97Å; L24-V26 VanDerWaalsContact C-N 3.3Å; L24-V26 PolarHBondContact O-N 2.88Å; V26-M29 PolarHBondContact O-N 3.35Å; V26-I30 HydrophobicContact CG1-CD1 4.17Å; V26-I30 WeakPolarHBondContact O-CG1 3.34Å; V26-I30 PolarHBondContact O-N 2.87Å; V26-I30 VanDerWaalsContact O-N 3.17Å; V26-G218 WeakPolarHBondContact CG2-O 3.47Å; V26-V221 HydrophobicContact CG2-CB 4.07Å; V26-V221 HydrophobicContact CG2-CG1 3.78Å; V26-A222 HydrophobicContact CG2-CB 4.22Å; V26-M228 HydrophobicContact CB-CE 4.18Å; V26-M228 HydrophobicContact CG1-CE 3.58Å; V26-M228 HydrophobicContact CG1-SD 4.43Å; V26-A231 HydrophobicContact CG1-CB 3.88Å; V26-A231 HydrophobicContact CG2-CB 4.26Å |
| 27 | R | 87.8 | Confident | 81.3 | Confident | 134 Ų | 134 | 73.6 Ų | 73.6 | 51% | 0.506 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -61.9 | -46.5 | 176.6 | -77.5 | -76.5 | 178.4 | 169.1 | 5.4 | 111.6 | L23 L24 M29 I30 Q31 M228 | L23-R27 WeakPolarHBondContact O-CB 3.26Å; L23-R27 WeakPolarHBondContact O-CG 3.16Å; L23-R27 PolarHBondContact O-N 3.31Å; L24-R27 PolarHBondContact O-N 3.31Å; R27-M29 VanDerWaalsContact C-N 3.32Å; R27-M29 PolarHBondContact O-N 3.29Å; R27-I30 PolarHBondContact O-N 3.46Å; R27-Q31 WeakPolarHBondContact O-CG 3.4Å; R27-Q31 PolarHBondContact O-N 2.68Å; R27-M228 HydrophobicContact CB-CE 4.38Å; R27-M228 VanDerWaalsContact CD-CE 3.46Å; R27-M228 HydrophobicContact CG-CE 3.63Å; R27-M228 HydrophobicContact CG-SD 4.34Å |
| 28 | L | 84.3 | Confident | 80.4 | Confident | 84 Ų | 84 | 74.2 Ų | 74.2 | 44% | 0.44 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -60.5 | -43.4 | 178.8 | -70.3 | 172.9 | 0 | 0 | 0 | 111 | L24 I30 Q31 V32 | L24-L28 HydrophobicContact CD1-CD1 4.15Å; L24-L28 HydrophobicContact CD1-CG 4.26Å; L24-L28 HydrophobicContact CG-CD1 4.04Å; L24-L28 WeakPolarHBondContact O-CB 3.43Å; L24-L28 VanDerWaalsContact O-CG 3.27Å; L24-L28 WeakPolarHBondContact O-CG 3.39Å; L24-L28 PolarHBondContact O-N 3.45Å; L28-I30 PolarHBondContact O-N 3.14Å; L28-Q31 PolarHBondContact O-N 3.37Å; L28-V32 WeakPolarHBondContact O-CG2 3.39Å; L28-V32 PolarHBondContact O-N 3.22Å |
| 29 | M | 76.8 | Confident | 79.7 | Confident | 39 Ų | 39 | 84.2 Ų | 84.2 | 19% | 0.192 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -67.9 | -35.9 | -178.6 | -177.8 | 161.9 | 163.4 | 0 | 0 | 113.5 | P25 V26 R27 Q31 V32 Y40 L44 A222 | P25-M29 WeakPolarHBondContact O-CB 3.42Å; P25-M29 PolarHBondContact O-N 3.13Å; V26-M29 PolarHBondContact O-N 3.35Å; R27-M29 VanDerWaalsContact C-N 3.32Å; R27-M29 PolarHBondContact O-N 3.29Å; M29-Q31 PolarHBondContact O-N 2.93Å; M29-V32 PolarHBondContact O-N 2.9Å; M29-Y40 HydrophobicContact CB-CE1 3.98Å; M29-Y40 HydrophobicContact CG-CE1 3.88Å; M29-Y40 HydrophobicContact SD-CE1 4.39Å; M29-L44 HydrophobicContact SD-CD1 4.28Å; M29-A222 HydrophobicContact CB-CB 3.87Å; M29-A222 WeakPolarHBondContact CE-O 3.44Å; M29-A222 HydrophobicContact CG-CB 4.12Å; M29-A222 HydrophobicContact SD-CB 3.38Å; M29-A222 WeakPolarHBondContact SD-CB 3.49Å |
| 30 | I | 73.9 | Confident | 78.8 | Confident | 104 Ų | 104 | 85.1 Ų | 85.1 | 53% | 0.533 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -66.5 | -28.2 | 176.8 | -69 | 172.2 | 0 | 0 | 0 | 111.7 | V26 R27 L28 M228 | V26-I30 HydrophobicContact CG1-CD1 4.17Å; V26-I30 WeakPolarHBondContact O-CG1 3.34Å; V26-I30 PolarHBondContact O-N 2.87Å; V26-I30 VanDerWaalsContact O-N 3.17Å; R27-I30 PolarHBondContact O-N 3.46Å; L28-I30 PolarHBondContact O-N 3.14Å; I30-M228 HydrophobicContact CD1-CB 4.27Å; I30-M228 HydrophobicContact CD1-CE 3.6Å |
| 31 | Q | 73.6 | Confident | 77.9 | Confident | 138 Ų | 138 | 89.9 Ų | 89.9 | 65% | 0.645 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -87.3 | -9 | -176.8 | -70.7 | 176.7 | -20.1 | 0 | 0 | 114.1 | R27 L28 M29 D33 | R27-Q31 WeakPolarHBondContact O-CG 3.4Å; R27-Q31 PolarHBondContact O-N 2.68Å; L28-Q31 PolarHBondContact O-N 3.37Å; M29-Q31 PolarHBondContact O-N 2.93Å; Q31-D33 PolarHBondContact O-N 2.98Å |
| 32 | V | 74.4 | Confident | 77.4 | Confident | 47 Ų | 47 | 94 Ų | 94 | 29% | 0.285 | 44% | 0.438 | S | S | . | . | S | Bend | trans | -78.5 | 119.6 | -177.9 | 172 | 0 | 0 | 0 | 0 | 110.5 | L28 M29 K36 Y40 | L28-V32 WeakPolarHBondContact O-CG2 3.39Å; L28-V32 PolarHBondContact O-N 3.22Å; M29-V32 PolarHBondContact O-N 2.9Å; V32-K36 HydrophobicContact CG1-CB 4.02Å; V32-Y40 HydrophobicContact CB-CD1 4.45Å; V32-Y40 HydrophobicContact CG1-CD1 4.27Å; V32-Y40 HydrophobicContact CG1-CG 4.07Å; V32-Y40 HydrophobicContact CG2-CD1 4.21Å; V32-Y40 HydrophobicContact CG2-CD2 3.95Å; V32-Y40 HydrophobicContact CG2-CE1 4.17Å; V32-Y40 HydrophobicContact CG2-CE2 3.93Å; V32-Y40 HydrophobicContact CG2-CG 4.09Å |
| 33 | D | 63.1 | Low | 76.9 | Confident | 109 Ų | 109 | 96.6 Ų | 96.6 | 58% | 0.583 | 46% | 0.46 | S | S | * | . | trans | -54.9 | 147.4 | 174.4 | -70.1 | -47.1 | 0 | 0 | 0 | 113.3 | Q31 E35 K36 A37 | Q31-D33 PolarHBondContact O-N 2.98Å; D33-E35 PolarHBondContact O-N 3.4Å; D33-E35 VanDerWaalsContact O-N 3.12Å; D33-K36 PolarHBondContact O-N 3.29Å; D33-A37 PolarHBondContact O-N 3.46Å | ||
| 34 | F | 57.6 | Low | 76.3 | Confident | 208 Ų | 208 | 96 Ų | 96 | 91% | 0.912 | 46% | 0.457 | S | S | * | . | G | 310 helix | trans | -53.1 | -34.1 | 179.8 | -82.9 | -87.3 | 0 | 0 | 0 | 114 | K36 A37 | F34-K36 VanDerWaalsContact C-N 3.34Å; F34-K36 PolarHBondContact O-N 3.22Å; F34-A37 VanDerWaalsContact O-CB 3.26Å; F34-A37 WeakPolarHBondContact O-CB 3.46Å; F34-A37 PolarHBondContact O-N 3.02Å |
| 35 | E | 60.2 | Low | 75.8 | Confident | 185 Ų | 185 | 91.4 Ų | 91.4 | 86% | 0.864 | 44% | 0.435 | S | S | * | . | G | 310 helix | trans | -67.3 | -30.4 | 179.3 | -74.8 | -113.5 | 115.7 | 0 | 0 | 113.5 | D33 | D33-E35 PolarHBondContact O-N 3.4Å; D33-E35 VanDerWaalsContact O-N 3.12Å |
| 36 | K | 69.4 | Low | 75.7 | Confident | 137 Ų | 137 | 91.8 Ų | 91.8 | 60% | 0.596 | 44% | 0.436 | S | S | * | . | G | 310 helix | trans | -93.2 | -7.5 | -179 | -66.7 | 175.4 | -175 | 166.5 | 0 | 112.8 | V32 D33 F34 P38 R39 Y40 | V32-K36 HydrophobicContact CG1-CB 4.02Å; D33-K36 PolarHBondContact O-N 3.29Å; F34-K36 VanDerWaalsContact C-N 3.34Å; F34-K36 PolarHBondContact O-N 3.22Å; K36-P38 VanDerWaalsContact C-CD 3.46Å; K36-R39 PolarHBondContact O-N 2.68Å; K36-Y40 WeakPolarHBondContact O-CB 2.96Å; K36-Y40 PolarHBondContact O-N 3.43Å |
| 37 | A | 68.1 | Low | 75.5 | Confident | 28 Ų | 28 | 95 Ų | 95 | 23% | 0.231 | 46% | 0.458 | C | S | . | . | H | α-helix | trans | -50.4 | -44 | -176.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | D33 F34 R41 | D33-A37 PolarHBondContact O-N 3.46Å; F34-A37 VanDerWaalsContact O-CB 3.26Å; F34-A37 WeakPolarHBondContact O-CB 3.46Å; F34-A37 PolarHBondContact O-N 3.02Å; A37-R41 WeakPolarHBondContact O-CB 3.32Å; A37-R41 VanDerWaalsContact O-CG 3.27Å; A37-R41 WeakPolarHBondContact O-CG 3.37Å; A37-R41 PolarHBondContact O-N 3.44Å |
| 38 | P | 73.8 | Confident | 75.3 | Confident | 90 Ų | 90 | 89.3 Ų | 89.3 | 58% | 0.584 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -70.7 | -41.1 | -177.9 | 25.2 | -32.6 | 0 | 0 | 0 | 112.9 | K36 Y40 R41 K42 | K36-P38 VanDerWaalsContact C-CD 3.46Å; P38-Y40 VanDerWaalsContact C-N 3.35Å; P38-R41 PolarHBondContact O-N 2.93Å; P38-K42 PolarHBondContact O-N 3.39Å; P38-K42 VanDerWaalsContact O-N 3.12Å |
| 39 | R | 78.6 | Confident | 75.5 | Confident | 213 Ų | 213 | 85.5 Ų | 85.5 | 80% | 0.804 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -65.9 | -40 | 175.9 | -71.4 | -177.6 | -178.3 | 159.3 | 2 | 111.3 | K36 K42 A43 | K36-R39 PolarHBondContact O-N 2.68Å; R39-K42 PolarHBondContact O-N 3.47Å; R39-A43 PolarHBondContact O-N 2.9Å |
| 40 | Y | 76.3 | Confident | 76.1 | Confident | 55 Ų | 55 | 86.6 Ų | 86.6 | 22% | 0.216 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -64.9 | -43.3 | 177.1 | -177.1 | -106 | 0 | 0 | 0 | 112.2 | M29 V32 K36 P38 K42 A43 L44 | M29-Y40 HydrophobicContact CB-CE1 3.98Å; M29-Y40 HydrophobicContact CG-CE1 3.88Å; M29-Y40 HydrophobicContact SD-CE1 4.39Å; V32-Y40 HydrophobicContact CB-CD1 4.45Å; V32-Y40 HydrophobicContact CG1-CD1 4.27Å; V32-Y40 HydrophobicContact CG1-CG 4.07Å; V32-Y40 HydrophobicContact CG2-CD1 4.21Å; V32-Y40 HydrophobicContact CG2-CD2 3.95Å; V32-Y40 HydrophobicContact CG2-CE1 4.17Å; V32-Y40 HydrophobicContact CG2-CE2 3.93Å; V32-Y40 HydrophobicContact CG2-CG 4.09Å; K36-Y40 WeakPolarHBondContact O-CB 2.96Å; K36-Y40 PolarHBondContact O-N 3.43Å; P38-Y40 VanDerWaalsContact C-N 3.35Å; Y40-K42 VanDerWaalsContact C-N 3.33Å; Y40-K42 PolarHBondContact O-N 2.83Å; Y40-A43 PolarHBondContact O-N 3Å; Y40-L44 HydrophobicContact CD1-CD1 3.8Å; Y40-L44 HydrophobicContact CD1-CG 4.28Å; Y40-L44 HydrophobicContact CE1-CD1 3.27Å; Y40-L44 HydrophobicContact CE1-CD2 4.5Å; Y40-L44 HydrophobicContact CE1-CG 3.91Å; Y40-L44 HydrophobicContact CE2-CD2 4.48Å; Y40-L44 HydrophobicContact CE2-CG 4.34Å; Y40-L44 WeakPolarHBondContact O-CG 3.34Å; Y40-L44 PolarHBondContact O-N 3.31Å |
| 41 | R | 75.9 | Confident | 76.8 | Confident | 157 Ų | 157 | 82.4 Ų | 82.4 | 59% | 0.592 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -58.8 | -42.7 | 173.8 | -77 | 175.4 | -176.3 | -97.8 | -0.4 | 112.2 | A37 P38 L44 A45 | A37-R41 WeakPolarHBondContact O-CB 3.32Å; A37-R41 VanDerWaalsContact O-CG 3.27Å; A37-R41 WeakPolarHBondContact O-CG 3.37Å; A37-R41 PolarHBondContact O-N 3.44Å; P38-R41 PolarHBondContact O-N 2.93Å; R41-L44 PolarHBondContact O-N 2.81Å; R41-A45 PolarHBondContact O-N 2.87Å |
| 42 | K | 81.5 | Confident | 77.5 | Confident | 91 Ų | 91 | 76 Ų | 76 | 40% | 0.396 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -63.1 | -47.4 | 174.8 | -179.1 | 166.8 | 177 | 146.1 | 0 | 111.8 | P38 R39 Y40 L44 A45 L46 D293 | P38-K42 PolarHBondContact O-N 3.39Å; P38-K42 VanDerWaalsContact O-N 3.12Å; R39-K42 PolarHBondContact O-N 3.47Å; Y40-K42 VanDerWaalsContact C-N 3.33Å; Y40-K42 PolarHBondContact O-N 2.83Å; K42-L44 VanDerWaalsContact C-N 3.32Å; K42-L44 PolarHBondContact O-N 3.01Å; K42-A45 PolarHBondContact O-N 3.44Å; K42-L46 HydrophobicContact CG-CD1 4.48Å; K42-L46 WeakPolarHBondContact O-CG 3.48Å; K42-L46 PolarHBondContact O-N 3.06Å; K42-D293 WeakPolarHBondContact CD-OD2 3.31Å; K42-D293 WeakPolarHBondContact CE-OD2 3.39Å; K42-D293 IonicContact NZ-OD1 3.83Å; K42-D293 PolarHBondContact NZ-OD1 3.49Å; K42-D293 IonicContact NZ-OD2 2.9Å; K42-D293 PolarHBondContact NZ-OD2 3.02Å |
| 43 | A | 82.3 | Confident | 78.4 | Confident | 56 Ų | 56 | 73.7 Ų | 73.7 | 46% | 0.463 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -59.8 | -41.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | R39 Y40 L46 C47 | R39-A43 PolarHBondContact O-N 2.9Å; Y40-A43 PolarHBondContact O-N 3Å; A43-L46 PolarHBondContact O-N 3.37Å; A43-C47 WeakPolarHBondContact O-CB 3.42Å; A43-C47 PolarHBondContact O-N 3.16Å |
| 44 | L | 78.8 | Confident | 79.7 | Confident | 21 Ų | 21 | 69 Ų | 69 | 11% | 0.11 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -64.6 | -40 | 175.4 | -76.1 | -179.2 | 0 | 0 | 0 | 112.9 | M29 Y40 R41 K42 L46 C47 N48 V219 | M29-L44 HydrophobicContact SD-CD1 4.28Å; Y40-L44 HydrophobicContact CD1-CD1 3.8Å; Y40-L44 HydrophobicContact CD1-CG 4.28Å; Y40-L44 HydrophobicContact CE1-CD1 3.27Å; Y40-L44 HydrophobicContact CE1-CD2 4.5Å; Y40-L44 HydrophobicContact CE1-CG 3.91Å; Y40-L44 HydrophobicContact CE2-CD2 4.48Å; Y40-L44 HydrophobicContact CE2-CG 4.34Å; Y40-L44 WeakPolarHBondContact O-CG 3.34Å; Y40-L44 PolarHBondContact O-N 3.31Å; R41-L44 PolarHBondContact O-N 2.81Å; K42-L44 VanDerWaalsContact C-N 3.32Å; K42-L44 PolarHBondContact O-N 3.01Å; L44-L46 VanDerWaalsContact C-N 3.33Å; L44-C47 PolarHBondContact O-N 2.89Å; L44-N48 WeakPolarHBondContact O-CB 3.27Å; L44-N48 PolarHBondContact O-N 3.26Å; L44-V219 HydrophobicContact CD2-CG1 4.35Å; L44-V219 HydrophobicContact CD2-CG2 4.28Å |
| 45 | A | 80.6 | Confident | 81.3 | Confident | 10 Ų | 10 | 59.2 Ų | 59.2 | 8% | 0.083 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -63.9 | -39.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | R41 K42 S49 | R41-A45 PolarHBondContact O-N 2.87Å; K42-A45 PolarHBondContact O-N 3.44Å; A45-S49 WeakPolarHBondContact O-CB 3.26Å; A45-S49 PolarHBondContact O-N 2.91Å; A45-S49 PolarHBondContact O-OG 3.42Å |
| 46 | L | 85.8 | Confident | 82.8 | Confident | 21 Ų | 21 | 52 Ų | 52 | 11% | 0.11 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -68.5 | -41.2 | 174.7 | -64.2 | 179.2 | 0 | 0 | 0 | 112.2 | K42 A43 L44 S49 F50 L296 K297 F300 | K42-L46 HydrophobicContact CG-CD1 4.48Å; K42-L46 WeakPolarHBondContact O-CG 3.48Å; K42-L46 PolarHBondContact O-N 3.06Å; A43-L46 PolarHBondContact O-N 3.37Å; L44-L46 VanDerWaalsContact C-N 3.33Å; L46-S49 PolarHBondContact O-N 3.46Å; L46-F50 WeakPolarHBondContact O-CB 3.47Å; L46-F50 PolarHBondContact O-N 3.32Å; L46-L296 HydrophobicContact CD1-CD2 3.77Å; L46-L296 HydrophobicContact CD1-CG 4.32Å; L46-L296 HydrophobicContact CD2-CB 4.19Å; L46-L296 HydrophobicContact CD2-CD2 3.81Å; L46-L296 HydrophobicContact CD2-CG 3.66Å; L46-L296 HydrophobicContact CG-CD2 4.42Å; L46-K297 HydrophobicContact CD2-CG 4.27Å; L46-F300 HydrophobicContact CB-CD1 3.84Å; L46-F300 HydrophobicContact CB-CD2 4.48Å; L46-F300 HydrophobicContact CB-CE1 3.95Å; L46-F300 HydrophobicContact CB-CG 4.13Å; L46-F300 HydrophobicContact CB-CZ 4.3Å; L46-F300 HydrophobicContact CD1-CE2 4.13Å; L46-F300 HydrophobicContact CD1-CZ 4.08Å; L46-F300 HydrophobicContact CD2-CD2 4.01Å; L46-F300 HydrophobicContact CD2-CE2 4.31Å; L46-F300 HydrophobicContact CD2-CG 4.25Å; L46-F300 WeakPolarHBondContact O-CD1 3.13Å |
| 47 | C | 83 | Confident | 83.9 | Confident | 69 Ų | 69 | 45.5 Ų | 45.5 | 47% | 0.466 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -62 | -43.8 | 175 | -171 | 0 | 0 | 0 | 0 | 111.7 | A43 L44 F50 G51 | A43-C47 WeakPolarHBondContact O-CB 3.42Å; A43-C47 PolarHBondContact O-N 3.16Å; L44-C47 PolarHBondContact O-N 2.89Å; C47-F50 WeakPolarHBondContact O-CB 3.23Å; C47-F50 PolarHBondContact O-N 3.02Å; C47-G51 PolarHBondContact O-N 3.4Å |
| 48 | N | 83.3 | Confident | 84.9 | Confident | 14 Ų | 14 | 44.4 Ų | 44.4 | 8% | 0.075 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -66.3 | -38.1 | 175.4 | -80.8 | 10.3 | 0 | 0 | 0 | 112.3 | L44 F50 G51 G52 V219 K223 E287 | L44-N48 WeakPolarHBondContact O-CB 3.27Å; L44-N48 PolarHBondContact O-N 3.26Å; N48-F50 VanDerWaalsContact C-N 3.34Å; N48-G51 PolarHBondContact O-N 3.03Å; N48-G52 PolarHBondContact O-N 3.48Å; N48-V219 WeakPolarHBondContact ND2-CG1 3.3Å; N48-V219 WeakPolarHBondContact OD1-CG1 3.29Å; N48-K223 PolarHBondContact ND2-NZ 3.36Å; N48-E287 HydrophobicContact CB-CG 3.75Å; N48-E287 WeakPolarHBondContact CB-OE1 3.45Å; N48-E287 PolarHBondContact ND2-OE1 3.32Å |
| 49 | S | 88.9 | Confident | 85.8 | Confident | 4 Ų | 4 | 40.1 Ų | 40.1 | 3% | 0.028 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -63.3 | -43.5 | 174.8 | -58.4 | 0 | 0 | 0 | 0 | 110.8 | A45 L46 G52 G53 K297 L301 | A45-S49 WeakPolarHBondContact O-CB 3.26Å; A45-S49 PolarHBondContact O-N 2.91Å; A45-S49 PolarHBondContact O-OG 3.42Å; L46-S49 PolarHBondContact O-N 3.46Å; S49-G52 PolarHBondContact O-N 2.83Å; S49-G53 PolarHBondContact O-N 3.38Å; S49-K297 WeakPolarHBondContact CB-O 3.38Å; S49-K297 WeakPolarHBondContact OG-CB 3.29Å; S49-K297 WeakPolarHBondContact OG-CG 3.31Å; S49-L301 VanDerWaalsContact O-CA 3.3Å; S49-L301 WeakPolarHBondContact O-CA 3.27Å; S49-L301 WeakPolarHBondContact O-CD1 3.15Å |
| 50 | F | 90 | Very high | 86.5 | Confident | 62 Ų | 62 | 34 Ų | 34 | 27% | 0.272 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -59.1 | -47.4 | 171.2 | 178.5 | -86.9 | 0 | 0 | 0 | 112 | L46 C47 N48 G52 G53 V54 F300 L303 V307 | L46-F50 WeakPolarHBondContact O-CB 3.47Å; L46-F50 PolarHBondContact O-N 3.32Å; C47-F50 WeakPolarHBondContact O-CB 3.23Å; C47-F50 PolarHBondContact O-N 3.02Å; N48-F50 VanDerWaalsContact C-N 3.34Å; F50-G52 VanDerWaalsContact C-N 3.32Å; F50-G52 PolarHBondContact O-N 3.48Å; F50-G53 WeakPolarHBondContact O-CA 3.41Å; F50-G53 PolarHBondContact O-N 2.82Å; F50-V54 HydrophobicContact CD1-CG2 3.92Å; F50-V54 HydrophobicContact CE1-CG2 3.56Å; F50-V54 HydrophobicContact CZ-CG2 4.11Å; F50-V54 WeakPolarHBondContact O-CG2 3.36Å; F50-V54 PolarHBondContact O-N 2.94Å; F50-F300 VanDerWaalsContact CA-O 3.3Å; F50-F300 WeakPolarHBondContact CA-O 3.31Å; F50-F300 HydrophobicContact CB-CB 4.28Å; F50-F300 HydrophobicContact CB-CD1 4.14Å; F50-L303 HydrophobicContact CD2-CB 4.34Å; F50-L303 HydrophobicContact CD2-CD2 4.27Å; F50-L303 HydrophobicContact CD2-CG 4.26Å; F50-L303 HydrophobicContact CE2-CD2 4.25Å; F50-L303 HydrophobicContact CE2-CG 4.05Å; F50-V307 HydrophobicContact CE2-CB 4.44Å; F50-V307 HydrophobicContact CE2-CG2 4.13Å; F50-V307 HydrophobicContact CZ-CB 4.2Å; F50-V307 HydrophobicContact CZ-CG1 4.32Å; F50-V307 HydrophobicContact CZ-CG2 4.24Å |
| 51 | G | 87.1 | Confident | 87.2 | Confident | 16 Ų | 16 | 33.6 Ų | 33.6 | 17% | 0.165 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -56.4 | -42.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | C47 N48 G53 V54 F55 | C47-G51 PolarHBondContact O-N 3.4Å; N48-G51 PolarHBondContact O-N 3.03Å; G51-G53 PolarHBondContact O-N 3.24Å; G51-V54 WeakPolarHBondContact O-CB 3.19Å; G51-V54 PolarHBondContact O-N 2.86Å; G51-V54 VanDerWaalsContact O-N 3.15Å; G51-F55 WeakPolarHBondContact O-CD1 3.4Å; G51-F55 PolarHBondContact O-N 3.42Å |
| 52 | G | 89.6 | Confident | 87.8 | Confident | 2 Ų | 2 | 27.3 Ų | 27.3 | 2% | 0.021 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -58.8 | -34.8 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | N48 S49 F50 F55 L56 | N48-G52 PolarHBondContact O-N 3.48Å; S49-G52 PolarHBondContact O-N 2.83Å; F50-G52 VanDerWaalsContact C-N 3.32Å; F50-G52 PolarHBondContact O-N 3.48Å; G52-F55 PolarHBondContact O-N 3.46Å; G52-L56 WeakPolarHBondContact O-CB 3.38Å; G52-L56 PolarHBondContact O-N 3.41Å |
| 53 | G | 92.5 | Very high | 88.2 | Confident | 0 Ų | 0 | 23.5 Ų | 23.5 | 0% | 0 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -70 | -44.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | S49 F50 G51 F55 L56 A57 L301 Y305 | S49-G53 PolarHBondContact O-N 3.38Å; F50-G53 WeakPolarHBondContact O-CA 3.41Å; F50-G53 PolarHBondContact O-N 2.82Å; G51-G53 PolarHBondContact O-N 3.24Å; G53-F55 VanDerWaalsContact C-N 3.3Å; G53-F55 PolarHBondContact O-N 3.42Å; G53-L56 WeakPolarHBondContact O-CB 3.24Å; G53-L56 PolarHBondContact O-N 2.85Å; G53-A57 PolarHBondContact O-N 2.71Å; G53-L301 VanDerWaalsContact CA-O 3.24Å; G53-L301 WeakPolarHBondContact CA-O 3.48Å; G53-L301 VanDerWaalsContact N-CD1 3.29Å; G53-Y305 VanDerWaalsContact C-N 3.31Å; G53-Y305 VanDerWaalsContact O-CA 3.25Å; G53-Y305 WeakPolarHBondContact O-CA 3.34Å; G53-Y305 PolarHBondContact O-N 3.36Å |
| 54 | V | 90.8 | Very high | 88.7 | Confident | 9 Ų | 9 | 21.5 Ų | 21.5 | 6% | 0.055 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -58.6 | -43.4 | 173.6 | 178.7 | 0 | 0 | 0 | 0 | 110.3 | F50 G51 L56 A57 T58 L212 G304 L308 | F50-V54 HydrophobicContact CD1-CG2 3.92Å; F50-V54 HydrophobicContact CE1-CG2 3.56Å; F50-V54 HydrophobicContact CZ-CG2 4.11Å; F50-V54 WeakPolarHBondContact O-CG2 3.36Å; F50-V54 PolarHBondContact O-N 2.94Å; G51-V54 WeakPolarHBondContact O-CB 3.19Å; G51-V54 PolarHBondContact O-N 2.86Å; G51-V54 VanDerWaalsContact O-N 3.15Å; V54-L56 PolarHBondContact O-N 2.81Å; V54-A57 PolarHBondContact O-N 3.14Å; V54-T58 PolarHBondContact O-N 2.8Å; V54-T58 PolarHBondContact O-OG1 3.34Å; V54-T58 VanDerWaalsContact O-OG1 3.1Å; V54-L212 HydrophobicContact CG1-CD1 3.51Å; V54-G304 WeakPolarHBondContact CG2-O 3.39Å; V54-L308 HydrophobicContact CG1-CB 4.21Å; V54-L308 HydrophobicContact CG1-CD1 4.4Å; V54-L308 HydrophobicContact CG1-CD2 3.87Å; V54-L308 HydrophobicContact CG1-CG 4.38Å; V54-L308 WeakPolarHBondContact O-CD2 3.33Å |
| 55 | F | 90.2 | Very high | 89.4 | Confident | 4 Ų | 4 | 22.3 Ų | 22.3 | 2% | 0.018 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -67.6 | -37.5 | 178.9 | -77.6 | 40.8 | 0 | 0 | 0 | 111.7 | G51 G52 G53 A57 T58 C59 L212 A213 A216 F275 T279 I283 | G51-F55 WeakPolarHBondContact O-CD1 3.4Å; G51-F55 PolarHBondContact O-N 3.42Å; G52-F55 PolarHBondContact O-N 3.46Å; G53-F55 VanDerWaalsContact C-N 3.3Å; G53-F55 PolarHBondContact O-N 3.42Å; F55-A57 VanDerWaalsContact C-N 3.31Å; F55-A57 PolarHBondContact O-N 3.02Å; F55-T58 WeakPolarHBondContact O-CB 3.22Å; F55-T58 PolarHBondContact O-N 3.47Å; F55-T58 VanDerWaalsContact O-N 3.16Å; F55-C59 PolarHBondContact O-N 2.95Å; F55-C59 PolarHBondContact O-SG 3.22Å; F55-L212 HydrophobicContact CE1-CB 3.72Å; F55-L212 VanDerWaalsContact CZ-C 3.47Å; F55-L212 HydrophobicContact CZ-CB 4.38Å; F55-L212 WeakPolarHBondContact CZ-O 3.2Å; F55-A213 HydrophobicContact CE2-CB 4.17Å; F55-A213 HydrophobicContact CZ-CB 4.16Å; F55-A216 HydrophobicContact CE2-CB 4.38Å; F55-A216 HydrophobicContact CZ-CB 3.74Å; F55-F275 HydrophobicContact CB-CE1 4.04Å; F55-F275 HydrophobicContact CB-CZ 3.97Å; F55-F275 HydrophobicContact CD1-CZ 4.47Å; F55-F275 HydrophobicContact CD2-CE1 4.21Å; F55-F275 AromaticContact CD2-CE2 3.95Å; F55-F275 HydrophobicContact CD2-CE2 3.95Å; F55-F275 AromaticContact CD2-CZ 3.48Å; F55-F275 HydrophobicContact CD2-CZ 3.48Å; F55-F275 VanDerWaalsContact CD2-CZ 3.48Å; F55-F275 HydrophobicContact CE2-CE2 4.25Å; F55-F275 HydrophobicContact CE2-CZ 4.16Å; F55-F275 HydrophobicContact CG-CE1 4.29Å; F55-F275 AromaticContact CG-CZ 3.71Å; F55-F275 HydrophobicContact CG-CZ 3.71Å; F55-F275 WeakPolarHBondContact O-CE1 3.47Å; F55-T279 HydrophobicContact CB-CG2 3.76Å; F55-I283 HydrophobicContact CD2-CD1 3.32Å; F55-I283 HydrophobicContact CE2-CD1 3.09Å; F55-I283 HydrophobicContact CG-CD1 4.28Å; F55-I283 HydrophobicContact CZ-CD1 3.86Å |
| 56 | L | 93.2 | Very high | 89.8 | Confident | 33 Ų | 33 | 23.2 Ų | 23.2 | 17% | 0.173 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -61.7 | -42.2 | 174.3 | -170.4 | 70 | 0 | 0 | 0 | 111.2 | G52 G53 V54 C59 F60 T279 F280 Y305 | G52-L56 WeakPolarHBondContact O-CB 3.38Å; G52-L56 PolarHBondContact O-N 3.41Å; G53-L56 WeakPolarHBondContact O-CB 3.24Å; G53-L56 PolarHBondContact O-N 2.85Å; V54-L56 PolarHBondContact O-N 2.81Å; L56-C59 WeakPolarHBondContact O-CB 3.36Å; L56-C59 PolarHBondContact O-N 2.86Å; L56-F60 HydrophobicContact CD1-CD2 3.92Å; L56-F60 HydrophobicContact CD1-CE2 3.61Å; L56-F60 HydrophobicContact CG-CD2 4.23Å; L56-F60 HydrophobicContact CG-CE2 4.39Å; L56-F60 WeakPolarHBondContact O-CD2 3.44Å; L56-F60 PolarHBondContact O-N 3.01Å; L56-T279 HydrophobicContact CB-CG2 4.34Å; L56-T279 HydrophobicContact CD1-CG2 4.45Å; L56-F280 HydrophobicContact CD1-CE1 4.41Å; L56-F280 HydrophobicContact CD1-CE2 3.61Å; L56-F280 HydrophobicContact CD1-CZ 3.52Å; L56-Y305 HydrophobicContact CB-CD2 4.09Å; L56-Y305 HydrophobicContact CD2-CD2 4.07Å; L56-Y305 HydrophobicContact CG-CD2 4.06Å; L56-Y305 HydrophobicContact CG-CE2 4.34Å |
| 57 | A | 92 | Very high | 90.1 | Very high | 0 Ų | 0 | 22.2 Ų | 22.2 | 0% | 0 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -65.8 | -38.8 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | G53 V54 F55 C59 F60 N61 Y305 L308 | G53-A57 PolarHBondContact O-N 2.71Å; V54-A57 PolarHBondContact O-N 3.14Å; F55-A57 VanDerWaalsContact C-N 3.31Å; F55-A57 PolarHBondContact O-N 3.02Å; A57-C59 VanDerWaalsContact C-N 3.34Å; A57-C59 PolarHBondContact O-N 3.24Å; A57-F60 PolarHBondContact O-N 2.84Å; A57-N61 WeakPolarHBondContact O-CA 3.4Å; A57-N61 WeakPolarHBondContact O-CB 3.41Å; A57-N61 PolarHBondContact O-N 3.21Å; A57-Y305 HydrophobicContact CB-CD2 3.54Å; A57-Y305 HydrophobicContact CB-CE2 3.79Å; A57-Y305 HydrophobicContact CB-CG 4.06Å; A57-L308 HydrophobicContact CB-CB 3.78Å; A57-L308 HydrophobicContact CB-CD2 3.7Å; A57-L308 HydrophobicContact CB-CG 4.11Å |
| 58 | T | 89.9 | Confident | 90.7 | Very high | 5 Ų | 5 | 24 Ų | 24 | 3% | 0.031 | 13% | 0.128 | C | C | . | . | I | π-helix | trans | -59.8 | -44.4 | 173.7 | -61.4 | 0 | 0 | 0 | 0 | 111.1 | V54 F55 A62 L63 H209 F275 L308 | V54-T58 PolarHBondContact O-N 2.8Å; V54-T58 PolarHBondContact O-OG1 3.34Å; V54-T58 VanDerWaalsContact O-OG1 3.1Å; F55-T58 WeakPolarHBondContact O-CB 3.22Å; F55-T58 PolarHBondContact O-N 3.47Å; F55-T58 VanDerWaalsContact O-N 3.16Å; T58-A62 HydrophobicContact CG2-CB 4.49Å; T58-A62 WeakPolarHBondContact O-CB 3.48Å; T58-A62 PolarHBondContact O-N 3.08Å; T58-L63 HydrophobicContact CG2-CD1 4.02Å; T58-L63 HydrophobicContact CG2-CG 3.96Å; T58-L63 PolarHBondContact O-N 3.24Å; T58-H209 HydrophobicContact CG2-CB 3.65Å; T58-F275 HydrophobicContact CG2-CD1 4.5Å; T58-F275 HydrophobicContact CG2-CE1 3.75Å; T58-F275 HydrophobicContact CG2-CZ 3.93Å; T58-L308 WeakPolarHBondContact OG1-CD2 3.26Å |
| 59 | C | 92.3 | Very high | 91.1 | Very high | 0 Ų | 0 | 28.3 Ų | 28.3 | 0% | 0 | 15% | 0.151 | C | C | . | . | I | π-helix | trans | -55.9 | -56.1 | 178 | -68.5 | 0 | 0 | 0 | 0 | 111.5 | F55 L56 A57 L64 M91 F275 L276 T279 | F55-C59 PolarHBondContact O-N 2.95Å; F55-C59 PolarHBondContact O-SG 3.22Å; L56-C59 WeakPolarHBondContact O-CB 3.36Å; L56-C59 PolarHBondContact O-N 2.86Å; A57-C59 VanDerWaalsContact C-N 3.34Å; A57-C59 PolarHBondContact O-N 3.24Å; C59-L64 WeakPolarHBondContact O-CB 3.44Å; C59-L64 PolarHBondContact O-N 3.09Å; C59-M91 HydrophobicContact CB-CE 4.34Å; C59-F275 WeakPolarHBondContact SG-CD1 3.25Å; C59-L276 HydrophobicContact CB-CD1 4.14Å; C59-T279 PolarHBondContact SG-OG1 3.24Å; C59-T279 VanDerWaalsContact SG-OG1 3.42Å |
| 60 | F | 93.1 | Very high | 91.1 | Very high | 84 Ų | 84 | 29.1 Ų | 29.1 | 37% | 0.368 | 15% | 0.154 | S | C | . | . | I | π-helix | trans | -93 | -29.1 | -166.5 | -71.1 | -68.9 | 0 | 0 | 0 | 114.3 | L56 A57 L64 P65 L276 F280 | L56-F60 HydrophobicContact CD1-CD2 3.92Å; L56-F60 HydrophobicContact CD1-CE2 3.61Å; L56-F60 HydrophobicContact CG-CD2 4.23Å; L56-F60 HydrophobicContact CG-CE2 4.39Å; L56-F60 WeakPolarHBondContact O-CD2 3.44Å; L56-F60 PolarHBondContact O-N 3.01Å; A57-F60 PolarHBondContact O-N 2.84Å; F60-L64 HydrophobicContact CD1-CD2 4.23Å; F60-P65 VanDerWaalsContact O-CD 3.24Å; F60-P65 WeakPolarHBondContact O-CD 3.33Å; F60-L276 HydrophobicContact CE2-CD1 4.14Å; F60-L276 HydrophobicContact CZ-CD1 3.89Å; F60-F280 HydrophobicContact CE2-CE2 4.15Å; F60-F280 HydrophobicContact CE2-CZ 4.39Å; F60-F280 HydrophobicContact CZ-CE2 4.46Å |
| 61 | N | 91.3 | Very high | 91.3 | Very high | 47 Ų | 47 | 26.8 Ų | 26.8 | 25% | 0.251 | 15% | 0.145 | S | C | . | . | I | π-helix | trans | -105 | -15.8 | -173.6 | -55.1 | 0.7 | 0 | 0 | 0 | 112.4 | A57 Y305 A309 M312 | A57-N61 WeakPolarHBondContact O-CA 3.4Å; A57-N61 WeakPolarHBondContact O-CB 3.41Å; A57-N61 PolarHBondContact O-N 3.21Å; N61-Y305 PolarHBondContact ND2-OH 2.97Å; N61-Y305 VanDerWaalsContact ND2-OH 3.14Å; N61-Y305 PolarHBondContact OD1-OH 3.47Å; N61-A309 WeakPolarHBondContact ND2-CB 3.37Å; N61-M312 WeakPolarHBondContact O-CE 3.49Å |
| 62 | A | 87.9 | Confident | 91.6 | Very high | 26 Ų | 26 | 29.9 Ų | 29.9 | 22% | 0.215 | 16% | 0.157 | C | C | . | . | I | π-helix | trans | -116.5 | -61.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | T58 A66 M312 | T58-A62 HydrophobicContact CG2-CB 4.49Å; T58-A62 WeakPolarHBondContact O-CB 3.48Å; T58-A62 PolarHBondContact O-N 3.08Å; A62-A66 VanDerWaalsContact O-CB 3.25Å; A62-A66 WeakPolarHBondContact O-CB 3.32Å; A62-A66 PolarHBondContact O-N 2.97Å; A62-A66 VanDerWaalsContact O-N 3.08Å; A62-M312 HydrophobicContact CB-CE 3.64Å |
| 63 | L | 90.1 | Very high | 91.6 | Very high | 11 Ų | 11 | 33.5 Ų | 33.5 | 6% | 0.058 | 17% | 0.174 | C | C | . | . | I | π-helix | trans | -70.1 | -50.7 | -172.4 | -64.9 | 178.3 | 0 | 0 | 0 | 112.3 | T58 A66 V67 A272 F275 | T58-L63 HydrophobicContact CG2-CD1 4.02Å; T58-L63 HydrophobicContact CG2-CG 3.96Å; T58-L63 PolarHBondContact O-N 3.24Å; L63-A66 PolarHBondContact O-N 3.49Å; L63-V67 WeakPolarHBondContact O-CG2 3.44Å; L63-V67 PolarHBondContact O-N 3.48Å; L63-A272 HydrophobicContact CB-CB 4Å; L63-A272 HydrophobicContact CD1-CB 4.49Å; L63-F275 HydrophobicContact CD1-CB 3.96Å; L63-F275 HydrophobicContact CD1-CD1 3.59Å; L63-F275 HydrophobicContact CD1-CE1 4.24Å; L63-F275 HydrophobicContact CD1-CG 3.78Å |
| 64 | L | 93.4 | Very high | 91.5 | Very high | 13 Ų | 13 | 34.5 Ų | 34.5 | 7% | 0.068 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -59.8 | -47.7 | -179.8 | 174.6 | 62.8 | 0 | 0 | 0 | 112.6 | C59 F60 A66 V67 R68 A87 E88 M91 | C59-L64 WeakPolarHBondContact O-CB 3.44Å; C59-L64 PolarHBondContact O-N 3.09Å; F60-L64 HydrophobicContact CD1-CD2 4.23Å; L64-A66 PolarHBondContact O-N 3.34Å; L64-V67 PolarHBondContact O-N 2.95Å; L64-R68 HydrophobicContact CD1-CG 4.45Å; L64-R68 WeakPolarHBondContact O-CG 3.22Å; L64-R68 PolarHBondContact O-N 3.22Å; L64-A87 HydrophobicContact CD1-CB 4.36Å; L64-E88 HydrophobicContact CD1-CG 4.06Å; L64-M91 HydrophobicContact CB-SD 4.09Å; L64-M91 HydrophobicContact CD1-SD 3.94Å; L64-M91 HydrophobicContact CG-SD 4.42Å |
| 65 | P | 92 | Very high | 91.6 | Very high | 39 Ų | 39 | 35.5 Ų | 35.5 | 25% | 0.253 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -59.3 | -42.8 | 173.2 | -27.1 | 37.2 | 0 | 0 | 0 | 113 | F60 V67 R68 D69 | F60-P65 VanDerWaalsContact O-CD 3.24Å; F60-P65 WeakPolarHBondContact O-CD 3.33Å; P65-V67 VanDerWaalsContact C-N 3.3Å; P65-V67 PolarHBondContact O-N 3.17Å; P65-R68 WeakPolarHBondContact O-CB 3.11Å; P65-R68 PolarHBondContact O-N 2.81Å; P65-R68 VanDerWaalsContact O-N 3.13Å; P65-D69 PolarHBondContact O-N 3.31Å |
| 66 | A | 89.1 | Confident | 91.6 | Very high | 28 Ų | 28 | 42.8 Ų | 42.8 | 23% | 0.231 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -62.3 | -36.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | A62 L63 L64 K70 | A62-A66 VanDerWaalsContact O-CB 3.25Å; A62-A66 WeakPolarHBondContact O-CB 3.32Å; A62-A66 PolarHBondContact O-N 2.97Å; A62-A66 VanDerWaalsContact O-N 3.08Å; L63-A66 PolarHBondContact O-N 3.49Å; L64-A66 PolarHBondContact O-N 3.34Å; A66-K70 PolarHBondContact O-N 2.85Å; A66-K70 VanDerWaalsContact O-N 3.14Å |
| 67 | V | 93.1 | Very high | 91.3 | Very high | 1 Ų | 1 | 46.9 Ų | 46.9 | 1% | 0.006 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -68.6 | -42.3 | 173.7 | 178.6 | 0 | 0 | 0 | 0 | 110.6 | L63 L64 P65 K70 V71 A87 Q268 A272 | L63-V67 WeakPolarHBondContact O-CG2 3.44Å; L63-V67 PolarHBondContact O-N 3.48Å; L64-V67 PolarHBondContact O-N 2.95Å; P65-V67 VanDerWaalsContact C-N 3.3Å; P65-V67 PolarHBondContact O-N 3.17Å; V67-K70 PolarHBondContact O-N 3.33Å; V67-V71 HydrophobicContact CG1-CG2 4.38Å; V67-V71 WeakPolarHBondContact O-CG2 3.47Å; V67-V71 PolarHBondContact O-N 2.89Å; V67-A87 HydrophobicContact CB-CB 4.26Å; V67-A87 HydrophobicContact CG1-CB 3.72Å; V67-Q268 HydrophobicContact CG2-CB 4.44Å; V67-Q268 HydrophobicContact CG2-CG 4.02Å; V67-A272 HydrophobicContact CG2-CB 4.17Å |
| 68 | R | 94.6 | Very high | 91.2 | Very high | 106 Ų | 106 | 49.9 Ų | 49.9 | 40% | 0.4 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -57.8 | -49.1 | 174.6 | -73.3 | 175.8 | 178.7 | 159 | -2.8 | 111.8 | L64 P65 K70 V71 D72 A87 E88 | L64-R68 HydrophobicContact CD1-CG 4.45Å; L64-R68 WeakPolarHBondContact O-CG 3.22Å; L64-R68 PolarHBondContact O-N 3.22Å; P65-R68 WeakPolarHBondContact O-CB 3.11Å; P65-R68 PolarHBondContact O-N 2.81Å; P65-R68 VanDerWaalsContact O-N 3.13Å; R68-K70 VanDerWaalsContact C-N 3.3Å; R68-K70 PolarHBondContact O-N 2.84Å; R68-V71 WeakPolarHBondContact O-CB 3.49Å; R68-V71 PolarHBondContact O-N 3.25Å; R68-V71 VanDerWaalsContact O-N 3.11Å; R68-D72 PolarHBondContact O-N 2.92Å; R68-A87 HydrophobicContact CB-CB 4.19Å; R68-A87 HydrophobicContact CG-CB 3.46Å; R68-A87 VanDerWaalsContact CG-CB 3.46Å; R68-E88 IonicContact CZ-OE1 3.07Å; R68-E88 IonicContact NE-OE1 2.76Å; R68-E88 PolarHBondContact NE-OE1 3.42Å; R68-E88 IonicContact NH2-OE1 2.61Å; R68-E88 PolarHBondContact NH2-OE1 2.9Å |
| 69 | D | 91.3 | Very high | 91.1 | Very high | 105 Ų | 105 | 57 Ų | 57 | 56% | 0.561 | 29% | 0.294 | S | S | * | . | H | α-helix | trans | -59.1 | -42.5 | 178.9 | -68.7 | -19.1 | 0 | 0 | 0 | 111.3 | P65 D72 E73 | P65-D69 PolarHBondContact O-N 3.31Å; D69-D72 PolarHBondContact O-N 2.84Å; D69-E73 WeakPolarHBondContact O-CG 3.47Å; D69-E73 PolarHBondContact O-N 3.35Å |
| 70 | K | 89.8 | Confident | 91 | Very high | 21 Ų | 21 | 61.3 Ų | 61.3 | 9% | 0.091 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -67.1 | -38.4 | 175.2 | -88.1 | -158.8 | 175.6 | 175 | 0 | 113.4 | A66 V67 R68 D72 E73 V74 S264 V265 Q268 | A66-K70 PolarHBondContact O-N 2.85Å; A66-K70 VanDerWaalsContact O-N 3.14Å; V67-K70 PolarHBondContact O-N 3.33Å; R68-K70 VanDerWaalsContact C-N 3.3Å; R68-K70 PolarHBondContact O-N 2.84Å; K70-D72 VanDerWaalsContact C-N 3.31Å; K70-E73 PolarHBondContact O-N 3.46Å; K70-V74 WeakPolarHBondContact O-CG2 3.41Å; K70-V74 PolarHBondContact O-N 2.9Å; K70-S264 PolarHBondContact NZ-OG 2.95Å; K70-V265 HydrophobicContact CB-CB 4.22Å; K70-V265 HydrophobicContact CB-CG2 3.65Å; K70-Q268 VanDerWaalsContact CD-OE1 3.26Å |
| 71 | V | 94.2 | Very high | 90.7 | Very high | 12 Ų | 12 | 64 Ų | 64 | 7% | 0.073 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -60.2 | -46 | 175 | 164.3 | 0 | 0 | 0 | 0 | 109.6 | V67 R68 E73 V74 L75 L86 A87 M90 V265 | V67-V71 HydrophobicContact CG1-CG2 4.38Å; V67-V71 WeakPolarHBondContact O-CG2 3.47Å; V67-V71 PolarHBondContact O-N 2.89Å; R68-V71 WeakPolarHBondContact O-CB 3.49Å; R68-V71 PolarHBondContact O-N 3.25Å; R68-V71 VanDerWaalsContact O-N 3.11Å; V71-E73 VanDerWaalsContact C-N 3.32Å; V71-E73 PolarHBondContact O-N 3.16Å; V71-V74 PolarHBondContact O-N 2.99Å; V71-L75 HydrophobicContact CG1-CD1 3.76Å; V71-L75 HydrophobicContact CG1-CG 4.19Å; V71-L75 WeakPolarHBondContact O-CB 3.32Å; V71-L75 WeakPolarHBondContact O-CG 3.48Å; V71-L75 PolarHBondContact O-N 3.18Å; V71-L86 HydrophobicContact CG1-CB 3.89Å; V71-L86 HydrophobicContact CG1-CD1 4.1Å; V71-L86 HydrophobicContact CG2-CB 4.42Å; V71-A87 HydrophobicContact CG2-CB 4.17Å; V71-M90 HydrophobicContact CG2-SD 4.01Å; V71-V265 HydrophobicContact CB-CG2 4.44Å; V71-V265 HydrophobicContact CG2-CG2 3.58Å |
| 72 | D | 92.9 | Very high | 90.6 | Very high | 81 Ų | 81 | 64.7 Ų | 64.7 | 43% | 0.433 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -61.7 | -39.7 | 178.6 | -75.4 | -8.7 | 0 | 0 | 0 | 112.3 | R68 D69 K70 K76 | R68-D72 PolarHBondContact O-N 2.92Å; D69-D72 PolarHBondContact O-N 2.84Å; K70-D72 VanDerWaalsContact C-N 3.31Å; D72-K76 WeakPolarHBondContact O-CB 3.41Å; D72-K76 WeakPolarHBondContact O-CD 3.39Å; D72-K76 WeakPolarHBondContact O-CG 3.45Å; D72-K76 PolarHBondContact O-N 3.31Å |
| 73 | E | 89.4 | Confident | 90.7 | Very high | 79 Ų | 79 | 71.9 Ų | 71.9 | 37% | 0.369 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -61.9 | -46.7 | 173.9 | -73.2 | -176.5 | 166.9 | 0 | 0 | 112 | D69 K70 V71 K76 L77 K198 | D69-E73 WeakPolarHBondContact O-CG 3.47Å; D69-E73 PolarHBondContact O-N 3.35Å; K70-E73 PolarHBondContact O-N 3.46Å; V71-E73 VanDerWaalsContact C-N 3.32Å; V71-E73 PolarHBondContact O-N 3.16Å; E73-K76 PolarHBondContact O-N 3.37Å; E73-L77 WeakPolarHBondContact O-CG 3.08Å; E73-L77 PolarHBondContact O-N 3.31Å; E73-L77 VanDerWaalsContact O-N 3.12Å; E73-K198 WeakPolarHBondContact OE1-CE 3.24Å; E73-K198 IonicContact OE1-NZ 3.05Å; E73-K198 PolarHBondContact OE1-NZ 3.1Å; E73-K198 IonicContact OE2-NZ 2.68Å; E73-K198 PolarHBondContact OE2-NZ 2.94Å |
| 74 | V | 90.6 | Very high | 90.8 | Very high | 21 Ų | 21 | 77.3 Ų | 77.3 | 13% | 0.127 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -66.7 | -41.7 | 179.6 | 172.9 | 0 | 0 | 0 | 0 | 111.3 | K70 V71 K76 L77 V78 I262 V265 | K70-V74 WeakPolarHBondContact O-CG2 3.41Å; K70-V74 PolarHBondContact O-N 2.9Å; V71-V74 PolarHBondContact O-N 2.99Å; V74-K76 VanDerWaalsContact C-N 3.33Å; V74-K76 PolarHBondContact O-N 2.97Å; V74-L77 WeakPolarHBondContact O-CB 3.5Å; V74-L77 PolarHBondContact O-N 2.94Å; V74-L77 VanDerWaalsContact O-N 3.15Å; V74-V78 WeakPolarHBondContact O-CG2 3.42Å; V74-V78 PolarHBondContact O-N 3.28Å; V74-V78 VanDerWaalsContact O-N 3.12Å; V74-I262 HydrophobicContact CG1-CG1 3.77Å; V74-V265 HydrophobicContact CG2-CB 4.43Å; V74-V265 HydrophobicContact CG2-CG1 4.05Å |
| 75 | L | 92.3 | Very high | 90.9 | Very high | 29 Ų | 29 | 79.6 Ų | 79.6 | 15% | 0.152 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -62 | -40.6 | 177 | -76.2 | 175.8 | 0 | 0 | 0 | 112.2 | V71 L77 V78 N79 I80 T82 L86 | V71-L75 HydrophobicContact CG1-CD1 3.76Å; V71-L75 HydrophobicContact CG1-CG 4.19Å; V71-L75 WeakPolarHBondContact O-CB 3.32Å; V71-L75 WeakPolarHBondContact O-CG 3.48Å; V71-L75 PolarHBondContact O-N 3.18Å; L75-L77 VanDerWaalsContact C-N 3.32Å; L75-L77 PolarHBondContact O-N 3.44Å; L75-V78 CarbonylContact O-C 3.52Å; L75-V78 PolarHBondContact O-N 3.39Å; L75-N79 PolarHBondContact O-N 2.97Å; L75-I80 HydrophobicContact CD2-CB 4.12Å; L75-I80 HydrophobicContact CD2-CG2 4.07Å; L75-I80 PolarHBondContact O-N 3.22Å; L75-I80 VanDerWaalsContact O-N 3.13Å; L75-T82 HydrophobicContact CD1-CG2 3.77Å; L75-T82 HydrophobicContact CD2-CG2 4.13Å; L75-L86 HydrophobicContact CD1-CD1 4.27Å; L75-L86 HydrophobicContact CD2-CD1 4.18Å |
| 76 | K | 90.8 | Very high | 91.1 | Very high | 158 Ų | 158 | 80.5 Ų | 80.5 | 69% | 0.687 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -61.6 | -38.8 | 173.6 | -74.6 | 168.2 | -172.6 | 167.2 | 0 | 112.1 | D72 E73 V74 V78 N79 | D72-K76 WeakPolarHBondContact O-CB 3.41Å; D72-K76 WeakPolarHBondContact O-CD 3.39Å; D72-K76 WeakPolarHBondContact O-CG 3.45Å; D72-K76 PolarHBondContact O-N 3.31Å; E73-K76 PolarHBondContact O-N 3.37Å; V74-K76 VanDerWaalsContact C-N 3.33Å; V74-K76 PolarHBondContact O-N 2.97Å; K76-V78 VanDerWaalsContact C-N 3.34Å; K76-V78 PolarHBondContact O-N 2.98Å; K76-N79 PolarHBondContact O-N 3.47Å |
| 77 | L | 87.6 | Confident | 91.4 | Very high | 119 Ų | 119 | 79.3 Ų | 79.3 | 62% | 0.623 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -65.6 | -35.3 | 177.2 | -71.3 | 167.4 | 0 | 0 | 0 | 112.7 | E73 V74 L75 L258 | E73-L77 WeakPolarHBondContact O-CG 3.08Å; E73-L77 PolarHBondContact O-N 3.31Å; E73-L77 VanDerWaalsContact O-N 3.12Å; V74-L77 WeakPolarHBondContact O-CB 3.5Å; V74-L77 PolarHBondContact O-N 2.94Å; V74-L77 VanDerWaalsContact O-N 3.15Å; L75-L77 VanDerWaalsContact C-N 3.32Å; L75-L77 PolarHBondContact O-N 3.44Å; L77-L258 HydrophobicContact CB-CD1 4.34Å |
| 78 | V | 88.8 | Confident | 91.6 | Very high | 63 Ų | 63 | 81.8 Ų | 81.8 | 38% | 0.382 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -92.6 | -1.7 | -179.5 | -164.3 | 0 | 0 | 0 | 0 | 112.1 | V74 L75 K76 I80 L258 | V74-V78 WeakPolarHBondContact O-CG2 3.42Å; V74-V78 PolarHBondContact O-N 3.28Å; V74-V78 VanDerWaalsContact O-N 3.12Å; L75-V78 CarbonylContact O-C 3.52Å; L75-V78 PolarHBondContact O-N 3.39Å; K76-V78 VanDerWaalsContact C-N 3.34Å; K76-V78 PolarHBondContact O-N 2.98Å; V78-I80 HydrophobicContact CB-CD1 4.33Å; V78-I80 HydrophobicContact CB-CG1 4.43Å; V78-I80 HydrophobicContact CG1-CD1 3.72Å; V78-I80 HydrophobicContact CG1-CG1 4.12Å; V78-I80 PolarHBondContact O-N 3.32Å; V78-L258 HydrophobicContact CG2-CD1 3.96Å; V78-L258 HydrophobicContact CG2-CD2 4.15Å |
| 79 | N | 88.8 | Confident | 91.7 | Very high | 153 Ų | 153 | 79.3 Ų | 79.3 | 82% | 0.818 | 42% | 0.417 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.5 | 34.4 | -178.6 | -152.8 | 39.2 | 0 | 0 | 0 | 113.6 | L75 K76 | L75-N79 PolarHBondContact O-N 2.97Å; K76-N79 PolarHBondContact O-N 3.47Å |
| 80 | I | 90.5 | Very high | 91.9 | Very high | 92 Ų | 92 | 75.6 Ų | 75.6 | 47% | 0.472 | 40% | 0.397 | S | S | . | . | trans | -104.1 | 132.4 | 176.2 | -65.6 | 173.7 | 0 | 0 | 0 | 108 | L75 V78 | L75-I80 HydrophobicContact CD2-CB 4.12Å; L75-I80 HydrophobicContact CD2-CG2 4.07Å; L75-I80 PolarHBondContact O-N 3.22Å; L75-I80 VanDerWaalsContact O-N 3.13Å; V78-I80 HydrophobicContact CB-CD1 4.33Å; V78-I80 HydrophobicContact CB-CG1 4.43Å; V78-I80 HydrophobicContact CG1-CD1 3.72Å; V78-I80 HydrophobicContact CG1-CG1 4.12Å; V78-I80 PolarHBondContact O-N 3.32Å | ||
| 81 | T | 87.2 | Confident | 92.3 | Very high | 140 Ų | 140 | 75 Ų | 75 | 86% | 0.859 | 39% | 0.394 | S | S | * | . | trans | -109.9 | 132.4 | 169.2 | 51.6 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 82 | T | 88.6 | Confident | 92.4 | Very high | 62 Ų | 62 | 77.9 Ų | 77.9 | 38% | 0.38 | 41% | 0.408 | S | S | . | . | trans | -145.3 | 134.7 | 177.7 | -176.3 | 0 | 0 | 0 | 0 | 108.8 | L75 Y84 L86 | L75-T82 HydrophobicContact CD1-CG2 3.77Å; L75-T82 HydrophobicContact CD2-CG2 4.13Å; T82-Y84 VanDerWaalsContact OG1-CB 3.31Å; T82-Y84 WeakPolarHBondContact OG1-CB 3.4Å; T82-Y84 PolarHBondContact OG1-N 3.27Å; T82-L86 HydrophobicContact CG2-CD1 3.92Å; T82-L86 HydrophobicContact CG2-CG 4.47Å | ||
| 83 | D | 89.4 | Confident | 92.6 | Very high | 176 Ų | 176 | 79 Ų | 79 | 94% | 0.941 | 41% | 0.413 | S | S | * | . | trans | -83.6 | -0.7 | 172.4 | -59.3 | -44.2 | 0 | 0 | 0 | 111.7 | ||||
| 84 | Y | 92.8 | Very high | 92.9 | Very high | 126 Ų | 126 | 75.2 Ų | 75.2 | 49% | 0.494 | 40% | 0.396 | S | S | . | . | S | Bend | trans | -75.5 | 133.5 | -178.1 | -175.3 | -96.9 | 0 | 0 | 0 | 111.5 | T82 L86 T89 | T82-Y84 VanDerWaalsContact OG1-CB 3.31Å; T82-Y84 WeakPolarHBondContact OG1-CB 3.4Å; T82-Y84 PolarHBondContact OG1-N 3.27Å; Y84-L86 VanDerWaalsContact C-N 3.27Å; Y84-L86 HydrophobicContact CD1-CD2 3.72Å; Y84-L86 HydrophobicContact CD1-CG 3.96Å; Y84-L86 HydrophobicContact CE1-CD2 4.04Å; Y84-L86 PolarHBondContact O-N 3.29Å; Y84-T89 HydrophobicContact CE1-CG2 4.18Å; Y84-T89 VanDerWaalsContact CE1-OG1 3.28Å; Y84-T89 WeakPolarHBondContact CE1-OG1 3.27Å; Y84-T89 VanDerWaalsContact CZ-OG1 3.31Å; Y84-T89 PolarHBondContact OH-OG1 3.33Å |
| 85 | P | 95.3 | Very high | 93.1 | Very high | 61 Ų | 61 | 75.5 Ų | 75.5 | 40% | 0.396 | 40% | 0.396 | S | S | . | . | trans | -75.3 | 71.7 | -176.4 | 32.7 | -38 | 0 | 0 | 0 | 112.3 | A87 E88 T89 | P85-A87 VanDerWaalsContact C-N 3.33Å; P85-A87 PolarHBondContact O-N 2.79Å; P85-E88 WeakPolarHBondContact CA-OE2 3.33Å; P85-E88 HydrophobicContact CB-CB 4.17Å; P85-E88 HydrophobicContact CB-CG 4.24Å; P85-E88 WeakPolarHBondContact CB-OE2 3.32Å; P85-E88 PolarHBondContact O-N 3.47Å; P85-T89 PolarHBondContact O-N 2.92Å; P85-T89 PolarHBondContact O-OG1 3.16Å | ||
| 86 | L | 95.6 | Very high | 93.2 | Very high | 57 Ų | 57 | 79.9 Ų | 79.9 | 30% | 0.298 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -60 | -40.7 | -176.1 | -77 | 173.8 | 0 | 0 | 0 | 112.5 | V71 L75 T82 Y84 E88 T89 M90 | V71-L86 HydrophobicContact CG1-CB 3.89Å; V71-L86 HydrophobicContact CG1-CD1 4.1Å; V71-L86 HydrophobicContact CG2-CB 4.42Å; L75-L86 HydrophobicContact CD1-CD1 4.27Å; L75-L86 HydrophobicContact CD2-CD1 4.18Å; T82-L86 HydrophobicContact CG2-CD1 3.92Å; T82-L86 HydrophobicContact CG2-CG 4.47Å; Y84-L86 VanDerWaalsContact C-N 3.27Å; Y84-L86 HydrophobicContact CD1-CD2 3.72Å; Y84-L86 HydrophobicContact CD1-CG 3.96Å; Y84-L86 HydrophobicContact CE1-CD2 4.04Å; Y84-L86 PolarHBondContact O-N 3.29Å; L86-E88 PolarHBondContact O-N 3.36Å; L86-T89 PolarHBondContact O-N 3.07Å; L86-M90 HydrophobicContact CB-SD 4.37Å; L86-M90 WeakPolarHBondContact O-CB 3.31Å; L86-M90 WeakPolarHBondContact O-CG 3.46Å; L86-M90 PolarHBondContact O-N 2.99Å; L86-M90 VanDerWaalsContact O-SD 3.33Å |
| 87 | A | 95.9 | Very high | 93.3 | Very high | 3 Ų | 3 | 75.7 Ų | 75.7 | 3% | 0.025 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -60.8 | -45.7 | -179.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | L64 V67 R68 V71 P85 M90 M91 | L64-A87 HydrophobicContact CD1-CB 4.36Å; V67-A87 HydrophobicContact CB-CB 4.26Å; V67-A87 HydrophobicContact CG1-CB 3.72Å; R68-A87 HydrophobicContact CB-CB 4.19Å; R68-A87 HydrophobicContact CG-CB 3.46Å; R68-A87 VanDerWaalsContact CG-CB 3.46Å; V71-A87 HydrophobicContact CG2-CB 4.17Å; P85-A87 VanDerWaalsContact C-N 3.33Å; P85-A87 PolarHBondContact O-N 2.79Å; A87-M90 PolarHBondContact O-N 3.44Å; A87-M91 WeakPolarHBondContact O-CB 3.29Å; A87-M91 PolarHBondContact O-N 3.13Å |
| 88 | E | 96.9 | Very high | 93.4 | Very high | 53 Ų | 53 | 70.7 Ų | 70.7 | 25% | 0.248 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -64.7 | -42.9 | 176.3 | -65.4 | 79.9 | 171.2 | 0 | 0 | 111 | L64 R68 P85 L86 M90 M91 M92 | L64-E88 HydrophobicContact CD1-CG 4.06Å; R68-E88 IonicContact CZ-OE1 3.07Å; R68-E88 IonicContact NE-OE1 2.76Å; R68-E88 PolarHBondContact NE-OE1 3.42Å; R68-E88 IonicContact NH2-OE1 2.61Å; R68-E88 PolarHBondContact NH2-OE1 2.9Å; P85-E88 WeakPolarHBondContact CA-OE2 3.33Å; P85-E88 HydrophobicContact CB-CB 4.17Å; P85-E88 HydrophobicContact CB-CG 4.24Å; P85-E88 WeakPolarHBondContact CB-OE2 3.32Å; P85-E88 PolarHBondContact O-N 3.47Å; L86-E88 PolarHBondContact O-N 3.36Å; E88-M90 VanDerWaalsContact C-N 3.35Å; E88-M90 PolarHBondContact O-N 2.95Å; E88-M91 WeakPolarHBondContact O-CB 3.29Å; E88-M91 PolarHBondContact O-N 2.94Å; E88-M92 WeakPolarHBondContact O-CB 3.47Å; E88-M92 WeakPolarHBondContact O-CG 3.35Å; E88-M92 PolarHBondContact O-N 3.4Å |
| 89 | T | 97.1 | Very high | 93.4 | Very high | 54 Ų | 54 | 69.7 Ų | 69.7 | 33% | 0.331 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -63.6 | -41.3 | 177.7 | -64.5 | 0 | 0 | 0 | 0 | 111.7 | Y84 P85 L86 M92 L93 | Y84-T89 HydrophobicContact CE1-CG2 4.18Å; Y84-T89 VanDerWaalsContact CE1-OG1 3.28Å; Y84-T89 WeakPolarHBondContact CE1-OG1 3.27Å; Y84-T89 VanDerWaalsContact CZ-OG1 3.31Å; Y84-T89 PolarHBondContact OH-OG1 3.33Å; P85-T89 PolarHBondContact O-N 2.92Å; P85-T89 PolarHBondContact O-OG1 3.16Å; L86-T89 PolarHBondContact O-N 3.07Å; T89-M92 PolarHBondContact O-N 2.92Å; T89-L93 WeakPolarHBondContact O-CB 3.49Å; T89-L93 PolarHBondContact O-N 3.44Å |
| 90 | M | 96.6 | Very high | 93.4 | Very high | 28 Ų | 28 | 69.1 Ų | 69.1 | 14% | 0.138 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -67 | -39 | 176.4 | -65.7 | 157.7 | 73.7 | 0 | 0 | 111.4 | V71 L86 A87 E88 L93 G94 V265 V266 | V71-M90 HydrophobicContact CG2-SD 4.01Å; L86-M90 HydrophobicContact CB-SD 4.37Å; L86-M90 WeakPolarHBondContact O-CB 3.31Å; L86-M90 WeakPolarHBondContact O-CG 3.46Å; L86-M90 PolarHBondContact O-N 2.99Å; L86-M90 VanDerWaalsContact O-SD 3.33Å; A87-M90 PolarHBondContact O-N 3.44Å; E88-M90 VanDerWaalsContact C-N 3.35Å; E88-M90 PolarHBondContact O-N 2.95Å; M90-L93 WeakPolarHBondContact O-CB 3.24Å; M90-L93 PolarHBondContact O-N 3.13Å; M90-G94 PolarHBondContact O-N 3.44Å; M90-V265 HydrophobicContact CE-CB 4.39Å; M90-V265 HydrophobicContact CE-CG1 4.09Å; M90-V265 HydrophobicContact CE-CG2 4.04Å; M90-V265 WeakPolarHBondContact CE-O 3.03Å; M90-V266 HydrophobicContact CE-CB 4.1Å; M90-V266 HydrophobicContact CE-CG2 3.76Å |
| 91 | M | 96.5 | Very high | 93.2 | Very high | 7 Ų | 7 | 67.5 Ų | 67.5 | 3% | 0.034 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -61.9 | -46.9 | 172 | -172.4 | 177.4 | -175.4 | 0 | 0 | 111.7 | C59 L64 A87 E88 L93 G94 F95 G269 A272 G273 L276 | C59-M91 HydrophobicContact CB-CE 4.34Å; L64-M91 HydrophobicContact CB-SD 4.09Å; L64-M91 HydrophobicContact CD1-SD 3.94Å; L64-M91 HydrophobicContact CG-SD 4.42Å; A87-M91 WeakPolarHBondContact O-CB 3.29Å; A87-M91 PolarHBondContact O-N 3.13Å; E88-M91 WeakPolarHBondContact O-CB 3.29Å; E88-M91 PolarHBondContact O-N 2.94Å; M91-L93 VanDerWaalsContact C-N 3.3Å; M91-L93 PolarHBondContact O-N 3.33Å; M91-G94 PolarHBondContact O-N 3.36Å; M91-F95 PolarHBondContact O-N 3.33Å; M91-G269 WeakPolarHBondContact CA-O 3.37Å; M91-A272 HydrophobicContact CE-CB 4.5Å; M91-A272 HydrophobicContact CG-CB 4.1Å; M91-A272 HydrophobicContact SD-CB 4.46Å; M91-G273 WeakPolarHBondContact O-CA 3.34Å; M91-L276 HydrophobicContact CE-CB 3.83Å; M91-L276 HydrophobicContact CE-CD1 3.91Å; M91-L276 HydrophobicContact CE-CD2 4.04Å; M91-L276 HydrophobicContact CE-CG 4.13Å |
| 92 | M | 97.3 | Very high | 93 | Very high | 73 Ų | 73 | 62.7 Ų | 62.7 | 36% | 0.36 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -65.9 | -33.6 | 177.1 | -70.8 | -52 | -55.6 | 0 | 0 | 112.4 | E88 T89 F95 F96 L276 | E88-M92 WeakPolarHBondContact O-CB 3.47Å; E88-M92 WeakPolarHBondContact O-CG 3.35Å; E88-M92 PolarHBondContact O-N 3.4Å; T89-M92 PolarHBondContact O-N 2.92Å; M92-F95 HydrophobicContact CE-CD1 3.82Å; M92-F95 HydrophobicContact CE-CE1 4.46Å; M92-F95 HydrophobicContact CE-CG 4.33Å; M92-F95 WeakPolarHBondContact O-CB 3.43Å; M92-F95 PolarHBondContact O-N 3.39Å; M92-F96 HydrophobicContact CB-CE2 4.15Å; M92-F96 HydrophobicContact CE-CE1 4.03Å; M92-F96 HydrophobicContact CE-CE2 3.98Å; M92-F96 HydrophobicContact CE-CZ 3.58Å; M92-F96 WeakPolarHBondContact O-CD2 3.17Å; M92-F96 WeakPolarHBondContact O-CG 3.43Å; M92-F96 PolarHBondContact O-N 2.97Å; M92-L276 HydrophobicContact SD-CD2 4.39Å |
| 93 | L | 97 | Very high | 92.8 | Very high | 104 Ų | 104 | 63.4 Ų | 63.4 | 55% | 0.545 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -62.5 | -43.7 | 173.3 | -177 | 62.7 | 0 | 0 | 0 | 111.4 | T89 M90 M91 F95 F96 L97 L270 | T89-L93 WeakPolarHBondContact O-CB 3.49Å; T89-L93 PolarHBondContact O-N 3.44Å; M90-L93 WeakPolarHBondContact O-CB 3.24Å; M90-L93 PolarHBondContact O-N 3.13Å; M91-L93 VanDerWaalsContact C-N 3.3Å; M91-L93 PolarHBondContact O-N 3.33Å; L93-F95 VanDerWaalsContact C-N 3.34Å; L93-F96 PolarHBondContact O-N 3.23Å; L93-L97 VanDerWaalsContact O-CB 3.27Å; L93-L97 WeakPolarHBondContact O-CB 3.47Å; L93-L97 PolarHBondContact O-N 3.47Å; L93-L270 HydrophobicContact CB-CD2 4.07Å; L93-L270 HydrophobicContact CD2-CD2 3.96Å; L93-L270 HydrophobicContact CG-CD2 3.8Å |
| 94 | G | 95.4 | Very high | 92.6 | Very high | 0 Ų | 0 | 56.1 Ų | 56.1 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -63 | -41 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | M90 M91 L97 T98 | M90-G94 PolarHBondContact O-N 3.44Å; M91-G94 PolarHBondContact O-N 3.36Å; G94-L97 PolarHBondContact O-N 2.98Å; G94-T98 PolarHBondContact O-N 3.37Å; G94-T98 PolarHBondContact O-OG1 2.87Å |
| 95 | F | 95.1 | Very high | 92.1 | Very high | 28 Ų | 28 | 53.5 Ų | 53.5 | 12% | 0.123 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -59.1 | -53 | 174.8 | 173 | -92.5 | 0 | 0 | 0 | 111.2 | M91 M92 L93 L97 T98 V99 G273 L276 F277 F281 | M91-F95 PolarHBondContact O-N 3.33Å; M92-F95 HydrophobicContact CE-CD1 3.82Å; M92-F95 HydrophobicContact CE-CE1 4.46Å; M92-F95 HydrophobicContact CE-CG 4.33Å; M92-F95 WeakPolarHBondContact O-CB 3.43Å; M92-F95 PolarHBondContact O-N 3.39Å; L93-F95 VanDerWaalsContact C-N 3.34Å; F95-L97 VanDerWaalsContact C-N 3.34Å; F95-L97 PolarHBondContact O-N 3.44Å; F95-T98 WeakPolarHBondContact O-CB 3.45Å; F95-T98 PolarHBondContact O-N 3.04Å; F95-T98 VanDerWaalsContact O-N 3.16Å; F95-V99 HydrophobicContact CD1-CG2 4.32Å; F95-V99 HydrophobicContact CE1-CG2 3.84Å; F95-V99 HydrophobicContact CE2-CG2 4.37Å; F95-V99 HydrophobicContact CZ-CG2 3.87Å; F95-V99 WeakPolarHBondContact O-CG2 3.37Å; F95-V99 PolarHBondContact O-N 3.43Å; F95-G273 WeakPolarHBondContact CA-O 3.2Å; F95-L276 HydrophobicContact CD2-CD2 4.17Å; F95-L276 HydrophobicContact CD2-CG 4.38Å; F95-F277 HydrophobicContact CD2-CB 3.71Å; F95-F277 HydrophobicContact CD2-CD2 4.42Å; F95-F277 HydrophobicContact CE2-CB 3.99Å; F95-F277 AromaticContact CE2-CD2 3.99Å; F95-F277 HydrophobicContact CE2-CD2 3.99Å; F95-F281 AromaticContact CE2-CD2 3.97Å; F95-F281 HydrophobicContact CE2-CD2 3.97Å; F95-F281 AromaticContact CE2-CE2 3.56Å; F95-F281 HydrophobicContact CE2-CE2 3.56Å; F95-F281 HydrophobicContact CZ-CD2 4.3Å; F95-F281 AromaticContact CZ-CE2 3.52Å; F95-F281 HydrophobicContact CZ-CE2 3.52Å; F95-F281 HydrophobicContact CZ-CZ 4.21Å |
| 96 | F | 94.7 | Very high | 91.2 | Very high | 120 Ų | 120 | 53 Ų | 53 | 53% | 0.526 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -65.6 | -35.6 | 179.6 | -64.9 | -44.7 | 0 | 0 | 0 | 113 | M92 L93 T98 V99 F100 | M92-F96 HydrophobicContact CB-CE2 4.15Å; M92-F96 HydrophobicContact CE-CE1 4.03Å; M92-F96 HydrophobicContact CE-CE2 3.98Å; M92-F96 HydrophobicContact CE-CZ 3.58Å; M92-F96 WeakPolarHBondContact O-CD2 3.17Å; M92-F96 WeakPolarHBondContact O-CG 3.43Å; M92-F96 PolarHBondContact O-N 2.97Å; L93-F96 PolarHBondContact O-N 3.23Å; F96-T98 VanDerWaalsContact C-N 3.3Å; F96-T98 PolarHBondContact O-N 3.46Å; F96-V99 PolarHBondContact O-N 3.37Å; F96-F100 WeakPolarHBondContact O-CB 3.46Å; F96-F100 PolarHBondContact O-N 3.25Å |
| 97 | L | 93.3 | Very high | 90.5 | Very high | 70 Ų | 70 | 55.2 Ų | 55.2 | 37% | 0.366 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -59.2 | -44.3 | 172.9 | -179.5 | 68.7 | 0 | 0 | 0 | 110.9 | L93 G94 F95 F100 V101 F185 | L93-L97 VanDerWaalsContact O-CB 3.27Å; L93-L97 WeakPolarHBondContact O-CB 3.47Å; L93-L97 PolarHBondContact O-N 3.47Å; G94-L97 PolarHBondContact O-N 2.98Å; F95-L97 VanDerWaalsContact C-N 3.34Å; F95-L97 PolarHBondContact O-N 3.44Å; L97-F100 PolarHBondContact O-N 3.45Å; L97-V101 WeakPolarHBondContact O-CG2 3.4Å; L97-V101 PolarHBondContact O-N 2.84Å; L97-F185 HydrophobicContact CD2-CE2 4.39Å; L97-F185 HydrophobicContact CD2-CZ 4.3Å |
| 98 | T | 89.4 | Confident | 89.6 | Confident | 14 Ų | 14 | 63.6 Ų | 63.6 | 9% | 0.086 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -64.8 | -46.2 | 178.6 | -49.7 | 0 | 0 | 0 | 0 | 111.2 | G94 F95 F96 F100 V101 E102 A178 T274 F277 | G94-T98 PolarHBondContact O-N 3.37Å; G94-T98 PolarHBondContact O-OG1 2.87Å; F95-T98 WeakPolarHBondContact O-CB 3.45Å; F95-T98 PolarHBondContact O-N 3.04Å; F95-T98 VanDerWaalsContact O-N 3.16Å; F96-T98 VanDerWaalsContact C-N 3.3Å; F96-T98 PolarHBondContact O-N 3.46Å; T98-F100 VanDerWaalsContact C-N 3.32Å; T98-F100 PolarHBondContact O-N 2.97Å; T98-V101 PolarHBondContact O-N 2.89Å; T98-E102 WeakPolarHBondContact O-CB 3.42Å; T98-E102 PolarHBondContact O-N 3.42Å; T98-A178 HydrophobicContact CG2-CB 4.02Å; T98-T274 WeakPolarHBondContact OG1-CA 3.1Å; T98-T274 WeakPolarHBondContact OG1-CB 3.36Å; T98-T274 WeakPolarHBondContact OG1-CG2 3.49Å; T98-F277 HydrophobicContact CG2-CB 4.03Å; T98-F277 HydrophobicContact CG2-CD1 3.28Å; T98-F277 HydrophobicContact CG2-CD2 4.38Å; T98-F277 HydrophobicContact CG2-CE1 3.84Å; T98-F277 HydrophobicContact CG2-CG 3.62Å |
| 99 | V | 88.9 | Confident | 88.4 | Confident | 42 Ų | 42 | 67.2 Ų | 67.2 | 26% | 0.255 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -56.6 | -47.9 | 174.2 | 173.5 | 0 | 0 | 0 | 0 | 110.4 | F95 F96 V101 E102 Q103 F277 | F95-V99 HydrophobicContact CD1-CG2 4.32Å; F95-V99 HydrophobicContact CE1-CG2 3.84Å; F95-V99 HydrophobicContact CE2-CG2 4.37Å; F95-V99 HydrophobicContact CZ-CG2 3.87Å; F95-V99 WeakPolarHBondContact O-CG2 3.37Å; F95-V99 PolarHBondContact O-N 3.43Å; F96-V99 PolarHBondContact O-N 3.37Å; V99-V101 PolarHBondContact O-N 3.16Å; V99-E102 PolarHBondContact O-N 2.78Å; V99-Q103 HydrophobicContact CG1-CG 4.16Å; V99-Q103 WeakPolarHBondContact O-CB 3.44Å; V99-Q103 VanDerWaalsContact O-CG 3.26Å; V99-Q103 WeakPolarHBondContact O-CG 3.34Å; V99-Q103 PolarHBondContact O-N 3.08Å; V99-F277 HydrophobicContact CG2-CD2 3.57Å; V99-F277 HydrophobicContact CG2-CE2 3.78Å |
| 100 | F | 88.8 | Confident | 86.3 | Confident | 141 Ų | 141 | 74.2 Ų | 74.2 | 62% | 0.618 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -59.7 | -46.4 | 179.5 | 174 | -98.5 | 0 | 0 | 0 | 112.1 | F96 L97 T98 Q103 A104 | F96-F100 WeakPolarHBondContact O-CB 3.46Å; F96-F100 PolarHBondContact O-N 3.25Å; L97-F100 PolarHBondContact O-N 3.45Å; T98-F100 VanDerWaalsContact C-N 3.32Å; T98-F100 PolarHBondContact O-N 2.97Å; F100-Q103 PolarHBondContact O-N 3.31Å; F100-A104 VanDerWaalsContact O-CB 3.23Å; F100-A104 WeakPolarHBondContact O-CB 3.45Å; F100-A104 PolarHBondContact O-N 3.08Å |
| 101 | V | 86.5 | Confident | 84.1 | Confident | 58 Ų | 58 | 77.3 Ų | 77.3 | 35% | 0.352 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -61.9 | -45.3 | 178.3 | 170.9 | 0 | 0 | 0 | 0 | 110.8 | L97 T98 V99 A104 V105 L177 | L97-V101 WeakPolarHBondContact O-CG2 3.4Å; L97-V101 PolarHBondContact O-N 2.84Å; T98-V101 PolarHBondContact O-N 2.89Å; V99-V101 PolarHBondContact O-N 3.16Å; V101-A104 PolarHBondContact O-N 3.2Å; V101-V105 HydrophobicContact CG1-CG2 4.47Å; V101-V105 VanDerWaalsContact O-CG2 3.29Å; V101-V105 WeakPolarHBondContact O-CG2 3.36Å; V101-V105 PolarHBondContact O-N 3.29Å; V101-L177 HydrophobicContact CG1-CD2 3.88Å |
| 102 | E | 83.1 | Confident | 81.7 | Confident | 39 Ų | 39 | 86.5 Ų | 86.5 | 18% | 0.182 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -59.5 | -51.4 | 177 | -175.7 | -168.5 | -152 | 0 | 0 | 111.4 | T98 V99 A104 V105 L106 S174 F277 | T98-E102 WeakPolarHBondContact O-CB 3.42Å; T98-E102 PolarHBondContact O-N 3.42Å; V99-E102 PolarHBondContact O-N 2.78Å; E102-A104 VanDerWaalsContact C-N 3.31Å; E102-A104 PolarHBondContact O-N 3.22Å; E102-V105 PolarHBondContact O-N 2.84Å; E102-L106 HydrophobicContact CG-CD1 4.23Å; E102-L106 WeakPolarHBondContact O-CG 3.38Å; E102-L106 PolarHBondContact O-N 3.06Å; E102-S174 PolarHBondContact OE1-OG 3.38Å; E102-F277 WeakPolarHBondContact OE2-CE2 3.03Å; E102-F277 WeakPolarHBondContact OE2-CZ 3.34Å |
| 103 | Q | 84.5 | Confident | 79.2 | Confident | 77 Ų | 77 | 88.6 Ų | 88.6 | 36% | 0.36 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -64.1 | -36.2 | -179.3 | -64.4 | -51.1 | -51.6 | 0 | 0 | 112.1 | V99 F100 L106 T107 | V99-Q103 HydrophobicContact CG1-CG 4.16Å; V99-Q103 WeakPolarHBondContact O-CB 3.44Å; V99-Q103 VanDerWaalsContact O-CG 3.26Å; V99-Q103 WeakPolarHBondContact O-CG 3.34Å; V99-Q103 PolarHBondContact O-N 3.08Å; F100-Q103 PolarHBondContact O-N 3.31Å; Q103-L106 PolarHBondContact O-N 2.87Å; Q103-T107 VanDerWaalsContact O-CB 3.31Å; Q103-T107 WeakPolarHBondContact O-CB 3.38Å; Q103-T107 PolarHBondContact O-N 3.16Å; Q103-T107 PolarHBondContact O-OG1 3.31Å |
| 104 | A | 84.4 | Confident | 77.1 | Confident | 23 Ų | 23 | 87.5 Ų | 87.5 | 19% | 0.19 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -62.2 | -49.4 | 173.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | F100 V101 E102 L106 T107 F108 | F100-A104 VanDerWaalsContact O-CB 3.23Å; F100-A104 WeakPolarHBondContact O-CB 3.45Å; F100-A104 PolarHBondContact O-N 3.08Å; V101-A104 PolarHBondContact O-N 3.2Å; E102-A104 VanDerWaalsContact C-N 3.31Å; E102-A104 PolarHBondContact O-N 3.22Å; A104-L106 VanDerWaalsContact C-N 3.3Å; A104-L106 PolarHBondContact O-N 3.2Å; A104-T107 PolarHBondContact O-N 3.11Å; A104-T107 VanDerWaalsContact O-N 3.16Å; A104-F108 HydrophobicContact CB-CD2 4.36Å; A104-F108 HydrophobicContact CB-CE2 4.21Å; A104-F108 WeakPolarHBondContact O-CD2 3.48Å; A104-F108 PolarHBondContact O-N 3.47Å |
| 105 | V | 81.4 | Confident | 75 | Confident | 71 Ų | 71 | 93.7 Ų | 93.7 | 43% | 0.43 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -57.3 | -44.1 | 178.1 | 168.9 | 0 | 0 | 0 | 0 | 111.2 | V101 E102 K109 L177 | V101-V105 HydrophobicContact CG1-CG2 4.47Å; V101-V105 VanDerWaalsContact O-CG2 3.29Å; V101-V105 WeakPolarHBondContact O-CG2 3.36Å; V101-V105 PolarHBondContact O-N 3.29Å; E102-V105 PolarHBondContact O-N 2.84Å; V105-K109 WeakPolarHBondContact O-CB 3.37Å; V105-K109 PolarHBondContact O-N 3.27Å; V105-L177 HydrophobicContact CG2-CD2 3.96Å |
| 106 | L | 77.3 | Confident | 72.8 | Confident | 50 Ų | 50 | 98.8 Ų | 98.8 | 26% | 0.262 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.9 | -42.8 | 177.2 | -66.8 | 174 | 0 | 0 | 0 | 112 | E102 Q103 A104 K109 | E102-L106 HydrophobicContact CG-CD1 4.23Å; E102-L106 WeakPolarHBondContact O-CG 3.38Å; E102-L106 PolarHBondContact O-N 3.06Å; Q103-L106 PolarHBondContact O-N 2.87Å; A104-L106 VanDerWaalsContact C-N 3.3Å; A104-L106 PolarHBondContact O-N 3.2Å; L106-K109 PolarHBondContact O-N 2.87Å |
| 107 | T | 80 | Confident | 70.5 | Confident | 104 Ų | 104 | 98.9 Ų | 98.9 | 64% | 0.638 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -63.1 | -44.8 | 179.7 | -59.3 | 0 | 0 | 0 | 0 | 111.9 | Q103 A104 K109 | Q103-T107 VanDerWaalsContact O-CB 3.31Å; Q103-T107 WeakPolarHBondContact O-CB 3.38Å; Q103-T107 PolarHBondContact O-N 3.16Å; Q103-T107 PolarHBondContact O-OG1 3.31Å; A104-T107 PolarHBondContact O-N 3.11Å; A104-T107 VanDerWaalsContact O-N 3.16Å; T107-K109 PolarHBondContact O-N 2.88Å |
| 108 | F | 77.6 | Confident | 68.3 | Low | 180 Ų | 180 | 102 Ų | 102 | 79% | 0.789 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -71.9 | -16.8 | -179.4 | -71.9 | -64.4 | 0 | 0 | 0 | 113.6 | A104 | A104-F108 HydrophobicContact CB-CD2 4.36Å; A104-F108 HydrophobicContact CB-CE2 4.21Å; A104-F108 WeakPolarHBondContact O-CD2 3.48Å; A104-F108 PolarHBondContact O-N 3.47Å |
| 109 | K | 72.3 | Confident | 66.2 | Low | 129 Ų | 129 | 108.3 Ų | 108.3 | 56% | 0.561 | 55% | 0.545 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85 | -2.2 | -177.5 | -146.2 | 172.5 | 176.7 | 177.7 | 0 | 114.8 | V105 L106 T107 L170 | V105-K109 WeakPolarHBondContact O-CB 3.37Å; V105-K109 PolarHBondContact O-N 3.27Å; L106-K109 PolarHBondContact O-N 2.87Å; T107-K109 PolarHBondContact O-N 2.88Å; K109-L170 HydrophobicContact CD-CD2 3.88Å |
| 110 | K | 52.9 | Low | 64.1 | Low | 200 Ų | 200 | 112.2 Ų | 112.2 | 87% | 0.87 | 57% | 0.569 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 50 | 57.4 | -178.3 | -81.1 | -173.1 | 174.8 | 178.9 | 0 | 113.4 | ||
| 111 | E | 49.4 | Very low | 61.8 | Low | 93 Ų | 93 | 114.3 Ų | 114.3 | 44% | 0.435 | 58% | 0.578 | S | S | . | * | S | Bend | trans | -133 | 143.2 | 157.6 | -85.8 | 179.1 | 170.7 | 0 | 0 | 108.9 | R166 | E111-R166 IonicContact OE1-CZ 2.68Å; E111-R166 IonicContact OE1-NE 3.63Å; E111-R166 PolarHBondContact OE1-NE 3.46Å; E111-R166 IonicContact OE1-NH2 2.91Å; E111-R166 PolarHBondContact OE1-NH2 2.77Å; E111-R166 IonicContact OE2-NE 3.76Å |
| 112 | K | 46.4 | Very low | 59.7 | Low | 201 Ų | 201 | 117.1 Ų | 117.1 | 87% | 0.874 | 59% | 0.591 | S | S | * | * | P | Polyproline II helix | trans | -54.4 | 137.9 | -176 | -69.2 | 176.2 | 179.4 | 179.5 | 0 | 110 | S114 | K112-S114 PolarHBondContact O-N 2.9Å; K112-S114 VanDerWaalsContact O-N 3.1Å |
| 113 | P | 45.8 | Very low | 57.8 | Low | 117 Ų | 117 | 119.7 Ų | 119.7 | 76% | 0.76 | 62% | 0.62 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 117.9 | -174.9 | 25.1 | -32.9 | 0 | 0 | 0 | 110 | ||
| 114 | S | 52.8 | Low | 55.5 | Low | 81 Ų | 81 | 127.3 Ų | 127.3 | 57% | 0.566 | 65% | 0.645 | S | S | * | * | P | Polyproline II helix | trans | -83 | 125.4 | 155.6 | 61.1 | 0 | 0 | 0 | 0 | 107.1 | K112 | K112-S114 PolarHBondContact O-N 2.9Å; K112-S114 VanDerWaalsContact O-N 3.1Å |
| 115 | F | 51 | Low | 53.4 | Low | 129 Ų | 129 | 130 Ų | 130 | 57% | 0.566 | 66% | 0.662 | S | S | * | * | S | Bend | trans | 96.7 | 61.3 | 165.9 | -146.4 | -96.8 | 0 | 0 | 0 | 117.7 | ||
| 116 | I | 48.6 | Very low | 51.4 | Low | 136 Ų | 136 | 131.9 Ų | 131.9 | 70% | 0.697 | 68% | 0.679 | S | S | * | * | -140.2 | 104.2 | 121.1 | -56.2 | -177 | 0 | 0 | 0 | 105.2 | L118 | I116-L118 HydrophobicContact CG2-CB 4.27Å; I116-L118 HydrophobicContact CG2-CD1 3.69Å; I116-L118 PolarHBondContact O-N 3.02Å | |||
| 117 | D | 45.8 | Very low | 50 | Low | 122 Ų | 122 | 139 Ų | 139 | 65% | 0.652 | 71% | 0.711 | S | S | * | * | trans | -72.5 | 86.4 | 166.9 | -171.2 | 11.3 | 0 | 0 | 0 | 108 | E119 | D117-E119 PolarHBondContact O-N 3Å; D117-E119 WeakPolarHBondContact OD1-CB 3.07Å; D117-E119 WeakPolarHBondContact OD1-CG 3.2Å; D117-E119 PolarHBondContact OD1-N 3.39Å | ||
| 118 | L | 46.9 | Very low | 47.8 | Very low | 134 Ų | 134 | 138.8 Ų | 138.8 | 70% | 0.702 | 72% | 0.719 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.4 | 19.8 | 177.9 | -150 | 84.3 | 0 | 0 | 0 | 111.3 | I116 | I116-L118 HydrophobicContact CG2-CB 4.27Å; I116-L118 HydrophobicContact CG2-CD1 3.69Å; I116-L118 PolarHBondContact O-N 3.02Å |
| 119 | E | 46.6 | Very low | 45.8 | Very low | 148 Ų | 148 | 134 Ų | 134 | 69% | 0.692 | 72% | 0.721 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.3 | -15.2 | 176.1 | -68 | -155.2 | 150.9 | 0 | 0 | 113.4 | D117 F121 N122 | D117-E119 PolarHBondContact O-N 3Å; D117-E119 WeakPolarHBondContact OD1-CB 3.07Å; D117-E119 WeakPolarHBondContact OD1-CG 3.2Å; D117-E119 PolarHBondContact OD1-N 3.39Å; E119-F121 VanDerWaalsContact C-N 3.26Å; E119-F121 PolarHBondContact O-N 3.46Å; E119-N122 PolarHBondContact O-N 2.95Å |
| 120 | T | 44.6 | Very low | 43.9 | Very low | 123 Ų | 123 | 133.6 Ų | 133.6 | 76% | 0.755 | 73% | 0.734 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.5 | -16.4 | 179.3 | -56.7 | 0 | 0 | 0 | 0 | 113.3 | ||
| 121 | F | 39.1 | Very low | 43.2 | Very low | 185 Ų | 185 | 131.2 Ų | 131.2 | 81% | 0.811 | 73% | 0.731 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.2 | -13.9 | 178.4 | -130.1 | -93.7 | 0 | 0 | 0 | 114.3 | E119 | E119-F121 VanDerWaalsContact C-N 3.26Å; E119-F121 PolarHBondContact O-N 3.46Å |
| 122 | N | 43.1 | Very low | 42.5 | Very low | 117 Ų | 117 | 132 Ų | 132 | 63% | 0.626 | 75% | 0.747 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.3 | -11 | -176.6 | -134 | 12 | 0 | 0 | 0 | 113.7 | E119 R124 S125 | E119-N122 PolarHBondContact O-N 2.95Å; N122-R124 PolarHBondContact O-N 3.47Å; N122-S125 PolarHBondContact O-OG 2.84Å; N122-S125 PolarHBondContact OD1-OG 3.49Å |
| 123 | A | 43 | Very low | 41.8 | Very low | 94 Ų | 94 | 131.2 Ų | 131.2 | 78% | 0.777 | 75% | 0.746 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.7 | 2.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||
| 124 | R | 37.3 | Very low | 41.3 | Very low | 237 Ų | 237 | 136.1 Ų | 136.1 | 89% | 0.894 | 75% | 0.751 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115.1 | 3.7 | -179.7 | -166.6 | 158.3 | 171.5 | 81.7 | 1.2 | 114.6 | N122 | N122-R124 PolarHBondContact O-N 3.47Š|
| 125 | S | 39 | Very low | 40.4 | Very low | 79 Ų | 79 | 140 Ų | 140 | 55% | 0.552 | 77% | 0.765 | S | S | * | * | S | Bend | trans | -116.8 | 7.6 | -176.4 | 40.8 | 0 | 0 | 0 | 0 | 114.7 | N122 | N122-S125 PolarHBondContact O-OG 2.84Å; N122-S125 PolarHBondContact OD1-OG 3.49Å |
| 126 | S | 39.8 | Very low | 39.6 | Very low | 111 Ų | 111 | 137.8 Ų | 137.8 | 78% | 0.776 | 77% | 0.771 | S | S | * | * | trans | -112.3 | 52.6 | 174.8 | -57.6 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 127 | E | 47.5 | Very low | 39.8 | Very low | 200 Ų | 200 | 137 Ų | 137 | 94% | 0.935 | 77% | 0.774 | S | S | * | * | trans | -115.3 | 89.4 | 151.7 | -70.2 | -145.8 | 143.9 | 0 | 0 | 108.2 | ||||
| 128 | A | 35.3 | Very low | 39.2 | Very low | 99 Ų | 99 | 140.9 Ų | 140.9 | 82% | 0.818 | 79% | 0.786 | S | S | * | * | trans | -158.6 | 115.5 | 161.1 | 0 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 129 | G | 34.3 | Very low | 38.8 | Very low | 79 Ų | 79 | 140.9 Ų | 140.9 | 81% | 0.814 | 79% | 0.785 | S | S | * | * | trans | -77.2 | -177.6 | -162.3 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 130 | S | 32.3 | Very low | 38.3 | Very low | 121 Ų | 121 | 138.9 Ų | 138.9 | 85% | 0.846 | 79% | 0.787 | S | S | * | * | trans | -162.6 | 130.3 | 142.4 | -168.5 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 131 | D | 38.2 | Very low | 38.7 | Very low | 149 Ų | 149 | 138.2 Ų | 138.2 | 80% | 0.797 | 79% | 0.786 | S | S | * | * | trans | -81.7 | 178.4 | -173.8 | -58.9 | -47.9 | 0 | 0 | 0 | 114.1 | ||||
| 132 | S | 34.8 | Very low | 38.2 | Very low | 110 Ų | 110 | 135.8 Ų | 135.8 | 77% | 0.769 | 79% | 0.786 | S | S | * | * | trans | 85.9 | 132.6 | 165.2 | 73 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 133 | E | 33.1 | Very low | 37.7 | Very low | 185 Ų | 185 | 141.9 Ų | 141.9 | 86% | 0.864 | 80% | 0.8 | S | S | * | * | cis | -155.6 | 158.1 | 33.7 | -161.4 | 157.5 | 105.7 | 0 | 0 | 113 | ||||
| 134 | Y | 35.2 | Very low | 37.2 | Very low | 219 Ų | 219 | 141 Ų | 141 | 86% | 0.859 | 80% | 0.8 | S | S | * | * | trans | -58.2 | 143.5 | 178 | -99.2 | -117.9 | 0 | 0 | 0 | 114.6 | ||||
| 135 | D | 34.1 | Very low | 37 | Very low | 163 Ų | 163 | 134.9 Ų | 134.9 | 87% | 0.872 | 79% | 0.793 | S | S | * | * | -169.1 | 144.7 | 111.9 | -128.3 | -19.2 | 0 | 0 | 0 | 112.7 | |||||
| 136 | A | 33.8 | Very low | 36.9 | Very low | 82 Ų | 82 | 137.5 Ų | 137.5 | 68% | 0.678 | 81% | 0.808 | S | S | * | * | trans | -107.3 | -157.7 | -178 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 137 | P | 52 | Low | 36.7 | Very low | 119 Ų | 119 | 138.5 Ų | 138.5 | 77% | 0.773 | 81% | 0.81 | S | S | * | * | -114.2 | 151.2 | -105.1 | 35.1 | -18.6 | 0 | 0 | 0 | 114.6 | |||||
| 138 | F | 32.5 | Very low | 36.1 | Very low | 205 Ų | 205 | 133.4 Ų | 133.4 | 90% | 0.899 | 80% | 0.796 | S | S | * | * | trans | -159.4 | 157.2 | 157.9 | -148.4 | -105.2 | 0 | 0 | 0 | 115.6 | ||||
| 139 | I | 40 | Very low | 36 | Very low | 134 Ų | 134 | 139 Ų | 139 | 69% | 0.687 | 80% | 0.796 | S | S | * | * | trans | -85.9 | 144.9 | -162.8 | -65.2 | 165.7 | 0 | 0 | 0 | 113.5 | ||||
| 140 | S | 35.8 | Very low | 35.8 | Very low | 105 Ų | 105 | 143.2 Ų | 143.2 | 73% | 0.734 | 79% | 0.794 | S | S | * | * | trans | -10 | 176.8 | 158.9 | -42.1 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 141 | P | 51.6 | Low | 35.8 | Very low | 110 Ų | 110 | 144.9 Ų | 144.9 | 71% | 0.714 | 79% | 0.788 | S | S | * | * | cis | -133.6 | 173.9 | -31.2 | 31 | -10.3 | 0 | 0 | 0 | 114.1 | ||||
| 142 | T | 29.2 | Very low | 35.7 | Very low | 134 Ų | 134 | 146 Ų | 146 | 82% | 0.822 | 79% | 0.789 | S | S | * | * | trans | 142 | 138.8 | 137.1 | 47.5 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 143 | R | 32.6 | Very low | 35.5 | Very low | 245 Ų | 245 | 143.4 Ų | 143.4 | 93% | 0.925 | 78% | 0.779 | S | S | * | * | trans | 72.6 | 101.6 | 150.1 | -91.5 | 178 | 153.2 | -179.6 | -6.7 | 120.9 | ||||
| 144 | G | 32.2 | Very low | 35.6 | Very low | 74 Ų | 74 | 142.3 Ų | 142.3 | 76% | 0.763 | 77% | 0.773 | S | S | * | * | 82.2 | 94.6 | 112.2 | 0 | 0 | 0 | 0 | 0 | 118.7 | |||||
| 145 | S | 33.2 | Very low | 35.3 | Very low | 109 Ų | 109 | 140.9 Ų | 140.9 | 76% | 0.762 | 77% | 0.774 | S | S | * | * | trans | 175 | 147.2 | 132.3 | -79.9 | 0 | 0 | 0 | 0 | 110.1 | V147 | S145-V147 PolarHBondContact O-N 3.08Š| ||
| 146 | P | 36.8 | Very low | 35.6 | Very low | 134 Ų | 134 | 140.7 Ų | 140.7 | 87% | 0.87 | 77% | 0.768 | S | S | * | * | trans | -81.3 | 106.5 | -175.6 | 32.4 | -29.2 | 0 | 0 | 0 | 109.4 | ||||
| 147 | V | 36.4 | Very low | 35.6 | Very low | 132 Ų | 132 | 140.3 Ų | 140.3 | 80% | 0.8 | 77% | 0.772 | S | S | * | * | trans | -109.3 | 117.5 | 169.6 | -179.7 | 0 | 0 | 0 | 0 | 108.6 | S145 | S145-V147 PolarHBondContact O-N 3.08Š| ||
| 148 | S | 34.9 | Very low | 34.8 | Very low | 94 Ų | 94 | 142.1 Ų | 142.1 | 66% | 0.657 | 77% | 0.77 | S | S | * | * | trans | 6.7 | 106.3 | 160.9 | -156.1 | 0 | 0 | 0 | 0 | 116.7 | H150 | S148-H150 PolarHBondContact O-N 3.25Å; S148-H150 VanDerWaalsContact O-N 3.1Å | ||
| 149 | R | 32.3 | Very low | 35.1 | Very low | 217 Ų | 217 | 138.3 Ų | 138.3 | 82% | 0.819 | 76% | 0.758 | S | S | * | * | trans | -65.6 | 103.8 | 160.9 | -92.6 | 179 | 169.7 | 162.2 | -3.3 | 108.7 | H151 | R149-H151 PolarHBondContact O-N 3.1Š| ||
| 150 | H | 31.6 | Very low | 34.7 | Very low | 167 Ų | 167 | 134 Ų | 134 | 77% | 0.773 | 74% | 0.74 | S | S | * | * | trans | -67.2 | 99.3 | 154.1 | -87.1 | -75.9 | 0 | 0 | 0 | 108 | S148 H152 | S148-H150 PolarHBondContact O-N 3.25Å; S148-H150 VanDerWaalsContact O-N 3.1Å; H150-H152 PolarHBondContact O-N 3.07Å | ||
| 151 | H | 31.8 | Very low | 35.1 | Very low | 155 Ų | 155 | 133.4 Ų | 133.4 | 72% | 0.718 | 73% | 0.734 | S | S | * | * | trans | -68.6 | 111.4 | 161.5 | -84.8 | -85.6 | 0 | 0 | 0 | 107.8 | R149 G153 | R149-H151 PolarHBondContact O-N 3.1Å; H151-G153 PolarHBondContact O-N 3.22Å | ||
| 152 | H | 36.2 | Very low | 34.3 | Very low | 174 Ų | 174 | 133 Ų | 133 | 81% | 0.806 | 73% | 0.73 | S | S | * | * | trans | -64 | 88.9 | 156 | -74.7 | -74.1 | 0 | 0 | 0 | 107.5 | H150 H154 | H150-H152 PolarHBondContact O-N 3.07Å; H152-H154 PolarHBondContact O-N 2.68Å | ||
| 153 | G | 29.8 | Very low | 34.6 | Very low | 55 Ų | 55 | 131.9 Ų | 131.9 | 57% | 0.567 | 72% | 0.715 | S | S | * | * | trans | -68.5 | 107.9 | 167.5 | 0 | 0 | 0 | 0 | 0 | 108.2 | H151 H155 | H151-G153 PolarHBondContact O-N 3.22Å; G153-H155 VanDerWaalsContact C-N 3.26Å; G153-H155 PolarHBondContact O-N 2.95Å | ||
| 154 | H | 35.9 | Very low | 34.8 | Very low | 161 Ų | 161 | 126.3 Ų | 126.3 | 75% | 0.745 | 70% | 0.703 | S | S | * | * | trans | -58.4 | 94.2 | 160.7 | -67.5 | -78.4 | 0 | 0 | 0 | 108 | H152 H156 | H152-H154 PolarHBondContact O-N 2.68Å; H154-H156 PolarHBondContact O-N 2.92Å | ||
| 155 | H | 28.1 | Very low | 35.1 | Very low | 189 Ų | 189 | 126 Ų | 126 | 88% | 0.875 | 69% | 0.693 | S | S | * | * | trans | -70.3 | 84.1 | 166.8 | -93.1 | -83.2 | 0 | 0 | 0 | 107.8 | G153 G157 | G153-H155 VanDerWaalsContact C-N 3.26Å; G153-H155 PolarHBondContact O-N 2.95Å; H155-G157 PolarHBondContact O-N 3.39Å; H155-G157 VanDerWaalsContact O-N 3.16Å | ||
| 156 | H | 40.9 | Very low | 35.3 | Very low | 159 Ų | 159 | 127.4 Ų | 127.4 | 74% | 0.736 | 68% | 0.681 | S | S | * | * | trans | -56.7 | 117.2 | 152.4 | -66.5 | -70.2 | 0 | 0 | 0 | 106.3 | H154 H158 | H154-H156 PolarHBondContact O-N 2.92Å; H156-H158 PolarHBondContact O-N 3.41Å | ||
| 157 | G | 34.7 | Very low | 36 | Very low | 75 Ų | 75 | 122.4 Ų | 122.4 | 77% | 0.773 | 65% | 0.651 | S | S | * | * | trans | -60.1 | 83.3 | 171.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | H155 L159 | H155-G157 PolarHBondContact O-N 3.39Å; H155-G157 VanDerWaalsContact O-N 3.16Å; G157-L159 PolarHBondContact O-N 2.86Å | ||
| 158 | H | 33.5 | Very low | 37.4 | Very low | 157 Ų | 157 | 117.3 Ų | 117.3 | 73% | 0.727 | 63% | 0.626 | S | S | * | * | trans | -72.9 | 85.7 | 167.5 | -174.4 | -80.3 | 0 | 0 | 0 | 106.1 | H156 S160 | H156-H158 PolarHBondContact O-N 3.41Å; H158-S160 PolarHBondContact O-N 3.13Å | ||
| 159 | L | 39.9 | Very low | 39.3 | Very low | 125 Ų | 125 | 116.8 Ų | 116.8 | 65% | 0.654 | 62% | 0.62 | S | S | * | * | trans | -45.6 | 116.3 | 164.8 | -76.1 | 161.5 | 0 | 0 | 0 | 107 | G157 | G157-L159 PolarHBondContact O-N 2.86Š| ||
| 160 | S | 30.6 | Very low | 41.3 | Very low | 43 Ų | 43 | 108.6 Ų | 108.6 | 30% | 0.301 | 59% | 0.592 | S | S | . | * | trans | -61.8 | 143.3 | -178.3 | 66.2 | 0 | 0 | 0 | 0 | 108.4 | H158 T162 E163 L164 | H158-S160 PolarHBondContact O-N 3.13Å; S160-T162 PolarHBondContact O-N 3.32Å; S160-E163 PolarHBondContact O-N 2.95Å; S160-E163 VanDerWaalsContact OG-CG 3.3Å; S160-E163 WeakPolarHBondContact OG-CG 3.27Å; S160-E163 PolarHBondContact OG-N 3.41Å; S160-L164 PolarHBondContact O-N 2.95Å | ||
| 161 | P | 45.4 | Very low | 43.3 | Very low | 93 Ų | 93 | 104.6 Ų | 104.6 | 60% | 0.604 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -51.9 | -23 | 171.3 | -27.1 | 34.8 | 0 | 0 | 0 | 112.6 | A165 | P161-A165 WeakPolarHBondContact O-CB 3.19Å; P161-A165 PolarHBondContact O-N 2.95Å |
| 162 | T | 34.7 | Very low | 45.8 | Very low | 102 Ų | 102 | 97.8 Ų | 97.8 | 63% | 0.626 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -70.9 | -37.8 | 176.1 | -23.7 | 0 | 0 | 0 | 0 | 113.3 | S160 R166 | S160-T162 PolarHBondContact O-N 3.32Å; T162-R166 WeakPolarHBondContact O-CB 3.28Å; T162-R166 PolarHBondContact O-N 3.43Å |
| 163 | E | 34.7 | Very low | 48.1 | Very low | 110 Ų | 110 | 92 Ų | 92 | 51% | 0.514 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -71.6 | -38.7 | 173.3 | -69.4 | -88.4 | 122.4 | 0 | 0 | 111 | S160 A165 R166 A167 | S160-E163 PolarHBondContact O-N 2.95Å; S160-E163 VanDerWaalsContact OG-CG 3.3Å; S160-E163 WeakPolarHBondContact OG-CG 3.27Å; S160-E163 PolarHBondContact OG-N 3.41Å; E163-A165 VanDerWaalsContact C-N 3.34Å; E163-A165 PolarHBondContact O-N 3.34Å; E163-R166 PolarHBondContact O-N 3.18Å; E163-A167 PolarHBondContact O-N 3.43Å |
| 164 | L | 37.5 | Very low | 50.6 | Low | 128 Ų | 128 | 90.3 Ų | 90.3 | 67% | 0.67 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -68.1 | -33.7 | 175.7 | -146.3 | 73.2 | 0 | 0 | 0 | 112.1 | S160 | S160-L164 PolarHBondContact O-N 2.95Å |
| 165 | A | 37.8 | Very low | 53.1 | Low | 66 Ų | 66 | 82.9 Ų | 82.9 | 55% | 0.545 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -74 | -25.8 | 171.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | P161 E163 P169 | P161-A165 WeakPolarHBondContact O-CB 3.19Å; P161-A165 PolarHBondContact O-N 2.95Å; E163-A165 VanDerWaalsContact C-N 3.34Å; E163-A165 PolarHBondContact O-N 3.34Å; A165-P169 WeakPolarHBondContact O-CD 3.16Å |
| 166 | R | 38.4 | Very low | 56 | Low | 139 Ų | 139 | 75 Ų | 75 | 53% | 0.525 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -80.1 | -30.9 | 176.8 | -134 | 176.8 | 175.2 | 145.7 | -2.1 | 112.9 | E111 T162 E163 G168 P169 | E111-R166 IonicContact OE1-CZ 2.68Å; E111-R166 IonicContact OE1-NE 3.63Å; E111-R166 PolarHBondContact OE1-NE 3.46Å; E111-R166 IonicContact OE1-NH2 2.91Å; E111-R166 PolarHBondContact OE1-NH2 2.77Å; E111-R166 IonicContact OE2-NE 3.76Å; T162-R166 WeakPolarHBondContact O-CB 3.28Å; T162-R166 PolarHBondContact O-N 3.43Å; E163-R166 PolarHBondContact O-N 3.18Å; R166-G168 VanDerWaalsContact C-N 3.32Å; R166-G168 PolarHBondContact O-N 3.12Å; R166-P169 WeakPolarHBondContact O-CD 3.42Å |
| 167 | A | 50.5 | Low | 58.3 | Low | 29 Ų | 29 | 70.9 Ų | 70.9 | 24% | 0.24 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -67.6 | -29.6 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | E163 R171 | E163-A167 PolarHBondContact O-N 3.43Å; A167-R171 WeakPolarHBondContact O-CB 3.39Å; A167-R171 VanDerWaalsContact O-CG 3.27Å; A167-R171 WeakPolarHBondContact O-CG 3.2Å; A167-R171 PolarHBondContact O-N 2.83Å; A167-R171 VanDerWaalsContact O-N 3.07Å |
| 168 | G | 66.6 | Low | 60.9 | Low | 26 Ų | 26 | 67.6 Ų | 67.6 | 27% | 0.268 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -61.4 | -52.7 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | R166 L172 | R166-G168 VanDerWaalsContact C-N 3.32Å; R166-G168 PolarHBondContact O-N 3.12Å; G168-L172 WeakPolarHBondContact O-CB 3.41Å; G168-L172 PolarHBondContact O-N 3.1Å |
| 169 | P | 73.3 | Confident | 63.6 | Low | 83 Ų | 83 | 60.4 Ų | 60.4 | 54% | 0.539 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -65.1 | -36.5 | 178.7 | -25.7 | 33.7 | 0 | 0 | 0 | 114.2 | A165 R166 A173 | A165-P169 WeakPolarHBondContact O-CD 3.16Å; R166-P169 WeakPolarHBondContact O-CD 3.42Å; P169-A173 VanDerWaalsContact O-CB 3.26Å; P169-A173 WeakPolarHBondContact O-CB 3.33Å; P169-A173 PolarHBondContact O-N 3.33Å |
| 170 | L | 74.4 | Confident | 66.1 | Low | 45 Ų | 45 | 55.2 Ų | 55.2 | 24% | 0.236 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -68.4 | -45.8 | 177.7 | -68.4 | 178.6 | 0 | 0 | 0 | 111.5 | K109 A173 S174 | K109-L170 HydrophobicContact CD-CD2 3.88Å; L170-A173 WeakPolarHBondContact O-CB 3.38Å; L170-A173 PolarHBondContact O-N 3Å; L170-S174 PolarHBondContact O-N 2.91Å |
| 171 | R | 75.3 | Confident | 69 | Low | 83 Ų | 83 | 55 Ų | 55 | 31% | 0.313 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -63.9 | -43 | 175.4 | -70.6 | -179 | -177.5 | -172 | 2.6 | 111.6 | A167 A173 S174 L175 E289 | A167-R171 WeakPolarHBondContact O-CB 3.39Å; A167-R171 VanDerWaalsContact O-CG 3.27Å; A167-R171 WeakPolarHBondContact O-CG 3.2Å; A167-R171 PolarHBondContact O-N 2.83Å; A167-R171 VanDerWaalsContact O-N 3.07Å; R171-A173 VanDerWaalsContact C-N 3.29Å; R171-A173 PolarHBondContact O-N 3.35Å; R171-S174 WeakPolarHBondContact O-CB 3.43Å; R171-S174 PolarHBondContact O-N 2.94Å; R171-L175 WeakPolarHBondContact O-CB 3.43Å; R171-L175 PolarHBondContact O-N 3.27Å; R171-E289 IonicContact CZ-OE2 2.79Å; R171-E289 IonicContact NH1-OE2 3.14Å; R171-E289 PolarHBondContact NH1-OE2 3.4Å; R171-E289 IonicContact NH2-OE2 3.26Å |
| 172 | L | 84.3 | Confident | 71.2 | Confident | 12 Ų | 12 | 50.6 Ų | 50.6 | 6% | 0.063 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -61.4 | -39.1 | 174.2 | -179.2 | 61.9 | 0 | 0 | 0 | 111.8 | G168 V176 L217 V221 A224 L226 L234 | G168-L172 WeakPolarHBondContact O-CB 3.41Å; G168-L172 PolarHBondContact O-N 3.1Å; L172-V176 HydrophobicContact CD1-CG2 4.39Å; L172-V176 WeakPolarHBondContact O-CB 3.45Å; L172-V176 WeakPolarHBondContact O-CG2 3.47Å; L172-V176 PolarHBondContact O-N 3.46Å; L172-L217 HydrophobicContact CD1-CD1 3.95Å; L172-V221 HydrophobicContact CD1-CG2 3.95Å; L172-V221 HydrophobicContact CD2-CG2 4.37Å; L172-A224 HydrophobicContact CD2-CB 3.96Å; L172-L226 HydrophobicContact CD2-CD1 3.52Å; L172-L226 HydrophobicContact CD2-CG 4.35Å; L172-L234 HydrophobicContact CD2-CD1 4.45Å |
| 173 | A | 84.4 | Confident | 74 | Confident | 53 Ų | 53 | 45.7 Ų | 45.7 | 44% | 0.438 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -66.3 | -40.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | P169 L170 R171 V176 L177 | P169-A173 VanDerWaalsContact O-CB 3.26Å; P169-A173 WeakPolarHBondContact O-CB 3.33Å; P169-A173 PolarHBondContact O-N 3.33Å; L170-A173 WeakPolarHBondContact O-CB 3.38Å; L170-A173 PolarHBondContact O-N 3Å; R171-A173 VanDerWaalsContact C-N 3.29Å; R171-A173 PolarHBondContact O-N 3.35Å; A173-V176 PolarHBondContact O-N 2.85Å; A173-L177 WeakPolarHBondContact O-CB 3.25Å; A173-L177 PolarHBondContact O-N 3.18Å |
| 174 | S | 82.8 | Confident | 76.8 | Confident | 18 Ų | 18 | 42 Ų | 42 | 13% | 0.126 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -60.2 | -50.6 | 173.7 | -178.4 | 0 | 0 | 0 | 0 | 111.3 | E102 L170 R171 V176 L177 A178 E282 | E102-S174 PolarHBondContact OE1-OG 3.38Å; L170-S174 PolarHBondContact O-N 2.91Å; R171-S174 WeakPolarHBondContact O-CB 3.43Å; R171-S174 PolarHBondContact O-N 2.94Å; S174-V176 VanDerWaalsContact C-N 3.34Å; S174-V176 PolarHBondContact O-N 3.4Å; S174-L177 WeakPolarHBondContact O-CB 3.17Å; S174-L177 PolarHBondContact O-N 3.24Å; S174-L177 VanDerWaalsContact O-N 3.12Å; S174-A178 WeakPolarHBondContact O-CB 3.38Å; S174-A178 PolarHBondContact O-N 2.82Å; S174-E282 WeakPolarHBondContact CB-OE1 3.32Å; S174-E282 PolarHBondContact OG-OE1 3.39Å |
| 175 | L | 87.3 | Confident | 79.5 | Confident | 5 Ų | 5 | 38 Ų | 38 | 3% | 0.026 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -55.7 | -46.3 | 175.1 | 175.3 | 64 | 0 | 0 | 0 | 112.1 | R171 L177 L179 L217 V278 E282 | R171-L175 WeakPolarHBondContact O-CB 3.43Å; R171-L175 PolarHBondContact O-N 3.27Å; L175-L177 VanDerWaalsContact C-N 3.35Å; L175-L179 HydrophobicContact CD1-CD1 3.67Å; L175-L179 HydrophobicContact CD1-CG 3.95Å; L175-L179 HydrophobicContact CG-CD1 3.96Å; L175-L179 VanDerWaalsContact O-CB 3.28Å; L175-L179 WeakPolarHBondContact O-CB 3.5Å; L175-L179 WeakPolarHBondContact O-CG 3.3Å; L175-L179 PolarHBondContact O-N 2.82Å; L175-L217 HydrophobicContact CD2-CD1 3.72Å; L175-L217 HydrophobicContact CG-CD1 4.07Å; L175-V278 HydrophobicContact CD1-CG1 3.82Å; L175-E282 HydrophobicContact CB-CG 4.42Å; L175-E282 HydrophobicContact CD1-CB 3.84Å; L175-E282 HydrophobicContact CD1-CG 4.3Å |
| 176 | V | 90.2 | Very high | 82 | Confident | 24 Ų | 24 | 35 Ų | 35 | 15% | 0.145 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -63.4 | -41.7 | 177.5 | 168.2 | 0 | 0 | 0 | 0 | 111.4 | L172 A173 S174 S180 L217 L234 V238 | L172-V176 HydrophobicContact CD1-CG2 4.39Å; L172-V176 WeakPolarHBondContact O-CB 3.45Å; L172-V176 WeakPolarHBondContact O-CG2 3.47Å; L172-V176 PolarHBondContact O-N 3.46Å; A173-V176 PolarHBondContact O-N 2.85Å; S174-V176 VanDerWaalsContact C-N 3.34Å; S174-V176 PolarHBondContact O-N 3.4Å; V176-S180 WeakPolarHBondContact O-CB 3.31Å; V176-S180 PolarHBondContact O-N 3.32Å; V176-S180 PolarHBondContact O-OG 3.31Å; V176-L217 HydrophobicContact CG2-CD1 3.97Å; V176-L234 HydrophobicContact CG2-CD1 3.61Å; V176-L234 HydrophobicContact CG2-CD2 3.88Å; V176-L234 HydrophobicContact CG2-CG 3.77Å; V176-V238 HydrophobicContact CG1-CG2 3.89Å |
| 177 | L | 88.6 | Confident | 84.6 | Confident | 73 Ų | 73 | 28.4 Ų | 28.4 | 38% | 0.382 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -65.2 | -49 | 178.6 | 179.8 | 65.6 | 0 | 0 | 0 | 111.3 | V101 V105 A173 S174 L175 S180 A181 | V101-L177 HydrophobicContact CG1-CD2 3.88Å; V105-L177 HydrophobicContact CG2-CD2 3.96Å; A173-L177 WeakPolarHBondContact O-CB 3.25Å; A173-L177 PolarHBondContact O-N 3.18Å; S174-L177 WeakPolarHBondContact O-CB 3.17Å; S174-L177 PolarHBondContact O-N 3.24Å; S174-L177 VanDerWaalsContact O-N 3.12Å; L175-L177 VanDerWaalsContact C-N 3.35Å; L177-S180 PolarHBondContact O-N 3.44Å; L177-A181 PolarHBondContact O-N 2.93Å |
| 178 | A | 88.4 | Confident | 86.6 | Confident | 6 Ų | 6 | 28 Ų | 28 | 5% | 0.05 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -62.7 | -46 | 179.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | T98 S174 A181 H182 F277 V278 | T98-A178 HydrophobicContact CG2-CB 4.02Å; S174-A178 WeakPolarHBondContact O-CB 3.38Å; S174-A178 PolarHBondContact O-N 2.82Å; A178-A181 PolarHBondContact O-N 3.47Å; A178-H182 WeakPolarHBondContact O-CB 3.4Å; A178-H182 PolarHBondContact O-N 3.46Å; A178-F277 HydrophobicContact CB-CD1 4.42Å; A178-F277 HydrophobicContact CB-CE1 4.47Å; A178-V278 HydrophobicContact CB-CG2 3.64Å |
| 179 | L | 90.7 | Very high | 87.7 | Confident | 6 Ų | 6 | 26.9 Ų | 26.9 | 3% | 0.031 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -63.7 | -40.4 | 174.6 | -74.6 | 175.8 | 0 | 0 | 0 | 111.7 | L175 A181 H182 S183 A213 L217 V278 | L175-L179 HydrophobicContact CD1-CD1 3.67Å; L175-L179 HydrophobicContact CD1-CG 3.95Å; L175-L179 HydrophobicContact CG-CD1 3.96Å; L175-L179 VanDerWaalsContact O-CB 3.28Å; L175-L179 WeakPolarHBondContact O-CB 3.5Å; L175-L179 WeakPolarHBondContact O-CG 3.3Å; L175-L179 PolarHBondContact O-N 2.82Å; L179-A181 PolarHBondContact O-N 3.3Å; L179-H182 WeakPolarHBondContact O-CB 3.5Å; L179-H182 PolarHBondContact O-N 2.86Å; L179-S183 WeakPolarHBondContact O-CB 3.45Å; L179-S183 PolarHBondContact O-N 3.45Å; L179-S183 PolarHBondContact O-OG 2.77Å; L179-A213 HydrophobicContact CD2-CB 4.28Å; L179-L217 HydrophobicContact CD1-CB 4Å; L179-L217 HydrophobicContact CD1-CD1 4.4Å; L179-L217 HydrophobicContact CD1-CD2 4.01Å; L179-L217 HydrophobicContact CD1-CG 4.36Å; L179-V278 HydrophobicContact CD2-CG1 4.02Å; L179-V278 HydrophobicContact CD2-CG2 4.35Å; L179-V278 HydrophobicContact CG-CG1 4.43Å |
| 180 | S | 93.2 | Very high | 88.4 | Confident | 16 Ų | 16 | 23 Ų | 23 | 11% | 0.112 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -62 | -44.9 | 177 | -62.3 | 0 | 0 | 0 | 0 | 111.8 | V176 L177 S183 V184 | V176-S180 WeakPolarHBondContact O-CB 3.31Å; V176-S180 PolarHBondContact O-N 3.32Å; V176-S180 PolarHBondContact O-OG 3.31Å; L177-S180 PolarHBondContact O-N 3.44Å; S180-S183 PolarHBondContact O-N 2.84Å; S180-V184 WeakPolarHBondContact O-CG2 3.48Å; S180-V184 PolarHBondContact O-N 3.25Å |
| 181 | A | 89.9 | Confident | 89.1 | Confident | 37 Ų | 37 | 20.9 Ų | 20.9 | 31% | 0.306 | 12% | 0.121 | S | C | . | . | H | α-helix | trans | -63.2 | -44.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | L177 A178 L179 V184 F185 | L177-A181 PolarHBondContact O-N 2.93Å; A178-A181 PolarHBondContact O-N 3.47Å; L179-A181 PolarHBondContact O-N 3.3Å; A181-V184 PolarHBondContact O-N 2.91Å; A181-F185 WeakPolarHBondContact O-CD2 3.4Å; A181-F185 WeakPolarHBondContact O-CG 3.47Å; A181-F185 PolarHBondContact O-N 3.38Å; A181-F185 VanDerWaalsContact O-N 3.1Å |
| 182 | H | 92.8 | Very high | 89.7 | Confident | 1 Ų | 1 | 17.3 Ų | 17.3 | 1% | 0.005 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -54.3 | -54 | 172.8 | 178.5 | 70.5 | 0 | 0 | 0 | 111.9 | A178 L179 V184 F185 E186 A271 T274 F275 | A178-H182 WeakPolarHBondContact O-CB 3.4Å; A178-H182 PolarHBondContact O-N 3.46Å; L179-H182 WeakPolarHBondContact O-CB 3.5Å; L179-H182 PolarHBondContact O-N 2.86Å; H182-V184 VanDerWaalsContact C-N 3.31Å; H182-V184 PolarHBondContact O-N 3.15Å; H182-F185 PolarHBondContact O-N 3.46Å; H182-F185 VanDerWaalsContact O-N 3.13Å; H182-E186 PolarHBondContact O-N 3.02Å; H182-A271 PolarHBondContact CE1-O 3.05Å; H182-A271 PolarHBondContact ND1-O 3.21Å; H182-T274 WeakPolarHBondContact CA-OG1 3.28Å; H182-T274 WeakPolarHBondContact CB-OG1 3.44Å; H182-T274 PolarHBondContact ND1-OG1 2.65Å; H182-F275 AromaticContact CE1-CD2 3.93Å; H182-F275 AromaticContact NE2-CD2 3.75Å |
| 183 | S | 93.6 | Very high | 89.8 | Confident | 0 Ų | 0 | 17.7 Ų | 17.7 | 0% | 0 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -59.9 | -36.5 | -179.7 | -63.7 | 0 | 0 | 0 | 0 | 112.6 | L179 S180 G187 E210 I242 | L179-S183 WeakPolarHBondContact O-CB 3.45Å; L179-S183 PolarHBondContact O-N 3.45Å; L179-S183 PolarHBondContact O-OG 2.77Å; S180-S183 PolarHBondContact O-N 2.84Å; S183-G187 PolarHBondContact O-N 3.27Å; S183-E210 PolarHBondContact OG-OE1 3.17Å; S183-I242 WeakPolarHBondContact O-CG1 3.34Å |
| 184 | V | 94.1 | Very high | 89.6 | Confident | 32 Ų | 32 | 19 Ų | 19 | 19% | 0.194 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -66.4 | -45.3 | 174.5 | 171.5 | 0 | 0 | 0 | 0 | 111.4 | S180 A181 H182 G187 L188 M241 | S180-V184 WeakPolarHBondContact O-CG2 3.48Å; S180-V184 PolarHBondContact O-N 3.25Å; A181-V184 PolarHBondContact O-N 2.91Å; H182-V184 VanDerWaalsContact C-N 3.31Å; H182-V184 PolarHBondContact O-N 3.15Å; V184-G187 PolarHBondContact O-N 2.96Å; V184-L188 HydrophobicContact CG1-CD1 3.88Å; V184-L188 HydrophobicContact CG1-CG 4.41Å; V184-L188 WeakPolarHBondContact O-CB 3.24Å; V184-L188 WeakPolarHBondContact O-CG 3.3Å; V184-L188 PolarHBondContact O-N 3.31Å; V184-M241 HydrophobicContact CG2-CB 3.88Å; V184-M241 HydrophobicContact CG2-CG 4.24Å; V184-M241 HydrophobicContact CG2-SD 3.66Å |
| 185 | F | 92.7 | Very high | 89.5 | Confident | 43 Ų | 43 | 21.4 Ų | 21.4 | 19% | 0.189 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -64.3 | -43.6 | 179.6 | -62.5 | -26.5 | 0 | 0 | 0 | 112.1 | L97 A181 H182 L188 A189 L267 L270 A271 T274 | L97-F185 HydrophobicContact CD2-CE2 4.39Å; L97-F185 HydrophobicContact CD2-CZ 4.3Å; A181-F185 WeakPolarHBondContact O-CD2 3.4Å; A181-F185 WeakPolarHBondContact O-CG 3.47Å; A181-F185 PolarHBondContact O-N 3.38Å; A181-F185 VanDerWaalsContact O-N 3.1Å; H182-F185 PolarHBondContact O-N 3.46Å; H182-F185 VanDerWaalsContact O-N 3.13Å; F185-L188 PolarHBondContact O-N 3.21Å; F185-A189 WeakPolarHBondContact O-CB 3.3Å; F185-A189 PolarHBondContact O-N 3.47Å; F185-L267 HydrophobicContact CD1-CD2 3.98Å; F185-L267 HydrophobicContact CG-CD2 4.49Å; F185-L270 HydrophobicContact CD2-CB 4.23Å; F185-L270 HydrophobicContact CE2-CB 4.43Å; F185-A271 HydrophobicContact CB-CB 3.84Å; F185-T274 HydrophobicContact CD2-CG2 4.1Å; F185-T274 HydrophobicContact CE2-CG2 3.96Å |
| 186 | E | 91.7 | Very high | 89 | Confident | 4 Ų | 4 | 23.2 Ų | 23.2 | 2% | 0.019 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -63.2 | -45.7 | 176 | -168 | 63.9 | -154.5 | 0 | 0 | 111 | H182 L188 A189 L190 V206 | H182-E186 PolarHBondContact O-N 3.02Å; E186-L188 PolarHBondContact O-N 3.35Å; E186-A189 PolarHBondContact O-N 3.06Å; E186-L190 WeakPolarHBondContact O-CG 3.35Å; E186-L190 PolarHBondContact O-N 3.45Å; E186-V206 HydrophobicContact CG-CG1 4.28Å; E186-V206 HydrophobicContact CG-CG2 3.88Å; E186-V206 WeakPolarHBondContact OE1-CG2 3.03Å |
| 187 | G | 92.8 | Very high | 88.5 | Confident | 0 Ų | 0 | 26 Ų | 26 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -59.1 | -45.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | S183 V184 A189 L190 G191 G245 I246 | S183-G187 PolarHBondContact O-N 3.27Å; V184-G187 PolarHBondContact O-N 2.96Å; G187-A189 VanDerWaalsContact C-N 3.34Å; G187-A189 PolarHBondContact O-N 3.44Å; G187-L190 PolarHBondContact O-N 2.88Å; G187-G191 PolarHBondContact O-N 3.31Å; G187-G245 CarbonylContact C-O 3.34Å; G187-G245 CarbonylContact O-C 3.59Å; G187-I246 VanDerWaalsContact C-N 3.31Å; G187-I246 WeakPolarHBondContact O-CA 3.49Å; G187-I246 WeakPolarHBondContact O-CG1 3.36Å; G187-I246 PolarHBondContact O-N 3.26Å |
| 188 | L | 92.1 | Very high | 88 | Confident | 22 Ų | 22 | 25.7 Ų | 25.7 | 12% | 0.115 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -59.6 | -44.7 | 175.2 | -76.6 | 163.5 | 0 | 0 | 0 | 111.3 | V184 F185 E186 L190 G191 L192 G245 L248 I252 L267 | V184-L188 HydrophobicContact CG1-CD1 3.88Å; V184-L188 HydrophobicContact CG1-CG 4.41Å; V184-L188 WeakPolarHBondContact O-CB 3.24Å; V184-L188 WeakPolarHBondContact O-CG 3.3Å; V184-L188 PolarHBondContact O-N 3.31Å; F185-L188 PolarHBondContact O-N 3.21Å; E186-L188 PolarHBondContact O-N 3.35Å; L188-L190 PolarHBondContact O-N 2.87Å; L188-G191 PolarHBondContact O-N 2.86Å; L188-L192 WeakPolarHBondContact O-CB 3.38Å; L188-L192 VanDerWaalsContact O-CG 3.29Å; L188-L192 WeakPolarHBondContact O-CG 3.25Å; L188-L192 PolarHBondContact O-N 3.28Å; L188-G245 VanDerWaalsContact CA-O 3.3Å; L188-G245 WeakPolarHBondContact CA-O 3.43Å; L188-G245 VanDerWaalsContact N-C 3.34Å; L188-G245 PolarHBondContact N-O 3.23Å; L188-L248 HydrophobicContact CD2-CB 3.49Å; L188-L248 VanDerWaalsContact CD2-CB 3.49Å; L188-L248 HydrophobicContact CD2-CD1 4.46Å; L188-I252 HydrophobicContact CD2-CD1 4.24Å; L188-L267 HydrophobicContact CB-CD1 3.7Å; L188-L267 HydrophobicContact CD1-CD1 4.42Å; L188-L267 HydrophobicContact CD1-CD2 4.11Å |
| 189 | A | 88.8 | Confident | 87.6 | Confident | 1 Ų | 1 | 25.7 Ų | 25.7 | 1% | 0.008 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -61.9 | -41.2 | 179 | 0 | 0 | 0 | 0 | 0 | 112.3 | F185 E186 G187 Q193 S264 L267 Q268 | F185-A189 WeakPolarHBondContact O-CB 3.3Å; F185-A189 PolarHBondContact O-N 3.47Å; E186-A189 PolarHBondContact O-N 3.06Å; G187-A189 VanDerWaalsContact C-N 3.34Å; G187-A189 PolarHBondContact O-N 3.44Å; A189-Q193 PolarHBondContact O-N 3.36Å; A189-S264 PolarHBondContact O-OG 2.85Å; A189-L267 HydrophobicContact CB-CB 4.3Å; A189-Q268 HydrophobicContact CB-CB 4.33Å |
| 190 | L | 89.3 | Confident | 87.1 | Confident | 3 Ų | 3 | 27.3 Ų | 27.3 | 2% | 0.016 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -66.6 | -40.3 | 173.3 | -70.1 | 174.3 | 0 | 0 | 0 | 112.3 | E186 G187 L188 L192 Q193 L199 L202 V206 I246 | E186-L190 WeakPolarHBondContact O-CG 3.35Å; E186-L190 PolarHBondContact O-N 3.45Å; G187-L190 PolarHBondContact O-N 2.88Å; L188-L190 PolarHBondContact O-N 2.87Å; L190-L192 VanDerWaalsContact C-N 3.3Å; L190-L192 PolarHBondContact O-N 3.4Å; L190-Q193 WeakPolarHBondContact O-CB 3.41Å; L190-Q193 PolarHBondContact O-N 3.49Å; L190-Q193 VanDerWaalsContact O-N 3.16Å; L190-L199 HydrophobicContact CD2-CD1 4.28Å; L190-L202 HydrophobicContact CD2-CB 3.8Å; L190-V206 HydrophobicContact CD1-CG1 4.29Å; L190-V206 HydrophobicContact CD1-CG2 4.29Å; L190-I246 HydrophobicContact CB-CG1 4.11Å; L190-I246 HydrophobicContact CD1-CD1 4.34Å |
| 191 | G | 89.1 | Confident | 86.4 | Confident | 0 Ų | 0 | 30.3 Ų | 30.3 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -63.2 | -35.6 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | K7 G187 L188 Q193 | K7-G191 PolarHBondContact NZ-O 3.01Å; G187-G191 PolarHBondContact O-N 3.31Å; L188-G191 PolarHBondContact O-N 2.86Å; G191-Q193 VanDerWaalsContact C-N 3.32Å |
| 192 | L | 87.9 | Confident | 86 | Confident | 8 Ų | 8 | 30 Ų | 30 | 4% | 0.042 | 19% | 0.19 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -78.7 | -8.7 | 175.6 | -68.8 | 170.1 | 0 | 0 | 0 | 113.9 | L188 L190 E194 I252 N253 A263 L267 | L188-L192 WeakPolarHBondContact O-CB 3.38Å; L188-L192 VanDerWaalsContact O-CG 3.29Å; L188-L192 WeakPolarHBondContact O-CG 3.25Å; L188-L192 PolarHBondContact O-N 3.28Å; L190-L192 VanDerWaalsContact C-N 3.3Å; L190-L192 PolarHBondContact O-N 3.4Å; L192-E194 PolarHBondContact O-N 3.5Å; L192-I252 HydrophobicContact CD2-CB 4.05Å; L192-I252 HydrophobicContact CD2-CG2 3.86Å; L192-N253 HydrophobicContact CD2-CB 4.24Å; L192-N253 PolarHBondContact O-OD1 3.44Å; L192-A263 HydrophobicContact CD1-CB 4.02Å; L192-L267 HydrophobicContact CD1-CD1 3.77Å |
| 193 | Q | 85.1 | Confident | 85.5 | Confident | 20 Ų | 20 | 32.7 Ų | 32.7 | 9% | 0.093 | 20% | 0.202 | C | C | . | . | trans | -76.2 | 125.4 | -179.2 | -168.3 | 67.6 | -4.5 | 0 | 0 | 111.3 | K7 A189 L190 G191 L199 L202 | K7-Q193 WeakPolarHBondContact CE-O 3.3Å; K7-Q193 PolarHBondContact NZ-O 2.83Å; A189-Q193 PolarHBondContact O-N 3.36Å; L190-Q193 WeakPolarHBondContact O-CB 3.41Å; L190-Q193 PolarHBondContact O-N 3.49Å; L190-Q193 VanDerWaalsContact O-N 3.16Å; G191-Q193 VanDerWaalsContact C-N 3.32Å; Q193-L199 HydrophobicContact CB-CD1 4.45Å; Q193-L199 HydrophobicContact CG-CB 4.32Å; Q193-L202 HydrophobicContact CG-CD1 4.25Å | ||
| 194 | E | 80 | Confident | 85 | Confident | 80 Ų | 80 | 38.2 Ų | 38.2 | 37% | 0.374 | 23% | 0.23 | S | C | . | . | trans | -99.7 | -24.9 | -178.6 | -57 | -160.6 | 147.1 | 0 | 0 | 113.6 | L3 L192 N253 | L3-E194 WeakPolarHBondContact CD2-O 3.29Å; L192-E194 PolarHBondContact O-N 3.5Å; E194-N253 PolarHBondContact OE1-ND2 2.98Å; E194-N253 PolarHBondContact OE1-OD1 3.29Å | ||
| 195 | D | 81.9 | Confident | 84.4 | Confident | 69 Ų | 69 | 38.3 Ų | 38.3 | 37% | 0.369 | 24% | 0.238 | S | C | . | . | trans | -82.3 | 117.9 | 179.6 | -176.9 | -44.9 | 0 | 0 | 0 | 110.7 | A197 K198 L199 | D195-A197 WeakPolarHBondContact OD1-CA 3.48Å; D195-A197 WeakPolarHBondContact OD1-CB 3.49Å; D195-A197 PolarHBondContact OD1-N 2.86Å; D195-K198 HydrophobicContact CB-CB 3.99Å; D195-K198 HydrophobicContact CB-CD 3.94Å; D195-K198 HydrophobicContact CB-CG 4.06Å; D195-K198 PolarHBondContact O-N 3.44Å; D195-K198 PolarHBondContact OD1-N 3.28Å; D195-L199 VanDerWaalsContact O-CB 3.27Å; D195-L199 WeakPolarHBondContact O-CB 3.49Å; D195-L199 PolarHBondContact O-N 3.24Å | ||
| 196 | G | 76.8 | Confident | 83.9 | Confident | 43 Ų | 43 | 36.4 Ų | 36.4 | 44% | 0.443 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -67.3 | -33.3 | -178 | 0 | 0 | 0 | 0 | 0 | 114.6 | L199 G200 | G196-L199 PolarHBondContact O-N 2.94Å; G196-G200 PolarHBondContact O-N 3.48Å; G196-G200 VanDerWaalsContact O-N 3.08Å |
| 197 | A | 78.6 | Confident | 83.7 | Confident | 81 Ų | 81 | 36.8 Ų | 36.8 | 67% | 0.669 | 24% | 0.235 | S | C | * | . | H | α-helix | trans | -71.1 | -43.8 | 178 | 0 | 0 | 0 | 0 | 0 | 110.4 | D195 L199 G200 S201 | D195-A197 WeakPolarHBondContact OD1-CA 3.48Å; D195-A197 WeakPolarHBondContact OD1-CB 3.49Å; D195-A197 PolarHBondContact OD1-N 2.86Å; A197-L199 VanDerWaalsContact C-N 3.34Å; A197-G200 PolarHBondContact O-N 3.24Å; A197-S201 PolarHBondContact O-N 3Å |
| 198 | K | 78.3 | Confident | 83.2 | Confident | 67 Ų | 67 | 40.6 Ų | 40.6 | 29% | 0.291 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -66.3 | -35.6 | 173.4 | -65.9 | -179 | -178.8 | -178.2 | 0 | 112.2 | E73 D195 G200 S201 L202 | E73-K198 WeakPolarHBondContact OE1-CE 3.24Å; E73-K198 IonicContact OE1-NZ 3.05Å; E73-K198 PolarHBondContact OE1-NZ 3.1Å; E73-K198 IonicContact OE2-NZ 2.68Å; E73-K198 PolarHBondContact OE2-NZ 2.94Å; D195-K198 HydrophobicContact CB-CB 3.99Å; D195-K198 HydrophobicContact CB-CD 3.94Å; D195-K198 HydrophobicContact CB-CG 4.06Å; D195-K198 PolarHBondContact O-N 3.44Å; D195-K198 PolarHBondContact OD1-N 3.28Å; K198-G200 VanDerWaalsContact C-N 3.3Å; K198-G200 PolarHBondContact O-N 3.41Å; K198-S201 PolarHBondContact O-N 2.99Å; K198-S201 PolarHBondContact O-OG 3.46Å; K198-S201 VanDerWaalsContact O-OG 3.08Å; K198-L202 VanDerWaalsContact O-CB 3.28Å; K198-L202 WeakPolarHBondContact O-CB 3.34Å; K198-L202 WeakPolarHBondContact O-CG 3.43Å; K198-L202 PolarHBondContact O-N 3.38Å |
| 199 | L | 81.3 | Confident | 82.8 | Confident | 7 Ų | 7 | 40.1 Ų | 40.1 | 4% | 0.037 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -60.8 | -42.1 | 174.5 | 178.6 | 64.3 | 0 | 0 | 0 | 111 | L3 A6 K7 L190 Q193 D195 G196 A197 F203 | L3-L199 HydrophobicContact CD1-CD2 3.89Å; A6-L199 HydrophobicContact CB-CD2 4.39Å; K7-L199 HydrophobicContact CG-CD2 3.71Å; L190-L199 HydrophobicContact CD2-CD1 4.28Å; Q193-L199 HydrophobicContact CB-CD1 4.45Å; Q193-L199 HydrophobicContact CG-CB 4.32Å; D195-L199 VanDerWaalsContact O-CB 3.27Å; D195-L199 WeakPolarHBondContact O-CB 3.49Å; D195-L199 PolarHBondContact O-N 3.24Å; G196-L199 PolarHBondContact O-N 2.94Å; A197-L199 VanDerWaalsContact C-N 3.34Å; L199-F203 WeakPolarHBondContact O-CB 3.45Å; L199-F203 PolarHBondContact O-N 2.98Å |
| 200 | G | 79.4 | Confident | 82.8 | Confident | 40 Ų | 40 | 40.2 Ų | 40.2 | 41% | 0.412 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -63.9 | -45.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | G196 A197 K198 F203 L204 | G196-G200 PolarHBondContact O-N 3.48Å; G196-G200 VanDerWaalsContact O-N 3.08Å; A197-G200 PolarHBondContact O-N 3.24Å; K198-G200 VanDerWaalsContact C-N 3.3Å; K198-G200 PolarHBondContact O-N 3.41Å; G200-F203 PolarHBondContact O-N 3.25Å; G200-L204 PolarHBondContact O-N 3.21Å |
| 201 | S | 79.2 | Confident | 82.8 | Confident | 79 Ų | 79 | 41.9 Ų | 41.9 | 55% | 0.552 | 26% | 0.262 | S | S | * | . | H | α-helix | trans | -68.2 | -42.8 | 178.5 | 61.4 | 0 | 0 | 0 | 0 | 112.4 | A197 K198 F203 L204 G205 | A197-S201 PolarHBondContact O-N 3Å; K198-S201 PolarHBondContact O-N 2.99Å; K198-S201 PolarHBondContact O-OG 3.46Å; K198-S201 VanDerWaalsContact O-OG 3.08Å; S201-F203 VanDerWaalsContact C-N 3.35Å; S201-L204 PolarHBondContact O-N 3.21Å; S201-G205 PolarHBondContact O-N 3.27Å |
| 202 | L | 80.5 | Confident | 82.6 | Confident | 31 Ų | 31 | 44.6 Ų | 44.6 | 16% | 0.162 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -61.4 | -44.6 | 174 | -71.6 | 171.8 | 0 | 0 | 0 | 110.8 | L190 Q193 K198 L204 G205 V206 | L190-L202 HydrophobicContact CD2-CB 3.8Å; Q193-L202 HydrophobicContact CG-CD1 4.25Å; K198-L202 VanDerWaalsContact O-CB 3.28Å; K198-L202 WeakPolarHBondContact O-CB 3.34Å; K198-L202 WeakPolarHBondContact O-CG 3.43Å; K198-L202 PolarHBondContact O-N 3.38Å; L202-L204 PolarHBondContact O-N 3.31Å; L202-G205 PolarHBondContact O-N 3.43Å; L202-V206 WeakPolarHBondContact O-CB 3.39Å; L202-V206 WeakPolarHBondContact O-CG2 3.37Å; L202-V206 PolarHBondContact O-N 3.27Å |
| 203 | F | 82.1 | Confident | 82.5 | Confident | 57 Ų | 57 | 44.3 Ų | 44.3 | 25% | 0.25 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -60.1 | -43.8 | 178.2 | 176.5 | -109.9 | 0 | 0 | 0 | 112.7 | C10 V14 L199 G200 S201 V206 G207 | C10-F203 HydrophobicContact CB-CD2 3.62Å; C10-F203 HydrophobicContact CB-CE2 3.52Å; C10-F203 HydrophobicContact CB-CG 4.26Å; C10-F203 HydrophobicContact CB-CZ 4.19Å; C10-F203 WeakPolarHBondContact O-CE2 3.45Å; C10-F203 WeakPolarHBondContact SG-CD2 3.16Å; C10-F203 WeakPolarHBondContact SG-CE2 3.15Å; V14-F203 HydrophobicContact CB-CE2 4.43Å; V14-F203 HydrophobicContact CG2-CD2 4.06Å; V14-F203 HydrophobicContact CG2-CE2 3.36Å; V14-F203 HydrophobicContact CG2-CZ 4.15Å; L199-F203 WeakPolarHBondContact O-CB 3.45Å; L199-F203 PolarHBondContact O-N 2.98Å; G200-F203 PolarHBondContact O-N 3.25Å; S201-F203 VanDerWaalsContact C-N 3.35Å; F203-V206 PolarHBondContact O-N 3.2Å; F203-G207 PolarHBondContact O-N 3.28Å |
| 204 | L | 83 | Confident | 82.8 | Confident | 115 Ų | 115 | 43.5 Ų | 43.5 | 60% | 0.602 | 27% | 0.272 | S | S | * | . | H | α-helix | trans | -63.1 | -45.6 | 177.7 | -178.9 | 61.9 | 0 | 0 | 0 | 111 | G200 S201 L202 V206 G207 I208 | G200-L204 PolarHBondContact O-N 3.21Å; S201-L204 PolarHBondContact O-N 3.21Å; L202-L204 PolarHBondContact O-N 3.31Å; L204-V206 PolarHBondContact O-N 3.1Å; L204-G207 PolarHBondContact O-N 3.15Å; L204-I208 HydrophobicContact CD1-CD1 4.41Å; L204-I208 HydrophobicContact CG-CD1 4.39Å; L204-I208 WeakPolarHBondContact O-CG1 3.27Å; L204-I208 PolarHBondContact O-N 2.92Å; L204-I208 VanDerWaalsContact O-N 3.17Å |
| 205 | G | 81.1 | Confident | 83.2 | Confident | 35 Ų | 35 | 42.1 Ų | 42.1 | 36% | 0.361 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -58.8 | -46.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | S201 L202 I208 H209 | S201-G205 PolarHBondContact O-N 3.27Å; L202-G205 PolarHBondContact O-N 3.43Å; G205-I208 PolarHBondContact O-N 3.07Å; G205-H209 PolarHBondContact O-N 3.36Å; G205-H209 PolarHBondContact O-ND1 3.48Å |
| 206 | V | 84.1 | Confident | 83.4 | Confident | 3 Ų | 3 | 39.5 Ų | 39.5 | 2% | 0.018 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -61.1 | -49 | 176.1 | 172.8 | 0 | 0 | 0 | 0 | 111.7 | E186 L190 L202 F203 L204 I208 H209 E210 I242 | E186-V206 HydrophobicContact CG-CG1 4.28Å; E186-V206 HydrophobicContact CG-CG2 3.88Å; E186-V206 WeakPolarHBondContact OE1-CG2 3.03Å; L190-V206 HydrophobicContact CD1-CG1 4.29Å; L190-V206 HydrophobicContact CD1-CG2 4.29Å; L202-V206 WeakPolarHBondContact O-CB 3.39Å; L202-V206 WeakPolarHBondContact O-CG2 3.37Å; L202-V206 PolarHBondContact O-N 3.27Å; F203-V206 PolarHBondContact O-N 3.2Å; L204-V206 PolarHBondContact O-N 3.1Å; V206-I208 PolarHBondContact O-N 3.4Å; V206-H209 WeakPolarHBondContact CA-CE1 3.47Å; V206-H209 PolarHBondContact O-N 3.22Å; V206-E210 HydrophobicContact CG1-CB 4.38Å; V206-E210 WeakPolarHBondContact O-CB 3.47Å; V206-E210 PolarHBondContact O-N 3.27Å; V206-I242 HydrophobicContact CG1-CD1 4.38Å |
| 207 | G | 85.9 | Confident | 83.9 | Confident | 11 Ų | 11 | 37.5 Ų | 37.5 | 11% | 0.113 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -56 | -40.2 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | F203 L204 T211 | F203-G207 PolarHBondContact O-N 3.28Å; L204-G207 PolarHBondContact O-N 3.15Å; G207-T211 VanDerWaalsContact O-CB 3.28Å; G207-T211 WeakPolarHBondContact O-CB 3.14Å; G207-T211 PolarHBondContact O-N 3.4Å; G207-T211 PolarHBondContact O-OG1 3.5Å |
| 208 | I | 83.3 | Confident | 84.4 | Confident | 81 Ų | 81 | 33.7 Ų | 33.7 | 42% | 0.415 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -67.6 | -57.6 | 178.8 | -65.7 | 167.7 | 0 | 0 | 0 | 111.1 | L204 G205 V206 T211 L212 | L204-I208 HydrophobicContact CD1-CD1 4.41Å; L204-I208 HydrophobicContact CG-CD1 4.39Å; L204-I208 WeakPolarHBondContact O-CG1 3.27Å; L204-I208 PolarHBondContact O-N 2.92Å; L204-I208 VanDerWaalsContact O-N 3.17Å; G205-I208 PolarHBondContact O-N 3.07Å; V206-I208 PolarHBondContact O-N 3.4Å; I208-T211 PolarHBondContact O-N 2.81Å; I208-L212 HydrophobicContact CG2-CD1 4.19Å; I208-L212 WeakPolarHBondContact O-CG 3.49Å; I208-L212 PolarHBondContact O-N 2.87Å |
| 209 | H | 84.1 | Confident | 84.6 | Confident | 11 Ų | 11 | 30.8 Ų | 30.8 | 5% | 0.051 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -73.3 | -31.1 | -173.6 | 71.7 | -101.6 | 0 | 0 | 0 | 113.3 | T58 G205 V206 L212 A213 | T58-H209 HydrophobicContact CG2-CB 3.65Å; G205-H209 PolarHBondContact O-N 3.36Å; G205-H209 PolarHBondContact O-ND1 3.48Å; V206-H209 WeakPolarHBondContact CA-CE1 3.47Å; V206-H209 PolarHBondContact O-N 3.22Å; H209-L212 WeakPolarHBondContact O-CB 3.38Å; H209-L212 PolarHBondContact O-N 3.42Å; H209-A213 WeakPolarHBondContact O-CB 3.43Å; H209-A213 PolarHBondContact O-N 2.79Å |
| 210 | E | 88 | Confident | 84.7 | Confident | 3 Ų | 3 | 30.8 Ų | 30.8 | 1% | 0.014 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -71 | -35.8 | 177.5 | -165.9 | 72.1 | 176.6 | 0 | 0 | 111.4 | M18 S183 V206 L212 A213 A214 I242 | M18-E210 HydrophobicContact CE-CG 3.77Å; M18-E210 WeakPolarHBondContact CE-OE1 3.38Å; M18-E210 HydrophobicContact CG-CG 3.55Å; M18-E210 HydrophobicContact SD-CG 3.49Å; M18-E210 WeakPolarHBondContact SD-CG 3.05Å; S183-E210 PolarHBondContact OG-OE1 3.17Å; V206-E210 HydrophobicContact CG1-CB 4.38Å; V206-E210 WeakPolarHBondContact O-CB 3.47Å; V206-E210 PolarHBondContact O-N 3.27Å; E210-L212 VanDerWaalsContact C-N 3.29Å; E210-L212 PolarHBondContact O-N 3.03Å; E210-A213 PolarHBondContact O-N 3.44Å; E210-A214 VanDerWaalsContact O-CB 3.24Å; E210-A214 WeakPolarHBondContact O-CB 3.28Å; E210-A214 PolarHBondContact O-N 2.88Å; E210-I242 HydrophobicContact CB-CD1 4.49Å; E210-I242 VanDerWaalsContact CD-CD1 3.48Å; E210-I242 HydrophobicContact CG-CD1 3.58Å; E210-I242 VanDerWaalsContact OE1-CD1 3.31Å; E210-I242 WeakPolarHBondContact OE1-CD1 3.14Å |
| 211 | T | 88.6 | Confident | 85.1 | Confident | 38 Ų | 38 | 28.9 Ų | 28.9 | 23% | 0.233 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -63.9 | -39.1 | 172.6 | -57.9 | 0 | 0 | 0 | 0 | 110.8 | G207 I208 A214 V215 | G207-T211 VanDerWaalsContact O-CB 3.28Å; G207-T211 WeakPolarHBondContact O-CB 3.14Å; G207-T211 PolarHBondContact O-N 3.4Å; G207-T211 PolarHBondContact O-OG1 3.5Å; I208-T211 PolarHBondContact O-N 2.81Å; T211-A214 WeakPolarHBondContact O-CB 3.32Å; T211-A214 PolarHBondContact O-N 2.71Å; T211-V215 WeakPolarHBondContact O-CG2 3.27Å; T211-V215 PolarHBondContact O-N 2.91Å |
| 212 | L | 84.6 | Confident | 85.2 | Confident | 58 Ų | 58 | 25.4 Ų | 25.4 | 30% | 0.304 | 15% | 0.15 | S | C | . | . | H | α-helix | trans | -67 | -42.2 | 176.2 | -67.1 | 167.5 | 0 | 0 | 0 | 111.6 | V54 F55 I208 H209 E210 V215 A216 | V54-L212 HydrophobicContact CG1-CD1 3.51Å; F55-L212 HydrophobicContact CE1-CB 3.72Å; F55-L212 VanDerWaalsContact CZ-C 3.47Å; F55-L212 HydrophobicContact CZ-CB 4.38Å; F55-L212 WeakPolarHBondContact CZ-O 3.2Å; I208-L212 HydrophobicContact CG2-CD1 4.19Å; I208-L212 WeakPolarHBondContact O-CG 3.49Å; I208-L212 PolarHBondContact O-N 2.87Å; H209-L212 WeakPolarHBondContact O-CB 3.38Å; H209-L212 PolarHBondContact O-N 3.42Å; E210-L212 VanDerWaalsContact C-N 3.29Å; E210-L212 PolarHBondContact O-N 3.03Å; L212-V215 PolarHBondContact O-N 2.84Å; L212-A216 PolarHBondContact O-N 2.79Å |
| 213 | A | 86.3 | Confident | 85.1 | Confident | 2 Ų | 2 | 26.7 Ų | 26.7 | 2% | 0.017 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -56.5 | -48.1 | 170.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | F55 L179 H209 E210 V215 A216 L217 | F55-A213 HydrophobicContact CE2-CB 4.17Å; F55-A213 HydrophobicContact CZ-CB 4.16Å; L179-A213 HydrophobicContact CD2-CB 4.28Å; H209-A213 WeakPolarHBondContact O-CB 3.43Å; H209-A213 PolarHBondContact O-N 2.79Å; E210-A213 PolarHBondContact O-N 3.44Å; A213-V215 PolarHBondContact O-N 3.27Å; A213-A216 PolarHBondContact O-N 3.39Å; A213-L217 PolarHBondContact O-N 2.82Å |
| 214 | A | 91.7 | Very high | 84.9 | Confident | 3 Ų | 3 | 25.9 Ų | 25.9 | 3% | 0.025 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -58.8 | -43 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | M18 I22 E210 T211 L217 G218 | M18-A214 HydrophobicContact CB-CB 4.36Å; M18-A214 WeakPolarHBondContact O-CB 3.33Å; I22-A214 WeakPolarHBondContact CA-O 2.93Å; I22-A214 HydrophobicContact CD1-CB 4.47Å; I22-A214 HydrophobicContact CG1-CB 3.84Å; I22-A214 WeakPolarHBondContact CG1-O 3.31Å; E210-A214 VanDerWaalsContact O-CB 3.24Å; E210-A214 WeakPolarHBondContact O-CB 3.28Å; E210-A214 PolarHBondContact O-N 2.88Å; T211-A214 WeakPolarHBondContact O-CB 3.32Å; T211-A214 PolarHBondContact O-N 2.71Å; A214-L217 PolarHBondContact O-N 3.42Å; A214-G218 PolarHBondContact O-N 2.93Å |
| 215 | V | 89.2 | Confident | 84.8 | Confident | 50 Ų | 50 | 24.9 Ų | 24.9 | 30% | 0.303 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -64 | -45.1 | 175.4 | 169.5 | 0 | 0 | 0 | 0 | 111.6 | G21 P25 T211 L212 A213 L217 G218 V219 | G21-V215 VanDerWaalsContact O-CA 3.32Å; G21-V215 WeakPolarHBondContact O-CA 3.49Å; P25-V215 HydrophobicContact CG-CG1 4.08Å; T211-V215 WeakPolarHBondContact O-CG2 3.27Å; T211-V215 PolarHBondContact O-N 2.91Å; L212-V215 PolarHBondContact O-N 2.84Å; A213-V215 PolarHBondContact O-N 3.27Å; V215-L217 VanDerWaalsContact C-N 3.32Å; V215-L217 PolarHBondContact O-N 2.85Å; V215-G218 PolarHBondContact O-N 2.87Å; V215-V219 WeakPolarHBondContact O-CG2 3.39Å; V215-V219 PolarHBondContact O-N 3.07Å |
| 216 | A | 84.5 | Confident | 84.9 | Confident | 15 Ų | 15 | 25.9 Ų | 25.9 | 12% | 0.124 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -62.4 | -39.6 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | F55 L212 A213 S220 I283 | F55-A216 HydrophobicContact CE2-CB 4.38Å; F55-A216 HydrophobicContact CZ-CB 3.74Å; L212-A216 PolarHBondContact O-N 2.79Å; A213-A216 PolarHBondContact O-N 3.39Å; A216-S220 WeakPolarHBondContact O-CB 3.45Å; A216-S220 PolarHBondContact O-N 2.85Å; A216-S220 PolarHBondContact O-OG 2.93Å; A216-I283 HydrophobicContact CB-CD1 4.23Å |
| 217 | L | 88.4 | Confident | 85 | Confident | 1 Ų | 1 | 29 Ų | 29 | 1% | 0.005 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -64.1 | -45.7 | 171.8 | 177.4 | 59.3 | 0 | 0 | 0 | 111.4 | I22 L172 L175 V176 L179 A213 A214 V215 V219 S220 V221 L234 V238 | I22-L217 HydrophobicContact CD1-CD2 3.85Å; I22-L217 HydrophobicContact CG1-CD2 4.21Å; I22-L217 HydrophobicContact CG1-CG 4.5Å; L172-L217 HydrophobicContact CD1-CD1 3.95Å; L175-L217 HydrophobicContact CD2-CD1 3.72Å; L175-L217 HydrophobicContact CG-CD1 4.07Å; V176-L217 HydrophobicContact CG2-CD1 3.97Å; L179-L217 HydrophobicContact CD1-CB 4Å; L179-L217 HydrophobicContact CD1-CD1 4.4Å; L179-L217 HydrophobicContact CD1-CD2 4.01Å; L179-L217 HydrophobicContact CD1-CG 4.36Å; A213-L217 PolarHBondContact O-N 2.82Å; A214-L217 PolarHBondContact O-N 3.42Å; V215-L217 VanDerWaalsContact C-N 3.32Å; V215-L217 PolarHBondContact O-N 2.85Å; L217-V219 VanDerWaalsContact C-N 3.33Å; L217-V219 PolarHBondContact O-N 3.22Å; L217-S220 CarbonylContact O-C 3.59Å; L217-S220 WeakPolarHBondContact O-CA 3.3Å; L217-S220 WeakPolarHBondContact O-CB 3.46Å; L217-S220 PolarHBondContact O-N 3.34Å; L217-V221 HydrophobicContact CD1-CG2 4.23Å; L217-V221 HydrophobicContact CG-CG2 4.46Å; L217-V221 WeakPolarHBondContact O-CG2 3.22Å; L217-V221 PolarHBondContact O-N 3.01Å; L217-L234 HydrophobicContact CD1-CD2 4.19Å; L217-L234 HydrophobicContact CD2-CD2 3.85Å; L217-L234 HydrophobicContact CG-CD2 4.13Å; L217-V238 HydrophobicContact CD2-CB 4.27Å; L217-V238 HydrophobicContact CD2-CG1 4.07Å; L217-V238 HydrophobicContact CD2-CG2 3.95Å |
| 218 | G | 89.1 | Confident | 85.1 | Confident | 0 Ų | 0 | 29.9 Ų | 29.9 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -56.6 | -44.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | I22 V26 A214 V215 S220 V221 A222 | I22-G218 VanDerWaalsContact O-CA 3.31Å; I22-G218 WeakPolarHBondContact O-CA 3.44Å; V26-G218 WeakPolarHBondContact CG2-O 3.47Å; A214-G218 PolarHBondContact O-N 2.93Å; V215-G218 PolarHBondContact O-N 2.87Å; G218-S220 VanDerWaalsContact C-N 3.33Å; G218-S220 PolarHBondContact O-N 3.47Å; G218-V221 PolarHBondContact O-N 2.77Å; G218-A222 VanDerWaalsContact O-CB 3.31Å; G218-A222 WeakPolarHBondContact O-CB 3.26Å; G218-A222 PolarHBondContact O-N 3.48Å |
| 219 | V | 83.1 | Confident | 85.5 | Confident | 6 Ų | 6 | 35.8 Ų | 35.8 | 4% | 0.036 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -63.8 | -39.7 | 173.8 | 176.7 | 0 | 0 | 0 | 0 | 111.2 | P25 L44 N48 V215 L217 A222 K223 | P25-V219 HydrophobicContact CB-CG2 3.83Å; P25-V219 HydrophobicContact CG-CG2 4.3Å; L44-V219 HydrophobicContact CD2-CG1 4.35Å; L44-V219 HydrophobicContact CD2-CG2 4.28Å; N48-V219 WeakPolarHBondContact ND2-CG1 3.3Å; N48-V219 WeakPolarHBondContact OD1-CG1 3.29Å; V215-V219 WeakPolarHBondContact O-CG2 3.39Å; V215-V219 PolarHBondContact O-N 3.07Å; L217-V219 VanDerWaalsContact C-N 3.33Å; L217-V219 PolarHBondContact O-N 3.22Å; V219-A222 PolarHBondContact O-N 3.38Å; V219-K223 HydrophobicContact CG1-CD 4.14Å; V219-K223 HydrophobicContact CG1-CG 4.25Å; V219-K223 WeakPolarHBondContact O-CB 3.45Å; V219-K223 WeakPolarHBondContact O-CG 3.19Å; V219-K223 PolarHBondContact O-N 3.29Å |
| 220 | S | 82.8 | Confident | 85.8 | Confident | 7 Ų | 7 | 38.1 Ų | 38.1 | 5% | 0.049 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -63.5 | -41.7 | 177.4 | -67.8 | 0 | 0 | 0 | 0 | 112.7 | A216 L217 G218 A224 R286 | A216-S220 WeakPolarHBondContact O-CB 3.45Å; A216-S220 PolarHBondContact O-N 2.85Å; A216-S220 PolarHBondContact O-OG 2.93Å; L217-S220 CarbonylContact O-C 3.59Å; L217-S220 WeakPolarHBondContact O-CA 3.3Å; L217-S220 WeakPolarHBondContact O-CB 3.46Å; L217-S220 PolarHBondContact O-N 3.34Å; G218-S220 VanDerWaalsContact C-N 3.33Å; G218-S220 PolarHBondContact O-N 3.47Å; S220-A224 WeakPolarHBondContact O-CB 3.21Å; S220-A224 PolarHBondContact O-N 2.9Å; S220-R286 PolarHBondContact OG-NH1 3.48Å; S220-R286 VanDerWaalsContact OG-NH1 3.1Å |
| 221 | V | 86.6 | Confident | 85.9 | Confident | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -63.2 | -44.3 | 173.3 | 169.5 | 0 | 0 | 0 | 0 | 110.7 | V26 L172 L217 G218 A224 S225 L226 A231 L234 | V26-V221 HydrophobicContact CG2-CB 4.07Å; V26-V221 HydrophobicContact CG2-CG1 3.78Å; L172-V221 HydrophobicContact CD1-CG2 3.95Å; L172-V221 HydrophobicContact CD2-CG2 4.37Å; L217-V221 HydrophobicContact CD1-CG2 4.23Å; L217-V221 HydrophobicContact CG-CG2 4.46Å; L217-V221 WeakPolarHBondContact O-CG2 3.22Å; L217-V221 PolarHBondContact O-N 3.01Å; G218-V221 PolarHBondContact O-N 2.77Å; V221-A224 WeakPolarHBondContact O-CB 3.48Å; V221-A224 PolarHBondContact O-N 3.32Å; V221-S225 PolarHBondContact O-N 3.02Å; V221-L226 HydrophobicContact CG1-CB 4.15Å; V221-L226 HydrophobicContact CG1-CD1 4.23Å; V221-A231 HydrophobicContact CG1-CB 3.65Å; V221-L234 HydrophobicContact CG2-CD1 4.1Å; V221-L234 HydrophobicContact CG2-CD2 3.91Å |
| 222 | A | 82.6 | Confident | 86.2 | Confident | 7 Ų | 7 | 39.3 Ų | 39.3 | 6% | 0.058 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -64.1 | -44.6 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | V26 M29 G218 V219 A224 S225 | V26-A222 HydrophobicContact CG2-CB 4.22Å; M29-A222 HydrophobicContact CB-CB 3.87Å; M29-A222 WeakPolarHBondContact CE-O 3.44Å; M29-A222 HydrophobicContact CG-CB 4.12Å; M29-A222 HydrophobicContact SD-CB 3.38Å; M29-A222 WeakPolarHBondContact SD-CB 3.49Å; G218-A222 VanDerWaalsContact O-CB 3.31Å; G218-A222 WeakPolarHBondContact O-CB 3.26Å; G218-A222 PolarHBondContact O-N 3.48Å; V219-A222 PolarHBondContact O-N 3.38Å; A222-A224 VanDerWaalsContact C-N 3.28Å; A222-A224 PolarHBondContact O-N 3.43Å; A222-S225 WeakPolarHBondContact O-CA 3.39Å; A222-S225 PolarHBondContact O-N 3.18Å |
| 223 | K | 77.6 | Confident | 86.6 | Confident | 58 Ų | 58 | 42.9 Ų | 42.9 | 25% | 0.252 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -60.4 | -36 | 173.6 | -75.1 | -179.4 | -179.3 | -172.9 | 0 | 112.1 | N48 V219 S225 E287 | N48-K223 PolarHBondContact ND2-NZ 3.36Å; V219-K223 HydrophobicContact CG1-CD 4.14Å; V219-K223 HydrophobicContact CG1-CG 4.25Å; V219-K223 WeakPolarHBondContact O-CB 3.45Å; V219-K223 WeakPolarHBondContact O-CG 3.19Å; V219-K223 PolarHBondContact O-N 3.29Å; K223-S225 PolarHBondContact O-N 2.95Å; K223-E287 IonicContact NZ-OE1 2.74Å; K223-E287 PolarHBondContact NZ-OE1 2.94Å; K223-E287 IonicContact NZ-OE2 2.71Å; K223-E287 PolarHBondContact NZ-OE2 3.23Å |
| 224 | A | 79.3 | Confident | 86.9 | Confident | 40 Ų | 40 | 44.2 Ų | 44.2 | 33% | 0.331 | 23% | 0.233 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -71.7 | -3.1 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | L172 S220 V221 A222 L226 | L172-A224 HydrophobicContact CD2-CB 3.96Å; S220-A224 WeakPolarHBondContact O-CB 3.21Å; S220-A224 PolarHBondContact O-N 2.9Å; V221-A224 WeakPolarHBondContact O-CB 3.48Å; V221-A224 PolarHBondContact O-N 3.32Å; A222-A224 VanDerWaalsContact C-N 3.28Å; A222-A224 PolarHBondContact O-N 3.43Å; A224-L226 HydrophobicContact CB-CG 4.22Å; A224-L226 PolarHBondContact O-N 3.4Å |
| 225 | S | 80.6 | Confident | 87 | Confident | 94 Ų | 94 | 44.1 Ų | 44.1 | 66% | 0.657 | 23% | 0.232 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 55.3 | 32.9 | 178.3 | -51.7 | 0 | 0 | 0 | 0 | 113.4 | V221 A222 K223 | V221-S225 PolarHBondContact O-N 3.02Å; A222-S225 WeakPolarHBondContact O-CA 3.39Å; A222-S225 PolarHBondContact O-N 3.18Å; K223-S225 PolarHBondContact O-N 2.95Å |
| 226 | L | 83 | Confident | 87.2 | Confident | 55 Ų | 55 | 44.1 Ų | 44.1 | 29% | 0.288 | 23% | 0.232 | S | C | . | . | trans | -68.8 | 143.3 | 176.9 | -69.1 | -174.6 | 0 | 0 | 0 | 110.9 | L172 V221 A224 | L172-L226 HydrophobicContact CD2-CD1 3.52Å; L172-L226 HydrophobicContact CD2-CG 4.35Å; V221-L226 HydrophobicContact CG1-CB 4.15Å; V221-L226 HydrophobicContact CG1-CD1 4.23Å; A224-L226 HydrophobicContact CB-CG 4.22Å; A224-L226 PolarHBondContact O-N 3.4Å | ||
| 227 | P | 86.6 | Confident | 87.6 | Confident | 70 Ų | 70 | 46.6 Ų | 46.6 | 46% | 0.455 | 25% | 0.246 | S | C | . | . | trans | -64.1 | 147.9 | 175.1 | 29.1 | -35 | 0 | 0 | 0 | 110.1 | R229 D230 A231 | P227-R229 PolarHBondContact O-N 2.85Å; P227-D230 HydrophobicContact CG-CB 4.15Å; P227-D230 WeakPolarHBondContact CG-OD2 3.4Å; P227-D230 PolarHBondContact O-N 3.23Å; P227-A231 PolarHBondContact O-N 2.65Å; P227-A231 VanDerWaalsContact O-N 3.11Å | ||
| 228 | M | 87.8 | Confident | 87.8 | Confident | 29 Ų | 29 | 46.7 Ų | 46.7 | 14% | 0.143 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -51 | -32.2 | -179.1 | -179.1 | 58.5 | 55.8 | 0 | 0 | 113.2 | L23 V26 R27 I30 A231 I232 | L23-M228 HydrophobicContact CD2-SD 4.27Å; V26-M228 HydrophobicContact CB-CE 4.18Å; V26-M228 HydrophobicContact CG1-CE 3.58Å; V26-M228 HydrophobicContact CG1-SD 4.43Å; R27-M228 HydrophobicContact CB-CE 4.38Å; R27-M228 VanDerWaalsContact CD-CE 3.46Å; R27-M228 HydrophobicContact CG-CE 3.63Å; R27-M228 HydrophobicContact CG-SD 4.34Å; I30-M228 HydrophobicContact CD1-CB 4.27Å; I30-M228 HydrophobicContact CD1-CE 3.6Å; M228-A231 PolarHBondContact O-N 2.88Å; M228-I232 HydrophobicContact CG-CD1 3.93Å; M228-I232 HydrophobicContact CG-CG1 4.42Å; M228-I232 VanDerWaalsContact O-CG1 3.23Å; M228-I232 WeakPolarHBondContact O-CG1 3.38Å; M228-I232 PolarHBondContact O-N 2.92Å; M228-I232 HydrophobicContact SD-CD1 4.23Å; M228-I232 HydrophobicContact SD-CG1 4.18Å |
| 229 | R | 90.8 | Very high | 88.1 | Confident | 204 Ų | 204 | 46.7 Ų | 46.7 | 77% | 0.77 | 25% | 0.246 | S | C | * | . | H | α-helix | trans | -62.2 | -42.8 | 177.1 | -64.4 | -176.9 | 179.7 | -175.3 | 0 | 112.3 | P227 I232 K233 | P227-R229 PolarHBondContact O-N 2.85Å; R229-I232 PolarHBondContact O-N 3.11Å; R229-K233 WeakPolarHBondContact O-CG 3.31Å; R229-K233 PolarHBondContact O-N 3.29Å; R229-K233 VanDerWaalsContact O-N 3.11Å |
| 230 | D | 90.2 | Very high | 88.6 | Confident | 60 Ų | 60 | 49.7 Ų | 49.7 | 32% | 0.321 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -78.7 | -32.5 | -179.7 | -63.5 | -27.4 | 0 | 0 | 0 | 111 | P227 I232 K233 L234 | P227-D230 HydrophobicContact CG-CB 4.15Å; P227-D230 WeakPolarHBondContact CG-OD2 3.4Å; P227-D230 PolarHBondContact O-N 3.23Å; D230-I232 VanDerWaalsContact C-N 3.32Å; D230-I232 PolarHBondContact O-N 2.94Å; D230-K233 PolarHBondContact O-N 2.91Å; D230-K233 IonicContact OD1-NZ 2.89Å; D230-K233 PolarHBondContact OD1-NZ 2.96Å; D230-L234 VanDerWaalsContact O-CB 3.28Å; D230-L234 WeakPolarHBondContact O-CB 3.43Å; D230-L234 PolarHBondContact O-N 3.4Å |
| 231 | A | 90.6 | Very high | 89.2 | Confident | 0 Ų | 0 | 51.3 Ų | 51.3 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -59.3 | -41.3 | 168.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | V26 V221 P227 M228 G235 | V26-A231 HydrophobicContact CG1-CB 3.88Å; V26-A231 HydrophobicContact CG2-CB 4.26Å; V221-A231 HydrophobicContact CG1-CB 3.65Å; P227-A231 PolarHBondContact O-N 2.65Å; P227-A231 VanDerWaalsContact O-N 3.11Å; M228-A231 PolarHBondContact O-N 2.88Å; A231-G235 PolarHBondContact O-N 3.47Å |
| 232 | I | 94.2 | Very high | 89.5 | Confident | 67 Ų | 67 | 51.3 Ų | 51.3 | 34% | 0.344 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -64.9 | -47.2 | 175 | -70.3 | 164.2 | 0 | 0 | 0 | 111.1 | L23 M228 R229 D230 L234 G235 V236 | L23-I232 HydrophobicContact CD1-CG1 4.27Å; L23-I232 HydrophobicContact CD2-CG1 3.74Å; M228-I232 HydrophobicContact CG-CD1 3.93Å; M228-I232 HydrophobicContact CG-CG1 4.42Å; M228-I232 VanDerWaalsContact O-CG1 3.23Å; M228-I232 WeakPolarHBondContact O-CG1 3.38Å; M228-I232 PolarHBondContact O-N 2.92Å; M228-I232 HydrophobicContact SD-CD1 4.23Å; M228-I232 HydrophobicContact SD-CG1 4.18Å; R229-I232 PolarHBondContact O-N 3.11Å; D230-I232 VanDerWaalsContact C-N 3.32Å; D230-I232 PolarHBondContact O-N 2.94Å; I232-L234 PolarHBondContact O-N 3.08Å; I232-G235 PolarHBondContact O-N 3.12Å; I232-V236 HydrophobicContact CG2-CG2 4.37Å; I232-V236 WeakPolarHBondContact O-CB 3.34Å; I232-V236 VanDerWaalsContact O-CG2 3.31Å; I232-V236 WeakPolarHBondContact O-CG2 3.42Å; I232-V236 PolarHBondContact O-N 2.98Å |
| 233 | K | 93.9 | Very high | 90 | Very high | 133 Ų | 133 | 51.6 Ų | 51.6 | 58% | 0.578 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -57.6 | -50.8 | 177.8 | -69.8 | 171 | -167.1 | 159.8 | 0 | 111.1 | R229 D230 V236 T237 | R229-K233 WeakPolarHBondContact O-CG 3.31Å; R229-K233 PolarHBondContact O-N 3.29Å; R229-K233 VanDerWaalsContact O-N 3.11Å; D230-K233 PolarHBondContact O-N 2.91Å; D230-K233 IonicContact OD1-NZ 2.89Å; D230-K233 PolarHBondContact OD1-NZ 2.96Å; K233-V236 PolarHBondContact O-N 3.28Å; K233-T237 PolarHBondContact O-N 3Å; K233-T237 PolarHBondContact O-OG1 3.05Å |
| 234 | L | 92.2 | Very high | 90.7 | Very high | 30 Ų | 30 | 52.7 Ų | 52.7 | 16% | 0.157 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -62.8 | -43.9 | 179.6 | -176 | 157.5 | 0 | 0 | 0 | 111.4 | L172 V176 L217 V221 D230 I232 V236 T237 V238 | L172-L234 HydrophobicContact CD2-CD1 4.45Å; V176-L234 HydrophobicContact CG2-CD1 3.61Å; V176-L234 HydrophobicContact CG2-CD2 3.88Å; V176-L234 HydrophobicContact CG2-CG 3.77Å; L217-L234 HydrophobicContact CD1-CD2 4.19Å; L217-L234 HydrophobicContact CD2-CD2 3.85Å; L217-L234 HydrophobicContact CG-CD2 4.13Å; V221-L234 HydrophobicContact CG2-CD1 4.1Å; V221-L234 HydrophobicContact CG2-CD2 3.91Å; D230-L234 VanDerWaalsContact O-CB 3.28Å; D230-L234 WeakPolarHBondContact O-CB 3.43Å; D230-L234 PolarHBondContact O-N 3.4Å; I232-L234 PolarHBondContact O-N 3.08Å; L234-V236 PolarHBondContact O-N 3.47Å; L234-T237 PolarHBondContact O-N 2.89Å; L234-V238 HydrophobicContact CD2-CG2 4.37Å; L234-V238 WeakPolarHBondContact O-CG2 3.19Å; L234-V238 PolarHBondContact O-N 2.94Å |
| 235 | G | 92.9 | Very high | 91.4 | Very high | 0 Ų | 0 | 50.8 Ų | 50.8 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -60.1 | -44.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | A231 I232 S239 | A231-G235 PolarHBondContact O-N 3.47Å; I232-G235 PolarHBondContact O-N 3.12Å; G235-S239 WeakPolarHBondContact O-CB 3.4Å; G235-S239 PolarHBondContact O-N 2.96Å; G235-S239 PolarHBondContact O-OG 2.95Å |
| 236 | V | 94.8 | Very high | 91.9 | Very high | 50 Ų | 50 | 46.3 Ų | 46.3 | 30% | 0.303 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -64.7 | -44.6 | 174.8 | 170.1 | 0 | 0 | 0 | 0 | 111.1 | L19 I232 K233 L234 V238 S239 L240 | L19-V236 HydrophobicContact CD1-CG2 4.06Å; I232-V236 HydrophobicContact CG2-CG2 4.37Å; I232-V236 WeakPolarHBondContact O-CB 3.34Å; I232-V236 VanDerWaalsContact O-CG2 3.31Å; I232-V236 WeakPolarHBondContact O-CG2 3.42Å; I232-V236 PolarHBondContact O-N 2.98Å; K233-V236 PolarHBondContact O-N 3.28Å; L234-V236 PolarHBondContact O-N 3.47Å; V236-V238 PolarHBondContact O-N 2.96Å; V236-S239 PolarHBondContact O-N 3.14Å; V236-L240 HydrophobicContact CG1-CD1 3.74Å; V236-L240 HydrophobicContact CG1-CG 4.31Å; V236-L240 WeakPolarHBondContact O-CB 3.49Å; V236-L240 VanDerWaalsContact O-CG 3.28Å; V236-L240 WeakPolarHBondContact O-CG 3.29Å; V236-L240 PolarHBondContact O-N 2.96Å |
| 237 | T | 93.1 | Very high | 92.3 | Very high | 67 Ų | 67 | 45.5 Ų | 45.5 | 41% | 0.411 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -57.4 | -50.8 | 178.4 | -62.5 | 0 | 0 | 0 | 0 | 111.7 | K233 L234 M241 | K233-T237 PolarHBondContact O-N 3Å; K233-T237 PolarHBondContact O-OG1 3.05Å; L234-T237 PolarHBondContact O-N 2.89Å; T237-M241 HydrophobicContact CG2-CE 4.09Å; T237-M241 VanDerWaalsContact O-CE 3.31Å; T237-M241 WeakPolarHBondContact O-CE 3.31Å; T237-M241 WeakPolarHBondContact O-CG 3.14Å |
| 238 | V | 92.6 | Very high | 92.5 | Very high | 3 Ų | 3 | 46.4 Ų | 46.4 | 2% | 0.018 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -69.1 | -42.8 | -178.9 | 177.2 | 0 | 0 | 0 | 0 | 111.1 | M18 I22 V176 L217 L234 V236 L240 M241 | M18-V238 HydrophobicContact CE-CG1 3.81Å; I22-V238 HydrophobicContact CD1-CB 4.33Å; I22-V238 HydrophobicContact CD1-CG1 4.47Å; V176-V238 HydrophobicContact CG1-CG2 3.89Å; L217-V238 HydrophobicContact CD2-CB 4.27Å; L217-V238 HydrophobicContact CD2-CG1 4.07Å; L217-V238 HydrophobicContact CD2-CG2 3.95Å; L234-V238 HydrophobicContact CD2-CG2 4.37Å; L234-V238 WeakPolarHBondContact O-CG2 3.19Å; L234-V238 PolarHBondContact O-N 2.94Å; V236-V238 PolarHBondContact O-N 2.96Å; V238-L240 PolarHBondContact O-N 3.14Å; V238-M241 WeakPolarHBondContact O-CB 3.48Å; V238-M241 PolarHBondContact O-N 3.16Å; V238-M241 VanDerWaalsContact O-N 3.11Å |
| 239 | S | 94.4 | Very high | 92.6 | Very high | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -66.7 | -23.2 | -178.5 | -52.6 | 0 | 0 | 0 | 0 | 113.4 | F15 M18 L19 G235 V236 P243 | F15-S239 WeakPolarHBondContact CD2-O 3.42Å; M18-S239 WeakPolarHBondContact CB-OG 3.12Å; L19-S239 PolarHBondContact N-OG 3.3Å; G235-S239 WeakPolarHBondContact O-CB 3.4Å; G235-S239 PolarHBondContact O-N 2.96Å; G235-S239 PolarHBondContact O-OG 2.95Å; V236-S239 PolarHBondContact O-N 3.14Å; S239-P243 WeakPolarHBondContact O-CD 3.47Å; S239-P243 WeakPolarHBondContact O-CG 3.42Å |
| 240 | L | 94.4 | Very high | 92.4 | Very high | 70 Ų | 70 | 38.2 Ų | 38.2 | 37% | 0.366 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -77.4 | -17.8 | 175.8 | -79.4 | 172.1 | 0 | 0 | 0 | 113.6 | F15 V236 V238 I242 P243 I244 | F15-L240 HydrophobicContact CD2-CD2 4.17Å; F15-L240 HydrophobicContact CD2-CG 4.46Å; F15-L240 HydrophobicContact CE2-CD2 3.89Å; F15-L240 HydrophobicContact CE2-CG 3.97Å; V236-L240 HydrophobicContact CG1-CD1 3.74Å; V236-L240 HydrophobicContact CG1-CG 4.31Å; V236-L240 WeakPolarHBondContact O-CB 3.49Å; V236-L240 VanDerWaalsContact O-CG 3.28Å; V236-L240 WeakPolarHBondContact O-CG 3.29Å; V236-L240 PolarHBondContact O-N 2.96Å; V238-L240 PolarHBondContact O-N 3.14Å; L240-I242 PolarHBondContact O-N 2.79Å; L240-P243 WeakPolarHBondContact O-CD 3.46Å; L240-I244 HydrophobicContact CB-CD1 4.13Å; L240-I244 WeakPolarHBondContact O-CB 3.33Å; L240-I244 WeakPolarHBondContact O-CD1 3.38Å; L240-I244 WeakPolarHBondContact O-CG1 3.39Å; L240-I244 PolarHBondContact O-N 2.93Å |
| 241 | M | 95.1 | Very high | 92.2 | Very high | 41 Ų | 41 | 40 Ų | 40 | 20% | 0.202 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -65.7 | -40.3 | -174 | -68.1 | -61.7 | 140.8 | 0 | 0 | 112.9 | V184 T237 V238 I244 G245 | V184-M241 HydrophobicContact CG2-CB 3.88Å; V184-M241 HydrophobicContact CG2-CG 4.24Å; V184-M241 HydrophobicContact CG2-SD 3.66Å; T237-M241 HydrophobicContact CG2-CE 4.09Å; T237-M241 VanDerWaalsContact O-CE 3.31Å; T237-M241 WeakPolarHBondContact O-CE 3.31Å; T237-M241 WeakPolarHBondContact O-CG 3.14Å; V238-M241 WeakPolarHBondContact O-CB 3.48Å; V238-M241 PolarHBondContact O-N 3.16Å; V238-M241 VanDerWaalsContact O-N 3.11Å; M241-I244 HydrophobicContact CE-CD1 4.48Å; M241-I244 PolarHBondContact O-N 3.34Å; M241-G245 PolarHBondContact O-N 3.26Å |
| 242 | I | 92.4 | Very high | 91.9 | Very high | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -65 | -52.6 | 174.1 | -62.2 | -175 | 0 | 0 | 0 | 111.4 | V14 M18 S183 V206 E210 L240 I244 G245 I246 | V14-I242 HydrophobicContact CG1-CB 4.03Å; V14-I242 HydrophobicContact CG1-CD1 3.54Å; V14-I242 HydrophobicContact CG1-CG1 4.31Å; V14-I242 HydrophobicContact CG1-CG2 3.92Å; M18-I242 HydrophobicContact SD-CD1 3.77Å; M18-I242 HydrophobicContact SD-CG1 4.21Å; S183-I242 WeakPolarHBondContact O-CG1 3.34Å; V206-I242 HydrophobicContact CG1-CD1 4.38Å; E210-I242 HydrophobicContact CB-CD1 4.49Å; E210-I242 VanDerWaalsContact CD-CD1 3.48Å; E210-I242 HydrophobicContact CG-CD1 3.58Å; E210-I242 VanDerWaalsContact OE1-CD1 3.31Å; E210-I242 WeakPolarHBondContact OE1-CD1 3.14Å; L240-I242 PolarHBondContact O-N 2.79Å; I242-I244 VanDerWaalsContact C-N 3.28Å; I242-I244 PolarHBondContact O-N 2.96Å; I242-G245 WeakPolarHBondContact O-CA 3.32Å; I242-G245 PolarHBondContact O-N 2.79Å; I242-G245 VanDerWaalsContact O-N 3.08Å; I242-I246 HydrophobicContact CG2-CD1 3.69Å; I242-I246 HydrophobicContact CG2-CG1 4.12Å; I242-I246 WeakPolarHBondContact O-CG1 3.42Å; I242-I246 PolarHBondContact O-N 2.71Å |
| 243 | P | 92.6 | Very high | 90.7 | Very high | 12 Ų | 12 | 43.1 Ų | 43.1 | 8% | 0.078 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -49 | -45.5 | 172.1 | -33.1 | 35.9 | 0 | 0 | 0 | 114.9 | L11 F15 S239 L240 I246 G247 | L11-P243 HydrophobicContact CD1-CB 3.79Å; L11-P243 HydrophobicContact CD2-CB 3.73Å; L11-P243 HydrophobicContact CD2-CG 3.93Å; L11-P243 HydrophobicContact CG-CB 3.51Å; L11-P243 HydrophobicContact CG-CG 3.85Å; F15-P243 HydrophobicContact CB-CG 4.17Å; F15-P243 HydrophobicContact CD2-CG 4.43Å; S239-P243 WeakPolarHBondContact O-CD 3.47Å; S239-P243 WeakPolarHBondContact O-CG 3.42Å; L240-P243 WeakPolarHBondContact O-CD 3.46Å; P243-I246 PolarHBondContact O-N 2.77Å; P243-G247 PolarHBondContact O-N 3.22Å |
| 244 | I | 93.9 | Very high | 89.2 | Confident | 81 Ų | 81 | 42.2 Ų | 42.2 | 42% | 0.415 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -62.8 | -47.8 | 177.2 | -70.8 | 166.1 | 0 | 0 | 0 | 109.8 | L240 M241 I242 I246 G247 L248 | L240-I244 HydrophobicContact CB-CD1 4.13Å; L240-I244 WeakPolarHBondContact O-CB 3.33Å; L240-I244 WeakPolarHBondContact O-CD1 3.38Å; L240-I244 WeakPolarHBondContact O-CG1 3.39Å; L240-I244 PolarHBondContact O-N 2.93Å; M241-I244 HydrophobicContact CE-CD1 4.48Å; M241-I244 PolarHBondContact O-N 3.34Å; I242-I244 VanDerWaalsContact C-N 3.28Å; I242-I244 PolarHBondContact O-N 2.96Å; I244-I246 PolarHBondContact O-N 3.09Å; I244-G247 PolarHBondContact O-N 3.3Å; I244-L248 HydrophobicContact CG2-CD1 3.97Å; I244-L248 HydrophobicContact CG2-CG 4.41Å; I244-L248 WeakPolarHBondContact O-CB 3.37Å; I244-L248 VanDerWaalsContact O-CG 3.31Å; I244-L248 WeakPolarHBondContact O-CG 3.47Å; I244-L248 PolarHBondContact O-N 2.8Å |
| 245 | G | 93.9 | Very high | 87.2 | Confident | 0 Ų | 0 | 43.4 Ų | 43.4 | 0% | 0 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -57.5 | -47.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | G187 L188 M241 I242 G247 L248 G249 | G187-G245 CarbonylContact C-O 3.34Å; G187-G245 CarbonylContact O-C 3.59Å; L188-G245 VanDerWaalsContact CA-O 3.3Å; L188-G245 WeakPolarHBondContact CA-O 3.43Å; L188-G245 VanDerWaalsContact N-C 3.34Å; L188-G245 PolarHBondContact N-O 3.23Å; M241-G245 PolarHBondContact O-N 3.26Å; I242-G245 WeakPolarHBondContact O-CA 3.32Å; I242-G245 PolarHBondContact O-N 2.79Å; I242-G245 VanDerWaalsContact O-N 3.08Å; G245-G247 PolarHBondContact O-N 3.27Å; G245-L248 PolarHBondContact O-N 3.33Å; G245-G249 PolarHBondContact O-N 2.88Å |
| 246 | I | 91.4 | Very high | 85.6 | Confident | 1 Ų | 1 | 50.8 Ų | 50.8 | 1% | 0.005 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -59.8 | -47.7 | 177.9 | -66.9 | 171.4 | 0 | 0 | 0 | 110.4 | L11 G187 L190 I242 P243 I244 L248 G249 M250 | L11-I246 HydrophobicContact CB-CD1 4.49Å; G187-I246 VanDerWaalsContact C-N 3.31Å; G187-I246 WeakPolarHBondContact O-CA 3.49Å; G187-I246 WeakPolarHBondContact O-CG1 3.36Å; G187-I246 PolarHBondContact O-N 3.26Å; L190-I246 HydrophobicContact CB-CG1 4.11Å; L190-I246 HydrophobicContact CD1-CD1 4.34Å; I242-I246 HydrophobicContact CG2-CD1 3.69Å; I242-I246 HydrophobicContact CG2-CG1 4.12Å; I242-I246 WeakPolarHBondContact O-CG1 3.42Å; I242-I246 PolarHBondContact O-N 2.71Å; P243-I246 PolarHBondContact O-N 2.77Å; I244-I246 PolarHBondContact O-N 3.09Å; I246-L248 PolarHBondContact O-N 2.85Å; I246-G249 PolarHBondContact O-N 3.23Å; I246-M250 HydrophobicContact CG2-CG 4.32Å; I246-M250 HydrophobicContact CG2-SD 3.85Å; I246-M250 WeakPolarHBondContact O-CB 3.45Å; I246-M250 VanDerWaalsContact O-CG 3.25Å; I246-M250 WeakPolarHBondContact O-CG 3.47Å; I246-M250 PolarHBondContact O-N 3.46Å |
| 247 | G | 90.2 | Very high | 84.7 | Confident | 37 Ų | 37 | 53 Ų | 53 | 38% | 0.381 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -60.2 | -43.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | P243 I244 G245 M250 C251 | P243-G247 PolarHBondContact O-N 3.22Å; I244-G247 PolarHBondContact O-N 3.3Å; G245-G247 PolarHBondContact O-N 3.27Å; G247-M250 PolarHBondContact O-N 3.1Å; G247-C251 WeakPolarHBondContact O-CB 3.33Å; G247-C251 PolarHBondContact O-N 2.99Å |
| 248 | L | 90.9 | Very high | 84.2 | Confident | 89 Ų | 89 | 53.9 Ų | 53.9 | 47% | 0.466 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -64 | -43.8 | 174.8 | -70.6 | 174.8 | 0 | 0 | 0 | 111.6 | L188 I244 G245 I246 M250 C251 I252 | L188-L248 HydrophobicContact CD2-CB 3.49Å; L188-L248 VanDerWaalsContact CD2-CB 3.49Å; L188-L248 HydrophobicContact CD2-CD1 4.46Å; I244-L248 HydrophobicContact CG2-CD1 3.97Å; I244-L248 HydrophobicContact CG2-CG 4.41Å; I244-L248 WeakPolarHBondContact O-CB 3.37Å; I244-L248 VanDerWaalsContact O-CG 3.31Å; I244-L248 WeakPolarHBondContact O-CG 3.47Å; I244-L248 PolarHBondContact O-N 2.8Å; G245-L248 PolarHBondContact O-N 3.33Å; I246-L248 PolarHBondContact O-N 2.85Å; L248-M250 VanDerWaalsContact C-N 3.34Å; L248-M250 PolarHBondContact O-N 3Å; L248-C251 WeakPolarHBondContact O-CB 3.46Å; L248-C251 PolarHBondContact O-N 3.48Å; L248-C251 VanDerWaalsContact O-N 3.15Å; L248-I252 WeakPolarHBondContact O-CG1 3.24Å; L248-I252 PolarHBondContact O-N 3.43Å |
| 249 | G | 89.8 | Confident | 83.8 | Confident | 0 Ų | 0 | 56.8 Ų | 56.8 | 0% | 0 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -62.5 | -42.1 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | G245 I246 C251 I252 N253 | G245-G249 PolarHBondContact O-N 2.88Å; I246-G249 PolarHBondContact O-N 3.23Å; G249-C251 VanDerWaalsContact C-N 3.32Å; G249-C251 PolarHBondContact O-N 3.03Å; G249-I252 PolarHBondContact O-N 3.43Å; G249-N253 VanDerWaalsContact O-CB 3.27Å; G249-N253 WeakPolarHBondContact O-CB 3.47Å; G249-N253 PolarHBondContact O-N 2.93Å |
| 250 | M | 87.7 | Confident | 83.3 | Confident | 61 Ų | 61 | 57.3 Ų | 57.3 | 30% | 0.3 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -62.2 | -38.1 | 173.8 | -72.2 | 174.5 | 64.1 | 0 | 0 | 112.5 | V4 K7 I246 G247 L248 N253 | V4-M250 HydrophobicContact CG1-CE 4.14Å; K7-M250 HydrophobicContact CB-SD 3.95Å; K7-M250 HydrophobicContact CD-CE 4.38Å; K7-M250 HydrophobicContact CD-CG 3.78Å; K7-M250 HydrophobicContact CD-SD 3.82Å; K7-M250 HydrophobicContact CG-SD 4.48Å; I246-M250 HydrophobicContact CG2-CG 4.32Å; I246-M250 HydrophobicContact CG2-SD 3.85Å; I246-M250 WeakPolarHBondContact O-CB 3.45Å; I246-M250 VanDerWaalsContact O-CG 3.25Å; I246-M250 WeakPolarHBondContact O-CG 3.47Å; I246-M250 PolarHBondContact O-N 3.46Å; G247-M250 PolarHBondContact O-N 3.1Å; L248-M250 VanDerWaalsContact C-N 3.34Å; L248-M250 PolarHBondContact O-N 3Å; M250-N253 PolarHBondContact O-N 3.24Å |
| 251 | C | 85.4 | Confident | 82.9 | Confident | 97 Ų | 97 | 56.6 Ų | 56.6 | 66% | 0.655 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -65.7 | -43.1 | 176.9 | -175.3 | 0 | 0 | 0 | 0 | 111.8 | G247 L248 G249 N253 | G247-C251 WeakPolarHBondContact O-CB 3.33Å; G247-C251 PolarHBondContact O-N 2.99Å; L248-C251 WeakPolarHBondContact O-CB 3.46Å; L248-C251 PolarHBondContact O-N 3.48Å; L248-C251 VanDerWaalsContact O-N 3.15Å; G249-C251 VanDerWaalsContact C-N 3.32Å; G249-C251 PolarHBondContact O-N 3.03Å; C251-N253 VanDerWaalsContact C-N 3.34Å |
| 252 | I | 83.3 | Confident | 82.7 | Confident | 106 Ų | 106 | 58 Ų | 58 | 54% | 0.544 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -66.6 | -37.2 | 176.7 | -64 | 164 | 0 | 0 | 0 | 110.9 | L188 L192 L248 G249 S254 | L188-I252 HydrophobicContact CD2-CD1 4.24Å; L192-I252 HydrophobicContact CD2-CB 4.05Å; L192-I252 HydrophobicContact CD2-CG2 3.86Å; L248-I252 WeakPolarHBondContact O-CG1 3.24Å; L248-I252 PolarHBondContact O-N 3.43Å; G249-I252 PolarHBondContact O-N 3.43Å; I252-S254 PolarHBondContact O-N 2.93Å |
| 253 | N | 69.5 | Low | 82.5 | Confident | 28 Ų | 28 | 59.7 Ų | 59.7 | 15% | 0.15 | 36% | 0.363 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -70.5 | 1.5 | -176.4 | -157.9 | 75.3 | 0 | 0 | 0 | 115 | L192 E194 G249 M250 C251 A255 | L192-N253 HydrophobicContact CD2-CB 4.24Å; L192-N253 PolarHBondContact O-OD1 3.44Å; E194-N253 PolarHBondContact OE1-ND2 2.98Å; E194-N253 PolarHBondContact OE1-OD1 3.29Å; G249-N253 VanDerWaalsContact O-CB 3.27Å; G249-N253 WeakPolarHBondContact O-CB 3.47Å; G249-N253 PolarHBondContact O-N 2.93Å; M250-N253 PolarHBondContact O-N 3.24Å; C251-N253 VanDerWaalsContact C-N 3.34Å; N253-A255 PolarHBondContact O-N 2.83Å; N253-A255 VanDerWaalsContact O-N 3.13Å |
| 254 | S | 61.9 | Low | 82.4 | Confident | 114 Ų | 114 | 59.2 Ų | 59.2 | 80% | 0.797 | 36% | 0.36 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.5 | -13.2 | 176.1 | -161.3 | 0 | 0 | 0 | 0 | 112.9 | I252 | I252-S254 PolarHBondContact O-N 2.93Š|
| 255 | A | 51.3 | Low | 82.3 | Confident | 54 Ų | 54 | 55.7 Ų | 55.7 | 45% | 0.446 | 34% | 0.342 | S | S | . | . | S | Bend | trans | -112.4 | 99 | 172.4 | 0 | 0 | 0 | 0 | 0 | 110.2 | N253 N257 | N253-A255 PolarHBondContact O-N 2.83Å; N253-A255 VanDerWaalsContact O-N 3.13Å; A255-N257 VanDerWaalsContact O-CG 3.25Å; A255-N257 PolarHBondContact O-N 3.41Å |
| 256 | Q | 59.8 | Low | 82.3 | Confident | 156 Ų | 156 | 58.5 Ų | 58.5 | 73% | 0.729 | 36% | 0.359 | S | S | * | . | trans | -64.3 | 84.2 | -175.1 | -61.9 | -162.9 | -82.6 | 0 | 0 | 113.2 | ||||
| 257 | N | 74.9 | Confident | 82.4 | Confident | 96 Ų | 96 | 59.8 Ų | 59.8 | 51% | 0.513 | 37% | 0.366 | S | S | . | . | trans | -132.7 | 148.6 | -166.9 | -57.3 | -16.7 | 0 | 0 | 0 | 112.1 | A255 A259 G260 | A255-N257 VanDerWaalsContact O-CG 3.25Å; A255-N257 PolarHBondContact O-N 3.41Å; N257-A259 HydrophobicContact CB-CB 4.29Å; N257-A259 PolarHBondContact O-N 3.34Å; N257-G260 PolarHBondContact O-N 3.45Å | ||
| 258 | L | 82 | Confident | 82.5 | Confident | 85 Ų | 85 | 58.3 Ų | 58.3 | 45% | 0.445 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -44.8 | -33.2 | 167.2 | 174.1 | 64.1 | 0 | 0 | 0 | 113.1 | L77 V78 G260 S261 I262 | L77-L258 HydrophobicContact CB-CD1 4.34Å; V78-L258 HydrophobicContact CG2-CD1 3.96Å; V78-L258 HydrophobicContact CG2-CD2 4.15Å; L258-G260 VanDerWaalsContact C-N 3.25Å; L258-G260 PolarHBondContact O-N 2.82Å; L258-S261 PolarHBondContact O-N 3.22Å; L258-I262 HydrophobicContact CD1-CD1 4.28Å; L258-I262 HydrophobicContact CD1-CG1 4.43Å; L258-I262 HydrophobicContact CD2-CD1 4.46Å; L258-I262 HydrophobicContact CG-CD1 3.91Å; L258-I262 HydrophobicContact CG-CG1 4.48Å; L258-I262 WeakPolarHBondContact O-CG1 3.32Å; L258-I262 PolarHBondContact O-N 2.63Å |
| 259 | A | 84.8 | Confident | 82.7 | Confident | 64 Ų | 64 | 54 Ų | 54 | 53% | 0.529 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -57.7 | -34.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | N257 A263 | N257-A259 HydrophobicContact CB-CB 4.29Å; N257-A259 PolarHBondContact O-N 3.34Å; A259-A263 WeakPolarHBondContact O-CB 3.28Å; A259-A263 PolarHBondContact O-N 3.27Å |
| 260 | G | 84.4 | Confident | 83 | Confident | 12 Ų | 12 | 55.2 Ų | 55.2 | 12% | 0.124 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -68.1 | -41.8 | 177 | 0 | 0 | 0 | 0 | 0 | 112.4 | N257 L258 A263 S264 | N257-G260 PolarHBondContact O-N 3.45Å; L258-G260 VanDerWaalsContact C-N 3.25Å; L258-G260 PolarHBondContact O-N 2.82Å; G260-A263 PolarHBondContact O-N 2.93Å; G260-S264 VanDerWaalsContact O-CB 3.29Å; G260-S264 WeakPolarHBondContact O-CB 3.34Å; G260-S264 PolarHBondContact O-N 2.94Å |
| 261 | S | 85.8 | Confident | 83.3 | Confident | 54 Ų | 54 | 52.3 Ų | 52.3 | 38% | 0.378 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -65.4 | -42.8 | 174.9 | -51.9 | 0 | 0 | 0 | 0 | 111.8 | L258 S264 V265 | L258-S261 PolarHBondContact O-N 3.22Å; S261-S264 PolarHBondContact O-N 2.94Å; S261-V265 PolarHBondContact O-N 3.07Å |
| 262 | I | 89.8 | Confident | 83.8 | Confident | 70 Ų | 70 | 47.8 Ų | 47.8 | 36% | 0.359 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -62.7 | -46.7 | 174.9 | -65.4 | 169.5 | 0 | 0 | 0 | 110.5 | V74 L258 S264 V265 V266 | V74-I262 HydrophobicContact CG1-CG1 3.77Å; L258-I262 HydrophobicContact CD1-CD1 4.28Å; L258-I262 HydrophobicContact CD1-CG1 4.43Å; L258-I262 HydrophobicContact CD2-CD1 4.46Å; L258-I262 HydrophobicContact CG-CD1 3.91Å; L258-I262 HydrophobicContact CG-CG1 4.48Å; L258-I262 WeakPolarHBondContact O-CG1 3.32Å; L258-I262 PolarHBondContact O-N 2.63Å; I262-S264 VanDerWaalsContact C-N 3.35Å; I262-S264 PolarHBondContact O-N 3.49Å; I262-V265 WeakPolarHBondContact O-CG1 3.36Å; I262-V265 PolarHBondContact O-N 3.28Å; I262-V266 HydrophobicContact CG2-CG2 4.45Å; I262-V266 VanDerWaalsContact O-CG2 3.26Å; I262-V266 WeakPolarHBondContact O-CG2 3.26Å; I262-V266 PolarHBondContact O-N 2.93Å |
| 263 | A | 90.1 | Very high | 84.3 | Confident | 36 Ų | 36 | 42.7 Ų | 42.7 | 30% | 0.298 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -61.7 | -43.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | L192 A259 G260 V265 V266 L267 | L192-A263 HydrophobicContact CD1-CB 4.02Å; A259-A263 WeakPolarHBondContact O-CB 3.28Å; A259-A263 PolarHBondContact O-N 3.27Å; G260-A263 PolarHBondContact O-N 2.93Å; A263-V265 PolarHBondContact O-N 3.3Å; A263-V266 PolarHBondContact O-N 3.31Å; A263-L267 WeakPolarHBondContact O-CB 3.35Å; A263-L267 WeakPolarHBondContact O-CD1 3.21Å; A263-L267 WeakPolarHBondContact O-CG 3.34Å; A263-L267 PolarHBondContact O-N 3.32Å |
| 264 | S | 89.3 | Confident | 85.4 | Confident | 3 Ų | 3 | 41.4 Ų | 41.4 | 2% | 0.021 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -59.9 | -45.9 | 178.1 | -175.1 | 0 | 0 | 0 | 0 | 111.7 | K70 A189 G260 S261 I262 L267 Q268 | K70-S264 PolarHBondContact NZ-OG 2.95Å; A189-S264 PolarHBondContact O-OG 2.85Å; G260-S264 VanDerWaalsContact O-CB 3.29Å; G260-S264 WeakPolarHBondContact O-CB 3.34Å; G260-S264 PolarHBondContact O-N 2.94Å; S261-S264 PolarHBondContact O-N 2.94Å; I262-S264 VanDerWaalsContact C-N 3.35Å; I262-S264 PolarHBondContact O-N 3.49Å; S264-L267 PolarHBondContact O-N 3.45Å; S264-Q268 WeakPolarHBondContact O-CB 3.35Å; S264-Q268 PolarHBondContact O-N 3.5Å |
| 265 | V | 91.8 | Very high | 86.9 | Confident | 7 Ų | 7 | 36 Ų | 36 | 4% | 0.042 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -68.4 | -37.9 | 178.5 | 70.9 | 0 | 0 | 0 | 0 | 112 | K70 V71 V74 M90 S261 I262 A263 Q268 G269 | K70-V265 HydrophobicContact CB-CB 4.22Å; K70-V265 HydrophobicContact CB-CG2 3.65Å; V71-V265 HydrophobicContact CB-CG2 4.44Å; V71-V265 HydrophobicContact CG2-CG2 3.58Å; V74-V265 HydrophobicContact CG2-CB 4.43Å; V74-V265 HydrophobicContact CG2-CG1 4.05Å; M90-V265 HydrophobicContact CE-CB 4.39Å; M90-V265 HydrophobicContact CE-CG1 4.09Å; M90-V265 HydrophobicContact CE-CG2 4.04Å; M90-V265 WeakPolarHBondContact CE-O 3.03Å; S261-V265 PolarHBondContact O-N 3.07Å; I262-V265 WeakPolarHBondContact O-CG1 3.36Å; I262-V265 PolarHBondContact O-N 3.28Å; A263-V265 PolarHBondContact O-N 3.3Å; V265-Q268 PolarHBondContact O-N 2.87Å; V265-G269 PolarHBondContact O-N 3.46Å |
| 266 | V | 94.1 | Very high | 88.9 | Confident | 58 Ų | 58 | 34.2 Ų | 34.2 | 35% | 0.352 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -60.9 | -50.9 | 173.3 | 173.6 | 0 | 0 | 0 | 0 | 111.3 | M90 I262 A263 Q268 G269 L270 | M90-V266 HydrophobicContact CE-CB 4.1Å; M90-V266 HydrophobicContact CE-CG2 3.76Å; I262-V266 HydrophobicContact CG2-CG2 4.45Å; I262-V266 VanDerWaalsContact O-CG2 3.26Å; I262-V266 WeakPolarHBondContact O-CG2 3.26Å; I262-V266 PolarHBondContact O-N 2.93Å; A263-V266 PolarHBondContact O-N 3.31Å; V266-Q268 VanDerWaalsContact C-N 3.33Å; V266-Q268 PolarHBondContact O-N 2.95Å; V266-G269 PolarHBondContact O-N 2.87Å; V266-L270 HydrophobicContact CG1-CD1 4.04Å; V266-L270 HydrophobicContact CG1-CG 4.36Å; V266-L270 VanDerWaalsContact O-CG 3.3Å; V266-L270 WeakPolarHBondContact O-CG 3.4Å; V266-L270 PolarHBondContact O-N 3.47Å |
| 267 | L | 93.4 | Very high | 90.4 | Very high | 29 Ų | 29 | 26.8 Ų | 26.8 | 15% | 0.152 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -61.1 | -42.1 | 179.7 | -72.1 | 164.5 | 0 | 0 | 0 | 111.8 | F185 L188 A189 L192 A263 S264 L270 A271 | F185-L267 HydrophobicContact CD1-CD2 3.98Å; F185-L267 HydrophobicContact CG-CD2 4.49Å; L188-L267 HydrophobicContact CB-CD1 3.7Å; L188-L267 HydrophobicContact CD1-CD1 4.42Å; L188-L267 HydrophobicContact CD1-CD2 4.11Å; A189-L267 HydrophobicContact CB-CB 4.3Å; L192-L267 HydrophobicContact CD1-CD1 3.77Å; A263-L267 WeakPolarHBondContact O-CB 3.35Å; A263-L267 WeakPolarHBondContact O-CD1 3.21Å; A263-L267 WeakPolarHBondContact O-CG 3.34Å; A263-L267 PolarHBondContact O-N 3.32Å; S264-L267 PolarHBondContact O-N 3.45Å; L267-L270 PolarHBondContact O-N 3.49Å; L267-A271 VanDerWaalsContact O-CB 3.32Å; L267-A271 WeakPolarHBondContact O-CB 3.42Å; L267-A271 PolarHBondContact O-N 3.25Å |
| 268 | Q | 92.9 | Very high | 91 | Very high | 5 Ų | 5 | 22.3 Ų | 22.3 | 2% | 0.023 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -68.8 | -37.4 | 178.2 | -164.1 | 175.1 | -31.8 | 0 | 0 | 112.2 | V67 K70 A189 S264 V265 V266 A271 A272 | V67-Q268 HydrophobicContact CG2-CB 4.44Å; V67-Q268 HydrophobicContact CG2-CG 4.02Å; K70-Q268 VanDerWaalsContact CD-OE1 3.26Å; A189-Q268 HydrophobicContact CB-CB 4.33Å; S264-Q268 WeakPolarHBondContact O-CB 3.35Å; S264-Q268 PolarHBondContact O-N 3.5Å; V265-Q268 PolarHBondContact O-N 2.87Å; V266-Q268 VanDerWaalsContact C-N 3.33Å; V266-Q268 PolarHBondContact O-N 2.95Å; Q268-A271 PolarHBondContact O-N 2.88Å; Q268-A272 WeakPolarHBondContact O-CB 3.37Å; Q268-A272 PolarHBondContact O-N 3.47Å |
| 269 | G | 95.5 | Very high | 91.4 | Very high | 0 Ų | 0 | 18.2 Ų | 18.2 | 0% | 0 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -62 | -47 | 171.3 | 0 | 0 | 0 | 0 | 0 | 112 | M91 V265 V266 A271 A272 G273 | M91-G269 WeakPolarHBondContact CA-O 3.37Å; V265-G269 PolarHBondContact O-N 3.46Å; V266-G269 PolarHBondContact O-N 2.87Å; G269-A271 PolarHBondContact O-N 3.38Å; G269-A272 PolarHBondContact O-N 3.38Å; G269-G273 PolarHBondContact O-N 2.92Å |
| 270 | L | 95.9 | Very high | 91.6 | Very high | 24 Ų | 24 | 18.9 Ų | 18.9 | 13% | 0.126 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -61.5 | -42.6 | 175.7 | -66.7 | 176.7 | 0 | 0 | 0 | 111.8 | L93 F185 V266 L267 G273 T274 | L93-L270 HydrophobicContact CB-CD2 4.07Å; L93-L270 HydrophobicContact CD2-CD2 3.96Å; L93-L270 HydrophobicContact CG-CD2 3.8Å; F185-L270 HydrophobicContact CD2-CB 4.23Å; F185-L270 HydrophobicContact CE2-CB 4.43Å; V266-L270 HydrophobicContact CG1-CD1 4.04Å; V266-L270 HydrophobicContact CG1-CG 4.36Å; V266-L270 VanDerWaalsContact O-CG 3.3Å; V266-L270 WeakPolarHBondContact O-CG 3.4Å; V266-L270 PolarHBondContact O-N 3.47Å; L267-L270 PolarHBondContact O-N 3.49Å; L270-G273 WeakPolarHBondContact O-CA 3.48Å; L270-G273 PolarHBondContact O-N 3.25Å; L270-T274 VanDerWaalsContact O-CG2 3.24Å; L270-T274 WeakPolarHBondContact O-CG2 3.48Å; L270-T274 PolarHBondContact O-N 3.03Å |
| 271 | A | 94.1 | Very high | 91.5 | Very high | 0 Ų | 0 | 22.6 Ų | 22.6 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -61.7 | -43.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | H182 F185 L267 Q268 G269 G273 T274 F275 | H182-A271 PolarHBondContact CE1-O 3.05Å; H182-A271 PolarHBondContact ND1-O 3.21Å; F185-A271 HydrophobicContact CB-CB 3.84Å; L267-A271 VanDerWaalsContact O-CB 3.32Å; L267-A271 WeakPolarHBondContact O-CB 3.42Å; L267-A271 PolarHBondContact O-N 3.25Å; Q268-A271 PolarHBondContact O-N 2.88Å; G269-A271 PolarHBondContact O-N 3.38Å; A271-G273 PolarHBondContact O-N 3.23Å; A271-T274 PolarHBondContact O-N 2.96Å; A271-T274 PolarHBondContact O-OG1 3.48Å; A271-F275 WeakPolarHBondContact O-CB 2.94Å; A271-F275 PolarHBondContact O-N 2.94Å |
| 272 | A | 94.4 | Very high | 91.3 | Very high | 2 Ų | 2 | 20.8 Ų | 20.8 | 2% | 0.017 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -60.1 | -37.7 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | L63 V67 M91 Q268 G269 F275 L276 | L63-A272 HydrophobicContact CB-CB 4Å; L63-A272 HydrophobicContact CD1-CB 4.49Å; V67-A272 HydrophobicContact CG2-CB 4.17Å; M91-A272 HydrophobicContact CE-CB 4.5Å; M91-A272 HydrophobicContact CG-CB 4.1Å; M91-A272 HydrophobicContact SD-CB 4.46Å; Q268-A272 WeakPolarHBondContact O-CB 3.37Å; Q268-A272 PolarHBondContact O-N 3.47Å; G269-A272 PolarHBondContact O-N 3.38Å; A272-F275 PolarHBondContact O-N 3.43Å; A272-L276 PolarHBondContact O-N 3.06Å |
| 273 | G | 95.1 | Very high | 90.9 | Very high | 0 Ų | 0 | 18.2 Ų | 18.2 | 0% | 0 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -65 | -44 | 174.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | M91 F95 G269 L270 A271 F275 L276 F277 | M91-G273 WeakPolarHBondContact O-CA 3.34Å; F95-G273 WeakPolarHBondContact CA-O 3.2Å; G269-G273 PolarHBondContact O-N 2.92Å; L270-G273 WeakPolarHBondContact O-CA 3.48Å; L270-G273 PolarHBondContact O-N 3.25Å; A271-G273 PolarHBondContact O-N 3.23Å; G273-F275 VanDerWaalsContact C-N 3.32Å; G273-L276 WeakPolarHBondContact O-CB 3.28Å; G273-L276 PolarHBondContact O-N 3.02Å; G273-F277 PolarHBondContact O-N 2.9Å; G273-F277 VanDerWaalsContact O-N 3.09Å |
| 274 | T | 93.3 | Very high | 90.7 | Very high | 1 Ų | 1 | 17.7 Ų | 17.7 | 1% | 0.006 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -65.2 | -38.9 | 176.3 | 66.4 | 0 | 0 | 0 | 0 | 111 | T98 H182 F185 L270 A271 L276 F277 V278 | T98-T274 WeakPolarHBondContact OG1-CA 3.1Å; T98-T274 WeakPolarHBondContact OG1-CB 3.36Å; T98-T274 WeakPolarHBondContact OG1-CG2 3.49Å; H182-T274 WeakPolarHBondContact CA-OG1 3.28Å; H182-T274 WeakPolarHBondContact CB-OG1 3.44Å; H182-T274 PolarHBondContact ND1-OG1 2.65Å; F185-T274 HydrophobicContact CD2-CG2 4.1Å; F185-T274 HydrophobicContact CE2-CG2 3.96Å; L270-T274 VanDerWaalsContact O-CG2 3.24Å; L270-T274 WeakPolarHBondContact O-CG2 3.48Å; L270-T274 PolarHBondContact O-N 3.03Å; A271-T274 PolarHBondContact O-N 2.96Å; A271-T274 PolarHBondContact O-OG1 3.48Å; T274-L276 PolarHBondContact O-N 2.91Å; T274-F277 WeakPolarHBondContact O-CB 3.4Å; T274-F277 PolarHBondContact O-N 3.38Å; T274-V278 WeakPolarHBondContact O-CG2 3.42Å; T274-V278 PolarHBondContact O-N 3.07Å |
| 275 | F | 91.8 | Very high | 90.4 | Very high | 1 Ų | 1 | 19.2 Ų | 19.2 | 0% | 0.004 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -64.8 | -38.1 | 175.2 | -167.6 | -94.6 | 0 | 0 | 0 | 112.3 | F55 T58 C59 L63 H182 A271 A272 G273 V278 T279 | F55-F275 HydrophobicContact CB-CE1 4.04Å; F55-F275 HydrophobicContact CB-CZ 3.97Å; F55-F275 HydrophobicContact CD1-CZ 4.47Å; F55-F275 HydrophobicContact CD2-CE1 4.21Å; F55-F275 AromaticContact CD2-CE2 3.95Å; F55-F275 HydrophobicContact CD2-CE2 3.95Å; F55-F275 AromaticContact CD2-CZ 3.48Å; F55-F275 HydrophobicContact CD2-CZ 3.48Å; F55-F275 VanDerWaalsContact CD2-CZ 3.48Å; F55-F275 HydrophobicContact CE2-CE2 4.25Å; F55-F275 HydrophobicContact CE2-CZ 4.16Å; F55-F275 HydrophobicContact CG-CE1 4.29Å; F55-F275 AromaticContact CG-CZ 3.71Å; F55-F275 HydrophobicContact CG-CZ 3.71Å; F55-F275 WeakPolarHBondContact O-CE1 3.47Å; T58-F275 HydrophobicContact CG2-CD1 4.5Å; T58-F275 HydrophobicContact CG2-CE1 3.75Å; T58-F275 HydrophobicContact CG2-CZ 3.93Å; C59-F275 WeakPolarHBondContact SG-CD1 3.25Å; L63-F275 HydrophobicContact CD1-CB 3.96Å; L63-F275 HydrophobicContact CD1-CD1 3.59Å; L63-F275 HydrophobicContact CD1-CE1 4.24Å; L63-F275 HydrophobicContact CD1-CG 3.78Å; H182-F275 AromaticContact CE1-CD2 3.93Å; H182-F275 AromaticContact NE2-CD2 3.75Å; A271-F275 WeakPolarHBondContact O-CB 2.94Å; A271-F275 PolarHBondContact O-N 2.94Å; A272-F275 PolarHBondContact O-N 3.43Å; G273-F275 VanDerWaalsContact C-N 3.32Å; F275-V278 PolarHBondContact O-N 3.41Å; F275-T279 WeakPolarHBondContact O-CB 3.35Å; F275-T279 PolarHBondContact O-N 3.45Å; F275-T279 PolarHBondContact O-OG1 3.22Å |
| 276 | L | 93.6 | Very high | 89.6 | Confident | 15 Ų | 15 | 22 Ų | 22 | 8% | 0.079 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -59.5 | -46.3 | 172.5 | -173.6 | 71.5 | 0 | 0 | 0 | 111.2 | C59 F60 M91 M92 F95 A272 G273 T274 T279 F280 | C59-L276 HydrophobicContact CB-CD1 4.14Å; F60-L276 HydrophobicContact CE2-CD1 4.14Å; F60-L276 HydrophobicContact CZ-CD1 3.89Å; M91-L276 HydrophobicContact CE-CB 3.83Å; M91-L276 HydrophobicContact CE-CD1 3.91Å; M91-L276 HydrophobicContact CE-CD2 4.04Å; M91-L276 HydrophobicContact CE-CG 4.13Å; M92-L276 HydrophobicContact SD-CD2 4.39Å; F95-L276 HydrophobicContact CD2-CD2 4.17Å; F95-L276 HydrophobicContact CD2-CG 4.38Å; A272-L276 PolarHBondContact O-N 3.06Å; G273-L276 WeakPolarHBondContact O-CB 3.28Å; G273-L276 PolarHBondContact O-N 3.02Å; T274-L276 PolarHBondContact O-N 2.91Å; L276-T279 PolarHBondContact O-N 2.74Å; L276-F280 HydrophobicContact CD1-CD2 3.74Å; L276-F280 HydrophobicContact CD1-CE2 3.54Å; L276-F280 HydrophobicContact CG-CD2 4.13Å; L276-F280 HydrophobicContact CG-CE2 4.36Å; L276-F280 WeakPolarHBondContact O-CD2 3.33Å; L276-F280 PolarHBondContact O-N 3.38Å; L276-F280 VanDerWaalsContact O-N 3.08Å |
| 277 | F | 91.2 | Very high | 88.9 | Confident | 1 Ų | 1 | 19.6 Ų | 19.6 | 0% | 0.004 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -58.3 | -52.1 | 176.1 | 172.1 | -89.4 | 0 | 0 | 0 | 111.4 | F95 T98 V99 E102 A178 G273 T274 T279 F280 F281 E282 | F95-F277 HydrophobicContact CD2-CB 3.71Å; F95-F277 HydrophobicContact CD2-CD2 4.42Å; F95-F277 HydrophobicContact CE2-CB 3.99Å; F95-F277 AromaticContact CE2-CD2 3.99Å; F95-F277 HydrophobicContact CE2-CD2 3.99Å; T98-F277 HydrophobicContact CG2-CB 4.03Å; T98-F277 HydrophobicContact CG2-CD1 3.28Å; T98-F277 HydrophobicContact CG2-CD2 4.38Å; T98-F277 HydrophobicContact CG2-CE1 3.84Å; T98-F277 HydrophobicContact CG2-CG 3.62Å; V99-F277 HydrophobicContact CG2-CD2 3.57Å; V99-F277 HydrophobicContact CG2-CE2 3.78Å; E102-F277 WeakPolarHBondContact OE2-CE2 3.03Å; E102-F277 WeakPolarHBondContact OE2-CZ 3.34Å; A178-F277 HydrophobicContact CB-CD1 4.42Å; A178-F277 HydrophobicContact CB-CE1 4.47Å; G273-F277 PolarHBondContact O-N 2.9Å; G273-F277 VanDerWaalsContact O-N 3.09Å; T274-F277 WeakPolarHBondContact O-CB 3.4Å; T274-F277 PolarHBondContact O-N 3.38Å; F277-T279 VanDerWaalsContact C-N 3.27Å; F277-T279 PolarHBondContact O-N 2.89Å; F277-F280 PolarHBondContact O-N 3.01Å; F277-F281 HydrophobicContact CD2-CB 4.29Å; F277-F281 AromaticContact CD2-CD2 3.76Å; F277-F281 HydrophobicContact CD2-CD2 3.76Å; F277-F281 HydrophobicContact CD2-CG 4.18Å; F277-F281 HydrophobicContact CE1-CB 4.47Å; F277-F281 HydrophobicContact CE2-CB 3.85Å; F277-F281 AromaticContact CE2-CD2 3.95Å; F277-F281 HydrophobicContact CE2-CD2 3.95Å; F277-F281 AromaticContact CE2-CG 3.89Å; F277-F281 HydrophobicContact CE2-CG 3.89Å; F277-F281 HydrophobicContact CZ-CB 3.93Å; F277-F281 HydrophobicContact CZ-CG 4.45Å; F277-F281 WeakPolarHBondContact O-CB 3.41Å; F277-F281 PolarHBondContact O-N 2.83Å; F277-E282 HydrophobicContact CE1-CG 4Å |
| 278 | V | 88 | Confident | 88.4 | Confident | 1 Ų | 1 | 21.1 Ų | 21.1 | 1% | 0.006 | 10% | 0.102 | C | C | . | . | I | π-helix | trans | -57.1 | -43 | 179.1 | 170.4 | 0 | 0 | 0 | 0 | 111.1 | L175 A178 L179 T274 F275 E282 I283 | L175-V278 HydrophobicContact CD1-CG1 3.82Å; A178-V278 HydrophobicContact CB-CG2 3.64Å; L179-V278 HydrophobicContact CD2-CG1 4.02Å; L179-V278 HydrophobicContact CD2-CG2 4.35Å; L179-V278 HydrophobicContact CG-CG1 4.43Å; T274-V278 WeakPolarHBondContact O-CG2 3.42Å; T274-V278 PolarHBondContact O-N 3.07Å; F275-V278 PolarHBondContact O-N 3.41Å; V278-E282 HydrophobicContact CG1-CB 4.39Å; V278-E282 WeakPolarHBondContact O-CB 3.42Å; V278-E282 PolarHBondContact O-N 3.3Å; V278-E282 VanDerWaalsContact O-N 3.11Å; V278-I283 HydrophobicContact CG1-CD1 3.97Å; V278-I283 HydrophobicContact CG1-CG1 4.31Å; V278-I283 PolarHBondContact O-N 2.88Å |
| 279 | T | 89.6 | Confident | 87.7 | Confident | 0 Ų | 0 | 26 Ų | 26 | 0% | 0 | 12% | 0.124 | C | C | . | . | I | π-helix | trans | -61.4 | -51.2 | -179.5 | -60.2 | 0 | 0 | 0 | 0 | 111.7 | F55 L56 C59 F275 L276 F277 L284 | F55-T279 HydrophobicContact CB-CG2 3.76Å; L56-T279 HydrophobicContact CB-CG2 4.34Å; L56-T279 HydrophobicContact CD1-CG2 4.45Å; C59-T279 PolarHBondContact SG-OG1 3.24Å; C59-T279 VanDerWaalsContact SG-OG1 3.42Å; F275-T279 WeakPolarHBondContact O-CB 3.35Å; F275-T279 PolarHBondContact O-N 3.45Å; F275-T279 PolarHBondContact O-OG1 3.22Å; L276-T279 PolarHBondContact O-N 2.74Å; F277-T279 VanDerWaalsContact C-N 3.27Å; F277-T279 PolarHBondContact O-N 2.89Å; T279-L284 WeakPolarHBondContact O-CB 2.91Å; T279-L284 PolarHBondContact O-N 2.94Å |
| 280 | F | 89.3 | Confident | 86.7 | Confident | 78 Ų | 78 | 29.1 Ų | 29.1 | 34% | 0.342 | 14% | 0.141 | S | C | . | . | I | π-helix | trans | -76.5 | -47.1 | -175.5 | -85.3 | -84.2 | 0 | 0 | 0 | 113.2 | L56 F60 L276 F277 L284 S285 | L56-F280 HydrophobicContact CD1-CE1 4.41Å; L56-F280 HydrophobicContact CD1-CE2 3.61Å; L56-F280 HydrophobicContact CD1-CZ 3.52Å; F60-F280 HydrophobicContact CE2-CE2 4.15Å; F60-F280 HydrophobicContact CE2-CZ 4.39Å; F60-F280 HydrophobicContact CZ-CE2 4.46Å; L276-F280 HydrophobicContact CD1-CD2 3.74Å; L276-F280 HydrophobicContact CD1-CE2 3.54Å; L276-F280 HydrophobicContact CG-CD2 4.13Å; L276-F280 HydrophobicContact CG-CE2 4.36Å; L276-F280 WeakPolarHBondContact O-CD2 3.33Å; L276-F280 PolarHBondContact O-N 3.38Å; L276-F280 VanDerWaalsContact O-N 3.08Å; F277-F280 PolarHBondContact O-N 3.01Å; F280-L284 HydrophobicContact CD1-CD2 4.09Å; F280-L284 HydrophobicContact CE1-CD2 4.25Å; F280-S285 WeakPolarHBondContact O-CB 3.43Å; F280-S285 PolarHBondContact O-N 2.89Å |
| 281 | F | 83.7 | Confident | 85.9 | Confident | 90 Ų | 90 | 36.6 Ų | 36.6 | 40% | 0.395 | 17% | 0.173 | S | C | . | . | I | π-helix | trans | -93.4 | -36.9 | -168 | -71.3 | -86.4 | 0 | 0 | 0 | 113.2 | F95 F277 S285 | F95-F281 AromaticContact CE2-CD2 3.97Å; F95-F281 HydrophobicContact CE2-CD2 3.97Å; F95-F281 AromaticContact CE2-CE2 3.56Å; F95-F281 HydrophobicContact CE2-CE2 3.56Å; F95-F281 HydrophobicContact CZ-CD2 4.3Å; F95-F281 AromaticContact CZ-CE2 3.52Å; F95-F281 HydrophobicContact CZ-CE2 3.52Å; F95-F281 HydrophobicContact CZ-CZ 4.21Å; F277-F281 HydrophobicContact CD2-CB 4.29Å; F277-F281 AromaticContact CD2-CD2 3.76Å; F277-F281 HydrophobicContact CD2-CD2 3.76Å; F277-F281 HydrophobicContact CD2-CG 4.18Å; F277-F281 HydrophobicContact CE1-CB 4.47Å; F277-F281 HydrophobicContact CE2-CB 3.85Å; F277-F281 AromaticContact CE2-CD2 3.95Å; F277-F281 HydrophobicContact CE2-CD2 3.95Å; F277-F281 AromaticContact CE2-CG 3.89Å; F277-F281 HydrophobicContact CE2-CG 3.89Å; F277-F281 HydrophobicContact CZ-CB 3.93Å; F277-F281 HydrophobicContact CZ-CG 4.45Å; F277-F281 WeakPolarHBondContact O-CB 3.41Å; F277-F281 PolarHBondContact O-N 2.83Å; F281-S285 WeakPolarHBondContact O-CB 3.28Å |
| 282 | E | 81.1 | Confident | 85.2 | Confident | 15 Ų | 15 | 43 Ų | 43 | 7% | 0.07 | 20% | 0.202 | C | C | . | . | I | π-helix | trans | -94 | -33.4 | -175.1 | -65.9 | -70.4 | 178.3 | 0 | 0 | 113 | S174 L175 F277 V278 R286 | S174-E282 WeakPolarHBondContact CB-OE1 3.32Å; S174-E282 PolarHBondContact OG-OE1 3.39Å; L175-E282 HydrophobicContact CB-CG 4.42Å; L175-E282 HydrophobicContact CD1-CB 3.84Å; L175-E282 HydrophobicContact CD1-CG 4.3Å; F277-E282 HydrophobicContact CE1-CG 4Å; V278-E282 HydrophobicContact CG1-CB 4.39Å; V278-E282 WeakPolarHBondContact O-CB 3.42Å; V278-E282 PolarHBondContact O-N 3.3Å; V278-E282 VanDerWaalsContact O-N 3.11Å; E282-R286 WeakPolarHBondContact O-CB 3.31Å |
| 283 | I | 81.9 | Confident | 84.8 | Confident | 16 Ų | 16 | 46.1 Ų | 46.1 | 8% | 0.082 | 22% | 0.219 | C | C | . | . | I | π-helix | trans | -100 | -61.9 | -178.1 | -60.3 | 174.3 | 0 | 0 | 0 | 111 | F55 A216 V278 R286 E287 | F55-I283 HydrophobicContact CD2-CD1 3.32Å; F55-I283 HydrophobicContact CE2-CD1 3.09Å; F55-I283 HydrophobicContact CG-CD1 4.28Å; F55-I283 HydrophobicContact CZ-CD1 3.86Å; A216-I283 HydrophobicContact CB-CD1 4.23Å; V278-I283 HydrophobicContact CG1-CD1 3.97Å; V278-I283 HydrophobicContact CG1-CG1 4.31Å; V278-I283 PolarHBondContact O-N 2.88Å; I283-R286 PolarHBondContact O-N 2.82Å; I283-E287 PolarHBondContact O-N 3.21Å |
| 284 | L | 84.3 | Confident | 84.4 | Confident | 25 Ų | 25 | 53.8 Ų | 53.8 | 13% | 0.131 | 25% | 0.248 | C | C | . | . | I | π-helix | trans | -67.6 | -49.5 | -170.5 | -176.2 | 60.3 | 0 | 0 | 0 | 112.4 | T279 F280 R286 E287 L288 L301 | T279-L284 WeakPolarHBondContact O-CB 2.91Å; T279-L284 PolarHBondContact O-N 2.94Å; F280-L284 HydrophobicContact CD1-CD2 4.09Å; F280-L284 HydrophobicContact CE1-CD2 4.25Å; L284-R286 PolarHBondContact O-N 3.17Å; L284-E287 PolarHBondContact O-N 3.25Å; L284-L288 HydrophobicContact CD1-CD1 3.62Å; L284-L288 HydrophobicContact CD1-CG 3.91Å; L284-L288 HydrophobicContact CD2-CD1 4.5Å; L284-L288 HydrophobicContact CG-CD1 3.81Å; L284-L288 HydrophobicContact CG-CG 4.38Å; L284-L288 WeakPolarHBondContact O-CB 3.5Å; L284-L288 WeakPolarHBondContact O-CG 3.43Å; L284-L288 PolarHBondContact O-N 3.01Å; L284-L301 HydrophobicContact CD1-CD1 3.42Å; L284-L301 VanDerWaalsContact CD1-CD1 3.42Å; L284-L301 HydrophobicContact CD1-CD2 3.76Å; L284-L301 HydrophobicContact CD1-CG 4.26Å |
| 285 | S | 84 | Confident | 84.4 | Confident | 36 Ų | 36 | 61 Ų | 61 | 25% | 0.252 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -53.3 | -44.7 | 177.2 | -174.2 | 0 | 0 | 0 | 0 | 111.2 | F280 F281 E287 L288 E289 | F280-S285 WeakPolarHBondContact O-CB 3.43Å; F280-S285 PolarHBondContact O-N 2.89Å; F281-S285 WeakPolarHBondContact O-CB 3.28Å; S285-E287 PolarHBondContact O-N 3.18Å; S285-L288 PolarHBondContact O-N 3.37Å; S285-E289 VanDerWaalsContact O-CB 3.27Å; S285-E289 WeakPolarHBondContact O-CB 3.32Å; S285-E289 PolarHBondContact O-N 2.91Å |
| 286 | R | 75.5 | Confident | 84.4 | Confident | 64 Ų | 64 | 63.7 Ų | 63.7 | 24% | 0.242 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -63.1 | -44.1 | -178.8 | -173.8 | 179.4 | -176.3 | 177.5 | 2.2 | 113.5 | S220 E282 I283 L284 | S220-R286 PolarHBondContact OG-NH1 3.48Å; S220-R286 VanDerWaalsContact OG-NH1 3.1Å; E282-R286 WeakPolarHBondContact O-CB 3.31Å; I283-R286 PolarHBondContact O-N 2.82Å; L284-R286 PolarHBondContact O-N 3.17Å |
| 287 | E | 79.1 | Confident | 84.3 | Confident | 8 Ų | 8 | 63.1 Ų | 63.1 | 4% | 0.037 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -75.7 | -31.5 | -177.4 | -63.1 | -60 | 150.1 | 0 | 0 | 111.9 | N48 K223 I283 L284 S285 K297 | N48-E287 HydrophobicContact CB-CG 3.75Å; N48-E287 WeakPolarHBondContact CB-OE1 3.45Å; N48-E287 PolarHBondContact ND2-OE1 3.32Å; K223-E287 IonicContact NZ-OE1 2.74Å; K223-E287 PolarHBondContact NZ-OE1 2.94Å; K223-E287 IonicContact NZ-OE2 2.71Å; K223-E287 PolarHBondContact NZ-OE2 3.23Å; I283-E287 PolarHBondContact O-N 3.21Å; L284-E287 PolarHBondContact O-N 3.25Å; S285-E287 PolarHBondContact O-N 3.18Å; E287-K297 VanDerWaalsContact O-CD 3.31Å; E287-K297 WeakPolarHBondContact O-CD 3.46Å; E287-K297 PolarHBondContact O-NZ 3.35Å |
| 288 | L | 81.4 | Confident | 84.4 | Confident | 62 Ų | 62 | 65.8 Ų | 65.8 | 33% | 0.325 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -81.7 | -22.5 | 178.1 | -65.5 | -177.4 | 0 | 0 | 0 | 114.2 | L284 S285 D290 V298 | L284-L288 HydrophobicContact CD1-CD1 3.62Å; L284-L288 HydrophobicContact CD1-CG 3.91Å; L284-L288 HydrophobicContact CD2-CD1 4.5Å; L284-L288 HydrophobicContact CG-CD1 3.81Å; L284-L288 HydrophobicContact CG-CG 4.38Å; L284-L288 WeakPolarHBondContact O-CB 3.5Å; L284-L288 WeakPolarHBondContact O-CG 3.43Å; L284-L288 PolarHBondContact O-N 3.01Å; S285-L288 PolarHBondContact O-N 3.37Å; L288-D290 VanDerWaalsContact C-N 3.3Å; L288-V298 HydrophobicContact CD2-CG2 3.98Å |
| 289 | E | 80.1 | Confident | 84.8 | Confident | 106 Ų | 106 | 70.6 Ų | 70.6 | 50% | 0.495 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -65.7 | -32.6 | 174.3 | -173.2 | 176 | -165.2 | 0 | 0 | 111.7 | R171 S285 K291 | R171-E289 IonicContact CZ-OE2 2.79Å; R171-E289 IonicContact NH1-OE2 3.14Å; R171-E289 PolarHBondContact NH1-OE2 3.4Å; R171-E289 IonicContact NH2-OE2 3.26Å; S285-E289 VanDerWaalsContact O-CB 3.27Å; S285-E289 WeakPolarHBondContact O-CB 3.32Å; S285-E289 PolarHBondContact O-N 2.91Å; E289-K291 PolarHBondContact O-N 2.92Å |
| 290 | D | 74.4 | Confident | 85 | Confident | 67 Ų | 67 | 73.6 Ų | 73.6 | 36% | 0.358 | 35% | 0.351 | S | S | . | . | S | Bend | trans | -73.1 | 119.9 | 176.9 | 167.6 | 26.4 | 0 | 0 | 0 | 112 | L288 H292 K297 | L288-D290 VanDerWaalsContact C-N 3.3Å; D290-H292 PolarHBondContact O-N 2.99Å; D290-H292 IonicContact OD1-CG 3.99Å; D290-H292 PolarHBondContact OD1-N 3.4Å; D290-H292 VanDerWaalsContact OD1-N 3.16Å; D290-H292 IonicContact OD1-ND1 3.18Å; D290-H292 PolarHBondContact OD1-ND1 2.95Å; D290-H292 VanDerWaalsContact OD1-ND1 3.14Å; D290-K297 PolarHBondContact O-NZ 3.47Å; D290-K297 IonicContact OD2-NZ 3Å; D290-K297 PolarHBondContact OD2-NZ 3.35Å |
| 291 | K | 77.8 | Confident | 85.2 | Confident | 180 Ų | 180 | 71 Ų | 71 | 78% | 0.783 | 34% | 0.341 | S | S | * | . | trans | -69.6 | -12.1 | -171.3 | -60.1 | -177.2 | -177.7 | -178.5 | 0 | 114.5 | E289 R294 | E289-K291 PolarHBondContact O-N 2.92Å; K291-R294 WeakPolarHBondContact O-CG 3.31Å | ||
| 292 | H | 79.1 | Confident | 85.8 | Confident | 135 Ų | 135 | 72 Ų | 72 | 63% | 0.625 | 35% | 0.349 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.2 | 137 | 178.4 | -65.9 | 82.1 | 0 | 0 | 0 | 112.1 | D290 R294 K297 | D290-H292 PolarHBondContact O-N 2.99Å; D290-H292 IonicContact OD1-CG 3.99Å; D290-H292 PolarHBondContact OD1-N 3.4Å; D290-H292 VanDerWaalsContact OD1-N 3.16Å; D290-H292 IonicContact OD1-ND1 3.18Å; D290-H292 PolarHBondContact OD1-ND1 2.95Å; D290-H292 VanDerWaalsContact OD1-ND1 3.14Å; H292-R294 VanDerWaalsContact C-N 3.26Å; H292-R294 PolarHBondContact O-N 2.92Å; H292-R294 VanDerWaalsContact O-N 3.14Å; H292-K297 WeakPolarHBondContact O-CE 3.39Å; H292-K297 PolarHBondContact O-NZ 2.82Å |
| 293 | D | 85.9 | Confident | 86.5 | Confident | 68 Ų | 68 | 75.7 Ų | 75.7 | 36% | 0.364 | 37% | 0.369 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 53.8 | 33.2 | 171.4 | -63.8 | -53.9 | 0 | 0 | 0 | 115.1 | K42 L295 L296 K297 | K42-D293 WeakPolarHBondContact CD-OD2 3.31Å; K42-D293 WeakPolarHBondContact CE-OD2 3.39Å; K42-D293 IonicContact NZ-OD1 3.83Å; K42-D293 PolarHBondContact NZ-OD1 3.49Å; K42-D293 IonicContact NZ-OD2 2.9Å; K42-D293 PolarHBondContact NZ-OD2 3.02Å; D293-L295 PolarHBondContact O-N 3.44Å; D293-L296 HydrophobicContact CB-CB 4.2Å; D293-L296 WeakPolarHBondContact O-CA 3.28Å; D293-L296 WeakPolarHBondContact O-CB 3.36Å; D293-L296 PolarHBondContact O-N 2.92Å; D293-K297 PolarHBondContact O-N 3.29Å |
| 294 | R | 88.3 | Confident | 87 | Confident | 161 Ų | 161 | 75 Ų | 75 | 61% | 0.608 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -50.2 | -48.3 | -171.5 | -63.8 | 178.6 | 75 | -159.6 | 2.3 | 114.2 | K291 H292 L296 K297 V298 | K291-R294 WeakPolarHBondContact O-CG 3.31Å; H292-R294 VanDerWaalsContact C-N 3.26Å; H292-R294 PolarHBondContact O-N 2.92Å; H292-R294 VanDerWaalsContact O-N 3.14Å; R294-L296 VanDerWaalsContact C-N 3.33Å; R294-L296 PolarHBondContact O-N 2.76Å; R294-K297 PolarHBondContact O-N 3.27Å; R294-V298 WeakPolarHBondContact O-CG2 3.44Å; R294-V298 PolarHBondContact O-N 3.09Å |
| 295 | L | 92.4 | Very high | 87.5 | Confident | 151 Ų | 151 | 77.6 Ų | 77.6 | 79% | 0.791 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -67.2 | -35 | -180 | -65.4 | -179.1 | 0 | 0 | 0 | 112.3 | D293 V298 L299 | D293-L295 PolarHBondContact O-N 3.44Å; L295-V298 PolarHBondContact O-N 3.11Å; L295-L299 PolarHBondContact O-N 3.46Å |
| 296 | L | 91.9 | Very high | 88 | Confident | 59 Ų | 59 | 77.7 Ų | 77.7 | 31% | 0.309 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -69.5 | -38.5 | 177.6 | -168.6 | 64.4 | 0 | 0 | 0 | 110.8 | L46 D293 R294 L299 F300 | L46-L296 HydrophobicContact CD1-CD2 3.77Å; L46-L296 HydrophobicContact CD1-CG 4.32Å; L46-L296 HydrophobicContact CD2-CB 4.19Å; L46-L296 HydrophobicContact CD2-CD2 3.81Å; L46-L296 HydrophobicContact CD2-CG 3.66Å; L46-L296 HydrophobicContact CG-CD2 4.42Å; D293-L296 HydrophobicContact CB-CB 4.2Å; D293-L296 WeakPolarHBondContact O-CA 3.28Å; D293-L296 WeakPolarHBondContact O-CB 3.36Å; D293-L296 PolarHBondContact O-N 2.92Å; R294-L296 VanDerWaalsContact C-N 3.33Å; R294-L296 PolarHBondContact O-N 2.76Å; L296-L299 HydrophobicContact CD1-CD2 4.24Å; L296-L299 WeakPolarHBondContact O-CB 3.38Å; L296-L299 PolarHBondContact O-N 3.12Å; L296-F300 HydrophobicContact CD1-CD2 4.24Å; L296-F300 HydrophobicContact CD1-CE2 3.97Å; L296-F300 HydrophobicContact CG-CD2 4.21Å; L296-F300 HydrophobicContact CG-CE2 4.15Å; L296-F300 VanDerWaalsContact O-CD2 3.29Å; L296-F300 WeakPolarHBondContact O-CD2 3.41Å; L296-F300 PolarHBondContact O-N 3.37Å |
| 297 | K | 91.4 | Very high | 88.7 | Confident | 3 Ų | 3 | 78.4 Ų | 78.4 | 1% | 0.013 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -60.2 | -45.7 | 172 | -68.4 | 179.7 | 179.4 | 174.5 | 0 | 111.7 | L46 S49 E287 D290 H292 D293 R294 L299 F300 L301 | L46-K297 HydrophobicContact CD2-CG 4.27Å; S49-K297 WeakPolarHBondContact CB-O 3.38Å; S49-K297 WeakPolarHBondContact OG-CB 3.29Å; S49-K297 WeakPolarHBondContact OG-CG 3.31Å; E287-K297 VanDerWaalsContact O-CD 3.31Å; E287-K297 WeakPolarHBondContact O-CD 3.46Å; E287-K297 PolarHBondContact O-NZ 3.35Å; D290-K297 PolarHBondContact O-NZ 3.47Å; D290-K297 IonicContact OD2-NZ 3Å; D290-K297 PolarHBondContact OD2-NZ 3.35Å; H292-K297 WeakPolarHBondContact O-CE 3.39Å; H292-K297 PolarHBondContact O-NZ 2.82Å; D293-K297 PolarHBondContact O-N 3.29Å; R294-K297 PolarHBondContact O-N 3.27Å; K297-L299 VanDerWaalsContact C-N 3.33Å; K297-L299 PolarHBondContact O-N 3.41Å; K297-F300 PolarHBondContact O-N 3.32Å; K297-L301 WeakPolarHBondContact O-CB 3.28Å; K297-L301 PolarHBondContact O-N 2.89Å |
| 298 | V | 93.6 | Very high | 89.1 | Confident | 57 Ų | 57 | 78.9 Ų | 78.9 | 35% | 0.345 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -62.3 | -39.5 | 175.6 | 174.3 | 0 | 0 | 0 | 0 | 111.5 | L288 R294 L295 L301 I302 | L288-V298 HydrophobicContact CD2-CG2 3.98Å; R294-V298 WeakPolarHBondContact O-CG2 3.44Å; R294-V298 PolarHBondContact O-N 3.09Å; L295-V298 PolarHBondContact O-N 3.11Å; V298-L301 WeakPolarHBondContact O-CB 3.27Å; V298-L301 PolarHBondContact O-N 3.47Å; V298-I302 HydrophobicContact CG1-CD1 4Å; V298-I302 WeakPolarHBondContact O-CG1 3.27Å; V298-I302 PolarHBondContact O-N 3.11Å |
| 299 | L | 95.3 | Very high | 89.5 | Confident | 102 Ų | 102 | 77.1 Ų | 77.1 | 53% | 0.534 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -60.9 | -46.1 | 174.3 | -179.8 | 67.2 | 0 | 0 | 0 | 111.7 | L295 L296 K297 L301 I302 L303 | L295-L299 PolarHBondContact O-N 3.46Å; L296-L299 HydrophobicContact CD1-CD2 4.24Å; L296-L299 WeakPolarHBondContact O-CB 3.38Å; L296-L299 PolarHBondContact O-N 3.12Å; K297-L299 VanDerWaalsContact C-N 3.33Å; K297-L299 PolarHBondContact O-N 3.41Å; L299-L301 VanDerWaalsContact C-N 3.32Å; L299-L301 PolarHBondContact O-N 3.45Å; L299-I302 PolarHBondContact O-N 3.34Å; L299-L303 WeakPolarHBondContact O-CB 3.38Å; L299-L303 PolarHBondContact O-N 2.98Å |
| 300 | F | 94 | Very high | 89.9 | Confident | 63 Ų | 63 | 73.8 Ų | 73.8 | 28% | 0.276 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -65.4 | -36.3 | 177.5 | -88.7 | -110.5 | 0 | 0 | 0 | 111.9 | L46 F50 L296 K297 L303 G304 | L46-F300 HydrophobicContact CB-CD1 3.84Å; L46-F300 HydrophobicContact CB-CD2 4.48Å; L46-F300 HydrophobicContact CB-CE1 3.95Å; L46-F300 HydrophobicContact CB-CG 4.13Å; L46-F300 HydrophobicContact CB-CZ 4.3Å; L46-F300 HydrophobicContact CD1-CE2 4.13Å; L46-F300 HydrophobicContact CD1-CZ 4.08Å; L46-F300 HydrophobicContact CD2-CD2 4.01Å; L46-F300 HydrophobicContact CD2-CE2 4.31Å; L46-F300 HydrophobicContact CD2-CG 4.25Å; L46-F300 WeakPolarHBondContact O-CD1 3.13Å; F50-F300 VanDerWaalsContact CA-O 3.3Å; F50-F300 WeakPolarHBondContact CA-O 3.31Å; F50-F300 HydrophobicContact CB-CB 4.28Å; F50-F300 HydrophobicContact CB-CD1 4.14Å; L296-F300 HydrophobicContact CD1-CD2 4.24Å; L296-F300 HydrophobicContact CD1-CE2 3.97Å; L296-F300 HydrophobicContact CG-CD2 4.21Å; L296-F300 HydrophobicContact CG-CE2 4.15Å; L296-F300 VanDerWaalsContact O-CD2 3.29Å; L296-F300 WeakPolarHBondContact O-CD2 3.41Å; L296-F300 PolarHBondContact O-N 3.37Å; K297-F300 PolarHBondContact O-N 3.32Å; F300-L303 PolarHBondContact O-N 3.31Å; F300-G304 PolarHBondContact O-N 3.29Å |
| 301 | L | 94.3 | Very high | 90.4 | Very high | 24 Ų | 24 | 74.6 Ų | 74.6 | 13% | 0.126 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -58.2 | -51.3 | 171.6 | -175.9 | 81.5 | 0 | 0 | 0 | 111.5 | S49 G53 L284 K297 V298 L299 L303 G304 Y305 | S49-L301 VanDerWaalsContact O-CA 3.3Å; S49-L301 WeakPolarHBondContact O-CA 3.27Å; S49-L301 WeakPolarHBondContact O-CD1 3.15Å; G53-L301 VanDerWaalsContact CA-O 3.24Å; G53-L301 WeakPolarHBondContact CA-O 3.48Å; G53-L301 VanDerWaalsContact N-CD1 3.29Å; L284-L301 HydrophobicContact CD1-CD1 3.42Å; L284-L301 VanDerWaalsContact CD1-CD1 3.42Å; L284-L301 HydrophobicContact CD1-CD2 3.76Å; L284-L301 HydrophobicContact CD1-CG 4.26Å; K297-L301 WeakPolarHBondContact O-CB 3.28Å; K297-L301 PolarHBondContact O-N 2.89Å; V298-L301 WeakPolarHBondContact O-CB 3.27Å; V298-L301 PolarHBondContact O-N 3.47Å; L299-L301 VanDerWaalsContact C-N 3.32Å; L299-L301 PolarHBondContact O-N 3.45Å; L301-L303 VanDerWaalsContact C-N 3.31Å; L301-L303 PolarHBondContact O-N 2.91Å; L301-G304 PolarHBondContact O-N 2.98Å; L301-Y305 PolarHBondContact O-N 2.94Å |
| 302 | I | 96.3 | Very high | 90.5 | Very high | 111 Ų | 111 | 70.8 Ų | 70.8 | 57% | 0.569 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -61.9 | -42.1 | 177.8 | -66.3 | 165.9 | 0 | 0 | 0 | 110.5 | V298 L299 Y305 G306 | V298-I302 HydrophobicContact CG1-CD1 4Å; V298-I302 WeakPolarHBondContact O-CG1 3.27Å; V298-I302 PolarHBondContact O-N 3.11Å; L299-I302 PolarHBondContact O-N 3.34Å; I302-Y305 PolarHBondContact O-N 3.34Å; I302-G306 PolarHBondContact O-N 3Å |
| 303 | L | 95.6 | Very high | 90.7 | Very high | 92 Ų | 92 | 72.8 Ų | 72.8 | 48% | 0.482 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -61.6 | -44.6 | 177.3 | -174.3 | 69.4 | 0 | 0 | 0 | 111.5 | F50 L299 F300 L301 G306 V307 | F50-L303 HydrophobicContact CD2-CB 4.34Å; F50-L303 HydrophobicContact CD2-CD2 4.27Å; F50-L303 HydrophobicContact CD2-CG 4.26Å; F50-L303 HydrophobicContact CE2-CD2 4.25Å; F50-L303 HydrophobicContact CE2-CG 4.05Å; L299-L303 WeakPolarHBondContact O-CB 3.38Å; L299-L303 PolarHBondContact O-N 2.98Å; F300-L303 PolarHBondContact O-N 3.31Å; L301-L303 VanDerWaalsContact C-N 3.31Å; L301-L303 PolarHBondContact O-N 2.91Å; L303-G306 PolarHBondContact O-N 2.89Å; L303-V307 HydrophobicContact CG-CG2 4.48Å; L303-V307 VanDerWaalsContact O-CG2 3.3Å; L303-V307 WeakPolarHBondContact O-CG2 3.46Å; L303-V307 PolarHBondContact O-N 3.38Å |
| 304 | G | 92.6 | Very high | 90.5 | Very high | 0 Ų | 0 | 74.2 Ų | 74.2 | 0% | 0 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -60.9 | -45.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | V54 F300 L301 V307 L308 | V54-G304 WeakPolarHBondContact CG2-O 3.39Å; F300-G304 PolarHBondContact O-N 3.29Å; L301-G304 PolarHBondContact O-N 2.98Å; G304-V307 PolarHBondContact O-N 3.43Å; G304-L308 PolarHBondContact O-N 3.36Å |
| 305 | Y | 94.3 | Very high | 88.9 | Confident | 80 Ų | 80 | 76.3 Ų | 76.3 | 31% | 0.314 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -59.4 | -49.1 | 173.6 | -178.7 | -84.6 | 0 | 0 | 0 | 111.1 | G53 L56 A57 N61 L301 I302 V307 L308 A309 | G53-Y305 VanDerWaalsContact C-N 3.31Å; G53-Y305 VanDerWaalsContact O-CA 3.25Å; G53-Y305 WeakPolarHBondContact O-CA 3.34Å; G53-Y305 PolarHBondContact O-N 3.36Å; L56-Y305 HydrophobicContact CB-CD2 4.09Å; L56-Y305 HydrophobicContact CD2-CD2 4.07Å; L56-Y305 HydrophobicContact CG-CD2 4.06Å; L56-Y305 HydrophobicContact CG-CE2 4.34Å; A57-Y305 HydrophobicContact CB-CD2 3.54Å; A57-Y305 HydrophobicContact CB-CE2 3.79Å; A57-Y305 HydrophobicContact CB-CG 4.06Å; N61-Y305 PolarHBondContact ND2-OH 2.97Å; N61-Y305 VanDerWaalsContact ND2-OH 3.14Å; N61-Y305 PolarHBondContact OD1-OH 3.47Å; L301-Y305 PolarHBondContact O-N 2.94Å; I302-Y305 PolarHBondContact O-N 3.34Å; Y305-V307 PolarHBondContact O-N 2.89Å; Y305-L308 PolarHBondContact O-N 2.91Å; Y305-A309 HydrophobicContact CD1-CB 4.39Å; Y305-A309 HydrophobicContact CE1-CB 4.12Å; Y305-A309 VanDerWaalsContact O-CB 3.24Å; Y305-A309 WeakPolarHBondContact O-CB 3.43Å; Y305-A309 PolarHBondContact O-N 2.9Å |
| 306 | G | 94.3 | Very high | 87 | Confident | 39 Ų | 39 | 82.5 Ų | 82.5 | 40% | 0.402 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -62.3 | -39.8 | -178.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | I302 L303 G310 | I302-G306 PolarHBondContact O-N 3Å; L303-G306 PolarHBondContact O-N 2.89Å; G306-G310 PolarHBondContact O-N 3.39Å |
| 307 | V | 91.1 | Very high | 86.8 | Confident | 79 Ų | 79 | 83.7 Ų | 83.7 | 48% | 0.479 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -62.7 | -49.1 | 176.9 | 167.4 | 0 | 0 | 0 | 0 | 110.8 | F50 L303 G304 Y305 G310 L311 | F50-V307 HydrophobicContact CE2-CB 4.44Å; F50-V307 HydrophobicContact CE2-CG2 4.13Å; F50-V307 HydrophobicContact CZ-CB 4.2Å; F50-V307 HydrophobicContact CZ-CG1 4.32Å; F50-V307 HydrophobicContact CZ-CG2 4.24Å; L303-V307 HydrophobicContact CG-CG2 4.48Å; L303-V307 VanDerWaalsContact O-CG2 3.3Å; L303-V307 WeakPolarHBondContact O-CG2 3.46Å; L303-V307 PolarHBondContact O-N 3.38Å; G304-V307 PolarHBondContact O-N 3.43Å; Y305-V307 PolarHBondContact O-N 2.89Å; V307-G310 PolarHBondContact O-N 3.38Å; V307-L311 WeakPolarHBondContact O-CB 3.23Å; V307-L311 PolarHBondContact O-N 3.47Å |
| 308 | L | 87.8 | Confident | 86.5 | Confident | 17 Ų | 17 | 87.9 Ų | 87.9 | 9% | 0.089 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -69.8 | -39.5 | 179.9 | -171 | 70.8 | 0 | 0 | 0 | 111.6 | V54 A57 T58 G304 Y305 G310 L311 M312 | V54-L308 HydrophobicContact CG1-CB 4.21Å; V54-L308 HydrophobicContact CG1-CD1 4.4Å; V54-L308 HydrophobicContact CG1-CD2 3.87Å; V54-L308 HydrophobicContact CG1-CG 4.38Å; V54-L308 WeakPolarHBondContact O-CD2 3.33Å; A57-L308 HydrophobicContact CB-CB 3.78Å; A57-L308 HydrophobicContact CB-CD2 3.7Å; A57-L308 HydrophobicContact CB-CG 4.11Å; T58-L308 WeakPolarHBondContact OG1-CD2 3.26Å; G304-L308 PolarHBondContact O-N 3.36Å; Y305-L308 PolarHBondContact O-N 2.91Å; L308-G310 VanDerWaalsContact C-N 3.32Å; L308-G310 PolarHBondContact O-N 3.26Å; L308-L311 HydrophobicContact CD1-CD2 4.3Å; L308-L311 PolarHBondContact O-N 3.45Å; L308-M312 HydrophobicContact CG-CG 4.49Å; L308-M312 VanDerWaalsContact O-CG 3.29Å; L308-M312 WeakPolarHBondContact O-CG 3.19Å; L308-M312 PolarHBondContact O-N 3.17Å |
| 309 | A | 89.9 | Confident | 86.1 | Confident | 26 Ų | 26 | 89.6 Ų | 89.6 | 22% | 0.215 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -59.9 | -42.9 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | N61 Y305 M312 F313 | N61-A309 WeakPolarHBondContact ND2-CB 3.37Å; Y305-A309 HydrophobicContact CD1-CB 4.39Å; Y305-A309 HydrophobicContact CE1-CB 4.12Å; Y305-A309 VanDerWaalsContact O-CB 3.24Å; Y305-A309 WeakPolarHBondContact O-CB 3.43Å; Y305-A309 PolarHBondContact O-N 2.9Å; A309-M312 PolarHBondContact O-N 3.49Å; A309-F313 PolarHBondContact O-N 3.4Å |
| 310 | G | 88.6 | Confident | 85.6 | Confident | 35 Ų | 35 | 88.9 Ų | 88.9 | 36% | 0.361 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -64.8 | -40.2 | 175 | 0 | 0 | 0 | 0 | 0 | 112.7 | G306 V307 L308 F313 I314 | G306-G310 PolarHBondContact O-N 3.39Å; V307-G310 PolarHBondContact O-N 3.38Å; L308-G310 VanDerWaalsContact C-N 3.32Å; L308-G310 PolarHBondContact O-N 3.26Å; G310-F313 WeakPolarHBondContact O-CB 3.42Å; G310-F313 PolarHBondContact O-N 3.36Å; G310-I314 PolarHBondContact O-N 3.41Å |
| 311 | L | 83.8 | Confident | 85.1 | Confident | 85 Ų | 85 | 90.5 Ų | 90.5 | 45% | 0.445 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -62 | -43.3 | 175.2 | -173.3 | 68.7 | 0 | 0 | 0 | 111.6 | V307 L308 F313 I314 | V307-L311 WeakPolarHBondContact O-CB 3.23Å; V307-L311 PolarHBondContact O-N 3.47Å; L308-L311 HydrophobicContact CD1-CD2 4.3Å; L308-L311 PolarHBondContact O-N 3.45Å; L311-F313 VanDerWaalsContact C-N 3.28Å; L311-F313 PolarHBondContact O-N 3.46Å; L311-I314 PolarHBondContact O-N 3.02Å |
| 312 | M | 79.6 | Confident | 84.4 | Confident | 99 Ų | 99 | 94.9 Ų | 94.9 | 49% | 0.488 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -69.3 | -24.7 | 177.8 | -67.9 | -70.5 | -75.8 | 0 | 0 | 113 | N61 A62 L308 A309 | N61-M312 WeakPolarHBondContact O-CE 3.49Å; A62-M312 HydrophobicContact CB-CE 3.64Å; L308-M312 HydrophobicContact CG-CG 4.49Å; L308-M312 VanDerWaalsContact O-CG 3.29Å; L308-M312 WeakPolarHBondContact O-CG 3.19Å; L308-M312 PolarHBondContact O-N 3.17Å; A309-M312 PolarHBondContact O-N 3.49Å |
| 313 | F | 83.1 | Confident | 83.6 | Confident | 178 Ų | 178 | 93.8 Ų | 93.8 | 78% | 0.781 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -72.2 | -31 | 175.7 | -175.7 | -98.4 | 0 | 0 | 0 | 112.5 | A309 G310 L311 K315 | A309-F313 PolarHBondContact O-N 3.4Å; G310-F313 WeakPolarHBondContact O-CB 3.42Å; G310-F313 PolarHBondContact O-N 3.36Å; L311-F313 VanDerWaalsContact C-N 3.28Å; L311-F313 PolarHBondContact O-N 3.46Å; F313-K315 PolarHBondContact O-N 3.42Å; F313-K315 VanDerWaalsContact O-N 3.13Å |
| 314 | I | 82.5 | Confident | 82.7 | Confident | 98 Ų | 98 | 93.9 Ų | 93.9 | 50% | 0.503 | 46% | 0.464 | S | S | . | . | S | Bend | trans | -77.3 | 101.4 | 177.7 | -60.5 | 167.7 | 0 | 0 | 0 | 107.7 | G310 L311 W316 | G310-I314 PolarHBondContact O-N 3.41Å; L311-I314 PolarHBondContact O-N 3.02Å; I314-W316 PolarHBondContact O-N 3.12Å |
| 315 | K | 55.3 | Low | 81.8 | Confident | 204 Ų | 204 | 101.8 Ų | 101.8 | 89% | 0.887 | 50% | 0.502 | S | S | * | . | trans | -64 | 118.2 | 173.6 | -74.2 | -175.8 | 172.7 | -179.4 | 0 | 109.6 | F313 | F313-K315 PolarHBondContact O-N 3.42Å; F313-K315 VanDerWaalsContact O-N 3.13Å | ||
| 316 | W | 51.7 | Low | 80.7 | Confident | 281 Ų | 281 | 103.7 Ų | 103.7 | 100% | 1.064 | 52% | 0.519 | S | S | * | . | trans | -98.2 | 0 | 166.5 | -65.8 | 84.4 | 0 | 0 | 0 | 109.8 | I314 | I314-W316 PolarHBondContact O-N 3.12Š|
Retrieved 316 of 316 residues in 1804.6 ms
(Link to these results)