| 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 | I | 85.1 | Confident | 92.8 | Very high | 136 Ų | 136 | 76.5 Ų | 76.5 | 70% | 0.697 | 43% | 0.425 | S | S | * | . | 0 | -55.8 | 0 | -61.6 | 172 | 0 | 0 | 0 | 110.9 | A3 L4 V5 L56 | I1-A3 PolarHBondContact O-N 3.03Å; I1-L4 PolarHBondContact O-N 3.34Å; I1-L4 VanDerWaalsContact O-N 3.15Å; I1-V5 HydrophobicContact CG2-CG2 4.04Å; I1-V5 PolarHBondContact O-N 3.13Å; I1-L56 HydrophobicContact CG2-CD1 4.25Å | |||
| 2 | A | 90.1 | Very high | 93.1 | Very high | 39 Ų | 39 | 70.2 Ų | 70.2 | 32% | 0.322 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -46.2 | -59.8 | 179.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | L4 V5 S6 L60 | A2-L4 VanDerWaalsContact C-N 3.29Å; A2-L4 PolarHBondContact O-N 3.35Å; A2-V5 PolarHBondContact O-N 3.49Å; A2-S6 WeakPolarHBondContact O-CB 3.25Å; A2-S6 PolarHBondContact O-N 2.86Å; A2-S6 PolarHBondContact O-OG 3.42Å; A2-L60 HydrophobicContact CB-CD1 4.01Å; A2-L60 HydrophobicContact CB-CD2 4.23Å |
| 3 | A | 93.3 | Very high | 93.3 | Very high | 83 Ų | 83 | 66.9 Ų | 66.9 | 69% | 0.686 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -57.8 | -39 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | I1 F7 | I1-A3 PolarHBondContact O-N 3.03Å; A3-F7 WeakPolarHBondContact O-CB 3.46Å; A3-F7 PolarHBondContact O-N 3.17Å |
| 4 | L | 92.6 | Very high | 93.5 | Very high | 126 Ų | 126 | 67.4 Ų | 67.4 | 66% | 0.66 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -67.6 | -45 | 179.5 | -179.3 | 145.6 | 0 | 0 | 0 | 111.5 | I1 A2 F7 L8 | I1-L4 PolarHBondContact O-N 3.34Å; I1-L4 VanDerWaalsContact O-N 3.15Å; A2-L4 VanDerWaalsContact C-N 3.29Å; A2-L4 PolarHBondContact O-N 3.35Å; L4-F7 PolarHBondContact O-N 3.28Å; L4-L8 PolarHBondContact O-N 3.09Å |
| 5 | V | 91.8 | Very high | 93.6 | Very high | 4 Ų | 4 | 63.5 Ų | 63.5 | 2% | 0.024 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -69.4 | -41.1 | 178.4 | 173.9 | 0 | 0 | 0 | 0 | 111 | I1 A2 F7 L8 I9 L56 W284 | I1-V5 HydrophobicContact CG2-CG2 4.04Å; I1-V5 PolarHBondContact O-N 3.13Å; A2-V5 PolarHBondContact O-N 3.49Å; V5-F7 VanDerWaalsContact C-N 3.3Å; V5-F7 PolarHBondContact O-N 3.15Å; V5-L8 WeakPolarHBondContact O-CB 3.46Å; V5-L8 PolarHBondContact O-N 3.17Å; V5-L8 VanDerWaalsContact O-N 3.13Å; V5-I9 HydrophobicContact CG1-CD1 3.89Å; V5-I9 HydrophobicContact CG1-CG1 4.37Å; V5-I9 VanDerWaalsContact O-CG1 3.32Å; V5-I9 WeakPolarHBondContact O-CG1 3.34Å; V5-I9 PolarHBondContact O-N 3.11Å; V5-L56 HydrophobicContact CB-CD1 3.99Å; V5-L56 HydrophobicContact CB-CD2 4.06Å; V5-L56 HydrophobicContact CG1-CB 4.08Å; V5-L56 HydrophobicContact CG1-CD1 4.11Å; V5-L56 HydrophobicContact CG1-CD2 3.84Å; V5-L56 HydrophobicContact CG1-CG 4.22Å; V5-L56 HydrophobicContact CG2-CD1 4.18Å; V5-W284 HydrophobicContact CB-CH2 4.26Å; V5-W284 HydrophobicContact CB-CZ3 4.28Å; V5-W284 HydrophobicContact CG1-CE3 4.48Å; V5-W284 HydrophobicContact CG1-CH2 3.36Å; V5-W284 HydrophobicContact CG1-CZ2 4.34Å; V5-W284 HydrophobicContact CG1-CZ3 3.43Å; V5-W284 VanDerWaalsContact CG1-CZ3 3.43Å; V5-W284 HydrophobicContact CG2-CE3 4.16Å; V5-W284 HydrophobicContact CG2-CH2 3.86Å; V5-W284 HydrophobicContact CG2-CZ2 4.19Å; V5-W284 HydrophobicContact CG2-CZ3 3.83Å |
| 6 | S | 93 | Very high | 93.7 | Very high | 62 Ų | 62 | 59.6 Ų | 59.6 | 43% | 0.434 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -60.8 | -40.3 | 174.7 | -60.4 | 0 | 0 | 0 | 0 | 111.9 | A2 I9 L10 | A2-S6 WeakPolarHBondContact O-CB 3.25Å; A2-S6 PolarHBondContact O-N 2.86Å; A2-S6 PolarHBondContact O-OG 3.42Å; S6-I9 PolarHBondContact O-N 3.41Å; S6-L10 PolarHBondContact O-N 3.44Å |
| 7 | F | 94.6 | Very high | 93.9 | Very high | 140 Ų | 140 | 60.3 Ų | 60.3 | 61% | 0.614 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -62.2 | -45 | 172 | 174.1 | -97.5 | 0 | 0 | 0 | 111.7 | A3 L4 V5 I9 L10 F11 | A3-F7 WeakPolarHBondContact O-CB 3.46Å; A3-F7 PolarHBondContact O-N 3.17Å; L4-F7 PolarHBondContact O-N 3.28Å; V5-F7 VanDerWaalsContact C-N 3.3Å; V5-F7 PolarHBondContact O-N 3.15Å; F7-I9 VanDerWaalsContact C-N 3.34Å; F7-I9 PolarHBondContact O-N 2.92Å; F7-L10 PolarHBondContact O-N 2.93Å; F7-F11 VanDerWaalsContact O-CB 3.3Å; F7-F11 WeakPolarHBondContact O-CB 3.44Å; F7-F11 PolarHBondContact O-N 3.24Å |
| 8 | L | 94.1 | Very high | 93.9 | Very high | 21 Ų | 21 | 58.3 Ų | 58.3 | 11% | 0.11 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -59.9 | -43.2 | 177.3 | -174.2 | 71.4 | 0 | 0 | 0 | 111.9 | L4 V5 F11 T12 S291 | L4-L8 PolarHBondContact O-N 3.09Å; V5-L8 WeakPolarHBondContact O-CB 3.46Å; V5-L8 PolarHBondContact O-N 3.17Å; V5-L8 VanDerWaalsContact O-N 3.13Å; L8-F11 PolarHBondContact O-N 3.02Å; L8-T12 WeakPolarHBondContact O-CB 3.48Å; L8-T12 PolarHBondContact O-N 3.09Å; L8-T12 PolarHBondContact O-OG1 2.97Å; L8-S291 WeakPolarHBondContact CD1-OG 3.24Å |
| 9 | I | 95.3 | Very high | 93.9 | Very high | 28 Ų | 28 | 55.3 Ų | 55.3 | 14% | 0.144 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -59.9 | -52.5 | 176.2 | -70.9 | 164.2 | 0 | 0 | 0 | 110 | V5 S6 F7 F11 T12 V13 A48 M52 P53 | V5-I9 HydrophobicContact CG1-CD1 3.89Å; V5-I9 HydrophobicContact CG1-CG1 4.37Å; V5-I9 VanDerWaalsContact O-CG1 3.32Å; V5-I9 WeakPolarHBondContact O-CG1 3.34Å; V5-I9 PolarHBondContact O-N 3.11Å; S6-I9 PolarHBondContact O-N 3.41Å; F7-I9 VanDerWaalsContact C-N 3.34Å; F7-I9 PolarHBondContact O-N 2.92Å; I9-F11 VanDerWaalsContact C-N 3.33Å; I9-F11 PolarHBondContact O-N 3.45Å; I9-T12 PolarHBondContact O-N 2.91Å; I9-V13 HydrophobicContact CG2-CG2 4.49Å; I9-V13 WeakPolarHBondContact O-CG2 3.47Å; I9-V13 PolarHBondContact O-N 3.36Å; I9-A48 HydrophobicContact CG2-CB 4.44Å; I9-A48 WeakPolarHBondContact CG2-O 3.47Å; I9-M52 HydrophobicContact CD1-CB 3.86Å; I9-M52 HydrophobicContact CG1-CB 3.74Å; I9-M52 HydrophobicContact CG1-CG 4.47Å; I9-M52 HydrophobicContact CG1-SD 3.89Å; I9-P53 HydrophobicContact CD1-CG 4.17Å |
| 10 | L | 95.9 | Very high | 93.9 | Very high | 111 Ų | 111 | 54 Ų | 54 | 58% | 0.581 | 30% | 0.303 | S | S | * | . | H | α-helix | trans | -59.2 | -46.1 | 180 | -179.1 | 65.4 | 0 | 0 | 0 | 111.3 | S6 F7 T12 V13 V14 | S6-L10 PolarHBondContact O-N 3.44Å; F7-L10 PolarHBondContact O-N 2.93Å; L10-T12 VanDerWaalsContact C-N 3.33Å; L10-T12 PolarHBondContact O-N 2.89Å; L10-V13 PolarHBondContact O-N 2.89Å; L10-V14 HydrophobicContact CD1-CG2 3.97Å; L10-V14 HydrophobicContact CG-CG2 4.34Å; L10-V14 WeakPolarHBondContact O-CB 3.49Å; L10-V14 VanDerWaalsContact O-CG2 3.3Å; L10-V14 WeakPolarHBondContact O-CG2 3.34Å; L10-V14 PolarHBondContact O-N 3.31Å |
| 11 | F | 95.1 | Very high | 93.9 | Very high | 92 Ų | 92 | 54.5 Ų | 54.5 | 40% | 0.404 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -61.7 | -41.5 | 178.5 | -176.3 | -98.4 | 0 | 0 | 0 | 112 | F7 L8 I9 G15 S291 | F7-F11 VanDerWaalsContact O-CB 3.3Å; F7-F11 WeakPolarHBondContact O-CB 3.44Å; F7-F11 PolarHBondContact O-N 3.24Å; L8-F11 PolarHBondContact O-N 3.02Å; I9-F11 VanDerWaalsContact C-N 3.33Å; I9-F11 PolarHBondContact O-N 3.45Å; F11-G15 PolarHBondContact O-N 3.32Å; F11-S291 WeakPolarHBondContact CE1-O 3.08Å |
| 12 | T | 95.7 | Very high | 94.2 | Very high | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -64.2 | -46.2 | 177.4 | -56.9 | 0 | 0 | 0 | 0 | 111.5 | L8 I9 L10 N16 A48 S291 | L8-T12 WeakPolarHBondContact O-CB 3.48Å; L8-T12 PolarHBondContact O-N 3.09Å; L8-T12 PolarHBondContact O-OG1 2.97Å; I9-T12 PolarHBondContact O-N 2.91Å; L10-T12 VanDerWaalsContact C-N 3.33Å; L10-T12 PolarHBondContact O-N 2.89Å; T12-N16 WeakPolarHBondContact O-CB 3.42Å; T12-N16 PolarHBondContact O-N 2.88Å; T12-N16 VanDerWaalsContact O-N 3.09Å; T12-N16 PolarHBondContact O-ND2 2.99Å; T12-A48 HydrophobicContact CG2-CB 3.76Å; T12-S291 WeakPolarHBondContact OG1-CB 3.3Å |
| 13 | V | 96.8 | Very high | 94.3 | Very high | 28 Ų | 28 | 46.4 Ų | 46.4 | 17% | 0.17 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -64.2 | -53.7 | 179.2 | 172 | 0 | 0 | 0 | 0 | 110.6 | I9 L10 G15 N16 I17 A48 T49 | I9-V13 HydrophobicContact CG2-CG2 4.49Å; I9-V13 WeakPolarHBondContact O-CG2 3.47Å; I9-V13 PolarHBondContact O-N 3.36Å; L10-V13 PolarHBondContact O-N 2.89Å; V13-G15 PolarHBondContact O-N 2.78Å; V13-N16 PolarHBondContact O-N 3.39Å; V13-I17 HydrophobicContact CG1-CD1 3.59Å; V13-I17 HydrophobicContact CG1-CG1 4.43Å; V13-I17 WeakPolarHBondContact O-CB 3.2Å; V13-I17 WeakPolarHBondContact O-CG1 3.34Å; V13-I17 PolarHBondContact O-N 3.27Å; V13-A48 HydrophobicContact CG2-CB 3.74Å; V13-T49 HydrophobicContact CG2-CG2 3.91Å |
| 14 | V | 95.6 | Very high | 94.2 | Very high | 73 Ų | 73 | 47.1 Ų | 47.1 | 44% | 0.442 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -62.3 | -47.3 | -178 | 173.6 | 0 | 0 | 0 | 0 | 110.9 | L10 N16 I17 L18 | L10-V14 HydrophobicContact CD1-CG2 3.97Å; L10-V14 HydrophobicContact CG-CG2 4.34Å; L10-V14 WeakPolarHBondContact O-CB 3.49Å; L10-V14 VanDerWaalsContact O-CG2 3.3Å; L10-V14 WeakPolarHBondContact O-CG2 3.34Å; L10-V14 PolarHBondContact O-N 3.31Å; V14-N16 PolarHBondContact O-N 2.83Å; V14-I17 PolarHBondContact O-N 3.49Å; V14-L18 HydrophobicContact CG1-CD1 4.22Å; V14-L18 WeakPolarHBondContact O-CG 3.42Å; V14-L18 PolarHBondContact O-N 3.48Å |
| 15 | G | 94.8 | Very high | 94 | Very high | 9 Ų | 9 | 45.2 Ų | 45.2 | 9% | 0.093 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -59.8 | -45.6 | -179 | 0 | 0 | 0 | 0 | 0 | 112.6 | F11 V13 L18 V19 | F11-G15 PolarHBondContact O-N 3.32Å; V13-G15 PolarHBondContact O-N 2.78Å; G15-L18 WeakPolarHBondContact O-CB 3.39Å; G15-L18 PolarHBondContact O-N 2.98Å; G15-V19 WeakPolarHBondContact O-CG2 3.4Å; G15-V19 PolarHBondContact O-N 2.96Å; G15-V19 VanDerWaalsContact O-N 3.12Å |
| 16 | N | 95.9 | Very high | 93.8 | Very high | 1 Ų | 1 | 46.4 Ų | 46.4 | 1% | 0.005 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -75.2 | -32.3 | -179.9 | -76 | -65.2 | 0 | 0 | 0 | 112.8 | T12 V13 V14 L18 V19 V20 A41 D44 I45 S290 P294 | T12-N16 WeakPolarHBondContact O-CB 3.42Å; T12-N16 PolarHBondContact O-N 2.88Å; T12-N16 VanDerWaalsContact O-N 3.09Å; T12-N16 PolarHBondContact O-ND2 2.99Å; V13-N16 PolarHBondContact O-N 3.39Å; V14-N16 PolarHBondContact O-N 2.83Å; N16-L18 VanDerWaalsContact C-N 3.31Å; N16-L18 PolarHBondContact O-N 2.94Å; N16-V19 WeakPolarHBondContact O-CB 3.38Å; N16-V19 PolarHBondContact O-N 3.32Å; N16-V20 WeakPolarHBondContact O-CG2 3.35Å; N16-V20 PolarHBondContact O-N 2.83Å; N16-A41 HydrophobicContact CB-CB 4.03Å; N16-D44 WeakPolarHBondContact ND2-CB 3.24Å; N16-I45 HydrophobicContact CB-CD1 3.95Å; N16-I45 HydrophobicContact CB-CG1 3.59Å; N16-S290 PolarHBondContact ND2-O 3.4Å; N16-P294 WeakPolarHBondContact OD1-CG 3.39Å |
| 17 | I | 95.7 | Very high | 93.4 | Very high | 72 Ų | 72 | 54.6 Ų | 54.6 | 37% | 0.369 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -60 | -43.8 | 169.3 | -73.1 | 170.7 | 0 | 0 | 0 | 110.3 | V13 V14 V19 V20 I21 I45 | V13-I17 HydrophobicContact CG1-CD1 3.59Å; V13-I17 HydrophobicContact CG1-CG1 4.43Å; V13-I17 WeakPolarHBondContact O-CB 3.2Å; V13-I17 WeakPolarHBondContact O-CG1 3.34Å; V13-I17 PolarHBondContact O-N 3.27Å; V14-I17 PolarHBondContact O-N 3.49Å; I17-V19 VanDerWaalsContact C-N 3.3Å; I17-V19 PolarHBondContact O-N 2.88Å; I17-V20 PolarHBondContact O-N 3.25Å; I17-I21 HydrophobicContact CG2-CD1 3.63Å; I17-I21 HydrophobicContact CG2-CG1 4.23Å; I17-I21 WeakPolarHBondContact O-CG1 3.36Å; I17-I21 PolarHBondContact O-N 3.48Å; I17-I45 HydrophobicContact CG1-CD1 3.83Å |
| 18 | L | 93.9 | Very high | 92.9 | Very high | 25 Ų | 25 | 51.1 Ų | 51.1 | 13% | 0.131 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -60.2 | -39.9 | 175.4 | -71.2 | 172.6 | 0 | 0 | 0 | 111.9 | V14 G15 N16 I21 A22 F308 I311 L312 | V14-L18 HydrophobicContact CG1-CD1 4.22Å; V14-L18 WeakPolarHBondContact O-CG 3.42Å; V14-L18 PolarHBondContact O-N 3.48Å; G15-L18 WeakPolarHBondContact O-CB 3.39Å; G15-L18 PolarHBondContact O-N 2.98Å; N16-L18 VanDerWaalsContact C-N 3.31Å; N16-L18 PolarHBondContact O-N 2.94Å; L18-I21 PolarHBondContact O-N 3.27Å; L18-A22 WeakPolarHBondContact O-CB 3.39Å; L18-A22 PolarHBondContact O-N 3.48Å; L18-F308 HydrophobicContact CB-CD1 4.24Å; L18-F308 HydrophobicContact CB-CE1 3.85Å; L18-F308 HydrophobicContact CB-CZ 4.04Å; L18-F308 WeakPolarHBondContact O-CE1 3.29Å; L18-I311 HydrophobicContact CD2-CG2 3.76Å; L18-L312 HydrophobicContact CD1-CD2 4.38Å; L18-L312 HydrophobicContact CD2-CD2 4.37Å |
| 19 | V | 94.1 | Very high | 92.4 | Very high | 0 Ų | 0 | 50.2 Ų | 50.2 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -58.2 | -49.7 | 173.8 | 173.2 | 0 | 0 | 0 | 0 | 110.7 | G15 N16 I17 A22 V23 A41 P294 Y297 F304 F308 | G15-V19 WeakPolarHBondContact O-CG2 3.4Å; G15-V19 PolarHBondContact O-N 2.96Å; G15-V19 VanDerWaalsContact O-N 3.12Å; N16-V19 WeakPolarHBondContact O-CB 3.38Å; N16-V19 PolarHBondContact O-N 3.32Å; I17-V19 VanDerWaalsContact C-N 3.3Å; I17-V19 PolarHBondContact O-N 2.88Å; V19-A22 PolarHBondContact O-N 2.92Å; V19-V23 WeakPolarHBondContact O-CG2 3.3Å; V19-V23 PolarHBondContact O-N 3.32Å; V19-A41 HydrophobicContact CB-CB 4.27Å; V19-A41 HydrophobicContact CG1-CB 4.06Å; V19-P294 HydrophobicContact CG2-CB 4.04Å; V19-P294 HydrophobicContact CG2-CG 4.08Å; V19-Y297 HydrophobicContact CG1-CD2 4.27Å; V19-Y297 HydrophobicContact CG1-CE2 4.27Å; V19-Y297 HydrophobicContact CG2-CD2 3.78Å; V19-Y297 HydrophobicContact CG2-CE2 4.26Å; V19-F304 HydrophobicContact CG1-CE1 4.07Å; V19-F304 HydrophobicContact CG1-CZ 4.42Å; V19-F308 HydrophobicContact CG2-CZ 3.82Å |
| 20 | V | 95.3 | Very high | 91.9 | Very high | 29 Ų | 29 | 55 Ų | 55 | 18% | 0.176 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -58.7 | -51.7 | 178.5 | 174 | 0 | 0 | 0 | 0 | 110.6 | N16 I17 A22 V23 L24 V38 A41 | N16-V20 WeakPolarHBondContact O-CG2 3.35Å; N16-V20 PolarHBondContact O-N 2.83Å; I17-V20 PolarHBondContact O-N 3.25Å; V20-A22 VanDerWaalsContact C-N 3.34Å; V20-A22 PolarHBondContact O-N 2.94Å; V20-V23 PolarHBondContact O-N 3.04Å; V20-L24 HydrophobicContact CG1-CD1 3.75Å; V20-L24 HydrophobicContact CG1-CG 4.4Å; V20-L24 VanDerWaalsContact O-CG 3.29Å; V20-L24 WeakPolarHBondContact O-CG 3.45Å; V20-L24 PolarHBondContact O-N 3.4Å; V20-V38 HydrophobicContact CG1-CG1 4.24Å; V20-V38 HydrophobicContact CG2-CG1 4.23Å; V20-A41 HydrophobicContact CG2-CB 3.9Å |
| 21 | I | 93.1 | Very high | 91.5 | Very high | 66 Ų | 66 | 51.2 Ų | 51.2 | 34% | 0.338 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -59.1 | -46 | 179.2 | -65.7 | 171 | 0 | 0 | 0 | 110.4 | I17 L18 V23 L24 T25 I311 | I17-I21 HydrophobicContact CG2-CD1 3.63Å; I17-I21 HydrophobicContact CG2-CG1 4.23Å; I17-I21 WeakPolarHBondContact O-CG1 3.36Å; I17-I21 PolarHBondContact O-N 3.48Å; L18-I21 PolarHBondContact O-N 3.27Å; I21-V23 PolarHBondContact O-N 2.96Å; I21-L24 PolarHBondContact O-N 3.46Å; I21-T25 HydrophobicContact CG2-CG2 3.91Å; I21-T25 VanDerWaalsContact O-CB 3.32Å; I21-T25 WeakPolarHBondContact O-CB 3.34Å; I21-T25 VanDerWaalsContact O-CG2 3.31Å; I21-T25 WeakPolarHBondContact O-CG2 3.36Å; I21-T25 PolarHBondContact O-N 2.95Å; I21-T25 PolarHBondContact O-OG1 2.85Å; I21-I311 HydrophobicContact CB-CD1 4.31Å; I21-I311 HydrophobicContact CG2-CD1 3.69Å; I21-I311 HydrophobicContact CG2-CG1 4.26Å |
| 22 | A | 91.7 | Very high | 91.1 | Very high | 0 Ų | 0 | 48.5 Ų | 48.5 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -59.9 | -43 | -178.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | L18 V19 V20 S26 L29 F304 A307 F308 I311 | L18-A22 WeakPolarHBondContact O-CB 3.39Å; L18-A22 PolarHBondContact O-N 3.48Å; V19-A22 PolarHBondContact O-N 2.92Å; V20-A22 VanDerWaalsContact C-N 3.34Å; V20-A22 PolarHBondContact O-N 2.94Å; A22-S26 WeakPolarHBondContact O-CB 3.45Å; A22-S26 PolarHBondContact O-N 3.15Å; A22-L29 HydrophobicContact CB-CD1 4.17Å; A22-F304 HydrophobicContact CB-CD1 4.09Å; A22-F304 HydrophobicContact CB-CE1 4.18Å; A22-A307 HydrophobicContact CB-CB 3.77Å; A22-F308 HydrophobicContact CB-CD1 3.93Å; A22-F308 HydrophobicContact CB-CE1 3.63Å; A22-I311 HydrophobicContact CB-CD1 4.18Å |
| 23 | V | 92.4 | Very high | 90.6 | Very high | 5 Ų | 5 | 50 Ų | 50 | 3% | 0.03 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -67.4 | -41.3 | 177.5 | 175.8 | 0 | 0 | 0 | 0 | 111.5 | V19 V20 I21 N34 V38 F304 | V19-V23 WeakPolarHBondContact O-CG2 3.3Å; V19-V23 PolarHBondContact O-N 3.32Å; V20-V23 PolarHBondContact O-N 3.04Å; I21-V23 PolarHBondContact O-N 2.96Å; V23-N34 HydrophobicContact CG1-CB 3.84Å; V23-N34 HydrophobicContact CG2-CB 4.34Å; V23-V38 HydrophobicContact CB-CG2 3.69Å; V23-V38 HydrophobicContact CG1-CG2 3.55Å; V23-V38 HydrophobicContact CG2-CG2 4.13Å; V23-F304 HydrophobicContact CG2-CE1 3.85Å; V23-F304 HydrophobicContact CG2-CZ 3.7Å |
| 24 | L | 90.4 | Very high | 90.4 | Very high | 98 Ų | 98 | 49.3 Ų | 49.3 | 51% | 0.513 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -75.6 | -27.4 | -177.1 | -65.3 | 179.9 | 0 | 0 | 0 | 113.6 | V20 I21 K30 | V20-L24 HydrophobicContact CG1-CD1 3.75Å; V20-L24 HydrophobicContact CG1-CG 4.4Å; V20-L24 VanDerWaalsContact O-CG 3.29Å; V20-L24 WeakPolarHBondContact O-CG 3.45Å; V20-L24 PolarHBondContact O-N 3.4Å; I21-L24 PolarHBondContact O-N 3.46Å; L24-K30 WeakPolarHBondContact O-CE 3.39Å; L24-K30 PolarHBondContact O-NZ 3.49Å |
| 25 | T | 88.7 | Confident | 90.2 | Very high | 85 Ų | 85 | 47.9 Ų | 47.9 | 52% | 0.521 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -97.7 | -37.2 | -176.4 | 58.2 | 0 | 0 | 0 | 0 | 113.1 | I21 R27 | I21-T25 HydrophobicContact CG2-CG2 3.91Å; I21-T25 VanDerWaalsContact O-CB 3.32Å; I21-T25 WeakPolarHBondContact O-CB 3.34Å; I21-T25 VanDerWaalsContact O-CG2 3.31Å; I21-T25 WeakPolarHBondContact O-CG2 3.36Å; I21-T25 PolarHBondContact O-N 2.95Å; I21-T25 PolarHBondContact O-OG1 2.85Å; T25-R27 PolarHBondContact O-N 3.44Å |
| 26 | S | 88.4 | Confident | 90.2 | Very high | 29 Ų | 29 | 47.6 Ų | 47.6 | 20% | 0.203 | 25% | 0.249 | C | C | . | . | trans | -82 | 118.3 | -173.2 | -177.8 | 0 | 0 | 0 | 0 | 112.3 | A22 A28 L29 K30 | A22-S26 WeakPolarHBondContact O-CB 3.45Å; A22-S26 PolarHBondContact O-N 3.15Å; S26-A28 PolarHBondContact O-N 3.19Å; S26-A28 VanDerWaalsContact O-N 3.13Å; S26-A28 PolarHBondContact OG-N 3.35Å; S26-L29 CarbonylContact O-C 3.59Å; S26-L29 PolarHBondContact O-N 2.94Å; S26-K30 WeakPolarHBondContact O-CG 3.25Å; S26-K30 PolarHBondContact O-N 2.91Å; S26-K30 VanDerWaalsContact O-N 3.12Å | ||
| 27 | R | 84.8 | Confident | 90 | Very high | 235 Ų | 235 | 48.1 Ų | 48.1 | 89% | 0.887 | 25% | 0.252 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.4 | -32.5 | 174.7 | -65.2 | -174.4 | -173 | -165.9 | 1.7 | 112.8 | T25 L29 | T25-R27 PolarHBondContact O-N 3.44Å; R27-L29 VanDerWaalsContact C-N 3.26Å; R27-L29 PolarHBondContact O-N 3Å |
| 28 | A | 82.2 | Confident | 90 | Very high | 66 Ų | 66 | 45.7 Ų | 45.7 | 55% | 0.545 | 24% | 0.241 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -70.5 | -22.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | S26 | S26-A28 PolarHBondContact O-N 3.19Å; S26-A28 VanDerWaalsContact O-N 3.13Å; S26-A28 PolarHBondContact OG-N 3.35Å |
| 29 | L | 85.1 | Confident | 90.1 | Very high | 3 Ų | 3 | 45.1 Ų | 45.1 | 2% | 0.016 | 24% | 0.239 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -107 | -1.7 | -178.1 | -61 | 172.9 | 0 | 0 | 0 | 113.2 | A22 S26 R27 A31 N34 D303 F304 A307 | A22-L29 HydrophobicContact CB-CD1 4.17Å; S26-L29 CarbonylContact O-C 3.59Å; S26-L29 PolarHBondContact O-N 2.94Å; R27-L29 VanDerWaalsContact C-N 3.26Å; R27-L29 PolarHBondContact O-N 3Å; L29-A31 PolarHBondContact O-N 3.45Å; L29-N34 WeakPolarHBondContact CA-ND2 3.45Å; L29-N34 VanDerWaalsContact O-CB 3.31Å; L29-N34 WeakPolarHBondContact O-CB 3.28Å; L29-N34 PolarHBondContact O-ND2 3.33Å; L29-D303 HydrophobicContact CD2-CB 3.89Å; L29-D303 HydrophobicContact CG-CB 4.43Å; L29-F304 HydrophobicContact CD1-CD1 3.9Å; L29-F304 HydrophobicContact CD1-CD2 4.47Å; L29-F304 HydrophobicContact CD1-CE1 3.99Å; L29-F304 HydrophobicContact CD1-CG 4.15Å; L29-F304 HydrophobicContact CD1-CZ 4.31Å; L29-F304 HydrophobicContact CD2-CD2 4.15Å; L29-F304 HydrophobicContact CD2-CE2 4.08Å; L29-F304 HydrophobicContact CD2-CZ 4.46Å; L29-A307 HydrophobicContact CD1-CB 4.1Å |
| 30 | K | 84.3 | Confident | 90.1 | Very high | 129 Ų | 129 | 45.2 Ų | 45.2 | 56% | 0.561 | 24% | 0.239 | S | C | * | . | trans | -72.6 | 14.2 | 178.5 | -79.4 | -177.4 | -177.9 | -162.2 | 0 | 115.3 | L24 S26 | L24-K30 WeakPolarHBondContact O-CE 3.39Å; L24-K30 PolarHBondContact O-NZ 3.49Å; S26-K30 WeakPolarHBondContact O-CG 3.25Å; S26-K30 PolarHBondContact O-N 2.91Å; S26-K30 VanDerWaalsContact O-N 3.12Å | ||
| 31 | A | 87.1 | Confident | 90.1 | Very high | 31 Ų | 31 | 43.9 Ų | 43.9 | 26% | 0.256 | 23% | 0.231 | S | C | . | . | S | Bend | trans | -68.4 | 141.4 | 177.6 | 0 | 0 | 0 | 0 | 0 | 110.5 | L29 Q33 N34 | L29-A31 PolarHBondContact O-N 3.45Å; A31-Q33 VanDerWaalsContact CB-CD 3.43Å; A31-Q33 HydrophobicContact CB-CG 4.49Å; A31-Q33 PolarHBondContact O-N 3.13Å; A31-N34 WeakPolarHBondContact O-CB 3.44Å; A31-N34 PolarHBondContact O-N 3.09Å |
| 32 | P | 86.4 | Confident | 90.3 | Very high | 35 Ų | 35 | 43.6 Ų | 43.6 | 23% | 0.227 | 23% | 0.232 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -52.9 | -35.2 | -171.8 | -28.3 | 34.5 | 0 | 0 | 0 | 114.6 | N34 L35 P112 I115 | P32-N34 VanDerWaalsContact C-N 3.29Å; P32-N34 PolarHBondContact O-N 2.91Å; P32-L35 VanDerWaalsContact O-CB 3.27Å; P32-L35 WeakPolarHBondContact O-CB 3.35Å; P32-L35 VanDerWaalsContact O-CG 3.29Å; P32-L35 WeakPolarHBondContact O-CG 3.42Å; P32-L35 PolarHBondContact O-N 3.42Å; P32-P112 HydrophobicContact CB-CG 4.28Å; P32-P112 HydrophobicContact CG-CG 4.07Å; P32-I115 HydrophobicContact CB-CG1 4.1Å |
| 33 | Q | 86.8 | Confident | 90.5 | Very high | 32 Ų | 32 | 43.6 Ų | 43.6 | 15% | 0.15 | 23% | 0.232 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -67.6 | -23.7 | 179.1 | 63.7 | -84.9 | 13.8 | 0 | 0 | 115.8 | A31 L35 F36 R110 | A31-Q33 VanDerWaalsContact CB-CD 3.43Å; A31-Q33 HydrophobicContact CB-CG 4.49Å; A31-Q33 PolarHBondContact O-N 3.13Å; Q33-L35 PolarHBondContact O-N 3.48Å; Q33-F36 WeakPolarHBondContact O-CB 3.42Å; Q33-F36 WeakPolarHBondContact O-CD2 3.39Å; Q33-F36 PolarHBondContact O-N 2.95Å; Q33-F36 VanDerWaalsContact O-N 3.11Å; Q33-R110 VanDerWaalsContact CG-CZ 3.47Å; Q33-R110 VanDerWaalsContact OE1-NH1 3.13Å |
| 34 | N | 91.3 | Very high | 90.6 | Very high | 13 Ų | 13 | 43.4 Ų | 43.4 | 7% | 0.07 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -73.1 | -9.6 | 179.7 | -66 | -15.1 | 0 | 0 | 0 | 110.5 | V23 L29 A31 P32 F36 L37 V38 | V23-N34 HydrophobicContact CG1-CB 3.84Å; V23-N34 HydrophobicContact CG2-CB 4.34Å; L29-N34 WeakPolarHBondContact CA-ND2 3.45Å; L29-N34 VanDerWaalsContact O-CB 3.31Å; L29-N34 WeakPolarHBondContact O-CB 3.28Å; L29-N34 PolarHBondContact O-ND2 3.33Å; A31-N34 WeakPolarHBondContact O-CB 3.44Å; A31-N34 PolarHBondContact O-N 3.09Å; P32-N34 VanDerWaalsContact C-N 3.29Å; P32-N34 PolarHBondContact O-N 2.91Å; N34-F36 PolarHBondContact O-N 2.95Å; N34-L37 HydrophobicContact CB-CD1 4.44Å; N34-L37 WeakPolarHBondContact O-CB 3.17Å; N34-L37 PolarHBondContact O-N 2.91Å; N34-L37 VanDerWaalsContact O-N 3.08Å; N34-V38 PolarHBondContact O-N 2.84Å |
| 35 | L | 92.7 | Very high | 91 | Very high | 43 Ų | 43 | 40.2 Ų | 40.2 | 23% | 0.225 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -62 | -28.5 | 167.4 | -64.8 | 175.7 | 0 | 0 | 0 | 112.6 | P32 Q33 L37 V38 S39 I115 K116 I119 | P32-L35 VanDerWaalsContact O-CB 3.27Å; P32-L35 WeakPolarHBondContact O-CB 3.35Å; P32-L35 VanDerWaalsContact O-CG 3.29Å; P32-L35 WeakPolarHBondContact O-CG 3.42Å; P32-L35 PolarHBondContact O-N 3.42Å; Q33-L35 PolarHBondContact O-N 3.48Å; L35-L37 VanDerWaalsContact C-N 3.28Å; L35-L37 PolarHBondContact O-N 3.06Å; L35-V38 PolarHBondContact O-N 3.06Å; L35-S39 PolarHBondContact O-N 3.45Å; L35-I115 HydrophobicContact CB-CG2 3.96Å; L35-I115 HydrophobicContact CD1-CG2 4.43Å; L35-K116 HydrophobicContact CD1-CG 4.35Å; L35-I119 HydrophobicContact CB-CD1 3.98Å |
| 36 | F | 93.7 | Very high | 91.3 | Very high | 2 Ų | 2 | 38.6 Ų | 38.6 | 1% | 0.009 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -62.8 | -38.4 | 171.5 | -70.6 | -60.5 | 0 | 0 | 0 | 111.7 | Q33 N34 V38 S39 L40 A91 I92 D95 I115 I118 I119 | Q33-F36 WeakPolarHBondContact O-CB 3.42Å; Q33-F36 WeakPolarHBondContact O-CD2 3.39Å; Q33-F36 PolarHBondContact O-N 2.95Å; Q33-F36 VanDerWaalsContact O-N 3.11Å; N34-F36 PolarHBondContact O-N 2.95Å; F36-V38 VanDerWaalsContact C-N 3.33Å; F36-S39 PolarHBondContact O-N 3Å; F36-L40 WeakPolarHBondContact O-CB 3.47Å; F36-L40 PolarHBondContact O-N 2.93Å; F36-A91 HydrophobicContact CE1-CB 4.11Å; F36-A91 HydrophobicContact CZ-CB 4.5Å; F36-I92 HydrophobicContact CB-CD1 3.99Å; F36-I92 HydrophobicContact CB-CG1 3.61Å; F36-I92 HydrophobicContact CD2-CG1 4.34Å; F36-I92 HydrophobicContact CG-CG1 4.04Å; F36-D95 HydrophobicContact CE2-CB 4.11Å; F36-I115 HydrophobicContact CD1-CG2 4.37Å; F36-I115 HydrophobicContact CD2-CG2 4.14Å; F36-I115 HydrophobicContact CE1-CG2 4.11Å; F36-I115 HydrophobicContact CE2-CD1 3.7Å; F36-I115 HydrophobicContact CE2-CG2 3.89Å; F36-I115 HydrophobicContact CG-CG2 4.38Å; F36-I115 HydrophobicContact CZ-CD1 3.92Å; F36-I115 HydrophobicContact CZ-CG2 3.86Å; F36-I118 HydrophobicContact CE1-CB 4.11Å; F36-I118 HydrophobicContact CE1-CG2 3.68Å; F36-I118 HydrophobicContact CZ-CB 4.13Å; F36-I118 HydrophobicContact CZ-CD1 4.27Å; F36-I118 HydrophobicContact CZ-CG2 3.83Å; F36-I119 HydrophobicContact CD1-CD1 4.2Å; F36-I119 HydrophobicContact CD1-CG1 3.66Å; F36-I119 HydrophobicContact CE1-CG1 3.81Å |
| 37 | L | 91.9 | Very high | 91.7 | Very high | 12 Ų | 12 | 37.5 Ų | 37.5 | 6% | 0.063 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -68.1 | -35.2 | 177.5 | -54.7 | 177.9 | 0 | 0 | 0 | 111.4 | N34 L35 A41 I92 Y297 F304 | N34-L37 HydrophobicContact CB-CD1 4.44Å; N34-L37 WeakPolarHBondContact O-CB 3.17Å; N34-L37 PolarHBondContact O-N 2.91Å; N34-L37 VanDerWaalsContact O-N 3.08Å; L35-L37 VanDerWaalsContact C-N 3.28Å; L35-L37 PolarHBondContact O-N 3.06Å; L37-A41 VanDerWaalsContact O-CB 3.24Å; L37-A41 WeakPolarHBondContact O-CB 3.42Å; L37-A41 PolarHBondContact O-N 2.83Å; L37-I92 HydrophobicContact CD2-CD1 4.15Å; L37-Y297 HydrophobicContact CD2-CE1 4.03Å; L37-F304 HydrophobicContact CD1-CE2 3.82Å; L37-F304 HydrophobicContact CD1-CZ 3.81Å |
| 38 | V | 95.2 | Very high | 92.2 | Very high | 22 Ų | 22 | 26.3 Ų | 26.3 | 13% | 0.133 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -64.3 | -48.1 | 173.6 | 175.9 | 0 | 0 | 0 | 0 | 110.3 | V20 V23 N34 L35 F36 L40 A41 T42 | V20-V38 HydrophobicContact CG1-CG1 4.24Å; V20-V38 HydrophobicContact CG2-CG1 4.23Å; V23-V38 HydrophobicContact CB-CG2 3.69Å; V23-V38 HydrophobicContact CG1-CG2 3.55Å; V23-V38 HydrophobicContact CG2-CG2 4.13Å; N34-V38 PolarHBondContact O-N 2.84Å; L35-V38 PolarHBondContact O-N 3.06Å; F36-V38 VanDerWaalsContact C-N 3.33Å; V38-L40 PolarHBondContact O-N 2.81Å; V38-A41 PolarHBondContact O-N 3.41Å; V38-T42 PolarHBondContact O-N 2.91Å; V38-T42 PolarHBondContact O-OG1 3.39Å |
| 39 | S | 96.3 | Very high | 92.9 | Very high | 13 Ų | 13 | 26.1 Ų | 26.1 | 9% | 0.091 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -62.8 | -41.7 | 178.9 | -170.5 | 0 | 0 | 0 | 0 | 112.4 | L35 F36 T42 A43 H88 I119 W123 | L35-S39 PolarHBondContact O-N 3.45Å; F36-S39 PolarHBondContact O-N 3Å; S39-T42 WeakPolarHBondContact O-CB 3.33Å; S39-T42 PolarHBondContact O-N 2.65Å; S39-A43 PolarHBondContact O-N 3.33Å; S39-H88 WeakPolarHBondContact CB-NE2 3.24Å; S39-H88 PolarHBondContact OG-CE1 3.24Å; S39-H88 PolarHBondContact OG-NE2 3.44Å; S39-I119 VanDerWaalsContact OG-CG2 3.28Å; S39-I119 WeakPolarHBondContact OG-CG2 3.35Å; S39-W123 PolarHBondContact OG-NE1 2.95Å |
| 40 | L | 94.3 | Very high | 93.4 | Very high | 2 Ų | 2 | 28.8 Ų | 28.8 | 1% | 0.01 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -62.3 | -45.8 | 174.3 | -176.7 | 65.4 | 0 | 0 | 0 | 111.6 | F36 V38 T42 A43 D44 H88 L89 | F36-L40 WeakPolarHBondContact O-CB 3.47Å; F36-L40 PolarHBondContact O-N 2.93Å; V38-L40 PolarHBondContact O-N 2.81Å; L40-T42 VanDerWaalsContact C-N 3.27Å; L40-T42 PolarHBondContact O-N 3.26Å; L40-A43 WeakPolarHBondContact O-CB 3.47Å; L40-A43 PolarHBondContact O-N 3.45Å; L40-A43 VanDerWaalsContact O-N 3.09Å; L40-D44 PolarHBondContact O-N 3.24Å; L40-H88 HydrophobicContact CD1-CB 4.06Å; L40-L89 HydrophobicContact CD2-CD2 4.11Å |
| 41 | A | 95.8 | Very high | 93.9 | Very high | 1 Ų | 1 | 22.6 Ų | 22.6 | 1% | 0.008 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -61.3 | -35.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | N16 V19 V20 L37 V38 D44 I45 | N16-A41 HydrophobicContact CB-CB 4.03Å; V19-A41 HydrophobicContact CB-CB 4.27Å; V19-A41 HydrophobicContact CG1-CB 4.06Å; V20-A41 HydrophobicContact CG2-CB 3.9Å; L37-A41 VanDerWaalsContact O-CB 3.24Å; L37-A41 WeakPolarHBondContact O-CB 3.42Å; L37-A41 PolarHBondContact O-N 2.83Å; V38-A41 PolarHBondContact O-N 3.41Å; A41-D44 PolarHBondContact O-N 2.88Å; A41-I45 WeakPolarHBondContact O-CD1 3.35Å; A41-I45 VanDerWaalsContact O-CG1 3.23Å; A41-I45 WeakPolarHBondContact O-CG1 3.46Å; A41-I45 PolarHBondContact O-N 3.12Å |
| 42 | T | 96.1 | Very high | 94.2 | Very high | 59 Ų | 59 | 21.1 Ų | 21.1 | 36% | 0.362 | 12% | 0.119 | S | C | . | . | H | α-helix | trans | -63.7 | -43 | 172.6 | -57.5 | 0 | 0 | 0 | 0 | 111.5 | V38 S39 L40 I45 L46 | V38-T42 PolarHBondContact O-N 2.91Å; V38-T42 PolarHBondContact O-OG1 3.39Å; S39-T42 WeakPolarHBondContact O-CB 3.33Å; S39-T42 PolarHBondContact O-N 2.65Å; L40-T42 VanDerWaalsContact C-N 3.27Å; L40-T42 PolarHBondContact O-N 3.26Å; T42-I45 PolarHBondContact O-N 3Å; T42-L46 HydrophobicContact CG2-CD1 4.11Å; T42-L46 HydrophobicContact CG2-CG 4.5Å; T42-L46 VanDerWaalsContact O-CG 3.26Å; T42-L46 WeakPolarHBondContact O-CG 3.49Å; T42-L46 PolarHBondContact O-N 3.06Å |
| 43 | A | 95.9 | Very high | 94.6 | Very high | 0 Ų | 0 | 21.8 Ų | 21.8 | 0% | 0 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -60.6 | -45.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | S39 L40 I45 L46 V47 W123 | S39-A43 PolarHBondContact O-N 3.33Å; L40-A43 WeakPolarHBondContact O-CB 3.47Å; L40-A43 PolarHBondContact O-N 3.45Å; L40-A43 VanDerWaalsContact O-N 3.09Å; A43-I45 PolarHBondContact O-N 3.31Å; A43-L46 PolarHBondContact O-N 3.25Å; A43-L46 VanDerWaalsContact O-N 3.15Å; A43-V47 WeakPolarHBondContact O-CG2 3.33Å; A43-V47 PolarHBondContact O-N 3.45Å; A43-W123 HydrophobicContact CB-CH2 4.02Å; A43-W123 HydrophobicContact CB-CZ2 4.15Å |
| 44 | D | 96 | Very high | 95 | Very high | 1 Ų | 1 | 22.1 Ų | 22.1 | 1% | 0.005 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -61.7 | -39.8 | 177.6 | -70.7 | -34.9 | 0 | 0 | 0 | 112.9 | N16 L40 A41 V47 A48 S290 N293 | N16-D44 WeakPolarHBondContact ND2-CB 3.24Å; L40-D44 PolarHBondContact O-N 3.24Å; A41-D44 PolarHBondContact O-N 2.88Å; D44-V47 PolarHBondContact O-N 3.39Å; D44-A48 PolarHBondContact O-N 3.12Å; D44-A48 VanDerWaalsContact O-N 3.11Å; D44-S290 WeakPolarHBondContact OD1-CA 3.37Å; D44-S290 WeakPolarHBondContact OD1-CB 3.36Å; D44-S290 PolarHBondContact OD1-OG 3.26Å; D44-N293 PolarHBondContact OD2-ND2 3.15Å |
| 45 | I | 97.3 | Very high | 95 | Very high | 32 Ų | 32 | 22 Ų | 22 | 16% | 0.164 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -62.7 | -44.9 | 174 | -69.7 | 162.4 | 0 | 0 | 0 | 110.2 | N16 I17 A41 T42 A43 V47 A48 T49 | N16-I45 HydrophobicContact CB-CD1 3.95Å; N16-I45 HydrophobicContact CB-CG1 3.59Å; I17-I45 HydrophobicContact CG1-CD1 3.83Å; A41-I45 WeakPolarHBondContact O-CD1 3.35Å; A41-I45 VanDerWaalsContact O-CG1 3.23Å; A41-I45 WeakPolarHBondContact O-CG1 3.46Å; A41-I45 PolarHBondContact O-N 3.12Å; T42-I45 PolarHBondContact O-N 3Å; A43-I45 PolarHBondContact O-N 3.31Å; I45-V47 VanDerWaalsContact C-N 3.35Å; I45-V47 PolarHBondContact O-N 3.27Å; I45-A48 PolarHBondContact O-N 3.4Å; I45-T49 HydrophobicContact CG2-CG2 4.37Å; I45-T49 WeakPolarHBondContact O-CG2 3.31Å; I45-T49 PolarHBondContact O-N 3.48Å; I45-T49 PolarHBondContact O-OG1 3.33Å; I45-T49 VanDerWaalsContact O-OG1 3.07Å |
| 46 | L | 96.8 | Very high | 95.1 | Very high | 50 Ų | 50 | 20.6 Ų | 20.6 | 26% | 0.262 | 12% | 0.117 | S | C | . | . | H | α-helix | trans | -65.6 | -36 | -179.7 | -68 | 169.2 | 0 | 0 | 0 | 112.2 | T42 A43 T49 L50 F81 W123 | T42-L46 HydrophobicContact CG2-CD1 4.11Å; T42-L46 HydrophobicContact CG2-CG 4.5Å; T42-L46 VanDerWaalsContact O-CG 3.26Å; T42-L46 WeakPolarHBondContact O-CG 3.49Å; T42-L46 PolarHBondContact O-N 3.06Å; A43-L46 PolarHBondContact O-N 3.25Å; A43-L46 VanDerWaalsContact O-N 3.15Å; L46-T49 PolarHBondContact O-N 3.42Å; L46-L50 HydrophobicContact CD2-CD1 3.84Å; L46-L50 HydrophobicContact CD2-CG 4.48Å; L46-L50 WeakPolarHBondContact O-CA 3.4Å; L46-L50 VanDerWaalsContact O-CB 3.28Å; L46-L50 WeakPolarHBondContact O-CB 3.19Å; L46-L50 PolarHBondContact O-N 2.98Å; L46-F81 HydrophobicContact CB-CD1 4.23Å; L46-F81 HydrophobicContact CB-CD2 4.23Å; L46-F81 HydrophobicContact CB-CE1 3.71Å; L46-F81 HydrophobicContact CB-CE2 3.71Å; L46-F81 HydrophobicContact CB-CG 4.49Å; L46-F81 HydrophobicContact CB-CZ 3.43Å; L46-F81 VanDerWaalsContact CB-CZ 3.43Å; L46-F81 HydrophobicContact CD1-CD1 4.43Å; L46-F81 HydrophobicContact CD1-CE1 3.58Å; L46-F81 HydrophobicContact CD1-CZ 3.86Å; L46-F81 HydrophobicContact CG-CE1 4.27Å; L46-F81 HydrophobicContact CG-CZ 4.16Å; L46-W123 HydrophobicContact CD1-CH2 4.27Å |
| 47 | V | 96 | Very high | 95 | Very high | 6 Ų | 6 | 21.7 Ų | 21.7 | 4% | 0.036 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -60 | -48.4 | 170.7 | 175.8 | 0 | 0 | 0 | 0 | 110.3 | A43 D44 I45 T49 V51 M52 F81 Y287 | A43-V47 WeakPolarHBondContact O-CG2 3.33Å; A43-V47 PolarHBondContact O-N 3.45Å; D44-V47 PolarHBondContact O-N 3.39Å; I45-V47 VanDerWaalsContact C-N 3.35Å; I45-V47 PolarHBondContact O-N 3.27Å; V47-T49 VanDerWaalsContact C-N 3.29Å; V47-T49 PolarHBondContact O-N 3.09Å; V47-V51 HydrophobicContact CG1-CB 4.4Å; V47-V51 WeakPolarHBondContact O-CA 3.41Å; V47-V51 WeakPolarHBondContact O-CB 3.07Å; V47-V51 PolarHBondContact O-N 3.36Å; V47-V51 VanDerWaalsContact O-N 3.08Å; V47-M52 HydrophobicContact CG1-CE 3.66Å; V47-M52 HydrophobicContact CG1-CG 4.12Å; V47-M52 PolarHBondContact O-N 3.45Å; V47-F81 HydrophobicContact CG2-CB 3.28Å; V47-F81 HydrophobicContact CG2-CD2 3.88Å; V47-F81 HydrophobicContact CG2-CG 3.88Å; V47-Y287 HydrophobicContact CG1-CD1 3.87Å; V47-Y287 HydrophobicContact CG1-CE1 4.06Å |
| 48 | A | 96.4 | Very high | 94.9 | Very high | 0 Ų | 0 | 22.4 Ų | 22.4 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -66.3 | -28.8 | -177 | 0 | 0 | 0 | 0 | 0 | 113.6 | I9 T12 V13 D44 I45 M52 P53 | I9-A48 HydrophobicContact CG2-CB 4.44Å; I9-A48 WeakPolarHBondContact CG2-O 3.47Å; T12-A48 HydrophobicContact CG2-CB 3.76Å; V13-A48 HydrophobicContact CG2-CB 3.74Å; D44-A48 PolarHBondContact O-N 3.12Å; D44-A48 VanDerWaalsContact O-N 3.11Å; I45-A48 PolarHBondContact O-N 3.4Å; A48-M52 HydrophobicContact CB-SD 4.33Å; A48-P53 VanDerWaalsContact O-CD 3.29Å; A48-P53 WeakPolarHBondContact O-CD 3.4Å; A48-P53 WeakPolarHBondContact O-CG 3.32Å |
| 49 | T | 95.8 | Very high | 94.6 | Very high | 62 Ų | 62 | 24.1 Ų | 24.1 | 38% | 0.38 | 14% | 0.137 | S | C | . | . | H | α-helix | trans | -98.2 | -36.1 | -177.6 | 58 | 0 | 0 | 0 | 0 | 114.1 | V13 I45 L46 V47 | V13-T49 HydrophobicContact CG2-CG2 3.91Å; I45-T49 HydrophobicContact CG2-CG2 4.37Å; I45-T49 WeakPolarHBondContact O-CG2 3.31Å; I45-T49 PolarHBondContact O-N 3.48Å; I45-T49 PolarHBondContact O-OG1 3.33Å; I45-T49 VanDerWaalsContact O-OG1 3.07Å; L46-T49 PolarHBondContact O-N 3.42Å; V47-T49 VanDerWaalsContact C-N 3.29Å; V47-T49 PolarHBondContact O-N 3.09Å |
| 50 | L | 95.3 | Very high | 94.4 | Very high | 59 Ų | 59 | 28.4 Ų | 28.4 | 31% | 0.309 | 16% | 0.158 | S | C | . | . | H | α-helix | trans | -104.6 | -13.4 | -172.9 | -57.9 | -178.9 | 0 | 0 | 0 | 114 | L46 F54 L77 F81 | L46-L50 HydrophobicContact CD2-CD1 3.84Å; L46-L50 HydrophobicContact CD2-CG 4.48Å; L46-L50 WeakPolarHBondContact O-CA 3.4Å; L46-L50 VanDerWaalsContact O-CB 3.28Å; L46-L50 WeakPolarHBondContact O-CB 3.19Å; L46-L50 PolarHBondContact O-N 2.98Å; L50-F54 WeakPolarHBondContact O-CD2 3.37Å; L50-F54 WeakPolarHBondContact O-CE2 3.43Å; L50-L77 HydrophobicContact CB-CD1 4.26Å; L50-L77 HydrophobicContact CD1-CD1 4.28Å; L50-F81 HydrophobicContact CB-CE2 4.49Å; L50-F81 HydrophobicContact CD1-CE2 4.44Å; L50-F81 HydrophobicContact CD1-CZ 4.32Å |
| 51 | V | 94.9 | Very high | 94.2 | Very high | 0 Ų | 0 | 32.2 Ų | 32.2 | 0% | 0 | 18% | 0.177 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -118.5 | -63.4 | -175.8 | -175.6 | 0 | 0 | 0 | 0 | 110.5 | V47 P53 F54 S55 Y74 L77 D78 F81 Y287 | V47-V51 HydrophobicContact CG1-CB 4.4Å; V47-V51 WeakPolarHBondContact O-CA 3.41Å; V47-V51 WeakPolarHBondContact O-CB 3.07Å; V47-V51 PolarHBondContact O-N 3.36Å; V47-V51 VanDerWaalsContact O-N 3.08Å; V51-P53 VanDerWaalsContact C-CD 3.4Å; V51-P53 VanDerWaalsContact O-N 3.16Å; V51-F54 PolarHBondContact O-N 3.37Å; V51-S55 PolarHBondContact O-N 3.31Å; V51-S55 PolarHBondContact O-OG 3.18Å; V51-S55 VanDerWaalsContact O-OG 3.09Å; V51-Y74 HydrophobicContact CB-CE2 4.44Å; V51-Y74 HydrophobicContact CG1-CD2 4.26Å; V51-Y74 HydrophobicContact CG1-CE2 3.64Å; V51-L77 HydrophobicContact CG2-CB 4.32Å; V51-D78 HydrophobicContact CG1-CB 3.94Å; V51-D78 WeakPolarHBondContact CG1-OD1 2.87Å; V51-F81 HydrophobicContact CG2-CD2 3.91Å; V51-F81 HydrophobicContact CG2-CE2 4.15Å; V51-Y287 HydrophobicContact CG1-CE1 4.08Å; V51-Y287 WeakPolarHBondContact CG1-OH 3.37Å |
| 52 | M | 94.4 | Very high | 93.7 | Very high | 0 Ų | 0 | 34.1 Ų | 34.1 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -53.6 | -39.4 | -173.5 | -62.8 | -171.8 | -168.3 | 0 | 0 | 115.3 | I9 V47 A48 F54 S55 L56 Y287 | I9-M52 HydrophobicContact CD1-CB 3.86Å; I9-M52 HydrophobicContact CG1-CB 3.74Å; I9-M52 HydrophobicContact CG1-CG 4.47Å; I9-M52 HydrophobicContact CG1-SD 3.89Å; V47-M52 HydrophobicContact CG1-CE 3.66Å; V47-M52 HydrophobicContact CG1-CG 4.12Å; V47-M52 PolarHBondContact O-N 3.45Å; A48-M52 HydrophobicContact CB-SD 4.33Å; M52-F54 VanDerWaalsContact C-N 3.33Å; M52-F54 PolarHBondContact O-N 2.97Å; M52-S55 PolarHBondContact O-N 3.07Å; M52-L56 WeakPolarHBondContact O-CB 3.28Å; M52-L56 PolarHBondContact O-N 2.9Å; M52-Y287 HydrophobicContact CE-CD1 4.42Å; M52-Y287 HydrophobicContact CE-CG 4.17Å; M52-Y287 WeakPolarHBondContact CE-O 3.3Å; M52-Y287 HydrophobicContact CG-CD2 4.25Å; M52-Y287 HydrophobicContact CG-CG 4.21Å |
| 53 | P | 95 | Very high | 93.2 | Very high | 48 Ų | 48 | 34.6 Ų | 34.6 | 31% | 0.312 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -66 | -36.1 | 179.1 | -21.2 | 34.7 | 0 | 0 | 0 | 112.5 | I9 A48 V51 L56 A57 | I9-P53 HydrophobicContact CD1-CG 4.17Å; A48-P53 VanDerWaalsContact O-CD 3.29Å; A48-P53 WeakPolarHBondContact O-CD 3.4Å; A48-P53 WeakPolarHBondContact O-CG 3.32Å; V51-P53 VanDerWaalsContact C-CD 3.4Å; V51-P53 VanDerWaalsContact O-N 3.16Å; P53-L56 PolarHBondContact O-N 3.13Å; P53-A57 WeakPolarHBondContact O-CB 3.08Å; P53-A57 PolarHBondContact O-N 3.24Å |
| 54 | F | 93.9 | Very high | 92.9 | Very high | 40 Ų | 40 | 34.9 Ų | 34.9 | 18% | 0.175 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -75 | -38.1 | 178.3 | -60.3 | -82.3 | 0 | 0 | 0 | 111.1 | L50 V51 M52 L56 A57 N58 W64 F66 W70 Y74 | L50-F54 WeakPolarHBondContact O-CD2 3.37Å; L50-F54 WeakPolarHBondContact O-CE2 3.43Å; V51-F54 PolarHBondContact O-N 3.37Å; M52-F54 VanDerWaalsContact C-N 3.33Å; M52-F54 PolarHBondContact O-N 2.97Å; F54-L56 VanDerWaalsContact C-N 3.31Å; F54-L56 PolarHBondContact O-N 3.13Å; F54-A57 PolarHBondContact O-N 2.89Å; F54-N58 WeakPolarHBondContact O-CB 3.43Å; F54-N58 PolarHBondContact O-N 3.33Å; F54-W64 HydrophobicContact CB-CH2 4.14Å; F54-W64 HydrophobicContact CB-CZ3 4.39Å; F54-F66 HydrophobicContact CD1-CD1 4.19Å; F54-F66 AromaticContact CD1-CD2 3.92Å; F54-F66 HydrophobicContact CD1-CD2 3.92Å; F54-F66 AromaticContact CD1-CE1 4Å; F54-F66 HydrophobicContact CD1-CE1 4Å; F54-F66 AromaticContact CD1-CE2 3.73Å; F54-F66 HydrophobicContact CD1-CE2 3.73Å; F54-F66 HydrophobicContact CD1-CG 4.15Å; F54-F66 AromaticContact CD1-CZ 3.77Å; F54-F66 HydrophobicContact CD1-CZ 3.77Å; F54-F66 HydrophobicContact CE1-CD1 4.1Å; F54-F66 AromaticContact CE1-CE1 3.95Å; F54-F66 HydrophobicContact CE1-CE1 3.95Å; F54-F66 HydrophobicContact CE1-CE2 4.49Å; F54-F66 HydrophobicContact CE1-CG 4.44Å; F54-F66 HydrophobicContact CE1-CZ 4.15Å; F54-W70 AromaticContact CD1-CD1 3.95Å; F54-W70 AromaticContact CD1-NE1 3.2Å; F54-W70 HydrophobicContact CD2-CZ2 4.45Å; F54-W70 AromaticContact CE1-CE2 3.76Å; F54-W70 AromaticContact CE1-CZ2 3.98Å; F54-W70 HydrophobicContact CE1-CZ2 3.98Å; F54-W70 AromaticContact CE1-NE1 3.14Å; F54-W70 AromaticContact CE2-CZ2 3.74Å; F54-W70 HydrophobicContact CE2-CZ2 3.74Å; F54-W70 AromaticContact CE2-NE1 3.98Å; F54-W70 AromaticContact CG-NE1 3.66Å; F54-W70 AromaticContact CZ-CE2 3.75Å; F54-W70 AromaticContact CZ-CZ2 3.46Å; F54-W70 HydrophobicContact CZ-CZ2 3.46Å; F54-W70 VanDerWaalsContact CZ-CZ2 3.46Å; F54-W70 AromaticContact CZ-NE1 3.55Å; F54-Y74 HydrophobicContact CB-CD2 3.96Å; F54-Y74 HydrophobicContact CB-CE2 4.08Å |
| 55 | S | 92.4 | Very high | 92.5 | Very high | 9 Ų | 9 | 42.4 Ų | 42.4 | 6% | 0.063 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -60.1 | -42.8 | 170.6 | -42.4 | 0 | 0 | 0 | 0 | 111.2 | V51 M52 N58 E59 Y74 | V51-S55 PolarHBondContact O-N 3.31Å; V51-S55 PolarHBondContact O-OG 3.18Å; V51-S55 VanDerWaalsContact O-OG 3.09Å; M52-S55 PolarHBondContact O-N 3.07Å; S55-N58 PolarHBondContact O-N 3.26Å; S55-E59 WeakPolarHBondContact O-CB 3.45Å; S55-E59 PolarHBondContact O-N 2.92Å; S55-Y74 WeakPolarHBondContact OG-CE2 3.31Å; S55-Y74 PolarHBondContact OG-OH 3.47Å |
| 56 | L | 93.1 | Very high | 92.1 | Very high | 14 Ų | 14 | 44.6 Ų | 44.6 | 7% | 0.073 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -65.3 | -44.9 | 176.1 | 179 | 61.3 | 0 | 0 | 0 | 111.8 | I1 V5 M52 P53 F54 N58 E59 L60 W284 | I1-L56 HydrophobicContact CG2-CD1 4.25Å; V5-L56 HydrophobicContact CB-CD1 3.99Å; V5-L56 HydrophobicContact CB-CD2 4.06Å; V5-L56 HydrophobicContact CG1-CB 4.08Å; V5-L56 HydrophobicContact CG1-CD1 4.11Å; V5-L56 HydrophobicContact CG1-CD2 3.84Å; V5-L56 HydrophobicContact CG1-CG 4.22Å; V5-L56 HydrophobicContact CG2-CD1 4.18Å; M52-L56 WeakPolarHBondContact O-CB 3.28Å; M52-L56 PolarHBondContact O-N 2.9Å; P53-L56 PolarHBondContact O-N 3.13Å; F54-L56 VanDerWaalsContact C-N 3.31Å; F54-L56 PolarHBondContact O-N 3.13Å; L56-N58 VanDerWaalsContact C-N 3.33Å; L56-N58 PolarHBondContact O-N 3.15Å; L56-E59 WeakPolarHBondContact O-CB 3.35Å; L56-E59 PolarHBondContact O-N 2.94Å; L56-L60 HydrophobicContact CD1-CD1 3.98Å; L56-L60 HydrophobicContact CD1-CD2 4.48Å; L56-L60 HydrophobicContact CD1-CG 3.99Å; L56-L60 HydrophobicContact CD2-CD1 4.49Å; L56-L60 HydrophobicContact CG-CD1 3.92Å; L56-L60 HydrophobicContact CG-CG 4.32Å; L56-L60 WeakPolarHBondContact O-CG 3.3Å; L56-L60 PolarHBondContact O-N 3.04Å; L56-W284 HydrophobicContact CB-CH2 4.3Å |
| 57 | A | 92.8 | Very high | 91.6 | Very high | 25 Ų | 25 | 44 Ų | 44 | 21% | 0.207 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -60.5 | -44.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | P53 F54 E59 L60 M61 F66 | P53-A57 WeakPolarHBondContact O-CB 3.08Å; P53-A57 PolarHBondContact O-N 3.24Å; F54-A57 PolarHBondContact O-N 2.89Å; A57-E59 VanDerWaalsContact C-N 3.29Å; A57-E59 PolarHBondContact O-N 3.41Å; A57-L60 PolarHBondContact O-N 3.37Å; A57-M61 WeakPolarHBondContact O-CB 3.49Å; A57-M61 VanDerWaalsContact O-CG 3.28Å; A57-M61 WeakPolarHBondContact O-CG 3.3Å; A57-M61 PolarHBondContact O-N 2.91Å; A57-F66 HydrophobicContact CB-CE2 3.91Å; A57-F66 HydrophobicContact CB-CZ 4Å |
| 58 | N | 89.8 | Confident | 91 | Very high | 27 Ų | 27 | 50.5 Ų | 50.5 | 14% | 0.144 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -60.8 | -39 | 175.1 | -171.1 | 67.8 | 0 | 0 | 0 | 111.8 | F54 S55 L56 G62 Y63 W64 | F54-N58 WeakPolarHBondContact O-CB 3.43Å; F54-N58 PolarHBondContact O-N 3.33Å; S55-N58 PolarHBondContact O-N 3.26Å; L56-N58 VanDerWaalsContact C-N 3.33Å; L56-N58 PolarHBondContact O-N 3.15Å; N58-G62 WeakPolarHBondContact O-CA 3.41Å; N58-G62 PolarHBondContact O-N 3.36Å; N58-Y63 PolarHBondContact OD1-O 2.97Å; N58-W64 HydrophobicContact CB-CE3 4.01Å; N58-W64 HydrophobicContact CB-CZ3 4.24Å; N58-W64 PolarHBondContact OD1-N 3.02Å |
| 59 | E | 89.4 | Confident | 90.4 | Very high | 58 Ų | 58 | 55.3 Ų | 55.3 | 27% | 0.271 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -67.1 | -41.5 | 177.1 | -169.4 | 61.8 | -163 | 0 | 0 | 113 | S55 L56 A57 K280 | S55-E59 WeakPolarHBondContact O-CB 3.45Å; S55-E59 PolarHBondContact O-N 2.92Å; L56-E59 WeakPolarHBondContact O-CB 3.35Å; L56-E59 PolarHBondContact O-N 2.94Å; A57-E59 VanDerWaalsContact C-N 3.29Å; A57-E59 PolarHBondContact O-N 3.41Å; E59-K280 IonicContact OE1-NZ 2.64Å; E59-K280 PolarHBondContact OE1-NZ 3.4Å; E59-K280 WeakPolarHBondContact OE2-CD 3.18Å; E59-K280 WeakPolarHBondContact OE2-CE 3.29Å; E59-K280 IonicContact OE2-NZ 3.46Å; E59-K280 PolarHBondContact OE2-NZ 3.3Å |
| 60 | L | 91.3 | Very high | 90.1 | Very high | 104 Ų | 104 | 56 Ų | 56 | 55% | 0.545 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -75.3 | -35.4 | -177.9 | -67.7 | 175.7 | 0 | 0 | 0 | 112.6 | A2 L56 A57 | A2-L60 HydrophobicContact CB-CD1 4.01Å; A2-L60 HydrophobicContact CB-CD2 4.23Å; L56-L60 HydrophobicContact CD1-CD1 3.98Å; L56-L60 HydrophobicContact CD1-CD2 4.48Å; L56-L60 HydrophobicContact CD1-CG 3.99Å; L56-L60 HydrophobicContact CD2-CD1 4.49Å; L56-L60 HydrophobicContact CG-CD1 3.92Å; L56-L60 HydrophobicContact CG-CG 4.32Å; L56-L60 WeakPolarHBondContact O-CG 3.3Å; L56-L60 PolarHBondContact O-N 3.04Å; A57-L60 PolarHBondContact O-N 3.37Å |
| 61 | M | 89.6 | Confident | 89.8 | Confident | 82 Ų | 82 | 54.1 Ų | 54.1 | 40% | 0.404 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -85.9 | -25.7 | -178.6 | -62.1 | -123.5 | -78.2 | 0 | 0 | 112.4 | A57 Y63 Y65 | A57-M61 WeakPolarHBondContact O-CB 3.49Å; A57-M61 VanDerWaalsContact O-CG 3.28Å; A57-M61 WeakPolarHBondContact O-CG 3.3Å; A57-M61 PolarHBondContact O-N 2.91Å; M61-Y63 HydrophobicContact CB-CD1 4.13Å; M61-Y63 HydrophobicContact CB-CE1 3.94Å; M61-Y63 HydrophobicContact CE-CE2 4.25Å; M61-Y63 WeakPolarHBondContact O-CD1 3.22Å; M61-Y63 PolarHBondContact O-N 3.47Å; M61-Y65 HydrophobicContact CE-CD1 4.49Å; M61-Y65 HydrophobicContact CE-CD2 4.21Å; M61-Y65 HydrophobicContact CE-CG 3.81Å |
| 62 | G | 86.4 | Confident | 89.3 | Confident | 41 Ų | 41 | 54.4 Ų | 54.4 | 42% | 0.423 | 28% | 0.284 | S | S | . | . | S | Bend | trans | 76.2 | 3 | -176.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | N58 Q148 | N58-G62 WeakPolarHBondContact O-CA 3.41Å; N58-G62 PolarHBondContact O-N 3.36Å; G62-Q148 PolarHBondContact O-NE2 3.2Å |
| 63 | Y | 84.9 | Confident | 89.1 | Confident | 68 Ų | 68 | 57.2 Ų | 57.2 | 27% | 0.267 | 30% | 0.299 | S | S | . | . | S | Bend | trans | -151.2 | 163 | 176.1 | 67.9 | -87.6 | 0 | 0 | 0 | 111.3 | N58 M61 Y65 Q146 | N58-Y63 PolarHBondContact OD1-O 2.97Å; M61-Y63 HydrophobicContact CB-CD1 4.13Å; M61-Y63 HydrophobicContact CB-CE1 3.94Å; M61-Y63 HydrophobicContact CE-CE2 4.25Å; M61-Y63 WeakPolarHBondContact O-CD1 3.22Å; M61-Y63 PolarHBondContact O-N 3.47Å; Y63-Y65 HydrophobicContact CE2-CD2 4.19Å; Y63-Q146 HydrophobicContact CG-CB 4.47Å |
| 64 | W | 88.6 | Confident | 88.9 | Confident | 7 Ų | 7 | 55.7 Ų | 55.7 | 3% | 0.027 | 29% | 0.287 | C | S | . | . | trans | -90.3 | 106.4 | -179 | -173.1 | -100.5 | 0 | 0 | 0 | 112.7 | F54 N58 F66 G67 W70 C71 Y74 P147 C149 | F54-W64 HydrophobicContact CB-CH2 4.14Å; F54-W64 HydrophobicContact CB-CZ3 4.39Å; N58-W64 HydrophobicContact CB-CE3 4.01Å; N58-W64 HydrophobicContact CB-CZ3 4.24Å; N58-W64 PolarHBondContact OD1-N 3.02Å; W64-F66 HydrophobicContact CD2-CD2 4.33Å; W64-F66 HydrophobicContact CE3-CD2 4.42Å; W64-F66 HydrophobicContact CH2-CD2 4.24Å; W64-F66 HydrophobicContact CZ2-CB 4.06Å; W64-F66 HydrophobicContact CZ2-CD2 4.15Å; W64-F66 HydrophobicContact CZ3-CD2 4.37Å; W64-G67 PolarHBondContact NE1-O 3.44Å; W64-W70 HydrophobicContact CZ2-CB 4.45Å; W64-W70 AromaticContact CZ2-CD1 3.54Å; W64-W70 HydrophobicContact CZ2-CG 4.33Å; W64-C71 HydrophobicContact CZ2-CB 4.1Å; W64-Y74 AromaticContact CH2-CD1 3.67Å; W64-Y74 HydrophobicContact CH2-CD1 3.67Å; W64-Y74 HydrophobicContact CH2-CD2 4.08Å; W64-Y74 HydrophobicContact CH2-CE1 4.26Å; W64-Y74 AromaticContact CH2-CG 3.58Å; W64-Y74 HydrophobicContact CH2-CG 3.58Å; W64-Y74 HydrophobicContact CZ2-CD1 4.44Å; W64-Y74 HydrophobicContact CZ2-CG 4.34Å; W64-Y74 HydrophobicContact CZ3-CD1 4.11Å; W64-Y74 HydrophobicContact CZ3-CE1 4.27Å; W64-Y74 HydrophobicContact CZ3-CG 4.35Å; W64-P147 WeakPolarHBondContact CB-O 3.16Å; W64-P147 PolarHBondContact N-O 3.15Å; W64-P147 WeakPolarHBondContact O-CG 3.45Å; W64-C149 HydrophobicContact CB-CB 3.84Å; W64-C149 HydrophobicContact CD2-CB 3.34Å; W64-C149 HydrophobicContact CE3-CB 3.49Å; W64-C149 VanDerWaalsContact CE3-CB 3.49Å; W64-C149 HydrophobicContact CG-CB 3.51Å; W64-C149 HydrophobicContact CZ2-CB 4.49Å; W64-C149 HydrophobicContact CZ3-CB 4.15Å | ||
| 65 | Y | 89.1 | Confident | 88.6 | Confident | 158 Ų | 158 | 54.8 Ų | 54.8 | 62% | 0.62 | 28% | 0.284 | S | S | * | . | trans | -82.2 | -27.9 | -177.9 | 179.6 | -100.9 | 0 | 0 | 0 | 114.6 | M61 Y63 G67 | M61-Y65 HydrophobicContact CE-CD1 4.49Å; M61-Y65 HydrophobicContact CE-CD2 4.21Å; M61-Y65 HydrophobicContact CE-CG 3.81Å; Y63-Y65 HydrophobicContact CE2-CD2 4.19Å; Y65-G67 PolarHBondContact O-N 2.93Å; Y65-G67 VanDerWaalsContact O-N 3.08Å | ||
| 66 | F | 88.6 | Confident | 88.5 | Confident | 79 Ų | 79 | 54.7 Ų | 54.7 | 35% | 0.346 | 28% | 0.284 | S | S | . | . | S | Bend | trans | -80.1 | 8.5 | -164.3 | -54.9 | -80.5 | 0 | 0 | 0 | 115.4 | F54 A57 W64 W70 | F54-F66 HydrophobicContact CD1-CD1 4.19Å; F54-F66 AromaticContact CD1-CD2 3.92Å; F54-F66 HydrophobicContact CD1-CD2 3.92Å; F54-F66 AromaticContact CD1-CE1 4Å; F54-F66 HydrophobicContact CD1-CE1 4Å; F54-F66 AromaticContact CD1-CE2 3.73Å; F54-F66 HydrophobicContact CD1-CE2 3.73Å; F54-F66 HydrophobicContact CD1-CG 4.15Å; F54-F66 AromaticContact CD1-CZ 3.77Å; F54-F66 HydrophobicContact CD1-CZ 3.77Å; F54-F66 HydrophobicContact CE1-CD1 4.1Å; F54-F66 AromaticContact CE1-CE1 3.95Å; F54-F66 HydrophobicContact CE1-CE1 3.95Å; F54-F66 HydrophobicContact CE1-CE2 4.49Å; F54-F66 HydrophobicContact CE1-CG 4.44Å; F54-F66 HydrophobicContact CE1-CZ 4.15Å; A57-F66 HydrophobicContact CB-CE2 3.91Å; A57-F66 HydrophobicContact CB-CZ 4Å; W64-F66 HydrophobicContact CD2-CD2 4.33Å; W64-F66 HydrophobicContact CE3-CD2 4.42Å; W64-F66 HydrophobicContact CH2-CD2 4.24Å; W64-F66 HydrophobicContact CZ2-CB 4.06Å; W64-F66 HydrophobicContact CZ2-CD2 4.15Å; W64-F66 HydrophobicContact CZ3-CD2 4.37Å; F66-W70 HydrophobicContact CB-CB 3.88Å; F66-W70 VanDerWaalsContact CB-CD1 3.42Å; F66-W70 HydrophobicContact CB-CG 3.89Å; F66-W70 AromaticContact CG-CD1 3.88Å; F66-W70 VanDerWaalsContact O-CB 3.25Å; F66-W70 WeakPolarHBondContact O-CB 3.21Å |
| 67 | G | 85.7 | Confident | 88.5 | Confident | 38 Ų | 38 | 55.6 Ų | 55.6 | 39% | 0.392 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | 76.9 | 168.1 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | W64 Y65 W70 C71 | W64-G67 PolarHBondContact NE1-O 3.44Å; Y65-G67 PolarHBondContact O-N 2.93Å; Y65-G67 VanDerWaalsContact O-N 3.08Å; G67-W70 PolarHBondContact O-N 3.45Å; G67-C71 PolarHBondContact O-N 3.39Å; G67-C71 VanDerWaalsContact O-N 3.15Å |
| 68 | K | 82.9 | Confident | 88.5 | Confident | 142 Ų | 142 | 54.8 Ų | 54.8 | 62% | 0.617 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -65.4 | -41.4 | -172.1 | -65.9 | -175.3 | 177.3 | -174.3 | 0 | 113.5 | W70 C71 G72 | K68-W70 VanDerWaalsContact C-N 3.35Å; K68-W70 PolarHBondContact O-N 3.17Å; K68-C71 WeakPolarHBondContact O-CB 3.38Å; K68-C71 PolarHBondContact O-N 3.45Å; K68-G72 PolarHBondContact O-N 3.09Å; K68-G72 VanDerWaalsContact O-N 3.13Å |
| 69 | V | 84.8 | Confident | 88.5 | Confident | 100 Ų | 100 | 54.2 Ų | 54.2 | 61% | 0.606 | 28% | 0.278 | S | S | * | . | H | α-helix | trans | -61.5 | -45.1 | -179.8 | 179 | 0 | 0 | 0 | 0 | 110.8 | C71 G72 I73 | V69-C71 VanDerWaalsContact C-N 3.33Å; V69-C71 PolarHBondContact O-N 3.37Å; V69-G72 PolarHBondContact O-N 2.75Å; V69-I73 HydrophobicContact CG1-CD1 4.03Å; V69-I73 WeakPolarHBondContact O-CG1 3.39Å; V69-I73 PolarHBondContact O-N 2.88Å; V69-I73 VanDerWaalsContact O-N 3.14Å |
| 70 | W | 89 | Confident | 88.7 | Confident | 78 Ų | 78 | 52.6 Ų | 52.6 | 30% | 0.295 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -68 | -33.6 | 177.8 | -165 | -110.7 | 0 | 0 | 0 | 112.1 | F54 W64 F66 G67 K68 I73 Y74 | F54-W70 AromaticContact CD1-CD1 3.95Å; F54-W70 AromaticContact CD1-NE1 3.2Å; F54-W70 HydrophobicContact CD2-CZ2 4.45Å; F54-W70 AromaticContact CE1-CE2 3.76Å; F54-W70 AromaticContact CE1-CZ2 3.98Å; F54-W70 HydrophobicContact CE1-CZ2 3.98Å; F54-W70 AromaticContact CE1-NE1 3.14Å; F54-W70 AromaticContact CE2-CZ2 3.74Å; F54-W70 HydrophobicContact CE2-CZ2 3.74Å; F54-W70 AromaticContact CE2-NE1 3.98Å; F54-W70 AromaticContact CG-NE1 3.66Å; F54-W70 AromaticContact CZ-CE2 3.75Å; F54-W70 AromaticContact CZ-CZ2 3.46Å; F54-W70 HydrophobicContact CZ-CZ2 3.46Å; F54-W70 VanDerWaalsContact CZ-CZ2 3.46Å; F54-W70 AromaticContact CZ-NE1 3.55Å; W64-W70 HydrophobicContact CZ2-CB 4.45Å; W64-W70 AromaticContact CZ2-CD1 3.54Å; W64-W70 HydrophobicContact CZ2-CG 4.33Å; F66-W70 HydrophobicContact CB-CB 3.88Å; F66-W70 VanDerWaalsContact CB-CD1 3.42Å; F66-W70 HydrophobicContact CB-CG 3.89Å; F66-W70 AromaticContact CG-CD1 3.88Å; F66-W70 VanDerWaalsContact O-CB 3.25Å; F66-W70 WeakPolarHBondContact O-CB 3.21Å; G67-W70 PolarHBondContact O-N 3.45Å; K68-W70 VanDerWaalsContact C-N 3.35Å; K68-W70 PolarHBondContact O-N 3.17Å; W70-I73 HydrophobicContact CE3-CB 4.45Å; W70-I73 HydrophobicContact CE3-CD1 4.22Å; W70-I73 HydrophobicContact CE3-CG2 4.38Å; W70-I73 HydrophobicContact CZ3-CD1 4.49Å; W70-I73 HydrophobicContact CZ3-CG2 4.21Å; W70-I73 PolarHBondContact O-N 3.12Å; W70-Y74 WeakPolarHBondContact O-CB 3.45Å; W70-Y74 PolarHBondContact O-N 3.04Å |
| 71 | C | 88.4 | Confident | 88.9 | Confident | 18 Ų | 18 | 47.9 Ų | 47.9 | 12% | 0.122 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -58.6 | -48.7 | 173.8 | 177.1 | 0 | 0 | 0 | 0 | 111.6 | W64 G67 K68 V69 I73 Y74 L75 C149 | W64-C71 HydrophobicContact CZ2-CB 4.1Å; G67-C71 PolarHBondContact O-N 3.39Å; G67-C71 VanDerWaalsContact O-N 3.15Å; K68-C71 WeakPolarHBondContact O-CB 3.38Å; K68-C71 PolarHBondContact O-N 3.45Å; V69-C71 VanDerWaalsContact C-N 3.33Å; V69-C71 PolarHBondContact O-N 3.37Å; C71-I73 PolarHBondContact O-N 3Å; C71-Y74 PolarHBondContact O-N 2.94Å; C71-L75 WeakPolarHBondContact O-CG 3.49Å; C71-L75 PolarHBondContact O-N 2.99Å; C71-C149 WeakPolarHBondContact CA-SG 3.26Å; C71-C149 HydrophobicContact CB-CB 3.87Å; C71-C149 WeakPolarHBondContact CB-SG 3.42Å; C71-C149 WeakPolarHBondContact SG-CA 3.28Å; C71-C149 WeakPolarHBondContact SG-CB 3.5Å; C71-C149 CovalentContact SG-SG 2.03Å; C71-C149 PolarHBondContact SG-SG 3.42Å |
| 72 | G | 85.2 | Confident | 89 | Confident | 6 Ų | 6 | 44.4 Ų | 44.4 | 6% | 0.062 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -61 | -43.8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | K68 V69 A76 | K68-G72 PolarHBondContact O-N 3.09Å; K68-G72 VanDerWaalsContact O-N 3.13Å; V69-G72 PolarHBondContact O-N 2.75Å; G72-A76 VanDerWaalsContact O-CB 3.31Å; G72-A76 WeakPolarHBondContact O-CB 3.29Å; G72-A76 PolarHBondContact O-N 3Å |
| 73 | I | 89.3 | Confident | 89.3 | Confident | 60 Ų | 60 | 42.5 Ų | 42.5 | 31% | 0.308 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -63.6 | -46.1 | 176 | -65.9 | 169.2 | 0 | 0 | 0 | 110.9 | V69 W70 C71 A76 L77 L134 | V69-I73 HydrophobicContact CG1-CD1 4.03Å; V69-I73 WeakPolarHBondContact O-CG1 3.39Å; V69-I73 PolarHBondContact O-N 2.88Å; V69-I73 VanDerWaalsContact O-N 3.14Å; W70-I73 HydrophobicContact CE3-CB 4.45Å; W70-I73 HydrophobicContact CE3-CD1 4.22Å; W70-I73 HydrophobicContact CE3-CG2 4.38Å; W70-I73 HydrophobicContact CZ3-CD1 4.49Å; W70-I73 HydrophobicContact CZ3-CG2 4.21Å; W70-I73 PolarHBondContact O-N 3.12Å; C71-I73 PolarHBondContact O-N 3Å; I73-A76 PolarHBondContact O-N 3.18Å; I73-L77 HydrophobicContact CG2-CD1 3.8Å; I73-L77 HydrophobicContact CG2-CG 4.12Å; I73-L77 WeakPolarHBondContact O-CB 3.41Å; I73-L77 VanDerWaalsContact O-CG 3.26Å; I73-L77 WeakPolarHBondContact O-CG 3.39Å; I73-L77 PolarHBondContact O-N 3.05Å; I73-L134 HydrophobicContact CG1-CD2 4.35Å |
| 74 | Y | 91.5 | Very high | 89.7 | Confident | 15 Ų | 15 | 39.2 Ų | 39.2 | 6% | 0.059 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -57.9 | -49.8 | 179 | 161 | -98.9 | 0 | 0 | 0 | 111.6 | V51 F54 S55 W64 W70 C71 A76 L77 D78 | V51-Y74 HydrophobicContact CB-CE2 4.44Å; V51-Y74 HydrophobicContact CG1-CD2 4.26Å; V51-Y74 HydrophobicContact CG1-CE2 3.64Å; F54-Y74 HydrophobicContact CB-CD2 3.96Å; F54-Y74 HydrophobicContact CB-CE2 4.08Å; S55-Y74 WeakPolarHBondContact OG-CE2 3.31Å; S55-Y74 PolarHBondContact OG-OH 3.47Å; W64-Y74 AromaticContact CH2-CD1 3.67Å; W64-Y74 HydrophobicContact CH2-CD1 3.67Å; W64-Y74 HydrophobicContact CH2-CD2 4.08Å; W64-Y74 HydrophobicContact CH2-CE1 4.26Å; W64-Y74 AromaticContact CH2-CG 3.58Å; W64-Y74 HydrophobicContact CH2-CG 3.58Å; W64-Y74 HydrophobicContact CZ2-CD1 4.44Å; W64-Y74 HydrophobicContact CZ2-CG 4.34Å; W64-Y74 HydrophobicContact CZ3-CD1 4.11Å; W64-Y74 HydrophobicContact CZ3-CE1 4.27Å; W64-Y74 HydrophobicContact CZ3-CG 4.35Å; W70-Y74 WeakPolarHBondContact O-CB 3.45Å; W70-Y74 PolarHBondContact O-N 3.04Å; C71-Y74 PolarHBondContact O-N 2.94Å; Y74-A76 VanDerWaalsContact C-N 3.35Å; Y74-A76 PolarHBondContact O-N 3.04Å; Y74-L77 PolarHBondContact O-N 3.28Å; Y74-D78 WeakPolarHBondContact O-CB 3.48Å; Y74-D78 PolarHBondContact O-N 2.78Å |
| 75 | L | 88.5 | Confident | 90 | Very high | 21 Ų | 21 | 39.1 Ų | 39.1 | 11% | 0.11 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -63.4 | -40.8 | 178.1 | -67.5 | 174.5 | 0 | 0 | 0 | 111.7 | C71 D78 V79 P133 E150 L151 | C71-L75 WeakPolarHBondContact O-CG 3.49Å; C71-L75 PolarHBondContact O-N 2.99Å; L75-D78 PolarHBondContact O-N 3.3Å; L75-V79 WeakPolarHBondContact O-CG2 3.41Å; L75-V79 PolarHBondContact O-N 3.19Å; L75-V79 VanDerWaalsContact O-N 3.11Å; L75-P133 HydrophobicContact CB-CB 4.26Å; L75-E150 WeakPolarHBondContact CD1-O 3.31Å; L75-L151 HydrophobicContact CD2-CD2 4.22Å; L75-L151 HydrophobicContact CD2-CG 4.15Å |
| 76 | A | 90.6 | Very high | 90.1 | Very high | 8 Ų | 8 | 31.6 Ų | 31.6 | 7% | 0.066 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -64.9 | -42 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | G72 I73 Y74 L80 P133 L134 | G72-A76 VanDerWaalsContact O-CB 3.31Å; G72-A76 WeakPolarHBondContact O-CB 3.29Å; G72-A76 PolarHBondContact O-N 3Å; I73-A76 PolarHBondContact O-N 3.18Å; Y74-A76 VanDerWaalsContact C-N 3.35Å; Y74-A76 PolarHBondContact O-N 3.04Å; A76-L80 WeakPolarHBondContact O-CB 3.39Å; A76-L80 PolarHBondContact O-N 2.9Å; A76-P133 HydrophobicContact CB-CB 4.31Å; A76-L134 HydrophobicContact CB-CD1 4.19Å; A76-L134 HydrophobicContact CB-CD2 3.76Å; A76-L134 HydrophobicContact CB-CG 3.7Å |
| 77 | L | 92.8 | Very high | 90.3 | Very high | 33 Ų | 33 | 28.7 Ų | 28.7 | 17% | 0.173 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -66.4 | -41.3 | 177.3 | -73.5 | 179.2 | 0 | 0 | 0 | 112 | L50 V51 I73 Y74 L80 F81 | L50-L77 HydrophobicContact CB-CD1 4.26Å; L50-L77 HydrophobicContact CD1-CD1 4.28Å; V51-L77 HydrophobicContact CG2-CB 4.32Å; I73-L77 HydrophobicContact CG2-CD1 3.8Å; I73-L77 HydrophobicContact CG2-CG 4.12Å; I73-L77 WeakPolarHBondContact O-CB 3.41Å; I73-L77 VanDerWaalsContact O-CG 3.26Å; I73-L77 WeakPolarHBondContact O-CG 3.39Å; I73-L77 PolarHBondContact O-N 3.05Å; Y74-L77 PolarHBondContact O-N 3.28Å; L77-L80 HydrophobicContact CD2-CD2 4.16Å; L77-L80 WeakPolarHBondContact O-CB 3.49Å; L77-L80 PolarHBondContact O-N 3.46Å; L77-F81 HydrophobicContact CB-CD2 4.32Å; L77-F81 HydrophobicContact CB-CE2 3.84Å; L77-F81 HydrophobicContact CB-CZ 4.46Å; L77-F81 HydrophobicContact CD2-CE2 4.02Å; L77-F81 HydrophobicContact CD2-CZ 3.77Å; L77-F81 HydrophobicContact CG-CE2 4.37Å; L77-F81 WeakPolarHBondContact O-CD2 2.94Å; L77-F81 VanDerWaalsContact O-CG 3.28Å; L77-F81 WeakPolarHBondContact O-CG 3.41Å; L77-F81 PolarHBondContact O-N 2.97Å |
| 78 | D | 91.7 | Very high | 90.7 | Very high | 8 Ų | 8 | 26.9 Ų | 26.9 | 4% | 0.043 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -59.1 | -52.2 | 176.6 | -177.9 | 59.4 | 0 | 0 | 0 | 111.5 | V51 Y74 L75 L80 F81 C82 F283 Y287 | V51-D78 HydrophobicContact CG1-CB 3.94Å; V51-D78 WeakPolarHBondContact CG1-OD1 2.87Å; Y74-D78 WeakPolarHBondContact O-CB 3.48Å; Y74-D78 PolarHBondContact O-N 2.78Å; L75-D78 PolarHBondContact O-N 3.3Å; D78-L80 VanDerWaalsContact C-N 3.34Å; D78-L80 PolarHBondContact O-N 3.43Å; D78-F81 PolarHBondContact O-N 3.35Å; D78-C82 WeakPolarHBondContact O-CB 3.36Å; D78-C82 PolarHBondContact O-N 3.5Å; D78-F283 VanDerWaalsContact OD2-CZ 3.22Å; D78-F283 WeakPolarHBondContact OD2-CZ 3.01Å; D78-Y287 WeakPolarHBondContact OD1-CE1 3.35Å; D78-Y287 PolarHBondContact OD1-OH 3.36Å |
| 79 | V | 90.3 | Very high | 91.1 | Very high | 14 Ų | 14 | 20.3 Ų | 20.3 | 9% | 0.085 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -63.3 | -40.5 | 176.4 | 177.4 | 0 | 0 | 0 | 0 | 111.1 | L75 T83 | L75-V79 WeakPolarHBondContact O-CG2 3.41Å; L75-V79 PolarHBondContact O-N 3.19Å; L75-V79 VanDerWaalsContact O-N 3.11Å; V79-T83 WeakPolarHBondContact O-CB 3.36Å; V79-T83 PolarHBondContact O-N 3.16Å; V79-T83 PolarHBondContact O-OG1 3.47Å |
| 80 | L | 93.5 | Very high | 91.4 | Very high | 24 Ų | 24 | 16.1 Ų | 16.1 | 13% | 0.126 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -58.1 | -51.6 | 178 | 172.8 | 63.1 | 0 | 0 | 0 | 111.5 | A76 L77 D78 T83 S84 W123 A127 S130 | A76-L80 WeakPolarHBondContact O-CB 3.39Å; A76-L80 PolarHBondContact O-N 2.9Å; L77-L80 HydrophobicContact CD2-CD2 4.16Å; L77-L80 WeakPolarHBondContact O-CB 3.49Å; L77-L80 PolarHBondContact O-N 3.46Å; D78-L80 VanDerWaalsContact C-N 3.34Å; D78-L80 PolarHBondContact O-N 3.43Å; L80-T83 PolarHBondContact O-N 3.19Å; L80-S84 WeakPolarHBondContact O-CB 3.19Å; L80-S84 PolarHBondContact O-N 3.16Å; L80-W123 HydrophobicContact CD1-CE3 4.4Å; L80-W123 HydrophobicContact CD1-CZ3 4.48Å; L80-W123 HydrophobicContact CD2-CZ3 4.35Å; L80-W123 HydrophobicContact CG-CZ3 4.28Å; L80-A127 HydrophobicContact CD1-CB 4.06Å; L80-S130 WeakPolarHBondContact CB-OG 3.47Å |
| 81 | F | 94.9 | Very high | 91.6 | Very high | 6 Ų | 6 | 13 Ų | 13 | 3% | 0.026 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -74.4 | -33.8 | -174.4 | -60.5 | -42.8 | 0 | 0 | 0 | 112.3 | L46 V47 L50 V51 L77 D78 S85 W123 | L46-F81 HydrophobicContact CB-CD1 4.23Å; L46-F81 HydrophobicContact CB-CD2 4.23Å; L46-F81 HydrophobicContact CB-CE1 3.71Å; L46-F81 HydrophobicContact CB-CE2 3.71Å; L46-F81 HydrophobicContact CB-CG 4.49Å; L46-F81 HydrophobicContact CB-CZ 3.43Å; L46-F81 VanDerWaalsContact CB-CZ 3.43Å; L46-F81 HydrophobicContact CD1-CD1 4.43Å; L46-F81 HydrophobicContact CD1-CE1 3.58Å; L46-F81 HydrophobicContact CD1-CZ 3.86Å; L46-F81 HydrophobicContact CG-CE1 4.27Å; L46-F81 HydrophobicContact CG-CZ 4.16Å; V47-F81 HydrophobicContact CG2-CB 3.28Å; V47-F81 HydrophobicContact CG2-CD2 3.88Å; V47-F81 HydrophobicContact CG2-CG 3.88Å; L50-F81 HydrophobicContact CB-CE2 4.49Å; L50-F81 HydrophobicContact CD1-CE2 4.44Å; L50-F81 HydrophobicContact CD1-CZ 4.32Å; V51-F81 HydrophobicContact CG2-CD2 3.91Å; V51-F81 HydrophobicContact CG2-CE2 4.15Å; L77-F81 HydrophobicContact CB-CD2 4.32Å; L77-F81 HydrophobicContact CB-CE2 3.84Å; L77-F81 HydrophobicContact CB-CZ 4.46Å; L77-F81 HydrophobicContact CD2-CE2 4.02Å; L77-F81 HydrophobicContact CD2-CZ 3.77Å; L77-F81 HydrophobicContact CG-CE2 4.37Å; L77-F81 WeakPolarHBondContact O-CD2 2.94Å; L77-F81 VanDerWaalsContact O-CG 3.28Å; L77-F81 WeakPolarHBondContact O-CG 3.41Å; L77-F81 PolarHBondContact O-N 2.97Å; D78-F81 PolarHBondContact O-N 3.35Å; F81-S85 WeakPolarHBondContact O-CB 3.25Å; F81-S85 PolarHBondContact O-N 3.44Å; F81-S85 PolarHBondContact O-OG 3.48Å; F81-W123 AromaticContact CD1-CH2 3.93Å; F81-W123 HydrophobicContact CD1-CH2 3.93Å; F81-W123 AromaticContact CD1-CZ3 3.94Å; F81-W123 HydrophobicContact CD1-CZ3 3.94Å; F81-W123 AromaticContact CE1-CH2 3.99Å; F81-W123 HydrophobicContact CE1-CH2 3.99Å; F81-W123 AromaticContact CE1-CZ3 3.92Å; F81-W123 HydrophobicContact CE1-CZ3 3.92Å |
| 82 | C | 91.9 | Very high | 91.7 | Very high | 9 Ų | 9 | 12.5 Ų | 12.5 | 6% | 0.061 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -62.3 | -49.3 | 169.9 | -179.8 | 0 | 0 | 0 | 0 | 111.2 | D78 S84 S85 I86 W255 | D78-C82 WeakPolarHBondContact O-CB 3.36Å; D78-C82 PolarHBondContact O-N 3.5Å; C82-S84 PolarHBondContact O-N 3.42Å; C82-S85 WeakPolarHBondContact O-CB 3.15Å; C82-S85 PolarHBondContact O-N 3.4Å; C82-I86 PolarHBondContact O-N 2.97Å; C82-W255 HydrophobicContact CB-CH2 3.97Å; C82-W255 HydrophobicContact CB-CZ2 4.14Å; C82-W255 HydrophobicContact CB-CZ3 4.42Å |
| 83 | T | 92.9 | Very high | 91.8 | Very high | 0 Ų | 0 | 12.2 Ų | 12.2 | 0% | 0 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -62 | -45.8 | 178.5 | -55.1 | 0 | 0 | 0 | 0 | 110.9 | V79 L80 S85 I86 V87 I129 S165 | V79-T83 WeakPolarHBondContact O-CB 3.36Å; V79-T83 PolarHBondContact O-N 3.16Å; V79-T83 PolarHBondContact O-OG1 3.47Å; L80-T83 PolarHBondContact O-N 3.19Å; T83-S85 VanDerWaalsContact C-N 3.28Å; T83-S85 PolarHBondContact O-N 3.23Å; T83-I86 WeakPolarHBondContact O-CG2 3.43Å; T83-I86 PolarHBondContact O-N 3.29Å; T83-V87 HydrophobicContact CG2-CG2 4.14Å; T83-V87 WeakPolarHBondContact O-CB 3.35Å; T83-V87 VanDerWaalsContact O-CG2 3.22Å; T83-V87 WeakPolarHBondContact O-CG2 3.44Å; T83-V87 PolarHBondContact O-N 3.41Å; T83-I129 HydrophobicContact CG2-CB 4.25Å; T83-I129 HydrophobicContact CG2-CD1 3.99Å; T83-I129 HydrophobicContact CG2-CG2 4.21Å; T83-S165 VanDerWaalsContact OG1-CB 3.29Å; T83-S165 WeakPolarHBondContact OG1-CB 3.33Å; T83-S165 PolarHBondContact OG1-OG 3.36Å |
| 84 | S | 94.7 | Very high | 91.8 | Very high | 0 Ų | 0 | 11.6 Ų | 11.6 | 0% | 0 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -57.3 | -43.7 | 176 | -176.2 | 0 | 0 | 0 | 0 | 111 | L80 C82 V87 H88 S126 | L80-S84 WeakPolarHBondContact O-CB 3.19Å; L80-S84 PolarHBondContact O-N 3.16Å; C82-S84 PolarHBondContact O-N 3.42Å; S84-V87 PolarHBondContact O-N 3.15Å; S84-H88 VanDerWaalsContact O-CB 3.3Å; S84-H88 WeakPolarHBondContact O-CB 3.49Å; S84-H88 PolarHBondContact O-N 3.24Å; S84-H88 PolarHBondContact O-ND1 2.64Å; S84-H88 PolarHBondContact OG-CE1 2.98Å; S84-H88 PolarHBondContact OG-ND1 3.1Å; S84-H88 VanDerWaalsContact OG-ND1 3.11Å; S84-S126 WeakPolarHBondContact CA-OG 3.4Å; S84-S126 PolarHBondContact N-OG 2.96Å |
| 85 | S | 93.4 | Very high | 91.7 | Very high | 4 Ų | 4 | 11 Ų | 11 | 3% | 0.028 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -60.4 | -50.2 | 179.8 | -62.5 | 0 | 0 | 0 | 0 | 112.4 | F81 C82 T83 H88 L89 | F81-S85 WeakPolarHBondContact O-CB 3.25Å; F81-S85 PolarHBondContact O-N 3.44Å; F81-S85 PolarHBondContact O-OG 3.48Å; C82-S85 WeakPolarHBondContact O-CB 3.15Å; C82-S85 PolarHBondContact O-N 3.4Å; T83-S85 VanDerWaalsContact C-N 3.28Å; T83-S85 PolarHBondContact O-N 3.23Å; S85-H88 PolarHBondContact O-N 3.42Å; S85-L89 WeakPolarHBondContact O-CG 3.35Å; S85-L89 PolarHBondContact O-N 3.3Å |
| 86 | I | 91.8 | Very high | 91.4 | Very high | 0 Ų | 0 | 11.8 Ų | 11.8 | 0% | 0 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -68.1 | -38.8 | 179.9 | -159.9 | 172.8 | 0 | 0 | 0 | 112 | C82 T83 H88 L89 C90 S165 F166 P169 C170 M173 F251 | C82-I86 PolarHBondContact O-N 2.97Å; T83-I86 WeakPolarHBondContact O-CG2 3.43Å; T83-I86 PolarHBondContact O-N 3.29Å; I86-H88 VanDerWaalsContact C-N 3.32Å; I86-H88 PolarHBondContact O-N 3.04Å; I86-L89 WeakPolarHBondContact O-CB 3.41Å; I86-L89 PolarHBondContact O-N 2.76Å; I86-L89 VanDerWaalsContact O-N 3.14Å; I86-C90 PolarHBondContact O-N 3.45Å; I86-C90 PolarHBondContact O-SG 2.97Å; I86-S165 WeakPolarHBondContact CG2-O 3.46Å; I86-F166 HydrophobicContact CD1-CD2 3.93Å; I86-F166 HydrophobicContact CD1-CE2 4.45Å; I86-F166 WeakPolarHBondContact CD1-O 3.48Å; I86-P169 HydrophobicContact CB-CB 4.5Å; I86-P169 HydrophobicContact CD1-CB 3.89Å; I86-P169 HydrophobicContact CG1-CB 3.93Å; I86-P169 HydrophobicContact CG2-CB 3.84Å; I86-P169 HydrophobicContact CG2-CG 3.99Å; I86-C170 HydrophobicContact CD1-CB 4.14Å; I86-M173 HydrophobicContact CD1-CE 4Å; I86-M173 HydrophobicContact CG1-CE 3.61Å; I86-F251 HydrophobicContact CB-CE1 3.72Å; I86-F251 HydrophobicContact CB-CE2 4.45Å; I86-F251 HydrophobicContact CB-CZ 3.68Å; I86-F251 HydrophobicContact CD1-CD1 4.21Å; I86-F251 HydrophobicContact CD1-CE1 3.66Å; I86-F251 HydrophobicContact CD1-CZ 4.47Å; I86-F251 HydrophobicContact CG1-CD1 4.16Å; I86-F251 HydrophobicContact CG1-CE1 3.7Å; I86-F251 HydrophobicContact CG1-CZ 4.2Å |
| 87 | V | 93.5 | Very high | 91.2 | Very high | 19 Ų | 19 | 14.5 Ų | 14.5 | 12% | 0.115 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -70.3 | -32.5 | -179.9 | -178.9 | 0 | 0 | 0 | 0 | 110.6 | T83 S84 C90 A91 V122 P169 | T83-V87 HydrophobicContact CG2-CG2 4.14Å; T83-V87 WeakPolarHBondContact O-CB 3.35Å; T83-V87 VanDerWaalsContact O-CG2 3.22Å; T83-V87 WeakPolarHBondContact O-CG2 3.44Å; T83-V87 PolarHBondContact O-N 3.41Å; S84-V87 PolarHBondContact O-N 3.15Å; V87-C90 WeakPolarHBondContact O-CB 3.37Å; V87-C90 PolarHBondContact O-N 2.87Å; V87-A91 PolarHBondContact O-N 3.04Å; V87-V122 HydrophobicContact CB-CG1 3.91Å; V87-V122 HydrophobicContact CG1-CB 4.21Å; V87-V122 HydrophobicContact CG1-CG1 3.65Å; V87-V122 HydrophobicContact CG1-CG2 3.96Å; V87-P169 HydrophobicContact CG2-CG 4.43Å |
| 88 | H | 93.9 | Very high | 90.9 | Very high | 0 Ų | 0 | 17.3 Ų | 17.3 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -63 | -43.5 | 168.3 | -82.5 | 91.8 | 0 | 0 | 0 | 111.6 | S39 L40 S84 S85 I86 C90 A91 I92 V122 W123 | S39-H88 WeakPolarHBondContact CB-NE2 3.24Å; S39-H88 PolarHBondContact OG-CE1 3.24Å; S39-H88 PolarHBondContact OG-NE2 3.44Å; L40-H88 HydrophobicContact CD1-CB 4.06Å; S84-H88 VanDerWaalsContact O-CB 3.3Å; S84-H88 WeakPolarHBondContact O-CB 3.49Å; S84-H88 PolarHBondContact O-N 3.24Å; S84-H88 PolarHBondContact O-ND1 2.64Å; S84-H88 PolarHBondContact OG-CE1 2.98Å; S84-H88 PolarHBondContact OG-ND1 3.1Å; S84-H88 VanDerWaalsContact OG-ND1 3.11Å; S85-H88 PolarHBondContact O-N 3.42Å; I86-H88 VanDerWaalsContact C-N 3.32Å; I86-H88 PolarHBondContact O-N 3.04Å; H88-C90 VanDerWaalsContact C-N 3.31Å; H88-C90 PolarHBondContact O-N 3.4Å; H88-A91 PolarHBondContact O-N 3.03Å; H88-I92 VanDerWaalsContact O-CG1 3.24Å; H88-I92 WeakPolarHBondContact O-CG1 3.38Å; H88-I92 PolarHBondContact O-N 2.88Å; H88-V122 WeakPolarHBondContact CE1-CG1 3.09Å; H88-V122 VanDerWaalsContact ND1-CG1 3.31Å; H88-V122 WeakPolarHBondContact ND1-CG1 3.39Å; H88-W123 AromaticContact CE1-NE1 3.65Å; H88-W123 AromaticContact NE2-NE1 3.89Å |
| 89 | L | 90.5 | Very high | 90.5 | Very high | 4 Ų | 4 | 17.4 Ų | 17.4 | 2% | 0.021 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -61.9 | -39.5 | 174.7 | -67.1 | 175.4 | 0 | 0 | 0 | 111.6 | L40 S85 I86 I92 S93 M173 V247 M248 F251 | L40-L89 HydrophobicContact CD2-CD2 4.11Å; S85-L89 WeakPolarHBondContact O-CG 3.35Å; S85-L89 PolarHBondContact O-N 3.3Å; I86-L89 WeakPolarHBondContact O-CB 3.41Å; I86-L89 PolarHBondContact O-N 2.76Å; I86-L89 VanDerWaalsContact O-N 3.14Å; L89-I92 PolarHBondContact O-N 2.86Å; L89-S93 WeakPolarHBondContact O-CB 3.45Å; L89-S93 PolarHBondContact O-N 3.2Å; L89-M173 HydrophobicContact CB-CE 4.45Å; L89-M173 HydrophobicContact CB-SD 3.51Å; L89-M173 VanDerWaalsContact CB-SD 3.51Å; L89-V247 HydrophobicContact CD2-CG1 3.67Å; L89-M248 HydrophobicContact CB-CG 4.37Å; L89-M248 HydrophobicContact CD2-CG 4.43Å; L89-M248 WeakPolarHBondContact O-CE 3.33Å; L89-F251 HydrophobicContact CD1-CB 3.66Å; L89-F251 HydrophobicContact CD1-CD1 4.37Å; L89-F251 HydrophobicContact CD1-CD2 3.58Å; L89-F251 HydrophobicContact CD1-CE2 4.39Å; L89-F251 HydrophobicContact CD1-CG 3.59Å |
| 90 | C | 91.8 | Very high | 89.9 | Confident | 11 Ų | 11 | 17.2 Ų | 17.2 | 7% | 0.074 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -58 | -50.7 | 170.4 | -67.4 | 0 | 0 | 0 | 0 | 111.6 | I86 V87 H88 I92 S93 L94 P169 M173 | I86-C90 PolarHBondContact O-N 3.45Å; I86-C90 PolarHBondContact O-SG 2.97Å; V87-C90 WeakPolarHBondContact O-CB 3.37Å; V87-C90 PolarHBondContact O-N 2.87Å; H88-C90 VanDerWaalsContact C-N 3.31Å; H88-C90 PolarHBondContact O-N 3.4Å; C90-I92 VanDerWaalsContact C-N 3.32Å; C90-I92 PolarHBondContact O-N 3.45Å; C90-S93 WeakPolarHBondContact O-CB 3.25Å; C90-S93 PolarHBondContact O-N 3.45Å; C90-S93 VanDerWaalsContact O-N 3.11Å; C90-S93 PolarHBondContact O-OG 3.45Å; C90-L94 WeakPolarHBondContact O-CG 3.34Å; C90-L94 PolarHBondContact O-N 2.85Å; C90-P169 VanDerWaalsContact SG-CB 3.54Å; C90-P169 PolarHBondContact SG-O 3.01Å; C90-M173 HydrophobicContact CB-CG 4.18Å; C90-M173 WeakPolarHBondContact SG-CG 3.32Å |
| 91 | A | 92.1 | Very high | 89.3 | Confident | 13 Ų | 13 | 17.7 Ų | 17.7 | 11% | 0.107 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -60.3 | -42.1 | 179.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | F36 V87 H88 S93 L94 D95 I118 V122 | F36-A91 HydrophobicContact CE1-CB 4.11Å; F36-A91 HydrophobicContact CZ-CB 4.5Å; V87-A91 PolarHBondContact O-N 3.04Å; H88-A91 PolarHBondContact O-N 3.03Å; A91-S93 VanDerWaalsContact C-N 3.35Å; A91-L94 PolarHBondContact O-N 3.03Å; A91-D95 WeakPolarHBondContact O-CB 3.48Å; A91-D95 PolarHBondContact O-N 2.71Å; A91-I118 HydrophobicContact CB-CG2 4.24Å; A91-V122 HydrophobicContact CB-CG2 4.13Å |
| 92 | I | 90.1 | Very high | 88.6 | Confident | 8 Ų | 8 | 22 Ų | 22 | 4% | 0.041 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -62.2 | -42.6 | 174.5 | -67.2 | 163.7 | 0 | 0 | 0 | 110.6 | F36 L37 H88 L89 C90 L94 R96 L244 | F36-I92 HydrophobicContact CB-CD1 3.99Å; F36-I92 HydrophobicContact CB-CG1 3.61Å; F36-I92 HydrophobicContact CD2-CG1 4.34Å; F36-I92 HydrophobicContact CG-CG1 4.04Å; L37-I92 HydrophobicContact CD2-CD1 4.15Å; H88-I92 VanDerWaalsContact O-CG1 3.24Å; H88-I92 WeakPolarHBondContact O-CG1 3.38Å; H88-I92 PolarHBondContact O-N 2.88Å; L89-I92 PolarHBondContact O-N 2.86Å; C90-I92 VanDerWaalsContact C-N 3.32Å; C90-I92 PolarHBondContact O-N 3.45Å; I92-L94 VanDerWaalsContact C-N 3.34Å; I92-L94 PolarHBondContact O-N 3.13Å; I92-R96 WeakPolarHBondContact O-CB 3.24Å; I92-R96 WeakPolarHBondContact O-CG 3.36Å; I92-R96 PolarHBondContact O-N 3.32Å; I92-L244 HydrophobicContact CG2-CD1 3.74Å; I92-L244 HydrophobicContact CG2-CD2 3.88Å; I92-L244 HydrophobicContact CG2-CG 4.45Å |
| 93 | S | 87.8 | Confident | 87.8 | Confident | 0 Ų | 0 | 23.3 Ų | 23.3 | 0% | 0 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -61.1 | -42.2 | 177.6 | 77.8 | 0 | 0 | 0 | 0 | 112.4 | L89 C90 A91 R96 Y97 | L89-S93 WeakPolarHBondContact O-CB 3.45Å; L89-S93 PolarHBondContact O-N 3.2Å; C90-S93 WeakPolarHBondContact O-CB 3.25Å; C90-S93 PolarHBondContact O-N 3.45Å; C90-S93 VanDerWaalsContact O-N 3.11Å; C90-S93 PolarHBondContact O-OG 3.45Å; A91-S93 VanDerWaalsContact C-N 3.35Å; S93-R96 WeakPolarHBondContact O-CB 3.46Å; S93-R96 PolarHBondContact O-N 3.03Å; S93-Y97 WeakPolarHBondContact O-CB 3.32Å; S93-Y97 PolarHBondContact O-N 2.92Å |
| 94 | L | 89.6 | Confident | 87.1 | Confident | 47 Ų | 47 | 29.1 Ų | 29.1 | 25% | 0.246 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -71.8 | -45.2 | -179.3 | -74.3 | 169.9 | 0 | 0 | 0 | 111.8 | C90 A91 I92 R96 Y97 W98 V176 | C90-L94 WeakPolarHBondContact O-CG 3.34Å; C90-L94 PolarHBondContact O-N 2.85Å; A91-L94 PolarHBondContact O-N 3.03Å; I92-L94 VanDerWaalsContact C-N 3.34Å; I92-L94 PolarHBondContact O-N 3.13Å; L94-R96 PolarHBondContact O-N 2.77Å; L94-Y97 WeakPolarHBondContact O-CB 3.23Å; L94-Y97 PolarHBondContact O-N 3.28Å; L94-Y97 VanDerWaalsContact O-N 3.15Å; L94-W98 VanDerWaalsContact C-CE3 3.41Å; L94-W98 HydrophobicContact CB-CE3 4.04Å; L94-W98 HydrophobicContact CB-CH2 3.88Å; L94-W98 HydrophobicContact CB-CZ3 3.56Å; L94-W98 HydrophobicContact CD1-CH2 4.33Å; L94-W98 HydrophobicContact CD2-CH2 4.28Å; L94-W98 HydrophobicContact CD2-CZ2 4.41Å; L94-W98 HydrophobicContact CG-CH2 4.41Å; L94-W98 PolarHBondContact O-N 3.46Å; L94-V176 HydrophobicContact CD2-CG1 4.41Å; L94-V176 HydrophobicContact CD2-CG2 3.54Å; L94-V176 HydrophobicContact CG-CG2 4.26Å |
| 95 | D | 88.7 | Confident | 86.5 | Confident | 3 Ų | 3 | 34 Ų | 34 | 2% | 0.016 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -53.1 | -40.4 | 171.4 | 164.3 | 89.7 | 0 | 0 | 0 | 110.6 | F36 A91 S99 Y106 R110 | F36-D95 HydrophobicContact CE2-CB 4.11Å; A91-D95 WeakPolarHBondContact O-CB 3.48Å; A91-D95 PolarHBondContact O-N 2.71Å; D95-S99 VanDerWaalsContact O-CB 3.32Å; D95-S99 WeakPolarHBondContact O-CB 3.49Å; D95-S99 PolarHBondContact O-N 3.23Å; D95-S99 PolarHBondContact O-OG 3.11Å; D95-Y106 PolarHBondContact OD1-OH 2.99Å; D95-R110 IonicContact OD1-CZ 3.73Å; D95-R110 IonicContact OD1-NE 3.03Å; D95-R110 PolarHBondContact OD1-NE 3.48Å; D95-R110 VanDerWaalsContact OD1-NE 3.09Å; D95-R110 IonicContact OD1-NH2 2.65Å; D95-R110 PolarHBondContact OD1-NH2 3.08Å; D95-R110 IonicContact OD2-CZ 3.78Å; D95-R110 IonicContact OD2-NH2 3.42Å; D95-R110 PolarHBondContact OD2-NH2 3.3Å |
| 96 | R | 83.7 | Confident | 86 | Confident | 36 Ų | 36 | 34.2 Ų | 34.2 | 14% | 0.136 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -70.7 | -45.4 | 178.1 | -69.5 | -79.3 | 167.6 | -172.5 | 5.7 | 112.5 | I92 S93 L94 W98 S99 V100 F240 L244 | I92-R96 WeakPolarHBondContact O-CB 3.24Å; I92-R96 WeakPolarHBondContact O-CG 3.36Å; I92-R96 PolarHBondContact O-N 3.32Å; S93-R96 WeakPolarHBondContact O-CB 3.46Å; S93-R96 PolarHBondContact O-N 3.03Å; L94-R96 PolarHBondContact O-N 2.77Å; R96-W98 VanDerWaalsContact C-N 3.33Å; R96-W98 PolarHBondContact O-N 3.44Å; R96-S99 WeakPolarHBondContact CA-OG 3.34Å; R96-S99 PolarHBondContact O-N 2.93Å; R96-S99 PolarHBondContact O-OG 2.65Å; R96-V100 WeakPolarHBondContact O-CG2 3.39Å; R96-V100 PolarHBondContact O-N 2.91Å; R96-F240 VanDerWaalsContact CZ-CZ 3.45Å; R96-F240 VanDerWaalsContact NH1-CD1 3.33Å; R96-L244 HydrophobicContact CB-CD1 4.38Å; R96-L244 HydrophobicContact CG-CD1 3.4Å |
| 97 | Y | 85 | Confident | 85.4 | Confident | 66 Ų | 66 | 38.5 Ų | 38.5 | 26% | 0.259 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -54.4 | -49 | 174.9 | 173.5 | -103.4 | 0 | 0 | 0 | 111.8 | S93 L94 V100 T101 V176 R179 I180 | S93-Y97 WeakPolarHBondContact O-CB 3.32Å; S93-Y97 PolarHBondContact O-N 2.92Å; L94-Y97 WeakPolarHBondContact O-CB 3.23Å; L94-Y97 PolarHBondContact O-N 3.28Å; L94-Y97 VanDerWaalsContact O-N 3.15Å; Y97-V100 PolarHBondContact O-N 3.03Å; Y97-T101 HydrophobicContact CD2-CG2 3.89Å; Y97-T101 HydrophobicContact CE1-CG2 4.29Å; Y97-T101 HydrophobicContact CE2-CG2 3.48Å; Y97-T101 VanDerWaalsContact CE2-CG2 3.48Å; Y97-T101 HydrophobicContact CG-CG2 4.45Å; Y97-T101 WeakPolarHBondContact O-CB 3.27Å; Y97-T101 WeakPolarHBondContact O-CG2 3.36Å; Y97-T101 PolarHBondContact O-N 2.71Å; Y97-T101 PolarHBondContact O-OG1 3.46Å; Y97-V176 HydrophobicContact CG-CG1 4.31Å; Y97-R179 HydrophobicContact CD2-CB 4.33Å; Y97-R179 HydrophobicContact CE2-CB 3.81Å; Y97-I180 HydrophobicContact CD2-CG1 3.73Å; Y97-I180 HydrophobicContact CG-CG1 4.32Å |
| 98 | W | 86.7 | Confident | 84.9 | Confident | 92 Ų | 92 | 44.4 Ų | 44.4 | 35% | 0.348 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -67 | -38.3 | 177.4 | -68.4 | -52.7 | 0 | 0 | 0 | 112.7 | L94 R96 V100 T101 Q102 Y106 | L94-W98 VanDerWaalsContact C-CE3 3.41Å; L94-W98 HydrophobicContact CB-CE3 4.04Å; L94-W98 HydrophobicContact CB-CH2 3.88Å; L94-W98 HydrophobicContact CB-CZ3 3.56Å; L94-W98 HydrophobicContact CD1-CH2 4.33Å; L94-W98 HydrophobicContact CD2-CH2 4.28Å; L94-W98 HydrophobicContact CD2-CZ2 4.41Å; L94-W98 HydrophobicContact CG-CH2 4.41Å; L94-W98 PolarHBondContact O-N 3.46Å; R96-W98 VanDerWaalsContact C-N 3.33Å; R96-W98 PolarHBondContact O-N 3.44Å; W98-V100 VanDerWaalsContact C-N 3.27Å; W98-V100 PolarHBondContact O-N 3.09Å; W98-T101 WeakPolarHBondContact CA-OG1 3.39Å; W98-Q102 CarbonylContact O-C 3.52Å; W98-Q102 WeakPolarHBondContact O-CA 3.29Å; W98-Q102 PolarHBondContact O-N 3.08Å; W98-Y106 HydrophobicContact CB-CD1 4.07Å; W98-Y106 HydrophobicContact CB-CD2 3.54Å; W98-Y106 HydrophobicContact CB-CE1 4.11Å; W98-Y106 HydrophobicContact CB-CE2 3.58Å; W98-Y106 HydrophobicContact CB-CG 3.78Å; W98-Y106 HydrophobicContact CD2-CE2 4.26Å; W98-Y106 HydrophobicContact CE3-CE2 4.05Å; W98-Y106 HydrophobicContact CG-CD2 4.26Å; W98-Y106 HydrophobicContact CG-CE2 4.11Å |
| 99 | S | 83.2 | Confident | 84.4 | Confident | 10 Ų | 10 | 49.2 Ų | 49.2 | 7% | 0.07 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -62.8 | -33.3 | 176 | 76.6 | 0 | 0 | 0 | 0 | 113.1 | D95 R96 A103 | D95-S99 VanDerWaalsContact O-CB 3.32Å; D95-S99 WeakPolarHBondContact O-CB 3.49Å; D95-S99 PolarHBondContact O-N 3.23Å; D95-S99 PolarHBondContact O-OG 3.11Å; R96-S99 WeakPolarHBondContact CA-OG 3.34Å; R96-S99 PolarHBondContact O-N 2.93Å; R96-S99 PolarHBondContact O-OG 2.65Å; S99-A103 VanDerWaalsContact O-CA 3.24Å; S99-A103 WeakPolarHBondContact O-CA 3.33Å; S99-A103 WeakPolarHBondContact O-CB 3.36Å |
| 100 | V | 78.5 | Confident | 84.2 | Confident | 10 Ų | 10 | 50.4 Ų | 50.4 | 6% | 0.061 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -82 | -46.6 | 178.8 | 172.5 | 0 | 0 | 0 | 0 | 110.7 | R96 Y97 W98 V183 R187 | R96-V100 WeakPolarHBondContact O-CG2 3.39Å; R96-V100 PolarHBondContact O-N 2.91Å; Y97-V100 PolarHBondContact O-N 3.03Å; W98-V100 VanDerWaalsContact C-N 3.27Å; W98-V100 PolarHBondContact O-N 3.09Å; V100-V183 HydrophobicContact CG1-CG1 4.4Å; V100-R187 PolarHBondContact O-NH1 2.88Å; V100-R187 PolarHBondContact O-NH2 2.94Å |
| 101 | T | 80.4 | Confident | 84.1 | Confident | 34 Ų | 34 | 52.9 Ų | 52.9 | 21% | 0.209 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -72 | -44.9 | -176 | 51.8 | 0 | 0 | 0 | 0 | 112.2 | Y97 W98 V183 R187 | Y97-T101 HydrophobicContact CD2-CG2 3.89Å; Y97-T101 HydrophobicContact CE1-CG2 4.29Å; Y97-T101 HydrophobicContact CE2-CG2 3.48Å; Y97-T101 VanDerWaalsContact CE2-CG2 3.48Å; Y97-T101 HydrophobicContact CG-CG2 4.45Å; Y97-T101 WeakPolarHBondContact O-CB 3.27Å; Y97-T101 WeakPolarHBondContact O-CG2 3.36Å; Y97-T101 PolarHBondContact O-N 2.71Å; Y97-T101 PolarHBondContact O-OG1 3.46Å; W98-T101 WeakPolarHBondContact CA-OG1 3.39Å; T101-V183 HydrophobicContact CG2-CG1 4.26Å; T101-V183 HydrophobicContact CG2-CG2 4.14Å; T101-R187 PolarHBondContact O-NH2 3.31Å |
| 102 | Q | 80.6 | Confident | 84 | Confident | 96 Ų | 96 | 55.6 Ų | 55.6 | 45% | 0.449 | 29% | 0.286 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -119.7 | 52.9 | -173.7 | -63.5 | 178.2 | -11 | 0 | 0 | 111.6 | W98 V104 E105 Y106 | W98-Q102 CarbonylContact O-C 3.52Å; W98-Q102 WeakPolarHBondContact O-CA 3.29Å; W98-Q102 PolarHBondContact O-N 3.08Å; Q102-V104 VanDerWaalsContact C-N 3.34Å; Q102-V104 PolarHBondContact O-N 3.47Å; Q102-V104 VanDerWaalsContact O-N 3.15Å; Q102-E105 PolarHBondContact O-N 3.04Å; Q102-Y106 WeakPolarHBondContact O-CB 3.45Å; Q102-Y106 PolarHBondContact O-N 2.9Å |
| 103 | A | 75.7 | Confident | 84.1 | Confident | 37 Ų | 37 | 63.4 Ų | 63.4 | 31% | 0.306 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -53.9 | -39.5 | -168.5 | 0 | 0 | 0 | 0 | 0 | 115.4 | S99 N107 | S99-A103 VanDerWaalsContact O-CA 3.24Å; S99-A103 WeakPolarHBondContact O-CA 3.33Å; S99-A103 WeakPolarHBondContact O-CB 3.36Å; A103-N107 VanDerWaalsContact O-CB 3.25Å; A103-N107 WeakPolarHBondContact O-CB 3.35Å; A103-N107 PolarHBondContact O-ND2 3.48Å |
| 104 | V | 76.9 | Confident | 84.3 | Confident | 121 Ų | 121 | 68.3 Ų | 68.3 | 73% | 0.733 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -78.4 | -53.2 | -176.7 | -179.9 | 0 | 0 | 0 | 0 | 111.2 | Q102 L108 | Q102-V104 VanDerWaalsContact C-N 3.34Å; Q102-V104 PolarHBondContact O-N 3.47Å; Q102-V104 VanDerWaalsContact O-N 3.15Å; V104-L108 PolarHBondContact O-N 3.15Å |
| 105 | E | 82.7 | Confident | 84.4 | Confident | 102 Ų | 102 | 66.1 Ų | 66.1 | 48% | 0.477 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -69 | -40.4 | -175.2 | -169 | -178.3 | 167.7 | 0 | 0 | 112.3 | Q102 L108 K109 | Q102-E105 PolarHBondContact O-N 3.04Å; E105-L108 PolarHBondContact O-N 3.29Å; E105-K109 WeakPolarHBondContact O-CG 3.11Å; E105-K109 PolarHBondContact O-N 3.19Å; E105-K109 WeakPolarHBondContact OE1-CE 3.23Å; E105-K109 IonicContact OE1-NZ 3.09Å; E105-K109 PolarHBondContact OE1-NZ 3.24Å |
| 106 | Y | 83.2 | Confident | 84.7 | Confident | 9 Ų | 9 | 72.4 Ų | 72.4 | 4% | 0.035 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -70.2 | -38.7 | -179.2 | -171.2 | -102.1 | 0 | 0 | 0 | 112.3 | D95 W98 Q102 L108 K109 R110 | D95-Y106 PolarHBondContact OD1-OH 2.99Å; W98-Y106 HydrophobicContact CB-CD1 4.07Å; W98-Y106 HydrophobicContact CB-CD2 3.54Å; W98-Y106 HydrophobicContact CB-CE1 4.11Å; W98-Y106 HydrophobicContact CB-CE2 3.58Å; W98-Y106 HydrophobicContact CB-CG 3.78Å; W98-Y106 HydrophobicContact CD2-CE2 4.26Å; W98-Y106 HydrophobicContact CE3-CE2 4.05Å; W98-Y106 HydrophobicContact CG-CD2 4.26Å; W98-Y106 HydrophobicContact CG-CE2 4.11Å; Q102-Y106 WeakPolarHBondContact O-CB 3.45Å; Q102-Y106 PolarHBondContact O-N 2.9Å; Y106-L108 PolarHBondContact O-N 3.27Å; Y106-K109 CarbonylContact O-C 3.59Å; Y106-K109 PolarHBondContact O-N 3.38Å; Y106-K109 VanDerWaalsContact O-N 3.08Å; Y106-R110 WeakPolarHBondContact O-CB 2.96Å; Y106-R110 PolarHBondContact O-N 3.36Å |
| 107 | N | 79.7 | Confident | 85.2 | Confident | 90 Ų | 90 | 74.2 Ų | 74.2 | 48% | 0.481 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -62.1 | -32.6 | 177.7 | -83.4 | -38.8 | 0 | 0 | 0 | 112.3 | A103 | A103-N107 VanDerWaalsContact O-CB 3.25Å; A103-N107 WeakPolarHBondContact O-CB 3.35Å; A103-N107 PolarHBondContact O-ND2 3.48Å |
| 108 | L | 81.3 | Confident | 85.7 | Confident | 144 Ų | 144 | 73.1 Ų | 73.1 | 75% | 0.754 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -70 | -35.8 | 173.9 | -67.5 | 170.5 | 0 | 0 | 0 | 112.4 | V104 E105 Y106 R110 | V104-L108 PolarHBondContact O-N 3.15Å; E105-L108 PolarHBondContact O-N 3.29Å; Y106-L108 PolarHBondContact O-N 3.27Å; L108-R110 VanDerWaalsContact C-N 3.3Å; L108-R110 PolarHBondContact O-N 3.06Å |
| 109 | K | 85.3 | Confident | 86.2 | Confident | 101 Ų | 101 | 69.9 Ų | 69.9 | 44% | 0.439 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -80.9 | -7 | 179 | -64.5 | 178.6 | -174.2 | 175.4 | 0 | 113.6 | E105 Y106 T111 | E105-K109 WeakPolarHBondContact O-CG 3.11Å; E105-K109 PolarHBondContact O-N 3.19Å; E105-K109 WeakPolarHBondContact OE1-CE 3.23Å; E105-K109 IonicContact OE1-NZ 3.09Å; E105-K109 PolarHBondContact OE1-NZ 3.24Å; Y106-K109 CarbonylContact O-C 3.59Å; Y106-K109 PolarHBondContact O-N 3.38Å; Y106-K109 VanDerWaalsContact O-N 3.08Å; K109-T111 VanDerWaalsContact C-N 3.33Å; K109-T111 PolarHBondContact O-N 3.31Å |
| 110 | R | 84.6 | Confident | 86.8 | Confident | 29 Ų | 29 | 74.5 Ų | 74.5 | 11% | 0.109 | 38% | 0.382 | C | S | . | . | trans | -82.9 | 74.3 | -174.3 | -161.9 | -170.9 | -153.4 | 173.3 | 5.2 | 111.6 | Q33 D95 Y106 L108 I115 | Q33-R110 VanDerWaalsContact CG-CZ 3.47Å; Q33-R110 VanDerWaalsContact OE1-NH1 3.13Å; D95-R110 IonicContact OD1-CZ 3.73Å; D95-R110 IonicContact OD1-NE 3.03Å; D95-R110 PolarHBondContact OD1-NE 3.48Å; D95-R110 VanDerWaalsContact OD1-NE 3.09Å; D95-R110 IonicContact OD1-NH2 2.65Å; D95-R110 PolarHBondContact OD1-NH2 3.08Å; D95-R110 IonicContact OD2-CZ 3.78Å; D95-R110 IonicContact OD2-NH2 3.42Å; D95-R110 PolarHBondContact OD2-NH2 3.3Å; Y106-R110 WeakPolarHBondContact O-CB 2.96Å; Y106-R110 PolarHBondContact O-N 3.36Å; L108-R110 VanDerWaalsContact C-N 3.3Å; L108-R110 PolarHBondContact O-N 3.06Å; R110-I115 HydrophobicContact CG-CD1 4.39Å | ||
| 111 | T | 90.3 | Very high | 87.6 | Confident | 62 Ų | 62 | 78.4 Ų | 78.4 | 38% | 0.38 | 40% | 0.402 | S | S | . | . | trans | -94.5 | 150.1 | 179.4 | 65.7 | 0 | 0 | 0 | 0 | 111.9 | K109 K113 R114 I115 | K109-T111 VanDerWaalsContact C-N 3.33Å; K109-T111 PolarHBondContact O-N 3.31Å; T111-K113 PolarHBondContact O-N 3.14Å; T111-R114 PolarHBondContact O-N 3.42Å; T111-R114 VanDerWaalsContact O-N 3.16Å; T111-R114 PolarHBondContact OG1-N 3Å; T111-I115 PolarHBondContact O-N 2.97Å; T111-I115 VanDerWaalsContact O-N 3.14Å | ||
| 112 | P | 89.2 | Confident | 88.3 | Confident | 70 Ų | 70 | 77.1 Ų | 77.1 | 46% | 0.455 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -56 | -35.7 | 174.1 | -25.2 | 32.9 | 0 | 0 | 0 | 113.4 | P32 I115 K116 | P32-P112 HydrophobicContact CB-CG 4.28Å; P32-P112 HydrophobicContact CG-CG 4.07Å; P112-I115 PolarHBondContact O-N 3.4Å; P112-K116 WeakPolarHBondContact O-CG 3.06Å; P112-K116 PolarHBondContact O-N 3.25Å |
| 113 | K | 92.4 | Very high | 89.1 | Confident | 172 Ų | 172 | 75.2 Ų | 75.2 | 75% | 0.748 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -59.4 | -49.5 | 176.6 | -68.2 | -176.3 | 178.3 | -177.9 | 0 | 110.9 | T111 I115 K116 C117 | T111-K113 PolarHBondContact O-N 3.14Å; K113-I115 PolarHBondContact O-N 3.12Å; K113-K116 PolarHBondContact O-N 2.91Å; K113-C117 PolarHBondContact O-N 2.86Å; K113-C117 PolarHBondContact O-SG 3.16Å |
| 114 | R | 92.3 | Very high | 90 | Very high | 104 Ų | 104 | 78.6 Ų | 78.6 | 39% | 0.392 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -62.3 | -42.5 | 178.8 | -171.5 | 176.4 | -178.4 | -174.4 | 1.3 | 112.2 | T111 C117 I118 | T111-R114 PolarHBondContact O-N 3.42Å; T111-R114 VanDerWaalsContact O-N 3.16Å; T111-R114 PolarHBondContact OG1-N 3Å; R114-C117 WeakPolarHBondContact O-CB 3.3Å; R114-C117 PolarHBondContact O-N 3.43Å; R114-I118 HydrophobicContact CG-CD1 4.26Å; R114-I118 WeakPolarHBondContact O-CG1 3.35Å; R114-I118 PolarHBondContact O-N 3.42Å |
| 115 | I | 92.8 | Very high | 90.8 | Very high | 1 Ų | 1 | 76.5 Ų | 76.5 | 1% | 0.005 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -63.4 | -44 | 177.6 | -59 | -53.8 | 0 | 0 | 0 | 111.2 | P32 L35 F36 R110 T111 P112 K113 C117 I118 I119 | P32-I115 HydrophobicContact CB-CG1 4.1Å; L35-I115 HydrophobicContact CB-CG2 3.96Å; L35-I115 HydrophobicContact CD1-CG2 4.43Å; F36-I115 HydrophobicContact CD1-CG2 4.37Å; F36-I115 HydrophobicContact CD2-CG2 4.14Å; F36-I115 HydrophobicContact CE1-CG2 4.11Å; F36-I115 HydrophobicContact CE2-CD1 3.7Å; F36-I115 HydrophobicContact CE2-CG2 3.89Å; F36-I115 HydrophobicContact CG-CG2 4.38Å; F36-I115 HydrophobicContact CZ-CD1 3.92Å; F36-I115 HydrophobicContact CZ-CG2 3.86Å; R110-I115 HydrophobicContact CG-CD1 4.39Å; T111-I115 PolarHBondContact O-N 2.97Å; T111-I115 VanDerWaalsContact O-N 3.14Å; P112-I115 PolarHBondContact O-N 3.4Å; K113-I115 PolarHBondContact O-N 3.12Å; I115-C117 VanDerWaalsContact C-N 3.33Å; I115-C117 PolarHBondContact O-N 2.85Å; I115-I118 HydrophobicContact CD1-CD1 4.42Å; I115-I118 PolarHBondContact O-N 3.46Å; I115-I119 HydrophobicContact CG2-CD1 3.92Å; I115-I119 HydrophobicContact CG2-CG1 4.45Å; I115-I119 WeakPolarHBondContact O-CG1 3.14Å; I115-I119 PolarHBondContact O-N 3.47Å |
| 116 | K | 93.9 | Very high | 91.3 | Very high | 135 Ų | 135 | 71.7 Ų | 71.7 | 59% | 0.587 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -60.5 | -40.5 | 174.7 | -72 | 179.6 | 179.7 | -170.7 | 0 | 112.3 | L35 P112 K113 I119 L120 | L35-K116 HydrophobicContact CD1-CG 4.35Å; P112-K116 WeakPolarHBondContact O-CG 3.06Å; P112-K116 PolarHBondContact O-N 3.25Å; K113-K116 PolarHBondContact O-N 2.91Å; K116-I119 PolarHBondContact O-N 3.48Å; K116-L120 PolarHBondContact O-N 3.23Å |
| 117 | C | 95.4 | Very high | 91.7 | Very high | 74 Ų | 74 | 73.4 Ų | 73.4 | 50% | 0.5 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -62.2 | -43.3 | 173.6 | -67.5 | 0 | 0 | 0 | 0 | 112.1 | K113 R114 I115 L120 I121 | K113-C117 PolarHBondContact O-N 2.86Å; K113-C117 PolarHBondContact O-SG 3.16Å; R114-C117 WeakPolarHBondContact O-CB 3.3Å; R114-C117 PolarHBondContact O-N 3.43Å; I115-C117 VanDerWaalsContact C-N 3.33Å; I115-C117 PolarHBondContact O-N 2.85Å; C117-L120 PolarHBondContact O-N 2.88Å; C117-I121 VanDerWaalsContact O-CG1 3.32Å; C117-I121 WeakPolarHBondContact O-CG1 3.32Å; C117-I121 PolarHBondContact O-N 3.34Å |
| 118 | I | 94.6 | Very high | 92.2 | Very high | 42 Ų | 42 | 76.8 Ų | 76.8 | 22% | 0.215 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -62.1 | -45.8 | 176.3 | -64.5 | 165.4 | 0 | 0 | 0 | 110.1 | F36 A91 R114 I115 L120 I121 V122 | F36-I118 HydrophobicContact CE1-CB 4.11Å; F36-I118 HydrophobicContact CE1-CG2 3.68Å; F36-I118 HydrophobicContact CZ-CB 4.13Å; F36-I118 HydrophobicContact CZ-CD1 4.27Å; F36-I118 HydrophobicContact CZ-CG2 3.83Å; A91-I118 HydrophobicContact CB-CG2 4.24Å; R114-I118 HydrophobicContact CG-CD1 4.26Å; R114-I118 WeakPolarHBondContact O-CG1 3.35Å; R114-I118 PolarHBondContact O-N 3.42Å; I115-I118 HydrophobicContact CD1-CD1 4.42Å; I115-I118 PolarHBondContact O-N 3.46Å; I118-L120 VanDerWaalsContact C-N 3.31Å; I118-L120 PolarHBondContact O-N 3.34Å; I118-I121 PolarHBondContact O-N 3.43Å; I118-I121 VanDerWaalsContact O-N 3.16Å; I118-V122 HydrophobicContact CG2-CG2 4.34Å; I118-V122 WeakPolarHBondContact O-CG2 3.4Å; I118-V122 PolarHBondContact O-N 3.36Å |
| 119 | I | 96.4 | Very high | 92.5 | Very high | 24 Ų | 24 | 71.5 Ų | 71.5 | 12% | 0.123 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -56.6 | -46.3 | 176.6 | -70.5 | 165.4 | 0 | 0 | 0 | 110.8 | L35 F36 S39 I115 K116 I121 V122 W123 | L35-I119 HydrophobicContact CB-CD1 3.98Å; F36-I119 HydrophobicContact CD1-CD1 4.2Å; F36-I119 HydrophobicContact CD1-CG1 3.66Å; F36-I119 HydrophobicContact CE1-CG1 3.81Å; S39-I119 VanDerWaalsContact OG-CG2 3.28Å; S39-I119 WeakPolarHBondContact OG-CG2 3.35Å; I115-I119 HydrophobicContact CG2-CD1 3.92Å; I115-I119 HydrophobicContact CG2-CG1 4.45Å; I115-I119 WeakPolarHBondContact O-CG1 3.14Å; I115-I119 PolarHBondContact O-N 3.47Å; K116-I119 PolarHBondContact O-N 3.48Å; I119-I121 VanDerWaalsContact C-N 3.35Å; I119-I121 PolarHBondContact O-N 3.23Å; I119-V122 WeakPolarHBondContact O-CB 3.33Å; I119-V122 PolarHBondContact O-N 2.95Å; I119-W123 VanDerWaalsContact O-CD1 3.25Å; I119-W123 PolarHBondContact O-N 2.92Å |
| 120 | L | 96.4 | Very high | 92.6 | Very high | 107 Ų | 107 | 67 Ų | 67 | 56% | 0.56 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -58.7 | -46.5 | 176.7 | -177.9 | 66.9 | 0 | 0 | 0 | 111.5 | K116 C117 I118 V122 W123 L124 | K116-L120 PolarHBondContact O-N 3.23Å; C117-L120 PolarHBondContact O-N 2.88Å; I118-L120 VanDerWaalsContact C-N 3.31Å; I118-L120 PolarHBondContact O-N 3.34Å; L120-V122 VanDerWaalsContact C-N 3.3Å; L120-V122 PolarHBondContact O-N 3.03Å; L120-W123 PolarHBondContact O-N 3.08Å; L120-L124 HydrophobicContact CG-CD1 4.12Å; L120-L124 HydrophobicContact CG-CG 4.47Å; L120-L124 VanDerWaalsContact O-CG 3.31Å; L120-L124 WeakPolarHBondContact O-CG 3.32Å; L120-L124 PolarHBondContact O-N 3.42Å |
| 121 | I | 95.8 | Very high | 92.4 | Very high | 93 Ų | 93 | 67.7 Ų | 67.7 | 48% | 0.477 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -59.5 | -42.4 | 176.8 | -68.7 | 165.3 | 0 | 0 | 0 | 110.9 | C117 I118 I119 W123 L124 I125 | C117-I121 VanDerWaalsContact O-CG1 3.32Å; C117-I121 WeakPolarHBondContact O-CG1 3.32Å; C117-I121 PolarHBondContact O-N 3.34Å; I118-I121 PolarHBondContact O-N 3.43Å; I118-I121 VanDerWaalsContact O-N 3.16Å; I119-I121 VanDerWaalsContact C-N 3.35Å; I119-I121 PolarHBondContact O-N 3.23Å; I121-W123 PolarHBondContact O-N 3Å; I121-L124 PolarHBondContact O-N 2.91Å; I121-I125 HydrophobicContact CG2-CD1 3.61Å; I121-I125 HydrophobicContact CG2-CG1 4.21Å; I121-I125 WeakPolarHBondContact O-CB 3.48Å; I121-I125 VanDerWaalsContact O-CG1 3.29Å; I121-I125 WeakPolarHBondContact O-CG1 3.48Å; I121-I125 PolarHBondContact O-N 3.37Å |
| 122 | V | 95.7 | Very high | 91.8 | Very high | 6 Ų | 6 | 66.7 Ų | 66.7 | 4% | 0.036 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -59.9 | -45.8 | 177.3 | 170.2 | 0 | 0 | 0 | 0 | 111.2 | V87 H88 A91 I118 I119 L120 I125 S126 | V87-V122 HydrophobicContact CB-CG1 3.91Å; V87-V122 HydrophobicContact CG1-CB 4.21Å; V87-V122 HydrophobicContact CG1-CG1 3.65Å; V87-V122 HydrophobicContact CG1-CG2 3.96Å; H88-V122 WeakPolarHBondContact CE1-CG1 3.09Å; H88-V122 VanDerWaalsContact ND1-CG1 3.31Å; H88-V122 WeakPolarHBondContact ND1-CG1 3.39Å; A91-V122 HydrophobicContact CB-CG2 4.13Å; I118-V122 HydrophobicContact CG2-CG2 4.34Å; I118-V122 WeakPolarHBondContact O-CG2 3.4Å; I118-V122 PolarHBondContact O-N 3.36Å; I119-V122 WeakPolarHBondContact O-CB 3.33Å; I119-V122 PolarHBondContact O-N 2.95Å; L120-V122 VanDerWaalsContact C-N 3.3Å; L120-V122 PolarHBondContact O-N 3.03Å; V122-I125 PolarHBondContact O-N 3.33Å; V122-S126 WeakPolarHBondContact O-CB 3.47Å; V122-S126 PolarHBondContact O-N 3.3Å; V122-S126 PolarHBondContact O-OG 3.01Å |
| 123 | W | 96.7 | Very high | 90.8 | Very high | 57 Ų | 57 | 64 Ų | 64 | 22% | 0.216 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -63.5 | -42.1 | 176.4 | -81.5 | 104 | 0 | 0 | 0 | 112.3 | S39 A43 L46 L80 F81 H88 I119 L120 I121 S126 A127 | S39-W123 PolarHBondContact OG-NE1 2.95Å; A43-W123 HydrophobicContact CB-CH2 4.02Å; A43-W123 HydrophobicContact CB-CZ2 4.15Å; L46-W123 HydrophobicContact CD1-CH2 4.27Å; L80-W123 HydrophobicContact CD1-CE3 4.4Å; L80-W123 HydrophobicContact CD1-CZ3 4.48Å; L80-W123 HydrophobicContact CD2-CZ3 4.35Å; L80-W123 HydrophobicContact CG-CZ3 4.28Å; F81-W123 AromaticContact CD1-CH2 3.93Å; F81-W123 HydrophobicContact CD1-CH2 3.93Å; F81-W123 AromaticContact CD1-CZ3 3.94Å; F81-W123 HydrophobicContact CD1-CZ3 3.94Å; F81-W123 AromaticContact CE1-CH2 3.99Å; F81-W123 HydrophobicContact CE1-CH2 3.99Å; F81-W123 AromaticContact CE1-CZ3 3.92Å; F81-W123 HydrophobicContact CE1-CZ3 3.92Å; H88-W123 AromaticContact CE1-NE1 3.65Å; H88-W123 AromaticContact NE2-NE1 3.89Å; I119-W123 VanDerWaalsContact O-CD1 3.25Å; I119-W123 PolarHBondContact O-N 2.92Å; L120-W123 PolarHBondContact O-N 3.08Å; I121-W123 PolarHBondContact O-N 3Å; W123-S126 PolarHBondContact O-N 3.28Å; W123-A127 WeakPolarHBondContact O-CB 3.39Å; W123-A127 PolarHBondContact O-N 3.41Å |
| 124 | L | 95.3 | Very high | 89.6 | Confident | 108 Ų | 108 | 59.7 Ų | 59.7 | 57% | 0.565 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -64.7 | -43.9 | 178 | -68.9 | 175 | 0 | 0 | 0 | 112.3 | L120 I121 S126 A127 F128 | L120-L124 HydrophobicContact CG-CD1 4.12Å; L120-L124 HydrophobicContact CG-CG 4.47Å; L120-L124 VanDerWaalsContact O-CG 3.31Å; L120-L124 WeakPolarHBondContact O-CG 3.32Å; L120-L124 PolarHBondContact O-N 3.42Å; I121-L124 PolarHBondContact O-N 2.91Å; L124-S126 VanDerWaalsContact C-N 3.3Å; L124-S126 PolarHBondContact O-N 3.3Å; L124-A127 PolarHBondContact O-N 3.1Å; L124-F128 WeakPolarHBondContact O-CB 3.46Å; L124-F128 PolarHBondContact O-N 3.13Å |
| 125 | I | 92.3 | Very high | 88.3 | Confident | 77 Ų | 77 | 62.6 Ų | 62.6 | 40% | 0.395 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -60.8 | -43.8 | 175 | -70.3 | 169.6 | 0 | 0 | 0 | 110.2 | I121 V122 F128 I129 | I121-I125 HydrophobicContact CG2-CD1 3.61Å; I121-I125 HydrophobicContact CG2-CG1 4.21Å; I121-I125 WeakPolarHBondContact O-CB 3.48Å; I121-I125 VanDerWaalsContact O-CG1 3.29Å; I121-I125 WeakPolarHBondContact O-CG1 3.48Å; I121-I125 PolarHBondContact O-N 3.37Å; V122-I125 PolarHBondContact O-N 3.33Å; I125-F128 PolarHBondContact O-N 3.06Å; I125-I129 HydrophobicContact CG2-CD1 3.77Å; I125-I129 VanDerWaalsContact O-CG1 3.3Å; I125-I129 WeakPolarHBondContact O-CG1 3.29Å; I125-I129 PolarHBondContact O-N 3.07Å |
| 126 | S | 94.1 | Very high | 86.8 | Confident | 0 Ų | 0 | 64.9 Ų | 64.9 | 0% | 0 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -66.1 | -42.3 | -179.4 | -52.6 | 0 | 0 | 0 | 0 | 111.6 | S84 V122 W123 L124 I129 S130 | S84-S126 WeakPolarHBondContact CA-OG 3.4Å; S84-S126 PolarHBondContact N-OG 2.96Å; V122-S126 WeakPolarHBondContact O-CB 3.47Å; V122-S126 PolarHBondContact O-N 3.3Å; V122-S126 PolarHBondContact O-OG 3.01Å; W123-S126 PolarHBondContact O-N 3.28Å; L124-S126 VanDerWaalsContact C-N 3.3Å; L124-S126 PolarHBondContact O-N 3.3Å; S126-I129 PolarHBondContact O-N 3.2Å; S126-S130 WeakPolarHBondContact O-CB 3.46Å; S126-S130 PolarHBondContact O-N 3.25Å; S126-S130 PolarHBondContact O-OG 3.29Å; S126-S130 VanDerWaalsContact O-OG 3.13Å |
| 127 | A | 92.5 | Very high | 85.2 | Confident | 45 Ų | 45 | 62.3 Ų | 62.3 | 37% | 0.372 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -64.6 | -38 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | L80 W123 L124 S130 S131 | L80-A127 HydrophobicContact CD1-CB 4.06Å; W123-A127 WeakPolarHBondContact O-CB 3.39Å; W123-A127 PolarHBondContact O-N 3.41Å; L124-A127 PolarHBondContact O-N 3.1Å; A127-S130 WeakPolarHBondContact CA-OG 3.38Å; A127-S130 PolarHBondContact O-N 3.04Å; A127-S130 PolarHBondContact O-OG 3.18Å; A127-S131 PolarHBondContact O-N 2.88Å |
| 128 | F | 90.1 | Very high | 83.1 | Confident | 162 Ų | 162 | 65.7 Ų | 65.7 | 71% | 0.711 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -62.4 | -48.9 | 174 | -179.1 | -103.5 | 0 | 0 | 0 | 111.1 | L124 I125 S130 S131 | L124-F128 WeakPolarHBondContact O-CB 3.46Å; L124-F128 PolarHBondContact O-N 3.13Å; I125-F128 PolarHBondContact O-N 3.06Å; F128-S130 VanDerWaalsContact C-N 3.32Å; F128-S130 PolarHBondContact O-N 3.37Å; F128-S131 PolarHBondContact O-N 3.21Å; F128-S131 PolarHBondContact O-OG 3.32Å |
| 129 | I | 87.4 | Confident | 81.1 | Confident | 33 Ų | 33 | 67.6 Ų | 67.6 | 17% | 0.169 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -64.8 | -34.3 | 179.2 | -65.2 | 166.3 | 0 | 0 | 0 | 112 | T83 I125 S126 P132 A164 S165 | T83-I129 HydrophobicContact CG2-CB 4.25Å; T83-I129 HydrophobicContact CG2-CD1 3.99Å; T83-I129 HydrophobicContact CG2-CG2 4.21Å; I125-I129 HydrophobicContact CG2-CD1 3.77Å; I125-I129 VanDerWaalsContact O-CG1 3.3Å; I125-I129 WeakPolarHBondContact O-CG1 3.29Å; I125-I129 PolarHBondContact O-N 3.07Å; S126-I129 PolarHBondContact O-N 3.2Å; I129-P132 VanDerWaalsContact O-CD 3.24Å; I129-P132 WeakPolarHBondContact O-CD 3.4Å; I129-A164 HydrophobicContact CD1-CB 4.2Å; I129-A164 HydrophobicContact CG1-CB 4.31Å; I129-A164 HydrophobicContact CG2-CB 3.82Å; I129-S165 VanDerWaalsContact CG2-OG 3.3Å; I129-S165 WeakPolarHBondContact CG2-OG 3.41Å |
| 130 | S | 86.3 | Confident | 78.8 | Confident | 7 Ų | 7 | 73.4 Ų | 73.4 | 5% | 0.049 | 40% | 0.397 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -88.5 | 1.2 | -177.5 | 72.2 | 0 | 0 | 0 | 0 | 114.9 | L80 S126 A127 F128 P132 P133 | L80-S130 WeakPolarHBondContact CB-OG 3.47Å; S126-S130 WeakPolarHBondContact O-CB 3.46Å; S126-S130 PolarHBondContact O-N 3.25Å; S126-S130 PolarHBondContact O-OG 3.29Å; S126-S130 VanDerWaalsContact O-OG 3.13Å; A127-S130 WeakPolarHBondContact CA-OG 3.38Å; A127-S130 PolarHBondContact O-N 3.04Å; A127-S130 PolarHBondContact O-OG 3.18Å; F128-S130 VanDerWaalsContact C-N 3.32Å; F128-S130 PolarHBondContact O-N 3.37Å; S130-P132 VanDerWaalsContact C-CD 3.46Å; S130-P133 WeakPolarHBondContact O-CD 3.42Å |
| 131 | S | 81.2 | Confident | 76.5 | Confident | 43 Ų | 43 | 76.5 Ų | 76.5 | 30% | 0.301 | 41% | 0.406 | S | S | . | . | trans | -71.8 | -30.9 | -178.3 | 64.9 | 0 | 0 | 0 | 0 | 116.3 | A127 F128 L134 | A127-S131 PolarHBondContact O-N 2.88Å; F128-S131 PolarHBondContact O-N 3.21Å; F128-S131 PolarHBondContact O-OG 3.32Å; S131-L134 WeakPolarHBondContact O-CB 3.24Å; S131-L134 PolarHBondContact O-N 2.75Å | ||
| 132 | P | 76.3 | Confident | 74.2 | Confident | 41 Ų | 41 | 80.4 Ų | 80.4 | 27% | 0.266 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -61.2 | -34.3 | -174.1 | -21 | 30.9 | 0 | 0 | 0 | 116.2 | I129 S130 L134 M135 S136 Y157 | I129-P132 VanDerWaalsContact O-CD 3.24Å; I129-P132 WeakPolarHBondContact O-CD 3.4Å; S130-P132 VanDerWaalsContact C-CD 3.46Å; P132-L134 PolarHBondContact O-N 3.25Å; P132-L134 VanDerWaalsContact O-N 3.15Å; P132-M135 PolarHBondContact O-N 3.19Å; P132-S136 PolarHBondContact O-N 2.66Å; P132-Y157 HydrophobicContact CB-CD2 4Å; P132-Y157 HydrophobicContact CB-CE2 3.62Å; P132-Y157 HydrophobicContact CG-CE2 4.08Å |
| 133 | P | 68.6 | Low | 71.9 | Confident | 13 Ų | 13 | 88.8 Ų | 88.8 | 8% | 0.084 | 47% | 0.466 | C | S | . | . | H | α-helix | trans | -52.7 | -30.5 | 171.1 | -31.4 | 36.6 | 0 | 0 | 0 | 115.1 | L75 A76 S130 M135 Y157 | L75-P133 HydrophobicContact CB-CB 4.26Å; A76-P133 HydrophobicContact CB-CB 4.31Å; S130-P133 WeakPolarHBondContact O-CD 3.42Å; P133-M135 VanDerWaalsContact C-N 3.31Å; P133-Y157 WeakPolarHBondContact CD-OH 3.48Å; P133-Y157 WeakPolarHBondContact CG-OH 3.42Å |
| 134 | L | 67.3 | Low | 69.9 | Low | 82 Ų | 82 | 90 Ų | 90 | 43% | 0.429 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -74.2 | -23.7 | 178.8 | -63.8 | 171.4 | 0 | 0 | 0 | 112.5 | I73 A76 S131 P132 I137 | I73-L134 HydrophobicContact CG1-CD2 4.35Å; A76-L134 HydrophobicContact CB-CD1 4.19Å; A76-L134 HydrophobicContact CB-CD2 3.76Å; A76-L134 HydrophobicContact CB-CG 3.7Å; S131-L134 WeakPolarHBondContact O-CB 3.24Å; S131-L134 PolarHBondContact O-N 2.75Å; P132-L134 PolarHBondContact O-N 3.25Å; P132-L134 VanDerWaalsContact O-N 3.15Å; L134-I137 WeakPolarHBondContact O-CD1 3.42Å |
| 135 | M | 66.4 | Low | 68.3 | Low | 164 Ų | 164 | 89.5 Ų | 89.5 | 81% | 0.808 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -87.4 | -19.1 | 178.7 | -61.8 | -177.1 | 65.9 | 0 | 0 | 112.3 | P132 P133 I137 | P132-M135 PolarHBondContact O-N 3.19Å; P133-M135 VanDerWaalsContact C-N 3.31Å; M135-I137 PolarHBondContact O-N 2.87Å |
| 136 | S | 59.8 | Low | 67.2 | Low | 49 Ų | 49 | 91.7 Ų | 91.7 | 34% | 0.343 | 51% | 0.51 | S | S | . | . | trans | -87.7 | 33.3 | 179.8 | -164.5 | 0 | 0 | 0 | 0 | 112.9 | P132 D138 | P132-S136 PolarHBondContact O-N 2.66Å; S136-D138 PolarHBondContact O-N 3.11Å | ||
| 137 | I | 61.2 | Low | 66.3 | Low | 81 Ų | 81 | 95.5 Ų | 95.5 | 42% | 0.415 | 53% | 0.534 | S | S | . | . | trans | -76.7 | -0.2 | 178.8 | -77.3 | 174.6 | 0 | 0 | 0 | 112.6 | L134 M135 | L134-I137 WeakPolarHBondContact O-CD1 3.42Å; M135-I137 PolarHBondContact O-N 2.87Å | ||
| 138 | D | 51.8 | Low | 65.7 | Low | 146 Ų | 146 | 97.8 Ų | 97.8 | 78% | 0.781 | 54% | 0.537 | S | S | * | . | trans | -110.4 | 31.9 | -167.4 | -103 | -9.9 | 0 | 0 | 0 | 116 | S136 N140 | S136-D138 PolarHBondContact O-N 3.11Å; D138-N140 PolarHBondContact O-N 3.46Å | ||
| 139 | S | 51.8 | Low | 65.3 | Low | 82 Ų | 82 | 90.7 Ų | 90.7 | 57% | 0.573 | 51% | 0.508 | S | S | * | . | trans | -89.6 | 94.2 | 167 | -67.4 | 0 | 0 | 0 | 0 | 110.9 | K141 | S139-K141 PolarHBondContact O-N 3.04Š| ||
| 140 | N | 47.6 | Very low | 64.8 | Low | 145 Ų | 145 | 94.7 Ų | 94.7 | 78% | 0.775 | 53% | 0.526 | S | S | * | . | trans | -62.3 | 97.2 | 162.6 | -78.9 | -49.1 | 0 | 0 | 0 | 109.4 | D138 | D138-N140 PolarHBondContact O-N 3.46Š| ||
| 141 | K | 47.6 | Very low | 64.2 | Low | 173 Ų | 173 | 96 Ų | 96 | 75% | 0.752 | 53% | 0.532 | S | S | * | . | trans | -110 | 108.3 | 159.3 | -78.6 | -175 | -179.5 | 172.3 | 0 | 109.6 | S139 | S139-K141 PolarHBondContact O-N 3.04Š| ||
| 142 | E | 47.4 | Very low | 63.9 | Low | 175 Ų | 175 | 95.5 Ų | 95.5 | 82% | 0.818 | 53% | 0.526 | S | S | * | . | trans | 7 | 143 | 157.5 | -63.6 | -102.4 | 126.3 | 0 | 0 | 120.8 | G144 | E142-G144 PolarHBondContact O-N 2.87Š| ||
| 143 | L | 48.8 | Very low | 63.8 | Low | 182 Ų | 182 | 97.1 Ų | 97.1 | 95% | 0.953 | 53% | 0.532 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.2 | 113.8 | 173.8 | -176.1 | 70.8 | 0 | 0 | 0 | 112.4 | ||
| 144 | G | 53.7 | Low | 64.4 | Low | 82 Ų | 82 | 100.1 Ų | 100.1 | 85% | 0.845 | 55% | 0.548 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 140.1 | -16.4 | 162.2 | 0 | 0 | 0 | 0 | 0 | 117.3 | E142 | E142-G144 PolarHBondContact O-N 2.87Š|
| 145 | S | 62.3 | Low | 65.2 | Low | 98 Ų | 98 | 99.8 Ų | 99.8 | 69% | 0.685 | 55% | 0.549 | S | S | * | . | S | Bend | trans | -102.1 | 146.7 | 177.1 | 42.8 | 0 | 0 | 0 | 0 | 111.9 | ||
| 146 | Q | 68.4 | Low | 66.2 | Low | 122 Ų | 122 | 99.6 Ų | 99.6 | 57% | 0.57 | 54% | 0.54 | S | S | * | . | P | Polyproline II helix | trans | -58 | 134.1 | 175.7 | -71 | 178.5 | -19.6 | 0 | 0 | 109.7 | Y63 Q148 | Y63-Q146 HydrophobicContact CG-CB 4.47Å; Q146-Q148 PolarHBondContact O-N 2.95Å |
| 147 | P | 75.9 | Confident | 67.3 | Low | 80 Ų | 80 | 97.5 Ų | 97.5 | 52% | 0.519 | 52% | 0.524 | S | S | . | . | P | Polyproline II helix | trans | -61.3 | 125.8 | -178.1 | 24.6 | -33.6 | 0 | 0 | 0 | 110.2 | W64 | W64-P147 WeakPolarHBondContact CB-O 3.16Å; W64-P147 PolarHBondContact N-O 3.15Å; W64-P147 WeakPolarHBondContact O-CG 3.45Å |
| 148 | Q | 80.8 | Confident | 68.6 | Low | 94 Ų | 94 | 93.7 Ų | 93.7 | 44% | 0.439 | 51% | 0.505 | S | S | . | . | trans | -107.9 | 146.6 | 173.7 | -64.1 | -63.6 | -30.5 | 0 | 0 | 109.6 | G62 Q146 E150 | G62-Q148 PolarHBondContact O-NE2 3.2Å; Q146-Q148 PolarHBondContact O-N 2.95Å; Q148-E150 HydrophobicContact CB-CG 4.18Å | ||
| 149 | C | 81 | Confident | 70.4 | Confident | 13 Ų | 13 | 89.5 Ų | 89.5 | 9% | 0.088 | 48% | 0.482 | C | S | . | . | trans | -111.1 | 91.5 | 173.5 | -175.4 | 0 | 0 | 0 | 0 | 108.9 | W64 C71 | W64-C149 HydrophobicContact CB-CB 3.84Å; W64-C149 HydrophobicContact CD2-CB 3.34Å; W64-C149 HydrophobicContact CE3-CB 3.49Å; W64-C149 VanDerWaalsContact CE3-CB 3.49Å; W64-C149 HydrophobicContact CG-CB 3.51Å; W64-C149 HydrophobicContact CZ2-CB 4.49Å; W64-C149 HydrophobicContact CZ3-CB 4.15Å; C71-C149 WeakPolarHBondContact CA-SG 3.26Å; C71-C149 HydrophobicContact CB-CB 3.87Å; C71-C149 WeakPolarHBondContact CB-SG 3.42Å; C71-C149 WeakPolarHBondContact SG-CA 3.28Å; C71-C149 WeakPolarHBondContact SG-CB 3.5Å; C71-C149 CovalentContact SG-SG 2.03Å; C71-C149 PolarHBondContact SG-SG 3.42Å | ||
| 150 | E | 76.7 | Confident | 72.2 | Confident | 117 Ų | 117 | 88.2 Ų | 88.2 | 55% | 0.547 | 47% | 0.473 | S | S | . | . | trans | -111.8 | 154.4 | -177.8 | -62.2 | -173.8 | 157.3 | 0 | 0 | 110.3 | L75 Q148 | L75-E150 WeakPolarHBondContact CD1-O 3.31Å; Q148-E150 HydrophobicContact CB-CG 4.18Å | ||
| 151 | L | 74.4 | Confident | 74 | Confident | 33 Ų | 33 | 81.8 Ų | 81.8 | 17% | 0.173 | 44% | 0.439 | C | S | . | . | trans | -63 | 153.5 | 173.6 | -78.6 | 148.6 | 0 | 0 | 0 | 110.1 | L75 D153 F258 Y262 F279 | L75-L151 HydrophobicContact CD2-CD2 4.22Å; L75-L151 HydrophobicContact CD2-CG 4.15Å; L151-D153 PolarHBondContact O-N 3.34Å; L151-F258 HydrophobicContact CD1-CZ 4.15Å; L151-Y262 HydrophobicContact CB-CE2 4.11Å; L151-Y262 HydrophobicContact CD1-CE2 4.13Å; L151-F279 HydrophobicContact CD1-CZ 4.37Å | ||
| 152 | N | 74.1 | Confident | 76.1 | Confident | 34 Ų | 34 | 73.5 Ų | 73.5 | 18% | 0.182 | 40% | 0.403 | C | S | . | . | trans | -62.5 | 131.7 | 179.4 | -173.4 | 26.8 | 0 | 0 | 0 | 111.2 | D154 Y157 I158 Y262 | N152-D154 VanDerWaalsContact C-N 3.33Å; N152-D154 PolarHBondContact ND2-OD2 2.73Å; N152-D154 PolarHBondContact OD1-OD2 2.88Å; N152-Y157 HydrophobicContact CB-CD1 3.66Å; N152-Y157 HydrophobicContact CB-CE1 4Å; N152-Y157 HydrophobicContact CB-CG 4.41Å; N152-I158 WeakPolarHBondContact O-CG1 3.44Å; N152-Y262 PolarHBondContact O-OH 3.33Å | ||
| 153 | D | 73.3 | Confident | 78.2 | Confident | 75 Ų | 75 | 68.6 Ų | 68.6 | 40% | 0.401 | 39% | 0.385 | S | S | . | . | trans | -82.9 | -5.8 | -176 | -82.6 | -37.6 | 0 | 0 | 0 | 113.6 | L151 T155 Y265 | L151-D153 PolarHBondContact O-N 3.34Å; D153-T155 PolarHBondContact O-N 3.34Å; D153-Y265 VanDerWaalsContact OD1-CE1 3.29Å; D153-Y265 WeakPolarHBondContact OD1-CE1 3.39Å; D153-Y265 PolarHBondContact OD1-OH 2.85Å | ||
| 154 | D | 82.1 | Confident | 80.1 | Confident | 76 Ų | 76 | 61.6 Ų | 61.6 | 41% | 0.406 | 35% | 0.354 | S | S | . | . | trans | -65.1 | 119.8 | -179.4 | -68.7 | -37.2 | 0 | 0 | 0 | 112.1 | N152 W156 Y157 I158 | N152-D154 VanDerWaalsContact C-N 3.33Å; N152-D154 PolarHBondContact ND2-OD2 2.73Å; N152-D154 PolarHBondContact OD1-OD2 2.88Å; D154-W156 VanDerWaalsContact C-N 3.29Å; D154-W156 PolarHBondContact O-N 2.93Å; D154-Y157 WeakPolarHBondContact O-CB 3.36Å; D154-Y157 PolarHBondContact O-N 3.22Å; D154-I158 WeakPolarHBondContact O-CG1 3.5Å; D154-I158 PolarHBondContact O-N 3.46Å | ||
| 155 | T | 85.3 | Confident | 81.8 | Confident | 75 Ų | 75 | 57.8 Ų | 57.8 | 46% | 0.46 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -49.9 | -45.2 | 178.3 | -63.7 | 0 | 0 | 0 | 0 | 113.3 | D153 Y157 I158 L159 G266 | D153-T155 PolarHBondContact O-N 3.34Å; T155-Y157 VanDerWaalsContact C-N 3.27Å; T155-Y157 PolarHBondContact O-N 3.33Å; T155-I158 PolarHBondContact O-N 3.42Å; T155-L159 HydrophobicContact CG2-CD1 3.77Å; T155-L159 HydrophobicContact CG2-CG 4.38Å; T155-L159 WeakPolarHBondContact O-CB 3.37Å; T155-L159 VanDerWaalsContact O-CG 3.28Å; T155-L159 WeakPolarHBondContact O-CG 3.47Å; T155-L159 PolarHBondContact O-N 2.97Å; T155-G266 WeakPolarHBondContact CB-O 3.29Å; T155-G266 WeakPolarHBondContact CG2-O 3.47Å; T155-G266 PolarHBondContact OG1-O 2.72Å |
| 156 | W | 85.6 | Confident | 83.2 | Confident | 160 Ų | 160 | 53.2 Ų | 53.2 | 61% | 0.606 | 28% | 0.282 | S | S | * | . | H | α-helix | trans | -62.9 | -37.9 | -178.5 | 77.7 | -96.3 | 0 | 0 | 0 | 111.3 | D154 S160 | D154-W156 VanDerWaalsContact C-N 3.29Å; D154-W156 PolarHBondContact O-N 2.93Å; W156-S160 VanDerWaalsContact O-CB 3.24Å; W156-S160 WeakPolarHBondContact O-CB 3.28Å; W156-S160 PolarHBondContact O-N 2.87Å; W156-S160 PolarHBondContact O-OG 2.92Å |
| 157 | Y | 84.1 | Confident | 84.4 | Confident | 5 Ų | 5 | 50.9 Ų | 50.9 | 2% | 0.02 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -72.5 | -47.6 | -179.4 | 173.4 | -101.1 | 0 | 0 | 0 | 110.4 | P132 P133 N152 D154 T155 L159 S160 S161 | P132-Y157 HydrophobicContact CB-CD2 4Å; P132-Y157 HydrophobicContact CB-CE2 3.62Å; P132-Y157 HydrophobicContact CG-CE2 4.08Å; P133-Y157 WeakPolarHBondContact CD-OH 3.48Å; P133-Y157 WeakPolarHBondContact CG-OH 3.42Å; N152-Y157 HydrophobicContact CB-CD1 3.66Å; N152-Y157 HydrophobicContact CB-CE1 4Å; N152-Y157 HydrophobicContact CB-CG 4.41Å; D154-Y157 WeakPolarHBondContact O-CB 3.36Å; D154-Y157 PolarHBondContact O-N 3.22Å; T155-Y157 VanDerWaalsContact C-N 3.27Å; T155-Y157 PolarHBondContact O-N 3.33Å; Y157-L159 VanDerWaalsContact C-N 3.29Å; Y157-L159 PolarHBondContact O-N 3.41Å; Y157-S160 PolarHBondContact O-N 2.99Å; Y157-S160 PolarHBondContact O-OG 3.11Å; Y157-S161 WeakPolarHBondContact O-CB 3.43Å; Y157-S161 PolarHBondContact O-N 3.19Å |
| 158 | I | 87.8 | Confident | 85.1 | Confident | 1 Ų | 1 | 49 Ų | 49 | 1% | 0.005 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -52.8 | -49.3 | 177.3 | -66.6 | 169 | 0 | 0 | 0 | 110.6 | N152 D154 T155 S162 Y262 Y265 | N152-I158 WeakPolarHBondContact O-CG1 3.44Å; D154-I158 WeakPolarHBondContact O-CG1 3.5Å; D154-I158 PolarHBondContact O-N 3.46Å; T155-I158 PolarHBondContact O-N 3.42Å; I158-S162 WeakPolarHBondContact O-CB 3.26Å; I158-S162 PolarHBondContact O-N 3.36Å; I158-S162 PolarHBondContact O-OG 3.37Å; I158-Y262 HydrophobicContact CB-CE1 4.19Å; I158-Y262 HydrophobicContact CD1-CE2 4.46Å; I158-Y262 HydrophobicContact CG1-CE1 4.19Å; I158-Y262 HydrophobicContact CG1-CE2 4.09Å; I158-Y262 HydrophobicContact CG2-CD1 3.86Å; I158-Y262 HydrophobicContact CG2-CD2 4.42Å; I158-Y262 HydrophobicContact CG2-CE1 3.75Å; I158-Y262 HydrophobicContact CG2-CE2 4.34Å; I158-Y262 HydrophobicContact CG2-CG 4.19Å; I158-Y262 WeakPolarHBondContact CG2-O 3.39Å; I158-Y265 HydrophobicContact CD1-CD1 3.9Å; I158-Y265 HydrophobicContact CD1-CE1 4.02Å |
| 159 | L | 90.3 | Very high | 85.6 | Confident | 58 Ų | 58 | 45 Ų | 45 | 30% | 0.304 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -72.2 | -44.1 | -176.6 | -65.6 | 176.6 | 0 | 0 | 0 | 112.7 | T155 Y157 T163 I267 | T155-L159 HydrophobicContact CG2-CD1 3.77Å; T155-L159 HydrophobicContact CG2-CG 4.38Å; T155-L159 WeakPolarHBondContact O-CB 3.37Å; T155-L159 VanDerWaalsContact O-CG 3.28Å; T155-L159 WeakPolarHBondContact O-CG 3.47Å; T155-L159 PolarHBondContact O-N 2.97Å; Y157-L159 VanDerWaalsContact C-N 3.29Å; Y157-L159 PolarHBondContact O-N 3.41Å; L159-T163 VanDerWaalsContact O-CB 3.23Å; L159-T163 WeakPolarHBondContact O-CB 3.43Å; L159-T163 PolarHBondContact O-N 2.88Å; L159-T163 PolarHBondContact O-OG1 3.28Å; L159-I267 HydrophobicContact CD2-CD1 4.42Å; L159-I267 HydrophobicContact CD2-CG1 3.96Å |
| 160 | S | 88.1 | Confident | 86.1 | Confident | 54 Ų | 54 | 45 Ų | 45 | 38% | 0.378 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -66.6 | -44.9 | 179.3 | 59.3 | 0 | 0 | 0 | 0 | 111.9 | W156 Y157 T163 A164 | W156-S160 VanDerWaalsContact O-CB 3.24Å; W156-S160 WeakPolarHBondContact O-CB 3.28Å; W156-S160 PolarHBondContact O-N 2.87Å; W156-S160 PolarHBondContact O-OG 2.92Å; Y157-S160 PolarHBondContact O-N 2.99Å; Y157-S160 PolarHBondContact O-OG 3.11Å; S160-T163 PolarHBondContact O-N 2.91Å; S160-A164 VanDerWaalsContact O-CB 3.32Å; S160-A164 WeakPolarHBondContact O-CB 3.25Å; S160-A164 PolarHBondContact O-N 2.93Å |
| 161 | S | 87.4 | Confident | 86.8 | Confident | 10 Ų | 10 | 44.2 Ų | 44.2 | 7% | 0.07 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -62.4 | -50.1 | 176.6 | -177.2 | 0 | 0 | 0 | 0 | 111.2 | Y157 T163 A164 S165 | Y157-S161 WeakPolarHBondContact O-CB 3.43Å; Y157-S161 PolarHBondContact O-N 3.19Å; S161-T163 VanDerWaalsContact C-N 3.29Å; S161-T163 PolarHBondContact O-N 3.35Å; S161-A164 PolarHBondContact O-N 3.09Å; S161-S165 WeakPolarHBondContact O-CB 3.22Å; S161-S165 PolarHBondContact O-N 2.84Å; S161-S165 PolarHBondContact O-OG 2.93Å |
| 162 | S | 90.9 | Very high | 87.5 | Confident | 0 Ų | 0 | 46.7 Ų | 46.7 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -61.2 | -38 | 178.5 | -59.4 | 0 | 0 | 0 | 0 | 112.6 | I158 F166 F167 Y262 S263 | I158-S162 WeakPolarHBondContact O-CB 3.26Å; I158-S162 PolarHBondContact O-N 3.36Å; I158-S162 PolarHBondContact O-OG 3.37Å; S162-F166 WeakPolarHBondContact O-CB 3.39Å; S162-F166 PolarHBondContact O-N 3.07Å; S162-F167 WeakPolarHBondContact O-CD2 3.47Å; S162-F167 PolarHBondContact O-N 3Å; S162-Y262 WeakPolarHBondContact OG-CD1 3.46Å; S162-S263 WeakPolarHBondContact CB-OG 3.11Å; S162-S263 PolarHBondContact OG-OG 2.96Å |
| 163 | T | 92.2 | Very high | 88.2 | Confident | 71 Ų | 71 | 45.3 Ų | 45.3 | 44% | 0.436 | 25% | 0.248 | S | C | . | . | I | π-helix | trans | -68 | -48.6 | 178.2 | -59.1 | 0 | 0 | 0 | 0 | 111.4 | L159 S160 S161 F167 A168 | L159-T163 VanDerWaalsContact O-CB 3.23Å; L159-T163 WeakPolarHBondContact O-CB 3.43Å; L159-T163 PolarHBondContact O-N 2.88Å; L159-T163 PolarHBondContact O-OG1 3.28Å; S160-T163 PolarHBondContact O-N 2.91Å; S161-T163 VanDerWaalsContact C-N 3.29Å; S161-T163 PolarHBondContact O-N 3.35Å; T163-F167 PolarHBondContact O-N 3.48Å; T163-A168 HydrophobicContact CG2-CB 4.49Å; T163-A168 VanDerWaalsContact O-CB 3.32Å; T163-A168 WeakPolarHBondContact O-CB 3.28Å; T163-A168 PolarHBondContact O-N 3.15Å |
| 164 | A | 88.4 | Confident | 88.9 | Confident | 36 Ų | 36 | 45.7 Ų | 45.7 | 30% | 0.298 | 25% | 0.249 | S | C | . | . | I | π-helix | trans | -70.4 | -39.1 | -178 | 0 | 0 | 0 | 0 | 0 | 112.6 | I129 S160 S161 P169 | I129-A164 HydrophobicContact CD1-CB 4.2Å; I129-A164 HydrophobicContact CG1-CB 4.31Å; I129-A164 HydrophobicContact CG2-CB 3.82Å; S160-A164 VanDerWaalsContact O-CB 3.32Å; S160-A164 WeakPolarHBondContact O-CB 3.25Å; S160-A164 PolarHBondContact O-N 2.93Å; S161-A164 PolarHBondContact O-N 3.09Å; A164-P169 VanDerWaalsContact O-CD 3.29Å; A164-P169 WeakPolarHBondContact O-CD 3.48Å; A164-P169 WeakPolarHBondContact O-CG 3.33Å |
| 165 | S | 88.7 | Confident | 89.2 | Confident | 2 Ų | 2 | 46.6 Ų | 46.6 | 1% | 0.014 | 25% | 0.253 | C | S | . | . | I | π-helix | trans | -87.9 | -17.1 | -175.1 | -65 | 0 | 0 | 0 | 0 | 114.5 | T83 I86 I129 S161 | T83-S165 VanDerWaalsContact OG1-CB 3.29Å; T83-S165 WeakPolarHBondContact OG1-CB 3.33Å; T83-S165 PolarHBondContact OG1-OG 3.36Å; I86-S165 WeakPolarHBondContact CG2-O 3.46Å; I129-S165 VanDerWaalsContact CG2-OG 3.3Å; I129-S165 WeakPolarHBondContact CG2-OG 3.41Å; S161-S165 WeakPolarHBondContact O-CB 3.22Å; S161-S165 PolarHBondContact O-N 2.84Å; S161-S165 PolarHBondContact O-OG 2.93Å |
| 166 | F | 91.6 | Very high | 89.3 | Confident | 2 Ų | 2 | 43.8 Ų | 43.8 | 1% | 0.009 | 24% | 0.236 | C | C | . | . | I | π-helix | trans | -138.2 | -61.4 | -178.3 | -176.2 | -103 | 0 | 0 | 0 | 114 | I86 S162 A168 P169 C170 F251 V252 W255 F256 F259 | I86-F166 HydrophobicContact CD1-CD2 3.93Å; I86-F166 HydrophobicContact CD1-CE2 4.45Å; I86-F166 WeakPolarHBondContact CD1-O 3.48Å; S162-F166 WeakPolarHBondContact O-CB 3.39Å; S162-F166 PolarHBondContact O-N 3.07Å; F166-A168 PolarHBondContact O-N 3.45Å; F166-P169 WeakPolarHBondContact O-CD 3.41Å; F166-C170 WeakPolarHBondContact O-CB 3.49Å; F166-C170 PolarHBondContact O-N 3.04Å; F166-F251 HydrophobicContact CD2-CE1 4.07Å; F166-F251 HydrophobicContact CE2-CD1 4.37Å; F166-F251 HydrophobicContact CE2-CE1 4.03Å; F166-V252 HydrophobicContact CZ-CG1 4.36Å; F166-W255 HydrophobicContact CD2-CB 4.07Å; F166-W255 HydrophobicContact CE2-CB 3.64Å; F166-W255 HydrophobicContact CZ-CB 4.45Å; F166-F256 HydrophobicContact CE1-CB 4.38Å; F166-F256 HydrophobicContact CE1-CD2 4.11Å; F166-F256 HydrophobicContact CZ-CB 3.98Å; F166-F256 HydrophobicContact CZ-CD2 4.42Å; F166-F259 HydrophobicContact CB-CB 4.25Å; F166-F259 HydrophobicContact CB-CD1 3.69Å; F166-F259 HydrophobicContact CB-CD2 3.5Å; F166-F259 VanDerWaalsContact CB-CD2 3.5Å; F166-F259 HydrophobicContact CB-CE1 3.81Å; F166-F259 HydrophobicContact CB-CE2 3.64Å; F166-F259 HydrophobicContact CB-CG 3.53Å; F166-F259 HydrophobicContact CB-CZ 3.8Å; F166-F259 HydrophobicContact CD1-CB 3.68Å; F166-F259 AromaticContact CD1-CD2 3.92Å; F166-F259 HydrophobicContact CD1-CD2 3.92Å; F166-F259 AromaticContact CD1-CG 3.86Å; F166-F259 HydrophobicContact CD1-CG 3.86Å; F166-F259 AromaticContact CD2-CD2 3.44Å; F166-F259 HydrophobicContact CD2-CD2 3.44Å; F166-F259 VanDerWaalsContact CD2-CD2 3.44Å; F166-F259 AromaticContact CD2-CE2 3.72Å; F166-F259 HydrophobicContact CD2-CE2 3.72Å; F166-F259 HydrophobicContact CD2-CG 4.19Å; F166-F259 HydrophobicContact CE1-CB 4.2Å; F166-F259 HydrophobicContact CE2-CD2 4.11Å; F166-F259 HydrophobicContact CG-CB 3.98Å; F166-F259 HydrophobicContact CG-CD1 4.28Å; F166-F259 AromaticContact CG-CD2 3.33Å; F166-F259 HydrophobicContact CG-CD2 3.33Å; F166-F259 AromaticContact CG-CE2 3.83Å; F166-F259 HydrophobicContact CG-CE2 3.83Å; F166-F259 AromaticContact CG-CG 3.6Å; F166-F259 HydrophobicContact CG-CG 3.6Å; F166-F259 HydrophobicContact CG-CZ 4.48Å |
| 167 | F | 93.3 | Very high | 89.1 | Confident | 72 Ų | 72 | 37.7 Ų | 37.7 | 32% | 0.316 | 21% | 0.213 | S | C | . | . | I | π-helix | trans | -66.3 | -45.4 | -168.5 | -66.7 | -73.3 | 0 | 0 | 0 | 113.6 | S162 T163 C170 L171 F259 S263 | S162-F167 WeakPolarHBondContact O-CD2 3.47Å; S162-F167 PolarHBondContact O-N 3Å; T163-F167 PolarHBondContact O-N 3.48Å; F167-C170 PolarHBondContact O-N 2.95Å; F167-L171 WeakPolarHBondContact O-CB 3.38Å; F167-L171 PolarHBondContact O-N 3.45Å; F167-F259 HydrophobicContact CE2-CB 4.37Å; F167-F259 HydrophobicContact CZ-CB 4.33Å; F167-S263 WeakPolarHBondContact CE2-OG 3.47Å |
| 168 | A | 91.9 | Very high | 89.2 | Confident | 41 Ų | 41 | 41.3 Ų | 41.3 | 34% | 0.339 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -67.5 | -48.5 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | T163 F166 C170 L171 I172 | T163-A168 HydrophobicContact CG2-CB 4.49Å; T163-A168 VanDerWaalsContact O-CB 3.32Å; T163-A168 WeakPolarHBondContact O-CB 3.28Å; T163-A168 PolarHBondContact O-N 3.15Å; F166-A168 PolarHBondContact O-N 3.45Å; A168-C170 VanDerWaalsContact C-N 3.33Å; A168-C170 PolarHBondContact O-N 2.75Å; A168-L171 PolarHBondContact O-N 3.01Å; A168-I172 WeakPolarHBondContact O-CG1 3.42Å; A168-I172 PolarHBondContact O-N 3.44Å |
| 169 | P | 90.6 | Very high | 89.1 | Confident | 11 Ų | 11 | 48.4 Ų | 48.4 | 7% | 0.071 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -61.2 | -39.6 | 173.6 | -20.1 | 30.5 | 0 | 0 | 0 | 112.6 | I86 V87 C90 A164 F166 L171 I172 M173 | I86-P169 HydrophobicContact CB-CB 4.5Å; I86-P169 HydrophobicContact CD1-CB 3.89Å; I86-P169 HydrophobicContact CG1-CB 3.93Å; I86-P169 HydrophobicContact CG2-CB 3.84Å; I86-P169 HydrophobicContact CG2-CG 3.99Å; V87-P169 HydrophobicContact CG2-CG 4.43Å; C90-P169 VanDerWaalsContact SG-CB 3.54Å; C90-P169 PolarHBondContact SG-O 3.01Å; A164-P169 VanDerWaalsContact O-CD 3.29Å; A164-P169 WeakPolarHBondContact O-CD 3.48Å; A164-P169 WeakPolarHBondContact O-CG 3.33Å; F166-P169 WeakPolarHBondContact O-CD 3.41Å; P169-L171 PolarHBondContact O-N 2.64Å; P169-I172 PolarHBondContact O-N 3.28Å; P169-M173 WeakPolarHBondContact O-CG 3.44Å; P169-M173 PolarHBondContact O-N 2.95Å |
| 170 | C | 90.9 | Very high | 88.7 | Confident | 11 Ų | 11 | 45.8 Ų | 45.8 | 7% | 0.074 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -59.9 | -46.4 | 176 | -175.3 | 0 | 0 | 0 | 0 | 111.9 | I86 F166 F167 A168 I172 M173 I174 | I86-C170 HydrophobicContact CD1-CB 4.14Å; F166-C170 WeakPolarHBondContact O-CB 3.49Å; F166-C170 PolarHBondContact O-N 3.04Å; F167-C170 PolarHBondContact O-N 2.95Å; A168-C170 VanDerWaalsContact C-N 3.33Å; A168-C170 PolarHBondContact O-N 2.75Å; C170-I172 PolarHBondContact O-N 2.96Å; C170-M173 PolarHBondContact O-N 3.3Å; C170-I174 VanDerWaalsContact O-CG1 3.31Å; C170-I174 WeakPolarHBondContact O-CG1 3.49Å; C170-I174 PolarHBondContact O-N 3.34Å |
| 171 | L | 91.4 | Very high | 88.4 | Confident | 102 Ų | 102 | 50.5 Ų | 50.5 | 53% | 0.534 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -59.3 | -46.2 | 176 | -179.6 | 63.2 | 0 | 0 | 0 | 111.5 | F167 A168 P169 M173 I174 L175 | F167-L171 WeakPolarHBondContact O-CB 3.38Å; F167-L171 PolarHBondContact O-N 3.45Å; A168-L171 PolarHBondContact O-N 3.01Å; P169-L171 PolarHBondContact O-N 2.64Å; L171-M173 VanDerWaalsContact C-N 3.34Å; L171-M173 PolarHBondContact O-N 2.91Å; L171-I174 PolarHBondContact O-N 3.29Å; L171-L175 HydrophobicContact CD1-CD1 4.24Å; L171-L175 HydrophobicContact CD1-CG 4.26Å; L171-L175 HydrophobicContact CG-CD1 4.1Å; L171-L175 HydrophobicContact CG-CG 4.49Å; L171-L175 WeakPolarHBondContact O-CB 3.19Å; L171-L175 VanDerWaalsContact O-CG 3.28Å; L171-L175 WeakPolarHBondContact O-CG 3.36Å; L171-L175 PolarHBondContact O-N 2.92Å |
| 172 | I | 90.3 | Very high | 88.1 | Confident | 85 Ų | 85 | 54 Ų | 54 | 44% | 0.436 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -57.7 | -48 | 176.7 | -67.5 | 166.8 | 0 | 0 | 0 | 110.3 | A168 P169 C170 I174 L175 V176 | A168-I172 WeakPolarHBondContact O-CG1 3.42Å; A168-I172 PolarHBondContact O-N 3.44Å; P169-I172 PolarHBondContact O-N 3.28Å; C170-I172 PolarHBondContact O-N 2.96Å; I172-I174 PolarHBondContact O-N 3.39Å; I172-L175 PolarHBondContact O-N 3.27Å; I172-V176 HydrophobicContact CG2-CG2 4.33Å; I172-V176 WeakPolarHBondContact O-CB 3.47Å; I172-V176 WeakPolarHBondContact O-CG2 3.44Å; I172-V176 PolarHBondContact O-N 3.37Å |
| 173 | M | 87.6 | Confident | 87.6 | Confident | 5 Ų | 5 | 55.9 Ų | 55.9 | 3% | 0.025 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -58.7 | -49.7 | 177.5 | -71.5 | -162.4 | -65.7 | 0 | 0 | 112.1 | I86 L89 C90 P169 C170 L171 L175 V176 Y177 M248 | I86-M173 HydrophobicContact CD1-CE 4Å; I86-M173 HydrophobicContact CG1-CE 3.61Å; L89-M173 HydrophobicContact CB-CE 4.45Å; L89-M173 HydrophobicContact CB-SD 3.51Å; L89-M173 VanDerWaalsContact CB-SD 3.51Å; C90-M173 HydrophobicContact CB-CG 4.18Å; C90-M173 WeakPolarHBondContact SG-CG 3.32Å; P169-M173 WeakPolarHBondContact O-CG 3.44Å; P169-M173 PolarHBondContact O-N 2.95Å; C170-M173 PolarHBondContact O-N 3.3Å; L171-M173 VanDerWaalsContact C-N 3.34Å; L171-M173 PolarHBondContact O-N 2.91Å; M173-L175 VanDerWaalsContact C-N 3.31Å; M173-L175 PolarHBondContact O-N 3.19Å; M173-V176 PolarHBondContact O-N 3.45Å; M173-Y177 WeakPolarHBondContact O-CD2 3.37Å; M173-Y177 PolarHBondContact O-N 2.94Å; M173-M248 HydrophobicContact SD-CG 3.99Å; M173-M248 HydrophobicContact SD-SD 3.96Å |
| 174 | I | 87.4 | Confident | 86.6 | Confident | 83 Ų | 83 | 53.9 Ų | 53.9 | 43% | 0.426 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -57.5 | -47.5 | -178.8 | -70 | 167.5 | 0 | 0 | 0 | 110 | C170 L171 I172 V176 Y177 I178 | C170-I174 VanDerWaalsContact O-CG1 3.31Å; C170-I174 WeakPolarHBondContact O-CG1 3.49Å; C170-I174 PolarHBondContact O-N 3.34Å; L171-I174 PolarHBondContact O-N 3.29Å; I172-I174 PolarHBondContact O-N 3.39Å; I174-V176 PolarHBondContact O-N 3.32Å; I174-Y177 PolarHBondContact O-N 2.89Å; I174-I178 HydrophobicContact CG2-CD1 3.75Å; I174-I178 HydrophobicContact CG2-CG1 4.43Å; I174-I178 VanDerWaalsContact O-CG1 3.29Å; I174-I178 WeakPolarHBondContact O-CG1 3.47Å; I174-I178 PolarHBondContact O-N 3.24Å |
| 175 | L | 89.6 | Confident | 86 | Confident | 94 Ų | 94 | 57 Ų | 57 | 49% | 0.492 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -61.6 | -44.6 | 178.5 | -68.3 | 176 | 0 | 0 | 0 | 112 | L171 I172 M173 Y177 I178 R179 | L171-L175 HydrophobicContact CD1-CD1 4.24Å; L171-L175 HydrophobicContact CD1-CG 4.26Å; L171-L175 HydrophobicContact CG-CD1 4.1Å; L171-L175 HydrophobicContact CG-CG 4.49Å; L171-L175 WeakPolarHBondContact O-CB 3.19Å; L171-L175 VanDerWaalsContact O-CG 3.28Å; L171-L175 WeakPolarHBondContact O-CG 3.36Å; L171-L175 PolarHBondContact O-N 2.92Å; I172-L175 PolarHBondContact O-N 3.27Å; M173-L175 VanDerWaalsContact C-N 3.31Å; M173-L175 PolarHBondContact O-N 3.19Å; L175-Y177 VanDerWaalsContact C-N 3.32Å; L175-Y177 PolarHBondContact O-N 3.38Å; L175-I178 PolarHBondContact O-N 3.39Å; L175-R179 WeakPolarHBondContact O-CG 3.35Å; L175-R179 PolarHBondContact O-N 2.93Å |
| 176 | V | 87.4 | Confident | 85.3 | Confident | 16 Ų | 16 | 61.5 Ų | 61.5 | 10% | 0.097 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -59.4 | -43.9 | 176.5 | 171.2 | 0 | 0 | 0 | 0 | 110.6 | L94 Y97 I172 M173 I174 R179 I180 | L94-V176 HydrophobicContact CD2-CG1 4.41Å; L94-V176 HydrophobicContact CD2-CG2 3.54Å; L94-V176 HydrophobicContact CG-CG2 4.26Å; Y97-V176 HydrophobicContact CG-CG1 4.31Å; I172-V176 HydrophobicContact CG2-CG2 4.33Å; I172-V176 WeakPolarHBondContact O-CB 3.47Å; I172-V176 WeakPolarHBondContact O-CG2 3.44Å; I172-V176 PolarHBondContact O-N 3.37Å; M173-V176 PolarHBondContact O-N 3.45Å; I174-V176 PolarHBondContact O-N 3.32Å; V176-R179 WeakPolarHBondContact O-CB 3.38Å; V176-R179 PolarHBondContact O-N 3.22Å; V176-I180 HydrophobicContact CG1-CD1 3.98Å; V176-I180 HydrophobicContact CG1-CG1 4.41Å; V176-I180 VanDerWaalsContact O-CG1 3.3Å; V176-I180 WeakPolarHBondContact O-CG1 3.03Å; V176-I180 PolarHBondContact O-N 3.39Å |
| 177 | Y | 81.8 | Confident | 84.1 | Confident | 33 Ų | 33 | 65.9 Ų | 65.9 | 13% | 0.129 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -68.1 | -40.5 | 179.2 | -93.6 | -93.3 | 0 | 0 | 0 | 114 | M173 I174 L175 R179 I180 Y181 T241 L244 A245 M248 | M173-Y177 WeakPolarHBondContact O-CD2 3.37Å; M173-Y177 PolarHBondContact O-N 2.94Å; I174-Y177 PolarHBondContact O-N 2.89Å; L175-Y177 VanDerWaalsContact C-N 3.32Å; L175-Y177 PolarHBondContact O-N 3.38Å; Y177-R179 PolarHBondContact O-N 2.9Å; Y177-I180 PolarHBondContact O-N 3.03Å; Y177-Y181 WeakPolarHBondContact O-CB 3.42Å; Y177-Y181 PolarHBondContact O-N 3.35Å; Y177-T241 HydrophobicContact CE1-CG2 4.1Å; Y177-L244 WeakPolarHBondContact OH-CB 3.18Å; Y177-A245 HydrophobicContact CD1-CB 3.86Å; Y177-A245 HydrophobicContact CE1-CB 3.59Å; Y177-M248 HydrophobicContact CD2-SD 3.77Å; Y177-M248 HydrophobicContact CE1-SD 4.48Å; Y177-M248 HydrophobicContact CE2-CE 3.56Å; Y177-M248 HydrophobicContact CE2-SD 2.96Å; Y177-M248 WeakPolarHBondContact CE2-SD 3.2Å; Y177-M248 WeakPolarHBondContact OH-CE 3.45Å; Y177-M248 PolarHBondContact OH-SD 3.05Å |
| 178 | I | 84.8 | Confident | 82.7 | Confident | 81 Ų | 81 | 64.6 Ų | 64.6 | 42% | 0.415 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -56.6 | -45.1 | 172.9 | -69.8 | 167.2 | 0 | 0 | 0 | 109.2 | I174 L175 Y181 Q182 | I174-I178 HydrophobicContact CG2-CD1 3.75Å; I174-I178 HydrophobicContact CG2-CG1 4.43Å; I174-I178 VanDerWaalsContact O-CG1 3.29Å; I174-I178 WeakPolarHBondContact O-CG1 3.47Å; I174-I178 PolarHBondContact O-N 3.24Å; L175-I178 PolarHBondContact O-N 3.39Å; I178-Y181 PolarHBondContact O-N 3.3Å; I178-Q182 HydrophobicContact CG2-CG 4.43Å; I178-Q182 WeakPolarHBondContact O-CB 3.33Å; I178-Q182 VanDerWaalsContact O-CG 3.25Å; I178-Q182 WeakPolarHBondContact O-CG 3.37Å; I178-Q182 PolarHBondContact O-N 3.43Å |
| 179 | R | 86.6 | Confident | 81.1 | Confident | 149 Ų | 149 | 71.2 Ų | 71.2 | 56% | 0.562 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -64.1 | -43.9 | 176.5 | -67.4 | -62.7 | -169.8 | -178.2 | 5.5 | 112.5 | Y97 L175 V176 Y177 Y181 Q182 V183 | Y97-R179 HydrophobicContact CD2-CB 4.33Å; Y97-R179 HydrophobicContact CE2-CB 3.81Å; L175-R179 WeakPolarHBondContact O-CG 3.35Å; L175-R179 PolarHBondContact O-N 2.93Å; V176-R179 WeakPolarHBondContact O-CB 3.38Å; V176-R179 PolarHBondContact O-N 3.22Å; Y177-R179 PolarHBondContact O-N 2.9Å; R179-Y181 VanDerWaalsContact C-N 3.32Å; R179-Y181 PolarHBondContact O-N 2.95Å; R179-Q182 PolarHBondContact O-N 3.04Å; R179-V183 VanDerWaalsContact O-CG2 3.28Å; R179-V183 WeakPolarHBondContact O-CG2 3.48Å; R179-V183 PolarHBondContact O-N 3.14Å |
| 180 | I | 82.5 | Confident | 79.4 | Confident | 3 Ų | 3 | 74.4 Ų | 74.4 | 2% | 0.015 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -58 | -47 | 175.2 | -65 | 168.2 | 0 | 0 | 0 | 110.3 | Y97 V176 Y177 V183 A184 T241 | Y97-I180 HydrophobicContact CD2-CG1 3.73Å; Y97-I180 HydrophobicContact CG-CG1 4.32Å; V176-I180 HydrophobicContact CG1-CD1 3.98Å; V176-I180 HydrophobicContact CG1-CG1 4.41Å; V176-I180 VanDerWaalsContact O-CG1 3.3Å; V176-I180 WeakPolarHBondContact O-CG1 3.03Å; V176-I180 PolarHBondContact O-N 3.39Å; Y177-I180 PolarHBondContact O-N 3.03Å; I180-V183 PolarHBondContact O-N 3.41Å; I180-A184 WeakPolarHBondContact O-CB 3.42Å; I180-A184 PolarHBondContact O-N 3.31Å; I180-T241 HydrophobicContact CG2-CG2 3.56Å |
| 181 | Y | 80.8 | Confident | 77.7 | Confident | 153 Ų | 153 | 76.8 Ų | 76.8 | 60% | 0.6 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -62.6 | -44.9 | 180 | 177 | -105.6 | 0 | 0 | 0 | 112 | Y177 I178 R179 A184 K185 | Y177-Y181 WeakPolarHBondContact O-CB 3.42Å; Y177-Y181 PolarHBondContact O-N 3.35Å; I178-Y181 PolarHBondContact O-N 3.3Å; R179-Y181 VanDerWaalsContact C-N 3.32Å; R179-Y181 PolarHBondContact O-N 2.95Å; Y181-A184 PolarHBondContact O-N 3.24Å; Y181-K185 HydrophobicContact CE1-CD 4.29Å; Y181-K185 WeakPolarHBondContact O-CB 3.47Å; Y181-K185 PolarHBondContact O-N 3Å |
| 182 | Q | 81.4 | Confident | 75.6 | Confident | 84 Ų | 84 | 76.2 Ų | 76.2 | 39% | 0.393 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -58.1 | -49.7 | 175.1 | -74.1 | 173.4 | -3.2 | 0 | 0 | 111.3 | I178 R179 A184 K185 T186 | I178-Q182 HydrophobicContact CG2-CG 4.43Å; I178-Q182 WeakPolarHBondContact O-CB 3.33Å; I178-Q182 VanDerWaalsContact O-CG 3.25Å; I178-Q182 WeakPolarHBondContact O-CG 3.37Å; I178-Q182 PolarHBondContact O-N 3.43Å; R179-Q182 PolarHBondContact O-N 3.04Å; Q182-A184 VanDerWaalsContact C-N 3.34Å; Q182-A184 PolarHBondContact O-N 3.11Å; Q182-K185 PolarHBondContact O-N 3.27Å; Q182-T186 PolarHBondContact O-N 3.47Å; Q182-T186 PolarHBondContact O-OG1 3.06Å |
| 183 | V | 80.1 | Confident | 73.5 | Confident | 39 Ų | 39 | 75.4 Ų | 75.4 | 24% | 0.236 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -60.7 | -43.6 | 178.9 | 171.6 | 0 | 0 | 0 | 0 | 111.1 | V100 T101 R179 I180 R187 | V100-V183 HydrophobicContact CG1-CG1 4.4Å; T101-V183 HydrophobicContact CG2-CG1 4.26Å; T101-V183 HydrophobicContact CG2-CG2 4.14Å; R179-V183 VanDerWaalsContact O-CG2 3.28Å; R179-V183 WeakPolarHBondContact O-CG2 3.48Å; R179-V183 PolarHBondContact O-N 3.14Å; I180-V183 PolarHBondContact O-N 3.41Å; V183-R187 WeakPolarHBondContact O-CG 3.3Å; V183-R187 PolarHBondContact O-N 2.91Å; V183-R187 VanDerWaalsContact O-N 3.08Å |
| 184 | A | 72.4 | Confident | 71.4 | Confident | 30 Ų | 30 | 83.4 Ų | 83.4 | 25% | 0.248 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -63.3 | -42.2 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | I180 Y181 Q182 R187 T188 | I180-A184 WeakPolarHBondContact O-CB 3.42Å; I180-A184 PolarHBondContact O-N 3.31Å; Y181-A184 PolarHBondContact O-N 3.24Å; Q182-A184 VanDerWaalsContact C-N 3.34Å; Q182-A184 PolarHBondContact O-N 3.11Å; A184-R187 PolarHBondContact O-N 3Å; A184-T188 PolarHBondContact O-N 3.39Å; A184-T188 PolarHBondContact O-OG1 3.02Å |
| 185 | K | 75.3 | Confident | 69.1 | Low | 101 Ų | 101 | 85.9 Ų | 85.9 | 44% | 0.439 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -65.4 | -46.5 | 178.5 | -170.8 | 172.1 | -177.5 | 176.3 | 0 | 111.3 | Y181 Q182 R187 T188 R189 | Y181-K185 HydrophobicContact CE1-CD 4.29Å; Y181-K185 WeakPolarHBondContact O-CB 3.47Å; Y181-K185 PolarHBondContact O-N 3Å; Q182-K185 PolarHBondContact O-N 3.27Å; K185-R187 VanDerWaalsContact C-N 3.34Å; K185-R187 PolarHBondContact O-N 3.38Å; K185-T188 PolarHBondContact O-N 3.21Å; K185-T188 VanDerWaalsContact O-N 3.12Å; K185-T188 PolarHBondContact O-OG1 3.5Å; K185-R189 PolarHBondContact O-N 3.31Å |
| 186 | T | 73.7 | Confident | 66.9 | Low | 96 Ų | 96 | 86.8 Ų | 86.8 | 59% | 0.589 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -60 | -42.5 | 177.9 | -58 | 0 | 0 | 0 | 0 | 111.8 | Q182 T188 R189 S190 | Q182-T186 PolarHBondContact O-N 3.47Å; Q182-T186 PolarHBondContact O-OG1 3.06Å; T186-T188 VanDerWaalsContact C-N 3.3Å; T186-T188 PolarHBondContact O-N 3.19Å; T186-R189 PolarHBondContact O-N 2.87Å; T186-S190 PolarHBondContact O-N 3.46Å |
| 187 | R | 67.1 | Low | 64.4 | Low | 94 Ų | 94 | 96 Ų | 96 | 36% | 0.355 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -64.2 | -30.4 | 175.6 | -73.8 | -178.7 | 179 | -179.1 | 4.6 | 113.5 | V100 T101 V183 A184 K185 S190 V191 | V100-R187 PolarHBondContact O-NH1 2.88Å; V100-R187 PolarHBondContact O-NH2 2.94Å; T101-R187 PolarHBondContact O-NH2 3.31Å; V183-R187 WeakPolarHBondContact O-CG 3.3Å; V183-R187 PolarHBondContact O-N 2.91Å; V183-R187 VanDerWaalsContact O-N 3.08Å; A184-R187 PolarHBondContact O-N 3Å; K185-R187 VanDerWaalsContact C-N 3.34Å; K185-R187 PolarHBondContact O-N 3.38Å; R187-S190 PolarHBondContact O-OG 3.42Å; R187-V191 WeakPolarHBondContact O-CG2 3.22Å |
| 188 | T | 63 | Low | 62.6 | Low | 46 Ų | 46 | 100.5 Ų | 100.5 | 28% | 0.282 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -78.8 | -32 | 175 | 50.3 | 0 | 0 | 0 | 0 | 114 | A184 K185 T186 V191 S192 | A184-T188 PolarHBondContact O-N 3.39Å; A184-T188 PolarHBondContact O-OG1 3.02Å; K185-T188 PolarHBondContact O-N 3.21Å; K185-T188 VanDerWaalsContact O-N 3.12Å; K185-T188 PolarHBondContact O-OG1 3.5Å; T186-T188 VanDerWaalsContact C-N 3.3Å; T186-T188 PolarHBondContact O-N 3.19Å; T188-V191 PolarHBondContact O-N 3.48Å; T188-S192 PolarHBondContact O-N 3.14Å; T188-S192 VanDerWaalsContact O-N 3.09Å |
| 189 | R | 59.2 | Low | 60.4 | Low | 179 Ų | 179 | 103.1 Ų | 103.1 | 68% | 0.675 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -67.3 | -40.2 | 175.7 | -68.8 | -179.6 | 86.8 | 151.3 | 6.1 | 111.7 | K185 T186 V191 S192 G193 | K185-R189 PolarHBondContact O-N 3.31Å; T186-R189 PolarHBondContact O-N 2.87Å; R189-V191 VanDerWaalsContact C-N 3.28Å; R189-V191 PolarHBondContact O-N 3.35Å; R189-S192 PolarHBondContact O-N 3.47Å; R189-G193 PolarHBondContact O-N 3.39Å |
| 190 | S | 54 | Low | 58.3 | Low | 79 Ų | 79 | 99.6 Ų | 99.6 | 55% | 0.552 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -66.9 | -27 | 178.1 | 68.3 | 0 | 0 | 0 | 0 | 113.7 | T186 R187 | T186-S190 PolarHBondContact O-N 3.46Å; R187-S190 PolarHBondContact O-OG 3.42Å |
| 191 | V | 55.4 | Low | 56.3 | Low | 60 Ų | 60 | 104.2 Ų | 104.2 | 36% | 0.364 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -79.7 | -37.2 | 174.4 | 176.9 | 0 | 0 | 0 | 0 | 111.4 | R187 T188 R189 K194 | R187-V191 WeakPolarHBondContact O-CG2 3.22Å; T188-V191 PolarHBondContact O-N 3.48Å; R189-V191 VanDerWaalsContact C-N 3.28Å; R189-V191 PolarHBondContact O-N 3.35Å; V191-K194 PolarHBondContact O-N 3.3Å |
| 192 | S | 47.2 | Very low | 54.4 | Low | 90 Ų | 90 | 103.8 Ų | 103.8 | 63% | 0.629 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -72.4 | -26.4 | 177 | -160.7 | 0 | 0 | 0 | 0 | 113.4 | T188 R189 K194 | T188-S192 PolarHBondContact O-N 3.14Å; T188-S192 VanDerWaalsContact O-N 3.09Å; R189-S192 PolarHBondContact O-N 3.47Å; S192-K194 VanDerWaalsContact C-N 3.26Å; S192-K194 PolarHBondContact O-N 2.61Å |
| 193 | G | 45.5 | Very low | 52.3 | Low | 69 Ų | 69 | 106.6 Ų | 106.6 | 71% | 0.711 | 60% | 0.598 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.8 | -8.1 | 173.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | R189 | R189-G193 PolarHBondContact O-N 3.39Š|
| 194 | K | 44.3 | Very low | 50.5 | Low | 173 Ų | 173 | 110.5 Ų | 110.5 | 75% | 0.752 | 63% | 0.627 | S | S | * | * | trans | -109.3 | 56.2 | 171.5 | -76.5 | -176.5 | 176 | 176.2 | 0 | 110.4 | V191 S192 P196 | V191-K194 PolarHBondContact O-N 3.3Å; S192-K194 VanDerWaalsContact C-N 3.26Å; S192-K194 PolarHBondContact O-N 2.61Å; K194-P196 WeakPolarHBondContact O-CD 3.4Å | ||
| 195 | N | 38.3 | Very low | 49.1 | Very low | 135 Ų | 135 | 114.7 Ų | 114.7 | 72% | 0.722 | 64% | 0.644 | S | S | * | * | P | Polyproline II helix | trans | -66.1 | 123.3 | 153.7 | -96.3 | -5.4 | 0 | 0 | 0 | 106.7 | R197 | N195-R197 PolarHBondContact O-N 2.97Å; N195-R197 VanDerWaalsContact O-N 3.09Å |
| 196 | P | 44.8 | Very low | 47.6 | Very low | 113 Ų | 113 | 115.8 Ų | 115.8 | 73% | 0.734 | 66% | 0.664 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 118.9 | 161.1 | -2.7 | 17.3 | 0 | 0 | 0 | 105 | K194 | K194-P196 WeakPolarHBondContact O-CD 3.4Š|
| 197 | R | 35.2 | Very low | 46.6 | Very low | 210 Ų | 210 | 114.9 Ų | 114.9 | 79% | 0.792 | 68% | 0.675 | S | S | * | * | P | Polyproline II helix | trans | -48.9 | 136.8 | 160.6 | -70.4 | 179.5 | 176.6 | -174.2 | -2.3 | 106.3 | N195 D199 | N195-R197 PolarHBondContact O-N 2.97Å; N195-R197 VanDerWaalsContact O-N 3.09Å; R197-D199 PolarHBondContact O-N 3.38Å |
| 198 | P | 42.2 | Very low | 45.9 | Very low | 127 Ų | 127 | 114.1 Ų | 114.1 | 83% | 0.825 | 68% | 0.68 | S | S | * | * | trans | -64.2 | 96.9 | 161.5 | 27.5 | -25.7 | 0 | 0 | 0 | 104.2 | G200 | P198-G200 PolarHBondContact O-N 3.35Š| ||
| 199 | D | 38.9 | Very low | 45.8 | Very low | 135 Ų | 135 | 115.8 Ų | 115.8 | 72% | 0.722 | 69% | 0.694 | S | S | * | * | trans | -62.8 | 94 | 166.7 | -72.3 | -26.8 | 0 | 0 | 0 | 104.9 | R197 V201 | R197-D199 PolarHBondContact O-N 3.38Å; D199-V201 HydrophobicContact CB-CG2 4.31Å; D199-V201 PolarHBondContact O-N 2.88Å | ||
| 200 | G | 43.2 | Very low | 45.7 | Very low | 75 Ų | 75 | 113.7 Ų | 113.7 | 77% | 0.773 | 70% | 0.696 | S | S | * | * | trans | -63.3 | 87.2 | 163.1 | 0 | 0 | 0 | 0 | 0 | 106.7 | P198 | P198-G200 PolarHBondContact O-N 3.35Š| ||
| 201 | V | 39.5 | Very low | 45.8 | Very low | 100 Ų | 100 | 118.3 Ų | 118.3 | 61% | 0.606 | 71% | 0.706 | S | S | * | * | trans | -114.7 | 85.8 | 165.7 | -179.1 | 0 | 0 | 0 | 0 | 106 | D199 Q203 | D199-V201 HydrophobicContact CB-CG2 4.31Å; D199-V201 PolarHBondContact O-N 2.88Å; V201-Q203 HydrophobicContact CG1-CB 3.77Å; V201-Q203 HydrophobicContact CG1-CG 3.79Å; V201-Q203 PolarHBondContact O-N 3.33Å; V201-Q203 VanDerWaalsContact O-N 3.11Å | ||
| 202 | T | 42.3 | Very low | 45.7 | Very low | 145 Ų | 145 | 118.2 Ų | 118.2 | 89% | 0.89 | 71% | 0.708 | S | S | * | * | trans | -70.5 | 87.8 | 152.7 | -47.8 | 0 | 0 | 0 | 0 | 105.7 | ||||
| 203 | Q | 37.2 | Very low | 46.3 | Very low | 143 Ų | 143 | 117.6 Ų | 117.6 | 67% | 0.668 | 70% | 0.7 | S | S | * | * | trans | -124.8 | 106.8 | 161.4 | -81.3 | -174.4 | -7.7 | 0 | 0 | 108.2 | V201 I205 | V201-Q203 HydrophobicContact CG1-CB 3.77Å; V201-Q203 HydrophobicContact CG1-CG 3.79Å; V201-Q203 PolarHBondContact O-N 3.33Å; V201-Q203 VanDerWaalsContact O-N 3.11Å; Q203-I205 PolarHBondContact O-N 3.46Å; Q203-I205 VanDerWaalsContact O-N 3.09Å | ||
| 204 | S | 42.7 | Very low | 47 | Very low | 120 Ų | 120 | 119.6 Ų | 119.6 | 84% | 0.839 | 70% | 0.695 | S | S | * | * | trans | -47.3 | 104.8 | 155.9 | 45.9 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 205 | I | 42.5 | Very low | 47.8 | Very low | 118 Ų | 118 | 116.9 Ų | 116.9 | 61% | 0.605 | 69% | 0.688 | S | S | * | * | trans | -117 | 89.5 | 163.2 | -55.7 | -178 | 0 | 0 | 0 | 107.1 | Q203 G207 V208 | Q203-I205 PolarHBondContact O-N 3.46Å; Q203-I205 VanDerWaalsContact O-N 3.09Å; I205-G207 PolarHBondContact O-N 3.47Å; I205-V208 HydrophobicContact CG2-CG2 3.78Å | ||
| 206 | S | 43.8 | Very low | 48.8 | Very low | 124 Ų | 124 | 116.6 Ų | 116.6 | 87% | 0.867 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.9 | 106.2 | 158.7 | 44.5 | 0 | 0 | 0 | 0 | 108.3 | ||
| 207 | G | 52.1 | Low | 49.6 | Very low | 78 Ų | 78 | 115.1 Ų | 115.1 | 80% | 0.804 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 140.7 | 11.3 | 167.4 | 0 | 0 | 0 | 0 | 0 | 118.9 | I205 | I205-G207 PolarHBondContact O-N 3.47Š|
| 208 | V | 53.7 | Low | 50.9 | Low | 78 Ų | 78 | 108.8 Ų | 108.8 | 47% | 0.473 | 66% | 0.657 | S | S | . | * | trans | -100.4 | 125.5 | 177.7 | -175.1 | 0 | 0 | 0 | 0 | 111 | I205 N210 | I205-V208 HydrophobicContact CG2-CG2 3.78Å; V208-N210 PolarHBondContact O-N 2.9Å | ||
| 209 | S | 60.1 | Low | 51.8 | Low | 80 Ų | 80 | 111.7 Ų | 111.7 | 56% | 0.559 | 65% | 0.652 | S | S | * | * | trans | -47.6 | 133.7 | 175.7 | -177.7 | 0 | 0 | 0 | 0 | 112.8 | K211 S212 | S209-K211 PolarHBondContact O-N 3.01Å; S209-S212 WeakPolarHBondContact O-CB 3.03Å; S209-S212 PolarHBondContact O-N 3.09Å; S209-S212 PolarHBondContact O-OG 2.96Å; S209-S212 VanDerWaalsContact O-OG 3.09Å | ||
| 210 | N | 56.9 | Low | 52.8 | Low | 136 Ų | 136 | 113.4 Ų | 113.4 | 73% | 0.727 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -51.7 | -31.1 | -178.8 | -78.7 | -9.2 | 0 | 0 | 0 | 113.4 | V208 S212 V213 D214 | V208-N210 PolarHBondContact O-N 2.9Å; N210-S212 VanDerWaalsContact C-N 3.31Å; N210-S212 PolarHBondContact O-N 3.44Å; N210-V213 PolarHBondContact O-N 3.03Å; N210-D214 PolarHBondContact O-N 3.47Å; N210-D214 VanDerWaalsContact O-N 3.13Å |
| 211 | K | 57 | Low | 53.6 | Low | 175 Ų | 175 | 117.7 Ų | 117.7 | 76% | 0.761 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -61.6 | -34.6 | 177.3 | -88.5 | 179.7 | 174.3 | 175 | 0 | 113.4 | S209 L215 | S209-K211 PolarHBondContact O-N 3.01Å; K211-L215 WeakPolarHBondContact O-CB 3.09Å; K211-L215 PolarHBondContact O-N 3.17Å |
| 212 | S | 52.4 | Low | 54.5 | Low | 59 Ų | 59 | 116.8 Ų | 116.8 | 41% | 0.413 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -71.3 | -38.7 | -178.5 | -32.7 | 0 | 0 | 0 | 0 | 111.3 | S209 N210 F216 | S209-S212 WeakPolarHBondContact O-CB 3.03Å; S209-S212 PolarHBondContact O-N 3.09Å; S209-S212 PolarHBondContact O-OG 2.96Å; S209-S212 VanDerWaalsContact O-OG 3.09Å; N210-S212 VanDerWaalsContact C-N 3.31Å; N210-S212 PolarHBondContact O-N 3.44Å; S212-F216 PolarHBondContact O-N 2.73Å; S212-F216 VanDerWaalsContact O-N 3.17Å |
| 213 | V | 60.7 | Low | 55.3 | Low | 76 Ų | 76 | 118.3 Ų | 118.3 | 46% | 0.461 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -69.3 | -45.5 | -179.9 | -176.3 | 0 | 0 | 0 | 0 | 109.9 | N210 L215 F216 V217 | N210-V213 PolarHBondContact O-N 3.03Å; V213-L215 VanDerWaalsContact C-N 3.35Å; V213-L215 PolarHBondContact O-N 3.04Å; V213-F216 WeakPolarHBondContact O-CB 3.28Å; V213-F216 PolarHBondContact O-N 3.33Å; V213-F216 VanDerWaalsContact O-N 3.15Å; V213-V217 HydrophobicContact CG1-CG2 4.49Å; V213-V217 WeakPolarHBondContact O-CG2 3.36Å; V213-V217 PolarHBondContact O-N 3.08Å |
| 214 | D | 59.3 | Low | 56.3 | Low | 111 Ų | 111 | 121.2 Ų | 121.2 | 59% | 0.594 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -62.2 | -39.1 | 176.7 | -79.8 | -29.2 | 0 | 0 | 0 | 112.9 | N210 F216 V217 S218 | N210-D214 PolarHBondContact O-N 3.47Å; N210-D214 VanDerWaalsContact O-N 3.13Å; D214-F216 VanDerWaalsContact C-N 3.31Å; D214-F216 PolarHBondContact O-N 2.76Å; D214-V217 PolarHBondContact O-N 2.95Å; D214-S218 VanDerWaalsContact O-CB 3.25Å; D214-S218 WeakPolarHBondContact O-CB 3.15Å; D214-S218 PolarHBondContact O-N 3.35Å |
| 215 | L | 60.9 | Low | 57.1 | Low | 116 Ų | 116 | 117.4 Ų | 117.4 | 61% | 0.607 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -64.4 | -37.6 | 175.7 | -157.4 | 79.2 | 0 | 0 | 0 | 111.6 | K211 V213 R219 | K211-L215 WeakPolarHBondContact O-CB 3.09Å; K211-L215 PolarHBondContact O-N 3.17Å; V213-L215 VanDerWaalsContact C-N 3.35Å; V213-L215 PolarHBondContact O-N 3.04Å; L215-R219 WeakPolarHBondContact O-CB 3.31Å; L215-R219 PolarHBondContact O-N 3.34Å |
| 216 | F | 60.6 | Low | 57.8 | Low | 129 Ų | 129 | 113.8 Ų | 113.8 | 57% | 0.566 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -69.8 | -42 | 177.9 | -135.6 | -93.1 | 0 | 0 | 0 | 112.1 | S212 V213 D214 R220 | S212-F216 PolarHBondContact O-N 2.73Å; S212-F216 VanDerWaalsContact O-N 3.17Å; V213-F216 WeakPolarHBondContact O-CB 3.28Å; V213-F216 PolarHBondContact O-N 3.33Å; V213-F216 VanDerWaalsContact O-N 3.15Å; D214-F216 VanDerWaalsContact C-N 3.31Å; D214-F216 PolarHBondContact O-N 2.76Å; F216-R220 WeakPolarHBondContact O-CG 3.34Å; F216-R220 PolarHBondContact O-N 2.73Å |
| 217 | V | 61.2 | Low | 58.5 | Low | 82 Ų | 82 | 113 Ų | 113 | 50% | 0.497 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -65.6 | -43.2 | 175.4 | 174.2 | 0 | 0 | 0 | 0 | 110.8 | V213 D214 R220 K221 | V213-V217 HydrophobicContact CG1-CG2 4.49Å; V213-V217 WeakPolarHBondContact O-CG2 3.36Å; V213-V217 PolarHBondContact O-N 3.08Å; D214-V217 PolarHBondContact O-N 2.95Å; V217-R220 PolarHBondContact O-N 3.41Å; V217-K221 WeakPolarHBondContact O-CB 3.48Å; V217-K221 PolarHBondContact O-N 3.21Å |
| 218 | S | 62 | Low | 58.8 | Low | 77 Ų | 77 | 111.9 Ų | 111.9 | 54% | 0.538 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -63.1 | -43.9 | 176.7 | -173.2 | 0 | 0 | 0 | 0 | 112.2 | D214 R220 K221 C222 | D214-S218 VanDerWaalsContact O-CB 3.25Å; D214-S218 WeakPolarHBondContact O-CB 3.15Å; D214-S218 PolarHBondContact O-N 3.35Å; S218-R220 PolarHBondContact O-N 2.85Å; S218-K221 PolarHBondContact O-N 2.89Å; S218-C222 WeakPolarHBondContact O-CB 3.31Å; S218-C222 PolarHBondContact O-N 3.11Å |
| 219 | R | 60.5 | Low | 59 | Low | 189 Ų | 189 | 116.8 Ų | 116.8 | 71% | 0.713 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -59.4 | -43.3 | 172 | -93.6 | -177.4 | 172.6 | -176.3 | -0.4 | 112.3 | L215 R223 | L215-R219 WeakPolarHBondContact O-CB 3.31Å; L215-R219 PolarHBondContact O-N 3.34Å; R219-R223 VanDerWaalsContact O-CB 3.24Å; R219-R223 WeakPolarHBondContact O-CB 3.32Å; R219-R223 PolarHBondContact O-N 3.21Å |
| 220 | R | 61.2 | Low | 58.9 | Low | 170 Ų | 170 | 119 Ų | 119 | 64% | 0.642 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -64.2 | -43.6 | 176.6 | -79.3 | -179 | -179 | 174.2 | 0.2 | 111.9 | F216 V217 S218 R223 R224 | F216-R220 WeakPolarHBondContact O-CG 3.34Å; F216-R220 PolarHBondContact O-N 2.73Å; V217-R220 PolarHBondContact O-N 3.41Å; S218-R220 PolarHBondContact O-N 2.85Å; R220-R223 PolarHBondContact O-N 3.41Å; R220-R224 WeakPolarHBondContact O-CB 3.47Å; R220-R224 PolarHBondContact O-N 3.02Å |
| 221 | K | 58.9 | Low | 58.8 | Low | 165 Ų | 165 | 120 Ų | 120 | 72% | 0.717 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -65 | -43 | 178.4 | -160 | 174.9 | -174.7 | 178.1 | 0 | 111.5 | V217 S218 R224 S225 | V217-K221 WeakPolarHBondContact O-CB 3.48Å; V217-K221 PolarHBondContact O-N 3.21Å; S218-K221 PolarHBondContact O-N 2.89Å; K221-R224 PolarHBondContact O-N 2.98Å; K221-S225 WeakPolarHBondContact O-CB 3.34Å; K221-S225 PolarHBondContact O-N 3.15Å |
| 222 | C | 59.5 | Low | 58.8 | Low | 81 Ų | 81 | 116.5 Ų | 116.5 | 55% | 0.547 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -62.9 | -45 | 175.5 | -165.6 | 0 | 0 | 0 | 0 | 111.6 | S218 S225 S226 | S218-C222 WeakPolarHBondContact O-CB 3.31Å; S218-C222 PolarHBondContact O-N 3.11Å; C222-S225 PolarHBondContact O-N 3.19Å; C222-S225 PolarHBondContact O-OG 2.89Å; C222-S226 WeakPolarHBondContact O-CB 3.5Å; C222-S226 PolarHBondContact O-N 3.16Å |
| 223 | R | 58.1 | Low | 59 | Low | 177 Ų | 177 | 117.3 Ų | 117.3 | 67% | 0.668 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -62.1 | -43.2 | 175.7 | -167.6 | 172.2 | 163.2 | -179.8 | -5.5 | 111.9 | R219 R220 S226 F227 | R219-R223 VanDerWaalsContact O-CB 3.24Å; R219-R223 WeakPolarHBondContact O-CB 3.32Å; R219-R223 PolarHBondContact O-N 3.21Å; R220-R223 PolarHBondContact O-N 3.41Å; R223-S226 PolarHBondContact O-N 3.47Å; R223-F227 HydrophobicContact CG-CD2 4.18Å; R223-F227 HydrophobicContact CG-CE2 4.21Å; R223-F227 WeakPolarHBondContact O-CD2 3.28Å; R223-F227 PolarHBondContact O-N 3.23Å |
| 224 | R | 58.7 | Low | 58.8 | Low | 205 Ų | 205 | 116.5 Ų | 116.5 | 77% | 0.774 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -64.7 | -38.7 | 175.7 | -155.7 | 172.7 | -178.1 | 169.7 | -0.3 | 112.1 | R220 K221 F227 A228 | R220-R224 WeakPolarHBondContact O-CB 3.47Å; R220-R224 PolarHBondContact O-N 3.02Å; K221-R224 PolarHBondContact O-N 2.98Å; R224-F227 PolarHBondContact O-N 3.4Å; R224-A228 WeakPolarHBondContact O-CB 3.45Å; R224-A228 PolarHBondContact O-N 2.93Å |
| 225 | S | 58.8 | Low | 58.6 | Low | 39 Ų | 39 | 114 Ų | 114 | 27% | 0.273 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -67.8 | -35.8 | 175 | 91.2 | 0 | 0 | 0 | 0 | 113.2 | K221 C222 R229 | K221-S225 WeakPolarHBondContact O-CB 3.34Å; K221-S225 PolarHBondContact O-N 3.15Å; C222-S225 PolarHBondContact O-N 3.19Å; C222-S225 PolarHBondContact O-OG 2.89Å; S225-R229 WeakPolarHBondContact O-CB 3.44Å; S225-R229 PolarHBondContact O-N 3.34Å; S225-R229 PolarHBondContact OG-NH2 2.96Å |
| 226 | S | 58.4 | Low | 58.4 | Low | 43 Ų | 43 | 117 Ų | 117 | 30% | 0.301 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -68.9 | -42.6 | 175.7 | 141.2 | 0 | 0 | 0 | 0 | 111.2 | C222 R223 R229 K230 | C222-S226 WeakPolarHBondContact O-CB 3.5Å; C222-S226 PolarHBondContact O-N 3.16Å; R223-S226 PolarHBondContact O-N 3.47Å; S226-R229 PolarHBondContact O-N 2.88Å; S226-K230 WeakPolarHBondContact O-CB 2.94Å; S226-K230 WeakPolarHBondContact O-CG 3.29Å; S226-K230 PolarHBondContact O-N 3.03Å |
| 227 | F | 58.2 | Low | 58.3 | Low | 106 Ų | 106 | 114.3 Ų | 114.3 | 47% | 0.465 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -65 | -42.5 | 173.4 | -93.8 | -93.4 | 0 | 0 | 0 | 112.2 | R223 R224 K230 K231 | R223-F227 HydrophobicContact CG-CD2 4.18Å; R223-F227 HydrophobicContact CG-CE2 4.21Å; R223-F227 WeakPolarHBondContact O-CD2 3.28Å; R223-F227 PolarHBondContact O-N 3.23Å; R224-F227 PolarHBondContact O-N 3.4Å; F227-K230 PolarHBondContact O-N 3.39Å; F227-K231 WeakPolarHBondContact O-CB 3.18Å; F227-K231 PolarHBondContact O-N 3.3Å |
| 228 | A | 57.5 | Low | 58.3 | Low | 56 Ų | 56 | 115.4 Ų | 115.4 | 46% | 0.463 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -62.7 | -44.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | R224 K230 K231 V232 | R224-A228 WeakPolarHBondContact O-CB 3.45Å; R224-A228 PolarHBondContact O-N 2.93Å; A228-K230 PolarHBondContact O-N 3.31Å; A228-K231 PolarHBondContact O-N 3.45Å; A228-V232 WeakPolarHBondContact O-CG2 3.21Å; A228-V232 PolarHBondContact O-N 2.97Å |
| 229 | R | 58.5 | Low | 58.3 | Low | 180 Ų | 180 | 117.8 Ų | 117.8 | 68% | 0.679 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -60.1 | -42.7 | 173.5 | -92.9 | -178.8 | -95.2 | -168.5 | -6.8 | 112.5 | S225 S226 V232 S233 | S225-R229 WeakPolarHBondContact O-CB 3.44Å; S225-R229 PolarHBondContact O-N 3.34Å; S225-R229 PolarHBondContact OG-NH2 2.96Å; S226-R229 PolarHBondContact O-N 2.88Å; R229-V232 PolarHBondContact O-N 2.81Å; R229-S233 WeakPolarHBondContact O-CB 3.35Å; R229-S233 PolarHBondContact O-N 3.47Å |
| 230 | K | 57 | Low | 58.4 | Low | 128 Ų | 128 | 111.4 Ų | 111.4 | 56% | 0.557 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -63 | -41 | 174.8 | -77.1 | 177.9 | 179.6 | -178.1 | 0 | 112.2 | S226 F227 A228 S233 Q234 | S226-K230 WeakPolarHBondContact O-CB 2.94Å; S226-K230 WeakPolarHBondContact O-CG 3.29Å; S226-K230 PolarHBondContact O-N 3.03Å; F227-K230 PolarHBondContact O-N 3.39Å; A228-K230 PolarHBondContact O-N 3.31Å; K230-S233 PolarHBondContact O-N 3.24Å; K230-Q234 WeakPolarHBondContact O-CB 3.39Å; K230-Q234 VanDerWaalsContact O-CG 3.28Å; K230-Q234 WeakPolarHBondContact O-CG 3.31Å; K230-Q234 PolarHBondContact O-N 3.5Å |
| 231 | K | 55.3 | Low | 58.6 | Low | 155 Ų | 155 | 104.6 Ų | 104.6 | 67% | 0.674 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -66.7 | -40.2 | 178.9 | -145.5 | 175.9 | -173.5 | -177.8 | 0 | 112.1 | F227 A228 A235 | F227-K231 WeakPolarHBondContact O-CB 3.18Å; F227-K231 PolarHBondContact O-N 3.3Å; A228-K231 PolarHBondContact O-N 3.45Å; K231-A235 WeakPolarHBondContact O-CB 2.99Å; K231-A235 PolarHBondContact O-N 3.26Å |
| 232 | V | 58 | Low | 59.2 | Low | 103 Ų | 103 | 102.5 Ų | 102.5 | 62% | 0.624 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -67.8 | -42.4 | 174.8 | 173.7 | 0 | 0 | 0 | 0 | 111.5 | A228 R229 A235 R236 | A228-V232 WeakPolarHBondContact O-CG2 3.21Å; A228-V232 PolarHBondContact O-N 2.97Å; R229-V232 PolarHBondContact O-N 2.81Å; V232-A235 PolarHBondContact O-N 3.42Å; V232-R236 PolarHBondContact O-N 3.43Å |
| 233 | S | 55.9 | Low | 59.7 | Low | 75 Ų | 75 | 99.1 Ų | 99.1 | 52% | 0.524 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -59.4 | -48.5 | 174.1 | -167.1 | 0 | 0 | 0 | 0 | 111.2 | R229 K230 A235 R236 E237 | R229-S233 WeakPolarHBondContact O-CB 3.35Å; R229-S233 PolarHBondContact O-N 3.47Å; K230-S233 PolarHBondContact O-N 3.24Å; S233-A235 PolarHBondContact O-N 3.24Å; S233-R236 PolarHBondContact O-N 3.02Å; S233-E237 WeakPolarHBondContact O-CB 3.22Å; S233-E237 PolarHBondContact O-N 3.1Å |
| 234 | Q | 56.2 | Low | 60.2 | Low | 59 Ų | 59 | 91 Ų | 91 | 28% | 0.276 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -62.5 | -37.3 | 176.7 | -75.4 | 177.3 | -16.2 | 0 | 0 | 113.2 | K230 E237 K238 | K230-Q234 WeakPolarHBondContact O-CB 3.39Å; K230-Q234 VanDerWaalsContact O-CG 3.28Å; K230-Q234 WeakPolarHBondContact O-CG 3.31Å; K230-Q234 PolarHBondContact O-N 3.5Å; Q234-E237 PolarHBondContact O-N 3.46Å; Q234-K238 WeakPolarHBondContact O-CG 3.38Å; Q234-K238 PolarHBondContact O-N 2.67Å |
| 235 | A | 55.8 | Low | 61 | Low | 59 Ų | 59 | 83 Ų | 83 | 49% | 0.488 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -68.1 | -38.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | K231 V232 S233 E237 R239 | K231-A235 WeakPolarHBondContact O-CB 2.99Å; K231-A235 PolarHBondContact O-N 3.26Å; V232-A235 PolarHBondContact O-N 3.42Å; S233-A235 PolarHBondContact O-N 3.24Å; A235-E237 VanDerWaalsContact C-N 3.34Å; A235-R239 PolarHBondContact O-N 2.9Å; A235-R239 VanDerWaalsContact O-N 3.12Å |
| 236 | R | 56.6 | Low | 61.9 | Low | 179 Ų | 179 | 83 Ų | 83 | 68% | 0.675 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -66.9 | -37.2 | 174.8 | -166.6 | 176.4 | -178.2 | -174.1 | -0.1 | 111.5 | V232 S233 R239 F240 D303 | V232-R236 PolarHBondContact O-N 3.43Å; S233-R236 PolarHBondContact O-N 3.02Å; R236-R239 PolarHBondContact O-N 3.49Å; R236-F240 PolarHBondContact O-N 2.98Å; R236-F240 VanDerWaalsContact O-N 3.13Å; R236-D303 IonicContact NH2-OD2 3.94Å |
| 237 | E | 58.2 | Low | 62.8 | Low | 73 Ų | 73 | 81.1 Ų | 81.1 | 34% | 0.341 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -66.7 | -45.7 | 176.6 | -150.6 | 174.6 | -169.8 | 0 | 0 | 111.7 | S233 Q234 A235 R239 F240 T241 | S233-E237 WeakPolarHBondContact O-CB 3.22Å; S233-E237 PolarHBondContact O-N 3.1Å; Q234-E237 PolarHBondContact O-N 3.46Å; A235-E237 VanDerWaalsContact C-N 3.34Å; E237-R239 VanDerWaalsContact C-N 3.34Å; E237-R239 PolarHBondContact O-N 3.32Å; E237-F240 PolarHBondContact O-N 3.49Å; E237-F240 VanDerWaalsContact O-N 3.13Å; E237-T241 PolarHBondContact O-N 3.3Å; E237-T241 PolarHBondContact O-OG1 3.44Å |
| 238 | K | 61.3 | Low | 63.8 | Low | 104 Ų | 104 | 76.6 Ų | 76.6 | 45% | 0.452 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -58.4 | -42.1 | 173.4 | -77.2 | -179.8 | 176.6 | -168.4 | 0 | 113 | Q234 F240 T241 F242 | Q234-K238 WeakPolarHBondContact O-CG 3.38Å; Q234-K238 PolarHBondContact O-N 2.67Å; K238-F240 VanDerWaalsContact C-N 3.31Å; K238-F240 PolarHBondContact O-N 3.29Å; K238-T241 PolarHBondContact O-N 3.05Å; K238-F242 WeakPolarHBondContact O-CB 3.28Å; K238-F242 PolarHBondContact O-N 3.24Å |
| 239 | R | 62.5 | Low | 65.1 | Low | 127 Ų | 127 | 75.6 Ų | 75.6 | 48% | 0.479 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -62.5 | -40.7 | 176.8 | -171.7 | 176.4 | 178.6 | 157.9 | 6.3 | 110.6 | A235 R236 E237 F242 V243 | A235-R239 PolarHBondContact O-N 2.9Å; A235-R239 VanDerWaalsContact O-N 3.12Å; R236-R239 PolarHBondContact O-N 3.49Å; E237-R239 VanDerWaalsContact C-N 3.34Å; E237-R239 PolarHBondContact O-N 3.32Å; R239-F242 PolarHBondContact O-N 2.93Å; R239-V243 WeakPolarHBondContact O-CG2 3.32Å; R239-V243 PolarHBondContact O-N 3.39Å; R239-V243 VanDerWaalsContact O-N 3.15Å |
| 240 | F | 61.1 | Low | 66.6 | Low | 56 Ų | 56 | 68.8 Ų | 68.8 | 25% | 0.246 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -67.5 | -42.7 | 178.8 | -164.6 | -78.6 | 0 | 0 | 0 | 112.7 | R96 R236 E237 K238 V243 L244 | R96-F240 VanDerWaalsContact CZ-CZ 3.45Å; R96-F240 VanDerWaalsContact NH1-CD1 3.33Å; R236-F240 PolarHBondContact O-N 2.98Å; R236-F240 VanDerWaalsContact O-N 3.13Å; E237-F240 PolarHBondContact O-N 3.49Å; E237-F240 VanDerWaalsContact O-N 3.13Å; K238-F240 VanDerWaalsContact C-N 3.31Å; K238-F240 PolarHBondContact O-N 3.29Å; F240-V243 PolarHBondContact O-N 3.28Å; F240-L244 HydrophobicContact CD1-CD1 4.04Å; F240-L244 HydrophobicContact CD1-CG 4.24Å; F240-L244 HydrophobicContact CE1-CD1 3.45Å; F240-L244 VanDerWaalsContact CE1-CD1 3.45Å; F240-L244 HydrophobicContact CE1-CD2 4.18Å; F240-L244 HydrophobicContact CE1-CG 3.65Å; F240-L244 HydrophobicContact CZ-CD1 4.46Å; F240-L244 HydrophobicContact CZ-CG 4.4Å; F240-L244 PolarHBondContact O-N 2.94Å |
| 241 | T | 67.2 | Low | 68 | Low | 27 Ų | 27 | 62.7 Ų | 62.7 | 17% | 0.166 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -62.7 | -40.8 | 174.9 | -56.9 | 0 | 0 | 0 | 0 | 112.2 | Y177 I180 E237 K238 V243 L244 A245 | Y177-T241 HydrophobicContact CE1-CG2 4.1Å; I180-T241 HydrophobicContact CG2-CG2 3.56Å; E237-T241 PolarHBondContact O-N 3.3Å; E237-T241 PolarHBondContact O-OG1 3.44Å; K238-T241 PolarHBondContact O-N 3.05Å; T241-V243 VanDerWaalsContact C-N 3.29Å; T241-V243 PolarHBondContact O-N 3.37Å; T241-L244 PolarHBondContact O-N 3.41Å; T241-A245 PolarHBondContact O-N 2.93Å |
| 242 | F | 70.8 | Confident | 69.7 | Low | 121 Ų | 121 | 57 Ų | 57 | 53% | 0.531 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -59.6 | -42.1 | 176.1 | 177.2 | -98.3 | 0 | 0 | 0 | 111.8 | K238 R239 L244 A245 V246 F300 | K238-F242 WeakPolarHBondContact O-CB 3.28Å; K238-F242 PolarHBondContact O-N 3.24Å; R239-F242 PolarHBondContact O-N 2.93Å; F242-L244 PolarHBondContact O-N 2.96Å; F242-A245 WeakPolarHBondContact O-CB 3.5Å; F242-A245 PolarHBondContact O-N 3.45Å; F242-A245 VanDerWaalsContact O-N 3.16Å; F242-V246 HydrophobicContact CD1-CG2 4.14Å; F242-V246 HydrophobicContact CE1-CG2 3.69Å; F242-V246 HydrophobicContact CE2-CG2 4.36Å; F242-V246 HydrophobicContact CZ-CG2 3.82Å; F242-V246 WeakPolarHBondContact O-CG2 2.89Å; F242-V246 PolarHBondContact O-N 3.05Å; F242-F300 HydrophobicContact CD1-CE1 4.48Å; F242-F300 HydrophobicContact CE1-CE1 4.05Å |
| 243 | V | 68.9 | Low | 71.3 | Confident | 9 Ų | 9 | 57.2 Ų | 57.2 | 6% | 0.055 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -64.1 | -43.3 | -178.8 | 171.7 | 0 | 0 | 0 | 0 | 111.6 | R239 F240 T241 A245 V246 V247 F300 | R239-V243 WeakPolarHBondContact O-CG2 3.32Å; R239-V243 PolarHBondContact O-N 3.39Å; R239-V243 VanDerWaalsContact O-N 3.15Å; F240-V243 PolarHBondContact O-N 3.28Å; T241-V243 VanDerWaalsContact C-N 3.29Å; T241-V243 PolarHBondContact O-N 3.37Å; V243-A245 VanDerWaalsContact C-N 3.33Å; V243-V246 WeakPolarHBondContact O-CB 3.47Å; V243-V246 PolarHBondContact O-N 3.27Å; V243-V247 WeakPolarHBondContact O-CG2 3.01Å; V243-V247 PolarHBondContact O-N 2.96Å; V243-F300 HydrophobicContact CB-CB 3.97Å; V243-F300 HydrophobicContact CB-CG 4.27Å; V243-F300 HydrophobicContact CG1-CB 3.36Å; V243-F300 HydrophobicContact CG1-CD2 4.26Å; V243-F300 HydrophobicContact CG1-CG 3.89Å; V243-F300 HydrophobicContact CG2-CB 3.35Å; V243-F300 HydrophobicContact CG2-CD1 3.59Å; V243-F300 HydrophobicContact CG2-CG 3.59Å |
| 244 | L | 69.1 | Low | 73.1 | Confident | 8 Ų | 8 | 54.2 Ų | 54.2 | 4% | 0.042 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -69.1 | -32.5 | 175.1 | -66.4 | -179.3 | 0 | 0 | 0 | 112.7 | I92 R96 Y177 F240 T241 F242 V246 V247 M248 | I92-L244 HydrophobicContact CG2-CD1 3.74Å; I92-L244 HydrophobicContact CG2-CD2 3.88Å; I92-L244 HydrophobicContact CG2-CG 4.45Å; R96-L244 HydrophobicContact CB-CD1 4.38Å; R96-L244 HydrophobicContact CG-CD1 3.4Å; Y177-L244 WeakPolarHBondContact OH-CB 3.18Å; F240-L244 HydrophobicContact CD1-CD1 4.04Å; F240-L244 HydrophobicContact CD1-CG 4.24Å; F240-L244 HydrophobicContact CE1-CD1 3.45Å; F240-L244 VanDerWaalsContact CE1-CD1 3.45Å; F240-L244 HydrophobicContact CE1-CD2 4.18Å; F240-L244 HydrophobicContact CE1-CG 3.65Å; F240-L244 HydrophobicContact CZ-CD1 4.46Å; F240-L244 HydrophobicContact CZ-CG 4.4Å; F240-L244 PolarHBondContact O-N 2.94Å; T241-L244 PolarHBondContact O-N 3.41Å; F242-L244 PolarHBondContact O-N 2.96Å; L244-V246 VanDerWaalsContact C-N 3.29Å; L244-V246 PolarHBondContact O-N 3.5Å; L244-V247 PolarHBondContact O-N 3.39Å; L244-M248 HydrophobicContact CB-CE 4.27Å; L244-M248 VanDerWaalsContact O-CG 3.23Å; L244-M248 WeakPolarHBondContact O-CG 3.22Å; L244-M248 PolarHBondContact O-N 3.47Å |
| 245 | A | 75.5 | Confident | 74.8 | Confident | 37 Ų | 37 | 51.9 Ų | 51.9 | 31% | 0.306 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -62.2 | -38.5 | 171 | 0 | 0 | 0 | 0 | 0 | 111.4 | Y177 T241 F242 V243 M248 G249 | Y177-A245 HydrophobicContact CD1-CB 3.86Å; Y177-A245 HydrophobicContact CE1-CB 3.59Å; T241-A245 PolarHBondContact O-N 2.93Å; F242-A245 WeakPolarHBondContact O-CB 3.5Å; F242-A245 PolarHBondContact O-N 3.45Å; F242-A245 VanDerWaalsContact O-N 3.16Å; V243-A245 VanDerWaalsContact C-N 3.33Å; A245-M248 PolarHBondContact O-N 2.89Å; A245-G249 PolarHBondContact O-N 3.42Å |
| 246 | V | 78.5 | Confident | 76.6 | Confident | 39 Ų | 39 | 53.5 Ų | 53.5 | 24% | 0.236 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -65.2 | -48 | 174.4 | 172.9 | 0 | 0 | 0 | 0 | 111.1 | F242 V243 L244 M248 G249 V250 F300 | F242-V246 HydrophobicContact CD1-CG2 4.14Å; F242-V246 HydrophobicContact CE1-CG2 3.69Å; F242-V246 HydrophobicContact CE2-CG2 4.36Å; F242-V246 HydrophobicContact CZ-CG2 3.82Å; F242-V246 WeakPolarHBondContact O-CG2 2.89Å; F242-V246 PolarHBondContact O-N 3.05Å; V243-V246 WeakPolarHBondContact O-CB 3.47Å; V243-V246 PolarHBondContact O-N 3.27Å; L244-V246 VanDerWaalsContact C-N 3.29Å; L244-V246 PolarHBondContact O-N 3.5Å; V246-M248 PolarHBondContact O-N 2.62Å; V246-G249 PolarHBondContact O-N 2.66Å; V246-V250 HydrophobicContact CG1-CG2 4.38Å; V246-V250 WeakPolarHBondContact O-CG2 3.21Å; V246-V250 PolarHBondContact O-N 3.11Å; V246-F300 HydrophobicContact CB-CE2 4.45Å; V246-F300 HydrophobicContact CG1-CE2 3.85Å; V246-F300 HydrophobicContact CG1-CZ 4.12Å; V246-F300 HydrophobicContact CG2-CZ 4.33Å |
| 247 | V | 75.9 | Confident | 78.4 | Confident | 2 Ų | 2 | 46.6 Ų | 46.6 | 1% | 0.012 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -52.4 | -45.1 | 175.5 | 176 | 0 | 0 | 0 | 0 | 110.6 | L89 V243 L244 V250 F251 I296 Y297 | L89-V247 HydrophobicContact CD2-CG1 3.67Å; V243-V247 WeakPolarHBondContact O-CG2 3.01Å; V243-V247 PolarHBondContact O-N 2.96Å; L244-V247 PolarHBondContact O-N 3.39Å; V247-V250 PolarHBondContact O-N 3.42Å; V247-F251 PolarHBondContact O-N 2.91Å; V247-F251 VanDerWaalsContact O-N 3.07Å; V247-I296 HydrophobicContact CG2-CB 4.34Å; V247-I296 HydrophobicContact CG2-CD1 4.44Å; V247-I296 HydrophobicContact CG2-CG2 3.43Å; V247-I296 VanDerWaalsContact CG2-CG2 3.43Å; V247-Y297 HydrophobicContact CG2-CE1 4.33Å |
| 248 | M | 81 | Confident | 80.1 | Confident | 11 Ų | 11 | 43.6 Ų | 43.6 | 5% | 0.054 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -72.7 | -38.9 | -178.3 | -67.1 | 170.2 | -164.6 | 0 | 0 | 112.9 | L89 M173 Y177 L244 A245 V246 V250 F251 V252 | L89-M248 HydrophobicContact CB-CG 4.37Å; L89-M248 HydrophobicContact CD2-CG 4.43Å; L89-M248 WeakPolarHBondContact O-CE 3.33Å; M173-M248 HydrophobicContact SD-CG 3.99Å; M173-M248 HydrophobicContact SD-SD 3.96Å; Y177-M248 HydrophobicContact CD2-SD 3.77Å; Y177-M248 HydrophobicContact CE1-SD 4.48Å; Y177-M248 HydrophobicContact CE2-CE 3.56Å; Y177-M248 HydrophobicContact CE2-SD 2.96Å; Y177-M248 WeakPolarHBondContact CE2-SD 3.2Å; Y177-M248 WeakPolarHBondContact OH-CE 3.45Å; Y177-M248 PolarHBondContact OH-SD 3.05Å; L244-M248 HydrophobicContact CB-CE 4.27Å; L244-M248 VanDerWaalsContact O-CG 3.23Å; L244-M248 WeakPolarHBondContact O-CG 3.22Å; L244-M248 PolarHBondContact O-N 3.47Å; A245-M248 PolarHBondContact O-N 2.89Å; V246-M248 PolarHBondContact O-N 2.62Å; M248-V250 VanDerWaalsContact C-N 3.3Å; M248-V250 PolarHBondContact O-N 3.43Å; M248-F251 PolarHBondContact O-N 3.49Å; M248-V252 WeakPolarHBondContact O-CG2 3.43Å; M248-V252 PolarHBondContact O-N 3.37Å |
| 249 | G | 84.8 | Confident | 81.5 | Confident | 36 Ų | 36 | 39.2 Ų | 39.2 | 37% | 0.371 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -60.3 | -41.9 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | A245 V246 V252 V253 | A245-G249 PolarHBondContact O-N 3.42Å; V246-G249 PolarHBondContact O-N 2.66Å; G249-V252 PolarHBondContact O-N 2.89Å; G249-V253 WeakPolarHBondContact O-CB 3.28Å; G249-V253 VanDerWaalsContact O-CG2 3.26Å; G249-V253 WeakPolarHBondContact O-CG2 3.39Å; G249-V253 PolarHBondContact O-N 2.79Å |
| 250 | V | 88.3 | Confident | 83 | Confident | 37 Ų | 37 | 38 Ų | 38 | 22% | 0.224 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -61.4 | -46.9 | 174.7 | 172.2 | 0 | 0 | 0 | 0 | 110.7 | V246 V247 M248 V252 V253 C254 L292 I296 | V246-V250 HydrophobicContact CG1-CG2 4.38Å; V246-V250 WeakPolarHBondContact O-CG2 3.21Å; V246-V250 PolarHBondContact O-N 3.11Å; V247-V250 PolarHBondContact O-N 3.42Å; M248-V250 VanDerWaalsContact C-N 3.3Å; M248-V250 PolarHBondContact O-N 3.43Å; V250-V252 PolarHBondContact O-N 2.78Å; V250-V253 PolarHBondContact O-N 3.29Å; V250-C254 WeakPolarHBondContact O-CB 3.42Å; V250-C254 PolarHBondContact O-N 3.38Å; V250-C254 PolarHBondContact O-SG 3.31Å; V250-C254 VanDerWaalsContact O-SG 3.32Å; V250-L292 HydrophobicContact CG1-CB 4.32Å; V250-L292 HydrophobicContact CG1-CD1 3.56Å; V250-I296 HydrophobicContact CB-CD1 4.22Å; V250-I296 HydrophobicContact CG1-CD1 4.24Å; V250-I296 HydrophobicContact CG2-CD1 4.09Å |
| 251 | F | 87.6 | Confident | 84.5 | Confident | 0 Ų | 0 | 35.6 Ų | 35.6 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -55.8 | -49.7 | 176.8 | -173.5 | -80.6 | 0 | 0 | 0 | 112.1 | I86 L89 F166 V247 M248 C254 W255 N289 | I86-F251 HydrophobicContact CB-CE1 3.72Å; I86-F251 HydrophobicContact CB-CE2 4.45Å; I86-F251 HydrophobicContact CB-CZ 3.68Å; I86-F251 HydrophobicContact CD1-CD1 4.21Å; I86-F251 HydrophobicContact CD1-CE1 3.66Å; I86-F251 HydrophobicContact CD1-CZ 4.47Å; I86-F251 HydrophobicContact CG1-CD1 4.16Å; I86-F251 HydrophobicContact CG1-CE1 3.7Å; I86-F251 HydrophobicContact CG1-CZ 4.2Å; L89-F251 HydrophobicContact CD1-CB 3.66Å; L89-F251 HydrophobicContact CD1-CD1 4.37Å; L89-F251 HydrophobicContact CD1-CD2 3.58Å; L89-F251 HydrophobicContact CD1-CE2 4.39Å; L89-F251 HydrophobicContact CD1-CG 3.59Å; F166-F251 HydrophobicContact CD2-CE1 4.07Å; F166-F251 HydrophobicContact CE2-CD1 4.37Å; F166-F251 HydrophobicContact CE2-CE1 4.03Å; V247-F251 PolarHBondContact O-N 2.91Å; V247-F251 VanDerWaalsContact O-N 3.07Å; M248-F251 PolarHBondContact O-N 3.49Å; F251-C254 PolarHBondContact O-N 2.92Å; F251-W255 AromaticContact CD2-CD1 3.92Å; F251-W255 HydrophobicContact CE1-CB 4.16Å; F251-W255 AromaticContact CE1-CD1 3.76Å; F251-W255 HydrophobicContact CE1-CG 4.07Å; F251-W255 AromaticContact CE2-CD1 3.58Å; F251-W255 HydrophobicContact CE2-CG 4.49Å; F251-W255 AromaticContact CE2-NE1 3.7Å; F251-W255 AromaticContact CZ-CD1 3.48Å; F251-W255 VanDerWaalsContact CZ-CD1 3.48Å; F251-W255 AromaticContact CZ-CG 4Å; F251-W255 HydrophobicContact CZ-CG 4Å; F251-W255 AromaticContact CZ-NE1 3.85Å; F251-W255 WeakPolarHBondContact O-CB 3.46Å; F251-W255 PolarHBondContact O-N 2.84Å; F251-N289 WeakPolarHBondContact CA-OD1 3.47Å; F251-N289 VanDerWaalsContact CD2-ND2 3.33Å; F251-N289 WeakPolarHBondContact CD2-ND2 3.31Å |
| 252 | V | 90.2 | Very high | 85.6 | Confident | 36 Ų | 36 | 34.9 Ų | 34.9 | 22% | 0.218 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -62.8 | -45.8 | -179.9 | 174.3 | 0 | 0 | 0 | 0 | 110.6 | F166 M248 G249 V250 C254 W255 F256 | F166-V252 HydrophobicContact CZ-CG1 4.36Å; M248-V252 WeakPolarHBondContact O-CG2 3.43Å; M248-V252 PolarHBondContact O-N 3.37Å; G249-V252 PolarHBondContact O-N 2.89Å; V250-V252 PolarHBondContact O-N 2.78Å; V252-C254 VanDerWaalsContact C-N 3.3Å; V252-C254 PolarHBondContact O-N 3.49Å; V252-W255 PolarHBondContact O-N 2.75Å; V252-F256 HydrophobicContact CG1-CB 4.41Å; V252-F256 WeakPolarHBondContact O-CA 3.42Å; V252-F256 WeakPolarHBondContact O-CB 3.2Å; V252-F256 PolarHBondContact O-N 3.43Å |
| 253 | V | 92.6 | Very high | 86.6 | Confident | 106 Ų | 106 | 29.8 Ų | 29.8 | 64% | 0.642 | 17% | 0.173 | S | C | * | . | H | α-helix | trans | -62.9 | -37.8 | 179.1 | 169.4 | 0 | 0 | 0 | 0 | 111.8 | G249 V250 P257 | G249-V253 WeakPolarHBondContact O-CB 3.28Å; G249-V253 VanDerWaalsContact O-CG2 3.26Å; G249-V253 WeakPolarHBondContact O-CG2 3.39Å; G249-V253 PolarHBondContact O-N 2.79Å; V250-V253 PolarHBondContact O-N 3.29Å; V253-P257 WeakPolarHBondContact O-CD 3.36Å |
| 254 | C | 92.8 | Very high | 87.7 | Confident | 12 Ų | 12 | 32.2 Ų | 32.2 | 8% | 0.081 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -71.1 | -42.1 | 179.6 | -73.4 | 0 | 0 | 0 | 0 | 112.8 | V250 F251 V252 I285 N289 | V250-C254 WeakPolarHBondContact O-CB 3.42Å; V250-C254 PolarHBondContact O-N 3.38Å; V250-C254 PolarHBondContact O-SG 3.31Å; V250-C254 VanDerWaalsContact O-SG 3.32Å; F251-C254 PolarHBondContact O-N 2.92Å; V252-C254 VanDerWaalsContact C-N 3.3Å; V252-C254 PolarHBondContact O-N 3.49Å; C254-I285 HydrophobicContact CB-CG2 4.16Å; C254-I285 WeakPolarHBondContact O-CG2 3.35Å; C254-N289 HydrophobicContact CB-CB 3.93Å |
| 255 | W | 92.9 | Very high | 88.6 | Confident | 10 Ų | 10 | 34.3 Ų | 34.3 | 4% | 0.038 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -95.4 | -22.1 | -172.5 | -78.8 | 99.6 | 0 | 0 | 0 | 114.3 | C82 F166 F251 V252 F258 F259 G286 Y287 | C82-W255 HydrophobicContact CB-CH2 3.97Å; C82-W255 HydrophobicContact CB-CZ2 4.14Å; C82-W255 HydrophobicContact CB-CZ3 4.42Å; F166-W255 HydrophobicContact CD2-CB 4.07Å; F166-W255 HydrophobicContact CE2-CB 3.64Å; F166-W255 HydrophobicContact CZ-CB 4.45Å; F251-W255 AromaticContact CD2-CD1 3.92Å; F251-W255 HydrophobicContact CE1-CB 4.16Å; F251-W255 AromaticContact CE1-CD1 3.76Å; F251-W255 HydrophobicContact CE1-CG 4.07Å; F251-W255 AromaticContact CE2-CD1 3.58Å; F251-W255 HydrophobicContact CE2-CG 4.49Å; F251-W255 AromaticContact CE2-NE1 3.7Å; F251-W255 AromaticContact CZ-CD1 3.48Å; F251-W255 VanDerWaalsContact CZ-CD1 3.48Å; F251-W255 AromaticContact CZ-CG 4Å; F251-W255 HydrophobicContact CZ-CG 4Å; F251-W255 AromaticContact CZ-NE1 3.85Å; F251-W255 WeakPolarHBondContact O-CB 3.46Å; F251-W255 PolarHBondContact O-N 2.84Å; V252-W255 PolarHBondContact O-N 2.75Å; W255-F258 HydrophobicContact CE3-CD1 4.02Å; W255-F258 HydrophobicContact CZ3-CD1 4.03Å; W255-F258 HydrophobicContact CZ3-CE1 4.39Å; W255-F258 PolarHBondContact O-N 2.87Å; W255-F259 HydrophobicContact CB-CD2 4.01Å; W255-F259 HydrophobicContact CB-CE2 4.12Å; W255-F259 HydrophobicContact CD2-CE2 4.09Å; W255-F259 HydrophobicContact CE3-CD2 4.07Å; W255-F259 AromaticContact CE3-CE2 3.48Å; W255-F259 HydrophobicContact CE3-CE2 3.48Å; W255-F259 VanDerWaalsContact CE3-CE2 3.48Å; W255-F259 HydrophobicContact CE3-CZ 4.32Å; W255-F259 HydrophobicContact CG-CE2 4.39Å; W255-F259 HydrophobicContact CZ3-CE2 4.21Å; W255-F259 WeakPolarHBondContact O-CD2 3.22Å; W255-F259 PolarHBondContact O-N 3.47Å; W255-G286 PolarHBondContact NE1-O 3.37Å; W255-Y287 HydrophobicContact CH2-CE1 4.46Å |
| 256 | F | 93.8 | Very high | 89.2 | Confident | 94 Ų | 94 | 32.6 Ų | 32.6 | 41% | 0.412 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -57.4 | -46.6 | -178.8 | 177.8 | -94 | 0 | 0 | 0 | 113.6 | F166 V252 F258 F259 F260 | F166-F256 HydrophobicContact CE1-CB 4.38Å; F166-F256 HydrophobicContact CE1-CD2 4.11Å; F166-F256 HydrophobicContact CZ-CB 3.98Å; F166-F256 HydrophobicContact CZ-CD2 4.42Å; V252-F256 HydrophobicContact CG1-CB 4.41Å; V252-F256 WeakPolarHBondContact O-CA 3.42Å; V252-F256 WeakPolarHBondContact O-CB 3.2Å; V252-F256 PolarHBondContact O-N 3.43Å; F256-F258 VanDerWaalsContact C-N 3.27Å; F256-F258 PolarHBondContact O-N 3.29Å; F256-F259 PolarHBondContact O-N 2.91Å; F256-F260 HydrophobicContact CD1-CB 4.48Å; F256-F260 HydrophobicContact CE1-CB 4.19Å; F256-F260 HydrophobicContact CE1-CG 4.28Å; F256-F260 HydrophobicContact CE2-CB 4.44Å; F256-F260 HydrophobicContact CZ-CB 4.17Å; F256-F260 HydrophobicContact CZ-CD2 4.01Å; F256-F260 HydrophobicContact CZ-CG 4.14Å; F256-F260 WeakPolarHBondContact O-CB 3.44Å; F256-F260 PolarHBondContact O-N 3.32Å |
| 257 | P | 94.3 | Very high | 89.8 | Confident | 33 Ų | 33 | 36.5 Ų | 36.5 | 21% | 0.214 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -57.6 | -41.6 | -179.9 | -24.6 | 34.8 | 0 | 0 | 0 | 112.4 | V253 S261 F282 | V253-P257 WeakPolarHBondContact O-CD 3.36Å; P257-S261 WeakPolarHBondContact O-CB 3.15Å; P257-S261 PolarHBondContact O-N 2.85Å; P257-S261 PolarHBondContact O-OG 3.28Å; P257-F282 HydrophobicContact CB-CB 4.19Å; P257-F282 HydrophobicContact CB-CD1 3.7Å; P257-F282 HydrophobicContact CB-CD2 4.01Å; P257-F282 HydrophobicContact CB-CE1 4Å; P257-F282 HydrophobicContact CB-CE2 4.29Å; P257-F282 HydrophobicContact CB-CG 3.71Å; P257-F282 HydrophobicContact CB-CZ 4.28Å |
| 258 | F | 92.3 | Very high | 90.4 | Very high | 11 Ų | 11 | 38.3 Ų | 38.3 | 5% | 0.048 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -65 | -59.4 | 177 | 174 | -102.3 | 0 | 0 | 0 | 111.4 | L151 W255 F256 F260 S261 Y262 F279 F282 F283 | L151-F258 HydrophobicContact CD1-CZ 4.15Å; W255-F258 HydrophobicContact CE3-CD1 4.02Å; W255-F258 HydrophobicContact CZ3-CD1 4.03Å; W255-F258 HydrophobicContact CZ3-CE1 4.39Å; W255-F258 PolarHBondContact O-N 2.87Å; F256-F258 VanDerWaalsContact C-N 3.27Å; F256-F258 PolarHBondContact O-N 3.29Å; F258-F260 VanDerWaalsContact C-N 3.27Å; F258-F260 PolarHBondContact O-N 3.31Å; F258-S261 PolarHBondContact O-N 3.49Å; F258-S261 PolarHBondContact O-OG 3.08Å; F258-Y262 HydrophobicContact CZ-CG 4.47Å; F258-Y262 WeakPolarHBondContact O-CB 3.26Å; F258-Y262 PolarHBondContact O-N 3.4Å; F258-F279 HydrophobicContact CD2-CE2 4.32Å; F258-F279 HydrophobicContact CD2-CZ 4.27Å; F258-F279 HydrophobicContact CE2-CE1 4.01Å; F258-F279 AromaticContact CE2-CE2 3.91Å; F258-F279 HydrophobicContact CE2-CE2 3.91Å; F258-F279 AromaticContact CE2-CZ 3.47Å; F258-F279 HydrophobicContact CE2-CZ 3.47Å; F258-F279 VanDerWaalsContact CE2-CZ 3.47Å; F258-F279 HydrophobicContact CZ-CZ 4.28Å; F258-F282 HydrophobicContact CB-CB 4.2Å; F258-F283 HydrophobicContact CD2-CB 4.2Å; F258-F283 AromaticContact CD2-CD2 3.68Å; F258-F283 HydrophobicContact CD2-CD2 3.68Å; F258-F283 HydrophobicContact CD2-CG 4.43Å; F258-F283 HydrophobicContact CE1-CD2 4.29Å; F258-F283 HydrophobicContact CE1-CE2 4.39Å; F258-F283 HydrophobicContact CE2-CB 4.44Å; F258-F283 AromaticContact CE2-CD2 3.36Å; F258-F283 HydrophobicContact CE2-CD2 3.36Å; F258-F283 AromaticContact CE2-CE2 3.95Å; F258-F283 HydrophobicContact CE2-CE2 3.95Å; F258-F283 HydrophobicContact CE2-CG 4.3Å; F258-F283 HydrophobicContact CG-CD2 4.26Å; F258-F283 AromaticContact CZ-CD2 3.7Å; F258-F283 HydrophobicContact CZ-CD2 3.7Å; F258-F283 AromaticContact CZ-CE2 3.83Å; F258-F283 HydrophobicContact CZ-CE2 3.83Å |
| 259 | F | 92.6 | Very high | 90.7 | Very high | 11 Ų | 11 | 39.1 Ų | 39.1 | 5% | 0.048 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -62.5 | -34 | -176.4 | -80.4 | -73.1 | 0 | 0 | 0 | 113.1 | F166 F167 W255 F256 S263 | F166-F259 HydrophobicContact CB-CB 4.25Å; F166-F259 HydrophobicContact CB-CD1 3.69Å; F166-F259 HydrophobicContact CB-CD2 3.5Å; F166-F259 VanDerWaalsContact CB-CD2 3.5Å; F166-F259 HydrophobicContact CB-CE1 3.81Å; F166-F259 HydrophobicContact CB-CE2 3.64Å; F166-F259 HydrophobicContact CB-CG 3.53Å; F166-F259 HydrophobicContact CB-CZ 3.8Å; F166-F259 HydrophobicContact CD1-CB 3.68Å; F166-F259 AromaticContact CD1-CD2 3.92Å; F166-F259 HydrophobicContact CD1-CD2 3.92Å; F166-F259 AromaticContact CD1-CG 3.86Å; F166-F259 HydrophobicContact CD1-CG 3.86Å; F166-F259 AromaticContact CD2-CD2 3.44Å; F166-F259 HydrophobicContact CD2-CD2 3.44Å; F166-F259 VanDerWaalsContact CD2-CD2 3.44Å; F166-F259 AromaticContact CD2-CE2 3.72Å; F166-F259 HydrophobicContact CD2-CE2 3.72Å; F166-F259 HydrophobicContact CD2-CG 4.19Å; F166-F259 HydrophobicContact CE1-CB 4.2Å; F166-F259 HydrophobicContact CE2-CD2 4.11Å; F166-F259 HydrophobicContact CG-CB 3.98Å; F166-F259 HydrophobicContact CG-CD1 4.28Å; F166-F259 AromaticContact CG-CD2 3.33Å; F166-F259 HydrophobicContact CG-CD2 3.33Å; F166-F259 AromaticContact CG-CE2 3.83Å; F166-F259 HydrophobicContact CG-CE2 3.83Å; F166-F259 AromaticContact CG-CG 3.6Å; F166-F259 HydrophobicContact CG-CG 3.6Å; F166-F259 HydrophobicContact CG-CZ 4.48Å; F167-F259 HydrophobicContact CE2-CB 4.37Å; F167-F259 HydrophobicContact CZ-CB 4.33Å; W255-F259 HydrophobicContact CB-CD2 4.01Å; W255-F259 HydrophobicContact CB-CE2 4.12Å; W255-F259 HydrophobicContact CD2-CE2 4.09Å; W255-F259 HydrophobicContact CE3-CD2 4.07Å; W255-F259 AromaticContact CE3-CE2 3.48Å; W255-F259 HydrophobicContact CE3-CE2 3.48Å; W255-F259 VanDerWaalsContact CE3-CE2 3.48Å; W255-F259 HydrophobicContact CE3-CZ 4.32Å; W255-F259 HydrophobicContact CG-CE2 4.39Å; W255-F259 HydrophobicContact CZ3-CE2 4.21Å; W255-F259 WeakPolarHBondContact O-CD2 3.22Å; W255-F259 PolarHBondContact O-N 3.47Å; F256-F259 PolarHBondContact O-N 2.91Å; F259-S263 VanDerWaalsContact O-CB 3.24Å; F259-S263 WeakPolarHBondContact O-CB 3.29Å; F259-S263 PolarHBondContact O-N 3.4Å; F259-S263 PolarHBondContact O-OG 2.7Å |
| 260 | F | 93.4 | Very high | 90.7 | Very high | 101 Ų | 101 | 43.3 Ų | 43.3 | 44% | 0.443 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -65.4 | -51.4 | 174.6 | -179.1 | -104.3 | 0 | 0 | 0 | 111.3 | F256 F258 Y262 S263 L264 | F256-F260 HydrophobicContact CD1-CB 4.48Å; F256-F260 HydrophobicContact CE1-CB 4.19Å; F256-F260 HydrophobicContact CE1-CG 4.28Å; F256-F260 HydrophobicContact CE2-CB 4.44Å; F256-F260 HydrophobicContact CZ-CB 4.17Å; F256-F260 HydrophobicContact CZ-CD2 4.01Å; F256-F260 HydrophobicContact CZ-CG 4.14Å; F256-F260 WeakPolarHBondContact O-CB 3.44Å; F256-F260 PolarHBondContact O-N 3.32Å; F258-F260 VanDerWaalsContact C-N 3.27Å; F258-F260 PolarHBondContact O-N 3.31Å; F260-Y262 PolarHBondContact O-N 3.46Å; F260-S263 PolarHBondContact O-N 2.98Å; F260-L264 HydrophobicContact CD1-CD1 3.83Å; F260-L264 HydrophobicContact CE1-CD1 3.31Å; F260-L264 HydrophobicContact CE1-CG 4.19Å; F260-L264 HydrophobicContact CE2-CD1 4.39Å; F260-L264 HydrophobicContact CE2-CG 4.48Å; F260-L264 HydrophobicContact CZ-CD1 3.64Å; F260-L264 HydrophobicContact CZ-CD2 4.47Å; F260-L264 HydrophobicContact CZ-CG 4.18Å; F260-L264 WeakPolarHBondContact O-CG 3.45Å; F260-L264 PolarHBondContact O-N 2.91Å |
| 261 | S | 91.8 | Very high | 90.6 | Very high | 7 Ų | 7 | 47 Ų | 47 | 5% | 0.049 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -64.3 | -39.6 | 178.9 | 65.2 | 0 | 0 | 0 | 0 | 113 | P257 F258 L264 Y265 | P257-S261 WeakPolarHBondContact O-CB 3.15Å; P257-S261 PolarHBondContact O-N 2.85Å; P257-S261 PolarHBondContact O-OG 3.28Å; F258-S261 PolarHBondContact O-N 3.49Å; F258-S261 PolarHBondContact O-OG 3.08Å; S261-L264 PolarHBondContact O-N 2.87Å; S261-Y265 PolarHBondContact O-N 2.86Å |
| 262 | Y | 90.3 | Very high | 90.6 | Very high | 11 Ų | 11 | 49 Ų | 49 | 4% | 0.043 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -65.9 | -41.1 | 176.9 | -173 | -122.6 | 0 | 0 | 0 | 111.7 | L151 N152 I158 S162 F258 F260 Y265 G266 F279 | L151-Y262 HydrophobicContact CB-CE2 4.11Å; L151-Y262 HydrophobicContact CD1-CE2 4.13Å; N152-Y262 PolarHBondContact O-OH 3.33Å; I158-Y262 HydrophobicContact CB-CE1 4.19Å; I158-Y262 HydrophobicContact CD1-CE2 4.46Å; I158-Y262 HydrophobicContact CG1-CE1 4.19Å; I158-Y262 HydrophobicContact CG1-CE2 4.09Å; I158-Y262 HydrophobicContact CG2-CD1 3.86Å; I158-Y262 HydrophobicContact CG2-CD2 4.42Å; I158-Y262 HydrophobicContact CG2-CE1 3.75Å; I158-Y262 HydrophobicContact CG2-CE2 4.34Å; I158-Y262 HydrophobicContact CG2-CG 4.19Å; I158-Y262 WeakPolarHBondContact CG2-O 3.39Å; S162-Y262 WeakPolarHBondContact OG-CD1 3.46Å; F258-Y262 HydrophobicContact CZ-CG 4.47Å; F258-Y262 WeakPolarHBondContact O-CB 3.26Å; F258-Y262 PolarHBondContact O-N 3.4Å; F260-Y262 PolarHBondContact O-N 3.46Å; Y262-Y265 PolarHBondContact O-N 3.39Å; Y262-G266 PolarHBondContact O-N 3.09Å; Y262-F279 HydrophobicContact CD2-CE2 4.11Å; Y262-F279 HydrophobicContact CD2-CZ 4.1Å |
| 263 | S | 92.3 | Very high | 90.3 | Very high | 14 Ų | 14 | 53.7 Ų | 53.7 | 10% | 0.098 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -68.3 | -37.9 | 175.2 | -58.6 | 0 | 0 | 0 | 0 | 112.5 | S162 F167 F259 F260 Y265 G266 I267 | S162-S263 WeakPolarHBondContact CB-OG 3.11Å; S162-S263 PolarHBondContact OG-OG 2.96Å; F167-S263 WeakPolarHBondContact CE2-OG 3.47Å; F259-S263 VanDerWaalsContact O-CB 3.24Å; F259-S263 WeakPolarHBondContact O-CB 3.29Å; F259-S263 PolarHBondContact O-N 3.4Å; F259-S263 PolarHBondContact O-OG 2.7Å; F260-S263 PolarHBondContact O-N 2.98Å; S263-Y265 VanDerWaalsContact C-N 3.35Å; S263-G266 PolarHBondContact O-N 3.25Å; S263-I267 WeakPolarHBondContact O-CG1 3.25Å; S263-I267 PolarHBondContact O-N 2.97Å; S263-I267 VanDerWaalsContact O-N 3.12Å |
| 264 | L | 91.4 | Very high | 90.1 | Very high | 60 Ų | 60 | 50.8 Ų | 50.8 | 31% | 0.314 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -60.3 | -45.9 | 173.3 | -78.8 | 177.2 | 0 | 0 | 0 | 111.1 | F260 S261 G266 I267 C268 C272 | F260-L264 HydrophobicContact CD1-CD1 3.83Å; F260-L264 HydrophobicContact CE1-CD1 3.31Å; F260-L264 HydrophobicContact CE1-CG 4.19Å; F260-L264 HydrophobicContact CE2-CD1 4.39Å; F260-L264 HydrophobicContact CE2-CG 4.48Å; F260-L264 HydrophobicContact CZ-CD1 3.64Å; F260-L264 HydrophobicContact CZ-CD2 4.47Å; F260-L264 HydrophobicContact CZ-CG 4.18Å; F260-L264 WeakPolarHBondContact O-CG 3.45Å; F260-L264 PolarHBondContact O-N 2.91Å; S261-L264 PolarHBondContact O-N 2.87Å; L264-G266 VanDerWaalsContact C-N 3.27Å; L264-G266 PolarHBondContact O-N 3.06Å; L264-I267 PolarHBondContact O-N 3.17Å; L264-C268 PolarHBondContact O-N 3.46Å; L264-C268 PolarHBondContact O-SG 2.91Å; L264-C272 HydrophobicContact CB-CB 4.36Å |
| 265 | Y | 89.3 | Confident | 90 | Very high | 52 Ų | 52 | 54.3 Ų | 54.3 | 20% | 0.204 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -57.1 | -41.9 | 173.9 | 174.1 | -108.9 | 0 | 0 | 0 | 111.7 | D153 I158 S261 Y262 S263 I267 G269 | D153-Y265 VanDerWaalsContact OD1-CE1 3.29Å; D153-Y265 WeakPolarHBondContact OD1-CE1 3.39Å; D153-Y265 PolarHBondContact OD1-OH 2.85Å; I158-Y265 HydrophobicContact CD1-CD1 3.9Å; I158-Y265 HydrophobicContact CD1-CE1 4.02Å; S261-Y265 PolarHBondContact O-N 2.86Å; Y262-Y265 PolarHBondContact O-N 3.39Å; S263-Y265 VanDerWaalsContact C-N 3.35Å; Y265-I267 VanDerWaalsContact C-N 3.28Å; Y265-I267 PolarHBondContact O-N 3.29Å; Y265-G269 WeakPolarHBondContact O-CA 3.33Å; Y265-G269 PolarHBondContact O-N 3.19Å |
| 266 | G | 87.9 | Confident | 89.5 | Confident | 2 Ų | 2 | 58.4 Ų | 58.4 | 2% | 0.021 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -58.6 | -35 | 173.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | T155 Y262 S263 L264 | T155-G266 WeakPolarHBondContact CB-O 3.29Å; T155-G266 WeakPolarHBondContact CG2-O 3.47Å; T155-G266 PolarHBondContact OG1-O 2.72Å; Y262-G266 PolarHBondContact O-N 3.09Å; S263-G266 PolarHBondContact O-N 3.25Å; L264-G266 VanDerWaalsContact C-N 3.27Å; L264-G266 PolarHBondContact O-N 3.06Å |
| 267 | I | 90.4 | Very high | 89.2 | Confident | 120 Ų | 120 | 58.8 Ų | 58.8 | 62% | 0.615 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -83 | -49.1 | -176.3 | -64.4 | 166.9 | 0 | 0 | 0 | 112.4 | L159 S263 L264 Y265 | L159-I267 HydrophobicContact CD2-CD1 4.42Å; L159-I267 HydrophobicContact CD2-CG1 3.96Å; S263-I267 WeakPolarHBondContact O-CG1 3.25Å; S263-I267 PolarHBondContact O-N 2.97Å; S263-I267 VanDerWaalsContact O-N 3.12Å; L264-I267 PolarHBondContact O-N 3.17Å; Y265-I267 VanDerWaalsContact C-N 3.28Å; Y265-I267 PolarHBondContact O-N 3.29Å |
| 268 | C | 89.8 | Confident | 89 | Confident | 41 Ų | 41 | 60.5 Ų | 60.5 | 28% | 0.277 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -110 | 3.3 | -172.1 | 25.7 | 0 | 0 | 0 | 0 | 114.3 | L264 D270 S271 C272 | L264-C268 PolarHBondContact O-N 3.46Å; L264-C268 PolarHBondContact O-SG 2.91Å; C268-D270 PolarHBondContact O-N 3.41Å; C268-S271 WeakPolarHBondContact O-CB 3.35Å; C268-S271 PolarHBondContact O-N 2.82Å; C268-S271 VanDerWaalsContact O-N 3.09Å; C268-C272 HydrophobicContact CB-CB 3.84Å; C268-C272 WeakPolarHBondContact CB-SG 3.1Å; C268-C272 WeakPolarHBondContact SG-CB 3.33Å; C268-C272 CovalentContact SG-SG 2.01Å; C268-C272 PolarHBondContact SG-SG 3.27Å |
| 269 | G | 86.1 | Confident | 88.8 | Confident | 27 Ų | 27 | 62.3 Ų | 62.3 | 28% | 0.278 | 35% | 0.346 | S | S | . | . | G | 310 helix | trans | 52.8 | -130.4 | 178 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y265 S271 C272 K273 | Y265-G269 WeakPolarHBondContact O-CA 3.33Å; Y265-G269 PolarHBondContact O-N 3.19Å; G269-S271 PolarHBondContact O-N 3.31Å; G269-C272 PolarHBondContact O-N 3.3Å; G269-K273 PolarHBondContact O-N 2.87Å |
| 270 | D | 84.1 | Confident | 88.5 | Confident | 124 Ų | 124 | 64.2 Ų | 64.2 | 66% | 0.663 | 35% | 0.354 | S | S | * | . | G | 310 helix | trans | -61.8 | -23.4 | -178.9 | -69.6 | -46.9 | 0 | 0 | 0 | 114.2 | C268 C272 K273 | C268-D270 PolarHBondContact O-N 3.41Å; D270-C272 PolarHBondContact O-N 3.04Å; D270-K273 WeakPolarHBondContact O-CB 3.33Å; D270-K273 PolarHBondContact O-N 2.78Å; D270-K273 IonicContact OD1-NZ 2.67Å |
| 271 | S | 87.6 | Confident | 88.3 | Confident | 114 Ų | 114 | 65.1 Ų | 65.1 | 80% | 0.797 | 36% | 0.358 | S | S | * | . | G | 310 helix | trans | -69 | -22 | 179.4 | -59.6 | 0 | 0 | 0 | 0 | 113 | C268 G269 | C268-S271 WeakPolarHBondContact O-CB 3.35Å; C268-S271 PolarHBondContact O-N 2.82Å; C268-S271 VanDerWaalsContact O-N 3.09Å; G269-S271 PolarHBondContact O-N 3.31Å |
| 272 | C | 86.8 | Confident | 88.3 | Confident | 44 Ų | 44 | 66.8 Ų | 66.8 | 30% | 0.297 | 36% | 0.364 | S | S | . | . | G | 310 helix | trans | -116.6 | 18.8 | 178.5 | -66.7 | 0 | 0 | 0 | 0 | 112.6 | L264 C268 G269 D270 I274 | L264-C272 HydrophobicContact CB-CB 4.36Å; C268-C272 HydrophobicContact CB-CB 3.84Å; C268-C272 WeakPolarHBondContact CB-SG 3.1Å; C268-C272 WeakPolarHBondContact SG-CB 3.33Å; C268-C272 CovalentContact SG-SG 2.01Å; C268-C272 PolarHBondContact SG-SG 3.27Å; G269-C272 PolarHBondContact O-N 3.3Å; D270-C272 PolarHBondContact O-N 3.04Å; C272-I274 PolarHBondContact O-N 3.19Å; C272-I274 VanDerWaalsContact O-N 3.15Å |
| 273 | K | 84.4 | Confident | 88.2 | Confident | 133 Ų | 133 | 67.4 Ų | 67.4 | 58% | 0.578 | 37% | 0.367 | S | S | * | . | trans | -68.3 | 114.2 | -178.7 | -170.2 | 171.5 | -169.8 | 163.7 | 0 | 110.1 | G269 D270 | G269-K273 PolarHBondContact O-N 2.87Å; D270-K273 WeakPolarHBondContact O-CB 3.33Å; D270-K273 PolarHBondContact O-N 2.78Å; D270-K273 IonicContact OD1-NZ 2.67Å | ||
| 274 | I | 88.2 | Confident | 88.2 | Confident | 46 Ų | 46 | 68.7 Ų | 68.7 | 24% | 0.236 | 37% | 0.37 | C | S | . | . | trans | -78.3 | 149 | 173 | 58.4 | 163.5 | 0 | 0 | 0 | 110.4 | C272 L276 L278 F279 F282 | C272-I274 PolarHBondContact O-N 3.19Å; C272-I274 VanDerWaalsContact O-N 3.15Å; I274-L276 PolarHBondContact O-N 3.15Å; I274-L278 HydrophobicContact CB-CD2 4.49Å; I274-L278 HydrophobicContact CD1-CG 4.48Å; I274-F279 HydrophobicContact CD1-CB 3.74Å; I274-F279 HydrophobicContact CD1-CD2 3.92Å; I274-F279 HydrophobicContact CD1-CG 4.33Å; I274-F279 HydrophobicContact CG1-CB 4.01Å; I274-F279 HydrophobicContact CG1-CD2 4.19Å; I274-F282 HydrophobicContact CD1-CD2 4Å; I274-F282 HydrophobicContact CD1-CE2 4.05Å | ||
| 275 | P | 89.8 | Confident | 88.3 | Confident | 86 Ų | 86 | 68.1 Ų | 68.1 | 56% | 0.558 | 37% | 0.367 | S | S | * | . | trans | -54.4 | 136.5 | 175.8 | -25.4 | 33.9 | 0 | 0 | 0 | 111.5 | P277 L278 F279 | P275-P277 VanDerWaalsContact C-CD 3.41Å; P275-P277 VanDerWaalsContact C-N 3.32Å; P275-L278 WeakPolarHBondContact O-CA 3.39Å; P275-L278 WeakPolarHBondContact O-CB 3.39Å; P275-L278 PolarHBondContact O-N 2.86Å; P275-F279 PolarHBondContact O-N 3.37Å; P275-F279 VanDerWaalsContact O-N 3.09Å | ||
| 276 | L | 83.6 | Confident | 88.4 | Confident | 96 Ų | 96 | 65.7 Ų | 65.7 | 50% | 0.503 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -52 | -40.3 | -177 | -174.8 | 64.9 | 0 | 0 | 0 | 114.1 | I274 L278 F279 K280 | I274-L276 PolarHBondContact O-N 3.15Å; L276-L278 VanDerWaalsContact C-N 3.27Å; L276-L278 PolarHBondContact O-N 2.03Å; L276-F279 PolarHBondContact O-N 3.13Å; L276-K280 HydrophobicContact CD1-CD 4.44Å; L276-K280 HydrophobicContact CD1-CG 4.42Å; L276-K280 HydrophobicContact CG-CD 4.14Å; L276-K280 WeakPolarHBondContact O-CG 3.47Å; L276-K280 PolarHBondContact O-N 3.02Å |
| 277 | P | 87.8 | Confident | 88.6 | Confident | 102 Ų | 102 | 65.6 Ų | 65.6 | 66% | 0.662 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -61.3 | -34.9 | 175.2 | -24.3 | 35.5 | 0 | 0 | 0 | 113.3 | P275 F281 | P275-P277 VanDerWaalsContact C-CD 3.41Å; P275-P277 VanDerWaalsContact C-N 3.32Å; P277-F281 VanDerWaalsContact O-CB 3.28Å; P277-F281 WeakPolarHBondContact O-CB 3.24Å; P277-F281 PolarHBondContact O-N 3.47Å |
| 278 | L | 89.4 | Confident | 88.6 | Confident | 69 Ų | 69 | 62 Ų | 62 | 36% | 0.361 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -73.5 | -40.4 | 178.9 | -173.7 | 62.3 | 0 | 0 | 0 | 111.4 | I274 P275 L276 F281 F282 | I274-L278 HydrophobicContact CB-CD2 4.49Å; I274-L278 HydrophobicContact CD1-CG 4.48Å; P275-L278 WeakPolarHBondContact O-CA 3.39Å; P275-L278 WeakPolarHBondContact O-CB 3.39Å; P275-L278 PolarHBondContact O-N 2.86Å; L276-L278 VanDerWaalsContact C-N 3.27Å; L276-L278 PolarHBondContact O-N 2.03Å; L278-F281 HydrophobicContact CD1-CD1 4.36Å; L278-F281 WeakPolarHBondContact O-CB 3.32Å; L278-F281 PolarHBondContact O-N 2.95Å; L278-F282 HydrophobicContact CD1-CD1 4.49Å; L278-F282 HydrophobicContact CD1-CE1 3.82Å; L278-F282 HydrophobicContact CD1-CE2 4.34Å; L278-F282 HydrophobicContact CD1-CZ 3.73Å; L278-F282 HydrophobicContact CD2-CE2 4.37Å; L278-F282 HydrophobicContact CD2-CZ 4.22Å; L278-F282 HydrophobicContact CG-CE1 4.34Å; L278-F282 HydrophobicContact CG-CE2 3.97Å; L278-F282 HydrophobicContact CG-CZ 3.84Å; L278-F282 WeakPolarHBondContact O-CG 3.39Å; L278-F282 PolarHBondContact O-N 3.47Å |
| 279 | F | 87.1 | Confident | 88.7 | Confident | 48 Ų | 48 | 60 Ų | 60 | 21% | 0.211 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -59.6 | -48.7 | 174.5 | -175.3 | -95.4 | 0 | 0 | 0 | 111.3 | L151 F258 Y262 I274 P275 L276 F281 F282 F283 | L151-F279 HydrophobicContact CD1-CZ 4.37Å; F258-F279 HydrophobicContact CD2-CE2 4.32Å; F258-F279 HydrophobicContact CD2-CZ 4.27Å; F258-F279 HydrophobicContact CE2-CE1 4.01Å; F258-F279 AromaticContact CE2-CE2 3.91Å; F258-F279 HydrophobicContact CE2-CE2 3.91Å; F258-F279 AromaticContact CE2-CZ 3.47Å; F258-F279 HydrophobicContact CE2-CZ 3.47Å; F258-F279 VanDerWaalsContact CE2-CZ 3.47Å; F258-F279 HydrophobicContact CZ-CZ 4.28Å; Y262-F279 HydrophobicContact CD2-CE2 4.11Å; Y262-F279 HydrophobicContact CD2-CZ 4.1Å; I274-F279 HydrophobicContact CD1-CB 3.74Å; I274-F279 HydrophobicContact CD1-CD2 3.92Å; I274-F279 HydrophobicContact CD1-CG 4.33Å; I274-F279 HydrophobicContact CG1-CB 4.01Å; I274-F279 HydrophobicContact CG1-CD2 4.19Å; P275-F279 PolarHBondContact O-N 3.37Å; P275-F279 VanDerWaalsContact O-N 3.09Å; L276-F279 PolarHBondContact O-N 3.13Å; F279-F281 VanDerWaalsContact C-N 3.32Å; F279-F281 PolarHBondContact O-N 3.13Å; F279-F282 PolarHBondContact O-N 3.34Å; F279-F283 PolarHBondContact O-N 3.45Å; F279-F283 VanDerWaalsContact O-N 3.1Å |
| 280 | K | 86.9 | Confident | 88.9 | Confident | 52 Ų | 52 | 59 Ų | 59 | 23% | 0.226 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -61.1 | -40.5 | 175.5 | -70.3 | 173.5 | 169 | -165.6 | 0 | 111.8 | E59 L276 F282 F283 W284 | E59-K280 IonicContact OE1-NZ 2.64Å; E59-K280 PolarHBondContact OE1-NZ 3.4Å; E59-K280 WeakPolarHBondContact OE2-CD 3.18Å; E59-K280 WeakPolarHBondContact OE2-CE 3.29Å; E59-K280 IonicContact OE2-NZ 3.46Å; E59-K280 PolarHBondContact OE2-NZ 3.3Å; L276-K280 HydrophobicContact CD1-CD 4.44Å; L276-K280 HydrophobicContact CD1-CG 4.42Å; L276-K280 HydrophobicContact CG-CD 4.14Å; L276-K280 WeakPolarHBondContact O-CG 3.47Å; L276-K280 PolarHBondContact O-N 3.02Å; K280-F282 PolarHBondContact O-N 3.04Å; K280-F283 WeakPolarHBondContact O-CB 3.35Å; K280-F283 PolarHBondContact O-N 3.17Å; K280-W284 PolarHBondContact O-N 3.38Å |
| 281 | F | 89.9 | Confident | 89.3 | Confident | 119 Ų | 119 | 53.4 Ų | 53.4 | 52% | 0.522 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -60.5 | -44.9 | 176.8 | 177.4 | -106.6 | 0 | 0 | 0 | 112.5 | P277 L278 F279 F283 W284 I285 | P277-F281 VanDerWaalsContact O-CB 3.28Å; P277-F281 WeakPolarHBondContact O-CB 3.24Å; P277-F281 PolarHBondContact O-N 3.47Å; L278-F281 HydrophobicContact CD1-CD1 4.36Å; L278-F281 WeakPolarHBondContact O-CB 3.32Å; L278-F281 PolarHBondContact O-N 2.95Å; F279-F281 VanDerWaalsContact C-N 3.32Å; F279-F281 PolarHBondContact O-N 3.13Å; F281-F283 VanDerWaalsContact C-N 3.3Å; F281-F283 PolarHBondContact O-N 3.41Å; F281-W284 PolarHBondContact O-N 3.45Å; F281-I285 HydrophobicContact CD1-CD1 3.79Å; F281-I285 HydrophobicContact CE1-CD1 3.33Å; F281-I285 HydrophobicContact CE1-CG1 4.32Å; F281-I285 HydrophobicContact CE2-CD1 4.36Å; F281-I285 HydrophobicContact CG-CD1 4.49Å; F281-I285 HydrophobicContact CZ-CD1 3.66Å; F281-I285 HydrophobicContact CZ-CG1 4.26Å; F281-I285 WeakPolarHBondContact O-CG1 3.42Å; F281-I285 PolarHBondContact O-N 2.94Å |
| 282 | F | 92.3 | Very high | 89.4 | Confident | 43 Ų | 43 | 51.2 Ų | 51.2 | 19% | 0.189 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -62.7 | -37.8 | 175.1 | -66.4 | -21.5 | 0 | 0 | 0 | 112.7 | P257 F258 I274 L278 F279 K280 I285 G286 | P257-F282 HydrophobicContact CB-CB 4.19Å; P257-F282 HydrophobicContact CB-CD1 3.7Å; P257-F282 HydrophobicContact CB-CD2 4.01Å; P257-F282 HydrophobicContact CB-CE1 4Å; P257-F282 HydrophobicContact CB-CE2 4.29Å; P257-F282 HydrophobicContact CB-CG 3.71Å; P257-F282 HydrophobicContact CB-CZ 4.28Å; F258-F282 HydrophobicContact CB-CB 4.2Å; I274-F282 HydrophobicContact CD1-CD2 4Å; I274-F282 HydrophobicContact CD1-CE2 4.05Å; L278-F282 HydrophobicContact CD1-CD1 4.49Å; L278-F282 HydrophobicContact CD1-CE1 3.82Å; L278-F282 HydrophobicContact CD1-CE2 4.34Å; L278-F282 HydrophobicContact CD1-CZ 3.73Å; L278-F282 HydrophobicContact CD2-CE2 4.37Å; L278-F282 HydrophobicContact CD2-CZ 4.22Å; L278-F282 HydrophobicContact CG-CE1 4.34Å; L278-F282 HydrophobicContact CG-CE2 3.97Å; L278-F282 HydrophobicContact CG-CZ 3.84Å; L278-F282 WeakPolarHBondContact O-CG 3.39Å; L278-F282 PolarHBondContact O-N 3.47Å; F279-F282 PolarHBondContact O-N 3.34Å; K280-F282 PolarHBondContact O-N 3.04Å; F282-I285 HydrophobicContact CD1-CD1 4.31Å; F282-I285 PolarHBondContact O-N 3.14Å; F282-G286 PolarHBondContact O-N 3.15Å; F282-G286 VanDerWaalsContact O-N 3.14Å |
| 283 | F | 88.3 | Confident | 89.3 | Confident | 24 Ų | 24 | 49.2 Ų | 49.2 | 11% | 0.105 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -63.3 | -44.1 | 175.6 | -162.7 | -115.8 | 0 | 0 | 0 | 112.2 | D78 F258 F279 K280 F281 I285 G286 Y287 | D78-F283 VanDerWaalsContact OD2-CZ 3.22Å; D78-F283 WeakPolarHBondContact OD2-CZ 3.01Å; F258-F283 HydrophobicContact CD2-CB 4.2Å; F258-F283 AromaticContact CD2-CD2 3.68Å; F258-F283 HydrophobicContact CD2-CD2 3.68Å; F258-F283 HydrophobicContact CD2-CG 4.43Å; F258-F283 HydrophobicContact CE1-CD2 4.29Å; F258-F283 HydrophobicContact CE1-CE2 4.39Å; F258-F283 HydrophobicContact CE2-CB 4.44Å; F258-F283 AromaticContact CE2-CD2 3.36Å; F258-F283 HydrophobicContact CE2-CD2 3.36Å; F258-F283 AromaticContact CE2-CE2 3.95Å; F258-F283 HydrophobicContact CE2-CE2 3.95Å; F258-F283 HydrophobicContact CE2-CG 4.3Å; F258-F283 HydrophobicContact CG-CD2 4.26Å; F258-F283 AromaticContact CZ-CD2 3.7Å; F258-F283 HydrophobicContact CZ-CD2 3.7Å; F258-F283 AromaticContact CZ-CE2 3.83Å; F258-F283 HydrophobicContact CZ-CE2 3.83Å; F279-F283 PolarHBondContact O-N 3.45Å; F279-F283 VanDerWaalsContact O-N 3.1Å; K280-F283 WeakPolarHBondContact O-CB 3.35Å; K280-F283 PolarHBondContact O-N 3.17Å; F281-F283 VanDerWaalsContact C-N 3.3Å; F281-F283 PolarHBondContact O-N 3.41Å; F283-I285 VanDerWaalsContact C-N 3.33Å; F283-I285 PolarHBondContact O-N 2.93Å; F283-G286 WeakPolarHBondContact O-CA 3.36Å; F283-G286 PolarHBondContact O-N 2.98Å; F283-Y287 HydrophobicContact CD1-CD2 4.31Å; F283-Y287 AromaticContact CD1-CE2 3.59Å; F283-Y287 HydrophobicContact CD1-CE2 3.59Å; F283-Y287 AromaticContact CD1-CZ 3.89Å; F283-Y287 HydrophobicContact CE1-CD2 4.45Å; F283-Y287 HydrophobicContact CE1-CE1 4.32Å; F283-Y287 AromaticContact CE1-CE2 3.37Å; F283-Y287 HydrophobicContact CE1-CE2 3.37Å; F283-Y287 AromaticContact CE1-CZ 3.27Å; F283-Y287 WeakPolarHBondContact CE1-OH 3.36Å; F283-Y287 HydrophobicContact CZ-CE1 4.35Å; F283-Y287 HydrophobicContact CZ-CE2 4.18Å; F283-Y287 AromaticContact CZ-CZ 3.62Å; F283-Y287 WeakPolarHBondContact CZ-OH 3.45Å; F283-Y287 PolarHBondContact O-N 2.72Å; F283-Y287 VanDerWaalsContact O-N 3.11Å |
| 284 | W | 91.6 | Very high | 89.5 | Confident | 40 Ų | 40 | 43.1 Ų | 43.1 | 15% | 0.152 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -63.6 | -34.7 | 174.6 | -79.3 | 110.3 | 0 | 0 | 0 | 113.3 | V5 L56 K280 F281 G286 Y287 C288 | V5-W284 HydrophobicContact CB-CH2 4.26Å; V5-W284 HydrophobicContact CB-CZ3 4.28Å; V5-W284 HydrophobicContact CG1-CE3 4.48Å; V5-W284 HydrophobicContact CG1-CH2 3.36Å; V5-W284 HydrophobicContact CG1-CZ2 4.34Å; V5-W284 HydrophobicContact CG1-CZ3 3.43Å; V5-W284 VanDerWaalsContact CG1-CZ3 3.43Å; V5-W284 HydrophobicContact CG2-CE3 4.16Å; V5-W284 HydrophobicContact CG2-CH2 3.86Å; V5-W284 HydrophobicContact CG2-CZ2 4.19Å; V5-W284 HydrophobicContact CG2-CZ3 3.83Å; L56-W284 HydrophobicContact CB-CH2 4.3Å; K280-W284 PolarHBondContact O-N 3.38Å; F281-W284 PolarHBondContact O-N 3.45Å; W284-G286 VanDerWaalsContact C-N 3.28Å; W284-G286 PolarHBondContact O-N 3.37Å; W284-Y287 HydrophobicContact CD2-CD2 4.34Å; W284-Y287 AromaticContact CE3-CD2 3.82Å; W284-Y287 HydrophobicContact CE3-CD2 3.82Å; W284-Y287 AromaticContact CZ3-CD2 3.91Å; W284-Y287 HydrophobicContact CZ3-CD2 3.91Å; W284-Y287 PolarHBondContact O-N 3.48Å; W284-C288 PolarHBondContact O-N 3.48Å; W284-C288 PolarHBondContact O-SG 2.92Å; W284-C288 VanDerWaalsContact O-SG 3.33Å |
| 285 | I | 92.9 | Very high | 89.5 | Confident | 49 Ų | 49 | 42.5 Ų | 42.5 | 25% | 0.251 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -61.8 | -39.8 | 171.9 | -68.9 | 166.1 | 0 | 0 | 0 | 110.7 | C254 F281 F282 F283 C288 | C254-I285 HydrophobicContact CB-CG2 4.16Å; C254-I285 WeakPolarHBondContact O-CG2 3.35Å; F281-I285 HydrophobicContact CD1-CD1 3.79Å; F281-I285 HydrophobicContact CE1-CD1 3.33Å; F281-I285 HydrophobicContact CE1-CG1 4.32Å; F281-I285 HydrophobicContact CE2-CD1 4.36Å; F281-I285 HydrophobicContact CG-CD1 4.49Å; F281-I285 HydrophobicContact CZ-CD1 3.66Å; F281-I285 HydrophobicContact CZ-CG1 4.26Å; F281-I285 WeakPolarHBondContact O-CG1 3.42Å; F281-I285 PolarHBondContact O-N 2.94Å; F282-I285 HydrophobicContact CD1-CD1 4.31Å; F282-I285 PolarHBondContact O-N 3.14Å; F283-I285 VanDerWaalsContact C-N 3.33Å; F283-I285 PolarHBondContact O-N 2.93Å; I285-C288 WeakPolarHBondContact O-CB 3.39Å; I285-C288 PolarHBondContact O-N 3.04Å |
| 286 | G | 91.6 | Very high | 89.3 | Confident | 0 Ų | 0 | 39 Ų | 39 | 0% | 0 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -56.8 | -47.4 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | W255 F282 F283 W284 C288 N289 | W255-G286 PolarHBondContact NE1-O 3.37Å; F282-G286 PolarHBondContact O-N 3.15Å; F282-G286 VanDerWaalsContact O-N 3.14Å; F283-G286 WeakPolarHBondContact O-CA 3.36Å; F283-G286 PolarHBondContact O-N 2.98Å; W284-G286 VanDerWaalsContact C-N 3.28Å; W284-G286 PolarHBondContact O-N 3.37Å; G286-C288 PolarHBondContact O-N 3.48Å; G286-N289 WeakPolarHBondContact O-CB 3.44Å; G286-N289 PolarHBondContact O-N 2.71Å; G286-N289 VanDerWaalsContact O-N 3.1Å |
| 287 | Y | 92.2 | Very high | 89.3 | Confident | 1 Ų | 1 | 35 Ų | 35 | 0% | 0.004 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -63.5 | -34.9 | 176.7 | -72.4 | -24.9 | 0 | 0 | 0 | 114.6 | V47 V51 M52 D78 W255 F283 W284 N289 S290 | V47-Y287 HydrophobicContact CG1-CD1 3.87Å; V47-Y287 HydrophobicContact CG1-CE1 4.06Å; V51-Y287 HydrophobicContact CG1-CE1 4.08Å; V51-Y287 WeakPolarHBondContact CG1-OH 3.37Å; M52-Y287 HydrophobicContact CE-CD1 4.42Å; M52-Y287 HydrophobicContact CE-CG 4.17Å; M52-Y287 WeakPolarHBondContact CE-O 3.3Å; M52-Y287 HydrophobicContact CG-CD2 4.25Å; M52-Y287 HydrophobicContact CG-CG 4.21Å; D78-Y287 WeakPolarHBondContact OD1-CE1 3.35Å; D78-Y287 PolarHBondContact OD1-OH 3.36Å; W255-Y287 HydrophobicContact CH2-CE1 4.46Å; F283-Y287 HydrophobicContact CD1-CD2 4.31Å; F283-Y287 AromaticContact CD1-CE2 3.59Å; F283-Y287 HydrophobicContact CD1-CE2 3.59Å; F283-Y287 AromaticContact CD1-CZ 3.89Å; F283-Y287 HydrophobicContact CE1-CD2 4.45Å; F283-Y287 HydrophobicContact CE1-CE1 4.32Å; F283-Y287 AromaticContact CE1-CE2 3.37Å; F283-Y287 HydrophobicContact CE1-CE2 3.37Å; F283-Y287 AromaticContact CE1-CZ 3.27Å; F283-Y287 WeakPolarHBondContact CE1-OH 3.36Å; F283-Y287 HydrophobicContact CZ-CE1 4.35Å; F283-Y287 HydrophobicContact CZ-CE2 4.18Å; F283-Y287 AromaticContact CZ-CZ 3.62Å; F283-Y287 WeakPolarHBondContact CZ-OH 3.45Å; F283-Y287 PolarHBondContact O-N 2.72Å; F283-Y287 VanDerWaalsContact O-N 3.11Å; W284-Y287 HydrophobicContact CD2-CD2 4.34Å; W284-Y287 AromaticContact CE3-CD2 3.82Å; W284-Y287 HydrophobicContact CE3-CD2 3.82Å; W284-Y287 AromaticContact CZ3-CD2 3.91Å; W284-Y287 HydrophobicContact CZ3-CD2 3.91Å; W284-Y287 PolarHBondContact O-N 3.48Å; Y287-N289 PolarHBondContact O-N 2.98Å; Y287-N289 VanDerWaalsContact O-N 3.13Å; Y287-S290 PolarHBondContact O-N 2.92Å |
| 288 | C | 91.1 | Very high | 89.1 | Confident | 43 Ų | 43 | 32 Ų | 32 | 29% | 0.291 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -58.6 | -25.7 | 174 | -71.7 | 0 | 0 | 0 | 0 | 112.6 | W284 I285 G286 S290 S291 L292 | W284-C288 PolarHBondContact O-N 3.48Å; W284-C288 PolarHBondContact O-SG 2.92Å; W284-C288 VanDerWaalsContact O-SG 3.33Å; I285-C288 WeakPolarHBondContact O-CB 3.39Å; I285-C288 PolarHBondContact O-N 3.04Å; G286-C288 PolarHBondContact O-N 3.48Å; C288-S290 VanDerWaalsContact C-N 3.3Å; C288-S290 PolarHBondContact O-N 3.44Å; C288-S291 WeakPolarHBondContact O-CB 3.04Å; C288-S291 PolarHBondContact O-N 2.73Å; C288-S291 PolarHBondContact O-OG 3.16Å; C288-L292 WeakPolarHBondContact O-CG 3.39Å; C288-L292 PolarHBondContact O-N 3Å |
| 289 | N | 91.1 | Very high | 88.8 | Confident | 1 Ų | 1 | 34.2 Ų | 34.2 | 1% | 0.005 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -55 | -43.5 | 177.5 | 178.6 | 74 | 0 | 0 | 0 | 112.8 | F251 C254 G286 Y287 S291 L292 N293 | F251-N289 WeakPolarHBondContact CA-OD1 3.47Å; F251-N289 VanDerWaalsContact CD2-ND2 3.33Å; F251-N289 WeakPolarHBondContact CD2-ND2 3.31Å; C254-N289 HydrophobicContact CB-CB 3.93Å; G286-N289 WeakPolarHBondContact O-CB 3.44Å; G286-N289 PolarHBondContact O-N 2.71Å; G286-N289 VanDerWaalsContact O-N 3.1Å; Y287-N289 PolarHBondContact O-N 2.98Å; Y287-N289 VanDerWaalsContact O-N 3.13Å; N289-S291 PolarHBondContact O-N 3.39Å; N289-L292 PolarHBondContact O-N 2.85Å; N289-N293 PolarHBondContact O-N 2.99Å |
| 290 | S | 91 | Very high | 88.3 | Confident | 4 Ų | 4 | 34.6 Ų | 34.6 | 3% | 0.028 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -61.4 | -27.6 | 179.9 | -68.3 | 0 | 0 | 0 | 0 | 113 | N16 D44 Y287 C288 | N16-S290 PolarHBondContact ND2-O 3.4Å; D44-S290 WeakPolarHBondContact OD1-CA 3.37Å; D44-S290 WeakPolarHBondContact OD1-CB 3.36Å; D44-S290 PolarHBondContact OD1-OG 3.26Å; Y287-S290 PolarHBondContact O-N 2.92Å; C288-S290 VanDerWaalsContact C-N 3.3Å; C288-S290 PolarHBondContact O-N 3.44Å |
| 291 | S | 91 | Very high | 88 | Confident | 8 Ų | 8 | 33.5 Ų | 33.5 | 6% | 0.056 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -79.9 | -27 | 176.4 | 83.4 | 0 | 0 | 0 | 0 | 113.2 | L8 F11 T12 C288 N289 | L8-S291 WeakPolarHBondContact CD1-OG 3.24Å; F11-S291 WeakPolarHBondContact CE1-O 3.08Å; T12-S291 WeakPolarHBondContact OG1-CB 3.3Å; C288-S291 WeakPolarHBondContact O-CB 3.04Å; C288-S291 PolarHBondContact O-N 2.73Å; C288-S291 PolarHBondContact O-OG 3.16Å; N289-S291 PolarHBondContact O-N 3.39Å |
| 292 | L | 89.7 | Confident | 87.7 | Confident | 67 Ų | 67 | 34.6 Ų | 34.6 | 35% | 0.351 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -77.9 | -26.5 | -176.6 | -66.9 | 173.4 | 0 | 0 | 0 | 112.4 | V250 C288 N289 A295 I296 | V250-L292 HydrophobicContact CG1-CB 4.32Å; V250-L292 HydrophobicContact CG1-CD1 3.56Å; C288-L292 WeakPolarHBondContact O-CG 3.39Å; C288-L292 PolarHBondContact O-N 3Å; N289-L292 PolarHBondContact O-N 2.85Å; L292-A295 WeakPolarHBondContact O-CB 3.2Å; L292-A295 PolarHBondContact O-N 3.32Å; L292-A295 VanDerWaalsContact O-N 3.1Å; L292-I296 HydrophobicContact CB-CD1 4.21Å; L292-I296 VanDerWaalsContact O-CG1 3.25Å; L292-I296 WeakPolarHBondContact O-CG1 3.41Å; L292-I296 PolarHBondContact O-N 3.09Å |
| 293 | N | 86.5 | Confident | 87.3 | Confident | 3 Ų | 3 | 34.5 Ų | 34.5 | 2% | 0.016 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -53.4 | -54.5 | -177.4 | -74.7 | -24.8 | 0 | 0 | 0 | 113.2 | D44 N289 A295 I296 Y297 | D44-N293 PolarHBondContact OD2-ND2 3.15Å; N289-N293 PolarHBondContact O-N 2.99Å; N293-A295 VanDerWaalsContact C-N 3.32Å; N293-A295 PolarHBondContact O-N 3.06Å; N293-I296 PolarHBondContact O-N 3.17Å; N293-Y297 HydrophobicContact CB-CE2 4.13Å; N293-Y297 WeakPolarHBondContact O-CD2 3.36Å; N293-Y297 VanDerWaalsContact O-CG 3.32Å; N293-Y297 PolarHBondContact O-N 2.01Å |
| 294 | P | 88.3 | Confident | 87.2 | Confident | 5 Ų | 5 | 33.4 Ų | 33.4 | 3% | 0.032 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -57.5 | -38.4 | 174.5 | -26 | 34 | 0 | 0 | 0 | 114.6 | N16 V19 Y297 T298 | N16-P294 WeakPolarHBondContact OD1-CG 3.39Å; V19-P294 HydrophobicContact CG2-CB 4.04Å; V19-P294 HydrophobicContact CG2-CG 4.08Å; P294-Y297 PolarHBondContact O-N 3.18Å; P294-T298 PolarHBondContact O-N 2.83Å; P294-T298 PolarHBondContact O-OG1 3.03Å |
| 295 | A | 86.8 | Confident | 87 | Confident | 33 Ų | 33 | 36.8 Ų | 36.8 | 27% | 0.273 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -65.1 | -44.7 | 178.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | L292 N293 Y297 T298 I299 | L292-A295 WeakPolarHBondContact O-CB 3.2Å; L292-A295 PolarHBondContact O-N 3.32Å; L292-A295 VanDerWaalsContact O-N 3.1Å; N293-A295 VanDerWaalsContact C-N 3.32Å; N293-A295 PolarHBondContact O-N 3.06Å; A295-Y297 PolarHBondContact O-N 3.33Å; A295-T298 PolarHBondContact O-N 3.5Å; A295-I299 VanDerWaalsContact O-CG1 3.31Å; A295-I299 WeakPolarHBondContact O-CG1 3.21Å; A295-I299 PolarHBondContact O-N 2.94Å |
| 296 | I | 85.6 | Confident | 86.7 | Confident | 12 Ų | 12 | 42.2 Ų | 42.2 | 6% | 0.062 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -60.5 | -46.6 | 176.5 | -62.3 | 164.3 | 0 | 0 | 0 | 109.9 | V247 V250 L292 N293 T298 I299 F300 | V247-I296 HydrophobicContact CG2-CB 4.34Å; V247-I296 HydrophobicContact CG2-CD1 4.44Å; V247-I296 HydrophobicContact CG2-CG2 3.43Å; V247-I296 VanDerWaalsContact CG2-CG2 3.43Å; V250-I296 HydrophobicContact CB-CD1 4.22Å; V250-I296 HydrophobicContact CG1-CD1 4.24Å; V250-I296 HydrophobicContact CG2-CD1 4.09Å; L292-I296 HydrophobicContact CB-CD1 4.21Å; L292-I296 VanDerWaalsContact O-CG1 3.25Å; L292-I296 WeakPolarHBondContact O-CG1 3.41Å; L292-I296 PolarHBondContact O-N 3.09Å; N293-I296 PolarHBondContact O-N 3.17Å; I296-T298 VanDerWaalsContact C-N 3.28Å; I296-T298 PolarHBondContact O-N 3.3Å; I296-I299 PolarHBondContact O-N 3.36Å; I296-F300 HydrophobicContact CB-CD2 4.5Å; I296-F300 HydrophobicContact CG2-CD2 3.63Å; I296-F300 HydrophobicContact CG2-CE2 4.05Å; I296-F300 WeakPolarHBondContact O-CB 3.36Å; I296-F300 VanDerWaalsContact O-CD2 3.28Å; I296-F300 WeakPolarHBondContact O-CD2 3.47Å; I296-F300 PolarHBondContact O-N 3.36Å |
| 297 | Y | 84.1 | Confident | 86.5 | Confident | 11 Ų | 11 | 42.6 Ų | 42.6 | 4% | 0.043 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -59.7 | -39.2 | 176.9 | -57.5 | -37.3 | 0 | 0 | 0 | 112.6 | V19 L37 V247 N293 P294 A295 N301 | V19-Y297 HydrophobicContact CG1-CD2 4.27Å; V19-Y297 HydrophobicContact CG1-CE2 4.27Å; V19-Y297 HydrophobicContact CG2-CD2 3.78Å; V19-Y297 HydrophobicContact CG2-CE2 4.26Å; L37-Y297 HydrophobicContact CD2-CE1 4.03Å; V247-Y297 HydrophobicContact CG2-CE1 4.33Å; N293-Y297 HydrophobicContact CB-CE2 4.13Å; N293-Y297 WeakPolarHBondContact O-CD2 3.36Å; N293-Y297 VanDerWaalsContact O-CG 3.32Å; N293-Y297 PolarHBondContact O-N 2.01Å; P294-Y297 PolarHBondContact O-N 3.18Å; A295-Y297 PolarHBondContact O-N 3.33Å; Y297-N301 WeakPolarHBondContact O-CA 3.23Å; Y297-N301 VanDerWaalsContact O-CB 3.22Å; Y297-N301 WeakPolarHBondContact O-CB 3.11Å; Y297-N301 PolarHBondContact O-N 3.03Å |
| 298 | T | 84.4 | Confident | 86.3 | Confident | 41 Ų | 41 | 43.3 Ų | 43.3 | 25% | 0.252 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -68.3 | -43.6 | -179.9 | -54.9 | 0 | 0 | 0 | 0 | 112.8 | P294 A295 I296 R305 F308 | P294-T298 PolarHBondContact O-N 2.83Å; P294-T298 PolarHBondContact O-OG1 3.03Å; A295-T298 PolarHBondContact O-N 3.5Å; I296-T298 VanDerWaalsContact C-N 3.28Å; I296-T298 PolarHBondContact O-N 3.3Å; T298-R305 HydrophobicContact CG2-CB 4.39Å; T298-R305 HydrophobicContact CG2-CG 4.27Å; T298-F308 HydrophobicContact CG2-CD2 4.43Å; T298-F308 WeakPolarHBondContact OG1-CD2 3.15Å; T298-F308 WeakPolarHBondContact OG1-CE2 3.38Å |
| 299 | I | 82.2 | Confident | 86.1 | Confident | 115 Ų | 115 | 46.4 Ų | 46.4 | 59% | 0.59 | 22% | 0.216 | S | C | * | . | H | α-helix | trans | -66.1 | -42.8 | -179 | -69.4 | 165.8 | 0 | 0 | 0 | 110.4 | A295 I296 | A295-I299 VanDerWaalsContact O-CG1 3.31Å; A295-I299 WeakPolarHBondContact O-CG1 3.21Å; A295-I299 PolarHBondContact O-N 2.94Å; I296-I299 PolarHBondContact O-N 3.36Å |
| 300 | F | 76.1 | Confident | 85.9 | Confident | 55 Ų | 55 | 52.9 Ų | 52.9 | 24% | 0.241 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -101.3 | -21.5 | -165.4 | -75.1 | -65.3 | 0 | 0 | 0 | 114.8 | F242 V243 V246 I296 | F242-F300 HydrophobicContact CD1-CE1 4.48Å; F242-F300 HydrophobicContact CE1-CE1 4.05Å; V243-F300 HydrophobicContact CB-CB 3.97Å; V243-F300 HydrophobicContact CB-CG 4.27Å; V243-F300 HydrophobicContact CG1-CB 3.36Å; V243-F300 HydrophobicContact CG1-CD2 4.26Å; V243-F300 HydrophobicContact CG1-CG 3.89Å; V243-F300 HydrophobicContact CG2-CB 3.35Å; V243-F300 HydrophobicContact CG2-CD1 3.59Å; V243-F300 HydrophobicContact CG2-CG 3.59Å; V246-F300 HydrophobicContact CB-CE2 4.45Å; V246-F300 HydrophobicContact CG1-CE2 3.85Å; V246-F300 HydrophobicContact CG1-CZ 4.12Å; V246-F300 HydrophobicContact CG2-CZ 4.33Å; I296-F300 HydrophobicContact CB-CD2 4.5Å; I296-F300 HydrophobicContact CG2-CD2 3.63Å; I296-F300 HydrophobicContact CG2-CE2 4.05Å; I296-F300 WeakPolarHBondContact O-CB 3.36Å; I296-F300 VanDerWaalsContact O-CD2 3.28Å; I296-F300 WeakPolarHBondContact O-CD2 3.47Å; I296-F300 PolarHBondContact O-N 3.36Å |
| 301 | N | 81.3 | Confident | 85.7 | Confident | 29 Ų | 29 | 55 Ų | 55 | 16% | 0.155 | 26% | 0.255 | C | S | . | . | trans | -116.6 | 108.5 | -178.7 | -168.5 | -30.3 | 0 | 0 | 0 | 111.9 | Y297 D303 F304 R305 | Y297-N301 WeakPolarHBondContact O-CA 3.23Å; Y297-N301 VanDerWaalsContact O-CB 3.22Å; Y297-N301 WeakPolarHBondContact O-CB 3.11Å; Y297-N301 PolarHBondContact O-N 3.03Å; N301-D303 PolarHBondContact O-N 2.72Å; N301-D303 WeakPolarHBondContact OD1-CB 3.39Å; N301-D303 PolarHBondContact OD1-N 3.2Å; N301-F304 HydrophobicContact CB-CB 4.21Å; N301-F304 HydrophobicContact CB-CD2 3.83Å; N301-F304 WeakPolarHBondContact ND2-CD2 3.32Å; N301-F304 PolarHBondContact O-N 3.28Å; N301-F304 PolarHBondContact OD1-N 3.12Å; N301-R305 PolarHBondContact O-N 3.05Å | ||
| 302 | R | 82.6 | Confident | 85.5 | Confident | 142 Ų | 142 | 59.9 Ų | 59.9 | 54% | 0.536 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -61.1 | -30.6 | 179.8 | -69.6 | -174.5 | 173.1 | -174.5 | -3 | 113.1 | R306 | R302-R306 WeakPolarHBondContact O-CG 3.39Å; R302-R306 PolarHBondContact O-N 3.43Å |
| 303 | D | 85.4 | Confident | 85.1 | Confident | 41 Ų | 41 | 61.3 Ų | 61.3 | 22% | 0.219 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -73.9 | -37.3 | -179.2 | -61.9 | -43.2 | 0 | 0 | 0 | 110.8 | L29 R236 N301 A307 | L29-D303 HydrophobicContact CD2-CB 3.89Å; L29-D303 HydrophobicContact CG-CB 4.43Å; R236-D303 IonicContact NH2-OD2 3.94Å; N301-D303 PolarHBondContact O-N 2.72Å; N301-D303 WeakPolarHBondContact OD1-CB 3.39Å; N301-D303 PolarHBondContact OD1-N 3.2Å; D303-A307 WeakPolarHBondContact O-CB 3.41Å; D303-A307 PolarHBondContact O-N 2.74Å |
| 304 | F | 85.9 | Confident | 84.1 | Confident | 1 Ų | 1 | 69 Ų | 69 | 0% | 0.004 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -63.5 | -48 | 169.5 | -89.4 | -73.3 | 0 | 0 | 0 | 111.7 | V19 A22 V23 L29 L37 N301 R306 A307 F308 | V19-F304 HydrophobicContact CG1-CE1 4.07Å; V19-F304 HydrophobicContact CG1-CZ 4.42Å; A22-F304 HydrophobicContact CB-CD1 4.09Å; A22-F304 HydrophobicContact CB-CE1 4.18Å; V23-F304 HydrophobicContact CG2-CE1 3.85Å; V23-F304 HydrophobicContact CG2-CZ 3.7Å; L29-F304 HydrophobicContact CD1-CD1 3.9Å; L29-F304 HydrophobicContact CD1-CD2 4.47Å; L29-F304 HydrophobicContact CD1-CE1 3.99Å; L29-F304 HydrophobicContact CD1-CG 4.15Å; L29-F304 HydrophobicContact CD1-CZ 4.31Å; L29-F304 HydrophobicContact CD2-CD2 4.15Å; L29-F304 HydrophobicContact CD2-CE2 4.08Å; L29-F304 HydrophobicContact CD2-CZ 4.46Å; L37-F304 HydrophobicContact CD1-CE2 3.82Å; L37-F304 HydrophobicContact CD1-CZ 3.81Å; N301-F304 HydrophobicContact CB-CB 4.21Å; N301-F304 HydrophobicContact CB-CD2 3.83Å; N301-F304 WeakPolarHBondContact ND2-CD2 3.32Å; N301-F304 PolarHBondContact O-N 3.28Å; N301-F304 PolarHBondContact OD1-N 3.12Å; F304-R306 VanDerWaalsContact C-N 3.31Å; F304-R306 PolarHBondContact O-N 2.96Å; F304-A307 WeakPolarHBondContact O-CB 3.1Å; F304-A307 PolarHBondContact O-N 3.02Å; F304-F308 HydrophobicContact CD1-CE1 4.03Å; F304-F308 HydrophobicContact CD1-CZ 4.19Å; F304-F308 WeakPolarHBondContact O-CG 2.89Å; F304-F308 PolarHBondContact O-N 3.22Å |
| 305 | R | 87.5 | Confident | 82.3 | Confident | 112 Ų | 112 | 73.2 Ų | 73.2 | 42% | 0.423 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -57.4 | -43.4 | 178.4 | -172.2 | 173.2 | 65.6 | -179.5 | 6.1 | 112.6 | T298 N301 F308 Q309 | T298-R305 HydrophobicContact CG2-CB 4.39Å; T298-R305 HydrophobicContact CG2-CG 4.27Å; N301-R305 PolarHBondContact O-N 3.05Å; R305-F308 PolarHBondContact O-N 3.32Å; R305-Q309 WeakPolarHBondContact O-CB 3.02Å; R305-Q309 VanDerWaalsContact O-CG 3.3Å; R305-Q309 WeakPolarHBondContact O-CG 3.49Å; R305-Q309 PolarHBondContact O-N 3.18Å |
| 306 | R | 87.3 | Confident | 80.1 | Confident | 162 Ų | 162 | 86.6 Ų | 86.6 | 61% | 0.611 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -65.4 | -39.8 | 175.1 | -75.8 | 175.1 | 178.8 | 168.7 | -5.2 | 112.3 | R302 F304 K310 | R302-R306 WeakPolarHBondContact O-CG 3.39Å; R302-R306 PolarHBondContact O-N 3.43Å; F304-R306 VanDerWaalsContact C-N 3.31Å; F304-R306 PolarHBondContact O-N 2.96Å; R306-K310 WeakPolarHBondContact O-CB 3.28Å; R306-K310 PolarHBondContact O-N 2.97Å |
| 307 | A | 86.7 | Confident | 79.8 | Confident | 8 Ų | 8 | 90.3 Ų | 90.3 | 7% | 0.066 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -63.8 | -44.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | A22 L29 D303 F304 K310 I311 | A22-A307 HydrophobicContact CB-CB 3.77Å; L29-A307 HydrophobicContact CD1-CB 4.1Å; D303-A307 WeakPolarHBondContact O-CB 3.41Å; D303-A307 PolarHBondContact O-N 2.74Å; F304-A307 WeakPolarHBondContact O-CB 3.1Å; F304-A307 PolarHBondContact O-N 3.02Å; A307-K310 PolarHBondContact O-N 3.38Å; A307-I311 WeakPolarHBondContact O-CD1 3.01Å; A307-I311 VanDerWaalsContact O-CG1 3.25Å; A307-I311 WeakPolarHBondContact O-CG1 3.44Å; A307-I311 PolarHBondContact O-N 3.49Å |
| 308 | F | 88.1 | Confident | 79.5 | Confident | 16 Ų | 16 | 94.5 Ų | 94.5 | 7% | 0.07 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -63.6 | -45.8 | 177.2 | -71.3 | 2.4 | 0 | 0 | 0 | 111.9 | L18 V19 A22 T298 F304 R305 K310 I311 L312 | L18-F308 HydrophobicContact CB-CD1 4.24Å; L18-F308 HydrophobicContact CB-CE1 3.85Å; L18-F308 HydrophobicContact CB-CZ 4.04Å; L18-F308 WeakPolarHBondContact O-CE1 3.29Å; V19-F308 HydrophobicContact CG2-CZ 3.82Å; A22-F308 HydrophobicContact CB-CD1 3.93Å; A22-F308 HydrophobicContact CB-CE1 3.63Å; T298-F308 HydrophobicContact CG2-CD2 4.43Å; T298-F308 WeakPolarHBondContact OG1-CD2 3.15Å; T298-F308 WeakPolarHBondContact OG1-CE2 3.38Å; F304-F308 HydrophobicContact CD1-CE1 4.03Å; F304-F308 HydrophobicContact CD1-CZ 4.19Å; F304-F308 WeakPolarHBondContact O-CG 2.89Å; F304-F308 PolarHBondContact O-N 3.22Å; R305-F308 PolarHBondContact O-N 3.32Å; F308-K310 VanDerWaalsContact C-N 3.27Å; F308-K310 PolarHBondContact O-N 3.03Å; F308-I311 PolarHBondContact O-N 2.89Å; F308-I311 VanDerWaalsContact O-N 3.15Å; F308-L312 WeakPolarHBondContact O-CB 3.24Å; F308-L312 WeakPolarHBondContact O-CG 3.47Å; F308-L312 PolarHBondContact O-N 3.45Å |
| 309 | Q | 86.9 | Confident | 79.3 | Confident | 108 Ų | 108 | 97.4 Ų | 97.4 | 51% | 0.505 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -57.7 | -41.4 | 172.9 | -75.2 | 175.3 | -29.4 | 0 | 0 | 111.6 | R305 I311 C313 | R305-Q309 WeakPolarHBondContact O-CB 3.02Å; R305-Q309 VanDerWaalsContact O-CG 3.3Å; R305-Q309 WeakPolarHBondContact O-CG 3.49Å; R305-Q309 PolarHBondContact O-N 3.18Å; Q309-I311 PolarHBondContact O-N 3.36Å; Q309-C313 WeakPolarHBondContact O-CA 3.46Å; Q309-C313 WeakPolarHBondContact O-CB 3.4Å; Q309-C313 PolarHBondContact O-N 3.03Å; Q309-C313 PolarHBondContact O-SG 3.28Å; Q309-C313 VanDerWaalsContact O-SG 3.39Å |
| 310 | K | 86.8 | Confident | 79.1 | Confident | 137 Ų | 137 | 96.4 Ų | 96.4 | 60% | 0.596 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -66.4 | -37.4 | 177.6 | -172.2 | 177.3 | 175.6 | -177.6 | 0 | 112.2 | R306 A307 F308 K314 | R306-K310 WeakPolarHBondContact O-CB 3.28Å; R306-K310 PolarHBondContact O-N 2.97Å; A307-K310 PolarHBondContact O-N 3.38Å; F308-K310 VanDerWaalsContact C-N 3.27Å; F308-K310 PolarHBondContact O-N 3.03Å; K310-K314 HydrophobicContact CG-CD 4.02Å; K310-K314 HydrophobicContact CG-CG 4.34Å; K310-K314 WeakPolarHBondContact O-CB 3.37Å; K310-K314 PolarHBondContact O-N 3.24Å |
| 311 | I | 86.1 | Confident | 79.3 | Confident | 49 Ų | 49 | 99 Ų | 99 | 25% | 0.251 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -72 | -46.8 | 179.3 | -66.6 | 159.9 | 0 | 0 | 0 | 110.5 | L18 I21 A22 A307 F308 Q309 | L18-I311 HydrophobicContact CD2-CG2 3.76Å; I21-I311 HydrophobicContact CB-CD1 4.31Å; I21-I311 HydrophobicContact CG2-CD1 3.69Å; I21-I311 HydrophobicContact CG2-CG1 4.26Å; A22-I311 HydrophobicContact CB-CD1 4.18Å; A307-I311 WeakPolarHBondContact O-CD1 3.01Å; A307-I311 VanDerWaalsContact O-CG1 3.25Å; A307-I311 WeakPolarHBondContact O-CG1 3.44Å; A307-I311 PolarHBondContact O-N 3.49Å; F308-I311 PolarHBondContact O-N 2.89Å; F308-I311 VanDerWaalsContact O-N 3.15Å; Q309-I311 PolarHBondContact O-N 3.36Å |
| 312 | L | 86.2 | Confident | 79.2 | Confident | 111 Ų | 111 | 103.7 Ų | 103.7 | 58% | 0.581 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -76.9 | -36.5 | -175.8 | -64.7 | 171.5 | 0 | 0 | 0 | 112.8 | L18 F308 | L18-L312 HydrophobicContact CD1-CD2 4.38Å; L18-L312 HydrophobicContact CD2-CD2 4.37Å; F308-L312 WeakPolarHBondContact O-CB 3.24Å; F308-L312 WeakPolarHBondContact O-CG 3.47Å; F308-L312 PolarHBondContact O-N 3.45Å |
| 313 | C | 82.4 | Confident | 78.9 | Confident | 97 Ų | 97 | 100.9 Ų | 100.9 | 66% | 0.655 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -98.8 | -6.4 | -174.1 | -52.5 | 0 | 0 | 0 | 0 | 114.7 | Q309 | Q309-C313 WeakPolarHBondContact O-CA 3.46Å; Q309-C313 WeakPolarHBondContact O-CB 3.4Å; Q309-C313 PolarHBondContact O-N 3.03Å; Q309-C313 PolarHBondContact O-SG 3.28Å; Q309-C313 VanDerWaalsContact O-SG 3.39Å |
| 314 | K | 64.6 | Low | 78.4 | Confident | 163 Ų | 163 | 105.5 Ų | 105.5 | 71% | 0.709 | 49% | 0.486 | S | S | * | . | S | Bend | trans | -98.3 | 10.4 | 170 | -76 | -162.5 | 159.5 | -154.8 | 0 | 113.8 | K310 W316 | K310-K314 HydrophobicContact CG-CD 4.02Å; K310-K314 HydrophobicContact CG-CG 4.34Å; K310-K314 WeakPolarHBondContact O-CB 3.37Å; K310-K314 PolarHBondContact O-N 3.24Å; K314-W316 PolarHBondContact O-N 3.34Å |
| 315 | S | 51.5 | Low | 77.8 | Confident | 95 Ų | 95 | 114.3 Ų | 114.3 | 66% | 0.664 | 53% | 0.526 | S | S | * | . | trans | -86.7 | 12 | 174.7 | -160 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 316 | W | 39.5 | Very low | 76.9 | Confident | 313 Ų | 313 | 114.5 Ų | 114.5 | 100% | 1.186 | 54% | 0.536 | S | S | * | . | trans | -137.4 | 0 | 171.6 | -87.3 | 74.4 | 0 | 0 | 0 | 109.3 | K314 | K314-W316 PolarHBondContact O-N 3.34Š|
Retrieved 316 of 316 residues in 278.3 ms
(Link to these results)