| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 48.8 | Very low | 79 | Confident | 190 Ų | 190 | 66.2 Ų | 66.2 | 94% | 0.936 | 39% | 0.385 | S | S | * | . | 0 | 119.9 | 0 | -47 | 171.7 | 91.5 | 0 | 0 | 106.4 | E111 | M1-E111 WeakPolarHBondContact CE-OE1 3.19Š| |||
| 2 | V | 58.9 | Low | 80.3 | Confident | 43 Ų | 43 | 63.8 Ų | 63.8 | 26% | 0.261 | 38% | 0.379 | S | S | . | . | trans | -68.6 | 142.4 | 175.3 | -178.3 | 0 | 0 | 0 | 0 | 108.8 | F6 N184 | V2-F6 HydrophobicContact CG1-CB 3.34Å; V2-F6 HydrophobicContact CG1-CD1 3.57Å; V2-F6 HydrophobicContact CG1-CE1 4.47Å; V2-F6 HydrophobicContact CG1-CG 3.65Å; V2-N184 WeakPolarHBondContact CB-OD1 3.49Å; V2-N184 HydrophobicContact CG2-CB 4.26Å; V2-N184 WeakPolarHBondContact CG2-OD1 3.41Å; V2-N184 PolarHBondContact N-OD1 2.72Å | ||
| 3 | S | 71.8 | Confident | 81.4 | Confident | 88 Ų | 88 | 61.7 Ų | 61.7 | 62% | 0.615 | 37% | 0.365 | S | S | * | . | trans | -54.5 | 141.5 | 177.5 | 176.4 | 0 | 0 | 0 | 0 | 111 | G5 F6 | S3-G5 PolarHBondContact O-N 3.5Å; S3-G5 VanDerWaalsContact O-N 3.08Å; S3-G5 PolarHBondContact OG-N 3.37Å; S3-F6 PolarHBondContact O-N 3.35Å | ||
| 4 | A | 75.6 | Confident | 82.4 | Confident | 43 Ų | 43 | 57.3 Ų | 57.3 | 36% | 0.355 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -53.3 | -31.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | F6 Q7 I8 | A4-F6 VanDerWaalsContact C-N 3.33Å; A4-F6 PolarHBondContact O-N 3.22Å; A4-Q7 PolarHBondContact O-N 3.09Å; A4-I8 WeakPolarHBondContact O-CD1 3.48Å; A4-I8 VanDerWaalsContact O-CG1 3.27Å; A4-I8 WeakPolarHBondContact O-CG1 3.47Å; A4-I8 PolarHBondContact O-N 3.36Å |
| 5 | G | 81.3 | Confident | 83.3 | Confident | 42 Ų | 42 | 57.8 Ų | 57.8 | 43% | 0.433 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -61.5 | -35.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | S3 L9 | S3-G5 PolarHBondContact O-N 3.5Å; S3-G5 VanDerWaalsContact O-N 3.08Å; S3-G5 PolarHBondContact OG-N 3.37Å; G5-L9 VanDerWaalsContact O-CB 3.26Å; G5-L9 WeakPolarHBondContact O-CB 3.25Å; G5-L9 PolarHBondContact O-N 3.33Å |
| 6 | F | 83.8 | Confident | 84.1 | Confident | 74 Ų | 74 | 60.3 Ų | 60.3 | 33% | 0.325 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -73.6 | -36.4 | -179.9 | -158.6 | -101.5 | 0 | 0 | 0 | 111.9 | V2 S3 A4 G10 M180 | V2-F6 HydrophobicContact CG1-CB 3.34Å; V2-F6 HydrophobicContact CG1-CD1 3.57Å; V2-F6 HydrophobicContact CG1-CE1 4.47Å; V2-F6 HydrophobicContact CG1-CG 3.65Å; S3-F6 PolarHBondContact O-N 3.35Å; A4-F6 VanDerWaalsContact C-N 3.33Å; A4-F6 PolarHBondContact O-N 3.22Å; F6-G10 PolarHBondContact O-N 3.46Å; F6-M180 HydrophobicContact CD1-CB 3.94Å; F6-M180 HydrophobicContact CD1-CE 4.49Å; F6-M180 HydrophobicContact CD1-CG 4.47Å; F6-M180 HydrophobicContact CD2-CE 3.61Å; F6-M180 VanDerWaalsContact CE1-CA 3.44Å; F6-M180 HydrophobicContact CE1-CB 3.43Å; F6-M180 VanDerWaalsContact CE1-CB 3.43Å; F6-M180 HydrophobicContact CE1-CE 4.2Å; F6-M180 HydrophobicContact CE1-CG 3.71Å; F6-M180 VanDerWaalsContact CE1-O 3.25Å; F6-M180 WeakPolarHBondContact CE1-O 3.49Å; F6-M180 HydrophobicContact CE2-CE 3.2Å; F6-M180 HydrophobicContact CE2-CG 4.27Å; F6-M180 HydrophobicContact CG-CE 4.25Å; F6-M180 HydrophobicContact CZ-CB 3.88Å; F6-M180 HydrophobicContact CZ-CE 3.55Å; F6-M180 HydrophobicContact CZ-CG 3.58Å; F6-M180 HydrophobicContact CZ-SD 4.44Å |
| 7 | Q | 85.3 | Confident | 84.8 | Confident | 25 Ų | 25 | 56.7 Ų | 56.7 | 12% | 0.117 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -66.4 | -42.7 | 175 | -173.3 | 176.8 | 3.6 | 0 | 0 | 110.7 | A4 S11 G101 L181 | A4-Q7 PolarHBondContact O-N 3.09Å; Q7-S11 WeakPolarHBondContact O-CB 3.49Å; Q7-S11 PolarHBondContact O-N 3Å; Q7-S11 PolarHBondContact O-OG 2.92Å; Q7-G101 PolarHBondContact NE2-O 2.97Å; Q7-G101 VanDerWaalsContact NE2-O 3.11Å; Q7-L181 HydrophobicContact CG-CD2 3.99Å |
| 8 | I | 88.4 | Confident | 85.5 | Confident | 112 Ų | 112 | 56.3 Ų | 56.3 | 57% | 0.574 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -63 | -49.3 | 176 | -66.7 | 164.6 | 0 | 0 | 0 | 110.1 | A4 G10 S11 A12 | A4-I8 WeakPolarHBondContact O-CD1 3.48Å; A4-I8 VanDerWaalsContact O-CG1 3.27Å; A4-I8 WeakPolarHBondContact O-CG1 3.47Å; A4-I8 PolarHBondContact O-N 3.36Å; I8-G10 PolarHBondContact O-N 2.92Å; I8-S11 WeakPolarHBondContact CA-OG 3.29Å; I8-S11 PolarHBondContact O-N 2.89Å; I8-S11 PolarHBondContact O-OG 2.94Å; I8-A12 WeakPolarHBondContact O-CB 3.43Å; I8-A12 PolarHBondContact O-N 2.77Å |
| 9 | L | 91.6 | Very high | 86.1 | Confident | 88 Ų | 88 | 57.6 Ų | 57.6 | 46% | 0.461 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -60.6 | -46.7 | 178.8 | -179.2 | 59.6 | 0 | 0 | 0 | 112 | G5 S11 A12 L13 M180 | G5-L9 VanDerWaalsContact O-CB 3.26Å; G5-L9 WeakPolarHBondContact O-CB 3.25Å; G5-L9 PolarHBondContact O-N 3.33Å; L9-S11 VanDerWaalsContact C-N 3.33Å; L9-S11 PolarHBondContact O-N 3.23Å; L9-A12 PolarHBondContact O-N 2.77Å; L9-L13 HydrophobicContact CD1-CD1 4.15Å; L9-L13 HydrophobicContact CD1-CG 4.26Å; L9-L13 HydrophobicContact CG-CD1 4.05Å; L9-L13 WeakPolarHBondContact O-CG 3.35Å; L9-L13 PolarHBondContact O-N 2.86Å; L9-M180 HydrophobicContact CD2-CE 3.7Å; L9-M180 HydrophobicContact CG-CE 4.14Å; L9-M180 HydrophobicContact CG-SD 4.5Å |
| 10 | G | 92 | Very high | 86.6 | Confident | 0 Ų | 0 | 55.2 Ų | 55.2 | 0% | 0 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -60.5 | -42.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | F6 I8 G14 G177 | F6-G10 PolarHBondContact O-N 3.46Å; I8-G10 PolarHBondContact O-N 2.92Å; G10-G14 PolarHBondContact O-N 2.74Å; G10-G177 VanDerWaalsContact O-CA 3.28Å; G10-G177 WeakPolarHBondContact O-CA 3.45Å |
| 11 | S | 91.4 | Very high | 87 | Confident | 23 Ų | 23 | 52.6 Ų | 52.6 | 16% | 0.161 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -65.4 | -40.6 | 175.3 | 69.7 | 0 | 0 | 0 | 0 | 112.9 | Q7 I8 L9 G14 I15 C98 | Q7-S11 WeakPolarHBondContact O-CB 3.49Å; Q7-S11 PolarHBondContact O-N 3Å; Q7-S11 PolarHBondContact O-OG 2.92Å; I8-S11 WeakPolarHBondContact CA-OG 3.29Å; I8-S11 PolarHBondContact O-N 2.89Å; I8-S11 PolarHBondContact O-OG 2.94Å; L9-S11 VanDerWaalsContact C-N 3.33Å; L9-S11 PolarHBondContact O-N 3.23Å; S11-G14 PolarHBondContact O-N 3.12Å; S11-I15 WeakPolarHBondContact O-CD1 3.4Å; S11-I15 VanDerWaalsContact O-CG1 3.24Å; S11-I15 WeakPolarHBondContact O-CG1 2.69Å; S11-I15 PolarHBondContact O-N 2.78Å; S11-C98 WeakPolarHBondContact CB-SG 3.47Å |
| 12 | A | 94.3 | Very high | 89.2 | Confident | 38 Ų | 38 | 46.5 Ų | 46.5 | 31% | 0.314 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -65.1 | -45.8 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | I8 L9 G14 I15 I16 | I8-A12 WeakPolarHBondContact O-CB 3.43Å; I8-A12 PolarHBondContact O-N 2.77Å; L9-A12 PolarHBondContact O-N 2.77Å; A12-G14 VanDerWaalsContact C-N 3.34Å; A12-G14 PolarHBondContact O-N 3.34Å; A12-I15 PolarHBondContact O-N 3.05Å; A12-I16 WeakPolarHBondContact O-CB 3.1Å; A12-I16 VanDerWaalsContact O-CG1 3.23Å; A12-I16 WeakPolarHBondContact O-CG1 3.49Å; A12-I16 PolarHBondContact O-N 2.95Å |
| 13 | L | 95.1 | Very high | 90.9 | Very high | 36 Ų | 36 | 47.9 Ų | 47.9 | 19% | 0.188 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -60.8 | -42.8 | 175.2 | -69.9 | 168.6 | 0 | 0 | 0 | 111.8 | L9 I16 G17 L173 I176 M180 | L9-L13 HydrophobicContact CD1-CD1 4.15Å; L9-L13 HydrophobicContact CD1-CG 4.26Å; L9-L13 HydrophobicContact CG-CD1 4.05Å; L9-L13 WeakPolarHBondContact O-CG 3.35Å; L9-L13 PolarHBondContact O-N 2.86Å; L13-I16 PolarHBondContact O-N 3.23Å; L13-G17 PolarHBondContact O-N 3.4Å; L13-L173 HydrophobicContact CD2-CD2 3.76Å; L13-I176 HydrophobicContact CD1-CG2 4.05Å; L13-M180 HydrophobicContact CD1-SD 3.74Å |
| 14 | G | 94.9 | Very high | 92 | Very high | 0 Ų | 0 | 43.7 Ų | 43.7 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -61.3 | -44.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113 | G10 S11 A12 G17 W18 F125 | G10-G14 PolarHBondContact O-N 2.74Å; S11-G14 PolarHBondContact O-N 3.12Å; A12-G14 VanDerWaalsContact C-N 3.34Å; A12-G14 PolarHBondContact O-N 3.34Å; G14-G17 PolarHBondContact O-N 3.1Å; G14-W18 WeakPolarHBondContact O-CB 3.47Å; G14-W18 PolarHBondContact O-N 3.11Å; G14-F125 WeakPolarHBondContact O-CE1 3.26Å |
| 15 | I | 95.6 | Very high | 92.8 | Very high | 65 Ų | 65 | 42.2 Ų | 42.2 | 33% | 0.333 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -67.1 | -44.4 | 178.2 | -67.6 | 163.6 | 0 | 0 | 0 | 111.2 | S11 A12 G17 W18 I19 I95 | S11-I15 WeakPolarHBondContact O-CD1 3.4Å; S11-I15 VanDerWaalsContact O-CG1 3.24Å; S11-I15 WeakPolarHBondContact O-CG1 2.69Å; S11-I15 PolarHBondContact O-N 2.78Å; A12-I15 PolarHBondContact O-N 3.05Å; I15-G17 VanDerWaalsContact C-N 3.32Å; I15-G17 PolarHBondContact O-N 3.17Å; I15-W18 PolarHBondContact O-N 3.24Å; I15-I19 HydrophobicContact CG2-CD1 4.1Å; I15-I19 WeakPolarHBondContact O-CG1 3.29Å; I15-I19 PolarHBondContact O-N 2.93Å; I15-I95 HydrophobicContact CG1-CD1 4.45Å; I15-I95 HydrophobicContact CG1-CG1 4.22Å |
| 16 | I | 96.8 | Very high | 93.2 | Very high | 97 Ų | 97 | 43.2 Ų | 43.2 | 50% | 0.497 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -61.6 | -44.2 | 177.2 | -67.1 | 165.5 | 0 | 0 | 0 | 110.1 | A12 L13 W18 I19 G20 L173 | A12-I16 WeakPolarHBondContact O-CB 3.1Å; A12-I16 VanDerWaalsContact O-CG1 3.23Å; A12-I16 WeakPolarHBondContact O-CG1 3.49Å; A12-I16 PolarHBondContact O-N 2.95Å; L13-I16 PolarHBondContact O-N 3.23Å; I16-W18 VanDerWaalsContact C-N 3.33Å; I16-W18 PolarHBondContact O-N 3.02Å; I16-I19 PolarHBondContact O-N 3.04Å; I16-G20 PolarHBondContact O-N 3.2Å; I16-L173 HydrophobicContact CG2-CD1 3.98Å |
| 17 | G | 96.1 | Very high | 93.6 | Very high | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -62.5 | -38.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | L13 G14 I15 G20 A21 A170 M174 | L13-G17 PolarHBondContact O-N 3.4Å; G14-G17 PolarHBondContact O-N 3.1Å; I15-G17 VanDerWaalsContact C-N 3.32Å; I15-G17 PolarHBondContact O-N 3.17Å; G17-G20 WeakPolarHBondContact O-CA 3.34Å; G17-G20 PolarHBondContact O-N 3.38Å; G17-A21 PolarHBondContact O-N 3.49Å; G17-A170 WeakPolarHBondContact O-CB 3.28Å; G17-M174 VanDerWaalsContact C-CG 3.47Å |
| 18 | W | 97 | Very high | 93.8 | Very high | 50 Ų | 50 | 42.1 Ų | 42.1 | 19% | 0.189 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -65.2 | -42.2 | 174.5 | 176.7 | 77.5 | 0 | 0 | 0 | 112.7 | G14 I15 I16 G20 A21 I22 I88 I92 I95 M174 | G14-W18 WeakPolarHBondContact O-CB 3.47Å; G14-W18 PolarHBondContact O-N 3.11Å; I15-W18 PolarHBondContact O-N 3.24Å; I16-W18 VanDerWaalsContact C-N 3.33Å; I16-W18 PolarHBondContact O-N 3.02Å; W18-G20 VanDerWaalsContact C-N 3.27Å; W18-G20 PolarHBondContact O-N 3.47Å; W18-A21 WeakPolarHBondContact O-CB 3Å; W18-A21 PolarHBondContact O-N 3.04Å; W18-A21 VanDerWaalsContact O-N 3.13Å; W18-I22 HydrophobicContact CD2-CD1 4.03Å; W18-I22 HydrophobicContact CE3-CD1 3.93Å; W18-I22 HydrophobicContact CH2-CD1 3.46Å; W18-I22 VanDerWaalsContact CH2-CD1 3.46Å; W18-I22 HydrophobicContact CZ2-CD1 3.55Å; W18-I22 HydrophobicContact CZ2-CG1 4.5Å; W18-I22 HydrophobicContact CZ3-CD1 3.65Å; W18-I22 PolarHBondContact O-N 3.35Å; W18-I22 VanDerWaalsContact O-N 3.13Å; W18-I88 HydrophobicContact CZ2-CG2 4.39Å; W18-I88 PolarHBondContact NE1-O 3.48Å; W18-I88 VanDerWaalsContact NE1-O 3.07Å; W18-I92 HydrophobicContact CH2-CG1 4.43Å; W18-I92 HydrophobicContact CZ2-CD1 4.14Å; W18-I92 HydrophobicContact CZ2-CG1 3.43Å; W18-I92 VanDerWaalsContact CZ2-CG1 3.43Å; W18-I95 HydrophobicContact CB-CD1 4.39Å; W18-I95 HydrophobicContact CD2-CD1 3.54Å; W18-I95 HydrophobicContact CE3-CD1 3.59Å; W18-I95 HydrophobicContact CG-CD1 3.91Å; W18-I95 HydrophobicContact CH2-CD1 4.49Å; W18-I95 HydrophobicContact CZ2-CD1 4.45Å; W18-I95 HydrophobicContact CZ3-CD1 4.09Å; W18-M174 HydrophobicContact CB-SD 4.38Å |
| 19 | I | 96.9 | Very high | 93.9 | Very high | 81 Ų | 81 | 39.2 Ų | 39.2 | 42% | 0.415 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -60.1 | -41.9 | 171.9 | -66 | 167.7 | 0 | 0 | 0 | 110 | I15 I16 A21 I22 I23 | I15-I19 HydrophobicContact CG2-CD1 4.1Å; I15-I19 WeakPolarHBondContact O-CG1 3.29Å; I15-I19 PolarHBondContact O-N 2.93Å; I16-I19 PolarHBondContact O-N 3.04Å; I19-A21 VanDerWaalsContact C-N 3.32Å; I19-A21 PolarHBondContact O-N 3.3Å; I19-I22 WeakPolarHBondContact O-CB 3.3Å; I19-I22 PolarHBondContact O-N 2.97Å; I19-I22 VanDerWaalsContact O-N 3.13Å; I19-I23 HydrophobicContact CG2-CD1 4.02Å; I19-I23 WeakPolarHBondContact O-CG1 3.38Å; I19-I23 PolarHBondContact O-N 3.43Å |
| 20 | G | 95.5 | Very high | 93.9 | Very high | 9 Ų | 9 | 35 Ų | 35 | 9% | 0.093 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -55.9 | -43.5 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | I16 G17 W18 I22 I23 V24 | I16-G20 PolarHBondContact O-N 3.2Å; G17-G20 WeakPolarHBondContact O-CA 3.34Å; G17-G20 PolarHBondContact O-N 3.38Å; W18-G20 VanDerWaalsContact C-N 3.27Å; W18-G20 PolarHBondContact O-N 3.47Å; G20-I22 VanDerWaalsContact C-N 3.32Å; G20-I22 PolarHBondContact O-N 3.23Å; G20-I23 PolarHBondContact O-N 3.38Å; G20-V24 WeakPolarHBondContact O-CG2 3.45Å; G20-V24 PolarHBondContact O-N 3.38Å |
| 21 | A | 94.8 | Very high | 93.7 | Very high | 0 Ų | 0 | 35.8 Ų | 35.8 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -63.3 | -35.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | G17 W18 I19 V24 C25 M174 | G17-A21 PolarHBondContact O-N 3.49Å; W18-A21 WeakPolarHBondContact O-CB 3Å; W18-A21 PolarHBondContact O-N 3.04Å; W18-A21 VanDerWaalsContact O-N 3.13Å; I19-A21 VanDerWaalsContact C-N 3.32Å; I19-A21 PolarHBondContact O-N 3.3Å; A21-V24 PolarHBondContact O-N 2.91Å; A21-C25 WeakPolarHBondContact O-CB 3.2Å; A21-C25 PolarHBondContact O-N 2.94Å; A21-M174 HydrophobicContact CB-CE 3.96Å |
| 22 | I | 95.6 | Very high | 93.6 | Very high | 62 Ų | 62 | 35.4 Ų | 35.4 | 32% | 0.318 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -65.7 | -45.1 | 173.2 | -64.9 | 169.9 | 0 | 0 | 0 | 110.8 | W18 I19 G20 V24 C25 A26 I88 | W18-I22 HydrophobicContact CD2-CD1 4.03Å; W18-I22 HydrophobicContact CE3-CD1 3.93Å; W18-I22 HydrophobicContact CH2-CD1 3.46Å; W18-I22 VanDerWaalsContact CH2-CD1 3.46Å; W18-I22 HydrophobicContact CZ2-CD1 3.55Å; W18-I22 HydrophobicContact CZ2-CG1 4.5Å; W18-I22 HydrophobicContact CZ3-CD1 3.65Å; W18-I22 PolarHBondContact O-N 3.35Å; W18-I22 VanDerWaalsContact O-N 3.13Å; I19-I22 WeakPolarHBondContact O-CB 3.3Å; I19-I22 PolarHBondContact O-N 2.97Å; I19-I22 VanDerWaalsContact O-N 3.13Å; G20-I22 VanDerWaalsContact C-N 3.32Å; G20-I22 PolarHBondContact O-N 3.23Å; I22-V24 VanDerWaalsContact C-N 3.3Å; I22-V24 PolarHBondContact O-N 2.91Å; I22-C25 WeakPolarHBondContact O-CB 3.26Å; I22-C25 PolarHBondContact O-N 3.27Å; I22-C25 VanDerWaalsContact O-N 3.14Å; I22-A26 PolarHBondContact O-N 2.93Å; I22-I88 HydrophobicContact CG1-CD1 4.19Å; I22-I88 HydrophobicContact CG1-CG1 4.23Å; I22-I88 HydrophobicContact CG1-CG2 4.24Å |
| 23 | I | 95.2 | Very high | 93.1 | Very high | 72 Ų | 72 | 33.6 Ų | 33.6 | 37% | 0.369 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -59.9 | -44.5 | 178 | -68.5 | 168.4 | 0 | 0 | 0 | 110.2 | I19 G20 C25 A26 L27 I166 | I19-I23 HydrophobicContact CG2-CD1 4.02Å; I19-I23 WeakPolarHBondContact O-CG1 3.38Å; I19-I23 PolarHBondContact O-N 3.43Å; G20-I23 PolarHBondContact O-N 3.38Å; I23-C25 VanDerWaalsContact C-N 3.29Å; I23-C25 PolarHBondContact O-N 3.42Å; I23-A26 PolarHBondContact O-N 2.87Å; I23-A26 VanDerWaalsContact O-N 3.17Å; I23-L27 HydrophobicContact CG2-CD1 3.45Å; I23-L27 VanDerWaalsContact CG2-CD1 3.45Å; I23-L27 HydrophobicContact CG2-CG 3.92Å; I23-L27 WeakPolarHBondContact O-CB 3.37Å; I23-L27 WeakPolarHBondContact O-CG 3.46Å; I23-L27 PolarHBondContact O-N 3.43Å; I23-I166 HydrophobicContact CG2-CD1 4.39Å; I23-I166 HydrophobicContact CG2-CG2 4.48Å |
| 24 | V | 94.1 | Very high | 92.4 | Very high | 0 Ų | 0 | 33.2 Ų | 33.2 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -60.3 | -39.8 | 176.3 | 170.5 | 0 | 0 | 0 | 0 | 111.3 | G20 A21 I22 W30 I166 G167 | G20-V24 WeakPolarHBondContact O-CG2 3.45Å; G20-V24 PolarHBondContact O-N 3.38Å; A21-V24 PolarHBondContact O-N 2.91Å; I22-V24 VanDerWaalsContact C-N 3.3Å; I22-V24 PolarHBondContact O-N 2.91Å; V24-W30 HydrophobicContact CG1-CH2 4.3Å; V24-W30 HydrophobicContact CG1-CZ2 3.47Å; V24-W30 VanDerWaalsContact CG1-CZ2 3.47Å; V24-W30 PolarHBondContact O-NE1 3.35Å; V24-I166 HydrophobicContact CG2-CB 3.79Å; V24-I166 HydrophobicContact CG2-CG2 3.6Å; V24-G167 VanDerWaalsContact CG2-N 3.33Å |
| 25 | C | 92.7 | Very high | 91.2 | Very high | 12 Ų | 12 | 36.3 Ų | 36.3 | 8% | 0.081 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -65.1 | -40.5 | 175 | -168 | 0 | 0 | 0 | 0 | 112.6 | A21 I22 I23 W51 V84 I88 | A21-C25 WeakPolarHBondContact O-CB 3.2Å; A21-C25 PolarHBondContact O-N 2.94Å; I22-C25 WeakPolarHBondContact O-CB 3.26Å; I22-C25 PolarHBondContact O-N 3.27Å; I22-C25 VanDerWaalsContact O-N 3.14Å; I23-C25 VanDerWaalsContact C-N 3.29Å; I23-C25 PolarHBondContact O-N 3.42Å; C25-W51 PolarHBondContact O-NE1 3.04Å; C25-W51 VanDerWaalsContact O-NE1 3.1Å; C25-W51 PolarHBondContact SG-NE1 3.32Å; C25-W51 VanDerWaalsContact SG-NE1 3.35Å; C25-V84 HydrophobicContact CB-CG1 3.58Å; C25-I88 HydrophobicContact CB-CD1 3.82Å |
| 26 | A | 91.1 | Very high | 89.6 | Confident | 63 Ų | 63 | 39.3 Ų | 39.3 | 52% | 0.521 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -82.4 | -33.3 | -173.6 | 0 | 0 | 0 | 0 | 0 | 114 | I22 I23 | I22-A26 PolarHBondContact O-N 2.93Å; I23-A26 PolarHBondContact O-N 2.87Å; I23-A26 VanDerWaalsContact O-N 3.17Å |
| 27 | L | 91.2 | Very high | 87.8 | Confident | 50 Ų | 50 | 36.3 Ų | 36.3 | 26% | 0.262 | 21% | 0.207 | S | C | . | . | trans | -72.9 | 132.5 | -174.3 | -76.3 | 177.9 | 0 | 0 | 0 | 112.4 | I23 M29 I166 | I23-L27 HydrophobicContact CG2-CD1 3.45Å; I23-L27 VanDerWaalsContact CG2-CD1 3.45Å; I23-L27 HydrophobicContact CG2-CG 3.92Å; I23-L27 WeakPolarHBondContact O-CB 3.37Å; I23-L27 WeakPolarHBondContact O-CG 3.46Å; I23-L27 PolarHBondContact O-N 3.43Å; L27-M29 HydrophobicContact CB-CE 4.44Å; L27-M29 HydrophobicContact CD1-CE 3.93Å; L27-M29 HydrophobicContact CD2-CE 4.02Å; L27-M29 HydrophobicContact CG-CE 4.37Å; L27-M29 PolarHBondContact O-N 3.43Å; L27-I166 HydrophobicContact CD1-CD1 3.85Å | ||
| 28 | P | 89.4 | Confident | 85.9 | Confident | 26 Ų | 26 | 42.4 Ų | 42.4 | 17% | 0.169 | 25% | 0.25 | C | C | . | . | S | Bend | trans | -85 | 37.5 | -179.6 | 36.1 | -36.8 | 0 | 0 | 0 | 113.8 | W47 E48 G49 M52 | P28-W47 CarbonylContact O-C 3.49Å; P28-W47 WeakPolarHBondContact O-CB 3.46Å; P28-E48 CarbonylContact O-C 3.53Å; P28-G49 VanDerWaalsContact CA-CA 3.47Å; P28-M52 HydrophobicContact CB-CG 3.57Å; P28-M52 HydrophobicContact CB-SD 4.32Å; P28-M52 HydrophobicContact CG-CG 4.17Å; P28-M52 HydrophobicContact CG-SD 4.27Å |
| 29 | M | 89.8 | Confident | 84 | Confident | 51 Ų | 51 | 45 Ų | 45 | 25% | 0.251 | 27% | 0.268 | S | S | . | . | trans | -124.8 | 50.6 | -172.5 | -60 | -170.6 | -78 | 0 | 0 | 111.4 | L27 W47 G161 A162 S163 | L27-M29 HydrophobicContact CB-CE 4.44Å; L27-M29 HydrophobicContact CD1-CE 3.93Å; L27-M29 HydrophobicContact CD2-CE 4.02Å; L27-M29 HydrophobicContact CG-CE 4.37Å; L27-M29 PolarHBondContact O-N 3.43Å; M29-W47 HydrophobicContact CB-CE3 4.11Å; M29-W47 HydrophobicContact CG-CD2 4.49Å; M29-W47 HydrophobicContact CG-CE3 3.61Å; M29-W47 HydrophobicContact CG-CZ3 4.07Å; M29-W47 HydrophobicContact SD-CE3 3.94Å; M29-W47 HydrophobicContact SD-CZ3 3.8Å; M29-G161 CarbonylContact O-C 3.52Å; M29-G161 WeakPolarHBondContact O-CA 3.39Å; M29-A162 HydrophobicContact CB-CB 4.25Å; M29-A162 HydrophobicContact CE-CB 4.06Å; M29-A162 PolarHBondContact O-N 3Å; M29-A162 HydrophobicContact SD-CB 4.07Å; M29-S163 VanDerWaalsContact O-CB 3.28Å; M29-S163 WeakPolarHBondContact O-CB 3.5Å; M29-S163 PolarHBondContact O-N 3.02Å; M29-S163 PolarHBondContact O-OG 3.21Å | ||
| 30 | W | 91.6 | Very high | 82 | Confident | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 28% | 0.283 | C | S | . | . | S | Bend | trans | -86.1 | -47 | 177.5 | -83.9 | 65.9 | 0 | 0 | 0 | 111.6 | V24 E48 I50 A80 V84 P135 V136 T139 G161 S163 L164 | V24-W30 HydrophobicContact CG1-CH2 4.3Å; V24-W30 HydrophobicContact CG1-CZ2 3.47Å; V24-W30 VanDerWaalsContact CG1-CZ2 3.47Å; V24-W30 PolarHBondContact O-NE1 3.35Å; W30-E48 WeakPolarHBondContact CA-O 3.47Å; W30-E48 WeakPolarHBondContact CB-O 3.48Å; W30-E48 PolarHBondContact N-O 3.46Å; W30-I50 HydrophobicContact CD2-CD1 4.2Å; W30-I50 HydrophobicContact CD2-CG1 4.09Å; W30-I50 HydrophobicContact CG-CG1 4.34Å; W30-I50 HydrophobicContact CH2-CD1 4.03Å; W30-I50 HydrophobicContact CZ2-CD1 3.23Å; W30-I50 HydrophobicContact CZ2-CG1 4.03Å; W30-A80 HydrophobicContact CH2-CB 4.22Å; W30-A80 HydrophobicContact CZ3-CB 3.96Å; W30-V84 HydrophobicContact CH2-CG2 3.92Å; W30-V84 HydrophobicContact CZ2-CG2 4.09Å; W30-P135 HydrophobicContact CH2-CB 4.49Å; W30-V136 HydrophobicContact CH2-CG2 4.1Å; W30-T139 HydrophobicContact CE3-CG2 4.03Å; W30-T139 HydrophobicContact CZ3-CG2 3.98Å; W30-G161 PolarHBondContact O-N 3.17Å; W30-S163 VanDerWaalsContact CA-OG 3.23Å; W30-S163 WeakPolarHBondContact CA-OG 3.44Å; W30-S163 PolarHBondContact N-OG 3.35Å; W30-S163 PolarHBondContact NE1-OG 3.46Å; W30-L164 HydrophobicContact CD2-CD2 4.33Å; W30-L164 HydrophobicContact CE3-CD2 3.75Å; W30-L164 HydrophobicContact CZ3-CD2 4.06Å; W30-L164 WeakPolarHBondContact O-CD1 3.18Å |
| 31 | K | 88.7 | Confident | 80.2 | Confident | 17 Ų | 17 | 54 Ų | 54 | 7% | 0.074 | 32% | 0.317 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.6 | 137.6 | 175 | -51.7 | 171.9 | 62.7 | -152 | 0 | 108.6 | E48 L77 I143 Y158 | K31-E48 HydrophobicContact CB-CB 4.18Å; K31-E48 WeakPolarHBondContact CD-OE2 3.44Å; K31-E48 PolarHBondContact N-O 2.99Å; K31-E48 VanDerWaalsContact N-O 3.08Å; K31-E48 IonicContact NZ-OE2 3.56Å; K31-E48 PolarHBondContact NZ-OE2 3.3Å; K31-E48 VanDerWaalsContact NZ-OE2 3.15Å; K31-E48 PolarHBondContact O-N 3.38Å; K31-L77 HydrophobicContact CD-CD1 3.58Å; K31-L77 HydrophobicContact CG-CD1 4.46Å; K31-I143 HydrophobicContact CG-CD1 3.92Å; K31-I143 HydrophobicContact CG-CG1 4.25Å; K31-Y158 HydrophobicContact CB-CD1 3.83Å; K31-Y158 HydrophobicContact CB-CE1 4.28Å; K31-Y158 VanDerWaalsContact NZ-CZ 3.31Å |
| 32 | V | 88.8 | Confident | 78.6 | Confident | 14 Ų | 14 | 58 Ų | 58 | 9% | 0.085 | 34% | 0.342 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.5 | 136.8 | 176.2 | -176.8 | 0 | 0 | 0 | 0 | 107.5 | I45 T46 W47 Y158 E159 | V32-I45 HydrophobicContact CG1-CG2 4.09Å; V32-T46 WeakPolarHBondContact CA-O 3.28Å; V32-W47 HydrophobicContact CG1-CD2 4.45Å; V32-W47 HydrophobicContact CG1-CE3 4.33Å; V32-W47 HydrophobicContact CG1-CZ3 4.41Å; V32-W47 HydrophobicContact CG2-CD2 4.2Å; V32-W47 HydrophobicContact CG2-CE3 3.42Å; V32-W47 VanDerWaalsContact CG2-CE3 3.42Å; V32-W47 HydrophobicContact CG2-CH2 4.49Å; V32-W47 HydrophobicContact CG2-CZ3 3.6Å; V32-Y158 CarbonylContact O-C 3.6Å; V32-Y158 VanDerWaalsContact O-CA 3.32Å; V32-Y158 WeakPolarHBondContact O-CA 3.3Å; V32-E159 HydrophobicContact CB-CB 4.41Å; V32-E159 PolarHBondContact N-O 2.92Å; V32-E159 VanDerWaalsContact N-O 3.1Å; V32-E159 PolarHBondContact O-N 3.23Å |
| 33 | T | 84.9 | Confident | 77.2 | Confident | 1 Ų | 1 | 56.8 Ų | 56.8 | 1% | 0.006 | 34% | 0.339 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.7 | 134 | 170.9 | 179.6 | 0 | 0 | 0 | 0 | 109 | F35 T46 K157 Y158 | T33-F35 HydrophobicContact CG2-CD2 4.36Å; T33-F35 HydrophobicContact CG2-CE2 3.8Å; T33-F35 HydrophobicContact CG2-CZ 4.39Å; T33-T46 HydrophobicContact CG2-CG2 4.47Å; T33-T46 PolarHBondContact N-O 3.06Å; T33-T46 PolarHBondContact O-N 3.32Å; T33-K157 PolarHBondContact OG1-O 2.92Å; T33-Y158 HydrophobicContact CG2-CD1 4.05Å; T33-Y158 HydrophobicContact CG2-CE1 3.72Å |
| 34 | A | 78.8 | Confident | 76.4 | Confident | 28 Ų | 28 | 56.8 Ų | 56.8 | 23% | 0.231 | 34% | 0.338 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.8 | 110 | 173.6 | 0 | 0 | 0 | 0 | 0 | 107.7 | I36 I45 | A34-I36 HydrophobicContact CB-CD1 3.57Å; A34-I36 HydrophobicContact CB-CG1 4.33Å; A34-I36 WeakPolarHBondContact O-CD1 3.43Å; A34-I36 PolarHBondContact O-N 2.93Å; A34-I45 HydrophobicContact CB-CG1 4.46Å |
| 35 | F | 71 | Confident | 75.9 | Confident | 64 Ų | 64 | 60.3 Ų | 60.3 | 28% | 0.281 | 36% | 0.356 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.2 | 93.8 | 170.6 | -70.7 | -84.8 | 0 | 0 | 0 | 107.9 | T33 S43 Q44 A155 Q156 | T33-F35 HydrophobicContact CG2-CD2 4.36Å; T33-F35 HydrophobicContact CG2-CE2 3.8Å; T33-F35 HydrophobicContact CG2-CZ 4.39Å; F35-S43 WeakPolarHBondContact O-CA 3.07Å; F35-Q44 HydrophobicContact CB-CG 3.9Å; F35-Q44 HydrophobicContact CD2-CG 3.88Å; F35-Q44 HydrophobicContact CG-CG 4.23Å; F35-Q44 PolarHBondContact N-O 3.31Å; F35-Q44 PolarHBondContact O-N 3.27Å; F35-A155 WeakPolarHBondContact CD1-O 3.45Å; F35-Q156 HydrophobicContact CE1-CG 4.13Å |
| 36 | I | 61.6 | Low | 75.7 | Confident | 128 Ų | 128 | 60.5 Ų | 60.5 | 66% | 0.656 | 36% | 0.357 | S | S | * | . | trans | -97.6 | 82.7 | 170 | -54.7 | 113.2 | 0 | 0 | 0 | 108 | A34 | A34-I36 HydrophobicContact CB-CD1 3.57Å; A34-I36 HydrophobicContact CB-CG1 4.33Å; A34-I36 WeakPolarHBondContact O-CD1 3.43Å; A34-I36 PolarHBondContact O-N 2.93Å | ||
| 37 | G | 58.8 | Low | 75.6 | Confident | 34 Ų | 34 | 61.2 Ų | 61.2 | 35% | 0.351 | 35% | 0.346 | S | S | . | . | trans | -73.6 | 163.4 | 165.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | N39 | G37-N39 PolarHBondContact O-N 3.39Š| ||
| 38 | S | 56.8 | Low | 75.5 | Confident | 128 Ų | 128 | 60.4 Ų | 60.4 | 90% | 0.895 | 34% | 0.341 | S | S | * | . | S | Bend | trans | -61.6 | -6.7 | 176.7 | 51 | 0 | 0 | 0 | 0 | 114.8 | ||
| 39 | N | 56.1 | Low | 75.5 | Confident | 106 Ų | 106 | 59.1 Ų | 59.1 | 57% | 0.567 | 33% | 0.332 | S | S | * | . | S | Bend | trans | -111.2 | 120.9 | 173.8 | -79.2 | -67 | 0 | 0 | 0 | 111 | G37 V41 T42 | G37-N39 PolarHBondContact O-N 3.39Å; N39-V41 PolarHBondContact O-N 3.17Å; N39-V41 VanDerWaalsContact O-N 3.15Å; N39-T42 PolarHBondContact O-N 3.25Å; N39-T42 PolarHBondContact O-OG1 3.05Å |
| 40 | I | 55 | Low | 75.4 | Confident | 143 Ų | 143 | 56.8 Ų | 56.8 | 73% | 0.733 | 32% | 0.321 | S | S | * | . | G | 310 helix | trans | -55.6 | -32 | 177.3 | -64.1 | 168.2 | 0 | 0 | 0 | 111.5 | T42 S43 S58 | I40-T42 VanDerWaalsContact C-N 3.27Å; I40-T42 PolarHBondContact O-N 3.42Å; I40-S43 PolarHBondContact O-N 3.44Å; I40-S43 PolarHBondContact O-OG 3.42Å; I40-S58 PolarHBondContact O-OG 3.44Å |
| 41 | V | 58 | Low | 75.3 | Confident | 134 Ų | 134 | 60.9 Ų | 60.9 | 81% | 0.812 | 34% | 0.336 | S | S | * | . | G | 310 helix | trans | -67.7 | -19.9 | -176.8 | -173 | 0 | 0 | 0 | 0 | 113.7 | N39 | N39-V41 PolarHBondContact O-N 3.17Å; N39-V41 VanDerWaalsContact O-N 3.15Å |
| 42 | T | 61.6 | Low | 75.3 | Confident | 86 Ų | 86 | 63 Ų | 63 | 53% | 0.528 | 35% | 0.347 | S | S | . | . | G | 310 helix | trans | -109.3 | 10.2 | 178.2 | 54.8 | 0 | 0 | 0 | 0 | 113.4 | N39 I40 Q44 | N39-T42 PolarHBondContact O-N 3.25Å; N39-T42 PolarHBondContact O-OG1 3.05Å; I40-T42 VanDerWaalsContact C-N 3.27Å; I40-T42 PolarHBondContact O-N 3.42Å; T42-Q44 PolarHBondContact O-N 2.89Å |
| 43 | S | 65.1 | Low | 75.3 | Confident | 36 Ų | 36 | 63.5 Ų | 63.5 | 25% | 0.252 | 35% | 0.352 | S | S | . | . | trans | -72 | 120 | 179.4 | 62.5 | 0 | 0 | 0 | 0 | 110.7 | F35 I40 S58 | F35-S43 WeakPolarHBondContact O-CA 3.07Å; I40-S43 PolarHBondContact O-N 3.44Å; I40-S43 PolarHBondContact O-OG 3.42Å; S43-S58 PolarHBondContact O-N 3.36Å; S43-S58 PolarHBondContact O-OG 2.99Å; S43-S58 PolarHBondContact OG-OG 3.33Å | ||
| 44 | Q | 78.9 | Confident | 75.5 | Confident | 72 Ų | 72 | 63.6 Ų | 63.6 | 34% | 0.336 | 35% | 0.352 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.6 | 137.3 | -178.1 | 59 | -174.3 | -30.1 | 0 | 0 | 110.8 | F35 T42 V55 V56 Q57 | F35-Q44 HydrophobicContact CB-CG 3.9Å; F35-Q44 HydrophobicContact CD2-CG 3.88Å; F35-Q44 HydrophobicContact CG-CG 4.23Å; F35-Q44 PolarHBondContact N-O 3.31Å; F35-Q44 PolarHBondContact O-N 3.27Å; T42-Q44 PolarHBondContact O-N 2.89Å; Q44-V55 HydrophobicContact CB-CG1 3.98Å; Q44-V56 WeakPolarHBondContact CA-O 3.41Å; Q44-Q57 HydrophobicContact CB-CG 4.49Å |
| 45 | I | 84.9 | Confident | 76 | Confident | 74 Ų | 74 | 63.7 Ų | 63.7 | 38% | 0.379 | 35% | 0.35 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.7 | 118.6 | 174.7 | -56.7 | 171 | 0 | 0 | 0 | 107.4 | V32 A34 W47 V55 V56 | V32-I45 HydrophobicContact CG1-CG2 4.09Å; A34-I45 HydrophobicContact CB-CG1 4.46Å; I45-W47 HydrophobicContact CG2-CZ2 4.21Å; I45-V55 WeakPolarHBondContact O-CA 3.49Å; I45-V56 PolarHBondContact N-O 2.99Å; I45-V56 PolarHBondContact O-N 3.25Å |
| 46 | T | 87.2 | Confident | 76.7 | Confident | 16 Ų | 16 | 62.7 Ų | 62.7 | 10% | 0.098 | 35% | 0.349 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.4 | 128 | 179.2 | -55.5 | 0 | 0 | 0 | 0 | 110 | V32 T33 E48 C54 V55 | V32-T46 WeakPolarHBondContact CA-O 3.28Å; T33-T46 HydrophobicContact CG2-CG2 4.47Å; T33-T46 PolarHBondContact N-O 3.06Å; T33-T46 PolarHBondContact O-N 3.32Å; T46-E48 HydrophobicContact CG2-CG 4.3Å; T46-C54 WeakPolarHBondContact CA-O 3.42Å; T46-V55 HydrophobicContact CG2-CG2 3.95Å |
| 47 | W | 89.5 | Confident | 77.8 | Confident | 77 Ų | 77 | 60.1 Ų | 60.1 | 29% | 0.292 | 33% | 0.334 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.6 | 111.9 | 175.5 | -51.8 | 77.3 | 0 | 0 | 0 | 107.6 | P28 M29 V32 I45 S53 C54 | P28-W47 CarbonylContact O-C 3.49Å; P28-W47 WeakPolarHBondContact O-CB 3.46Å; M29-W47 HydrophobicContact CB-CE3 4.11Å; M29-W47 HydrophobicContact CG-CD2 4.49Å; M29-W47 HydrophobicContact CG-CE3 3.61Å; M29-W47 HydrophobicContact CG-CZ3 4.07Å; M29-W47 HydrophobicContact SD-CE3 3.94Å; M29-W47 HydrophobicContact SD-CZ3 3.8Å; V32-W47 HydrophobicContact CG1-CD2 4.45Å; V32-W47 HydrophobicContact CG1-CE3 4.33Å; V32-W47 HydrophobicContact CG1-CZ3 4.41Å; V32-W47 HydrophobicContact CG2-CD2 4.2Å; V32-W47 HydrophobicContact CG2-CE3 3.42Å; V32-W47 VanDerWaalsContact CG2-CE3 3.42Å; V32-W47 HydrophobicContact CG2-CH2 4.49Å; V32-W47 HydrophobicContact CG2-CZ3 3.6Å; I45-W47 HydrophobicContact CG2-CZ2 4.21Å; W47-S53 CarbonylContact O-C 3.17Å; W47-S53 VanDerWaalsContact O-CA 3.28Å; W47-S53 WeakPolarHBondContact O-CA 3.33Å; W47-C54 HydrophobicContact CB-CB 4.36Å; W47-C54 PolarHBondContact N-O 2.96Å; W47-C54 PolarHBondContact O-N 2.9Å |
| 48 | E | 89 | Confident | 78.7 | Confident | 33 Ų | 33 | 61.8 Ų | 61.8 | 15% | 0.154 | 34% | 0.34 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.5 | 122.8 | 175.7 | -61.4 | 179.1 | 167.6 | 0 | 0 | 109.2 | P28 W30 K31 T46 Y158 | P28-E48 CarbonylContact O-C 3.53Å; W30-E48 WeakPolarHBondContact CA-O 3.47Å; W30-E48 WeakPolarHBondContact CB-O 3.48Å; W30-E48 PolarHBondContact N-O 3.46Å; K31-E48 HydrophobicContact CB-CB 4.18Å; K31-E48 WeakPolarHBondContact CD-OE2 3.44Å; K31-E48 PolarHBondContact N-O 2.99Å; K31-E48 VanDerWaalsContact N-O 3.08Å; K31-E48 IonicContact NZ-OE2 3.56Å; K31-E48 PolarHBondContact NZ-OE2 3.3Å; K31-E48 VanDerWaalsContact NZ-OE2 3.15Å; K31-E48 PolarHBondContact O-N 3.38Å; T46-E48 HydrophobicContact CG2-CG 4.3Å; E48-Y158 PolarHBondContact OE1-OH 2.92Å; E48-Y158 WeakPolarHBondContact OE2-CE1 3.44Å; E48-Y158 PolarHBondContact OE2-OH 3.32Å |
| 49 | G | 89.5 | Confident | 79.7 | Confident | 0 Ų | 0 | 60.6 Ų | 60.6 | 0% | 0 | 33% | 0.328 | C | S | . | . | trans | -104.8 | 179.9 | 169.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | P28 M52 Y67 L77 | P28-G49 VanDerWaalsContact CA-CA 3.47Å; G49-M52 VanDerWaalsContact CA-O 3.24Å; G49-M52 WeakPolarHBondContact CA-O 3.46Å; G49-M52 PolarHBondContact N-O 2.97Å; G49-Y67 WeakPolarHBondContact O-CE2 3.41Å; G49-L77 WeakPolarHBondContact O-CD2 3.08Å | ||
| 50 | I | 87.4 | Confident | 80.8 | Confident | 1 Ų | 1 | 58.4 Ų | 58.4 | 1% | 0.005 | 33% | 0.33 | C | S | . | . | S | Bend | trans | -67.9 | -38.8 | 170.8 | -68.4 | 168.9 | 0 | 0 | 0 | 112.1 | W30 L77 R81 V84 | W30-I50 HydrophobicContact CD2-CD1 4.2Å; W30-I50 HydrophobicContact CD2-CG1 4.09Å; W30-I50 HydrophobicContact CG-CG1 4.34Å; W30-I50 HydrophobicContact CH2-CD1 4.03Å; W30-I50 HydrophobicContact CZ2-CD1 3.23Å; W30-I50 HydrophobicContact CZ2-CG1 4.03Å; I50-L77 HydrophobicContact CG1-CD2 4.44Å; I50-R81 HydrophobicContact CG2-CB 3.65Å; I50-R81 HydrophobicContact CG2-CG 3.65Å; I50-V84 HydrophobicContact CD1-CG2 4.43Å |
| 51 | W | 88.7 | Confident | 82.1 | Confident | 86 Ų | 86 | 57.4 Ų | 57.4 | 33% | 0.326 | 32% | 0.322 | S | S | . | . | S | Bend | trans | -111.4 | -27.6 | -169.6 | -56.6 | 95.4 | 0 | 0 | 0 | 114 | C25 Y67 R81 I85 | C25-W51 PolarHBondContact O-NE1 3.04Å; C25-W51 VanDerWaalsContact O-NE1 3.1Å; C25-W51 PolarHBondContact SG-NE1 3.32Å; C25-W51 VanDerWaalsContact SG-NE1 3.35Å; W51-Y67 VanDerWaalsContact C-CD2 3.48Å; W51-Y67 WeakPolarHBondContact O-CD2 3.49Å; W51-Y67 PolarHBondContact O-N 3.14Å; W51-R81 HydrophobicContact CH2-CG 4.34Å; W51-R81 VanDerWaalsContact CH2-CZ 3.5Å; W51-R81 HydrophobicContact CZ2-CG 4.14Å; W51-R81 VanDerWaalsContact CZ3-NE 3.33Å; W51-I85 HydrophobicContact CH2-CD1 3.81Å; W51-I85 HydrophobicContact CZ2-CD1 3.84Å; W51-I85 HydrophobicContact CZ2-CG1 4.24Å |
| 52 | M | 88.9 | Confident | 83.5 | Confident | 61 Ų | 61 | 56.9 Ų | 56.9 | 30% | 0.3 | 31% | 0.313 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -145.6 | 156.5 | -178.5 | 68.1 | -175.7 | 76.9 | 0 | 0 | 110.2 | P28 G49 K65 V66 | P28-M52 HydrophobicContact CB-CG 3.57Å; P28-M52 HydrophobicContact CB-SD 4.32Å; P28-M52 HydrophobicContact CG-CG 4.17Å; P28-M52 HydrophobicContact CG-SD 4.27Å; G49-M52 VanDerWaalsContact CA-O 3.24Å; G49-M52 WeakPolarHBondContact CA-O 3.46Å; G49-M52 PolarHBondContact N-O 2.97Å; M52-K65 WeakPolarHBondContact CA-O 3.46Å; M52-K65 WeakPolarHBondContact CB-O 3.35Å; M52-V66 HydrophobicContact CB-CG2 4.27Å |
| 53 | S | 89.1 | Confident | 84.7 | Confident | 26 Ų | 26 | 58.6 Ų | 58.6 | 18% | 0.182 | 31% | 0.314 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.8 | 138 | 169 | 56.9 | 0 | 0 | 0 | 0 | 109.4 | W47 C64 K65 | W47-S53 CarbonylContact O-C 3.17Å; W47-S53 VanDerWaalsContact O-CA 3.28Å; W47-S53 WeakPolarHBondContact O-CA 3.33Å; S53-C64 WeakPolarHBondContact O-CA 3.28Å; S53-K65 PolarHBondContact N-O 3.27Å; S53-K65 PolarHBondContact O-N 3.13Å |
| 54 | C | 89.8 | Confident | 85.9 | Confident | 2 Ų | 2 | 60 Ų | 60 | 1% | 0.014 | 32% | 0.324 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.2 | 133.6 | 175.1 | -62.9 | 0 | 0 | 0 | 0 | 110.1 | T46 W47 M62 Q63 C64 | T46-C54 WeakPolarHBondContact CA-O 3.42Å; W47-C54 HydrophobicContact CB-CB 4.36Å; W47-C54 PolarHBondContact N-O 2.96Å; W47-C54 PolarHBondContact O-N 2.9Å; C54-M62 HydrophobicContact CB-CE 4.09Å; C54-Q63 CarbonylContact C-O 3.5Å; C54-Q63 WeakPolarHBondContact CA-O 3.37Å; C54-C64 HydrophobicContact CB-CB 4.16Å; C54-C64 WeakPolarHBondContact CB-SG 3.4Å; C54-C64 WeakPolarHBondContact SG-CB 3.41Å; C54-C64 CovalentContact SG-SG 2.05Å; C54-C64 PolarHBondContact SG-SG 3.23Å |
| 55 | V | 88.4 | Confident | 86.4 | Confident | 30 Ų | 30 | 62.7 Ų | 62.7 | 18% | 0.182 | 33% | 0.334 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.9 | 131.4 | 176.8 | -177.6 | 0 | 0 | 0 | 0 | 108.6 | Q44 I45 T46 Q57 M62 Q63 | Q44-V55 HydrophobicContact CB-CG1 3.98Å; I45-V55 WeakPolarHBondContact O-CA 3.49Å; T46-V55 HydrophobicContact CG2-CG2 3.95Å; V55-Q57 HydrophobicContact CG1-CG 4.49Å; V55-M62 WeakPolarHBondContact O-CA 3.29Å; V55-Q63 PolarHBondContact N-O 2.89Å; V55-Q63 PolarHBondContact O-N 3.4Å |
| 56 | V | 86.8 | Confident | 86.5 | Confident | 44 Ų | 44 | 63.5 Ų | 63.5 | 27% | 0.267 | 34% | 0.343 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112 | 118.9 | 173.5 | -177.6 | 0 | 0 | 0 | 0 | 108.1 | Q44 I45 M62 | Q44-V56 WeakPolarHBondContact CA-O 3.41Å; I45-V56 PolarHBondContact N-O 2.99Å; I45-V56 PolarHBondContact O-N 3.25Å; V56-M62 HydrophobicContact CG2-CB 4.29Å; V56-M62 HydrophobicContact CG2-CG 4.17Å |
| 57 | Q | 84.3 | Confident | 86.3 | Confident | 73 Ų | 73 | 65 Ų | 65 | 34% | 0.341 | 35% | 0.347 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.7 | 157.6 | 177.7 | -71.1 | 164.5 | 31.1 | 0 | 0 | 110.7 | Q44 V55 T59 G60 Q61 | Q44-Q57 HydrophobicContact CB-CG 4.49Å; V55-Q57 HydrophobicContact CG1-CG 4.49Å; Q57-T59 PolarHBondContact O-N 3Å; Q57-G60 PolarHBondContact O-N 3.26Å; Q57-Q61 PolarHBondContact N-O 2.85Å; Q57-Q61 VanDerWaalsContact N-O 3.09Å |
| 58 | S | 78.3 | Confident | 85.5 | Confident | 69 Ų | 69 | 67.4 Ų | 67.4 | 48% | 0.483 | 37% | 0.365 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.9 | -17.1 | 179.1 | -7 | 0 | 0 | 0 | 0 | 113.9 | I40 S43 G60 | I40-S58 PolarHBondContact O-OG 3.44Å; S43-S58 PolarHBondContact O-N 3.36Å; S43-S58 PolarHBondContact O-OG 2.99Å; S43-S58 PolarHBondContact OG-OG 3.33Å; S58-G60 PolarHBondContact O-N 3.22Å |
| 59 | T | 78 | Confident | 84.6 | Confident | 104 Ų | 104 | 69.3 Ų | 69.3 | 64% | 0.638 | 38% | 0.382 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.1 | -1.9 | 172 | 55.7 | 0 | 0 | 0 | 0 | 113.5 | Q57 Q61 | Q57-T59 PolarHBondContact O-N 3Å; T59-Q61 VanDerWaalsContact C-N 3.26Å; T59-Q61 PolarHBondContact O-N 3.38Å |
| 60 | G | 78.6 | Confident | 83.1 | Confident | 59 Ų | 59 | 73.3 Ų | 73.3 | 61% | 0.608 | 40% | 0.402 | S | S | * | . | S | Bend | trans | 80.4 | 2.6 | -178.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | Q57 S58 | Q57-G60 PolarHBondContact O-N 3.26Å; S58-G60 PolarHBondContact O-N 3.22Å |
| 61 | Q | 82.9 | Confident | 81.7 | Confident | 122 Ų | 122 | 81.3 Ų | 81.3 | 57% | 0.57 | 44% | 0.444 | S | S | * | . | trans | -78.3 | 127 | 175.6 | -62.3 | -62.9 | -63 | 0 | 0 | 110.2 | Q57 T59 | Q57-Q61 PolarHBondContact N-O 2.85Å; Q57-Q61 VanDerWaalsContact N-O 3.09Å; T59-Q61 VanDerWaalsContact C-N 3.26Å; T59-Q61 PolarHBondContact O-N 3.38Å | ||
| 62 | M | 86.5 | Confident | 80.1 | Confident | 124 Ų | 124 | 81.2 Ų | 81.2 | 61% | 0.611 | 46% | 0.461 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -105.7 | 120.4 | 171.9 | 175.8 | 172.7 | 177.9 | 0 | 0 | 109.1 | C54 V55 V56 C64 | C54-M62 HydrophobicContact CB-CE 4.09Å; V55-M62 WeakPolarHBondContact O-CA 3.29Å; V56-M62 HydrophobicContact CG2-CB 4.29Å; V56-M62 HydrophobicContact CG2-CG 4.17Å; M62-C64 WeakPolarHBondContact CE-SG 3.39Å |
| 63 | Q | 87.3 | Confident | 79 | Confident | 121 Ų | 121 | 79.2 Ų | 79.2 | 57% | 0.565 | 45% | 0.452 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -120.2 | 117.3 | 177.6 | -63.5 | -173.8 | -53.7 | 0 | 0 | 109.2 | C54 V55 | C54-Q63 CarbonylContact C-O 3.5Å; C54-Q63 WeakPolarHBondContact CA-O 3.37Å; V55-Q63 PolarHBondContact N-O 2.89Å; V55-Q63 PolarHBondContact O-N 3.4Å |
| 64 | C | 90.8 | Very high | 78.3 | Confident | 66 Ų | 66 | 80.3 Ų | 80.3 | 45% | 0.446 | 46% | 0.459 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -104 | 130.7 | 172.4 | -65 | 0 | 0 | 0 | 0 | 109.7 | S53 C54 M62 | S53-C64 WeakPolarHBondContact O-CA 3.28Å; C54-C64 HydrophobicContact CB-CB 4.16Å; C54-C64 WeakPolarHBondContact CB-SG 3.4Å; C54-C64 WeakPolarHBondContact SG-CB 3.41Å; C54-C64 CovalentContact SG-SG 2.05Å; C54-C64 PolarHBondContact SG-SG 3.23Å; M62-C64 WeakPolarHBondContact CE-SG 3.39Å |
| 65 | K | 88.1 | Confident | 77.7 | Confident | 129 Ų | 129 | 84.6 Ų | 84.6 | 56% | 0.561 | 49% | 0.489 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -123.5 | 130.1 | 176.5 | -171.5 | 178.4 | 177.5 | -172.6 | 0 | 109.8 | M52 S53 D68 | M52-K65 WeakPolarHBondContact CA-O 3.46Å; M52-K65 WeakPolarHBondContact CB-O 3.35Å; S53-K65 PolarHBondContact N-O 3.27Å; S53-K65 PolarHBondContact O-N 3.13Å; K65-D68 WeakPolarHBondContact CE-OD2 3.24Å; K65-D68 IonicContact NZ-OD2 3.15Å; K65-D68 PolarHBondContact NZ-OD2 3.22Å |
| 66 | V | 87.9 | Confident | 77.3 | Confident | 91 Ų | 91 | 85.2 Ų | 85.2 | 55% | 0.552 | 49% | 0.491 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -75 | 142.6 | 171.6 | 179.8 | 0 | 0 | 0 | 0 | 108.8 | M52 D68 | M52-V66 HydrophobicContact CB-CG2 4.27Å; V66-D68 PolarHBondContact O-N 3.5Å; V66-D68 VanDerWaalsContact O-N 3.13Å |
| 67 | Y | 83.3 | Confident | 77 | Confident | 48 Ų | 48 | 83.1 Ų | 83.1 | 19% | 0.188 | 48% | 0.479 | C | S | . | . | trans | -68.8 | 111.8 | 177.3 | -62.2 | -69.4 | 0 | 0 | 0 | 110.7 | G49 W51 S69 L73 | G49-Y67 WeakPolarHBondContact O-CE2 3.41Å; W51-Y67 VanDerWaalsContact C-CD2 3.48Å; W51-Y67 WeakPolarHBondContact O-CD2 3.49Å; W51-Y67 PolarHBondContact O-N 3.14Å; Y67-S69 PolarHBondContact O-N 2.94Å; Y67-L73 HydrophobicContact CD2-CD1 4.1Å; Y67-L73 HydrophobicContact CE1-CD1 4.13Å; Y67-L73 HydrophobicContact CE2-CD1 3.67Å; Y67-L73 HydrophobicContact CG-CD1 4.5Å | ||
| 68 | D | 72.1 | Confident | 77 | Confident | 126 Ų | 126 | 84.4 Ų | 84.4 | 67% | 0.674 | 49% | 0.485 | S | S | * | . | S | Bend | trans | -67.5 | -18.7 | -179.1 | -65.8 | -44 | 0 | 0 | 0 | 113 | K65 V66 | K65-D68 WeakPolarHBondContact CE-OD2 3.24Å; K65-D68 IonicContact NZ-OD2 3.15Å; K65-D68 PolarHBondContact NZ-OD2 3.22Å; V66-D68 PolarHBondContact O-N 3.5Å; V66-D68 VanDerWaalsContact O-N 3.13Å |
| 69 | S | 69.6 | Low | 77.4 | Confident | 73 Ų | 73 | 83.7 Ų | 83.7 | 51% | 0.51 | 48% | 0.483 | S | S | . | . | trans | -151 | 138.1 | -178.8 | -69.9 | 0 | 0 | 0 | 0 | 111.9 | Y67 L71 A72 | Y67-S69 PolarHBondContact O-N 2.94Å; S69-L71 PolarHBondContact O-N 3.22Å; S69-A72 PolarHBondContact O-N 2.88Å | ||
| 70 | M | 57.7 | Low | 77.8 | Confident | 84 Ų | 84 | 78.8 Ų | 78.8 | 41% | 0.414 | 45% | 0.453 | S | S | . | . | G | 310 helix | trans | -63.3 | -23.3 | 179.4 | -60.3 | -60.1 | 125.6 | 0 | 0 | 113.3 | A72 L73 R81 | M70-A72 VanDerWaalsContact C-N 3.29Å; M70-A72 PolarHBondContact O-N 2.91Å; M70-L73 PolarHBondContact O-N 3.48Å; M70-R81 VanDerWaalsContact SD-CZ 3.53Å; M70-R81 PolarHBondContact SD-NH1 3.43Å |
| 71 | L | 57.6 | Low | 78.4 | Confident | 170 Ų | 170 | 78.4 Ų | 78.4 | 89% | 0.89 | 43% | 0.433 | S | S | * | . | G | 310 helix | trans | -76.9 | -13.7 | -176.5 | -152.1 | 74 | 0 | 0 | 0 | 113.5 | S69 | S69-L71 PolarHBondContact O-N 3.22Š|
| 72 | A | 55.5 | Low | 78.7 | Confident | 84 Ų | 84 | 75 Ų | 75 | 69% | 0.694 | 43% | 0.426 | S | S | * | . | G | 310 helix | trans | -89 | -3.5 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | S69 M70 | S69-A72 PolarHBondContact O-N 2.88Å; M70-A72 VanDerWaalsContact C-N 3.29Å; M70-A72 PolarHBondContact O-N 2.91Å |
| 73 | L | 66.3 | Low | 79 | Confident | 19 Ų | 19 | 71.4 Ų | 71.4 | 10% | 0.099 | 41% | 0.409 | C | S | . | . | S | Bend | trans | -95.4 | 142.4 | -177 | -166 | 63.1 | 0 | 0 | 0 | 110.6 | Y67 M70 L77 | Y67-L73 HydrophobicContact CD2-CD1 4.1Å; Y67-L73 HydrophobicContact CE1-CD1 4.13Å; Y67-L73 HydrophobicContact CE2-CD1 3.67Å; Y67-L73 HydrophobicContact CG-CD1 4.5Å; M70-L73 PolarHBondContact O-N 3.48Å; L73-L77 HydrophobicContact CD1-CB 3.94Å; L73-L77 HydrophobicContact CD1-CD2 4.28Å; L73-L77 HydrophobicContact CD2-CB 3.87Å; L73-L77 HydrophobicContact CG-CB 3.71Å |
| 74 | S | 73.7 | Confident | 79.3 | Confident | 49 Ų | 49 | 65.6 Ų | 65.6 | 34% | 0.343 | 38% | 0.382 | S | S | . | . | trans | -58.6 | 143.5 | 174.1 | 63 | 0 | 0 | 0 | 0 | 111.4 | D76 L77 Q78 | S74-D76 PolarHBondContact O-N 3.4Å; S74-D76 VanDerWaalsContact O-N 3.17Å; S74-L77 PolarHBondContact O-N 3.5Å; S74-L77 WeakPolarHBondContact OG-CD1 3.5Å; S74-Q78 PolarHBondContact O-N 2.95Å | ||
| 75 | S | 78.5 | Confident | 79.5 | Confident | 91 Ų | 91 | 65.3 Ų | 65.3 | 64% | 0.636 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -55.3 | -35.3 | -177.7 | 49.5 | 0 | 0 | 0 | 0 | 112.9 | Q78 A79 | S75-Q78 PolarHBondContact O-N 3.21Å; S75-A79 PolarHBondContact O-N 3.23Å |
| 76 | D | 79.8 | Confident | 79.8 | Confident | 43 Ų | 43 | 63.1 Ų | 63.1 | 23% | 0.23 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -61.1 | -45.8 | 176.2 | -69.4 | -24.1 | 0 | 0 | 0 | 112.1 | S74 A79 A80 W138 T142 | S74-D76 PolarHBondContact O-N 3.4Å; S74-D76 VanDerWaalsContact O-N 3.17Å; D76-A79 PolarHBondContact O-N 3.1Å; D76-A80 WeakPolarHBondContact O-CB 3.36Å; D76-A80 PolarHBondContact O-N 2.89Å; D76-W138 PolarHBondContact OD1-NE1 2.92Å; D76-T142 WeakPolarHBondContact OD2-CG2 3.24Å; D76-T142 PolarHBondContact OD2-OG1 3.36Å |
| 77 | L | 80.6 | Confident | 80.2 | Confident | 1 Ų | 1 | 58.8 Ų | 58.8 | 1% | 0.005 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -72.6 | -30.8 | 179 | -93 | 115.1 | 0 | 0 | 0 | 112.5 | K31 G49 I50 L73 S74 A80 R81 | K31-L77 HydrophobicContact CD-CD1 3.58Å; K31-L77 HydrophobicContact CG-CD1 4.46Å; G49-L77 WeakPolarHBondContact O-CD2 3.08Å; I50-L77 HydrophobicContact CG1-CD2 4.44Å; L73-L77 HydrophobicContact CD1-CB 3.94Å; L73-L77 HydrophobicContact CD1-CD2 4.28Å; L73-L77 HydrophobicContact CD2-CB 3.87Å; L73-L77 HydrophobicContact CG-CB 3.71Å; S74-L77 PolarHBondContact O-N 3.5Å; S74-L77 WeakPolarHBondContact OG-CD1 3.5Å; L77-A80 PolarHBondContact O-N 3.15Å; L77-R81 WeakPolarHBondContact O-CB 3.25Å; L77-R81 PolarHBondContact O-N 3.18Å |
| 78 | Q | 84.9 | Confident | 80.7 | Confident | 99 Ų | 99 | 57.9 Ų | 57.9 | 46% | 0.463 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -66.3 | -44 | 174.2 | -168 | 176.5 | 20.3 | 0 | 0 | 111.5 | S74 S75 R81 A82 | S74-Q78 PolarHBondContact O-N 2.95Å; S75-Q78 PolarHBondContact O-N 3.21Å; Q78-R81 PolarHBondContact O-N 2.85Å; Q78-A82 PolarHBondContact O-N 3.49Å |
| 79 | A | 84.9 | Confident | 81.9 | Confident | 54 Ų | 54 | 56.5 Ų | 56.5 | 45% | 0.446 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -64.2 | -42.7 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | S75 D76 R81 A82 L83 | S75-A79 PolarHBondContact O-N 3.23Å; D76-A79 PolarHBondContact O-N 3.1Å; A79-R81 VanDerWaalsContact C-N 3.31Å; A79-R81 PolarHBondContact O-N 3.11Å; A79-A82 PolarHBondContact O-N 3.23Å; A79-L83 WeakPolarHBondContact O-CG 3.43Å; A79-L83 PolarHBondContact O-N 2.99Å; A79-L83 VanDerWaalsContact O-N 3.09Å |
| 80 | A | 88.2 | Confident | 83.2 | Confident | 2 Ų | 2 | 54.1 Ų | 54.1 | 2% | 0.017 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -58.3 | -42.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | W30 D76 L77 A82 L83 V84 P135 T139 | W30-A80 HydrophobicContact CH2-CB 4.22Å; W30-A80 HydrophobicContact CZ3-CB 3.96Å; D76-A80 WeakPolarHBondContact O-CB 3.36Å; D76-A80 PolarHBondContact O-N 2.89Å; L77-A80 PolarHBondContact O-N 3.15Å; A80-A82 PolarHBondContact O-N 2.99Å; A80-L83 PolarHBondContact O-N 3.37Å; A80-V84 WeakPolarHBondContact O-CB 3.41Å; A80-V84 VanDerWaalsContact O-CG2 3.22Å; A80-V84 WeakPolarHBondContact O-CG2 3.33Å; A80-V84 PolarHBondContact O-N 2.95Å; A80-P135 HydrophobicContact CB-CB 3.63Å; A80-T139 HydrophobicContact CB-CG2 4.43Å |
| 81 | R | 89.8 | Confident | 85 | Confident | 50 Ų | 50 | 50.1 Ų | 50.1 | 19% | 0.189 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -57 | -49.5 | 176.7 | -177.3 | 170.3 | 164.9 | 170.4 | -12 | 112.5 | I50 W51 M70 L77 Q78 A79 I85 | I50-R81 HydrophobicContact CG2-CB 3.65Å; I50-R81 HydrophobicContact CG2-CG 3.65Å; W51-R81 HydrophobicContact CH2-CG 4.34Å; W51-R81 VanDerWaalsContact CH2-CZ 3.5Å; W51-R81 HydrophobicContact CZ2-CG 4.14Å; W51-R81 VanDerWaalsContact CZ3-NE 3.33Å; M70-R81 VanDerWaalsContact SD-CZ 3.53Å; M70-R81 PolarHBondContact SD-NH1 3.43Å; L77-R81 WeakPolarHBondContact O-CB 3.25Å; L77-R81 PolarHBondContact O-N 3.18Å; Q78-R81 PolarHBondContact O-N 2.85Å; A79-R81 VanDerWaalsContact C-N 3.31Å; A79-R81 PolarHBondContact O-N 3.11Å; R81-I85 HydrophobicContact CG-CD1 3.78Å; R81-I85 WeakPolarHBondContact O-CB 3.41Å; R81-I85 WeakPolarHBondContact O-CD1 3.48Å; R81-I85 WeakPolarHBondContact O-CG1 3.19Å; R81-I85 PolarHBondContact O-N 3.44Å |
| 82 | A | 90.6 | Very high | 86.8 | Confident | 50 Ų | 50 | 45.2 Ų | 45.2 | 41% | 0.413 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -62.4 | -47.4 | -179.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | Q78 A79 A80 V84 I85 I86 | Q78-A82 PolarHBondContact O-N 3.49Å; A79-A82 PolarHBondContact O-N 3.23Å; A80-A82 PolarHBondContact O-N 2.99Å; A82-V84 PolarHBondContact O-N 3.4Å; A82-I85 PolarHBondContact O-N 3Å; A82-I86 WeakPolarHBondContact O-CD1 3.41Å; A82-I86 WeakPolarHBondContact O-CG1 3.32Å; A82-I86 PolarHBondContact O-N 3.15Å |
| 83 | L | 92.2 | Very high | 88.7 | Confident | 49 Ų | 49 | 45.6 Ų | 45.6 | 26% | 0.257 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -63.7 | -42.5 | -178.9 | -69.4 | 172.4 | 0 | 0 | 0 | 112.7 | A79 A80 I86 S87 L131 I134 P135 | A79-L83 WeakPolarHBondContact O-CG 3.43Å; A79-L83 PolarHBondContact O-N 2.99Å; A79-L83 VanDerWaalsContact O-N 3.09Å; A80-L83 PolarHBondContact O-N 3.37Å; L83-I86 PolarHBondContact O-N 3.34Å; L83-S87 WeakPolarHBondContact O-CB 3.47Å; L83-S87 PolarHBondContact O-N 2.84Å; L83-L131 HydrophobicContact CD2-CD2 4.27Å; L83-I134 HydrophobicContact CD1-CG2 4Å; L83-P135 HydrophobicContact CB-CB 4.38Å; L83-P135 HydrophobicContact CB-CG 3.92Å; L83-P135 HydrophobicContact CD1-CB 4.22Å; L83-P135 HydrophobicContact CD1-CG 4.36Å |
| 84 | V | 92.9 | Very high | 90 | Very high | 0 Ų | 0 | 44.7 Ų | 44.7 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -67.6 | -40.2 | 178.3 | 174.6 | 0 | 0 | 0 | 0 | 111.4 | C25 W30 I50 A80 A82 S87 I88 P135 | C25-V84 HydrophobicContact CB-CG1 3.58Å; W30-V84 HydrophobicContact CH2-CG2 3.92Å; W30-V84 HydrophobicContact CZ2-CG2 4.09Å; I50-V84 HydrophobicContact CD1-CG2 4.43Å; A80-V84 WeakPolarHBondContact O-CB 3.41Å; A80-V84 VanDerWaalsContact O-CG2 3.22Å; A80-V84 WeakPolarHBondContact O-CG2 3.33Å; A80-V84 PolarHBondContact O-N 2.95Å; A82-V84 PolarHBondContact O-N 3.4Å; V84-S87 WeakPolarHBondContact O-CB 3.48Å; V84-S87 PolarHBondContact O-N 3.18Å; V84-I88 HydrophobicContact CG1-CD1 4.09Å; V84-I88 WeakPolarHBondContact O-CG1 3.27Å; V84-I88 PolarHBondContact O-N 2.93Å; V84-P135 HydrophobicContact CG2-CG 3.89Å |
| 85 | I | 94.4 | Very high | 91 | Very high | 60 Ų | 60 | 44 Ų | 44 | 31% | 0.308 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -63.1 | -46.9 | 175.2 | -68 | 166.7 | 0 | 0 | 0 | 110.6 | W51 R81 A82 S87 I88 L89 | W51-I85 HydrophobicContact CH2-CD1 3.81Å; W51-I85 HydrophobicContact CZ2-CD1 3.84Å; W51-I85 HydrophobicContact CZ2-CG1 4.24Å; R81-I85 HydrophobicContact CG-CD1 3.78Å; R81-I85 WeakPolarHBondContact O-CB 3.41Å; R81-I85 WeakPolarHBondContact O-CD1 3.48Å; R81-I85 WeakPolarHBondContact O-CG1 3.19Å; R81-I85 PolarHBondContact O-N 3.44Å; A82-I85 PolarHBondContact O-N 3Å; I85-S87 VanDerWaalsContact C-N 3.3Å; I85-S87 PolarHBondContact O-N 3.43Å; I85-I88 PolarHBondContact O-N 3.44Å; I85-I88 VanDerWaalsContact O-N 3.16Å; I85-L89 HydrophobicContact CG2-CD1 4.24Å; I85-L89 HydrophobicContact CG2-CG 4.5Å; I85-L89 WeakPolarHBondContact O-CG 3.24Å; I85-L89 PolarHBondContact O-N 3.27Å |
| 86 | I | 95.3 | Very high | 91.7 | Very high | 82 Ų | 82 | 44.9 Ų | 44.9 | 42% | 0.421 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -60.8 | -43.5 | 177.7 | -64.5 | 164.3 | 0 | 0 | 0 | 109.9 | A82 L83 I88 L89 V90 L131 | A82-I86 WeakPolarHBondContact O-CD1 3.41Å; A82-I86 WeakPolarHBondContact O-CG1 3.32Å; A82-I86 PolarHBondContact O-N 3.15Å; L83-I86 PolarHBondContact O-N 3.34Å; I86-I88 VanDerWaalsContact C-N 3.33Å; I86-I88 PolarHBondContact O-N 3.21Å; I86-L89 PolarHBondContact O-N 3.38Å; I86-V90 HydrophobicContact CG2-CG2 4.18Å; I86-V90 WeakPolarHBondContact O-CB 3.26Å; I86-V90 VanDerWaalsContact O-CG2 3.26Å; I86-V90 WeakPolarHBondContact O-CG2 3.35Å; I86-V90 PolarHBondContact O-N 3.33Å; I86-L131 HydrophobicContact CG2-CD1 3.92Å |
| 87 | S | 95.7 | Very high | 92.2 | Very high | 1 Ų | 1 | 45.7 Ų | 45.7 | 1% | 0.007 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -55.1 | -45.3 | 173.9 | 173 | 0 | 0 | 0 | 0 | 112.4 | L83 V84 I85 V90 G91 A128 | L83-S87 WeakPolarHBondContact O-CB 3.47Å; L83-S87 PolarHBondContact O-N 2.84Å; V84-S87 WeakPolarHBondContact O-CB 3.48Å; V84-S87 PolarHBondContact O-N 3.18Å; I85-S87 VanDerWaalsContact C-N 3.3Å; I85-S87 PolarHBondContact O-N 3.43Å; S87-V90 PolarHBondContact O-N 3.44Å; S87-G91 PolarHBondContact O-N 3.09Å; S87-A128 PolarHBondContact OG-O 2.75Å |
| 88 | I | 95.5 | Very high | 92.6 | Very high | 28 Ų | 28 | 46.4 Ų | 46.4 | 14% | 0.144 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -63.9 | -43.8 | 178.8 | -68.7 | 165.1 | 0 | 0 | 0 | 110.9 | W18 I22 C25 V84 I85 I86 G91 I92 | W18-I88 HydrophobicContact CZ2-CG2 4.39Å; W18-I88 PolarHBondContact NE1-O 3.48Å; W18-I88 VanDerWaalsContact NE1-O 3.07Å; I22-I88 HydrophobicContact CG1-CD1 4.19Å; I22-I88 HydrophobicContact CG1-CG1 4.23Å; I22-I88 HydrophobicContact CG1-CG2 4.24Å; C25-I88 HydrophobicContact CB-CD1 3.82Å; V84-I88 HydrophobicContact CG1-CD1 4.09Å; V84-I88 WeakPolarHBondContact O-CG1 3.27Å; V84-I88 PolarHBondContact O-N 2.93Å; I85-I88 PolarHBondContact O-N 3.44Å; I85-I88 VanDerWaalsContact O-N 3.16Å; I86-I88 VanDerWaalsContact C-N 3.33Å; I86-I88 PolarHBondContact O-N 3.21Å; I88-G91 PolarHBondContact O-N 3.49Å; I88-I92 HydrophobicContact CG2-CD1 4.38Å; I88-I92 WeakPolarHBondContact O-CG1 3.34Å; I88-I92 PolarHBondContact O-N 3.5Å |
| 89 | L | 96.9 | Very high | 92.7 | Very high | 98 Ų | 98 | 46 Ų | 46 | 51% | 0.513 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -63.5 | -45.1 | 178.1 | -66.9 | 176.6 | 0 | 0 | 0 | 112 | I85 I86 G91 I92 L93 | I85-L89 HydrophobicContact CG2-CD1 4.24Å; I85-L89 HydrophobicContact CG2-CG 4.5Å; I85-L89 WeakPolarHBondContact O-CG 3.24Å; I85-L89 PolarHBondContact O-N 3.27Å; I86-L89 PolarHBondContact O-N 3.38Å; L89-G91 VanDerWaalsContact C-N 3.27Å; L89-G91 PolarHBondContact O-N 3.44Å; L89-I92 HydrophobicContact CD2-CD1 4.46Å; L89-I92 WeakPolarHBondContact O-CB 3.48Å; L89-I92 PolarHBondContact O-N 2.91Å; L89-L93 PolarHBondContact O-N 3.36Å; L89-L93 VanDerWaalsContact O-N 3.14Å |
| 90 | V | 96.1 | Very high | 92.8 | Very high | 22 Ų | 22 | 44.8 Ų | 44.8 | 13% | 0.133 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -60.9 | -39.6 | 174.2 | 173.4 | 0 | 0 | 0 | 0 | 110.5 | I86 S87 L93 A94 M124 V127 A128 L131 | I86-V90 HydrophobicContact CG2-CG2 4.18Å; I86-V90 WeakPolarHBondContact O-CB 3.26Å; I86-V90 VanDerWaalsContact O-CG2 3.26Å; I86-V90 WeakPolarHBondContact O-CG2 3.35Å; I86-V90 PolarHBondContact O-N 3.33Å; S87-V90 PolarHBondContact O-N 3.44Å; V90-L93 WeakPolarHBondContact O-CB 3.31Å; V90-L93 PolarHBondContact O-N 3.38Å; V90-A94 PolarHBondContact O-N 3.38Å; V90-M124 HydrophobicContact CG1-CE 3.76Å; V90-M124 WeakPolarHBondContact CG1-O 2.99Å; V90-V127 HydrophobicContact CG1-CB 4.44Å; V90-V127 HydrophobicContact CG1-CG1 4.23Å; V90-A128 HydrophobicContact CB-CB 4.23Å; V90-A128 HydrophobicContact CG1-CB 3.88Å; V90-L131 HydrophobicContact CG2-CD1 4.21Å |
| 91 | G | 95.5 | Very high | 92.4 | Very high | 0 Ų | 0 | 44.8 Ų | 44.8 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -63.8 | -38 | 175 | 0 | 0 | 0 | 0 | 0 | 113.7 | S87 I88 L89 L93 A94 I95 | S87-G91 PolarHBondContact O-N 3.09Å; I88-G91 PolarHBondContact O-N 3.49Å; L89-G91 VanDerWaalsContact C-N 3.27Å; L89-G91 PolarHBondContact O-N 3.44Å; G91-L93 VanDerWaalsContact C-N 3.35Å; G91-L93 PolarHBondContact O-N 2.97Å; G91-A94 WeakPolarHBondContact O-CB 3.3Å; G91-A94 PolarHBondContact O-N 2.88Å; G91-I95 WeakPolarHBondContact O-CG1 3.24Å; G91-I95 PolarHBondContact O-N 3.42Å |
| 92 | I | 95.9 | Very high | 91.9 | Very high | 68 Ų | 68 | 43.2 Ų | 43.2 | 35% | 0.349 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -60.6 | -46.9 | 172.8 | -67.6 | 166.1 | 0 | 0 | 0 | 110.1 | W18 I88 L89 A94 I95 L96 | W18-I92 HydrophobicContact CH2-CG1 4.43Å; W18-I92 HydrophobicContact CZ2-CD1 4.14Å; W18-I92 HydrophobicContact CZ2-CG1 3.43Å; W18-I92 VanDerWaalsContact CZ2-CG1 3.43Å; I88-I92 HydrophobicContact CG2-CD1 4.38Å; I88-I92 WeakPolarHBondContact O-CG1 3.34Å; I88-I92 PolarHBondContact O-N 3.5Å; L89-I92 HydrophobicContact CD2-CD1 4.46Å; L89-I92 WeakPolarHBondContact O-CB 3.48Å; L89-I92 PolarHBondContact O-N 2.91Å; I92-A94 VanDerWaalsContact C-N 3.29Å; I92-A94 PolarHBondContact O-N 2.87Å; I92-I95 PolarHBondContact O-N 3.34Å; I92-L96 HydrophobicContact CG2-CD1 4.31Å; I92-L96 WeakPolarHBondContact O-CG 3.38Å; I92-L96 PolarHBondContact O-N 2.88Å |
| 93 | L | 95.1 | Very high | 90.8 | Very high | 92 Ų | 92 | 46.8 Ų | 46.8 | 48% | 0.482 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -60.8 | -40 | 176.6 | -63.9 | 176.3 | 0 | 0 | 0 | 111.6 | L89 V90 G91 I95 L96 L97 M124 | L89-L93 PolarHBondContact O-N 3.36Å; L89-L93 VanDerWaalsContact O-N 3.14Å; V90-L93 WeakPolarHBondContact O-CB 3.31Å; V90-L93 PolarHBondContact O-N 3.38Å; G91-L93 VanDerWaalsContact C-N 3.35Å; G91-L93 PolarHBondContact O-N 2.97Å; L93-I95 PolarHBondContact O-N 3.42Å; L93-L96 PolarHBondContact O-N 2.94Å; L93-L97 WeakPolarHBondContact O-CG 3.39Å; L93-L97 PolarHBondContact O-N 2.83Å; L93-M124 HydrophobicContact CB-CE 4.19Å; L93-M124 HydrophobicContact CD1-CE 4.28Å |
| 94 | A | 94.4 | Very high | 89.5 | Confident | 0 Ų | 0 | 51.2 Ų | 51.2 | 0% | 0 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -61.4 | -42.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | V90 G91 I92 L97 C98 S121 M124 F125 | V90-A94 PolarHBondContact O-N 3.38Å; G91-A94 WeakPolarHBondContact O-CB 3.3Å; G91-A94 PolarHBondContact O-N 2.88Å; I92-A94 VanDerWaalsContact C-N 3.29Å; I92-A94 PolarHBondContact O-N 2.87Å; A94-L97 PolarHBondContact O-N 3.09Å; A94-C98 VanDerWaalsContact O-CB 3.28Å; A94-C98 WeakPolarHBondContact O-CB 3.24Å; A94-C98 PolarHBondContact O-N 3.08Å; A94-S121 WeakPolarHBondContact O-CB 3.42Å; A94-M124 HydrophobicContact CB-CB 3.66Å; A94-F125 HydrophobicContact CB-CD1 3.96Å; A94-F125 HydrophobicContact CB-CD2 3.75Å; A94-F125 HydrophobicContact CB-CE1 4.03Å; A94-F125 HydrophobicContact CB-CE2 3.83Å; A94-F125 HydrophobicContact CB-CG 3.81Å; A94-F125 HydrophobicContact CB-CZ 3.97Å |
| 95 | I | 93.9 | Very high | 88.4 | Confident | 34 Ų | 34 | 52.9 Ų | 52.9 | 17% | 0.174 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -63.7 | -45.3 | 176.4 | -67.2 | 166 | 0 | 0 | 0 | 110.8 | I15 W18 G91 I92 L93 L97 C98 V99 F125 | I15-I95 HydrophobicContact CG1-CD1 4.45Å; I15-I95 HydrophobicContact CG1-CG1 4.22Å; W18-I95 HydrophobicContact CB-CD1 4.39Å; W18-I95 HydrophobicContact CD2-CD1 3.54Å; W18-I95 HydrophobicContact CE3-CD1 3.59Å; W18-I95 HydrophobicContact CG-CD1 3.91Å; W18-I95 HydrophobicContact CH2-CD1 4.49Å; W18-I95 HydrophobicContact CZ2-CD1 4.45Å; W18-I95 HydrophobicContact CZ3-CD1 4.09Å; G91-I95 WeakPolarHBondContact O-CG1 3.24Å; G91-I95 PolarHBondContact O-N 3.42Å; I92-I95 PolarHBondContact O-N 3.34Å; L93-I95 PolarHBondContact O-N 3.42Å; I95-L97 VanDerWaalsContact C-N 3.34Å; I95-L97 PolarHBondContact O-N 2.86Å; I95-C98 WeakPolarHBondContact O-CB 3.46Å; I95-C98 PolarHBondContact O-N 3.44Å; I95-C98 VanDerWaalsContact O-N 3.1Å; I95-V99 WeakPolarHBondContact O-CG2 3.22Å; I95-V99 PolarHBondContact O-N 3.22Å; I95-F125 HydrophobicContact CG1-CE1 4.2Å; I95-F125 HydrophobicContact CG1-CZ 3.72Å |
| 96 | L | 92.4 | Very high | 86.9 | Confident | 109 Ų | 109 | 56 Ų | 56 | 57% | 0.571 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -59.3 | -45 | 177.6 | -68.9 | 175.1 | 0 | 0 | 0 | 111.8 | I92 L93 C98 V99 A100 | I92-L96 HydrophobicContact CG2-CD1 4.31Å; I92-L96 WeakPolarHBondContact O-CG 3.38Å; I92-L96 PolarHBondContact O-N 2.88Å; L93-L96 PolarHBondContact O-N 2.94Å; L96-C98 VanDerWaalsContact C-N 3.33Å; L96-V99 PolarHBondContact O-N 3.43Å; L96-A100 WeakPolarHBondContact O-CB 3.36Å; L96-A100 PolarHBondContact O-N 3.07Å |
| 97 | L | 90.4 | Very high | 85.6 | Confident | 60 Ų | 60 | 56.3 Ų | 56.3 | 31% | 0.314 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -65.2 | -37.2 | 174.7 | -68.3 | 175 | 0 | 0 | 0 | 111.8 | L93 A94 I95 A100 G101 V117 M124 | L93-L97 WeakPolarHBondContact O-CG 3.39Å; L93-L97 PolarHBondContact O-N 2.83Å; A94-L97 PolarHBondContact O-N 3.09Å; I95-L97 VanDerWaalsContact C-N 3.34Å; I95-L97 PolarHBondContact O-N 2.86Å; L97-A100 PolarHBondContact O-N 3.36Å; L97-G101 PolarHBondContact O-N 2.98Å; L97-V117 HydrophobicContact CD2-CG1 4.43Å; L97-V117 WeakPolarHBondContact O-CG1 3.5Å; L97-M124 HydrophobicContact CD1-CG 4.12Å |
| 98 | C | 89.3 | Confident | 84.4 | Confident | 16 Ų | 16 | 57.9 Ų | 57.9 | 11% | 0.108 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -64 | -41.1 | 176.9 | -167.1 | 0 | 0 | 0 | 0 | 111.8 | S11 A94 I95 L96 G101 G102 F125 | S11-C98 WeakPolarHBondContact CB-SG 3.47Å; A94-C98 VanDerWaalsContact O-CB 3.28Å; A94-C98 WeakPolarHBondContact O-CB 3.24Å; A94-C98 PolarHBondContact O-N 3.08Å; I95-C98 WeakPolarHBondContact O-CB 3.46Å; I95-C98 PolarHBondContact O-N 3.44Å; I95-C98 VanDerWaalsContact O-N 3.1Å; L96-C98 VanDerWaalsContact C-N 3.33Å; C98-G101 PolarHBondContact O-N 3.06Å; C98-G102 PolarHBondContact O-N 3.07Å; C98-F125 HydrophobicContact CB-CE2 4.35Å |
| 99 | V | 88.3 | Confident | 83.2 | Confident | 92 Ų | 92 | 64.5 Ų | 64.5 | 56% | 0.558 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -64 | -47.5 | 173.9 | 174 | 0 | 0 | 0 | 0 | 110 | I95 L96 G101 G102 T105 | I95-V99 WeakPolarHBondContact O-CG2 3.22Å; I95-V99 PolarHBondContact O-N 3.22Å; L96-V99 PolarHBondContact O-N 3.43Å; V99-G101 VanDerWaalsContact C-N 3.29Å; V99-G101 PolarHBondContact O-N 3.16Å; V99-G102 PolarHBondContact O-N 3.19Å; V99-G102 VanDerWaalsContact O-N 3.15Å; V99-T105 WeakPolarHBondContact O-CG2 3.47Å |
| 100 | A | 85.7 | Confident | 82.3 | Confident | 27 Ų | 27 | 65.4 Ų | 65.4 | 22% | 0.223 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -61.5 | -33.4 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | L96 L97 T105 V117 | L96-A100 WeakPolarHBondContact O-CB 3.36Å; L96-A100 PolarHBondContact O-N 3.07Å; L97-A100 PolarHBondContact O-N 3.36Å; A100-T105 VanDerWaalsContact O-CG2 3.29Å; A100-T105 WeakPolarHBondContact O-CG2 3.32Å; A100-V117 HydrophobicContact CB-CG1 4.19Å |
| 101 | G | 80 | Confident | 81.4 | Confident | 3 Ų | 3 | 70 Ų | 70 | 3% | 0.031 | 39% | 0.387 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -86.4 | -1.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 115 | Q7 L97 C98 V99 | Q7-G101 PolarHBondContact NE2-O 2.97Å; Q7-G101 VanDerWaalsContact NE2-O 3.11Å; L97-G101 PolarHBondContact O-N 2.98Å; C98-G101 PolarHBondContact O-N 3.06Å; V99-G101 VanDerWaalsContact C-N 3.29Å; V99-G101 PolarHBondContact O-N 3.16Å |
| 102 | G | 79.7 | Confident | 80.7 | Confident | 17 Ų | 17 | 74.4 Ų | 74.4 | 18% | 0.175 | 41% | 0.414 | C | S | . | . | S | Bend | trans | -70.5 | 146.9 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | C98 V99 C104 T105 | C98-G102 PolarHBondContact O-N 3.07Å; V99-G102 PolarHBondContact O-N 3.19Å; V99-G102 VanDerWaalsContact O-N 3.15Å; G102-C104 PolarHBondContact O-N 2.72Å; G102-T105 PolarHBondContact O-N 2.94Å |
| 103 | K | 67.8 | Low | 80 | Confident | 125 Ų | 125 | 72.7 Ų | 72.7 | 54% | 0.543 | 41% | 0.411 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.2 | -27.9 | 175.1 | -66.9 | -168.2 | 179.9 | 179.2 | 0 | 112.9 | T105 | K103-T105 VanDerWaalsContact C-N 3.32Å; K103-T105 PolarHBondContact O-N 3.44Å |
| 104 | C | 63.9 | Low | 79.4 | Confident | 142 Ų | 142 | 70.5 Ų | 70.5 | 96% | 0.959 | 40% | 0.397 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.5 | -5.1 | -178.6 | -52.5 | 0 | 0 | 0 | 0 | 114.1 | G102 | G102-C104 PolarHBondContact O-N 2.72Š|
| 105 | T | 69.5 | Low | 78.8 | Confident | 35 Ų | 35 | 72.9 Ų | 72.9 | 22% | 0.215 | 41% | 0.41 | C | S | . | . | trans | -108.7 | 141.2 | 175.8 | -155.9 | 0 | 0 | 0 | 0 | 111.9 | V99 A100 G102 K103 C107 K114 | V99-T105 WeakPolarHBondContact O-CG2 3.47Å; A100-T105 VanDerWaalsContact O-CG2 3.29Å; A100-T105 WeakPolarHBondContact O-CG2 3.32Å; G102-T105 PolarHBondContact O-N 2.94Å; K103-T105 VanDerWaalsContact C-N 3.32Å; K103-T105 PolarHBondContact O-N 3.44Å; T105-C107 HydrophobicContact CG2-CB 4.12Å; T105-C107 PolarHBondContact OG1-SG 3.28Å; T105-K114 PolarHBondContact O-NZ 2.92Å | ||
| 106 | N | 63.7 | Low | 78.4 | Confident | 124 Ų | 124 | 77.9 Ų | 77.9 | 66% | 0.663 | 43% | 0.43 | S | S | * | . | trans | -102.7 | 35.6 | 175.3 | -158 | -14.4 | 0 | 0 | 0 | 111.6 | V108 | N106-V108 VanDerWaalsContact C-N 3.32Š| ||
| 107 | C | 67.6 | Low | 78.2 | Confident | 90 Ų | 90 | 74.3 Ų | 74.3 | 61% | 0.608 | 41% | 0.413 | S | S | * | . | S | Bend | trans | -72.5 | -26.8 | 174 | -65.3 | 0 | 0 | 0 | 0 | 112.6 | T105 | T105-C107 HydrophobicContact CG2-CB 4.12Å; T105-C107 PolarHBondContact OG1-SG 3.28Å |
| 108 | V | 70 | Confident | 78.2 | Confident | 33 Ų | 33 | 71.7 Ų | 71.7 | 20% | 0.2 | 40% | 0.4 | C | S | . | . | trans | -132.2 | 120.9 | -178.2 | 177.9 | 0 | 0 | 0 | 0 | 108.1 | N106 N110 A113 K114 | N106-V108 VanDerWaalsContact C-N 3.32Å; V108-N110 HydrophobicContact CG1-CB 4.45Å; V108-A113 HydrophobicContact CG1-CB 3.56Å; V108-K114 HydrophobicContact CB-CG 4.03Å; V108-K114 HydrophobicContact CG1-CG 4.05Å; V108-K114 WeakPolarHBondContact O-CE 3.22Å | ||
| 109 | Q | 71.2 | Confident | 78.2 | Confident | 168 Ų | 168 | 72.7 Ų | 72.7 | 79% | 0.785 | 40% | 0.404 | S | S | * | . | trans | -82.8 | -26.4 | -179.9 | -70.8 | 170.6 | 4.3 | 0 | 0 | 112.4 | E111 | Q109-E111 PolarHBondContact O-N 3.06Š| ||
| 110 | N | 78.3 | Confident | 78.3 | Confident | 117 Ų | 117 | 70.2 Ų | 70.2 | 63% | 0.626 | 39% | 0.393 | S | S | * | . | trans | -78.9 | 118.3 | -178.6 | -66.5 | -40.5 | 0 | 0 | 0 | 112 | V108 T112 A113 K114 | V108-N110 HydrophobicContact CG1-CB 4.45Å; N110-T112 PolarHBondContact O-N 3.36Å; N110-A113 HydrophobicContact CB-CB 3.87Å; N110-A113 PolarHBondContact O-N 3.46Å; N110-A113 VanDerWaalsContact O-N 3.1Å; N110-K114 PolarHBondContact O-N 2.7Å | ||
| 111 | E | 77.5 | Confident | 78.7 | Confident | 118 Ų | 118 | 69 Ų | 69 | 55% | 0.551 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -62 | -39.2 | -178.2 | -168.7 | 171 | -173.2 | 0 | 0 | 112.9 | M1 Q109 A113 K114 I115 | M1-E111 WeakPolarHBondContact CE-OE1 3.19Å; Q109-E111 PolarHBondContact O-N 3.06Å; E111-A113 VanDerWaalsContact C-N 3.3Å; E111-A113 PolarHBondContact O-N 3.34Å; E111-K114 WeakPolarHBondContact O-CB 3.39Å; E111-K114 PolarHBondContact O-N 2.95Å; E111-I115 WeakPolarHBondContact O-CG1 3.26Å; E111-I115 PolarHBondContact O-N 3.17Å; E111-I115 VanDerWaalsContact O-N 3.11Å |
| 112 | T | 79.4 | Confident | 79.3 | Confident | 92 Ų | 92 | 68.8 Ų | 68.8 | 56% | 0.564 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -64.1 | -35.6 | 175.3 | -41.8 | 0 | 0 | 0 | 0 | 112.3 | N110 K116 | N110-T112 PolarHBondContact O-N 3.36Å; T112-K116 WeakPolarHBondContact O-CG 3.28Å; T112-K116 PolarHBondContact O-N 3.02Å; T112-K116 VanDerWaalsContact O-N 3.17Å |
| 113 | A | 82.1 | Confident | 80 | Confident | 33 Ų | 33 | 71.3 Ų | 71.3 | 27% | 0.273 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -71.8 | -37.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | V108 N110 E111 I115 K116 V117 | V108-A113 HydrophobicContact CG1-CB 3.56Å; N110-A113 HydrophobicContact CB-CB 3.87Å; N110-A113 PolarHBondContact O-N 3.46Å; N110-A113 VanDerWaalsContact O-N 3.1Å; E111-A113 VanDerWaalsContact C-N 3.3Å; E111-A113 PolarHBondContact O-N 3.34Å; A113-I115 VanDerWaalsContact C-N 3.33Å; A113-I115 PolarHBondContact O-N 3.41Å; A113-K116 PolarHBondContact O-N 2.88Å; A113-V117 WeakPolarHBondContact O-CB 3.4Å; A113-V117 VanDerWaalsContact O-CG2 3.25Å; A113-V117 WeakPolarHBondContact O-CG2 3.35Å; A113-V117 PolarHBondContact O-N 2.89Å |
| 114 | K | 82.2 | Confident | 81.4 | Confident | 45 Ų | 45 | 67.9 Ų | 67.9 | 20% | 0.196 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -57.6 | -44.2 | 172.5 | -69.4 | -168.1 | -177.7 | -163.8 | 0 | 112.3 | T105 V108 N110 E111 V117 G118 | T105-K114 PolarHBondContact O-NZ 2.92Å; V108-K114 HydrophobicContact CB-CG 4.03Å; V108-K114 HydrophobicContact CG1-CG 4.05Å; V108-K114 WeakPolarHBondContact O-CE 3.22Å; N110-K114 PolarHBondContact O-N 2.7Å; E111-K114 WeakPolarHBondContact O-CB 3.39Å; E111-K114 PolarHBondContact O-N 2.95Å; K114-V117 PolarHBondContact O-N 3.32Å; K114-G118 PolarHBondContact O-N 2.9Å |
| 115 | I | 82.5 | Confident | 82.9 | Confident | 51 Ų | 51 | 61.1 Ų | 61.1 | 26% | 0.262 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -62.5 | -46.9 | 177.8 | -65.3 | 168.3 | 0 | 0 | 0 | 110.6 | E111 A113 V117 G118 I119 N184 P186 | E111-I115 WeakPolarHBondContact O-CG1 3.26Å; E111-I115 PolarHBondContact O-N 3.17Å; E111-I115 VanDerWaalsContact O-N 3.11Å; A113-I115 VanDerWaalsContact C-N 3.33Å; A113-I115 PolarHBondContact O-N 3.41Å; I115-V117 VanDerWaalsContact C-N 3.34Å; I115-V117 PolarHBondContact O-N 3.32Å; I115-G118 PolarHBondContact O-N 3.41Å; I115-I119 HydrophobicContact CG2-CD1 3.95Å; I115-I119 WeakPolarHBondContact O-CG1 3.43Å; I115-I119 PolarHBondContact O-N 3.45Å; I115-N184 WeakPolarHBondContact CG2-O 3.34Å; I115-P186 HydrophobicContact CG2-CB 4.46Å; I115-P186 HydrophobicContact CG2-CG 4.28Å |
| 116 | K | 85.8 | Confident | 84.2 | Confident | 138 Ų | 138 | 61.9 Ų | 61.9 | 60% | 0.6 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -60.5 | -42 | 177.6 | -71.6 | 179.2 | 179.8 | -173.8 | 0 | 112.3 | T112 A113 I119 A120 | T112-K116 WeakPolarHBondContact O-CG 3.28Å; T112-K116 PolarHBondContact O-N 3.02Å; T112-K116 VanDerWaalsContact O-N 3.17Å; A113-K116 PolarHBondContact O-N 2.88Å; K116-I119 PolarHBondContact O-N 3.06Å; K116-A120 WeakPolarHBondContact O-CB 3.47Å; K116-A120 PolarHBondContact O-N 3.03Å |
| 117 | V | 88.4 | Confident | 85.8 | Confident | 35 Ų | 35 | 59 Ų | 59 | 21% | 0.212 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -64.7 | -40 | 176.6 | 172.2 | 0 | 0 | 0 | 0 | 111.3 | L97 A100 A113 K114 I115 A120 S121 | L97-V117 HydrophobicContact CD2-CG1 4.43Å; L97-V117 WeakPolarHBondContact O-CG1 3.5Å; A100-V117 HydrophobicContact CB-CG1 4.19Å; A113-V117 WeakPolarHBondContact O-CB 3.4Å; A113-V117 VanDerWaalsContact O-CG2 3.25Å; A113-V117 WeakPolarHBondContact O-CG2 3.35Å; A113-V117 PolarHBondContact O-N 2.89Å; K114-V117 PolarHBondContact O-N 3.32Å; I115-V117 VanDerWaalsContact C-N 3.34Å; I115-V117 PolarHBondContact O-N 3.32Å; V117-A120 PolarHBondContact O-N 2.95Å; V117-S121 PolarHBondContact O-N 2.88Å |
| 118 | G | 89.1 | Confident | 87.2 | Confident | 4 Ų | 4 | 54.7 Ų | 54.7 | 4% | 0.041 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -66.9 | -33.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 114 | K114 I115 S121 G122 | K114-G118 PolarHBondContact O-N 2.9Å; I115-G118 PolarHBondContact O-N 3.41Å; G118-S121 PolarHBondContact O-OG 3.44Å; G118-G122 PolarHBondContact O-N 3.4Å |
| 119 | I | 88.9 | Confident | 88.5 | Confident | 37 Ų | 37 | 53.1 Ų | 53.1 | 19% | 0.19 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -70.5 | -42.1 | 172.3 | -65.8 | 165.5 | 0 | 0 | 0 | 110 | I115 K116 S121 G122 V123 P186 | I115-I119 HydrophobicContact CG2-CD1 3.95Å; I115-I119 WeakPolarHBondContact O-CG1 3.43Å; I115-I119 PolarHBondContact O-N 3.45Å; K116-I119 PolarHBondContact O-N 3.06Å; I119-S121 VanDerWaalsContact C-N 3.32Å; I119-S121 PolarHBondContact O-N 2.98Å; I119-G122 PolarHBondContact O-N 2.88Å; I119-G122 VanDerWaalsContact O-N 3.13Å; I119-V123 WeakPolarHBondContact O-CG2 3.48Å; I119-V123 PolarHBondContact O-N 3.4Å; I119-P186 VanDerWaalsContact CD1-CD 3.49Å |
| 120 | A | 92 | Very high | 89.7 | Confident | 41 Ų | 41 | 48.2 Ų | 48.2 | 34% | 0.339 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -59.6 | -41.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | K116 V117 G122 V123 M124 | K116-A120 WeakPolarHBondContact O-CB 3.47Å; K116-A120 PolarHBondContact O-N 3.03Å; V117-A120 PolarHBondContact O-N 2.95Å; A120-G122 VanDerWaalsContact C-N 3.35Å; A120-G122 PolarHBondContact O-N 3.43Å; A120-V123 PolarHBondContact O-N 2.94Å; A120-M124 VanDerWaalsContact O-CG 3.29Å; A120-M124 WeakPolarHBondContact O-CG 3.4Å; A120-M124 PolarHBondContact O-N 2.76Å |
| 121 | S | 93 | Very high | 90.5 | Very high | 0 Ų | 0 | 44.4 Ų | 44.4 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -63.5 | -40.2 | 174.5 | 67.8 | 0 | 0 | 0 | 0 | 112.3 | A94 V117 G118 I119 M124 F125 | A94-S121 WeakPolarHBondContact O-CB 3.42Å; V117-S121 PolarHBondContact O-N 2.88Å; G118-S121 PolarHBondContact O-OG 3.44Å; I119-S121 VanDerWaalsContact C-N 3.32Å; I119-S121 PolarHBondContact O-N 2.98Å; S121-M124 PolarHBondContact O-N 3.33Å; S121-F125 VanDerWaalsContact O-CD2 3.28Å; S121-F125 WeakPolarHBondContact O-CD2 3.23Å; S121-F125 PolarHBondContact O-N 3.13Å |
| 122 | G | 93.1 | Very high | 91.3 | Very high | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -60.4 | -45 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | G118 I119 A120 M124 F125 I126 G178 | G118-G122 PolarHBondContact O-N 3.4Å; I119-G122 PolarHBondContact O-N 2.88Å; I119-G122 VanDerWaalsContact O-N 3.13Å; A120-G122 VanDerWaalsContact C-N 3.35Å; A120-G122 PolarHBondContact O-N 3.43Å; G122-M124 VanDerWaalsContact C-N 3.33Å; G122-M124 PolarHBondContact O-N 3.35Å; G122-F125 PolarHBondContact O-N 3.13Å; G122-I126 WeakPolarHBondContact O-CG1 3.45Å; G122-I126 PolarHBondContact O-N 3.48Å; G122-G178 WeakPolarHBondContact O-CA 3.49Å |
| 123 | V | 95.2 | Very high | 92.1 | Very high | 70 Ų | 70 | 36.9 Ų | 36.9 | 42% | 0.424 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -61.6 | -43.3 | 176 | 175.1 | 0 | 0 | 0 | 0 | 110.7 | I119 A120 F125 I126 V127 C182 | I119-V123 WeakPolarHBondContact O-CG2 3.48Å; I119-V123 PolarHBondContact O-N 3.4Å; A120-V123 PolarHBondContact O-N 2.94Å; V123-F125 VanDerWaalsContact C-N 3.34Å; V123-F125 PolarHBondContact O-N 3.49Å; V123-I126 PolarHBondContact O-N 3.46Å; V123-V127 HydrophobicContact CG1-CG2 4.44Å; V123-V127 WeakPolarHBondContact O-CG2 3.49Å; V123-V127 PolarHBondContact O-N 3.5Å; V123-C182 PolarHBondContact N-SG 2.85Å; V123-C182 VanDerWaalsContact N-SG 3.42Å |
| 124 | M | 95.7 | Very high | 92.7 | Very high | 52 Ų | 52 | 39.3 Ų | 39.3 | 26% | 0.256 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -63.9 | -37.3 | 177.6 | -68.5 | -63 | -76.3 | 0 | 0 | 112.4 | V90 L93 A94 L97 A120 S121 G122 V127 A128 | V90-M124 HydrophobicContact CG1-CE 3.76Å; V90-M124 WeakPolarHBondContact CG1-O 2.99Å; L93-M124 HydrophobicContact CB-CE 4.19Å; L93-M124 HydrophobicContact CD1-CE 4.28Å; A94-M124 HydrophobicContact CB-CB 3.66Å; L97-M124 HydrophobicContact CD1-CG 4.12Å; A120-M124 VanDerWaalsContact O-CG 3.29Å; A120-M124 WeakPolarHBondContact O-CG 3.4Å; A120-M124 PolarHBondContact O-N 2.76Å; S121-M124 PolarHBondContact O-N 3.33Å; G122-M124 VanDerWaalsContact C-N 3.33Å; G122-M124 PolarHBondContact O-N 3.35Å; M124-V127 PolarHBondContact O-N 3.13Å; M124-A128 WeakPolarHBondContact O-CB 3.24Å; M124-A128 PolarHBondContact O-N 3.41Å |
| 125 | F | 96.1 | Very high | 93.3 | Very high | 0 Ų | 0 | 37.3 Ų | 37.3 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -63.6 | -40.2 | 172.1 | -86.7 | -63 | 0 | 0 | 0 | 112.6 | G14 A94 I95 C98 S121 G122 V123 A128 A129 L181 | G14-F125 WeakPolarHBondContact O-CE1 3.26Å; A94-F125 HydrophobicContact CB-CD1 3.96Å; A94-F125 HydrophobicContact CB-CD2 3.75Å; A94-F125 HydrophobicContact CB-CE1 4.03Å; A94-F125 HydrophobicContact CB-CE2 3.83Å; A94-F125 HydrophobicContact CB-CG 3.81Å; A94-F125 HydrophobicContact CB-CZ 3.97Å; I95-F125 HydrophobicContact CG1-CE1 4.2Å; I95-F125 HydrophobicContact CG1-CZ 3.72Å; C98-F125 HydrophobicContact CB-CE2 4.35Å; S121-F125 VanDerWaalsContact O-CD2 3.28Å; S121-F125 WeakPolarHBondContact O-CD2 3.23Å; S121-F125 PolarHBondContact O-N 3.13Å; G122-F125 PolarHBondContact O-N 3.13Å; V123-F125 VanDerWaalsContact C-N 3.34Å; V123-F125 PolarHBondContact O-N 3.49Å; F125-A128 PolarHBondContact O-N 3.4Å; F125-A129 WeakPolarHBondContact O-CB 3.45Å; F125-A129 PolarHBondContact O-N 3.43Å; F125-L181 HydrophobicContact CD2-CD1 3.9Å; F125-L181 HydrophobicContact CE2-CD1 4.18Å |
| 126 | I | 96.8 | Very high | 93.8 | Very high | 52 Ų | 52 | 34.9 Ų | 34.9 | 27% | 0.267 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -63.7 | -45.2 | 175.7 | -67.8 | 168.1 | 0 | 0 | 0 | 110.4 | G122 V123 A129 V130 L175 | G122-I126 WeakPolarHBondContact O-CG1 3.45Å; G122-I126 PolarHBondContact O-N 3.48Å; V123-I126 PolarHBondContact O-N 3.46Å; I126-A129 WeakPolarHBondContact O-CB 3.38Å; I126-A129 PolarHBondContact O-N 3.02Å; I126-V130 WeakPolarHBondContact O-CG2 3.33Å; I126-V130 PolarHBondContact O-N 2.91Å; I126-L175 HydrophobicContact CB-CD2 4.42Å; I126-L175 HydrophobicContact CG1-CD2 4.43Å; I126-L175 HydrophobicContact CG2-CD2 3.92Å |
| 127 | V | 96.9 | Very high | 94.2 | Very high | 63 Ų | 63 | 30.9 Ų | 30.9 | 38% | 0.382 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -61.4 | -45.9 | 177.3 | 173.2 | 0 | 0 | 0 | 0 | 110.8 | V90 V123 M124 A129 V130 L131 | V90-V127 HydrophobicContact CG1-CB 4.44Å; V90-V127 HydrophobicContact CG1-CG1 4.23Å; V123-V127 HydrophobicContact CG1-CG2 4.44Å; V123-V127 WeakPolarHBondContact O-CG2 3.49Å; V123-V127 PolarHBondContact O-N 3.5Å; M124-V127 PolarHBondContact O-N 3.13Å; V127-A129 VanDerWaalsContact C-N 3.32Å; V127-A129 PolarHBondContact O-N 2.95Å; V127-V130 PolarHBondContact O-N 3.46Å; V127-L131 HydrophobicContact CG1-CD1 4.01Å; V127-L131 HydrophobicContact CG1-CG 4.47Å; V127-L131 WeakPolarHBondContact O-CB 3.37Å; V127-L131 VanDerWaalsContact O-CG 3.3Å; V127-L131 WeakPolarHBondContact O-CG 3.37Å; V127-L131 PolarHBondContact O-N 3.48Å |
| 128 | A | 96.7 | Very high | 94.5 | Very high | 0 Ų | 0 | 36.1 Ų | 36.1 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -58 | -45.5 | 174 | 0 | 0 | 0 | 0 | 0 | 111.4 | S87 V90 M124 F125 V130 L131 C132 M174 | S87-A128 PolarHBondContact OG-O 2.75Å; V90-A128 HydrophobicContact CB-CB 4.23Å; V90-A128 HydrophobicContact CG1-CB 3.88Å; M124-A128 WeakPolarHBondContact O-CB 3.24Å; M124-A128 PolarHBondContact O-N 3.41Å; F125-A128 PolarHBondContact O-N 3.4Å; A128-V130 PolarHBondContact O-N 3.21Å; A128-L131 PolarHBondContact O-N 2.91Å; A128-C132 PolarHBondContact O-N 3.32Å; A128-M174 HydrophobicContact CB-SD 4.49Å |
| 129 | A | 97 | Very high | 94.6 | Very high | 0 Ų | 0 | 36 Ų | 36 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -60.6 | -43.6 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | F125 I126 V127 C132 L133 M174 L175 | F125-A129 WeakPolarHBondContact O-CB 3.45Å; F125-A129 PolarHBondContact O-N 3.43Å; I126-A129 WeakPolarHBondContact O-CB 3.38Å; I126-A129 PolarHBondContact O-N 3.02Å; V127-A129 VanDerWaalsContact C-N 3.32Å; V127-A129 PolarHBondContact O-N 2.95Å; A129-C132 PolarHBondContact O-N 3.22Å; A129-L133 VanDerWaalsContact O-CB 3.3Å; A129-L133 WeakPolarHBondContact O-CB 3.17Å; A129-L133 PolarHBondContact O-N 2.93Å; A129-M174 HydrophobicContact CB-CB 3.58Å; A129-L175 HydrophobicContact CB-CB 4.48Å; A129-L175 HydrophobicContact CB-CD2 3.91Å; A129-L175 HydrophobicContact CB-CG 3.66Å |
| 130 | V | 96.9 | Very high | 94.8 | Very high | 65 Ų | 65 | 34.5 Ų | 34.5 | 39% | 0.394 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -64.7 | -42.9 | 176.9 | 173.2 | 0 | 0 | 0 | 0 | 110.9 | I126 V127 A128 C132 L133 I134 L175 | I126-V130 WeakPolarHBondContact O-CG2 3.33Å; I126-V130 PolarHBondContact O-N 2.91Å; V127-V130 PolarHBondContact O-N 3.46Å; A128-V130 PolarHBondContact O-N 3.21Å; V130-C132 VanDerWaalsContact C-N 3.28Å; V130-C132 PolarHBondContact O-N 3.46Å; V130-L133 PolarHBondContact O-N 3.46Å; V130-L133 VanDerWaalsContact O-N 3.15Å; V130-I134 HydrophobicContact CG1-CD1 3.94Å; V130-I134 HydrophobicContact CG1-CG1 4.33Å; V130-I134 VanDerWaalsContact O-CG1 3.29Å; V130-I134 WeakPolarHBondContact O-CG1 3.24Å; V130-I134 PolarHBondContact O-N 2.91Å; V130-L175 HydrophobicContact CG2-CD2 4.48Å |
| 131 | L | 95 | Very high | 94.8 | Very high | 36 Ų | 36 | 37 Ų | 37 | 19% | 0.188 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -63.5 | -32 | 177 | -71.9 | 172.7 | 0 | 0 | 0 | 113.1 | L83 I86 V90 V127 A128 P135 | L83-L131 HydrophobicContact CD2-CD2 4.27Å; I86-L131 HydrophobicContact CG2-CD1 3.92Å; V90-L131 HydrophobicContact CG2-CD1 4.21Å; V127-L131 HydrophobicContact CG1-CD1 4.01Å; V127-L131 HydrophobicContact CG1-CG 4.47Å; V127-L131 WeakPolarHBondContact O-CB 3.37Å; V127-L131 VanDerWaalsContact O-CG 3.3Å; V127-L131 WeakPolarHBondContact O-CG 3.37Å; V127-L131 PolarHBondContact O-N 3.48Å; A128-L131 PolarHBondContact O-N 2.91Å; L131-P135 WeakPolarHBondContact O-CD 3.22Å |
| 132 | C | 95.1 | Very high | 94.6 | Very high | 0 Ų | 0 | 37.7 Ų | 37.7 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -74.4 | -38.8 | 171.9 | -166.5 | 0 | 0 | 0 | 0 | 112 | A128 A129 V130 P135 V136 M174 | A128-C132 PolarHBondContact O-N 3.32Å; A129-C132 PolarHBondContact O-N 3.22Å; V130-C132 VanDerWaalsContact C-N 3.28Å; V130-C132 PolarHBondContact O-N 3.46Å; C132-P135 VanDerWaalsContact O-CD 3.26Å; C132-P135 WeakPolarHBondContact O-CD 3.13Å; C132-P135 WeakPolarHBondContact O-CG 3.36Å; C132-V136 VanDerWaalsContact O-CG2 3.26Å; C132-V136 WeakPolarHBondContact O-CG2 3.34Å; C132-M174 HydrophobicContact CB-CE 4.14Å |
| 133 | L | 96.1 | Very high | 94.4 | Very high | 53 Ų | 53 | 37.8 Ų | 37.8 | 28% | 0.277 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -69.8 | -38.9 | -176 | -171.2 | 65.1 | 0 | 0 | 0 | 112.8 | A129 V130 V136 C137 | A129-L133 VanDerWaalsContact O-CB 3.3Å; A129-L133 WeakPolarHBondContact O-CB 3.17Å; A129-L133 PolarHBondContact O-N 2.93Å; V130-L133 PolarHBondContact O-N 3.46Å; V130-L133 VanDerWaalsContact O-N 3.15Å; L133-V136 PolarHBondContact O-N 3.25Å; L133-C137 WeakPolarHBondContact O-CB 3.19Å; L133-C137 PolarHBondContact O-N 3.47Å; L133-C137 PolarHBondContact O-SG 2.9Å; L133-C137 VanDerWaalsContact O-SG 3.39Å |
| 134 | I | 95.1 | Very high | 94.2 | Very high | 83 Ų | 83 | 38.2 Ų | 38.2 | 43% | 0.426 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -52.4 | -57.9 | 179.9 | -70 | 163.1 | 0 | 0 | 0 | 112.1 | L83 V130 V136 C137 W138 | L83-I134 HydrophobicContact CD1-CG2 4Å; V130-I134 HydrophobicContact CG1-CD1 3.94Å; V130-I134 HydrophobicContact CG1-CG1 4.33Å; V130-I134 VanDerWaalsContact O-CG1 3.29Å; V130-I134 WeakPolarHBondContact O-CG1 3.24Å; V130-I134 PolarHBondContact O-N 2.91Å; I134-V136 PolarHBondContact O-N 2.86Å; I134-C137 PolarHBondContact O-N 3.37Å; I134-W138 VanDerWaalsContact O-CB 3.24Å; I134-W138 WeakPolarHBondContact O-CB 3.45Å; I134-W138 PolarHBondContact O-N 3.13Å |
| 135 | P | 93.4 | Very high | 93.9 | Very high | 3 Ų | 3 | 41 Ų | 41 | 2% | 0.019 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -68.3 | -33.1 | -177.9 | 27.4 | -36 | 0 | 0 | 0 | 113.1 | W30 A80 L83 V84 L131 C132 T139 | W30-P135 HydrophobicContact CH2-CB 4.49Å; A80-P135 HydrophobicContact CB-CB 3.63Å; L83-P135 HydrophobicContact CB-CB 4.38Å; L83-P135 HydrophobicContact CB-CG 3.92Å; L83-P135 HydrophobicContact CD1-CB 4.22Å; L83-P135 HydrophobicContact CD1-CG 4.36Å; V84-P135 HydrophobicContact CG2-CG 3.89Å; L131-P135 WeakPolarHBondContact O-CD 3.22Å; C132-P135 VanDerWaalsContact O-CD 3.26Å; C132-P135 WeakPolarHBondContact O-CD 3.13Å; C132-P135 WeakPolarHBondContact O-CG 3.36Å; P135-T139 WeakPolarHBondContact O-CB 3.31Å; P135-T139 VanDerWaalsContact O-CG2 3.24Å; P135-T139 WeakPolarHBondContact O-CG2 3.36Å; P135-T139 PolarHBondContact O-N 2.99Å; P135-T139 PolarHBondContact O-OG1 2.94Å |
| 136 | V | 94.3 | Very high | 93.4 | Very high | 0 Ų | 0 | 43.7 Ų | 43.7 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -64.4 | -47.2 | 175.6 | 175.5 | 0 | 0 | 0 | 0 | 110.7 | W30 C132 L133 I134 T139 A140 L164 W168 | W30-V136 HydrophobicContact CH2-CG2 4.1Å; C132-V136 VanDerWaalsContact O-CG2 3.26Å; C132-V136 WeakPolarHBondContact O-CG2 3.34Å; L133-V136 PolarHBondContact O-N 3.25Å; I134-V136 PolarHBondContact O-N 2.86Å; V136-T139 PolarHBondContact O-OG1 2.93Å; V136-T139 VanDerWaalsContact O-OG1 3.07Å; V136-A140 VanDerWaalsContact O-CB 3.31Å; V136-A140 WeakPolarHBondContact O-CB 3.34Å; V136-A140 PolarHBondContact O-N 3.47Å; V136-L164 HydrophobicContact CB-CD2 4.5Å; V136-L164 HydrophobicContact CG1-CB 4.23Å; V136-L164 HydrophobicContact CG1-CD2 4.02Å; V136-L164 WeakPolarHBondContact CG1-O 3.47Å; V136-W168 HydrophobicContact CG1-CD2 4.4Å; V136-W168 HydrophobicContact CG1-CG 4.18Å |
| 137 | C | 94.5 | Very high | 92.9 | Very high | 55 Ų | 55 | 45.5 Ų | 45.5 | 37% | 0.372 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -69 | -38.9 | 178 | -70.5 | 0 | 0 | 0 | 0 | 112.1 | L133 I134 H141 W168 | L133-C137 WeakPolarHBondContact O-CB 3.19Å; L133-C137 PolarHBondContact O-N 3.47Å; L133-C137 PolarHBondContact O-SG 2.9Å; L133-C137 VanDerWaalsContact O-SG 3.39Å; I134-C137 PolarHBondContact O-N 3.37Å; C137-H141 WeakPolarHBondContact O-CB 3.36Å; C137-H141 PolarHBondContact O-N 2.93Å; C137-W168 PolarHBondContact SG-NE1 3.28Å; C137-W168 VanDerWaalsContact SG-NE1 3.44Å |
| 138 | W | 93.9 | Very high | 92.3 | Very high | 145 Ų | 145 | 51.2 Ų | 51.2 | 55% | 0.549 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -62.4 | -51.4 | 177.1 | -174.6 | -89.2 | 0 | 0 | 0 | 111.5 | D76 I134 A140 H141 T142 | D76-W138 PolarHBondContact OD1-NE1 2.92Å; I134-W138 VanDerWaalsContact O-CB 3.24Å; I134-W138 WeakPolarHBondContact O-CB 3.45Å; I134-W138 PolarHBondContact O-N 3.13Å; W138-A140 VanDerWaalsContact C-N 3.35Å; W138-A140 PolarHBondContact O-N 3.1Å; W138-H141 WeakPolarHBondContact O-CB 3.26Å; W138-H141 PolarHBondContact O-N 2.95Å; W138-H141 VanDerWaalsContact O-N 3.11Å; W138-T142 WeakPolarHBondContact O-CG2 3.17Å; W138-T142 PolarHBondContact O-N 3.44Å |
| 139 | T | 91.1 | Very high | 91.9 | Very high | 2 Ų | 2 | 54 Ų | 54 | 1% | 0.012 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -63.1 | -40.1 | 178.6 | 51.6 | 0 | 0 | 0 | 0 | 112.1 | W30 A80 P135 V136 H141 T142 I143 L164 | W30-T139 HydrophobicContact CE3-CG2 4.03Å; W30-T139 HydrophobicContact CZ3-CG2 3.98Å; A80-T139 HydrophobicContact CB-CG2 4.43Å; P135-T139 WeakPolarHBondContact O-CB 3.31Å; P135-T139 VanDerWaalsContact O-CG2 3.24Å; P135-T139 WeakPolarHBondContact O-CG2 3.36Å; P135-T139 PolarHBondContact O-N 2.99Å; P135-T139 PolarHBondContact O-OG1 2.94Å; V136-T139 PolarHBondContact O-OG1 2.93Å; V136-T139 VanDerWaalsContact O-OG1 3.07Å; T139-H141 VanDerWaalsContact C-N 3.31Å; T139-H141 PolarHBondContact O-N 3.38Å; T139-T142 PolarHBondContact O-N 3.11Å; T139-T142 PolarHBondContact O-OG1 2.92Å; T139-T142 VanDerWaalsContact O-OG1 3.13Å; T139-I143 WeakPolarHBondContact O-CD1 3.33Å; T139-I143 WeakPolarHBondContact O-CG1 3.49Å; T139-I143 PolarHBondContact O-N 3.44Å; T139-L164 VanDerWaalsContact OG1-CD2 3.24Å; T139-L164 WeakPolarHBondContact OG1-CD2 3.4Å |
| 140 | A | 92.1 | Very high | 91.2 | Very high | 4 Ų | 4 | 59.6 Ų | 59.6 | 3% | 0.033 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -59.8 | -43 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | V136 W138 I143 I144 L160 L164 W168 | V136-A140 VanDerWaalsContact O-CB 3.31Å; V136-A140 WeakPolarHBondContact O-CB 3.34Å; V136-A140 PolarHBondContact O-N 3.47Å; W138-A140 VanDerWaalsContact C-N 3.35Å; W138-A140 PolarHBondContact O-N 3.1Å; A140-I143 PolarHBondContact O-N 2.87Å; A140-I144 WeakPolarHBondContact O-CD1 3.41Å; A140-I144 VanDerWaalsContact O-CG1 3.23Å; A140-I144 WeakPolarHBondContact O-CG1 3.35Å; A140-I144 PolarHBondContact O-N 3.3Å; A140-L160 HydrophobicContact CB-CD2 3.81Å; A140-L164 HydrophobicContact CB-CD1 4.34Å; A140-W168 HydrophobicContact CB-CH2 4.27Å; A140-W168 HydrophobicContact CB-CZ2 3.82Å |
| 141 | H | 92.4 | Very high | 90.4 | Very high | 93 Ų | 93 | 66.5 Ų | 66.5 | 43% | 0.431 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -62.9 | -44.9 | 177.8 | -176.2 | 66.4 | 0 | 0 | 0 | 112.3 | C137 W138 T139 I143 I144 Q145 | C137-H141 WeakPolarHBondContact O-CB 3.36Å; C137-H141 PolarHBondContact O-N 2.93Å; W138-H141 WeakPolarHBondContact O-CB 3.26Å; W138-H141 PolarHBondContact O-N 2.95Å; W138-H141 VanDerWaalsContact O-N 3.11Å; T139-H141 VanDerWaalsContact C-N 3.31Å; T139-H141 PolarHBondContact O-N 3.38Å; H141-I143 PolarHBondContact O-N 3.44Å; H141-I144 PolarHBondContact O-N 3.13Å; H141-Q145 PolarHBondContact CE1-NE2 2.82Å; H141-Q145 VanDerWaalsContact NE2-CD 3.28Å; H141-Q145 PolarHBondContact NE2-NE2 3.44Å; H141-Q145 WeakPolarHBondContact O-CB 3.41Å; H141-Q145 WeakPolarHBondContact O-CG 3.02Å; H141-Q145 PolarHBondContact O-N 3.07Å |
| 142 | T | 89.9 | Confident | 89.7 | Confident | 15 Ų | 15 | 66.5 Ų | 66.5 | 9% | 0.092 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -67.7 | -35.2 | 179.4 | 61.7 | 0 | 0 | 0 | 0 | 112.2 | D76 W138 T139 N146 | D76-T142 WeakPolarHBondContact OD2-CG2 3.24Å; D76-T142 PolarHBondContact OD2-OG1 3.36Å; W138-T142 WeakPolarHBondContact O-CG2 3.17Å; W138-T142 PolarHBondContact O-N 3.44Å; T139-T142 PolarHBondContact O-N 3.11Å; T139-T142 PolarHBondContact O-OG1 2.92Å; T139-T142 VanDerWaalsContact O-OG1 3.13Å; T142-N146 WeakPolarHBondContact O-CB 3.26Å; T142-N146 VanDerWaalsContact O-CG 3.25Å; T142-N146 PolarHBondContact O-N 2.93Å; T142-N146 PolarHBondContact O-ND2 3.31Å |
| 143 | I | 89.1 | Confident | 88.8 | Confident | 3 Ų | 3 | 70.8 Ų | 70.8 | 2% | 0.015 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -60.6 | -49.9 | 172.1 | -67.2 | 162.1 | 0 | 0 | 0 | 110.5 | K31 T139 A140 H141 Q145 N146 F147 Y158 L160 L164 | K31-I143 HydrophobicContact CG-CD1 3.92Å; K31-I143 HydrophobicContact CG-CG1 4.25Å; T139-I143 WeakPolarHBondContact O-CD1 3.33Å; T139-I143 WeakPolarHBondContact O-CG1 3.49Å; T139-I143 PolarHBondContact O-N 3.44Å; A140-I143 PolarHBondContact O-N 2.87Å; H141-I143 PolarHBondContact O-N 3.44Å; I143-Q145 PolarHBondContact O-N 3.39Å; I143-N146 PolarHBondContact O-N 3.47Å; I143-F147 PolarHBondContact O-N 3.39Å; I143-Y158 VanDerWaalsContact CG2-O 3.3Å; I143-Y158 WeakPolarHBondContact CG2-O 3.4Å; I143-L160 HydrophobicContact CB-CD2 4.38Å; I143-L160 HydrophobicContact CD1-CD2 4.06Å; I143-L160 HydrophobicContact CG2-CD2 4.28Å; I143-L164 HydrophobicContact CD1-CD1 3.78Å |
| 144 | I | 90.6 | Very high | 87.6 | Confident | 79 Ų | 79 | 75.7 Ų | 75.7 | 41% | 0.405 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -63.3 | -44.8 | -179 | -66.7 | 165.3 | 0 | 0 | 0 | 110.8 | A140 H141 N146 F147 Y148 | A140-I144 WeakPolarHBondContact O-CD1 3.41Å; A140-I144 VanDerWaalsContact O-CG1 3.23Å; A140-I144 WeakPolarHBondContact O-CG1 3.35Å; A140-I144 PolarHBondContact O-N 3.3Å; H141-I144 PolarHBondContact O-N 3.13Å; I144-N146 VanDerWaalsContact C-N 3.33Å; I144-N146 PolarHBondContact O-N 2.77Å; I144-F147 WeakPolarHBondContact O-CB 3.33Å; I144-F147 PolarHBondContact O-N 3.03Å; I144-Y148 HydrophobicContact CG2-CD2 4.01Å; I144-Y148 HydrophobicContact CG2-CE2 3.84Å; I144-Y148 VanDerWaalsContact O-CD2 3.25Å; I144-Y148 WeakPolarHBondContact O-CD2 3.42Å; I144-Y148 PolarHBondContact O-N 3.05Å |
| 145 | Q | 89.4 | Confident | 86.3 | Confident | 109 Ų | 109 | 73 Ų | 73 | 51% | 0.509 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -60.1 | -43.5 | 176.9 | -77.8 | -169.5 | -26.6 | 0 | 0 | 112.2 | H141 I143 F147 Y148 N149 | H141-Q145 PolarHBondContact CE1-NE2 2.82Å; H141-Q145 VanDerWaalsContact NE2-CD 3.28Å; H141-Q145 PolarHBondContact NE2-NE2 3.44Å; H141-Q145 WeakPolarHBondContact O-CB 3.41Å; H141-Q145 WeakPolarHBondContact O-CG 3.02Å; H141-Q145 PolarHBondContact O-N 3.07Å; I143-Q145 PolarHBondContact O-N 3.39Å; Q145-F147 VanDerWaalsContact C-N 3.28Å; Q145-F147 PolarHBondContact O-N 2.91Å; Q145-Y148 PolarHBondContact O-N 3.32Å; Q145-N149 PolarHBondContact O-N 3.14Å |
| 146 | N | 85.6 | Confident | 85.3 | Confident | 58 Ų | 58 | 78 Ų | 78 | 31% | 0.31 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -66.4 | -31.4 | 177.6 | -75.3 | -42.8 | 0 | 0 | 0 | 112.4 | T142 I143 I144 Y148 N149 | T142-N146 WeakPolarHBondContact O-CB 3.26Å; T142-N146 VanDerWaalsContact O-CG 3.25Å; T142-N146 PolarHBondContact O-N 2.93Å; T142-N146 PolarHBondContact O-ND2 3.31Å; I143-N146 PolarHBondContact O-N 3.47Å; I144-N146 VanDerWaalsContact C-N 3.33Å; I144-N146 PolarHBondContact O-N 2.77Å; N146-Y148 VanDerWaalsContact C-N 3.34Å; N146-Y148 PolarHBondContact O-N 3.37Å; N146-N149 PolarHBondContact O-N 2.97Å |
| 147 | F | 85.4 | Confident | 84.6 | Confident | 89 Ų | 89 | 80.2 Ų | 80.2 | 39% | 0.39 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -64 | -37.8 | 176.8 | -169.2 | -89.1 | 0 | 0 | 0 | 112.8 | I143 I144 Q145 K157 | I143-F147 PolarHBondContact O-N 3.39Å; I144-F147 WeakPolarHBondContact O-CB 3.33Å; I144-F147 PolarHBondContact O-N 3.03Å; Q145-F147 VanDerWaalsContact C-N 3.28Å; Q145-F147 PolarHBondContact O-N 2.91Å; F147-K157 HydrophobicContact CD2-CB 4.07Å; F147-K157 HydrophobicContact CD2-CD 3.93Å; F147-K157 HydrophobicContact CD2-CG 4.3Å; F147-K157 HydrophobicContact CE2-CB 4.37Å; F147-K157 HydrophobicContact CE2-CD 3.9Å; F147-K157 HydrophobicContact CZ-CD 4.45Å; F147-K157 WeakPolarHBondContact O-CE 3.44Å |
| 148 | Y | 85.8 | Confident | 84.1 | Confident | 184 Ų | 184 | 80.2 Ų | 80.2 | 72% | 0.722 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -89.2 | -3 | 178.8 | -69.4 | -71.2 | 0 | 0 | 0 | 114.2 | I144 Q145 N146 P150 | I144-Y148 HydrophobicContact CG2-CD2 4.01Å; I144-Y148 HydrophobicContact CG2-CE2 3.84Å; I144-Y148 VanDerWaalsContact O-CD2 3.25Å; I144-Y148 WeakPolarHBondContact O-CD2 3.42Å; I144-Y148 PolarHBondContact O-N 3.05Å; Q145-Y148 PolarHBondContact O-N 3.32Å; N146-Y148 VanDerWaalsContact C-N 3.34Å; N146-Y148 PolarHBondContact O-N 3.37Å; Y148-P150 WeakPolarHBondContact O-CD 3.48Å |
| 149 | N | 86.3 | Confident | 83.9 | Confident | 58 Ų | 58 | 79 Ų | 79 | 31% | 0.31 | 38% | 0.382 | S | S | . | . | trans | -78.3 | 118.4 | -178.4 | -174.2 | -18 | 0 | 0 | 0 | 110.7 | Q145 N146 Y151 V152 | Q145-N149 PolarHBondContact O-N 3.14Å; N146-N149 PolarHBondContact O-N 2.97Å; N149-Y151 PolarHBondContact O-N 3.45Å; N149-Y151 WeakPolarHBondContact OD1-CB 3.34Å; N149-Y151 VanDerWaalsContact OD1-CD2 3.26Å; N149-Y151 WeakPolarHBondContact OD1-CD2 3.4Å; N149-Y151 PolarHBondContact OD1-N 2.81Å; N149-V152 HydrophobicContact CB-CG2 3.9Å; N149-V152 PolarHBondContact O-N 2.94Å; N149-V152 VanDerWaalsContact O-N 3.17Å | ||
| 150 | P | 82.7 | Confident | 83.8 | Confident | 118 Ų | 118 | 81.3 Ų | 81.3 | 77% | 0.766 | 39% | 0.394 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.7 | -13.7 | -177.3 | 29.4 | -36.5 | 0 | 0 | 0 | 113.8 | Y148 V152 | Y148-P150 WeakPolarHBondContact O-CD 3.48Å; P150-V152 VanDerWaalsContact C-N 3.34Å |
| 151 | Y | 81.8 | Confident | 83.7 | Confident | 209 Ų | 209 | 81.1 Ų | 81.1 | 82% | 0.82 | 39% | 0.392 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.8 | -7 | 177.2 | -60 | -74 | 0 | 0 | 0 | 113.3 | N149 | N149-Y151 PolarHBondContact O-N 3.45Å; N149-Y151 WeakPolarHBondContact OD1-CB 3.34Å; N149-Y151 VanDerWaalsContact OD1-CD2 3.26Å; N149-Y151 WeakPolarHBondContact OD1-CD2 3.4Å; N149-Y151 PolarHBondContact OD1-N 2.81Å |
| 152 | V | 78.9 | Confident | 83.8 | Confident | 36 Ų | 36 | 78.6 Ų | 78.6 | 22% | 0.218 | 39% | 0.387 | C | S | . | . | S | Bend | trans | -94 | 124.2 | 178.9 | -178.4 | 0 | 0 | 0 | 0 | 109.5 | N149 P150 Q156 K157 | N149-V152 HydrophobicContact CB-CG2 3.9Å; N149-V152 PolarHBondContact O-N 2.94Å; N149-V152 VanDerWaalsContact O-N 3.17Å; P150-V152 VanDerWaalsContact C-N 3.34Å; V152-Q156 HydrophobicContact CG1-CB 4.22Å; V152-K157 HydrophobicContact CG1-CG 4.47Å |
| 153 | V | 77.4 | Confident | 83.9 | Confident | 91 Ų | 91 | 77.9 Ų | 77.9 | 55% | 0.552 | 38% | 0.383 | S | S | * | . | trans | -61.6 | 138.1 | 175.9 | -175.5 | 0 | 0 | 0 | 0 | 109.3 | A155 Q156 | V153-A155 HydrophobicContact CG1-CB 4.31Å; V153-A155 PolarHBondContact O-N 3.02Å; V153-A155 VanDerWaalsContact O-N 3.12Å; V153-Q156 HydrophobicContact CB-CG 4.49Å; V153-Q156 PolarHBondContact O-N 3.4Å | ||
| 154 | E | 70.4 | Confident | 84.1 | Confident | 155 Ų | 155 | 77.7 Ų | 77.7 | 72% | 0.724 | 38% | 0.382 | S | S | * | . | G | 310 helix | trans | -54.3 | -36.4 | -178.3 | -71.6 | -162.8 | 133.8 | 0 | 0 | 113.4 | Q156 K157 | E154-Q156 PolarHBondContact O-N 3.14Å; E154-Q156 VanDerWaalsContact O-N 3.15Å; E154-K157 WeakPolarHBondContact O-CB 3.23Å; E154-K157 PolarHBondContact O-N 3.43Å; E154-K157 IonicContact OE1-NZ 2.83Å |
| 155 | A | 67.8 | Low | 84.3 | Confident | 28 Ų | 28 | 80 Ų | 80 | 23% | 0.231 | 39% | 0.387 | C | S | . | . | G | 310 helix | trans | -67.5 | -8.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | F35 V153 | F35-A155 WeakPolarHBondContact CD1-O 3.45Å; V153-A155 HydrophobicContact CG1-CB 4.31Å; V153-A155 PolarHBondContact O-N 3.02Å; V153-A155 VanDerWaalsContact O-N 3.12Å |
| 156 | Q | 71.9 | Confident | 84.6 | Confident | 106 Ų | 106 | 77.9 Ų | 77.9 | 50% | 0.495 | 38% | 0.378 | S | S | . | . | G | 310 helix | trans | -112.9 | 8.9 | 177.7 | -63.1 | -172.8 | -80.7 | 0 | 0 | 112.7 | F35 V152 V153 E154 Y158 | F35-Q156 HydrophobicContact CE1-CG 4.13Å; V152-Q156 HydrophobicContact CG1-CB 4.22Å; V153-Q156 HydrophobicContact CB-CG 4.49Å; V153-Q156 PolarHBondContact O-N 3.4Å; E154-Q156 PolarHBondContact O-N 3.14Å; E154-Q156 VanDerWaalsContact O-N 3.15Å; Q156-Y158 PolarHBondContact O-N 3.21Å |
| 157 | K | 79.8 | Confident | 85.1 | Confident | 48 Ų | 48 | 75.1 Ų | 75.1 | 21% | 0.209 | 36% | 0.363 | C | S | . | . | trans | -67 | 135.7 | 175.2 | -72 | 177.8 | 177.5 | 174 | 0 | 109.5 | T33 F147 V152 E154 | T33-K157 PolarHBondContact OG1-O 2.92Å; F147-K157 HydrophobicContact CD2-CB 4.07Å; F147-K157 HydrophobicContact CD2-CD 3.93Å; F147-K157 HydrophobicContact CD2-CG 4.3Å; F147-K157 HydrophobicContact CE2-CB 4.37Å; F147-K157 HydrophobicContact CE2-CD 3.9Å; F147-K157 HydrophobicContact CZ-CD 4.45Å; F147-K157 WeakPolarHBondContact O-CE 3.44Å; V152-K157 HydrophobicContact CG1-CG 4.47Å; E154-K157 WeakPolarHBondContact O-CB 3.23Å; E154-K157 PolarHBondContact O-N 3.43Å; E154-K157 IonicContact OE1-NZ 2.83Å | ||
| 158 | Y | 83.8 | Confident | 85.7 | Confident | 55 Ų | 55 | 75.1 Ų | 75.1 | 22% | 0.216 | 36% | 0.361 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.3 | 145.6 | 173.4 | -71.4 | -78.5 | 0 | 0 | 0 | 109.8 | K31 V32 T33 E48 I143 Q156 | K31-Y158 HydrophobicContact CB-CD1 3.83Å; K31-Y158 HydrophobicContact CB-CE1 4.28Å; K31-Y158 VanDerWaalsContact NZ-CZ 3.31Å; V32-Y158 CarbonylContact O-C 3.6Å; V32-Y158 VanDerWaalsContact O-CA 3.32Å; V32-Y158 WeakPolarHBondContact O-CA 3.3Å; T33-Y158 HydrophobicContact CG2-CD1 4.05Å; T33-Y158 HydrophobicContact CG2-CE1 3.72Å; E48-Y158 PolarHBondContact OE1-OH 2.92Å; E48-Y158 WeakPolarHBondContact OE2-CE1 3.44Å; E48-Y158 PolarHBondContact OE2-OH 3.32Å; I143-Y158 VanDerWaalsContact CG2-O 3.3Å; I143-Y158 WeakPolarHBondContact CG2-O 3.4Å; Q156-Y158 PolarHBondContact O-N 3.21Å |
| 159 | E | 89.1 | Confident | 86.2 | Confident | 118 Ų | 118 | 68 Ų | 68 | 55% | 0.551 | 34% | 0.343 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -110.7 | 159.1 | 170.8 | -61.7 | -174.5 | 168.9 | 0 | 0 | 110.1 | V32 G161 | V32-E159 HydrophobicContact CB-CB 4.41Å; V32-E159 PolarHBondContact N-O 2.92Å; V32-E159 VanDerWaalsContact N-O 3.1Å; V32-E159 PolarHBondContact O-N 3.23Å; E159-G161 PolarHBondContact O-N 2.9Å |
| 160 | L | 89.9 | Confident | 86.7 | Confident | 51 Ų | 51 | 65.4 Ų | 65.4 | 27% | 0.267 | 33% | 0.33 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.6 | 119.1 | 179.3 | -65.3 | 166.5 | 0 | 0 | 0 | 110.1 | A140 I143 L164 Y165 | A140-L160 HydrophobicContact CB-CD2 3.81Å; I143-L160 HydrophobicContact CB-CD2 4.38Å; I143-L160 HydrophobicContact CD1-CD2 4.06Å; I143-L160 HydrophobicContact CG2-CD2 4.28Å; L160-L164 HydrophobicContact CB-CD1 4.38Å; L160-L164 HydrophobicContact CD2-CD1 3.7Å; L160-Y165 HydrophobicContact CB-CE2 4.23Å |
| 161 | G | 90.9 | Very high | 87.4 | Confident | 0 Ų | 0 | 59.8 Ų | 59.8 | 0% | 0 | 29% | 0.294 | C | S | . | . | trans | -75 | 155.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | M29 W30 E159 S163 L164 | M29-G161 CarbonylContact O-C 3.52Å; M29-G161 WeakPolarHBondContact O-CA 3.39Å; W30-G161 PolarHBondContact O-N 3.17Å; E159-G161 PolarHBondContact O-N 2.9Å; G161-S163 PolarHBondContact O-N 2.99Å; G161-S163 VanDerWaalsContact O-N 3.16Å; G161-L164 WeakPolarHBondContact O-CB 3.47Å; G161-L164 PolarHBondContact O-N 2.83Å; G161-L164 VanDerWaalsContact O-N 3.09Å | ||
| 162 | A | 92.7 | Very high | 88.1 | Confident | 40 Ų | 40 | 52 Ų | 52 | 33% | 0.331 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -55.6 | -33.6 | -178.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | M29 L164 Y165 I166 | M29-A162 HydrophobicContact CB-CB 4.25Å; M29-A162 HydrophobicContact CE-CB 4.06Å; M29-A162 PolarHBondContact O-N 3Å; M29-A162 HydrophobicContact SD-CB 4.07Å; A162-L164 VanDerWaalsContact C-N 3.27Å; A162-L164 PolarHBondContact O-N 3.43Å; A162-Y165 PolarHBondContact O-N 2.87Å; A162-I166 PolarHBondContact O-N 3.44Å |
| 163 | S | 93 | Very high | 88.9 | Confident | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -65.6 | -27.5 | -179.5 | 68.5 | 0 | 0 | 0 | 0 | 113.1 | M29 W30 G161 I166 G167 | M29-S163 VanDerWaalsContact O-CB 3.28Å; M29-S163 WeakPolarHBondContact O-CB 3.5Å; M29-S163 PolarHBondContact O-N 3.02Å; M29-S163 PolarHBondContact O-OG 3.21Å; W30-S163 VanDerWaalsContact CA-OG 3.23Å; W30-S163 WeakPolarHBondContact CA-OG 3.44Å; W30-S163 PolarHBondContact N-OG 3.35Å; W30-S163 PolarHBondContact NE1-OG 3.46Å; G161-S163 PolarHBondContact O-N 2.99Å; G161-S163 VanDerWaalsContact O-N 3.16Å; S163-I166 PolarHBondContact O-N 3.3Å; S163-G167 PolarHBondContact O-N 2.99Å |
| 164 | L | 93.6 | Very high | 89.8 | Confident | 0 Ų | 0 | 48.7 Ų | 48.7 | 0% | 0 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -66.4 | -41.1 | 178.4 | -62.4 | 178 | 0 | 0 | 0 | 111.2 | W30 V136 T139 A140 I143 L160 G161 A162 G167 W168 | W30-L164 HydrophobicContact CD2-CD2 4.33Å; W30-L164 HydrophobicContact CE3-CD2 3.75Å; W30-L164 HydrophobicContact CZ3-CD2 4.06Å; W30-L164 WeakPolarHBondContact O-CD1 3.18Å; V136-L164 HydrophobicContact CB-CD2 4.5Å; V136-L164 HydrophobicContact CG1-CB 4.23Å; V136-L164 HydrophobicContact CG1-CD2 4.02Å; V136-L164 WeakPolarHBondContact CG1-O 3.47Å; T139-L164 VanDerWaalsContact OG1-CD2 3.24Å; T139-L164 WeakPolarHBondContact OG1-CD2 3.4Å; A140-L164 HydrophobicContact CB-CD1 4.34Å; I143-L164 HydrophobicContact CD1-CD1 3.78Å; L160-L164 HydrophobicContact CB-CD1 4.38Å; L160-L164 HydrophobicContact CD2-CD1 3.7Å; G161-L164 WeakPolarHBondContact O-CB 3.47Å; G161-L164 PolarHBondContact O-N 2.83Å; G161-L164 VanDerWaalsContact O-N 3.09Å; A162-L164 VanDerWaalsContact C-N 3.27Å; A162-L164 PolarHBondContact O-N 3.43Å; L164-G167 WeakPolarHBondContact O-CA 3.23Å; L164-G167 PolarHBondContact O-N 3.49Å; L164-G167 VanDerWaalsContact O-N 3.14Å; L164-W168 PolarHBondContact O-N 3.19Å |
| 165 | Y | 95.5 | Very high | 91.1 | Very high | 127 Ų | 127 | 44.1 Ų | 44.1 | 50% | 0.498 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -64.3 | -42.3 | 175.5 | -58.9 | -75.8 | 0 | 0 | 0 | 111.9 | L160 A162 G167 W168 G169 | L160-Y165 HydrophobicContact CB-CE2 4.23Å; A162-Y165 PolarHBondContact O-N 2.87Å; Y165-G167 VanDerWaalsContact C-N 3.26Å; Y165-G167 PolarHBondContact O-N 2.88Å; Y165-W168 AromaticContact CD1-CE3 3.92Å; Y165-W168 HydrophobicContact CD1-CE3 3.92Å; Y165-W168 AromaticContact CD1-CZ3 3.7Å; Y165-W168 HydrophobicContact CD1-CZ3 3.7Å; Y165-W168 AromaticContact CE1-CZ3 3.83Å; Y165-W168 HydrophobicContact CE1-CZ3 3.83Å; Y165-W168 PolarHBondContact O-N 3.29Å; Y165-G169 PolarHBondContact O-N 3.48Å |
| 166 | I | 95.4 | Very high | 92.4 | Very high | 65 Ų | 65 | 47.2 Ų | 47.2 | 33% | 0.333 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -63.1 | -37.7 | 174 | -57.7 | 171.6 | 0 | 0 | 0 | 109.9 | I23 V24 L27 A162 S163 G169 A170 | I23-I166 HydrophobicContact CG2-CD1 4.39Å; I23-I166 HydrophobicContact CG2-CG2 4.48Å; V24-I166 HydrophobicContact CG2-CB 3.79Å; V24-I166 HydrophobicContact CG2-CG2 3.6Å; L27-I166 HydrophobicContact CD1-CD1 3.85Å; A162-I166 PolarHBondContact O-N 3.44Å; S163-I166 PolarHBondContact O-N 3.3Å; I166-G169 PolarHBondContact O-N 3.02Å; I166-A170 WeakPolarHBondContact O-CB 3.36Å; I166-A170 PolarHBondContact O-N 3.43Å |
| 167 | G | 95.8 | Very high | 93.5 | Very high | 0 Ų | 0 | 42.1 Ų | 42.1 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -61.4 | -43.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | V24 S163 L164 Y165 S171 | V24-G167 VanDerWaalsContact CG2-N 3.33Å; S163-G167 PolarHBondContact O-N 2.99Å; L164-G167 WeakPolarHBondContact O-CA 3.23Å; L164-G167 PolarHBondContact O-N 3.49Å; L164-G167 VanDerWaalsContact O-N 3.14Å; Y165-G167 VanDerWaalsContact C-N 3.26Å; Y165-G167 PolarHBondContact O-N 2.88Å; G167-S171 VanDerWaalsContact O-CB 3.31Å; G167-S171 WeakPolarHBondContact O-CB 3.28Å; G167-S171 PolarHBondContact O-N 2.89Å; G167-S171 PolarHBondContact O-OG 3.08Å |
| 168 | W | 97.4 | Very high | 94.1 | Very high | 88 Ų | 88 | 39.9 Ų | 39.9 | 33% | 0.333 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -63.4 | -46.1 | 172.7 | -70.9 | -35.6 | 0 | 0 | 0 | 112.1 | V136 C137 A140 L164 Y165 S171 A172 | V136-W168 HydrophobicContact CG1-CD2 4.4Å; V136-W168 HydrophobicContact CG1-CG 4.18Å; C137-W168 PolarHBondContact SG-NE1 3.28Å; C137-W168 VanDerWaalsContact SG-NE1 3.44Å; A140-W168 HydrophobicContact CB-CH2 4.27Å; A140-W168 HydrophobicContact CB-CZ2 3.82Å; L164-W168 PolarHBondContact O-N 3.19Å; Y165-W168 AromaticContact CD1-CE3 3.92Å; Y165-W168 HydrophobicContact CD1-CE3 3.92Å; Y165-W168 AromaticContact CD1-CZ3 3.7Å; Y165-W168 HydrophobicContact CD1-CZ3 3.7Å; Y165-W168 AromaticContact CE1-CZ3 3.83Å; Y165-W168 HydrophobicContact CE1-CZ3 3.83Å; Y165-W168 PolarHBondContact O-N 3.29Å; W168-S171 PolarHBondContact O-N 3.04Å; W168-A172 WeakPolarHBondContact O-CB 3.46Å; W168-A172 PolarHBondContact O-N 2.98Å |
| 169 | G | 96.9 | Very high | 94.5 | Very high | 34 Ų | 34 | 39.3 Ų | 39.3 | 35% | 0.351 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -59.9 | -47.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y165 I166 S171 A172 L173 | Y165-G169 PolarHBondContact O-N 3.48Å; I166-G169 PolarHBondContact O-N 3.02Å; G169-S171 PolarHBondContact O-N 3.15Å; G169-A172 PolarHBondContact O-N 3.16Å; G169-L173 WeakPolarHBondContact O-CB 3.1Å; G169-L173 VanDerWaalsContact O-CG 3.26Å; G169-L173 WeakPolarHBondContact O-CG 3.44Å; G169-L173 PolarHBondContact O-N 3.21Å |
| 170 | A | 96.5 | Very high | 94.6 | Very high | 4 Ų | 4 | 35.1 Ų | 35.1 | 3% | 0.033 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -59.5 | -46.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | G17 I166 L173 M174 | G17-A170 WeakPolarHBondContact O-CB 3.28Å; I166-A170 WeakPolarHBondContact O-CB 3.36Å; I166-A170 PolarHBondContact O-N 3.43Å; A170-L173 PolarHBondContact O-N 3.5Å; A170-M174 HydrophobicContact CB-CE 4.48Å; A170-M174 WeakPolarHBondContact O-CG 3.43Å; A170-M174 PolarHBondContact O-N 3.34Å |
| 171 | S | 96.3 | Very high | 94.6 | Very high | 1 Ų | 1 | 32.9 Ų | 32.9 | 1% | 0.007 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -64.7 | -42.3 | 178.2 | -57.2 | 0 | 0 | 0 | 0 | 111.8 | G167 W168 G169 M174 L175 | G167-S171 VanDerWaalsContact O-CB 3.31Å; G167-S171 WeakPolarHBondContact O-CB 3.28Å; G167-S171 PolarHBondContact O-N 2.89Å; G167-S171 PolarHBondContact O-OG 3.08Å; W168-S171 PolarHBondContact O-N 3.04Å; G169-S171 PolarHBondContact O-N 3.15Å; S171-M174 PolarHBondContact O-N 2.82Å; S171-L175 WeakPolarHBondContact O-CB 3.25Å; S171-L175 WeakPolarHBondContact O-CG 3.48Å; S171-L175 PolarHBondContact O-N 3.33Å |
| 172 | A | 97.4 | Very high | 94.5 | Very high | 45 Ų | 45 | 34.3 Ų | 34.3 | 37% | 0.372 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -62.6 | -44.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | W168 G169 L175 I176 | W168-A172 WeakPolarHBondContact O-CB 3.46Å; W168-A172 PolarHBondContact O-N 2.98Å; G169-A172 PolarHBondContact O-N 3.16Å; A172-L175 PolarHBondContact O-N 3.34Å; A172-I176 WeakPolarHBondContact O-CB 3.41Å; A172-I176 VanDerWaalsContact O-CG1 3.24Å; A172-I176 WeakPolarHBondContact O-CG1 3.4Å; A172-I176 PolarHBondContact O-N 3.09Å |
| 173 | L | 96.6 | Very high | 94 | Very high | 57 Ų | 57 | 35.9 Ų | 35.9 | 30% | 0.298 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -63.2 | -43.1 | 177.3 | -69.9 | 171.7 | 0 | 0 | 0 | 112 | L13 I16 G169 A170 G177 | L13-L173 HydrophobicContact CD2-CD2 3.76Å; I16-L173 HydrophobicContact CG2-CD1 3.98Å; G169-L173 WeakPolarHBondContact O-CB 3.1Å; G169-L173 VanDerWaalsContact O-CG 3.26Å; G169-L173 WeakPolarHBondContact O-CG 3.44Å; G169-L173 PolarHBondContact O-N 3.21Å; A170-L173 PolarHBondContact O-N 3.5Å; L173-G177 PolarHBondContact O-N 2.9Å |
| 174 | M | 96.3 | Very high | 92.9 | Very high | 0 Ų | 0 | 37.1 Ų | 37.1 | 0% | 0 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -65.8 | -39.5 | 175.2 | -70.9 | -173.1 | -78.6 | 0 | 0 | 112.4 | G17 W18 A21 A128 A129 C132 A170 S171 G178 | G17-M174 VanDerWaalsContact C-CG 3.47Å; W18-M174 HydrophobicContact CB-SD 4.38Å; A21-M174 HydrophobicContact CB-CE 3.96Å; A128-M174 HydrophobicContact CB-SD 4.49Å; A129-M174 HydrophobicContact CB-CB 3.58Å; C132-M174 HydrophobicContact CB-CE 4.14Å; A170-M174 HydrophobicContact CB-CE 4.48Å; A170-M174 WeakPolarHBondContact O-CG 3.43Å; A170-M174 PolarHBondContact O-N 3.34Å; S171-M174 PolarHBondContact O-N 2.82Å; M174-G178 PolarHBondContact O-N 3.34Å |
| 175 | L | 96.4 | Very high | 91.3 | Very high | 59 Ų | 59 | 41.7 Ų | 41.7 | 31% | 0.309 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -63.1 | -48.3 | 175.6 | -81.8 | 174 | 0 | 0 | 0 | 111.7 | I126 A129 V130 S171 A172 G178 A179 | I126-L175 HydrophobicContact CB-CD2 4.42Å; I126-L175 HydrophobicContact CG1-CD2 4.43Å; I126-L175 HydrophobicContact CG2-CD2 3.92Å; A129-L175 HydrophobicContact CB-CB 4.48Å; A129-L175 HydrophobicContact CB-CD2 3.91Å; A129-L175 HydrophobicContact CB-CG 3.66Å; V130-L175 HydrophobicContact CG2-CD2 4.48Å; S171-L175 WeakPolarHBondContact O-CB 3.25Å; S171-L175 WeakPolarHBondContact O-CG 3.48Å; S171-L175 PolarHBondContact O-N 3.33Å; A172-L175 PolarHBondContact O-N 3.34Å; L175-G178 PolarHBondContact O-N 3.33Å; L175-A179 VanDerWaalsContact O-CB 3.24Å; L175-A179 WeakPolarHBondContact O-CB 3.45Å; L175-A179 PolarHBondContact O-N 2.86Å |
| 176 | I | 95.6 | Very high | 89.6 | Confident | 93 Ų | 93 | 38.4 Ų | 38.4 | 48% | 0.477 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -64 | -47.8 | 179.1 | -66.4 | 166.1 | 0 | 0 | 0 | 109.6 | L13 A172 G178 A179 M180 | L13-I176 HydrophobicContact CD1-CG2 4.05Å; A172-I176 WeakPolarHBondContact O-CB 3.41Å; A172-I176 VanDerWaalsContact O-CG1 3.24Å; A172-I176 WeakPolarHBondContact O-CG1 3.4Å; A172-I176 PolarHBondContact O-N 3.09Å; I176-G178 PolarHBondContact O-N 2.94Å; I176-A179 PolarHBondContact O-N 2.05Å; I176-M180 HydrophobicContact CG2-CG 4.43Å; I176-M180 HydrophobicContact CG2-SD 3.96Å; I176-M180 WeakPolarHBondContact O-CB 3.32Å; I176-M180 WeakPolarHBondContact O-CG 3.5Å; I176-M180 PolarHBondContact O-N 3.17Å |
| 177 | G | 93.9 | Very high | 87.4 | Confident | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -59.2 | -44.9 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | G10 L173 M180 L181 | G10-G177 VanDerWaalsContact O-CA 3.28Å; G10-G177 WeakPolarHBondContact O-CA 3.45Å; L173-G177 PolarHBondContact O-N 2.9Å; G177-M180 PolarHBondContact O-N 3.35Å; G177-L181 WeakPolarHBondContact O-CG 3.48Å; G177-L181 PolarHBondContact O-N 2.85Å; G177-L181 VanDerWaalsContact O-N 3.09Å |
| 178 | G | 93.4 | Very high | 85 | Confident | 0 Ų | 0 | 51.1 Ų | 51.1 | 0% | 0 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -64.9 | -44.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | G122 M174 L175 I176 M180 L181 C182 | G122-G178 WeakPolarHBondContact O-CA 3.49Å; M174-G178 PolarHBondContact O-N 3.34Å; L175-G178 PolarHBondContact O-N 3.33Å; I176-G178 PolarHBondContact O-N 2.94Å; G178-M180 VanDerWaalsContact C-N 3.33Å; G178-M180 PolarHBondContact O-N 2.63Å; G178-L181 PolarHBondContact O-N 2.97Å; G178-C182 PolarHBondContact O-N 3.47Å; G178-C182 PolarHBondContact O-SG 3.15Å |
| 179 | A | 92.9 | Very high | 82.6 | Confident | 44 Ų | 44 | 52.8 Ų | 52.8 | 36% | 0.364 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -61.9 | -40.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | L175 I176 L181 C182 S183 | L175-A179 VanDerWaalsContact O-CB 3.24Å; L175-A179 WeakPolarHBondContact O-CB 3.45Å; L175-A179 PolarHBondContact O-N 2.86Å; I176-A179 PolarHBondContact O-N 2.05Å; A179-L181 VanDerWaalsContact C-N 3.33Å; A179-L181 PolarHBondContact O-N 3.17Å; A179-C182 PolarHBondContact O-N 3.33Å; A179-S183 PolarHBondContact O-N 3.12Å; A179-S183 PolarHBondContact O-OG 3.2Å |
| 180 | M | 91.2 | Very high | 80.1 | Confident | 29 Ų | 29 | 55.2 Ų | 55.2 | 14% | 0.143 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -62.3 | -41.7 | 175.1 | -71 | 176.5 | 105.3 | 0 | 0 | 111.4 | F6 L9 L13 I176 G177 G178 S183 | F6-M180 HydrophobicContact CD1-CB 3.94Å; F6-M180 HydrophobicContact CD1-CE 4.49Å; F6-M180 HydrophobicContact CD1-CG 4.47Å; F6-M180 HydrophobicContact CD2-CE 3.61Å; F6-M180 VanDerWaalsContact CE1-CA 3.44Å; F6-M180 HydrophobicContact CE1-CB 3.43Å; F6-M180 VanDerWaalsContact CE1-CB 3.43Å; F6-M180 HydrophobicContact CE1-CE 4.2Å; F6-M180 HydrophobicContact CE1-CG 3.71Å; F6-M180 VanDerWaalsContact CE1-O 3.25Å; F6-M180 WeakPolarHBondContact CE1-O 3.49Å; F6-M180 HydrophobicContact CE2-CE 3.2Å; F6-M180 HydrophobicContact CE2-CG 4.27Å; F6-M180 HydrophobicContact CG-CE 4.25Å; F6-M180 HydrophobicContact CZ-CB 3.88Å; F6-M180 HydrophobicContact CZ-CE 3.55Å; F6-M180 HydrophobicContact CZ-CG 3.58Å; F6-M180 HydrophobicContact CZ-SD 4.44Å; L9-M180 HydrophobicContact CD2-CE 3.7Å; L9-M180 HydrophobicContact CG-CE 4.14Å; L9-M180 HydrophobicContact CG-SD 4.5Å; L13-M180 HydrophobicContact CD1-SD 3.74Å; I176-M180 HydrophobicContact CG2-CG 4.43Å; I176-M180 HydrophobicContact CG2-SD 3.96Å; I176-M180 WeakPolarHBondContact O-CB 3.32Å; I176-M180 WeakPolarHBondContact O-CG 3.5Å; I176-M180 PolarHBondContact O-N 3.17Å; G177-M180 PolarHBondContact O-N 3.35Å; G178-M180 VanDerWaalsContact C-N 3.33Å; G178-M180 PolarHBondContact O-N 2.63Å; M180-S183 WeakPolarHBondContact O-CB 3.13Å; M180-S183 PolarHBondContact O-N 3.48Å |
| 181 | L | 89.2 | Confident | 77.6 | Confident | 4 Ų | 4 | 61 Ų | 61 | 2% | 0.021 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -67.2 | -39.1 | 176.2 | -70.6 | 167.9 | 0 | 0 | 0 | 112.4 | Q7 F125 G177 G178 A179 S183 N184 | Q7-L181 HydrophobicContact CG-CD2 3.99Å; F125-L181 HydrophobicContact CD2-CD1 3.9Å; F125-L181 HydrophobicContact CE2-CD1 4.18Å; G177-L181 WeakPolarHBondContact O-CG 3.48Å; G177-L181 PolarHBondContact O-N 2.85Å; G177-L181 VanDerWaalsContact O-N 3.09Å; G178-L181 PolarHBondContact O-N 2.97Å; A179-L181 VanDerWaalsContact C-N 3.33Å; A179-L181 PolarHBondContact O-N 3.17Å; L181-S183 VanDerWaalsContact C-N 3.29Å; L181-S183 PolarHBondContact O-N 3.03Å; L181-N184 WeakPolarHBondContact O-CB 3.09Å; L181-N184 PolarHBondContact O-N 3.1Å |
| 182 | C | 87.9 | Confident | 74.9 | Confident | 31 Ų | 31 | 66.4 Ų | 66.4 | 21% | 0.209 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -67.1 | -27 | 175.3 | -69.9 | 0 | 0 | 0 | 0 | 113.6 | V123 G178 A179 N184 | V123-C182 PolarHBondContact N-SG 2.85Å; V123-C182 VanDerWaalsContact N-SG 3.42Å; G178-C182 PolarHBondContact O-N 3.47Å; G178-C182 PolarHBondContact O-SG 3.15Å; A179-C182 PolarHBondContact O-N 3.33Å; C182-N184 PolarHBondContact O-N 3.34Å |
| 183 | S | 83.5 | Confident | 72.4 | Confident | 72 Ų | 72 | 75.3 Ų | 75.3 | 50% | 0.503 | 40% | 0.403 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67 | -7.5 | -179.5 | -59.5 | 0 | 0 | 0 | 0 | 113.3 | A179 M180 L181 C185 | A179-S183 PolarHBondContact O-N 3.12Å; A179-S183 PolarHBondContact O-OG 3.2Å; M180-S183 WeakPolarHBondContact O-CB 3.13Å; M180-S183 PolarHBondContact O-N 3.48Å; L181-S183 VanDerWaalsContact C-N 3.29Å; L181-S183 PolarHBondContact O-N 3.03Å; S183-C185 PolarHBondContact O-N 2.82Å |
| 184 | N | 69.9 | Low | 69.8 | Low | 27 Ų | 27 | 76 Ų | 76 | 14% | 0.144 | 42% | 0.417 | C | S | . | . | trans | -76.4 | 24.1 | 176.6 | -135.8 | -2.3 | 0 | 0 | 0 | 113.5 | V2 I115 L181 C182 | V2-N184 WeakPolarHBondContact CB-OD1 3.49Å; V2-N184 HydrophobicContact CG2-CB 4.26Å; V2-N184 WeakPolarHBondContact CG2-OD1 3.41Å; V2-N184 PolarHBondContact N-OD1 2.72Å; I115-N184 WeakPolarHBondContact CG2-O 3.34Å; L181-N184 WeakPolarHBondContact O-CB 3.09Å; L181-N184 PolarHBondContact O-N 3.1Å; C182-N184 PolarHBondContact O-N 3.34Å | ||
| 185 | C | 60.1 | Low | 67.6 | Low | 95 Ų | 95 | 79.6 Ų | 79.6 | 64% | 0.642 | 45% | 0.446 | S | S | * | . | trans | -56 | 122.8 | -173.4 | -150 | 0 | 0 | 0 | 0 | 110.3 | S183 R187 | S183-C185 PolarHBondContact O-N 2.82Å; C185-R187 PolarHBondContact O-N 2.89Å | ||
| 186 | P | 58.4 | Low | 65 | Low | 58 Ų | 58 | 86.2 Ų | 86.2 | 38% | 0.377 | 47% | 0.472 | S | S | . | . | trans | -59.5 | 126.5 | 172.5 | 23.7 | -29.7 | 0 | 0 | 0 | 107.3 | I115 I119 N188 | I115-P186 HydrophobicContact CG2-CB 4.46Å; I115-P186 HydrophobicContact CG2-CG 4.28Å; I119-P186 VanDerWaalsContact CD1-CD 3.49Å; P186-N188 PolarHBondContact O-N 3.24Å | ||
| 187 | R | 49.6 | Very low | 62.7 | Low | 224 Ų | 224 | 92 Ų | 92 | 85% | 0.845 | 49% | 0.49 | S | S | * | . | trans | -54 | 114.1 | 169 | -92.1 | -179.2 | 159.9 | 144.1 | -4.2 | 106.6 | C185 D189 | C185-R187 PolarHBondContact O-N 2.89Å; R187-D189 VanDerWaalsContact C-N 3.32Å; R187-D189 PolarHBondContact O-N 2.76Å | ||
| 188 | N | 45.8 | Very low | 60.4 | Low | 108 Ų | 108 | 101.3 Ų | 101.3 | 58% | 0.578 | 53% | 0.531 | S | S | * | . | trans | -72.9 | 96.5 | 168.4 | -171 | 13.4 | 0 | 0 | 0 | 106.4 | P186 S190 T191 | P186-N188 PolarHBondContact O-N 3.24Å; N188-S190 PolarHBondContact ND2-OG 2.92Å; N188-S190 PolarHBondContact O-N 2.84Å; N188-S190 WeakPolarHBondContact OD1-CB 3.35Å; N188-S190 PolarHBondContact OD1-N 2.86Å; N188-S190 PolarHBondContact OD1-OG 3.06Å; N188-S190 VanDerWaalsContact OD1-OG 3.05Å; N188-T191 PolarHBondContact O-OG1 3.39Å | ||
| 189 | D | 46.6 | Very low | 58.2 | Low | 123 Ų | 123 | 105.6 Ų | 105.6 | 66% | 0.658 | 57% | 0.566 | S | S | * | * | G | 310 helix | trans | -68.5 | 17.6 | 170.1 | -75 | -30.9 | 0 | 0 | 0 | 112.2 | R187 T191 | R187-D189 VanDerWaalsContact C-N 3.32Å; R187-D189 PolarHBondContact O-N 2.76Å; D189-T191 VanDerWaalsContact C-N 3.32Å |
| 190 | S | 44 | Very low | 55.7 | Low | 85 Ų | 85 | 106.8 Ų | 106.8 | 59% | 0.594 | 58% | 0.582 | S | S | * | * | G | 310 helix | trans | -85.5 | 3.5 | 168.4 | 89.8 | 0 | 0 | 0 | 0 | 114.2 | N188 | N188-S190 PolarHBondContact ND2-OG 2.92Å; N188-S190 PolarHBondContact O-N 2.84Å; N188-S190 WeakPolarHBondContact OD1-CB 3.35Å; N188-S190 PolarHBondContact OD1-N 2.86Å; N188-S190 PolarHBondContact OD1-OG 3.06Å; N188-S190 VanDerWaalsContact OD1-OG 3.05Å |
| 191 | T | 43.8 | Very low | 53.4 | Low | 125 Ų | 125 | 113 Ų | 113 | 77% | 0.767 | 62% | 0.616 | S | S | * | * | G | 310 helix | trans | -101.5 | 17.2 | 167.1 | 22.1 | 0 | 0 | 0 | 0 | 113.6 | N188 D189 Y193 | N188-T191 PolarHBondContact O-OG1 3.39Å; D189-T191 VanDerWaalsContact C-N 3.32Å; T191-Y193 PolarHBondContact O-N 3.33Å; T191-Y193 VanDerWaalsContact O-N 3.12Å |
| 192 | N | 40.8 | Very low | 51.3 | Low | 115 Ų | 115 | 118 Ų | 118 | 62% | 0.615 | 65% | 0.651 | S | S | * | * | trans | -79.9 | 84.7 | 154 | -70.2 | -60.3 | 0 | 0 | 0 | 108 | A194 | N192-A194 HydrophobicContact CB-CB 4.38Å; N192-A194 PolarHBondContact O-N 2.9Å | ||
| 193 | Y | 44.2 | Very low | 49 | Very low | 233 Ų | 233 | 125.4 Ų | 125.4 | 91% | 0.914 | 68% | 0.683 | S | S | * | * | trans | -58.7 | 74.5 | 133.7 | -116.2 | -91.5 | 0 | 0 | 0 | 105.4 | T191 A195 | T191-Y193 PolarHBondContact O-N 3.33Å; T191-Y193 VanDerWaalsContact O-N 3.12Å; Y193-A195 PolarHBondContact O-N 3.09Å | ||
| 194 | A | 42.5 | Very low | 46.9 | Very low | 72 Ų | 72 | 131.9 Ų | 131.9 | 60% | 0.595 | 70% | 0.698 | S | S | * | * | trans | -62.5 | 99.4 | 164 | 0 | 0 | 0 | 0 | 0 | 103.2 | N192 K196 | N192-A194 HydrophobicContact CB-CB 4.38Å; N192-A194 PolarHBondContact O-N 2.9Å; A194-K196 PolarHBondContact O-N 2.91Å | ||
| 195 | A | 50.1 | Low | 45.5 | Very low | 75 Ų | 75 | 136.5 Ų | 136.5 | 62% | 0.62 | 73% | 0.727 | S | S | * | * | trans | -51.1 | 99.3 | 159.8 | 0 | 0 | 0 | 0 | 0 | 105.1 | Y193 Y197 | Y193-A195 PolarHBondContact O-N 3.09Å; A195-Y197 HydrophobicContact CB-CD2 4.41Å; A195-Y197 PolarHBondContact O-N 3.44Å | ||
| 196 | K | 42.1 | Very low | 44.6 | Very low | 197 Ų | 197 | 135.4 Ų | 135.4 | 86% | 0.857 | 73% | 0.725 | S | S | * | * | trans | -63.2 | 87.4 | 167 | -86.6 | -173.6 | 176.1 | -179.9 | 0 | 104.9 | A194 K198 | A194-K196 PolarHBondContact O-N 2.91Å; K196-K198 PolarHBondContact O-N 2.98Å | ||
| 197 | Y | 47.4 | Very low | 43.7 | Very low | 215 Ų | 215 | 138.6 Ų | 138.6 | 84% | 0.843 | 75% | 0.746 | S | S | * | * | trans | -60.8 | 98.7 | 155.2 | -89.1 | -85.1 | 0 | 0 | 0 | 105.2 | A195 A199 | A195-Y197 HydrophobicContact CB-CD2 4.41Å; A195-Y197 PolarHBondContact O-N 3.44Å; Y197-A199 PolarHBondContact O-N 3.18Å | ||
| 198 | K | 45.2 | Very low | 43.1 | Very low | 196 Ų | 196 | 139.2 Ų | 139.2 | 85% | 0.852 | 75% | 0.748 | S | S | * | * | trans | -61.8 | 96.1 | 157.5 | -77.3 | -167.2 | 177.9 | -169.3 | 0 | 104.9 | K196 G200 | K196-K198 PolarHBondContact O-N 2.98Å; K198-G200 PolarHBondContact O-N 3.16Å | ||
| 199 | A | 46.3 | Very low | 42.7 | Very low | 90 Ų | 90 | 139.6 Ų | 139.6 | 74% | 0.744 | 76% | 0.759 | S | S | * | * | trans | -58.1 | 109.2 | 158.9 | 0 | 0 | 0 | 0 | 0 | 105.5 | Y197 N201 | Y197-A199 PolarHBondContact O-N 3.18Å; A199-N201 PolarHBondContact O-N 3.15Å | ||
| 200 | G | 40.8 | Very low | 42.2 | Very low | 69 Ų | 69 | 142.7 Ų | 142.7 | 71% | 0.711 | 77% | 0.769 | S | S | * | * | trans | -60.7 | 121.1 | 171.8 | 0 | 0 | 0 | 0 | 0 | 107.5 | K198 S202 | K198-G200 PolarHBondContact O-N 3.16Å; G200-S202 VanDerWaalsContact C-N 3.34Å; G200-S202 PolarHBondContact O-N 3.28Å | ||
| 201 | N | 43 | Very low | 41.8 | Very low | 160 Ų | 160 | 149 Ų | 149 | 86% | 0.856 | 78% | 0.782 | S | S | * | * | trans | -60.5 | 101.1 | 166.3 | -87.5 | -2.1 | 0 | 0 | 0 | 107.3 | A199 E203 | A199-N201 PolarHBondContact O-N 3.15Å; N201-E203 PolarHBondContact O-N 2.77Å | ||
| 202 | S | 44.4 | Very low | 41.5 | Very low | 108 Ų | 108 | 147.2 Ų | 147.2 | 76% | 0.755 | 78% | 0.775 | S | S | * | * | trans | -75 | 99.1 | 159 | 56.2 | 0 | 0 | 0 | 0 | 106.9 | G200 Y204 | G200-S202 VanDerWaalsContact C-N 3.34Å; G200-S202 PolarHBondContact O-N 3.28Å; S202-Y204 VanDerWaalsContact C-N 3.32Å; S202-Y204 PolarHBondContact O-N 2.82Å | ||
| 203 | E | 40.9 | Very low | 41.3 | Very low | 187 Ų | 187 | 147.1 Ų | 147.1 | 87% | 0.874 | 78% | 0.783 | S | S | * | * | trans | -59.2 | 97.5 | 162.1 | -89.2 | 173.8 | 135.1 | 0 | 0 | 108.3 | N201 T205 | N201-E203 PolarHBondContact O-N 2.77Å; E203-T205 PolarHBondContact O-N 3.38Å | ||
| 204 | Y | 39.7 | Very low | 41.3 | Very low | 208 Ų | 208 | 143 Ų | 143 | 82% | 0.816 | 78% | 0.775 | S | S | * | * | trans | -88.3 | 96.9 | 164.4 | -162.6 | -91.7 | 0 | 0 | 0 | 107.4 | S202 A206 | S202-Y204 VanDerWaalsContact C-N 3.32Å; S202-Y204 PolarHBondContact O-N 2.82Å; Y204-A206 PolarHBondContact O-N 2.86Å; Y204-A206 VanDerWaalsContact O-N 3.09Å | ||
| 205 | T | 38.9 | Very low | 41.2 | Very low | 124 Ų | 124 | 145 Ų | 145 | 76% | 0.761 | 78% | 0.782 | S | S | * | * | trans | -65 | 104.5 | 171.2 | -53.1 | 0 | 0 | 0 | 0 | 108.9 | E203 | E203-T205 PolarHBondContact O-N 3.38Š| ||
| 206 | A | 42.9 | Very low | 40.9 | Very low | 72 Ų | 72 | 150 Ų | 150 | 60% | 0.595 | 79% | 0.792 | S | S | * | * | trans | -74.5 | 135.4 | 165.7 | 0 | 0 | 0 | 0 | 0 | 109.4 | Y204 R208 | Y204-A206 PolarHBondContact O-N 2.86Å; Y204-A206 VanDerWaalsContact O-N 3.09Å; A206-R208 PolarHBondContact O-N 3.26Å | ||
| 207 | P | 38.4 | Very low | 40.6 | Very low | 125 Ų | 125 | 150.1 Ų | 150.1 | 81% | 0.812 | 79% | 0.793 | S | S | * | * | trans | -66.8 | 127 | 178.3 | 24.2 | -29.7 | 0 | 0 | 0 | 110.8 | S209 | P207-S209 PolarHBondContact O-N 3.05Š| ||
| 208 | R | 36.4 | Very low | 40.2 | Very low | 237 Ų | 237 | 146.4 Ų | 146.4 | 89% | 0.894 | 79% | 0.788 | S | S | * | * | trans | -68.4 | 111.8 | -179.9 | -172.1 | 176.9 | -177.7 | 165.3 | -1.4 | 109.7 | A206 E210 | A206-R208 PolarHBondContact O-N 3.26Å; R208-E210 PolarHBondContact O-N 3.21Å | ||
| 209 | S | 38.5 | Very low | 39.8 | Very low | 116 Ų | 116 | 145.6 Ų | 145.6 | 81% | 0.811 | 79% | 0.787 | S | S | * | * | trans | -75.2 | 111.1 | 166.4 | 62 | 0 | 0 | 0 | 0 | 109 | P207 Y211 | P207-S209 PolarHBondContact O-N 3.05Å; S209-Y211 PolarHBondContact O-N 3.31Å | ||
| 210 | E | 35.5 | Very low | 39.5 | Very low | 187 Ų | 187 | 151.2 Ų | 151.2 | 87% | 0.874 | 81% | 0.811 | S | S | * | * | trans | -77.8 | 107.5 | 179 | -160.6 | 160.1 | -170 | 0 | 0 | 109.3 | R208 | R208-E210 PolarHBondContact O-N 3.21Š| ||
| 211 | Y | 35.5 | Very low | 39.4 | Very low | 217 Ų | 217 | 155.3 Ų | 155.3 | 85% | 0.851 | 82% | 0.816 | S | S | * | * | trans | -109.9 | 101.9 | 168.4 | -168.3 | -99.3 | 0 | 0 | 0 | 108.2 | S209 | S209-Y211 PolarHBondContact O-N 3.31Š| ||
| 212 | S | 37.2 | Very low | 39.2 | Very low | 89 Ų | 89 | 155.1 Ų | 155.1 | 62% | 0.622 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -78.4 | 116.7 | 174.1 | 65.8 | 0 | 0 | 0 | 0 | 109.9 | I214 | S212-I214 PolarHBondContact O-N 2.91Š|
| 213 | S | 37.7 | Very low | 38.9 | Very low | 112 Ų | 112 | 157.7 Ų | 157.7 | 78% | 0.783 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -75.9 | 116.1 | 164.4 | 40.1 | 0 | 0 | 0 | 0 | 109.8 | ||
| 214 | I | 43.6 | Very low | 38.8 | Very low | 147 Ų | 147 | 155.9 Ų | 155.9 | 75% | 0.754 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -92.1 | 134.5 | 172.9 | -60.7 | 173 | 0 | 0 | 0 | 108.3 | S212 | S212-I214 PolarHBondContact O-N 2.91Š|
| 215 | P | 41.6 | Very low | 38.8 | Very low | 114 Ų | 114 | 152.7 Ų | 152.7 | 74% | 0.74 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -81.8 | 146.7 | -177.6 | 32.4 | -32.5 | 0 | 0 | 0 | 112.6 | ||
| 216 | E | 42.3 | Very low | 38.7 | Very low | 179 Ų | 179 | 154.6 Ų | 154.6 | 84% | 0.836 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -63.1 | 125.7 | 174.4 | -166.7 | 169.6 | 128.3 | 0 | 0 | 111.6 | ||
| 217 | K | 36.3 | Very low | 38.4 | Very low | 200 Ų | 200 | 160.5 Ų | 160.5 | 87% | 0.87 | 83% | 0.834 | S | S | * | * | trans | -137.2 | 116.6 | 163.6 | -93.6 | -171.3 | 177.3 | -178.1 | 0 | 110.2 | ||||
| 218 | N | 40.2 | Very low | 38.4 | Very low | 137 Ų | 137 | 163.2 Ų | 163.2 | 73% | 0.733 | 84% | 0.835 | S | S | * | * | trans | -57.2 | 147.2 | 167.2 | -69 | -31.5 | 0 | 0 | 0 | 112.2 | ||||
| 219 | H | 34.9 | Very low | 38.6 | Very low | 179 Ų | 179 | 157.1 Ų | 157.1 | 83% | 0.829 | 83% | 0.83 | S | S | * | * | trans | -160.4 | 128.2 | 148.4 | -105.1 | -68.3 | 0 | 0 | 0 | 112.5 | ||||
| 220 | V | 40.1 | Very low | 38.6 | Very low | 208 Ų | 208 | 160.8 Ų | 160.8 | 100% | 1.261 | 83% | 0.832 | S | S | * | * | trans | 73.2 | 0 | 152.9 | -166.5 | 0 | 0 | 0 | 0 | 118.7 |
Retrieved 220 of 220 residues in 199.3 ms
(Link to these results)