| 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 | 73.1 | Confident | 88.4 | Confident | 205 Ų | 205 | 93.5 Ų | 93.5 | 100% | 1.01 | 49% | 0.494 | S | S | * | . | 0 | -54.3 | 0 | -150.8 | 165.3 | 164.3 | 0 | 0 | 111.5 | L3 N4 T5 | M1-L3 PolarHBondContact O-N 2.93Å; M1-N4 PolarHBondContact O-N 2.9Å; M1-T5 PolarHBondContact O-N 3.11Å; M1-T5 PolarHBondContact O-OG1 3.04Å | |||
| 2 | F | 88.6 | Confident | 88.6 | Confident | 171 Ų | 171 | 89.3 Ų | 89.3 | 75% | 0.75 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -53.5 | -48.1 | 179 | -174 | -102.1 | 0 | 0 | 0 | 115.2 | N4 T5 V6 | F2-N4 VanDerWaalsContact C-N 3.34Å; F2-N4 PolarHBondContact O-N 2.89Å; F2-T5 WeakPolarHBondContact O-CB 3.31Å; F2-T5 PolarHBondContact O-N 3.49Å; F2-T5 VanDerWaalsContact O-N 3.13Å; F2-V6 HydrophobicContact CD1-CG2 4.07Å; F2-V6 HydrophobicContact CE1-CG2 3.71Å; F2-V6 HydrophobicContact CE2-CG2 4.28Å; F2-V6 HydrophobicContact CG-CG2 4.5Å; F2-V6 HydrophobicContact CZ-CG2 3.82Å; F2-V6 WeakPolarHBondContact O-CG2 3.09Å; F2-V6 PolarHBondContact O-N 3.37Å |
| 3 | L | 86.9 | Confident | 88.9 | Confident | 139 Ų | 139 | 91.4 Ų | 91.4 | 73% | 0.728 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -60.6 | -40.5 | -178.4 | -168.6 | 72.8 | 0 | 0 | 0 | 113 | M1 V6 L7 | M1-L3 PolarHBondContact O-N 2.93Å; L3-V6 PolarHBondContact O-N 2.85Å; L3-L7 WeakPolarHBondContact O-CB 3.17Å; L3-L7 PolarHBondContact O-N 3.16Å |
| 4 | N | 87 | Confident | 89.1 | Confident | 101 Ų | 101 | 85.9 Ų | 85.9 | 54% | 0.54 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -67.1 | -39 | 176.7 | -74.7 | -15.2 | 0 | 0 | 0 | 111.3 | M1 F2 L7 V8 | M1-N4 PolarHBondContact O-N 2.9Å; F2-N4 VanDerWaalsContact C-N 3.34Å; F2-N4 PolarHBondContact O-N 2.89Å; N4-L7 PolarHBondContact O-N 3.31Å; N4-V8 VanDerWaalsContact O-CG2 3.29Å; N4-V8 WeakPolarHBondContact O-CG2 3.47Å; N4-V8 PolarHBondContact O-N 3.34Å |
| 5 | T | 88.9 | Confident | 89.3 | Confident | 82 Ų | 82 | 80.2 Ų | 80.2 | 50% | 0.503 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -62.3 | -46.7 | 174.7 | -51.9 | 0 | 0 | 0 | 0 | 111.1 | M1 F2 L7 V8 V9 | M1-T5 PolarHBondContact O-N 3.11Å; M1-T5 PolarHBondContact O-OG1 3.04Å; F2-T5 WeakPolarHBondContact O-CB 3.31Å; F2-T5 PolarHBondContact O-N 3.49Å; F2-T5 VanDerWaalsContact O-N 3.13Å; T5-L7 PolarHBondContact O-N 3.37Å; T5-V8 PolarHBondContact O-N 2.94Å; T5-V9 VanDerWaalsContact O-CG2 3.31Å; T5-V9 WeakPolarHBondContact O-CG2 3.36Å; T5-V9 PolarHBondContact O-N 3.27Å |
| 6 | V | 91.1 | Very high | 89.3 | Confident | 65 Ų | 65 | 85.3 Ų | 85.3 | 39% | 0.394 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -60.7 | -45.2 | 176.8 | 173.4 | 0 | 0 | 0 | 0 | 111 | F2 L3 V8 V9 L10 | F2-V6 HydrophobicContact CD1-CG2 4.07Å; F2-V6 HydrophobicContact CE1-CG2 3.71Å; F2-V6 HydrophobicContact CE2-CG2 4.28Å; F2-V6 HydrophobicContact CG-CG2 4.5Å; F2-V6 HydrophobicContact CZ-CG2 3.82Å; F2-V6 WeakPolarHBondContact O-CG2 3.09Å; F2-V6 PolarHBondContact O-N 3.37Å; L3-V6 PolarHBondContact O-N 2.85Å; V6-V8 PolarHBondContact O-N 3.28Å; V6-V9 PolarHBondContact O-N 3.04Å; V6-L10 WeakPolarHBondContact O-CB 3.48Å; V6-L10 PolarHBondContact O-N 2.94Å |
| 7 | L | 91.3 | Very high | 89.4 | Confident | 25 Ų | 25 | 86.7 Ų | 86.7 | 13% | 0.131 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -56.9 | -48.3 | 176.6 | 176.4 | 64 | 0 | 0 | 0 | 111.3 | L3 N4 T5 T11 A196 R199 I200 L203 | L3-L7 WeakPolarHBondContact O-CB 3.17Å; L3-L7 PolarHBondContact O-N 3.16Å; N4-L7 PolarHBondContact O-N 3.31Å; T5-L7 PolarHBondContact O-N 3.37Å; L7-T11 HydrophobicContact CD1-CG2 3.91Å; L7-T11 HydrophobicContact CG-CG2 4.45Å; L7-T11 VanDerWaalsContact O-CB 3.3Å; L7-T11 WeakPolarHBondContact O-CB 3.32Å; L7-T11 WeakPolarHBondContact O-CG2 3.23Å; L7-T11 PolarHBondContact O-N 3.35Å; L7-T11 PolarHBondContact O-OG1 3Å; L7-A196 HydrophobicContact CD2-CB 4.49Å; L7-R199 HydrophobicContact CD1-CB 4.37Å; L7-R199 HydrophobicContact CD2-CB 4.42Å; L7-R199 HydrophobicContact CG-CB 4.33Å; L7-I200 HydrophobicContact CD1-CG1 4.07Å; L7-I200 HydrophobicContact CD2-CD1 4.48Å; L7-I200 HydrophobicContact CD2-CG1 4.01Å; L7-L203 HydrophobicContact CD1-CD1 3.54Å |
| 8 | V | 89.8 | Confident | 89.4 | Confident | 55 Ų | 55 | 82.2 Ų | 82.2 | 33% | 0.333 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -63.1 | -46.9 | 179.2 | 172 | 0 | 0 | 0 | 0 | 111.1 | N4 T5 V6 L10 T11 D12 | N4-V8 VanDerWaalsContact O-CG2 3.29Å; N4-V8 WeakPolarHBondContact O-CG2 3.47Å; N4-V8 PolarHBondContact O-N 3.34Å; T5-V8 PolarHBondContact O-N 2.94Å; V6-V8 PolarHBondContact O-N 3.28Å; V8-L10 PolarHBondContact O-N 2.99Å; V8-T11 WeakPolarHBondContact CA-OG1 3.23Å; V8-T11 PolarHBondContact O-N 3.34Å; V8-T11 PolarHBondContact O-OG1 3.16Å; V8-D12 VanDerWaalsContact O-CB 3.29Å; V8-D12 WeakPolarHBondContact O-CB 3.25Å; V8-D12 VanDerWaalsContact O-CG 3.28Å; V8-D12 PolarHBondContact O-N 3.27Å |
| 9 | V | 91.8 | Very high | 89.1 | Confident | 93 Ų | 93 | 78.7 Ų | 78.7 | 56% | 0.564 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -62.2 | -46.7 | -179.9 | 171.9 | 0 | 0 | 0 | 0 | 111.6 | T5 V6 D12 L13 | T5-V9 VanDerWaalsContact O-CG2 3.31Å; T5-V9 WeakPolarHBondContact O-CG2 3.36Å; T5-V9 PolarHBondContact O-N 3.27Å; V6-V9 PolarHBondContact O-N 3.04Å; V9-D12 PolarHBondContact O-N 2.63Å; V9-L13 WeakPolarHBondContact O-CB 3.43Å; V9-L13 PolarHBondContact O-N 3.45Å |
| 10 | L | 92.1 | Very high | 89.1 | Confident | 92 Ų | 92 | 78.3 Ų | 78.3 | 48% | 0.482 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -65.2 | -43.6 | -179.3 | -174.9 | 64.3 | 0 | 0 | 0 | 111.4 | V6 V8 L13 A14 L203 | V6-L10 WeakPolarHBondContact O-CB 3.48Å; V6-L10 PolarHBondContact O-N 2.94Å; V8-L10 PolarHBondContact O-N 2.99Å; L10-L13 PolarHBondContact O-N 3.05Å; L10-A14 WeakPolarHBondContact O-CB 3.35Å; L10-A14 PolarHBondContact O-N 2.89Å; L10-L203 HydrophobicContact CD2-CD1 3.88Å; L10-L203 HydrophobicContact CD2-CD2 4.09Å; L10-L203 HydrophobicContact CG-CD1 4.39Å; L10-L203 HydrophobicContact CG-CD2 3.94Å |
| 11 | T | 92.6 | Very high | 88.9 | Confident | 0 Ų | 0 | 81.6 Ų | 81.6 | 0% | 0 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -65.7 | -43.4 | 178.5 | 51.5 | 0 | 0 | 0 | 0 | 111.9 | L7 V8 A14 A15 R199 L203 | L7-T11 HydrophobicContact CD1-CG2 3.91Å; L7-T11 HydrophobicContact CG-CG2 4.45Å; L7-T11 VanDerWaalsContact O-CB 3.3Å; L7-T11 WeakPolarHBondContact O-CB 3.32Å; L7-T11 WeakPolarHBondContact O-CG2 3.23Å; L7-T11 PolarHBondContact O-N 3.35Å; L7-T11 PolarHBondContact O-OG1 3Å; V8-T11 WeakPolarHBondContact CA-OG1 3.23Å; V8-T11 PolarHBondContact O-N 3.34Å; V8-T11 PolarHBondContact O-OG1 3.16Å; T11-A14 PolarHBondContact O-N 3.44Å; T11-A15 WeakPolarHBondContact O-CB 3.3Å; T11-A15 PolarHBondContact O-N 2.99Å; T11-R199 HydrophobicContact CG2-CB 3.74Å; T11-R199 HydrophobicContact CG2-CG 4.25Å; T11-R199 PolarHBondContact OG1-NH1 3.39Å; T11-L203 HydrophobicContact CG2-CD1 3.67Å; T11-L203 HydrophobicContact CG2-CD2 3.75Å; T11-L203 HydrophobicContact CG2-CG 3.45Å; T11-L203 VanDerWaalsContact CG2-CG 3.45Å |
| 12 | D | 90.4 | Very high | 89.6 | Confident | 44 Ų | 44 | 76.9 Ų | 76.9 | 24% | 0.235 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -65.3 | -40.7 | 178.4 | -77.4 | 10.3 | 0 | 0 | 0 | 111.6 | V8 V9 A15 R16 R199 | V8-D12 VanDerWaalsContact O-CB 3.29Å; V8-D12 WeakPolarHBondContact O-CB 3.25Å; V8-D12 VanDerWaalsContact O-CG 3.28Å; V8-D12 PolarHBondContact O-N 3.27Å; V9-D12 PolarHBondContact O-N 2.63Å; D12-A15 PolarHBondContact O-N 3.24Å; D12-R16 WeakPolarHBondContact O-CB 3.45Å; D12-R16 WeakPolarHBondContact O-CG 3.34Å; D12-R16 PolarHBondContact O-N 3.01Å; D12-R199 IonicContact OD1-CZ 2.73Å; D12-R199 IonicContact OD1-NH1 2.7Å; D12-R199 PolarHBondContact OD1-NH1 3.32Å; D12-R199 IonicContact OD1-NH2 3.67Å |
| 13 | L | 92.5 | Very high | 89.6 | Confident | 116 Ų | 116 | 70.8 Ų | 70.8 | 61% | 0.607 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -63.4 | -49.7 | 176 | -176.5 | 67.2 | 0 | 0 | 0 | 111.1 | V9 L10 A15 R16 L17 | V9-L13 WeakPolarHBondContact O-CB 3.43Å; V9-L13 PolarHBondContact O-N 3.45Å; L10-L13 PolarHBondContact O-N 3.05Å; L13-A15 VanDerWaalsContact C-N 3.33Å; L13-A15 PolarHBondContact O-N 3.35Å; L13-R16 PolarHBondContact O-N 2.93Å; L13-L17 PolarHBondContact O-N 3.4Å |
| 14 | A | 92.2 | Very high | 89.5 | Confident | 14 Ų | 14 | 69.2 Ų | 69.2 | 12% | 0.116 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -63 | -39.9 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | L10 T11 L17 L18 F202 V206 | L10-A14 WeakPolarHBondContact O-CB 3.35Å; L10-A14 PolarHBondContact O-N 2.89Å; T11-A14 PolarHBondContact O-N 3.44Å; A14-L17 PolarHBondContact O-N 3.04Å; A14-L18 WeakPolarHBondContact O-CB 3.19Å; A14-L18 PolarHBondContact O-N 3.27Å; A14-F202 HydrophobicContact CB-CE1 3.8Å; A14-F202 HydrophobicContact CB-CZ 4.37Å; A14-V206 HydrophobicContact CB-CG2 4.37Å |
| 15 | A | 91.4 | Very high | 89.4 | Confident | 1 Ų | 1 | 69.8 Ų | 69.8 | 1% | 0.008 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -67.1 | -35.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | T11 D12 L13 G19 F184 G185 L188 F202 | T11-A15 WeakPolarHBondContact O-CB 3.3Å; T11-A15 PolarHBondContact O-N 2.99Å; D12-A15 PolarHBondContact O-N 3.24Å; L13-A15 VanDerWaalsContact C-N 3.33Å; L13-A15 PolarHBondContact O-N 3.35Å; A15-G19 WeakPolarHBondContact O-CA 3.11Å; A15-G19 PolarHBondContact O-N 3.31Å; A15-F184 HydrophobicContact CB-CD1 3.74Å; A15-F184 HydrophobicContact CB-CE1 4.33Å; A15-G185 VanDerWaalsContact O-CA 3.29Å; A15-G185 WeakPolarHBondContact O-CA 3.22Å; A15-L188 HydrophobicContact CB-CD1 3.81Å; A15-F202 HydrophobicContact CB-CE1 4.05Å; A15-F202 HydrophobicContact CB-CZ 4Å |
| 16 | R | 89.4 | Confident | 89.5 | Confident | 161 Ų | 161 | 70.2 Ų | 70.2 | 61% | 0.608 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -66.3 | -40.9 | 172.7 | -75.9 | 172.4 | -168.8 | -167 | 5.2 | 111.8 | D12 L13 N20 | D12-R16 WeakPolarHBondContact O-CB 3.45Å; D12-R16 WeakPolarHBondContact O-CG 3.34Å; D12-R16 PolarHBondContact O-N 3.01Å; L13-R16 PolarHBondContact O-N 2.93Å; R16-N20 PolarHBondContact O-N 2.98Å |
| 17 | L | 90.9 | Very high | 89.5 | Confident | 110 Ų | 110 | 67.7 Ų | 67.7 | 58% | 0.576 | 33% | 0.334 | S | S | * | . | H | α-helix | trans | -64.9 | -57.1 | 178 | -174.5 | 77.1 | 0 | 0 | 0 | 111.1 | L13 A14 G19 N20 F23 | L13-L17 PolarHBondContact O-N 3.4Å; A14-L17 PolarHBondContact O-N 3.04Å; L17-G19 VanDerWaalsContact C-N 3.34Å; L17-G19 PolarHBondContact O-N 3.41Å; L17-N20 VanDerWaalsContact O-CB 3.26Å; L17-N20 WeakPolarHBondContact O-CB 3.41Å; L17-N20 PolarHBondContact O-N 3.26Å; L17-F23 WeakPolarHBondContact O-CB 3.21Å |
| 18 | L | 88.8 | Confident | 89.6 | Confident | 6 Ų | 6 | 67.6 Ų | 67.6 | 3% | 0.031 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -67.3 | -33.8 | -178.9 | -98.6 | 56.3 | 0 | 0 | 0 | 112.8 | A14 N20 F23 T181 S182 F202 V206 | A14-L18 WeakPolarHBondContact O-CB 3.19Å; A14-L18 PolarHBondContact O-N 3.27Å; L18-N20 PolarHBondContact O-N 2.76Å; L18-F23 HydrophobicContact CB-CD1 4.48Å; L18-F23 HydrophobicContact CB-CE1 4.39Å; L18-F23 HydrophobicContact CD1-CE1 3.92Å; L18-F23 HydrophobicContact CD1-CE2 4.44Å; L18-F23 HydrophobicContact CD1-CZ 3.88Å; L18-F23 HydrophobicContact CG-CD1 4.31Å; L18-F23 HydrophobicContact CG-CE1 3.75Å; L18-F23 HydrophobicContact CG-CZ 4.2Å; L18-T181 VanDerWaalsContact CD2-OG1 3.28Å; L18-T181 WeakPolarHBondContact CD2-OG1 3.38Å; L18-S182 WeakPolarHBondContact O-CB 3.44Å; L18-F202 HydrophobicContact CD2-CE2 4.21Å; L18-F202 HydrophobicContact CD2-CZ 4.11Å; L18-V206 HydrophobicContact CD2-CG2 3.82Å |
| 19 | G | 84.9 | Confident | 89.7 | Confident | 15 Ų | 15 | 69.2 Ų | 69.2 | 16% | 0.155 | 34% | 0.339 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -77.5 | -4.4 | 177 | 0 | 0 | 0 | 0 | 0 | 114.2 | A15 L17 | A15-G19 WeakPolarHBondContact O-CA 3.11Å; A15-G19 PolarHBondContact O-N 3.31Å; L17-G19 VanDerWaalsContact C-N 3.34Å; L17-G19 PolarHBondContact O-N 3.41Å |
| 20 | N | 88.9 | Confident | 89.7 | Confident | 70 Ų | 70 | 69.4 Ų | 69.4 | 37% | 0.374 | 34% | 0.336 | S | S | . | . | trans | -67 | 133.4 | 176.4 | -170.3 | -6.9 | 0 | 0 | 0 | 110.2 | R16 L17 L18 L22 F23 R24 | R16-N20 PolarHBondContact O-N 2.98Å; L17-N20 VanDerWaalsContact O-CB 3.26Å; L17-N20 WeakPolarHBondContact O-CB 3.41Å; L17-N20 PolarHBondContact O-N 3.26Å; L18-N20 PolarHBondContact O-N 2.76Å; N20-L22 PolarHBondContact O-N 3.42Å; N20-L22 PolarHBondContact OD1-N 3.49Å; N20-F23 HydrophobicContact CB-CB 4.25Å; N20-F23 PolarHBondContact O-N 3.09Å; N20-F23 VanDerWaalsContact O-N 3.15Å; N20-R24 PolarHBondContact O-N 2.92Å | ||
| 21 | K | 85.1 | Confident | 89.8 | Confident | 149 Ų | 149 | 65.2 Ų | 65.2 | 65% | 0.648 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -55.9 | -38.5 | 176.8 | -67.9 | -177.6 | -177.6 | 177.6 | 0 | 111.6 | R24 Q25 | K21-R24 PolarHBondContact O-N 2.9Å; K21-Q25 WeakPolarHBondContact O-CB 3.4Å; K21-Q25 WeakPolarHBondContact O-CG 3.1Å; K21-Q25 PolarHBondContact O-N 3.15Å |
| 22 | L | 87 | Confident | 89.8 | Confident | 105 Ų | 105 | 67.4 Ų | 67.4 | 55% | 0.55 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -62.9 | -47.5 | 178.4 | -67.9 | -179.4 | 0 | 0 | 0 | 111.5 | N20 Q25 H26 | N20-L22 PolarHBondContact O-N 3.42Å; N20-L22 PolarHBondContact OD1-N 3.49Å; L22-Q25 PolarHBondContact O-N 3.28Å; L22-H26 WeakPolarHBondContact O-CB 3.42Å; L22-H26 PolarHBondContact O-N 3.22Å; L22-H26 PolarHBondContact O-ND1 3.4Å |
| 23 | F | 88.4 | Confident | 90 | Very high | 44 Ų | 44 | 67.2 Ų | 67.2 | 19% | 0.193 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -59 | -52.8 | 177.3 | -178.7 | -93.5 | 0 | 0 | 0 | 110.5 | L17 L18 N20 Q25 H26 F27 A178 | L17-F23 WeakPolarHBondContact O-CB 3.21Å; L18-F23 HydrophobicContact CB-CD1 4.48Å; L18-F23 HydrophobicContact CB-CE1 4.39Å; L18-F23 HydrophobicContact CD1-CE1 3.92Å; L18-F23 HydrophobicContact CD1-CE2 4.44Å; L18-F23 HydrophobicContact CD1-CZ 3.88Å; L18-F23 HydrophobicContact CG-CD1 4.31Å; L18-F23 HydrophobicContact CG-CE1 3.75Å; L18-F23 HydrophobicContact CG-CZ 4.2Å; N20-F23 HydrophobicContact CB-CB 4.25Å; N20-F23 PolarHBondContact O-N 3.09Å; N20-F23 VanDerWaalsContact O-N 3.15Å; F23-Q25 VanDerWaalsContact C-N 3.27Å; F23-Q25 PolarHBondContact O-N 2.82Å; F23-H26 PolarHBondContact O-N 3.32Å; F23-F27 HydrophobicContact CE1-CB 4.49Å; F23-F27 HydrophobicContact CE1-CD2 4.17Å; F23-F27 HydrophobicContact CE1-CG 4.37Å; F23-F27 AromaticContact CE2-CD2 3.71Å; F23-F27 HydrophobicContact CE2-CD2 3.71Å; F23-F27 HydrophobicContact CE2-CE2 4.3Å; F23-F27 AromaticContact CZ-CD2 3.47Å; F23-F27 HydrophobicContact CZ-CD2 3.47Å; F23-F27 VanDerWaalsContact CZ-CD2 3.47Å; F23-F27 AromaticContact CZ-CE2 3.92Å; F23-F27 HydrophobicContact CZ-CE2 3.92Å; F23-F27 HydrophobicContact CZ-CG 4.11Å; F23-F27 WeakPolarHBondContact O-CB 3.4Å; F23-F27 PolarHBondContact O-N 3.38Å; F23-A178 HydrophobicContact CE1-CB 4.21Å |
| 24 | R | 84.7 | Confident | 90 | Very high | 106 Ų | 106 | 63 Ų | 63 | 40% | 0.4 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -58 | -38.1 | -179.9 | -168.6 | 177.1 | 67.7 | -166.5 | 3.3 | 113.1 | N20 K21 | N20-R24 PolarHBondContact O-N 2.92Å; K21-R24 PolarHBondContact O-N 2.9Å |
| 25 | Q | 86.1 | Confident | 90.1 | Very high | 113 Ų | 113 | 62.6 Ų | 62.6 | 53% | 0.528 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -77 | -40.3 | 179.4 | -75.4 | 176.2 | -24.4 | 0 | 0 | 113 | K21 L22 F23 H28 | K21-Q25 WeakPolarHBondContact O-CB 3.4Å; K21-Q25 WeakPolarHBondContact O-CG 3.1Å; K21-Q25 PolarHBondContact O-N 3.15Å; L22-Q25 PolarHBondContact O-N 3.28Å; F23-Q25 VanDerWaalsContact C-N 3.27Å; F23-Q25 PolarHBondContact O-N 2.82Å; Q25-H28 PolarHBondContact O-CE1 3.21Å; Q25-H28 PolarHBondContact O-ND1 3.48Å |
| 26 | H | 90.4 | Very high | 90.1 | Very high | 91 Ų | 91 | 66.3 Ų | 66.3 | 42% | 0.421 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -101.4 | -5.5 | -169 | -59.6 | 80.1 | 0 | 0 | 0 | 113.9 | L22 F23 H28 L29 L30 | L22-H26 WeakPolarHBondContact O-CB 3.42Å; L22-H26 PolarHBondContact O-N 3.22Å; L22-H26 PolarHBondContact O-ND1 3.4Å; F23-H26 PolarHBondContact O-N 3.32Å; H26-H28 VanDerWaalsContact C-N 3.25Å; H26-H28 PolarHBondContact O-N 2.91Å; H26-L29 WeakPolarHBondContact O-CA 3.45Å; H26-L29 WeakPolarHBondContact O-CB 2.87Å; H26-L29 PolarHBondContact O-N 3.42Å; H26-L30 PolarHBondContact O-N 3.16Å |
| 27 | F | 91.8 | Very high | 90.2 | Very high | 12 Ų | 12 | 65.6 Ų | 65.6 | 5% | 0.053 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -57.8 | -37.2 | -179.5 | -177.7 | -106.6 | 0 | 0 | 0 | 113 | F23 L29 L30 L31 C174 L175 A178 L209 I213 | F23-F27 HydrophobicContact CE1-CB 4.49Å; F23-F27 HydrophobicContact CE1-CD2 4.17Å; F23-F27 HydrophobicContact CE1-CG 4.37Å; F23-F27 AromaticContact CE2-CD2 3.71Å; F23-F27 HydrophobicContact CE2-CD2 3.71Å; F23-F27 HydrophobicContact CE2-CE2 4.3Å; F23-F27 AromaticContact CZ-CD2 3.47Å; F23-F27 HydrophobicContact CZ-CD2 3.47Å; F23-F27 VanDerWaalsContact CZ-CD2 3.47Å; F23-F27 AromaticContact CZ-CE2 3.92Å; F23-F27 HydrophobicContact CZ-CE2 3.92Å; F23-F27 HydrophobicContact CZ-CG 4.11Å; F23-F27 WeakPolarHBondContact O-CB 3.4Å; F23-F27 PolarHBondContact O-N 3.38Å; F27-L29 VanDerWaalsContact C-N 3.31Å; F27-L29 PolarHBondContact O-N 3.29Å; F27-L30 HydrophobicContact CD2-CD2 4.21Å; F27-L30 HydrophobicContact CE2-CD2 4.34Å; F27-L30 WeakPolarHBondContact O-CB 3.29Å; F27-L30 PolarHBondContact O-N 2.93Å; F27-L31 PolarHBondContact O-N 3.48Å; F27-C174 HydrophobicContact CE1-CB 4.2Å; F27-C174 HydrophobicContact CZ-CB 4.21Å; F27-L175 HydrophobicContact CD1-CD2 3.86Å; F27-L175 HydrophobicContact CE1-CD2 4.07Å; F27-A178 HydrophobicContact CD1-CB 3.51Å; F27-A178 HydrophobicContact CE1-CB 3.55Å; F27-A178 HydrophobicContact CG-CB 4.11Å; F27-A178 HydrophobicContact CZ-CB 4.16Å; F27-L209 HydrophobicContact CZ-CD1 3.97Å; F27-I213 HydrophobicContact CE2-CD1 4.09Å; F27-I213 HydrophobicContact CZ-CD1 4.18Å |
| 28 | H | 92.1 | Very high | 90.1 | Very high | 23 Ų | 23 | 60.6 Ų | 60.6 | 11% | 0.106 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -65.3 | -33.3 | 175.1 | 73.2 | -84 | 0 | 0 | 0 | 112.9 | Q25 H26 L31 S32 L175 W240 R241 | Q25-H28 PolarHBondContact O-CE1 3.21Å; Q25-H28 PolarHBondContact O-ND1 3.48Å; H26-H28 VanDerWaalsContact C-N 3.25Å; H26-H28 PolarHBondContact O-N 2.91Å; H28-L31 PolarHBondContact O-N 3.17Å; H28-S32 PolarHBondContact O-N 3Å; H28-S32 PolarHBondContact O-OG 2.89Å; H28-L175 HydrophobicContact CB-CD2 3.92Å; H28-W240 HydrophobicContact CB-CE3 4.39Å; H28-W240 HydrophobicContact CB-CH2 4.02Å; H28-W240 HydrophobicContact CB-CZ3 3.72Å; H28-W240 AromaticContact CG-CZ3 3.87Å; H28-W240 AromaticContact ND1-CH2 3.94Å; H28-R241 PolarHBondContact CD2-NH2 3.48Å; H28-R241 PolarHBondContact NE2-NH2 3Å; H28-R241 VanDerWaalsContact NE2-NH2 3.14Å |
| 29 | L | 92.3 | Very high | 90.2 | Very high | 89 Ų | 89 | 60.5 Ų | 60.5 | 47% | 0.466 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -70.7 | -38.5 | 175 | -62.7 | 173.8 | 0 | 0 | 0 | 111.2 | H26 F27 L31 S32 A33 | H26-L29 WeakPolarHBondContact O-CA 3.45Å; H26-L29 WeakPolarHBondContact O-CB 2.87Å; H26-L29 PolarHBondContact O-N 3.42Å; F27-L29 VanDerWaalsContact C-N 3.31Å; F27-L29 PolarHBondContact O-N 3.29Å; L29-L31 VanDerWaalsContact C-N 3.3Å; L29-L31 PolarHBondContact O-N 3.04Å; L29-S32 PolarHBondContact O-N 3.35Å; L29-A33 WeakPolarHBondContact O-CB 3.34Å; L29-A33 PolarHBondContact O-N 3.3Å |
| 30 | L | 92.1 | Very high | 90.4 | Very high | 96 Ų | 96 | 62.4 Ų | 62.4 | 50% | 0.503 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -57.9 | -46.2 | 171.6 | 177.5 | 69.6 | 0 | 0 | 0 | 110.4 | H26 F27 A33 V34 | H26-L30 PolarHBondContact O-N 3.16Å; F27-L30 HydrophobicContact CD2-CD2 4.21Å; F27-L30 HydrophobicContact CE2-CD2 4.34Å; F27-L30 WeakPolarHBondContact O-CB 3.29Å; F27-L30 PolarHBondContact O-N 2.93Å; L30-A33 PolarHBondContact O-N 2.77Å; L30-V34 WeakPolarHBondContact O-CG2 3.35Å; L30-V34 PolarHBondContact O-N 3.4Å |
| 31 | L | 93.4 | Very high | 90.3 | Very high | 5 Ų | 5 | 62.6 Ų | 62.6 | 3% | 0.026 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -64.6 | -41.8 | 178.5 | -166.9 | 66.6 | 0 | 0 | 0 | 112 | F27 H28 L29 V34 L35 C171 L175 L216 | F27-L31 PolarHBondContact O-N 3.48Å; H28-L31 PolarHBondContact O-N 3.17Å; L29-L31 VanDerWaalsContact C-N 3.3Å; L29-L31 PolarHBondContact O-N 3.04Å; L31-V34 PolarHBondContact O-N 2.76Å; L31-L35 WeakPolarHBondContact O-CG 3.4Å; L31-L35 PolarHBondContact O-N 3.04Å; L31-C171 HydrophobicContact CD2-CB 3.85Å; L31-L175 HydrophobicContact CD2-CD1 4.04Å; L31-L175 HydrophobicContact CD2-CD2 4.01Å; L31-L175 HydrophobicContact CD2-CG 3.76Å; L31-L216 HydrophobicContact CD1-CD2 3.43Å; L31-L216 VanDerWaalsContact CD1-CD2 3.43Å |
| 32 | S | 93.2 | Very high | 90.4 | Very high | 46 Ų | 46 | 57.1 Ų | 57.1 | 32% | 0.322 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -61.7 | -42 | 173.3 | -58.9 | 0 | 0 | 0 | 0 | 112.3 | H28 L29 L35 V36 | H28-S32 PolarHBondContact O-N 3Å; H28-S32 PolarHBondContact O-OG 2.89Å; L29-S32 PolarHBondContact O-N 3.35Å; S32-L35 PolarHBondContact O-N 3.26Å; S32-V36 WeakPolarHBondContact O-CG2 3.45Å; S32-V36 PolarHBondContact O-N 2.96Å |
| 33 | A | 93.6 | Very high | 90.4 | Very high | 40 Ų | 40 | 59.1 Ų | 59.1 | 33% | 0.331 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -62.6 | -43.5 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | L29 L30 L35 V36 F37 | L29-A33 WeakPolarHBondContact O-CB 3.34Å; L29-A33 PolarHBondContact O-N 3.3Å; L30-A33 PolarHBondContact O-N 2.77Å; A33-L35 VanDerWaalsContact C-N 3.31Å; A33-L35 PolarHBondContact O-N 2.89Å; A33-V36 PolarHBondContact O-N 2.88Å; A33-F37 HydrophobicContact CB-CD2 4.17Å; A33-F37 HydrophobicContact CB-CE2 4.41Å; A33-F37 WeakPolarHBondContact O-CB 3.28Å; A33-F37 WeakPolarHBondContact O-CD2 3.34Å; A33-F37 PolarHBondContact O-N 3.3Å |
| 34 | V | 93.5 | Very high | 90.2 | Very high | 27 Ų | 27 | 68 Ų | 68 | 16% | 0.164 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -59 | -41.7 | 174.5 | 167.9 | 0 | 0 | 0 | 0 | 111.4 | L30 L31 G38 L216 L217 L220 | L30-V34 WeakPolarHBondContact O-CG2 3.35Å; L30-V34 PolarHBondContact O-N 3.4Å; L31-V34 PolarHBondContact O-N 2.76Å; V34-G38 WeakPolarHBondContact O-CA 3.38Å; V34-G38 PolarHBondContact O-N 2.85Å; V34-L216 HydrophobicContact CG1-CD2 4.18Å; V34-L216 HydrophobicContact CG1-CG 4.47Å; V34-L217 HydrophobicContact CG1-CD2 3.69Å; V34-L217 HydrophobicContact CG1-CG 4.22Å; V34-L220 HydrophobicContact CG1-CD1 3.92Å; V34-L220 WeakPolarHBondContact O-CD1 3.41Å |
| 35 | L | 93.6 | Very high | 90.2 | Very high | 5 Ų | 5 | 65 Ų | 65 | 3% | 0.026 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -66.5 | -39.1 | 178.3 | -72.4 | 164.5 | 0 | 0 | 0 | 113.3 | L31 S32 A33 P39 V167 L216 L220 L230 | L31-L35 WeakPolarHBondContact O-CG 3.4Å; L31-L35 PolarHBondContact O-N 3.04Å; S32-L35 PolarHBondContact O-N 3.26Å; A33-L35 VanDerWaalsContact C-N 3.31Å; A33-L35 PolarHBondContact O-N 2.89Å; L35-P39 WeakPolarHBondContact O-CD 3.41Å; L35-V167 HydrophobicContact CD2-CG1 3.46Å; L35-V167 VanDerWaalsContact CD2-CG1 3.46Å; L35-L216 HydrophobicContact CD2-CD1 4.17Å; L35-L220 HydrophobicContact CD2-CD1 4.29Å; L35-L220 HydrophobicContact CD2-CD2 4.34Å; L35-L230 HydrophobicContact CB-CD1 4.43Å |
| 36 | V | 92.4 | Very high | 89.8 | Confident | 79 Ų | 79 | 62.9 Ų | 62.9 | 48% | 0.479 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -76.5 | -45.9 | -178.4 | 173.1 | 0 | 0 | 0 | 0 | 111.4 | S32 A33 L230 | S32-V36 WeakPolarHBondContact O-CG2 3.45Å; S32-V36 PolarHBondContact O-N 2.96Å; A33-V36 PolarHBondContact O-N 2.88Å; V36-L230 HydrophobicContact CG2-CD1 4.19Å |
| 37 | F | 91.4 | Very high | 88.9 | Confident | 147 Ų | 147 | 65.4 Ų | 65.4 | 65% | 0.645 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -92.8 | -21.5 | -174.7 | -62.2 | -67.3 | 0 | 0 | 0 | 113.6 | A33 P39 A40 | A33-F37 HydrophobicContact CB-CD2 4.17Å; A33-F37 HydrophobicContact CB-CE2 4.41Å; A33-F37 WeakPolarHBondContact O-CB 3.28Å; A33-F37 WeakPolarHBondContact O-CD2 3.34Å; A33-F37 PolarHBondContact O-N 3.3Å; F37-P39 VanDerWaalsContact C-N 3.33Å; F37-A40 VanDerWaalsContact O-CB 3.23Å; F37-A40 WeakPolarHBondContact O-CB 3.37Å; F37-A40 PolarHBondContact O-N 3.35Å |
| 38 | G | 89 | Confident | 87.8 | Confident | 4 Ų | 4 | 73.5 Ų | 73.5 | 4% | 0.041 | 39% | 0.386 | C | S | . | . | G | 310 helix | trans | -54.2 | -43.2 | -175.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | V34 A40 L41 | V34-G38 WeakPolarHBondContact O-CA 3.38Å; V34-G38 PolarHBondContact O-N 2.85Å; G38-A40 PolarHBondContact O-N 3.29Å; G38-L41 WeakPolarHBondContact O-CB 3.33Å; G38-L41 WeakPolarHBondContact O-CG 3.31Å; G38-L41 PolarHBondContact O-N 3.48Å |
| 39 | P | 90 | Very high | 87 | Confident | 4 Ų | 4 | 74.2 Ų | 74.2 | 3% | 0.026 | 39% | 0.394 | C | S | . | . | G | 310 helix | trans | -67.3 | -17.4 | 177.5 | -34.1 | 46.2 | 0 | 0 | 0 | 115.6 | L35 F37 L41 S42 L220 P224 F226 | L35-P39 WeakPolarHBondContact O-CD 3.41Å; F37-P39 VanDerWaalsContact C-N 3.33Å; P39-L41 PolarHBondContact O-N 3.26Å; P39-S42 VanDerWaalsContact O-CB 3.23Å; P39-S42 WeakPolarHBondContact O-CB 3.36Å; P39-S42 PolarHBondContact O-N 2.95Å; P39-S42 PolarHBondContact O-OG 3.49Å; P39-L220 WeakPolarHBondContact CA-O 3.45Å; P39-L220 HydrophobicContact CG-CB 4.02Å; P39-L220 HydrophobicContact CG-CD2 3.93Å; P39-L220 HydrophobicContact CG-CG 4.5Å; P39-P224 HydrophobicContact CB-CB 4.01Å; P39-F226 HydrophobicContact CB-CD2 4.11Å; P39-F226 HydrophobicContact CB-CE1 4.37Å; P39-F226 HydrophobicContact CB-CE2 3.04Å; P39-F226 HydrophobicContact CB-CZ 3.24Å; P39-F226 HydrophobicContact CG-CD2 4.4Å; P39-F226 HydrophobicContact CG-CE1 3.87Å; P39-F226 HydrophobicContact CG-CE2 3.45Å; P39-F226 VanDerWaalsContact CG-CE2 3.45Å; P39-F226 HydrophobicContact CG-CZ 3.13Å |
| 40 | A | 89.3 | Confident | 86 | Confident | 56 Ų | 56 | 75.7 Ų | 75.7 | 46% | 0.463 | 40% | 0.401 | S | S | . | . | G | 310 helix | trans | -64.4 | -22.2 | 169.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | F37 G38 S42 L43 | F37-A40 VanDerWaalsContact O-CB 3.23Å; F37-A40 WeakPolarHBondContact O-CB 3.37Å; F37-A40 PolarHBondContact O-N 3.35Å; G38-A40 PolarHBondContact O-N 3.29Å; A40-S42 PolarHBondContact O-N 3.12Å; A40-L43 PolarHBondContact O-N 3.26Å |
| 41 | L | 87.1 | Confident | 84.9 | Confident | 73 Ų | 73 | 75 Ų | 75 | 38% | 0.382 | 39% | 0.394 | S | S | . | . | G | 310 helix | trans | -64.1 | -21.8 | 172.7 | -58.9 | 172 | 0 | 0 | 0 | 112.3 | G38 P39 L43 W44 V45 L217 A221 | G38-L41 WeakPolarHBondContact O-CB 3.33Å; G38-L41 WeakPolarHBondContact O-CG 3.31Å; G38-L41 PolarHBondContact O-N 3.48Å; P39-L41 PolarHBondContact O-N 3.26Å; L41-L43 PolarHBondContact O-N 2.94Å; L41-L43 VanDerWaalsContact O-N 3.16Å; L41-W44 PolarHBondContact O-N 3.44Å; L41-V45 VanDerWaalsContact O-CG2 3.32Å; L41-V45 WeakPolarHBondContact O-CG2 3.34Å; L41-V45 PolarHBondContact O-N 3.08Å; L41-V45 VanDerWaalsContact O-N 3.16Å; L41-L217 HydrophobicContact CD1-CD2 4.04Å; L41-A221 HydrophobicContact CB-CB 3.9Å |
| 42 | S | 86.7 | Confident | 83.6 | Confident | 35 Ų | 35 | 75.9 Ų | 75.9 | 25% | 0.245 | 40% | 0.402 | C | S | . | . | G | 310 helix | trans | -58.5 | -27.2 | 176.1 | 66.9 | 0 | 0 | 0 | 0 | 112.9 | P39 A40 W44 A221 | P39-S42 VanDerWaalsContact O-CB 3.23Å; P39-S42 WeakPolarHBondContact O-CB 3.36Å; P39-S42 PolarHBondContact O-N 2.95Å; P39-S42 PolarHBondContact O-OG 3.49Å; A40-S42 PolarHBondContact O-N 3.12Å; S42-W44 PolarHBondContact O-N 3.05Å; S42-A221 VanDerWaalsContact CA-O 3.3Å; S42-A221 WeakPolarHBondContact CA-O 3.47Å; S42-A221 WeakPolarHBondContact CB-O 3.26Å |
| 43 | L | 86.8 | Confident | 82.7 | Confident | 147 Ų | 147 | 80.4 Ų | 80.4 | 77% | 0.77 | 42% | 0.416 | S | S | * | . | G | 310 helix | trans | -70.3 | -20.9 | 177.4 | -60 | 176.1 | 0 | 0 | 0 | 113.4 | A40 L41 | A40-L43 PolarHBondContact O-N 3.26Å; L41-L43 PolarHBondContact O-N 2.94Å; L41-L43 VanDerWaalsContact O-N 3.16Å |
| 44 | W | 85.8 | Confident | 81.4 | Confident | 231 Ų | 231 | 84.1 Ų | 84.1 | 88% | 0.875 | 42% | 0.422 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -109.7 | -18.6 | -173.1 | -65 | 82.3 | 0 | 0 | 0 | 113 | L41 S42 | L41-W44 PolarHBondContact O-N 3.44Å; S42-W44 PolarHBondContact O-N 3.05Å |
| 45 | V | 83.7 | Confident | 80.1 | Confident | 42 Ų | 42 | 85.3 Ų | 85.3 | 26% | 0.255 | 43% | 0.431 | S | S | . | . | S | Bend | trans | -88.6 | 128.7 | -171.9 | 169.4 | 0 | 0 | 0 | 0 | 111 | L41 H47 A221 Y222 | L41-V45 VanDerWaalsContact O-CG2 3.32Å; L41-V45 WeakPolarHBondContact O-CG2 3.34Å; L41-V45 PolarHBondContact O-N 3.08Å; L41-V45 VanDerWaalsContact O-N 3.16Å; V45-H47 PolarHBondContact O-N 3.02Å; V45-A221 HydrophobicContact CG2-CB 4.2Å; V45-Y222 HydrophobicContact CG1-CD1 3.71Å; V45-Y222 HydrophobicContact CG1-CE1 3.11Å; V45-Y222 HydrophobicContact CG1-CE2 4Å; V45-Y222 HydrophobicContact CG1-CG 4.39Å; V45-Y222 WeakPolarHBondContact CG1-OH 3.47Å |
| 46 | S | 78.5 | Confident | 79.4 | Confident | 69 Ų | 69 | 87.9 Ų | 87.9 | 48% | 0.483 | 44% | 0.443 | S | S | . | . | trans | -72.7 | 127.2 | 177.3 | 177.7 | 0 | 0 | 0 | 0 | 111.9 | H48 S49 | S46-H48 PolarHBondContact O-N 2.67Å; S46-H48 VanDerWaalsContact O-N 3.11Å; S46-H48 PolarHBondContact OG-N 3.45Å; S46-S49 WeakPolarHBondContact O-CB 3.19Å; S46-S49 PolarHBondContact O-N 2.03Å | ||
| 47 | H | 70.5 | Confident | 78.3 | Confident | 144 Ų | 144 | 90.9 Ų | 90.9 | 67% | 0.667 | 45% | 0.45 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.1 | -7.5 | 174.5 | -68.4 | -78.1 | 0 | 0 | 0 | 114.5 | V45 S49 A52 | V45-H47 PolarHBondContact O-N 3.02Å; H47-S49 VanDerWaalsContact C-N 3.33Å; H47-A52 WeakPolarHBondContact O-CB 3.4Å |
| 48 | H | 69 | Low | 77.2 | Confident | 181 Ų | 181 | 88.3 Ų | 88.3 | 84% | 0.838 | 44% | 0.442 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.9 | -1.3 | 178 | -62.4 | 87.7 | 0 | 0 | 0 | 113.6 | S46 | S46-H48 PolarHBondContact O-N 2.67Å; S46-H48 VanDerWaalsContact O-N 3.11Å; S46-H48 PolarHBondContact OG-N 3.45Å |
| 49 | S | 74.8 | Confident | 76.5 | Confident | 39 Ų | 39 | 89 Ų | 89 | 27% | 0.273 | 44% | 0.443 | S | S | . | . | S | Bend | trans | -67.3 | 147.8 | 176.3 | 175.4 | 0 | 0 | 0 | 0 | 111.9 | S46 H47 F51 A52 Y222 | S46-S49 WeakPolarHBondContact O-CB 3.19Å; S46-S49 PolarHBondContact O-N 2.03Å; H47-S49 VanDerWaalsContact C-N 3.33Å; S49-F51 PolarHBondContact O-N 2.88Å; S49-F51 PolarHBondContact OG-N 2.91Å; S49-A52 VanDerWaalsContact O-CB 3.31Å; S49-A52 WeakPolarHBondContact O-CB 3.4Å; S49-A52 PolarHBondContact O-N 3.31Å; S49-Y222 WeakPolarHBondContact CB-OH 3.25Å; S49-Y222 PolarHBondContact OG-OH 3.24Å |
| 50 | I | 72.3 | Confident | 75.9 | Confident | 120 Ų | 120 | 95.4 Ų | 95.4 | 62% | 0.615 | 47% | 0.467 | S | S | * | . | G | 310 helix | trans | -52.8 | -30.4 | 175.9 | -60.9 | 170.7 | 0 | 0 | 0 | 111.4 | ||
| 51 | F | 68 | Low | 75.5 | Confident | 82 Ų | 82 | 96.7 Ų | 96.7 | 36% | 0.36 | 47% | 0.466 | S | S | . | . | G | 310 helix | trans | -81.7 | -13.2 | -179.2 | -61.5 | -73.7 | 0 | 0 | 0 | 114.7 | S49 K53 F214 Y222 | S49-F51 PolarHBondContact O-N 2.88Å; S49-F51 PolarHBondContact OG-N 2.91Å; F51-K53 PolarHBondContact O-N 3.42Å; F51-F214 HydrophobicContact CE1-CE1 4.4Å; F51-F214 HydrophobicContact CZ-CE1 4.42Å; F51-F214 HydrophobicContact CZ-CZ 4.32Å; F51-Y222 HydrophobicContact CB-CD2 4.05Å; F51-Y222 HydrophobicContact CB-CE1 4.49Å; F51-Y222 HydrophobicContact CB-CE2 3.57Å |
| 52 | A | 67.1 | Low | 75.1 | Confident | 23 Ų | 23 | 96.5 Ų | 96.5 | 19% | 0.19 | 46% | 0.462 | C | S | . | . | G | 310 helix | trans | -71.4 | -18.1 | 177 | 0 | 0 | 0 | 0 | 0 | 112.6 | H47 S49 R54 Y222 F223 | H47-A52 WeakPolarHBondContact O-CB 3.4Å; S49-A52 VanDerWaalsContact O-CB 3.31Å; S49-A52 WeakPolarHBondContact O-CB 3.4Å; S49-A52 PolarHBondContact O-N 3.31Å; A52-R54 PolarHBondContact O-N 2.92Å; A52-Y222 VanDerWaalsContact CA-CD1 3.47Å; A52-Y222 HydrophobicContact CB-CD1 3.61Å; A52-Y222 HydrophobicContact CB-CE1 3.81Å; A52-F223 WeakPolarHBondContact O-CZ 3.29Å |
| 53 | K | 74.1 | Confident | 74.8 | Confident | 141 Ų | 141 | 95.3 Ų | 95.3 | 61% | 0.613 | 45% | 0.453 | S | S | * | . | trans | -85.5 | 103.8 | 178.5 | -161.2 | 175.6 | -171.1 | 174.7 | 0 | 110.4 | F51 S55 H56 | F51-K53 PolarHBondContact O-N 3.42Å; K53-S55 VanDerWaalsContact CE-OG 3.25Å; K53-S55 WeakPolarHBondContact CE-OG 3.4Å; K53-S55 WeakPolarHBondContact CG-OG 3.3Å; K53-S55 PolarHBondContact O-N 3.02Å; K53-H56 WeakPolarHBondContact O-CB 3.44Å; K53-H56 PolarHBondContact O-N 3.25Å | ||
| 54 | R | 66.7 | Low | 74.6 | Confident | 118 Ų | 118 | 99 Ų | 99 | 45% | 0.445 | 46% | 0.457 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.4 | -24.5 | 177.9 | -161.8 | 170.5 | 177.8 | 148.9 | 0.1 | 113.3 | A52 H56 Y59 F223 | A52-R54 PolarHBondContact O-N 2.92Å; R54-H56 VanDerWaalsContact C-N 3.26Å; R54-H56 PolarHBondContact O-N 3.44Å; R54-Y59 HydrophobicContact CG-CE1 4.5Å; R54-F223 HydrophobicContact CB-CD1 4.49Å; R54-F223 HydrophobicContact CB-CE1 3.62Å; R54-F223 HydrophobicContact CB-CE2 4.28Å; R54-F223 HydrophobicContact CB-CZ 3.5Å; R54-F223 HydrophobicContact CG-CE1 4.13Å; R54-F223 HydrophobicContact CG-CE2 4.35Å; R54-F223 HydrophobicContact CG-CZ 4.01Å |
| 55 | S | 66.3 | Low | 74.7 | Confident | 51 Ų | 51 | 90.1 Ų | 90.1 | 36% | 0.357 | 43% | 0.429 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80.1 | 0.1 | 179.1 | 82.1 | 0 | 0 | 0 | 0 | 114.3 | K53 F57 R60 | K53-S55 VanDerWaalsContact CE-OG 3.25Å; K53-S55 WeakPolarHBondContact CE-OG 3.4Å; K53-S55 WeakPolarHBondContact CG-OG 3.3Å; K53-S55 PolarHBondContact O-N 3.02Å; S55-F57 PolarHBondContact O-N 2.89Å; S55-R60 VanDerWaalsContact CA-CZ 3.49Å; S55-R60 PolarHBondContact O-NH2 2.85Å |
| 56 | H | 77.4 | Confident | 74.9 | Confident | 60 Ų | 60 | 88.2 Ų | 88.2 | 28% | 0.278 | 42% | 0.418 | S | S | . | . | trans | -61.7 | 127.1 | -178.3 | -162.2 | -100.9 | 0 | 0 | 0 | 110.5 | K53 R54 L58 Y59 R60 | K53-H56 WeakPolarHBondContact O-CB 3.44Å; K53-H56 PolarHBondContact O-N 3.25Å; R54-H56 VanDerWaalsContact C-N 3.26Å; R54-H56 PolarHBondContact O-N 3.44Å; H56-L58 PolarHBondContact O-N 2.9Å; H56-Y59 PolarHBondContact O-N 3.41Å; H56-R60 PolarHBondContact O-N 3.26Å | ||
| 57 | F | 70.7 | Confident | 75.6 | Confident | 142 Ų | 142 | 86.8 Ų | 86.8 | 62% | 0.623 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -61 | -44.9 | -171.3 | 174.8 | -102.1 | 0 | 0 | 0 | 112.1 | S55 Y59 R60 L61 | S55-F57 PolarHBondContact O-N 2.89Å; F57-Y59 VanDerWaalsContact C-N 3.3Å; F57-Y59 PolarHBondContact O-N 3.28Å; F57-R60 PolarHBondContact O-N 3.05Å; F57-L61 HydrophobicContact CE1-CB 4.42Å; F57-L61 HydrophobicContact CE1-CD2 3.71Å; F57-L61 HydrophobicContact CZ-CB 4.43Å; F57-L61 HydrophobicContact CZ-CD1 4.4Å; F57-L61 HydrophobicContact CZ-CD2 3.91Å; F57-L61 HydrophobicContact CZ-CG 4.49Å; F57-L61 VanDerWaalsContact O-CB 3.29Å; F57-L61 WeakPolarHBondContact O-CB 2.97Å; F57-L61 PolarHBondContact O-N 3.37Å |
| 58 | L | 68.8 | Low | 76.7 | Confident | 93 Ų | 93 | 81.5 Ų | 81.5 | 49% | 0.487 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -60.2 | -41.4 | -179.8 | -63.2 | -179.7 | 0 | 0 | 0 | 111.9 | H56 L61 F62 | H56-L58 PolarHBondContact O-N 2.9Å; L58-L61 PolarHBondContact O-N 3.41Å; L58-F62 WeakPolarHBondContact O-CB 3.15Å; L58-F62 VanDerWaalsContact O-CD2 3.3Å; L58-F62 WeakPolarHBondContact O-CD2 3.4Å; L58-F62 PolarHBondContact O-N 3.34Å |
| 59 | Y | 73.7 | Confident | 77.9 | Confident | 17 Ų | 17 | 77.6 Ų | 77.6 | 7% | 0.067 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -62.8 | -48.3 | 179.2 | 176.2 | -99.5 | 0 | 0 | 0 | 111.3 | R54 H56 F57 L63 L215 L219 F223 | R54-Y59 HydrophobicContact CG-CE1 4.5Å; H56-Y59 PolarHBondContact O-N 3.41Å; F57-Y59 VanDerWaalsContact C-N 3.3Å; F57-Y59 PolarHBondContact O-N 3.28Å; Y59-L63 HydrophobicContact CD1-CD1 3.71Å; Y59-L63 HydrophobicContact CD2-CD1 3.91Å; Y59-L63 HydrophobicContact CE1-CD1 3.36Å; Y59-L63 HydrophobicContact CE2-CD1 3.6Å; Y59-L63 HydrophobicContact CE2-CG 4.47Å; Y59-L63 HydrophobicContact CG-CD1 3.99Å; Y59-L63 WeakPolarHBondContact O-CB 3.25Å; Y59-L63 WeakPolarHBondContact O-CG 3.21Å; Y59-L63 PolarHBondContact O-N 3Å; Y59-L215 HydrophobicContact CD2-CD2 4.23Å; Y59-L219 HydrophobicContact CE2-CD1 3.91Å; Y59-L219 WeakPolarHBondContact OH-CD1 3.27Å; Y59-L219 VanDerWaalsContact OH-CG 3.29Å; Y59-L219 WeakPolarHBondContact OH-CG 3.36Å; Y59-F223 HydrophobicContact CE1-CE2 4.33Å; Y59-F223 WeakPolarHBondContact OH-CD2 3.47Å |
| 60 | R | 77.4 | Confident | 78.9 | Confident | 140 Ų | 140 | 75.8 Ų | 75.8 | 53% | 0.528 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -66.7 | -39.7 | 177.6 | -73.8 | -169.9 | -74.9 | -158.5 | 3.1 | 113.2 | S55 H56 F57 R64 | S55-R60 VanDerWaalsContact CA-CZ 3.49Å; S55-R60 PolarHBondContact O-NH2 2.85Å; H56-R60 PolarHBondContact O-N 3.26Å; F57-R60 PolarHBondContact O-N 3.05Å; R60-R64 VanDerWaalsContact O-CB 3.25Å; R60-R64 WeakPolarHBondContact O-CB 3.5Å; R60-R64 PolarHBondContact O-N 3.11Å; R60-R64 VanDerWaalsContact O-N 3.08Å |
| 61 | L | 79.9 | Confident | 79.9 | Confident | 83 Ų | 83 | 71.9 Ų | 71.9 | 44% | 0.435 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -65 | -47.3 | 179.6 | -176.2 | 67.7 | 0 | 0 | 0 | 111 | F57 L58 S65 | F57-L61 HydrophobicContact CE1-CB 4.42Å; F57-L61 HydrophobicContact CE1-CD2 3.71Å; F57-L61 HydrophobicContact CZ-CB 4.43Å; F57-L61 HydrophobicContact CZ-CD1 4.4Å; F57-L61 HydrophobicContact CZ-CD2 3.91Å; F57-L61 HydrophobicContact CZ-CG 4.49Å; F57-L61 VanDerWaalsContact O-CB 3.29Å; F57-L61 WeakPolarHBondContact O-CB 2.97Å; F57-L61 PolarHBondContact O-N 3.37Å; L58-L61 PolarHBondContact O-N 3.41Å; L61-S65 WeakPolarHBondContact O-CB 3.33Å; L61-S65 PolarHBondContact O-N 2.92Å |
| 62 | F | 80.1 | Confident | 81.2 | Confident | 69 Ų | 69 | 71.9 Ų | 71.9 | 30% | 0.303 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -69.9 | -40.6 | -178.9 | -87.9 | -78.6 | 0 | 0 | 0 | 112.9 | L58 G66 L211 L215 | L58-F62 WeakPolarHBondContact O-CB 3.15Å; L58-F62 VanDerWaalsContact O-CD2 3.3Å; L58-F62 WeakPolarHBondContact O-CD2 3.4Å; L58-F62 PolarHBondContact O-N 3.34Å; F62-G66 WeakPolarHBondContact O-CA 3.42Å; F62-G66 PolarHBondContact O-N 3.38Å; F62-L211 HydrophobicContact CD1-CD2 3.93Å; F62-L211 HydrophobicContact CE1-CD2 3.93Å; F62-L215 HydrophobicContact CB-CD1 4.05Å |
| 63 | L | 80.6 | Confident | 82.6 | Confident | 10 Ų | 10 | 72.9 Ų | 72.9 | 5% | 0.052 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -64 | -49.9 | 177.4 | -71.9 | 174 | 0 | 0 | 0 | 111.8 | Y59 S65 G66 L170 L215 L219 | Y59-L63 HydrophobicContact CD1-CD1 3.71Å; Y59-L63 HydrophobicContact CD2-CD1 3.91Å; Y59-L63 HydrophobicContact CE1-CD1 3.36Å; Y59-L63 HydrophobicContact CE2-CD1 3.6Å; Y59-L63 HydrophobicContact CE2-CG 4.47Å; Y59-L63 HydrophobicContact CG-CD1 3.99Å; Y59-L63 WeakPolarHBondContact O-CB 3.25Å; Y59-L63 WeakPolarHBondContact O-CG 3.21Å; Y59-L63 PolarHBondContact O-N 3Å; L63-S65 VanDerWaalsContact C-N 3.28Å; L63-S65 PolarHBondContact O-N 3.03Å; L63-G66 PolarHBondContact O-N 3.48Å; L63-G66 VanDerWaalsContact O-N 3.12Å; L63-L170 HydrophobicContact CD2-CD1 3.61Å; L63-L170 HydrophobicContact CD2-CD2 4.12Å; L63-L170 HydrophobicContact CD2-CG 4.04Å; L63-L215 HydrophobicContact CD2-CB 4.4Å; L63-L219 HydrophobicContact CD1-CD1 3.63Å; L63-L219 HydrophobicContact CD2-CD1 3.91Å; L63-L219 HydrophobicContact CG-CD1 4.45Å |
| 64 | R | 82.3 | Confident | 83.5 | Confident | 225 Ų | 225 | 66.2 Ų | 66.2 | 85% | 0.849 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -69 | -28.5 | -177.7 | -165.1 | 170 | -175.4 | 165.9 | 2.5 | 112.9 | R60 G66 | R60-R64 VanDerWaalsContact O-CB 3.25Å; R60-R64 WeakPolarHBondContact O-CB 3.5Å; R60-R64 PolarHBondContact O-N 3.11Å; R60-R64 VanDerWaalsContact O-N 3.08Å; R64-G66 VanDerWaalsContact C-N 3.35Å |
| 65 | S | 87 | Confident | 84.8 | Confident | 43 Ų | 43 | 60.8 Ų | 60.8 | 30% | 0.301 | 29% | 0.294 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -91.3 | 4.9 | 176.6 | -164.2 | 0 | 0 | 0 | 0 | 113 | L61 L63 W67 G68 W69 | L61-S65 WeakPolarHBondContact O-CB 3.33Å; L61-S65 PolarHBondContact O-N 2.92Å; L63-S65 VanDerWaalsContact C-N 3.28Å; L63-S65 PolarHBondContact O-N 3.03Å; S65-W67 VanDerWaalsContact C-N 3.31Å; S65-W67 PolarHBondContact O-N 3.03Å; S65-G68 WeakPolarHBondContact O-CA 3.44Å; S65-G68 PolarHBondContact O-N 2.99Å; S65-W69 PolarHBondContact O-N 3.48Å; S65-W69 VanDerWaalsContact O-N 3.09Å; S65-W69 PolarHBondContact OG-NE1 2.86Å; S65-W69 VanDerWaalsContact OG-NE1 3.14Å |
| 66 | G | 88.5 | Confident | 86.2 | Confident | 2 Ų | 2 | 60.9 Ų | 60.9 | 2% | 0.021 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -58 | -40.6 | -170.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | F62 L63 R64 T70 W212 | F62-G66 WeakPolarHBondContact O-CA 3.42Å; F62-G66 PolarHBondContact O-N 3.38Å; L63-G66 PolarHBondContact O-N 3.48Å; L63-G66 VanDerWaalsContact O-N 3.12Å; R64-G66 VanDerWaalsContact C-N 3.35Å; G66-T70 WeakPolarHBondContact O-CB 3.33Å; G66-T70 PolarHBondContact O-N 2.84Å; G66-T70 VanDerWaalsContact O-N 3.11Å; G66-T70 PolarHBondContact O-OG1 3.14Å; G66-W212 WeakPolarHBondContact O-CZ2 3.45Å |
| 67 | W | 93.4 | Very high | 87 | Confident | 39 Ų | 39 | 58 Ų | 58 | 15% | 0.148 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -63.6 | -42 | 174.2 | -173.5 | -111.6 | 0 | 0 | 0 | 112.7 | S65 T70 C71 L99 A102 G103 W106 L169 L176 | S65-W67 VanDerWaalsContact C-N 3.31Å; S65-W67 PolarHBondContact O-N 3.03Å; W67-T70 PolarHBondContact O-N 3.03Å; W67-C71 VanDerWaalsContact CZ2-SG 3.56Å; W67-C71 PolarHBondContact NE1-SG 3.08Å; W67-C71 WeakPolarHBondContact O-CB 3.46Å; W67-C71 PolarHBondContact O-N 3.25Å; W67-C71 PolarHBondContact O-SG 3.16Å; W67-L99 WeakPolarHBondContact CH2-O 3.5Å; W67-L99 WeakPolarHBondContact CZ2-O 3.36Å; W67-A102 HydrophobicContact CH2-CB 3.78Å; W67-A102 HydrophobicContact CZ3-CB 4.48Å; W67-G103 VanDerWaalsContact CE2-CA 3.49Å; W67-G103 VanDerWaalsContact CH2-N 3.32Å; W67-W106 HydrophobicContact CB-CE3 4.48Å; W67-W106 HydrophobicContact CB-CH2 4.4Å; W67-W106 HydrophobicContact CB-CZ3 4.11Å; W67-W106 HydrophobicContact CD2-CE3 4.36Å; W67-W106 HydrophobicContact CG-CE3 4.1Å; W67-W106 AromaticContact CG-CZ3 3.99Å; W67-W106 HydrophobicContact CG-CZ3 3.99Å; W67-L169 HydrophobicContact CB-CD1 3.99Å; W67-L169 HydrophobicContact CE3-CD1 4.1Å; W67-L176 HydrophobicContact CH2-CD1 4.11Å; W67-L176 HydrophobicContact CZ3-CD1 4.29Å |
| 68 | G | 93.6 | Very high | 88 | Confident | 34 Ų | 34 | 51.5 Ų | 51.5 | 35% | 0.351 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -63.6 | -49.7 | -178.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | S65 T70 C71 V72 | S65-G68 WeakPolarHBondContact O-CA 3.44Å; S65-G68 PolarHBondContact O-N 2.99Å; G68-T70 VanDerWaalsContact C-N 3.32Å; G68-T70 PolarHBondContact O-N 2.94Å; G68-C71 WeakPolarHBondContact O-CB 3.01Å; G68-C71 PolarHBondContact O-N 3.32Å; G68-V72 WeakPolarHBondContact O-CG2 3.35Å; G68-V72 PolarHBondContact O-N 3.39Å |
| 69 | W | 93.5 | Very high | 89 | Confident | 99 Ų | 99 | 50.5 Ų | 50.5 | 38% | 0.375 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -61.8 | -41 | 176.2 | -68 | 111.2 | 0 | 0 | 0 | 112.3 | S65 C71 V72 F73 L208 W212 | S65-W69 PolarHBondContact O-N 3.48Å; S65-W69 VanDerWaalsContact O-N 3.09Å; S65-W69 PolarHBondContact OG-NE1 2.86Å; S65-W69 VanDerWaalsContact OG-NE1 3.14Å; W69-C71 VanDerWaalsContact C-N 3.34Å; W69-C71 PolarHBondContact O-N 3Å; W69-V72 PolarHBondContact O-N 3.28Å; W69-F73 HydrophobicContact CE3-CD2 4.38Å; W69-F73 AromaticContact CE3-CE2 3.6Å; W69-F73 HydrophobicContact CE3-CE2 3.6Å; W69-F73 HydrophobicContact CE3-CZ 4.17Å; W69-F73 HydrophobicContact CZ3-CE2 4.22Å; W69-F73 HydrophobicContact CZ3-CZ 4.36Å; W69-F73 VanDerWaalsContact O-CD2 3.29Å; W69-F73 WeakPolarHBondContact O-CD2 3.04Å; W69-F73 PolarHBondContact O-N 3.05Å; W69-L208 HydrophobicContact CB-CD1 4.21Å; W69-W212 HydrophobicContact CB-CH2 4.41Å; W69-W212 HydrophobicContact CB-CZ2 4.03Å |
| 70 | T | 94.8 | Very high | 89.8 | Confident | 0 Ų | 0 | 52.8 Ų | 52.8 | 0% | 0 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -59.8 | -45.5 | 174.9 | -62.4 | 0 | 0 | 0 | 0 | 111 | G66 W67 G68 V74 C173 L176 L177 W212 | G66-T70 WeakPolarHBondContact O-CB 3.33Å; G66-T70 PolarHBondContact O-N 2.84Å; G66-T70 VanDerWaalsContact O-N 3.11Å; G66-T70 PolarHBondContact O-OG1 3.14Å; W67-T70 PolarHBondContact O-N 3.03Å; G68-T70 VanDerWaalsContact C-N 3.32Å; G68-T70 PolarHBondContact O-N 2.94Å; T70-V74 HydrophobicContact CG2-CG2 4.22Å; T70-V74 WeakPolarHBondContact O-CB 3.4Å; T70-V74 WeakPolarHBondContact O-CG2 3.42Å; T70-V74 PolarHBondContact O-N 3.43Å; T70-C173 HydrophobicContact CG2-CB 4.5Å; T70-C173 PolarHBondContact OG1-SG 3.05Å; T70-C173 VanDerWaalsContact OG1-SG 3.38Å; T70-L176 HydrophobicContact CG2-CD2 3.92Å; T70-L177 HydrophobicContact CG2-CD1 3.55Å; T70-W212 PolarHBondContact OG1-NE1 3.35Å |
| 71 | C | 94.5 | Very high | 90.3 | Very high | 39 Ų | 39 | 46.5 Ų | 46.5 | 26% | 0.264 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -62.3 | -43.8 | 176.7 | -72 | 0 | 0 | 0 | 0 | 113 | W67 G68 W69 G75 | W67-C71 VanDerWaalsContact CZ2-SG 3.56Å; W67-C71 PolarHBondContact NE1-SG 3.08Å; W67-C71 WeakPolarHBondContact O-CB 3.46Å; W67-C71 PolarHBondContact O-N 3.25Å; W67-C71 PolarHBondContact O-SG 3.16Å; G68-C71 WeakPolarHBondContact O-CB 3.01Å; G68-C71 PolarHBondContact O-N 3.32Å; W69-C71 VanDerWaalsContact C-N 3.34Å; W69-C71 PolarHBondContact O-N 3Å; C71-G75 WeakPolarHBondContact O-CA 3.28Å; C71-G75 PolarHBondContact O-N 2.93Å |
| 72 | V | 95.1 | Very high | 90.7 | Very high | 82 Ų | 82 | 42.8 Ų | 42.8 | 50% | 0.497 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -64.7 | -53.8 | -178.4 | 171 | 0 | 0 | 0 | 0 | 110.9 | G68 W69 S76 | G68-V72 WeakPolarHBondContact O-CG2 3.35Å; G68-V72 PolarHBondContact O-N 3.39Å; W69-V72 PolarHBondContact O-N 3.28Å; V72-S76 WeakPolarHBondContact O-CB 3.37Å; V72-S76 PolarHBondContact O-N 2.96Å; V72-S76 VanDerWaalsContact O-N 3.09Å; V72-S76 PolarHBondContact O-OG 3.35Å |
| 73 | F | 95.4 | Very high | 90.9 | Very high | 44 Ų | 44 | 44.5 Ų | 44.5 | 19% | 0.193 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -73.5 | -49.5 | -174.9 | -69.2 | -59.5 | 0 | 0 | 0 | 112.3 | W69 F77 L201 L204 L208 | W69-F73 HydrophobicContact CE3-CD2 4.38Å; W69-F73 AromaticContact CE3-CE2 3.6Å; W69-F73 HydrophobicContact CE3-CE2 3.6Å; W69-F73 HydrophobicContact CE3-CZ 4.17Å; W69-F73 HydrophobicContact CZ3-CE2 4.22Å; W69-F73 HydrophobicContact CZ3-CZ 4.36Å; W69-F73 VanDerWaalsContact O-CD2 3.29Å; W69-F73 WeakPolarHBondContact O-CD2 3.04Å; W69-F73 PolarHBondContact O-N 3.05Å; F73-F77 WeakPolarHBondContact O-CB 2.94Å; F73-F77 PolarHBondContact O-N 3.3Å; F73-L201 HydrophobicContact CD1-CD1 4.07Å; F73-L204 HydrophobicContact CD1-CB 4Å; F73-L204 HydrophobicContact CD1-CD1 4.24Å; F73-L204 HydrophobicContact CE1-CB 4.18Å; F73-L204 HydrophobicContact CE1-CD1 3.92Å; F73-L204 HydrophobicContact CE1-CG 4.47Å; F73-L208 HydrophobicContact CB-CD2 4.28Å; F73-L208 HydrophobicContact CD2-CD1 4.26Å; F73-L208 HydrophobicContact CD2-CD2 3.84Å; F73-L208 HydrophobicContact CE2-CD1 4.44Å |
| 74 | V | 94.8 | Very high | 91 | Very high | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -70.7 | -40.5 | -179.6 | -177.8 | 0 | 0 | 0 | 0 | 111.1 | T70 S76 F77 V78 L99 L176 L177 E180 | T70-V74 HydrophobicContact CG2-CG2 4.22Å; T70-V74 WeakPolarHBondContact O-CB 3.4Å; T70-V74 WeakPolarHBondContact O-CG2 3.42Å; T70-V74 PolarHBondContact O-N 3.43Å; V74-S76 VanDerWaalsContact C-N 3.35Å; V74-S76 PolarHBondContact O-N 3.13Å; V74-F77 WeakPolarHBondContact O-CB 3.34Å; V74-F77 PolarHBondContact O-N 3.38Å; V74-F77 VanDerWaalsContact O-N 3.16Å; V74-V78 HydrophobicContact CG1-CG2 4Å; V74-V78 WeakPolarHBondContact O-CB 3.41Å; V74-V78 VanDerWaalsContact O-CG2 3.29Å; V74-V78 WeakPolarHBondContact O-CG2 3.35Å; V74-V78 PolarHBondContact O-N 3.05Å; V74-L99 HydrophobicContact CB-CD2 4.25Å; V74-L99 HydrophobicContact CG1-CD1 4.21Å; V74-L99 HydrophobicContact CG1-CD2 4.31Å; V74-L176 HydrophobicContact CB-CD2 4.45Å; V74-L176 HydrophobicContact CG1-CD2 4.01Å; V74-L176 HydrophobicContact CG2-CD2 4.41Å; V74-L177 HydrophobicContact CG2-CD1 3.25Å; V74-L177 HydrophobicContact CG2-CG 3.58Å; V74-E180 HydrophobicContact CG1-CB 3.74Å; V74-E180 HydrophobicContact CG1-CG 3.91Å |
| 75 | G | 93.5 | Very high | 90.8 | Very high | 5 Ų | 5 | 37.1 Ų | 37.1 | 5% | 0.052 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -61.2 | -45.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | C71 F77 V78 F79 | C71-G75 WeakPolarHBondContact O-CA 3.28Å; C71-G75 PolarHBondContact O-N 2.93Å; G75-F77 VanDerWaalsContact C-N 3.32Å; G75-F77 PolarHBondContact O-N 2.91Å; G75-V78 PolarHBondContact O-N 3.41Å; G75-F79 VanDerWaalsContact O-CB 3.25Å; G75-F79 WeakPolarHBondContact O-CB 2.94Å; G75-F79 PolarHBondContact O-N 3.15Å |
| 76 | S | 94.4 | Very high | 90.2 | Very high | 53 Ų | 53 | 39.1 Ų | 39.1 | 37% | 0.371 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -62.6 | -40.3 | 174.4 | -59.1 | 0 | 0 | 0 | 0 | 111.6 | V72 V74 F79 L80 | V72-S76 WeakPolarHBondContact O-CB 3.37Å; V72-S76 PolarHBondContact O-N 2.96Å; V72-S76 VanDerWaalsContact O-N 3.09Å; V72-S76 PolarHBondContact O-OG 3.35Å; V74-S76 VanDerWaalsContact C-N 3.35Å; V74-S76 PolarHBondContact O-N 3.13Å; S76-F79 PolarHBondContact O-N 3.2Å; S76-L80 WeakPolarHBondContact O-CB 3.38Å; S76-L80 WeakPolarHBondContact O-CG 3.43Å; S76-L80 PolarHBondContact O-N 3.12Å |
| 77 | F | 94.1 | Very high | 89.6 | Confident | 0 Ų | 0 | 49 Ų | 49 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -63.8 | -50 | 179.2 | 171.3 | -103.2 | 0 | 0 | 0 | 111.4 | F73 V74 G75 F79 L80 L81 T181 F184 L198 L201 F202 | F73-F77 WeakPolarHBondContact O-CB 2.94Å; F73-F77 PolarHBondContact O-N 3.3Å; V74-F77 WeakPolarHBondContact O-CB 3.34Å; V74-F77 PolarHBondContact O-N 3.38Å; V74-F77 VanDerWaalsContact O-N 3.16Å; G75-F77 VanDerWaalsContact C-N 3.32Å; G75-F77 PolarHBondContact O-N 2.91Å; F77-F79 VanDerWaalsContact C-N 3.29Å; F77-F79 PolarHBondContact O-N 2.9Å; F77-L80 PolarHBondContact O-N 2.8Å; F77-L81 HydrophobicContact CE1-CD2 4.09Å; F77-L81 HydrophobicContact CZ-CD2 3.87Å; F77-L81 VanDerWaalsContact O-CB 3.25Å; F77-L81 WeakPolarHBondContact O-CB 3.16Å; F77-L81 PolarHBondContact O-N 3.48Å; F77-T181 HydrophobicContact CE1-CG2 4.47Å; F77-F184 HydrophobicContact CE2-CD2 4.11Å; F77-F184 HydrophobicContact CE2-CG 4.33Å; F77-F184 HydrophobicContact CZ-CB 3.97Å; F77-F184 HydrophobicContact CZ-CD2 4.14Å; F77-F184 HydrophobicContact CZ-CG 4.2Å; F77-L198 HydrophobicContact CD2-CD1 3.94Å; F77-L198 HydrophobicContact CE2-CD1 3.91Å; F77-L201 VanDerWaalsContact CA-CD2 3.47Å; F77-L201 HydrophobicContact CB-CD2 4.05Å; F77-L201 HydrophobicContact CB-CG 4.01Å; F77-L201 VanDerWaalsContact N-CD2 3.29Å; F77-F202 HydrophobicContact CD2-CB 4.21Å; F77-F202 HydrophobicContact CE2-CB 3.92Å; F77-F202 HydrophobicContact CE2-CD2 4.01Å; F77-F202 HydrophobicContact CE2-CG 4.44Å; F77-F202 HydrophobicContact CZ-CD2 4.14Å |
| 78 | V | 91.7 | Very high | 88.9 | Confident | 5 Ų | 5 | 49.1 Ų | 49.1 | 3% | 0.03 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -61.8 | -40.6 | 177.7 | 171.6 | 0 | 0 | 0 | 0 | 110.4 | V74 G75 S82 H95 E180 | V74-V78 HydrophobicContact CG1-CG2 4Å; V74-V78 WeakPolarHBondContact O-CB 3.41Å; V74-V78 VanDerWaalsContact O-CG2 3.29Å; V74-V78 WeakPolarHBondContact O-CG2 3.35Å; V74-V78 PolarHBondContact O-N 3.05Å; G75-V78 PolarHBondContact O-N 3.41Å; V78-S82 WeakPolarHBondContact O-CB 3.43Å; V78-S82 PolarHBondContact O-N 3.41Å; V78-S82 PolarHBondContact O-OG 3.47Å; V78-H95 HydrophobicContact CG1-CB 3.56Å; V78-E180 HydrophobicContact CG2-CB 4.3Å; V78-E180 HydrophobicContact CG2-CG 4.47Å; V78-E180 WeakPolarHBondContact CG2-OE2 3.32Å |
| 79 | F | 91.3 | Very high | 88.3 | Confident | 72 Ų | 72 | 51.3 Ų | 51.3 | 32% | 0.316 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -61.7 | -54.1 | 177.5 | -178.8 | -100.3 | 0 | 0 | 0 | 111.7 | G75 S76 F77 S82 Y83 S92 L96 | G75-F79 VanDerWaalsContact O-CB 3.25Å; G75-F79 WeakPolarHBondContact O-CB 2.94Å; G75-F79 PolarHBondContact O-N 3.15Å; S76-F79 PolarHBondContact O-N 3.2Å; F77-F79 VanDerWaalsContact C-N 3.29Å; F77-F79 PolarHBondContact O-N 2.9Å; F79-S82 PolarHBondContact O-N 3.2Å; F79-Y83 WeakPolarHBondContact O-CB 3.37Å; F79-Y83 PolarHBondContact O-N 3.46Å; F79-S92 WeakPolarHBondContact CA-OG 3.49Å; F79-S92 WeakPolarHBondContact CD2-OG 3.44Å; F79-S92 PolarHBondContact O-OG 3.05Å; F79-L96 HydrophobicContact CB-CD1 3.99Å; F79-L96 HydrophobicContact CD2-CD1 3.71Å; F79-L96 HydrophobicContact CG-CD1 4.32Å |
| 80 | L | 90 | Very high | 87.7 | Confident | 65 Ų | 65 | 53 Ų | 53 | 34% | 0.34 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -65.1 | -41.4 | -178 | -73.6 | -178.7 | 0 | 0 | 0 | 112 | S76 F77 Y83 S84 L198 L201 | S76-L80 WeakPolarHBondContact O-CB 3.38Å; S76-L80 WeakPolarHBondContact O-CG 3.43Å; S76-L80 PolarHBondContact O-N 3.12Å; F77-L80 PolarHBondContact O-N 2.8Å; L80-Y83 PolarHBondContact O-N 2.7Å; L80-S84 VanDerWaalsContact O-CB 3.26Å; L80-S84 WeakPolarHBondContact O-CB 3.48Å; L80-S84 PolarHBondContact O-N 2.9Å; L80-L198 HydrophobicContact CB-CD1 4.11Å; L80-L201 HydrophobicContact CD1-CD2 3.77Å |
| 81 | L | 88.5 | Confident | 86.9 | Confident | 7 Ų | 7 | 56.2 Ų | 56.2 | 4% | 0.037 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -62.4 | -46.6 | 176.6 | -177.1 | 63.8 | 0 | 0 | 0 | 111.2 | F77 I85 V183 F184 Y187 L198 | F77-L81 HydrophobicContact CE1-CD2 4.09Å; F77-L81 HydrophobicContact CZ-CD2 3.87Å; F77-L81 VanDerWaalsContact O-CB 3.25Å; F77-L81 WeakPolarHBondContact O-CB 3.16Å; F77-L81 PolarHBondContact O-N 3.48Å; L81-I85 HydrophobicContact CD1-CD1 4.12Å; L81-I85 HydrophobicContact CG-CD1 4.25Å; L81-I85 WeakPolarHBondContact O-CD1 3.08Å; L81-I85 WeakPolarHBondContact O-CG1 3.35Å; L81-I85 PolarHBondContact O-N 3.3Å; L81-V183 HydrophobicContact CD2-CG1 4.37Å; L81-F184 HydrophobicContact CD1-CD2 4.39Å; L81-Y187 HydrophobicContact CD1-CD1 3.86Å; L81-Y187 HydrophobicContact CD1-CD2 4.27Å; L81-Y187 HydrophobicContact CD1-CE1 3.87Å; L81-Y187 HydrophobicContact CD1-CE2 4.29Å; L81-Y187 HydrophobicContact CD1-CG 4.04Å; L81-L198 HydrophobicContact CB-CD1 4.18Å; L81-L198 HydrophobicContact CD1-CD2 4.14Å |
| 82 | S | 87.4 | Confident | 86.4 | Confident | 6 Ų | 6 | 54.4 Ų | 54.4 | 4% | 0.042 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -67.3 | -40.4 | -180 | -58.1 | 0 | 0 | 0 | 0 | 111.9 | V78 F79 I85 R86 H95 | V78-S82 WeakPolarHBondContact O-CB 3.43Å; V78-S82 PolarHBondContact O-N 3.41Å; V78-S82 PolarHBondContact O-OG 3.47Å; F79-S82 PolarHBondContact O-N 3.2Å; S82-I85 PolarHBondContact O-N 3.42Å; S82-R86 PolarHBondContact O-N 3.34Å; S82-R86 VanDerWaalsContact O-N 3.07Å; S82-H95 PolarHBondContact OG-CD2 2.94Å |
| 83 | Y | 85.1 | Confident | 85.8 | Confident | 104 Ų | 104 | 55 Ų | 55 | 41% | 0.408 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -67.6 | -41.4 | 178.4 | -175.1 | -100.5 | 0 | 0 | 0 | 112 | F79 L80 I85 R87 | F79-Y83 WeakPolarHBondContact O-CB 3.37Å; F79-Y83 PolarHBondContact O-N 3.46Å; L80-Y83 PolarHBondContact O-N 2.7Å; Y83-I85 PolarHBondContact O-N 2.96Å; Y83-R87 WeakPolarHBondContact O-CA 3.43Å; Y83-R87 PolarHBondContact O-N 3.44Å |
| 84 | S | 82.6 | Confident | 85.3 | Confident | 42 Ų | 42 | 56.5 Ų | 56.5 | 29% | 0.294 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -57.8 | -36 | 175.9 | 176.5 | 0 | 0 | 0 | 0 | 112.2 | L80 | L80-S84 VanDerWaalsContact O-CB 3.26Å; L80-S84 WeakPolarHBondContact O-CB 3.48Å; L80-S84 PolarHBondContact O-N 2.9Å |
| 85 | I | 76.8 | Confident | 84.8 | Confident | 39 Ų | 39 | 57 Ų | 57 | 20% | 0.2 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -83.9 | -46.8 | -175.6 | -63.5 | 165.4 | 0 | 0 | 0 | 112.7 | L81 S82 Y83 Y187 L264 | L81-I85 HydrophobicContact CD1-CD1 4.12Å; L81-I85 HydrophobicContact CG-CD1 4.25Å; L81-I85 WeakPolarHBondContact O-CD1 3.08Å; L81-I85 WeakPolarHBondContact O-CG1 3.35Å; L81-I85 PolarHBondContact O-N 3.3Å; S82-I85 PolarHBondContact O-N 3.42Å; Y83-I85 PolarHBondContact O-N 2.96Å; I85-Y187 HydrophobicContact CD1-CD2 3.78Å; I85-Y187 HydrophobicContact CD1-CE2 3.5Å; I85-Y187 HydrophobicContact CG1-CD2 4.38Å; I85-Y187 HydrophobicContact CG1-CE2 3.61Å; I85-L264 HydrophobicContact CB-CD2 3.96Å; I85-L264 HydrophobicContact CD1-CB 4.11Å; I85-L264 HydrophobicContact CD1-CD1 4.15Å; I85-L264 HydrophobicContact CD1-CD2 3.72Å; I85-L264 HydrophobicContact CD1-CG 4.2Å; I85-L264 HydrophobicContact CG1-CD2 4.44Å; I85-L264 HydrophobicContact CG2-CD2 3.76Å |
| 86 | R | 74.8 | Confident | 84.6 | Confident | 85 Ų | 85 | 58.9 Ų | 58.9 | 32% | 0.321 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -109.9 | -10.1 | -172.7 | -82 | -150.6 | -103.4 | -159.3 | -8.6 | 115.4 | S82 S88 H91 M267 | S82-R86 PolarHBondContact O-N 3.34Å; S82-R86 VanDerWaalsContact O-N 3.07Å; R86-S88 PolarHBondContact O-N 3.1Å; R86-H91 PolarHBondContact NH1-CE1 2.84Å; R86-M267 HydrophobicContact CG-SD 4.34Å |
| 87 | R | 75.4 | Confident | 84.3 | Confident | 209 Ų | 209 | 58.3 Ų | 58.3 | 79% | 0.789 | 28% | 0.282 | S | S | * | . | trans | 49.3 | 19.5 | -174.2 | -63.9 | -173.3 | 177 | -178.7 | -0.8 | 115.1 | Y83 | Y83-R87 WeakPolarHBondContact O-CA 3.43Å; Y83-R87 PolarHBondContact O-N 3.44Å | ||
| 88 | S | 78.7 | Confident | 84.2 | Confident | 41 Ų | 41 | 58.7 Ų | 58.7 | 29% | 0.287 | 28% | 0.283 | S | S | . | . | trans | -116.3 | 124.1 | -176.7 | 175.1 | 0 | 0 | 0 | 0 | 110.8 | R86 S92 | R86-S88 PolarHBondContact O-N 3.1Å; S88-S92 PolarHBondContact O-N 3.42Å | ||
| 89 | V | 81.7 | Confident | 84.3 | Confident | 81 Ų | 81 | 58.8 Ų | 58.8 | 49% | 0.491 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -66.5 | -41.1 | -178.3 | 178.7 | 0 | 0 | 0 | 0 | 111.2 | H91 S92 L93 | V89-H91 VanDerWaalsContact C-N 3.35Å; V89-H91 PolarHBondContact O-N 3.44Å; V89-S92 WeakPolarHBondContact O-CB 3.36Å; V89-S92 PolarHBondContact O-N 3.33Å; V89-S92 VanDerWaalsContact O-N 3.11Å; V89-L93 HydrophobicContact CG1-CD1 4.04Å; V89-L93 HydrophobicContact CG1-CG 4.19Å; V89-L93 WeakPolarHBondContact O-CG 3.33Å; V89-L93 PolarHBondContact O-N 2.96Å |
| 90 | L | 81.1 | Confident | 84.3 | Confident | 135 Ų | 135 | 58.8 Ų | 58.8 | 71% | 0.707 | 30% | 0.297 | S | S | * | . | H | α-helix | trans | -63.9 | -39.5 | -176.4 | -172 | 64.2 | 0 | 0 | 0 | 112.3 | R94 | L90-R94 PolarHBondContact O-N 3.01Å |
| 91 | H | 78.8 | Confident | 84.5 | Confident | 67 Ų | 67 | 57.6 Ų | 57.6 | 31% | 0.31 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -68 | -37.9 | 174.2 | -77.5 | -61 | 0 | 0 | 0 | 112.3 | R86 V89 R94 H95 | R86-H91 PolarHBondContact NH1-CE1 2.84Å; V89-H91 VanDerWaalsContact C-N 3.35Å; V89-H91 PolarHBondContact O-N 3.44Å; H91-R94 PolarHBondContact O-N 3.5Å; H91-H95 PolarHBondContact O-CD2 2.86Å; H91-H95 PolarHBondContact O-N 3.41Å |
| 92 | S | 82.3 | Confident | 84.8 | Confident | 0 Ų | 0 | 57.3 Ų | 57.3 | 0% | 0 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -62.6 | -48.2 | 175.6 | -164.6 | 0 | 0 | 0 | 0 | 111.1 | F79 S88 V89 R94 H95 L96 | F79-S92 WeakPolarHBondContact CA-OG 3.49Å; F79-S92 WeakPolarHBondContact CD2-OG 3.44Å; F79-S92 PolarHBondContact O-OG 3.05Å; S88-S92 PolarHBondContact O-N 3.42Å; V89-S92 WeakPolarHBondContact O-CB 3.36Å; V89-S92 PolarHBondContact O-N 3.33Å; V89-S92 VanDerWaalsContact O-N 3.11Å; S92-R94 PolarHBondContact O-N 3.16Å; S92-H95 WeakPolarHBondContact O-CA 3.49Å; S92-H95 WeakPolarHBondContact O-CB 3.48Å; S92-H95 PolarHBondContact O-N 3.39Å; S92-L96 WeakPolarHBondContact O-CD1 3.32Å; S92-L96 PolarHBondContact O-N 3.3Å |
| 93 | L | 83.3 | Confident | 85.1 | Confident | 95 Ų | 95 | 57.2 Ų | 57.2 | 50% | 0.497 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -57.5 | -35.2 | 177.3 | -72.1 | 176.2 | 0 | 0 | 0 | 112.9 | V89 H95 L96 S97 | V89-L93 HydrophobicContact CG1-CD1 4.04Å; V89-L93 HydrophobicContact CG1-CG 4.19Å; V89-L93 WeakPolarHBondContact O-CG 3.33Å; V89-L93 PolarHBondContact O-N 2.96Å; L93-H95 VanDerWaalsContact C-N 3.31Å; L93-H95 PolarHBondContact O-N 2.87Å; L93-L96 HydrophobicContact CD2-CD1 4.37Å; L93-L96 WeakPolarHBondContact O-CB 3.45Å; L93-L96 PolarHBondContact O-N 3Å; L93-S97 PolarHBondContact O-N 2.91Å |
| 94 | R | 84.5 | Confident | 85.5 | Confident | 75 Ų | 75 | 54.1 Ų | 54.1 | 28% | 0.283 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -66.2 | -31.4 | 173.7 | -173.4 | 173.7 | -176 | 177.8 | -4.7 | 113.3 | L90 H91 S92 S97 P252 S253 C256 P257 | L90-R94 PolarHBondContact O-N 3.01Å; H91-R94 PolarHBondContact O-N 3.5Å; S92-R94 PolarHBondContact O-N 3.16Å; R94-S97 PolarHBondContact O-OG 3.38Å; R94-P252 VanDerWaalsContact NH2-CA 3.25Å; R94-P252 VanDerWaalsContact NH2-CB 3.35Å; R94-P252 PolarHBondContact NH2-O 3.4Å; R94-P252 VanDerWaalsContact NH2-O 3.15Å; R94-S253 PolarHBondContact NH2-O 3.38Å; R94-C256 PolarHBondContact NE-O 3.29Å; R94-C256 PolarHBondContact NH2-O 3.13Å; R94-P257 HydrophobicContact CG-CB 4.36Å; R94-P257 WeakPolarHBondContact O-CB 3.27Å |
| 95 | H | 85.4 | Confident | 86.1 | Confident | 10 Ų | 10 | 54.6 Ų | 54.6 | 5% | 0.046 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -76.7 | -34.5 | 172.8 | -65.7 | -54.9 | 0 | 0 | 0 | 111.5 | V78 S82 H91 S92 L93 S97 R98 | V78-H95 HydrophobicContact CG1-CB 3.56Å; S82-H95 PolarHBondContact OG-CD2 2.94Å; H91-H95 PolarHBondContact O-CD2 2.86Å; H91-H95 PolarHBondContact O-N 3.41Å; S92-H95 WeakPolarHBondContact O-CA 3.49Å; S92-H95 WeakPolarHBondContact O-CB 3.48Å; S92-H95 PolarHBondContact O-N 3.39Å; L93-H95 VanDerWaalsContact C-N 3.31Å; L93-H95 PolarHBondContact O-N 2.87Å; H95-S97 VanDerWaalsContact C-N 3.27Å; H95-S97 PolarHBondContact O-N 2.88Å; H95-R98 WeakPolarHBondContact O-CB 3.42Å; H95-R98 PolarHBondContact O-N 3.45Å |
| 96 | L | 88.4 | Confident | 86.9 | Confident | 45 Ų | 45 | 54.9 Ų | 54.9 | 24% | 0.236 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -64.3 | -29.1 | 171.4 | -80.1 | 129.5 | 0 | 0 | 0 | 113.2 | F79 S92 L93 R98 L99 A100 | F79-L96 HydrophobicContact CB-CD1 3.99Å; F79-L96 HydrophobicContact CD2-CD1 3.71Å; F79-L96 HydrophobicContact CG-CD1 4.32Å; S92-L96 WeakPolarHBondContact O-CD1 3.32Å; S92-L96 PolarHBondContact O-N 3.3Å; L93-L96 HydrophobicContact CD2-CD1 4.37Å; L93-L96 WeakPolarHBondContact O-CB 3.45Å; L93-L96 PolarHBondContact O-N 3Å; L96-R98 PolarHBondContact O-N 2.99Å; L96-R98 VanDerWaalsContact O-N 3.09Å; L96-L99 WeakPolarHBondContact O-CB 3.33Å; L96-L99 PolarHBondContact O-N 3.48Å; L96-A100 PolarHBondContact O-N 3.45Å |
| 97 | S | 89.5 | Confident | 87.8 | Confident | 42 Ų | 42 | 55.4 Ų | 55.4 | 29% | 0.294 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -62.2 | -19 | 177.9 | 76.5 | 0 | 0 | 0 | 0 | 113 | L93 R94 H95 L99 A100 V101 | L93-S97 PolarHBondContact O-N 2.91Å; R94-S97 PolarHBondContact O-OG 3.38Å; H95-S97 VanDerWaalsContact C-N 3.27Å; H95-S97 PolarHBondContact O-N 2.88Å; S97-L99 VanDerWaalsContact C-N 3.33Å; S97-L99 PolarHBondContact O-N 2.98Å; S97-A100 PolarHBondContact O-N 3.25Å; S97-V101 WeakPolarHBondContact O-CB 3.13Å; S97-V101 VanDerWaalsContact O-CG2 3.27Å; S97-V101 WeakPolarHBondContact O-CG2 3.38Å; S97-V101 PolarHBondContact O-N 3.05Å |
| 98 | R | 91.1 | Very high | 88.7 | Confident | 7 Ų | 7 | 49.2 Ų | 49.2 | 3% | 0.026 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -59.2 | -43.4 | 169.9 | -66.3 | -164.7 | -66.8 | -120.6 | -2.9 | 112.4 | H95 L96 V101 A102 E180 Y248 P257 G258 | H95-R98 WeakPolarHBondContact O-CB 3.42Å; H95-R98 PolarHBondContact O-N 3.45Å; L96-R98 PolarHBondContact O-N 2.99Å; L96-R98 VanDerWaalsContact O-N 3.09Å; R98-V101 PolarHBondContact O-N 3.34Å; R98-A102 WeakPolarHBondContact O-CB 3.31Å; R98-A102 PolarHBondContact O-N 2.85Å; R98-E180 IonicContact CZ-OE1 3.48Å; R98-E180 IonicContact CZ-OE2 3.39Å; R98-E180 IonicContact NE-OE1 2.79Å; R98-E180 PolarHBondContact NE-OE1 3.08Å; R98-E180 IonicContact NE-OE2 3.42Å; R98-E180 PolarHBondContact NE-OE2 3.45Å; R98-E180 IonicContact NH2-OE1 3.58Å; R98-E180 IonicContact NH2-OE2 2.67Å; R98-E180 PolarHBondContact NH2-OE2 2.83Å; R98-Y248 WeakPolarHBondContact CA-OH 3.46Å; R98-Y248 HydrophobicContact CB-CE2 4.04Å; R98-Y248 HydrophobicContact CG-CD2 4.38Å; R98-Y248 HydrophobicContact CG-CE2 3.76Å; R98-Y248 PolarHBondContact O-OH 3.5Å; R98-P257 HydrophobicContact CG-CB 3.64Å; R98-P257 HydrophobicContact CG-CG 3.5Å; R98-G258 PolarHBondContact NH1-O 2.8Å |
| 99 | L | 92.9 | Very high | 89.4 | Confident | 8 Ų | 8 | 49.8 Ų | 49.8 | 4% | 0.042 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -66.2 | -44.7 | 176.7 | -82.5 | 64.6 | 0 | 0 | 0 | 110 | W67 V74 L96 S97 V101 A102 G103 L176 | W67-L99 WeakPolarHBondContact CH2-O 3.5Å; W67-L99 WeakPolarHBondContact CZ2-O 3.36Å; V74-L99 HydrophobicContact CB-CD2 4.25Å; V74-L99 HydrophobicContact CG1-CD1 4.21Å; V74-L99 HydrophobicContact CG1-CD2 4.31Å; L96-L99 WeakPolarHBondContact O-CB 3.33Å; L96-L99 PolarHBondContact O-N 3.48Å; S97-L99 VanDerWaalsContact C-N 3.33Å; S97-L99 PolarHBondContact O-N 2.98Å; L99-V101 VanDerWaalsContact C-N 3.32Å; L99-V101 PolarHBondContact O-N 2.97Å; L99-A102 PolarHBondContact O-N 3.43Å; L99-G103 PolarHBondContact O-N 3.29Å; L99-L176 HydrophobicContact CD1-CD2 4.49Å; L99-L176 HydrophobicContact CG-CD2 4.45Å |
| 100 | A | 92.7 | Very high | 89.9 | Confident | 71 Ų | 71 | 46.5 Ų | 46.5 | 59% | 0.587 | 26% | 0.263 | S | S | * | . | H | α-helix | trans | -59.1 | -43.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | L96 S97 G103 G104 | L96-A100 PolarHBondContact O-N 3.45Å; S97-A100 PolarHBondContact O-N 3.25Å; A100-G103 PolarHBondContact O-N 3.37Å; A100-G104 PolarHBondContact O-N 3.41Å |
| 101 | V | 93.6 | Very high | 90.5 | Very high | 41 Ų | 41 | 44.6 Ų | 44.6 | 25% | 0.248 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -63.5 | -45.7 | 176.3 | 167.2 | 0 | 0 | 0 | 0 | 111.4 | S97 R98 L99 G103 G104 L105 L243 W247 | S97-V101 WeakPolarHBondContact O-CB 3.13Å; S97-V101 VanDerWaalsContact O-CG2 3.27Å; S97-V101 WeakPolarHBondContact O-CG2 3.38Å; S97-V101 PolarHBondContact O-N 3.05Å; R98-V101 PolarHBondContact O-N 3.34Å; L99-V101 VanDerWaalsContact C-N 3.32Å; L99-V101 PolarHBondContact O-N 2.97Å; V101-G103 VanDerWaalsContact C-N 3.33Å; V101-G103 PolarHBondContact O-N 3.04Å; V101-G104 PolarHBondContact O-N 2.95Å; V101-L105 WeakPolarHBondContact O-CB 3.43Å; V101-L105 PolarHBondContact O-N 2.99Å; V101-L243 HydrophobicContact CG1-CD2 3.59Å; V101-W247 HydrophobicContact CG1-CE3 4.11Å; V101-W247 HydrophobicContact CG1-CH2 4.21Å; V101-W247 HydrophobicContact CG1-CZ3 3.44Å; V101-W247 VanDerWaalsContact CG1-CZ3 3.44Å; V101-W247 HydrophobicContact CG2-CH2 4.36Å; V101-W247 HydrophobicContact CG2-CZ3 4.38Å |
| 102 | A | 93.9 | Very high | 91.1 | Very high | 1 Ų | 1 | 46 Ų | 46 | 1% | 0.008 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -63.1 | -39.1 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | W67 R98 L99 L105 W106 L176 L243 | W67-A102 HydrophobicContact CH2-CB 3.78Å; W67-A102 HydrophobicContact CZ3-CB 4.48Å; R98-A102 WeakPolarHBondContact O-CB 3.31Å; R98-A102 PolarHBondContact O-N 2.85Å; L99-A102 PolarHBondContact O-N 3.43Å; A102-L105 PolarHBondContact O-N 3.48Å; A102-W106 WeakPolarHBondContact O-CB 3.49Å; A102-W106 PolarHBondContact O-N 2.93Å; A102-L176 HydrophobicContact CB-CD1 3.62Å; A102-L243 HydrophobicContact CB-CD1 3.91Å |
| 103 | G | 93.6 | Very high | 91.5 | Very high | 3 Ų | 3 | 47.1 Ų | 47.1 | 3% | 0.031 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -68 | -42.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | W67 L99 A100 V101 L105 W106 L107 | W67-G103 VanDerWaalsContact CE2-CA 3.49Å; W67-G103 VanDerWaalsContact CH2-N 3.32Å; L99-G103 PolarHBondContact O-N 3.29Å; A100-G103 PolarHBondContact O-N 3.37Å; V101-G103 VanDerWaalsContact C-N 3.33Å; V101-G103 PolarHBondContact O-N 3.04Å; G103-L105 VanDerWaalsContact C-N 3.33Å; G103-L105 PolarHBondContact O-N 3.19Å; G103-W106 PolarHBondContact O-N 3.4Å; G103-L107 WeakPolarHBondContact O-CG 3.38Å; G103-L107 PolarHBondContact O-N 3.46Å |
| 104 | G | 94.7 | Very high | 91.8 | Very high | 40 Ų | 40 | 45.8 Ų | 45.8 | 41% | 0.412 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -62.6 | -40.6 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | A100 V101 L107 C108 | A100-G104 PolarHBondContact O-N 3.41Å; V101-G104 PolarHBondContact O-N 2.95Å; G104-L107 PolarHBondContact O-N 2.65Å; G104-C108 VanDerWaalsContact O-CB 3.31Å; G104-C108 WeakPolarHBondContact O-CB 3.42Å; G104-C108 PolarHBondContact O-N 2.99Å |
| 105 | L | 94.3 | Very high | 92 | Very high | 51 Ų | 51 | 47.2 Ų | 47.2 | 27% | 0.267 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -63.9 | -44 | 175.2 | -174.2 | 63.2 | 0 | 0 | 0 | 111.5 | V101 A102 G103 C108 F109 L243 | V101-L105 WeakPolarHBondContact O-CB 3.43Å; V101-L105 PolarHBondContact O-N 2.99Å; A102-L105 PolarHBondContact O-N 3.48Å; G103-L105 VanDerWaalsContact C-N 3.33Å; G103-L105 PolarHBondContact O-N 3.19Å; L105-C108 PolarHBondContact O-N 2.99Å; L105-F109 HydrophobicContact CD1-CD2 3.93Å; L105-F109 HydrophobicContact CD1-CE2 3.53Å; L105-F109 HydrophobicContact CD2-CE2 4.21Å; L105-F109 HydrophobicContact CG-CD2 3.84Å; L105-F109 HydrophobicContact CG-CE2 3.69Å; L105-F109 VanDerWaalsContact O-CD2 3.24Å; L105-F109 WeakPolarHBondContact O-CD2 2.99Å; L105-F109 PolarHBondContact O-N 3.46Å; L105-L243 HydrophobicContact CD2-CD1 3.8Å; L105-L243 HydrophobicContact CD2-CD2 4.15Å; L105-L243 HydrophobicContact CD2-CG 3.88Å |
| 106 | W | 94.3 | Very high | 92.2 | Very high | 46 Ų | 46 | 50.3 Ų | 50.3 | 17% | 0.174 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -58.2 | -50.6 | 174.8 | 165.7 | 64 | 0 | 0 | 0 | 111.9 | W67 A102 G103 C108 F109 C110 F168 L169 L172 | W67-W106 HydrophobicContact CB-CE3 4.48Å; W67-W106 HydrophobicContact CB-CH2 4.4Å; W67-W106 HydrophobicContact CB-CZ3 4.11Å; W67-W106 HydrophobicContact CD2-CE3 4.36Å; W67-W106 HydrophobicContact CG-CE3 4.1Å; W67-W106 AromaticContact CG-CZ3 3.99Å; W67-W106 HydrophobicContact CG-CZ3 3.99Å; A102-W106 WeakPolarHBondContact O-CB 3.49Å; A102-W106 PolarHBondContact O-N 2.93Å; G103-W106 PolarHBondContact O-N 3.4Å; W106-C108 VanDerWaalsContact C-N 3.31Å; W106-C108 PolarHBondContact O-N 3.04Å; W106-F109 PolarHBondContact O-N 3.34Å; W106-F109 VanDerWaalsContact O-N 3.17Å; W106-C110 PolarHBondContact NE1-SG 3.22Å; W106-C110 VanDerWaalsContact NE1-SG 3.36Å; W106-C110 PolarHBondContact O-N 3.27Å; W106-F168 AromaticContact CD1-CD1 3.81Å; W106-F168 AromaticContact CD1-CE1 3.46Å; W106-F168 VanDerWaalsContact CD1-CE1 3.46Å; W106-F168 HydrophobicContact CG-CE1 4.38Å; W106-L169 HydrophobicContact CD2-CD1 4.16Å; W106-L169 HydrophobicContact CG-CD1 4.37Å; W106-L169 HydrophobicContact CZ2-CD1 4.31Å; W106-L169 HydrophobicContact CZ2-CD2 4.12Å; W106-L172 HydrophobicContact CB-CD2 3.82Å; W106-L172 HydrophobicContact CG-CD2 4.48Å |
| 107 | L | 94.3 | Very high | 92.2 | Very high | 95 Ų | 95 | 48.9 Ų | 48.9 | 50% | 0.497 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -59.4 | -43 | 177.5 | -70.9 | 173.9 | 0 | 0 | 0 | 111.8 | G103 G104 F109 C110 T111 | G103-L107 WeakPolarHBondContact O-CG 3.38Å; G103-L107 PolarHBondContact O-N 3.46Å; G104-L107 PolarHBondContact O-N 2.65Å; L107-F109 VanDerWaalsContact C-N 3.34Å; L107-F109 PolarHBondContact O-N 3.46Å; L107-C110 PolarHBondContact O-N 3.3Å; L107-T111 PolarHBondContact O-N 3.25Å; L107-T111 PolarHBondContact O-OG1 3.15Å; L107-T111 VanDerWaalsContact O-OG1 3.08Å |
| 108 | C | 94.3 | Very high | 92 | Very high | 80 Ų | 80 | 50.3 Ų | 50.3 | 54% | 0.541 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -59.6 | -44.1 | 176.4 | -180 | 0 | 0 | 0 | 0 | 111.8 | G104 L105 W106 T111 L112 | G104-C108 VanDerWaalsContact O-CB 3.31Å; G104-C108 WeakPolarHBondContact O-CB 3.42Å; G104-C108 PolarHBondContact O-N 2.99Å; L105-C108 PolarHBondContact O-N 2.99Å; W106-C108 VanDerWaalsContact C-N 3.31Å; W106-C108 PolarHBondContact O-N 3.04Å; C108-T111 PolarHBondContact O-N 3.22Å; C108-L112 WeakPolarHBondContact O-CB 3.45Å; C108-L112 PolarHBondContact O-N 2.88Å |
| 109 | F | 93.6 | Very high | 91.8 | Very high | 52 Ų | 52 | 54.6 Ų | 54.6 | 23% | 0.228 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -65.2 | -42.3 | 175.1 | -85.5 | -66.7 | 0 | 0 | 0 | 112.5 | L105 W106 L107 T111 L112 L113 F168 L235 S239 | L105-F109 HydrophobicContact CD1-CD2 3.93Å; L105-F109 HydrophobicContact CD1-CE2 3.53Å; L105-F109 HydrophobicContact CD2-CE2 4.21Å; L105-F109 HydrophobicContact CG-CD2 3.84Å; L105-F109 HydrophobicContact CG-CE2 3.69Å; L105-F109 VanDerWaalsContact O-CD2 3.24Å; L105-F109 WeakPolarHBondContact O-CD2 2.99Å; L105-F109 PolarHBondContact O-N 3.46Å; W106-F109 PolarHBondContact O-N 3.34Å; W106-F109 VanDerWaalsContact O-N 3.17Å; L107-F109 VanDerWaalsContact C-N 3.34Å; L107-F109 PolarHBondContact O-N 3.46Å; F109-T111 PolarHBondContact O-N 3.21Å; F109-L112 PolarHBondContact O-N 3.24Å; F109-L113 WeakPolarHBondContact O-CB 3.43Å; F109-L113 WeakPolarHBondContact O-CG 3.34Å; F109-L113 PolarHBondContact O-N 3.42Å; F109-F168 HydrophobicContact CB-CE1 3.56Å; F109-F168 HydrophobicContact CB-CZ 3.75Å; F109-F168 AromaticContact CD2-CZ 3.89Å; F109-F168 HydrophobicContact CD2-CZ 3.89Å; F109-F168 HydrophobicContact CG-CE1 4.32Å; F109-F168 HydrophobicContact CG-CZ 4.02Å; F109-L235 HydrophobicContact CE1-CD2 4.25Å; F109-S239 WeakPolarHBondContact CE2-OG 3.47Å |
| 110 | C | 91.8 | Very high | 91.4 | Very high | 12 Ų | 12 | 57.8 Ų | 57.8 | 8% | 0.081 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -57.5 | -50 | 174.6 | -74.6 | 0 | 0 | 0 | 0 | 111.1 | W106 L107 L112 L113 D114 | W106-C110 PolarHBondContact NE1-SG 3.22Å; W106-C110 VanDerWaalsContact NE1-SG 3.36Å; W106-C110 PolarHBondContact O-N 3.27Å; L107-C110 PolarHBondContact O-N 3.3Å; C110-L112 VanDerWaalsContact C-N 3.31Å; C110-L112 PolarHBondContact O-N 3.01Å; C110-L113 PolarHBondContact O-N 2.92Å; C110-D114 WeakPolarHBondContact O-CB 3.45Å; C110-D114 PolarHBondContact O-N 2.86Å |
| 111 | T | 92.5 | Very high | 91 | Very high | 95 Ų | 95 | 55 Ų | 55 | 58% | 0.583 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -62.3 | -37.9 | 178 | -53.5 | 0 | 0 | 0 | 0 | 112.6 | L107 C108 F109 L115 | L107-T111 PolarHBondContact O-N 3.25Å; L107-T111 PolarHBondContact O-OG1 3.15Å; L107-T111 VanDerWaalsContact O-OG1 3.08Å; C108-T111 PolarHBondContact O-N 3.22Å; F109-T111 PolarHBondContact O-N 3.21Å; T111-L115 WeakPolarHBondContact O-CB 3.41Å; T111-L115 PolarHBondContact O-N 2.88Å |
| 112 | L | 92.5 | Very high | 90.6 | Very high | 96 Ų | 96 | 54.9 Ų | 54.9 | 50% | 0.503 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -67.7 | -41.1 | 177 | -177.3 | 65.5 | 0 | 0 | 0 | 111.8 | C108 F109 C110 L115 L116 | C108-L112 WeakPolarHBondContact O-CB 3.45Å; C108-L112 PolarHBondContact O-N 2.88Å; F109-L112 PolarHBondContact O-N 3.24Å; C110-L112 VanDerWaalsContact C-N 3.31Å; C110-L112 PolarHBondContact O-N 3.01Å; L112-L115 PolarHBondContact O-N 2.88Å; L112-L116 WeakPolarHBondContact O-CB 3.39Å; L112-L116 PolarHBondContact O-N 3.34Å |
| 113 | L | 91.3 | Very high | 90.2 | Very high | 24 Ų | 24 | 54.9 Ų | 54.9 | 13% | 0.126 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -67.2 | -41.1 | 177.1 | -70.9 | 172.5 | 0 | 0 | 0 | 111.2 | F109 C110 L115 L116 E117 V163 L235 | F109-L113 WeakPolarHBondContact O-CB 3.43Å; F109-L113 WeakPolarHBondContact O-CG 3.34Å; F109-L113 PolarHBondContact O-N 3.42Å; C110-L113 PolarHBondContact O-N 2.92Å; L113-L115 VanDerWaalsContact C-N 3.32Å; L113-L115 PolarHBondContact O-N 2.95Å; L113-L116 PolarHBondContact O-N 2.88Å; L113-E117 WeakPolarHBondContact O-CB 3.37Å; L113-E117 PolarHBondContact O-N 2.81Å; L113-V163 HydrophobicContact CD1-CB 4.12Å; L113-V163 HydrophobicContact CD1-CG1 4.08Å; L113-V163 HydrophobicContact CD2-CB 4.04Å; L113-V163 HydrophobicContact CD2-CG1 4.46Å; L113-V163 HydrophobicContact CD2-CG2 3.86Å; L113-L235 HydrophobicContact CD1-CD1 3.92Å; L113-L235 HydrophobicContact CD2-CD1 4.21Å |
| 114 | D | 88.9 | Confident | 89.8 | Confident | 67 Ų | 67 | 57.4 Ų | 57.4 | 36% | 0.358 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -58.8 | -44.7 | 172.8 | -76.6 | -36.1 | 0 | 0 | 0 | 111.4 | C110 E117 N118 | C110-D114 WeakPolarHBondContact O-CB 3.45Å; C110-D114 PolarHBondContact O-N 2.86Å; D114-E117 PolarHBondContact O-N 3.23Å; D114-N118 WeakPolarHBondContact O-CB 3.49Å; D114-N118 PolarHBondContact O-N 3.09Å; D114-N118 PolarHBondContact O-ND2 3.22Å |
| 115 | L | 89.2 | Confident | 89.2 | Confident | 105 Ų | 105 | 60 Ų | 60 | 55% | 0.55 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -65.1 | -43.4 | 176.9 | -177.6 | 64.1 | 0 | 0 | 0 | 111.2 | T111 L112 L113 N118 T119 | T111-L115 WeakPolarHBondContact O-CB 3.41Å; T111-L115 PolarHBondContact O-N 2.88Å; L112-L115 PolarHBondContact O-N 2.88Å; L113-L115 VanDerWaalsContact C-N 3.32Å; L113-L115 PolarHBondContact O-N 2.95Å; L115-N118 PolarHBondContact O-N 2.95Å; L115-T119 HydrophobicContact CD1-CG2 4.34Å; L115-T119 WeakPolarHBondContact O-CB 3.39Å; L115-T119 VanDerWaalsContact O-CG2 3.29Å; L115-T119 WeakPolarHBondContact O-CG2 3.42Å; L115-T119 PolarHBondContact O-N 3.28Å; L115-T119 PolarHBondContact O-OG1 3.24Å |
| 116 | L | 88.4 | Confident | 88.3 | Confident | 76 Ų | 76 | 60.1 Ų | 60.1 | 40% | 0.398 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -63.4 | -43.2 | 178.2 | -171.7 | 69.4 | 0 | 0 | 0 | 111.2 | L112 L113 T119 T120 | L112-L116 WeakPolarHBondContact O-CB 3.39Å; L112-L116 PolarHBondContact O-N 3.34Å; L113-L116 PolarHBondContact O-N 2.88Å; L116-T119 WeakPolarHBondContact CA-OG1 3.49Å; L116-T119 PolarHBondContact O-N 2.75Å; L116-T119 PolarHBondContact O-OG1 3.26Å; L116-T120 HydrophobicContact CD1-CG2 3.88Å; L116-T120 HydrophobicContact CG-CG2 4.18Å; L116-T120 WeakPolarHBondContact O-CB 3.32Å; L116-T120 WeakPolarHBondContact O-CG2 3.3Å; L116-T120 PolarHBondContact O-N 2.91Å; L116-T120 PolarHBondContact O-OG1 3.13Å |
| 117 | E | 88.3 | Confident | 87.1 | Confident | 14 Ų | 14 | 61.4 Ų | 61.4 | 7% | 0.065 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -63.6 | -44.2 | 177.1 | -163.5 | -160.8 | 151.5 | 0 | 0 | 111.1 | L113 D114 T119 G121 K148 W158 | L113-E117 WeakPolarHBondContact O-CB 3.37Å; L113-E117 PolarHBondContact O-N 2.81Å; D114-E117 PolarHBondContact O-N 3.23Å; E117-T119 VanDerWaalsContact C-N 3.26Å; E117-T119 PolarHBondContact O-N 3.14Å; E117-G121 WeakPolarHBondContact O-CA 3.37Å; E117-G121 PolarHBondContact O-N 3.35Å; E117-K148 VanDerWaalsContact OE1-CE 3.32Å; E117-K148 WeakPolarHBondContact OE1-CE 3.26Å; E117-K148 IonicContact OE1-NZ 2.8Å; E117-K148 PolarHBondContact OE1-NZ 3.48Å; E117-K148 IonicContact OE2-NZ 2.67Å; E117-K148 PolarHBondContact OE2-NZ 3.21Å; E117-W158 WeakPolarHBondContact O-CZ2 3.32Å; E117-W158 PolarHBondContact OE1-NE1 3.01Å |
| 118 | N | 86.6 | Confident | 85.5 | Confident | 72 Ų | 72 | 62.6 Ų | 62.6 | 39% | 0.385 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -64.5 | -29.9 | 178.4 | -75.6 | -36.6 | 0 | 0 | 0 | 113.1 | D114 L115 K148 | D114-N118 WeakPolarHBondContact O-CB 3.49Å; D114-N118 PolarHBondContact O-N 3.09Å; D114-N118 PolarHBondContact O-ND2 3.22Å; L115-N118 PolarHBondContact O-N 2.95Å; N118-K148 WeakPolarHBondContact OD1-CB 3.32Å |
| 119 | T | 85.3 | Confident | 83.6 | Confident | 98 Ų | 98 | 64.4 Ų | 64.4 | 60% | 0.601 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -89.3 | -32.7 | -178.7 | 49.7 | 0 | 0 | 0 | 0 | 113.6 | L115 L116 E117 | L115-T119 HydrophobicContact CD1-CG2 4.34Å; L115-T119 WeakPolarHBondContact O-CB 3.39Å; L115-T119 VanDerWaalsContact O-CG2 3.29Å; L115-T119 WeakPolarHBondContact O-CG2 3.42Å; L115-T119 PolarHBondContact O-N 3.28Å; L115-T119 PolarHBondContact O-OG1 3.24Å; L116-T119 WeakPolarHBondContact CA-OG1 3.49Å; L116-T119 PolarHBondContact O-N 2.75Å; L116-T119 PolarHBondContact O-OG1 3.26Å; E117-T119 VanDerWaalsContact C-N 3.26Å; E117-T119 PolarHBondContact O-N 3.14Å |
| 120 | T | 85.3 | Confident | 81.6 | Confident | 75 Ų | 75 | 65.2 Ų | 65.2 | 46% | 0.46 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -94.4 | -20.1 | -178.6 | 59.1 | 0 | 0 | 0 | 0 | 113.1 | L116 | L116-T120 HydrophobicContact CD1-CG2 3.88Å; L116-T120 HydrophobicContact CG-CG2 4.18Å; L116-T120 WeakPolarHBondContact O-CB 3.32Å; L116-T120 WeakPolarHBondContact O-CG2 3.3Å; L116-T120 PolarHBondContact O-N 2.91Å; L116-T120 PolarHBondContact O-OG1 3.13Å |
| 121 | G | 83.9 | Confident | 79.3 | Confident | 12 Ų | 12 | 70.5 Ų | 70.5 | 12% | 0.124 | 42% | 0.423 | C | S | . | . | trans | -76.1 | 161 | -179.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | E117 W158 R159 | E117-G121 WeakPolarHBondContact O-CA 3.37Å; E117-G121 PolarHBondContact O-N 3.35Å; G121-W158 VanDerWaalsContact C-CZ2 3.48Å; G121-R159 VanDerWaalsContact CA-O 3.28Å; G121-R159 WeakPolarHBondContact CA-O 3.38Å | ||
| 122 | S | 85.4 | Confident | 77.3 | Confident | 39 Ų | 39 | 74.9 Ų | 74.9 | 27% | 0.273 | 44% | 0.437 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.9 | 144.4 | 179.3 | -71.5 | 0 | 0 | 0 | 0 | 110.2 | Y124 L142 R159 | S122-Y124 WeakPolarHBondContact O-CD2 3.41Å; S122-Y124 WeakPolarHBondContact O-CE2 3.44Å; S122-L142 VanDerWaalsContact CB-CD1 3.47Å; S122-R159 PolarHBondContact N-O 3.35Å; S122-R159 PolarHBondContact O-N 3.36Å |
| 123 | C | 86.4 | Confident | 75.2 | Confident | 1 Ų | 1 | 76.4 Ų | 76.4 | 1% | 0.007 | 45% | 0.451 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.6 | 135.2 | 177 | -169.2 | 0 | 0 | 0 | 0 | 110.6 | K143 C151 M156 W158 | C123-K143 PolarHBondContact O-N 3.47Å; C123-C151 VanDerWaalsContact CA-SG 3.51Å; C123-C151 HydrophobicContact CB-CB 3.69Å; C123-C151 WeakPolarHBondContact CB-SG 3.3Å; C123-C151 VanDerWaalsContact SG-CA 3.57Å; C123-C151 WeakPolarHBondContact SG-CB 3.5Å; C123-C151 CovalentContact SG-SG 2.03Å; C123-C151 PolarHBondContact SG-SG 3.19Å; C123-M156 VanDerWaalsContact SG-CB 3.53Å; C123-M156 WeakPolarHBondContact SG-CE 3.47Å; C123-W158 HydrophobicContact CB-CE3 4.09Å; C123-W158 HydrophobicContact CB-CZ3 4.17Å |
| 124 | Y | 83.4 | Confident | 73 | Confident | 55 Ų | 55 | 81.7 Ų | 81.7 | 22% | 0.216 | 48% | 0.484 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.3 | 125.8 | -179.8 | -64.6 | -86 | 0 | 0 | 0 | 111.2 | S122 L140 V141 L142 M156 V157 R159 | S122-Y124 WeakPolarHBondContact O-CD2 3.41Å; S122-Y124 WeakPolarHBondContact O-CE2 3.44Å; Y124-L140 HydrophobicContact CD1-CB 3.82Å; Y124-L140 HydrophobicContact CD1-CD1 4.44Å; Y124-L140 HydrophobicContact CG-CB 4.22Å; Y124-L140 HydrophobicContact CG-CD1 4.3Å; Y124-V141 WeakPolarHBondContact CA-O 3.28Å; Y124-L142 HydrophobicContact CD1-CD1 4.4Å; Y124-L142 HydrophobicContact CE1-CB 4.32Å; Y124-L142 HydrophobicContact CE1-CD1 3.85Å; Y124-M156 WeakPolarHBondContact O-CB 3.29Å; Y124-V157 WeakPolarHBondContact CB-O 3.35Å; Y124-V157 PolarHBondContact N-O 2.88Å; Y124-V157 PolarHBondContact O-N 3.49Å; Y124-R159 HydrophobicContact CD2-CB 4.14Å; Y124-R159 HydrophobicContact CD2-CG 3.95Å; Y124-R159 HydrophobicContact CE2-CB 3.72Å; Y124-R159 HydrophobicContact CE2-CG 3.93Å |
| 125 | E | 82.4 | Confident | 70.9 | Confident | 95 Ų | 95 | 82.3 Ų | 82.3 | 44% | 0.444 | 51% | 0.506 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.1 | 124.4 | 172.8 | -169.3 | 173.4 | 172 | 0 | 0 | 109.9 | L127 V141 M156 | E125-L127 PolarHBondContact O-N 2.97Å; E125-V141 HydrophobicContact CB-CB 4.5Å; E125-V141 PolarHBondContact N-O 2.99Å; E125-V141 PolarHBondContact O-N 3.37Å; E125-M156 HydrophobicContact CB-SD 4.03Å; E125-M156 HydrophobicContact CG-SD 4.32Å |
| 126 | P | 75.4 | Confident | 69.2 | Low | 54 Ų | 54 | 80.7 Ų | 80.7 | 35% | 0.351 | 51% | 0.514 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.1 | 111.5 | 177.3 | 29.4 | -31.6 | 0 | 0 | 0 | 110.9 | S128 L140 | P126-S128 PolarHBondContact O-N 2.92Å; P126-L140 HydrophobicContact CB-CD2 4.32Å |
| 127 | L | 70.8 | Confident | 67.5 | Low | 73 Ų | 73 | 85.4 Ų | 85.4 | 38% | 0.382 | 54% | 0.535 | S | S | . | . | trans | -76.8 | 118.3 | 178.9 | -136.6 | 75.9 | 0 | 0 | 0 | 110.5 | E125 L139 V141 | E125-L127 PolarHBondContact O-N 2.97Å; L127-L139 HydrophobicContact CB-CB 4.37Å; L127-L139 HydrophobicContact CB-CD2 4.5Å; L127-L139 HydrophobicContact CD2-CD2 3.87Å; L127-L139 PolarHBondContact N-O 3.48Å; L127-V141 HydrophobicContact CD1-CG2 3.87Å | ||
| 128 | S | 60.5 | Low | 66 | Low | 120 Ų | 120 | 89.2 Ų | 89.2 | 84% | 0.839 | 56% | 0.56 | S | S | * | * | trans | -96.9 | 23.2 | -177.8 | -65.5 | 0 | 0 | 0 | 0 | 114.6 | P126 | P126-S128 PolarHBondContact O-N 2.92Š| ||
| 129 | T | 53 | Low | 64.7 | Low | 117 Ų | 117 | 91.5 Ų | 91.5 | 72% | 0.718 | 57% | 0.572 | S | S | * | * | trans | -126.1 | 109.1 | -170.8 | 52.3 | 0 | 0 | 0 | 0 | 114 | ||||
| 130 | G | 51.5 | Low | 63.9 | Low | 69 Ų | 69 | 88.8 Ų | 88.8 | 71% | 0.711 | 55% | 0.554 | S | S | * | * | S | Bend | trans | 122.9 | 148.8 | 158.6 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||
| 131 | P | 45.2 | Very low | 63.4 | Low | 123 Ų | 123 | 88.3 Ų | 88.3 | 80% | 0.799 | 55% | 0.55 | S | S | * | * | S | Bend | trans | -63 | 145.6 | -151.8 | 29 | -35 | 0 | 0 | 0 | 113 | V133 | P131-V133 PolarHBondContact O-N 3.46Š|
| 132 | E | 49.3 | Very low | 63.1 | Low | 187 Ų | 187 | 91.3 Ų | 91.3 | 87% | 0.874 | 56% | 0.563 | S | S | * | * | trans | -30 | 98.4 | 178.2 | -62.7 | -168.2 | 152.3 | 0 | 0 | 113 | T134 | E132-T134 PolarHBondContact O-N 3.26Š| ||
| 133 | V | 49.5 | Very low | 62.4 | Low | 129 Ų | 129 | 93.5 Ų | 93.5 | 78% | 0.782 | 57% | 0.568 | S | S | * | * | trans | -69.6 | 95.7 | 156.4 | -178 | 0 | 0 | 0 | 0 | 104.9 | P131 G135 | P131-V133 PolarHBondContact O-N 3.46Å; V133-G135 PolarHBondContact O-N 2.92Å | ||
| 134 | T | 43.8 | Very low | 61.6 | Low | 135 Ų | 135 | 101.4 Ų | 101.4 | 83% | 0.828 | 61% | 0.605 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -36.3 | 99.4 | 164.9 | 40.1 | 0 | 0 | 0 | 0 | 109.9 | E132 | E132-T134 PolarHBondContact O-N 3.26Š|
| 135 | G | 46.3 | Very low | 60.7 | Low | 79 Ų | 79 | 102.9 Ų | 102.9 | 81% | 0.814 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 139.4 | 3.2 | 179.4 | 0 | 0 | 0 | 0 | 0 | 118.3 | V133 | V133-G135 PolarHBondContact O-N 2.92Š|
| 136 | G | 51.7 | Low | 60.1 | Low | 71 Ų | 71 | 101 Ų | 101 | 73% | 0.732 | 63% | 0.628 | S | S | * | * | trans | 71.9 | 51.4 | 146.1 | 0 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 137 | Q | 52.8 | Low | 60.4 | Low | 176 Ų | 176 | 100.5 Ų | 100.5 | 82% | 0.822 | 63% | 0.626 | S | S | * | * | trans | -139.1 | 130.7 | 152.7 | -68.6 | -167 | -32.5 | 0 | 0 | 110.2 | ||||
| 138 | P | 57.2 | Low | 61 | Low | 93 Ų | 93 | 99.7 Ų | 99.7 | 60% | 0.604 | 62% | 0.619 | S | S | * | * | trans | -63.3 | 138.5 | 176.6 | 26.4 | -32.9 | 0 | 0 | 0 | 109.9 | L140 | P138-L140 PolarHBondContact O-N 3.48Š| ||
| 139 | L | 59.8 | Low | 62.1 | Low | 121 Ų | 121 | 97 Ų | 97 | 63% | 0.634 | 60% | 0.6 | S | S | * | * | trans | -66.5 | 123 | 173.6 | -160.6 | 93.5 | 0 | 0 | 0 | 108.3 | L127 | L127-L139 HydrophobicContact CB-CB 4.37Å; L127-L139 HydrophobicContact CB-CD2 4.5Å; L127-L139 HydrophobicContact CD2-CD2 3.87Å; L127-L139 PolarHBondContact N-O 3.48Å | ||
| 140 | L | 68.1 | Low | 63.6 | Low | 41 Ų | 41 | 96.3 Ų | 96.3 | 22% | 0.215 | 59% | 0.589 | C | S | . | * | E | Extended strand (participates in β ladder) | trans | -111 | 120.4 | -177.3 | -69.7 | 179.8 | 0 | 0 | 0 | 109.2 | Y124 P126 P138 R159 | Y124-L140 HydrophobicContact CD1-CB 3.82Å; Y124-L140 HydrophobicContact CD1-CD1 4.44Å; Y124-L140 HydrophobicContact CG-CB 4.22Å; Y124-L140 HydrophobicContact CG-CD1 4.3Å; P126-L140 HydrophobicContact CB-CD2 4.32Å; P138-L140 PolarHBondContact O-N 3.48Å; L140-R159 VanDerWaalsContact CD1-CZ 3.43Å |
| 141 | V | 75.5 | Confident | 65.2 | Low | 64 Ų | 64 | 93 Ų | 93 | 39% | 0.388 | 56% | 0.555 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -90.2 | 124.5 | 175 | 175.6 | 0 | 0 | 0 | 0 | 109 | Y124 E125 L127 K143 | Y124-V141 WeakPolarHBondContact CA-O 3.28Å; E125-V141 HydrophobicContact CB-CB 4.5Å; E125-V141 PolarHBondContact N-O 2.99Å; E125-V141 PolarHBondContact O-N 3.37Å; L127-V141 HydrophobicContact CD1-CG2 3.87Å; V141-K143 PolarHBondContact O-N 2.98Å |
| 142 | L | 76.9 | Confident | 67.2 | Low | 75 Ų | 75 | 91.7 Ų | 91.7 | 39% | 0.393 | 54% | 0.541 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.6 | 123.9 | 177.3 | 179.1 | 67.4 | 0 | 0 | 0 | 109.8 | S122 Y124 E144 | S122-L142 VanDerWaalsContact CB-CD1 3.47Å; Y124-L142 HydrophobicContact CD1-CD1 4.4Å; Y124-L142 HydrophobicContact CE1-CB 4.32Å; Y124-L142 HydrophobicContact CE1-CD1 3.85Å; L142-E144 HydrophobicContact CD2-CG 4.02Å; L142-E144 HydrophobicContact CG-CG 4.13Å |
| 143 | K | 71.7 | Confident | 69 | Low | 85 Ų | 85 | 91.2 Ų | 91.2 | 37% | 0.37 | 54% | 0.535 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -109 | 105.5 | 171.2 | -155.4 | -173.3 | -174.1 | -170.2 | 0 | 108.9 | C123 V141 E146 M156 | C123-K143 PolarHBondContact O-N 3.47Å; V141-K143 PolarHBondContact O-N 2.98Å; K143-E146 HydrophobicContact CD-CG 4.34Å; K143-E146 WeakPolarHBondContact CE-OE1 3.33Å; K143-E146 IonicContact NZ-OE1 3.64Å; K143-E146 PolarHBondContact NZ-OE1 3.46Å; K143-E146 IonicContact NZ-OE2 3.66Å; K143-M156 HydrophobicContact CD-CE 4.05Å; K143-M156 HydrophobicContact CD-SD 4.22Å |
| 144 | E | 68.7 | Low | 70.7 | Confident | 168 Ų | 168 | 88 Ų | 88 | 79% | 0.785 | 52% | 0.523 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76 | 139.1 | -179.3 | -69.9 | 173.4 | 171.2 | 0 | 0 | 111.1 | L142 | L142-E144 HydrophobicContact CD2-CG 4.02Å; L142-E144 HydrophobicContact CG-CG 4.13Å |
| 145 | G | 64.9 | Low | 72.5 | Confident | 86 Ų | 86 | 84.6 Ų | 84.6 | 89% | 0.887 | 51% | 0.514 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 94 | 4.2 | 166.7 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||
| 146 | E | 69.8 | Low | 74.3 | Confident | 56 Ų | 56 | 81.6 Ų | 81.6 | 26% | 0.262 | 48% | 0.479 | S | S | . | . | trans | -96.1 | 143.1 | 175.7 | -66.4 | -158.1 | 167.2 | 0 | 0 | 113.1 | K143 M156 W158 | K143-E146 HydrophobicContact CD-CG 4.34Å; K143-E146 WeakPolarHBondContact CE-OE1 3.33Å; K143-E146 IonicContact NZ-OE1 3.64Å; K143-E146 PolarHBondContact NZ-OE1 3.46Å; K143-E146 IonicContact NZ-OE2 3.66Å; E146-M156 WeakPolarHBondContact OE2-CE 3.5Å; E146-W158 WeakPolarHBondContact O-CZ3 3.29Å | ||
| 147 | S | 81.6 | Confident | 75.8 | Confident | 43 Ų | 43 | 81.3 Ų | 81.3 | 30% | 0.301 | 46% | 0.463 | S | S | . | . | trans | -71.1 | 153.7 | 173.8 | 68.9 | 0 | 0 | 0 | 0 | 111.4 | S149 E150 C151 | S147-S149 PolarHBondContact O-N 3.4Å; S147-S149 VanDerWaalsContact O-N 3.08Å; S147-S149 PolarHBondContact OG-OG 3.01Å; S147-E150 WeakPolarHBondContact CB-OE2 3.19Å; S147-E150 PolarHBondContact N-OE2 2.82Å; S147-E150 VanDerWaalsContact N-OE2 3.13Å; S147-E150 PolarHBondContact O-N 3.33Å; S147-E150 WeakPolarHBondContact OG-CG 3.41Å; S147-E150 PolarHBondContact OG-N 3.48Å; S147-E150 PolarHBondContact OG-OE2 3.17Å; S147-C151 WeakPolarHBondContact O-CB 3.47Å; S147-C151 PolarHBondContact O-N 3.38Å | ||
| 148 | K | 82.9 | Confident | 77.4 | Confident | 56 Ų | 56 | 73.9 Ų | 73.9 | 24% | 0.243 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -49.3 | -39.6 | 175.3 | -179 | 176 | 175.6 | 175.3 | 0 | 112.4 | E117 N118 L152 W158 | E117-K148 VanDerWaalsContact OE1-CE 3.32Å; E117-K148 WeakPolarHBondContact OE1-CE 3.26Å; E117-K148 IonicContact OE1-NZ 2.8Å; E117-K148 PolarHBondContact OE1-NZ 3.48Å; E117-K148 IonicContact OE2-NZ 2.67Å; E117-K148 PolarHBondContact OE2-NZ 3.21Å; N118-K148 WeakPolarHBondContact OD1-CB 3.32Å; K148-L152 HydrophobicContact CG-CD1 3.93Å; K148-L152 HydrophobicContact CG-CG 4.46Å; K148-L152 WeakPolarHBondContact O-CB 3.37Å; K148-L152 VanDerWaalsContact O-CG 3.27Å; K148-L152 WeakPolarHBondContact O-CG 3.5Å; K148-L152 PolarHBondContact O-N 3.38Å; K148-W158 HydrophobicContact CB-CD2 3.93Å; K148-W158 HydrophobicContact CB-CE3 4.19Å; K148-W158 HydrophobicContact CB-CG 4.46Å; K148-W158 HydrophobicContact CB-CH2 4.22Å; K148-W158 HydrophobicContact CB-CZ2 3.96Å; K148-W158 HydrophobicContact CB-CZ3 4.32Å; K148-W158 HydrophobicContact CD-CG 4.47Å; K148-W158 HydrophobicContact CG-CD2 3.99Å; K148-W158 HydrophobicContact CG-CG 3.97Å |
| 149 | S | 83.8 | Confident | 78.6 | Confident | 63 Ų | 63 | 75.9 Ų | 75.9 | 44% | 0.441 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -68.6 | -38.7 | -178.1 | 80.7 | 0 | 0 | 0 | 0 | 113.4 | S147 K153 | S147-S149 PolarHBondContact O-N 3.4Å; S147-S149 VanDerWaalsContact O-N 3.08Å; S147-S149 PolarHBondContact OG-OG 3.01Å; S149-K153 WeakPolarHBondContact O-CB 3.47Å; S149-K153 WeakPolarHBondContact O-CD 3.28Å; S149-K153 WeakPolarHBondContact O-CG 3.29Å; S149-K153 PolarHBondContact O-N 2.88Å; S149-K153 VanDerWaalsContact O-N 3.12Å |
| 150 | E | 84.5 | Confident | 79.5 | Confident | 102 Ų | 102 | 71.5 Ų | 71.5 | 48% | 0.477 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -72.4 | -41.8 | 177.3 | -71.1 | 160.2 | 157.5 | 0 | 0 | 110.1 | S147 L152 K153 A154 | S147-E150 WeakPolarHBondContact CB-OE2 3.19Å; S147-E150 PolarHBondContact N-OE2 2.82Å; S147-E150 VanDerWaalsContact N-OE2 3.13Å; S147-E150 PolarHBondContact O-N 3.33Å; S147-E150 WeakPolarHBondContact OG-CG 3.41Å; S147-E150 PolarHBondContact OG-N 3.48Å; S147-E150 PolarHBondContact OG-OE2 3.17Å; E150-L152 PolarHBondContact O-N 3.11Å; E150-K153 PolarHBondContact O-N 2.96Å; E150-A154 WeakPolarHBondContact O-CB 3.41Å; E150-A154 PolarHBondContact O-N 2.79Å |
| 151 | C | 85.9 | Confident | 80 | Confident | 0 Ų | 0 | 75.2 Ų | 75.2 | 0% | 0 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -55.9 | -51.8 | 175.8 | -175.4 | 0 | 0 | 0 | 0 | 112.2 | C123 S147 K153 A154 G155 M156 W158 | C123-C151 VanDerWaalsContact CA-SG 3.51Å; C123-C151 HydrophobicContact CB-CB 3.69Å; C123-C151 WeakPolarHBondContact CB-SG 3.3Å; C123-C151 VanDerWaalsContact SG-CA 3.57Å; C123-C151 WeakPolarHBondContact SG-CB 3.5Å; C123-C151 CovalentContact SG-SG 2.03Å; C123-C151 PolarHBondContact SG-SG 3.19Å; S147-C151 WeakPolarHBondContact O-CB 3.47Å; S147-C151 PolarHBondContact O-N 3.38Å; C151-K153 PolarHBondContact O-N 2.73Å; C151-A154 PolarHBondContact O-N 2.88Å; C151-G155 PolarHBondContact O-N 2.7Å; C151-M156 WeakPolarHBondContact O-CB 3.34Å; C151-M156 PolarHBondContact O-N 2.94Å; C151-M156 VanDerWaalsContact O-N 3.09Å; C151-W158 HydrophobicContact CB-CE3 3.84Å; C151-W158 HydrophobicContact CB-CZ3 4.31Å |
| 152 | L | 86.7 | Confident | 80.3 | Confident | 96 Ų | 96 | 76.6 Ų | 76.6 | 50% | 0.503 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -69.4 | -33.9 | -179.4 | -66.8 | 174.8 | 0 | 0 | 0 | 112.4 | K148 E150 A154 G155 W158 | K148-L152 HydrophobicContact CG-CD1 3.93Å; K148-L152 HydrophobicContact CG-CG 4.46Å; K148-L152 WeakPolarHBondContact O-CB 3.37Å; K148-L152 VanDerWaalsContact O-CG 3.27Å; K148-L152 WeakPolarHBondContact O-CG 3.5Å; K148-L152 PolarHBondContact O-N 3.38Å; E150-L152 PolarHBondContact O-N 3.11Å; L152-A154 VanDerWaalsContact C-N 3.29Å; L152-A154 PolarHBondContact O-N 3.22Å; L152-G155 PolarHBondContact O-N 3.04Å; L152-G155 VanDerWaalsContact O-N 3.15Å; L152-W158 HydrophobicContact CD2-CB 4.36Å |
| 153 | K | 87.9 | Confident | 81 | Confident | 176 Ų | 176 | 74 Ų | 74 | 77% | 0.765 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -65 | -33.9 | 173.8 | -79.9 | 172.4 | -176.6 | 174.5 | 0 | 112.2 | S149 E150 C151 G155 | S149-K153 WeakPolarHBondContact O-CB 3.47Å; S149-K153 WeakPolarHBondContact O-CD 3.28Å; S149-K153 WeakPolarHBondContact O-CG 3.29Å; S149-K153 PolarHBondContact O-N 2.88Å; S149-K153 VanDerWaalsContact O-N 3.12Å; E150-K153 PolarHBondContact O-N 2.96Å; C151-K153 PolarHBondContact O-N 2.73Å; K153-G155 PolarHBondContact O-N 3.37Å |
| 154 | A | 83.7 | Confident | 81.9 | Confident | 63 Ų | 63 | 70.7 Ų | 70.7 | 52% | 0.521 | 40% | 0.396 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.3 | 1.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | E150 C151 L152 M156 | E150-A154 WeakPolarHBondContact O-CB 3.41Å; E150-A154 PolarHBondContact O-N 2.79Å; C151-A154 PolarHBondContact O-N 2.88Å; L152-A154 VanDerWaalsContact C-N 3.29Å; L152-A154 PolarHBondContact O-N 3.22Å; A154-M156 HydrophobicContact CB-CE 3.42Å; A154-M156 VanDerWaalsContact CB-CE 3.42Å; A154-M156 HydrophobicContact CB-CG 4.08Å; A154-M156 HydrophobicContact CB-SD 4.41Å; A154-M156 PolarHBondContact O-N 2.93Å |
| 155 | G | 82.1 | Confident | 83 | Confident | 62 Ų | 62 | 66.3 Ų | 66.3 | 64% | 0.639 | 38% | 0.375 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 73.5 | 15.8 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | C151 L152 K153 | C151-G155 PolarHBondContact O-N 2.7Å; L152-G155 PolarHBondContact O-N 3.04Å; L152-G155 VanDerWaalsContact O-N 3.15Å; K153-G155 PolarHBondContact O-N 3.37Å |
| 156 | M | 84.2 | Confident | 84.3 | Confident | 16 Ų | 16 | 64.9 Ų | 64.9 | 8% | 0.079 | 35% | 0.347 | C | S | . | . | P | Polyproline II helix | trans | -89.2 | 166.8 | -179.7 | -62.5 | -172 | -75.4 | 0 | 0 | 111.5 | C123 Y124 E125 K143 E146 C151 A154 | C123-M156 VanDerWaalsContact SG-CB 3.53Å; C123-M156 WeakPolarHBondContact SG-CE 3.47Å; Y124-M156 WeakPolarHBondContact O-CB 3.29Å; E125-M156 HydrophobicContact CB-SD 4.03Å; E125-M156 HydrophobicContact CG-SD 4.32Å; K143-M156 HydrophobicContact CD-CE 4.05Å; K143-M156 HydrophobicContact CD-SD 4.22Å; E146-M156 WeakPolarHBondContact OE2-CE 3.5Å; C151-M156 WeakPolarHBondContact O-CB 3.34Å; C151-M156 PolarHBondContact O-N 2.94Å; C151-M156 VanDerWaalsContact O-N 3.09Å; A154-M156 HydrophobicContact CB-CE 3.42Å; A154-M156 VanDerWaalsContact CB-CE 3.42Å; A154-M156 HydrophobicContact CB-CG 4.08Å; A154-M156 HydrophobicContact CB-SD 4.41Å; A154-M156 PolarHBondContact O-N 2.93Å |
| 157 | V | 84.2 | Confident | 85.4 | Confident | 65 Ų | 65 | 62.2 Ų | 62.2 | 39% | 0.394 | 34% | 0.335 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.4 | 122.6 | -177.8 | -179.4 | 0 | 0 | 0 | 0 | 109.8 | Y124 | Y124-V157 WeakPolarHBondContact CB-O 3.35Å; Y124-V157 PolarHBondContact N-O 2.88Å; Y124-V157 PolarHBondContact O-N 3.49Å |
| 158 | W | 84.5 | Confident | 86 | Confident | 20 Ų | 20 | 60.1 Ų | 60.1 | 8% | 0.076 | 32% | 0.32 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.3 | 135.5 | 172.1 | -173 | -101.4 | 0 | 0 | 0 | 110.5 | E117 G121 C123 E146 K148 C151 L152 | E117-W158 WeakPolarHBondContact O-CZ2 3.32Å; E117-W158 PolarHBondContact OE1-NE1 3.01Å; G121-W158 VanDerWaalsContact C-CZ2 3.48Å; C123-W158 HydrophobicContact CB-CE3 4.09Å; C123-W158 HydrophobicContact CB-CZ3 4.17Å; E146-W158 WeakPolarHBondContact O-CZ3 3.29Å; K148-W158 HydrophobicContact CB-CD2 3.93Å; K148-W158 HydrophobicContact CB-CE3 4.19Å; K148-W158 HydrophobicContact CB-CG 4.46Å; K148-W158 HydrophobicContact CB-CH2 4.22Å; K148-W158 HydrophobicContact CB-CZ2 3.96Å; K148-W158 HydrophobicContact CB-CZ3 4.32Å; K148-W158 HydrophobicContact CD-CG 4.47Å; K148-W158 HydrophobicContact CG-CD2 3.99Å; K148-W158 HydrophobicContact CG-CG 3.97Å; C151-W158 HydrophobicContact CB-CE3 3.84Å; C151-W158 HydrophobicContact CB-CZ3 4.31Å; L152-W158 HydrophobicContact CD2-CB 4.36Å |
| 159 | R | 82.6 | Confident | 86.6 | Confident | 136 Ų | 136 | 58 Ų | 58 | 51% | 0.513 | 31% | 0.312 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -127 | 123.3 | 164.8 | -58.5 | 179.3 | 168.1 | 174.2 | -3 | 109.3 | G121 S122 Y124 L140 | G121-R159 VanDerWaalsContact CA-O 3.28Å; G121-R159 WeakPolarHBondContact CA-O 3.38Å; S122-R159 PolarHBondContact N-O 3.35Å; S122-R159 PolarHBondContact O-N 3.36Å; Y124-R159 HydrophobicContact CD2-CB 4.14Å; Y124-R159 HydrophobicContact CD2-CG 3.95Å; Y124-R159 HydrophobicContact CE2-CB 3.72Å; Y124-R159 HydrophobicContact CE2-CG 3.93Å; L140-R159 VanDerWaalsContact CD1-CZ 3.43Å |
| 160 | G | 79.6 | Confident | 87.1 | Confident | 29 Ų | 29 | 55.2 Ų | 55.2 | 30% | 0.299 | 29% | 0.292 | S | S | . | . | trans | -144.7 | 178.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | E162 | G160-E162 VanDerWaalsContact C-N 3.35Å; G160-E162 PolarHBondContact O-N 2.87Å | ||
| 161 | Y | 77.5 | Confident | 87.7 | Confident | 119 Ų | 119 | 50.4 Ų | 50.4 | 47% | 0.467 | 27% | 0.269 | S | S | . | . | trans | -75.4 | 89.8 | 173.8 | -168.1 | -99.3 | 0 | 0 | 0 | 109.9 | V163 L231 | Y161-V163 HydrophobicContact CD1-CG2 3.73Å; Y161-V163 HydrophobicContact CE1-CG2 3.51Å; Y161-L231 HydrophobicContact CE1-CD1 3.96Å; Y161-L231 HydrophobicContact CE2-CD1 4.13Å; Y161-L231 VanDerWaalsContact CZ-CD1 3.41Å; Y161-L231 WeakPolarHBondContact OH-CD1 3.43Å; Y161-L231 VanDerWaalsContact OH-CD2 3.32Å; Y161-L231 WeakPolarHBondContact OH-CD2 3.31Å | ||
| 162 | E | 83.8 | Confident | 88.1 | Confident | 93 Ų | 93 | 50.6 Ų | 50.6 | 44% | 0.435 | 27% | 0.27 | S | S | . | . | trans | -81.2 | 122 | 178.5 | -67.1 | -179.4 | -177.4 | 0 | 0 | 109.9 | G160 T228 | G160-E162 VanDerWaalsContact C-N 3.35Å; G160-E162 PolarHBondContact O-N 2.87Å; E162-T228 WeakPolarHBondContact O-CB 3.26Å; E162-T228 WeakPolarHBondContact O-CG2 3.44Å | ||
| 163 | V | 90.1 | Very high | 88.6 | Confident | 20 Ų | 20 | 46 Ų | 46 | 12% | 0.121 | 25% | 0.247 | C | C | . | . | trans | -103.7 | 136.8 | 170.1 | 177.9 | 0 | 0 | 0 | 0 | 108.3 | L113 Y161 E165 L231 L235 | L113-V163 HydrophobicContact CD1-CB 4.12Å; L113-V163 HydrophobicContact CD1-CG1 4.08Å; L113-V163 HydrophobicContact CD2-CB 4.04Å; L113-V163 HydrophobicContact CD2-CG1 4.46Å; L113-V163 HydrophobicContact CD2-CG2 3.86Å; Y161-V163 HydrophobicContact CD1-CG2 3.73Å; Y161-V163 HydrophobicContact CE1-CG2 3.51Å; V163-E165 PolarHBondContact O-N 2.91Å; V163-L231 HydrophobicContact CG1-CB 4.17Å; V163-L231 HydrophobicContact CG2-CB 4.42Å; V163-L235 HydrophobicContact CG1-CD1 3.94Å | ||
| 164 | S | 91.8 | Very high | 89 | Confident | 15 Ų | 15 | 37.7 Ų | 37.7 | 11% | 0.105 | 21% | 0.21 | C | C | . | . | trans | -73.9 | 99.8 | -178.3 | -172.4 | 0 | 0 | 0 | 0 | 111.6 | D166 V167 F168 T228 | S164-D166 VanDerWaalsContact C-N 3.3Å; S164-D166 PolarHBondContact O-N 3.26Å; S164-V167 PolarHBondContact O-N 2.84Å; S164-V167 WeakPolarHBondContact OG-CG2 3.39Å; S164-F168 PolarHBondContact O-N 3.27Å; S164-T228 PolarHBondContact N-O 3.21Å; S164-T228 VanDerWaalsContact N-O 3.11Å | ||
| 165 | E | 91.3 | Very high | 89.5 | Confident | 77 Ų | 77 | 34.8 Ų | 34.8 | 36% | 0.36 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -61 | -36.8 | 174.4 | -68.8 | 176.6 | -134.7 | 0 | 0 | 112.8 | V163 F168 L169 | V163-E165 PolarHBondContact O-N 2.91Å; E165-F168 WeakPolarHBondContact O-CB 3.1Å; E165-F168 PolarHBondContact O-N 3.49Å; E165-L169 WeakPolarHBondContact O-CB 3.26Å; E165-L169 PolarHBondContact O-N 3.39Å |
| 166 | D | 91.3 | Very high | 90.1 | Very high | 55 Ų | 55 | 31.9 Ų | 31.9 | 29% | 0.294 | 16% | 0.156 | S | C | . | . | H | α-helix | trans | -61.9 | -46.5 | 178.9 | -68.9 | -36.9 | 0 | 0 | 0 | 111.2 | S164 L170 L219 | S164-D166 VanDerWaalsContact C-N 3.3Å; S164-D166 PolarHBondContact O-N 3.26Å; D166-L170 WeakPolarHBondContact O-CB 3.37Å; D166-L170 WeakPolarHBondContact O-CG 3.34Å; D166-L170 PolarHBondContact O-N 3.32Å; D166-L219 HydrophobicContact CB-CD1 4.36Å; D166-L219 HydrophobicContact CB-CD2 3.95Å |
| 167 | V | 93.6 | Very high | 90.7 | Very high | 0 Ų | 0 | 31.1 Ų | 31.1 | 0% | 0 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -67.1 | -40.2 | 177 | 177.1 | 0 | 0 | 0 | 0 | 110.9 | L35 S164 L170 C171 L216 L219 Q229 | L35-V167 HydrophobicContact CD2-CG1 3.46Å; L35-V167 VanDerWaalsContact CD2-CG1 3.46Å; S164-V167 PolarHBondContact O-N 2.84Å; S164-V167 WeakPolarHBondContact OG-CG2 3.39Å; V167-L170 PolarHBondContact O-N 2.84Å; V167-C171 VanDerWaalsContact O-CB 3.3Å; V167-C171 WeakPolarHBondContact O-CB 3.29Å; V167-C171 PolarHBondContact O-N 3.44Å; V167-C171 PolarHBondContact O-SG 3.37Å; V167-L216 HydrophobicContact CB-CD1 4.49Å; V167-L216 HydrophobicContact CG1-CD1 3.92Å; V167-L216 HydrophobicContact CG2-CD1 4.28Å; V167-L219 HydrophobicContact CG2-CD2 3.32Å; V167-Q229 WeakPolarHBondContact CG1-O 3.3Å; V167-Q229 HydrophobicContact CG2-CB 4.02Å; V167-Q229 HydrophobicContact CG2-CG 3.87Å |
| 168 | F | 94.9 | Very high | 91.1 | Very high | 0 Ų | 0 | 28.3 Ų | 28.3 | 0% | 0 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -56.7 | -53.1 | 175.6 | 169.8 | -137.6 | 0 | 0 | 0 | 111.6 | W106 F109 S164 E165 C171 L172 G232 L235 G236 | W106-F168 AromaticContact CD1-CD1 3.81Å; W106-F168 AromaticContact CD1-CE1 3.46Å; W106-F168 VanDerWaalsContact CD1-CE1 3.46Å; W106-F168 HydrophobicContact CG-CE1 4.38Å; F109-F168 HydrophobicContact CB-CE1 3.56Å; F109-F168 HydrophobicContact CB-CZ 3.75Å; F109-F168 AromaticContact CD2-CZ 3.89Å; F109-F168 HydrophobicContact CD2-CZ 3.89Å; F109-F168 HydrophobicContact CG-CE1 4.32Å; F109-F168 HydrophobicContact CG-CZ 4.02Å; S164-F168 PolarHBondContact O-N 3.27Å; E165-F168 WeakPolarHBondContact O-CB 3.1Å; E165-F168 PolarHBondContact O-N 3.49Å; F168-C171 PolarHBondContact O-N 2.6Å; F168-L172 WeakPolarHBondContact O-CB 3.43Å; F168-L172 PolarHBondContact O-N 3.45Å; F168-G232 VanDerWaalsContact CA-O 3.28Å; F168-G232 WeakPolarHBondContact CA-O 3.38Å; F168-G232 WeakPolarHBondContact CB-O 3.42Å; F168-L235 HydrophobicContact CD2-CB 3.86Å; F168-L235 HydrophobicContact CE2-CB 4.04Å; F168-L235 HydrophobicContact CG-CB 4.46Å; F168-G236 VanDerWaalsContact CD2-N 3.31Å |
| 169 | L | 94.9 | Very high | 91.6 | Very high | 11 Ų | 11 | 28.5 Ų | 28.5 | 6% | 0.058 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -61 | -48.7 | 179.6 | 176 | 60 | 0 | 0 | 0 | 111.6 | W67 W106 E165 C171 L172 C173 | W67-L169 HydrophobicContact CB-CD1 3.99Å; W67-L169 HydrophobicContact CE3-CD1 4.1Å; W106-L169 HydrophobicContact CD2-CD1 4.16Å; W106-L169 HydrophobicContact CG-CD1 4.37Å; W106-L169 HydrophobicContact CZ2-CD1 4.31Å; W106-L169 HydrophobicContact CZ2-CD2 4.12Å; E165-L169 WeakPolarHBondContact O-CB 3.26Å; E165-L169 PolarHBondContact O-N 3.39Å; L169-C171 VanDerWaalsContact C-N 3.34Å; L169-C171 PolarHBondContact O-N 3.01Å; L169-L172 PolarHBondContact O-N 3.24Å; L169-C173 WeakPolarHBondContact O-CB 3.39Å; L169-C173 PolarHBondContact O-N 2.85Å; L169-C173 PolarHBondContact O-SG 3.02Å; L169-C173 VanDerWaalsContact O-SG 3.39Å |
| 170 | L | 94.9 | Very high | 92.1 | Very high | 5 Ų | 5 | 22.2 Ų | 22.2 | 3% | 0.026 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -60.1 | -43.5 | 179.9 | -77.9 | 174.3 | 0 | 0 | 0 | 112.3 | L63 D166 V167 C173 C174 W212 L215 L216 L219 | L63-L170 HydrophobicContact CD2-CD1 3.61Å; L63-L170 HydrophobicContact CD2-CD2 4.12Å; L63-L170 HydrophobicContact CD2-CG 4.04Å; D166-L170 WeakPolarHBondContact O-CB 3.37Å; D166-L170 WeakPolarHBondContact O-CG 3.34Å; D166-L170 PolarHBondContact O-N 3.32Å; V167-L170 PolarHBondContact O-N 2.84Å; L170-C173 PolarHBondContact O-N 3.49Å; L170-C174 WeakPolarHBondContact O-CB 3.21Å; L170-C174 PolarHBondContact O-N 2.8Å; L170-C174 PolarHBondContact O-SG 2.89Å; L170-W212 HydrophobicContact CD2-CB 4.19Å; L170-W212 HydrophobicContact CD2-CD2 4.05Å; L170-W212 HydrophobicContact CD2-CE3 3.43Å; L170-W212 VanDerWaalsContact CD2-CE3 3.43Å; L170-W212 HydrophobicContact CD2-CG 4.38Å; L170-W212 HydrophobicContact CD2-CZ3 4.23Å; L170-L215 HydrophobicContact CD1-CB 4.39Å; L170-L215 HydrophobicContact CD2-CB 4.36Å; L170-L216 HydrophobicContact CD1-CB 4.13Å; L170-L216 HydrophobicContact CD1-CD1 4.37Å; L170-L219 HydrophobicContact CD1-CD1 4.36Å |
| 171 | C | 95.8 | Very high | 92.7 | Very high | 0 Ų | 0 | 20.9 Ų | 20.9 | 0% | 0 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -64.8 | -44.6 | 178.5 | -71.7 | 0 | 0 | 0 | 0 | 111.4 | L31 V167 F168 L169 C174 L175 | L31-C171 HydrophobicContact CD2-CB 3.85Å; V167-C171 VanDerWaalsContact O-CB 3.3Å; V167-C171 WeakPolarHBondContact O-CB 3.29Å; V167-C171 PolarHBondContact O-N 3.44Å; V167-C171 PolarHBondContact O-SG 3.37Å; F168-C171 PolarHBondContact O-N 2.6Å; L169-C171 VanDerWaalsContact C-N 3.34Å; L169-C171 PolarHBondContact O-N 3.01Å; C171-C174 PolarHBondContact O-N 2.96Å; C171-L175 VanDerWaalsContact O-CG 3.32Å; C171-L175 WeakPolarHBondContact O-CG 3.47Å; C171-L175 PolarHBondContact O-N 3.06Å |
| 172 | L | 95.6 | Very high | 93.3 | Very high | 4 Ų | 4 | 15.3 Ų | 15.3 | 2% | 0.021 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -60 | -46.7 | 176 | -177.4 | 63.9 | 0 | 0 | 0 | 111.4 | W106 F168 L169 L175 L176 | W106-L172 HydrophobicContact CB-CD2 3.82Å; W106-L172 HydrophobicContact CG-CD2 4.48Å; F168-L172 WeakPolarHBondContact O-CB 3.43Å; F168-L172 PolarHBondContact O-N 3.45Å; L169-L172 PolarHBondContact O-N 3.24Å; L172-L175 PolarHBondContact O-N 3.48Å; L172-L176 VanDerWaalsContact O-CB 3.23Å; L172-L176 WeakPolarHBondContact O-CB 3.19Å; L172-L176 PolarHBondContact O-N 3.47Å |
| 173 | C | 95.6 | Very high | 93.6 | Very high | 1 Ų | 1 | 11.4 Ų | 11.4 | 1% | 0.007 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -61 | -44.4 | 176.9 | -76.4 | 0 | 0 | 0 | 0 | 112.4 | T70 L169 L170 L176 L177 | T70-C173 HydrophobicContact CG2-CB 4.5Å; T70-C173 PolarHBondContact OG1-SG 3.05Å; T70-C173 VanDerWaalsContact OG1-SG 3.38Å; L169-C173 WeakPolarHBondContact O-CB 3.39Å; L169-C173 PolarHBondContact O-N 2.85Å; L169-C173 PolarHBondContact O-SG 3.02Å; L169-C173 VanDerWaalsContact O-SG 3.39Å; L170-C173 PolarHBondContact O-N 3.49Å; C173-L176 PolarHBondContact O-N 3.04Å; C173-L177 WeakPolarHBondContact O-CB 3.38Å; C173-L177 PolarHBondContact O-N 3.36Å |
| 174 | C | 96.3 | Very high | 93.6 | Very high | 0 Ų | 0 | 10.5 Ų | 10.5 | 0% | 0 | 6% | 0.055 | C | C | . | . | H | α-helix | trans | -60.3 | -49.3 | 177.5 | -71.7 | 0 | 0 | 0 | 0 | 111.8 | F27 L170 C171 L177 A178 L209 W212 | F27-C174 HydrophobicContact CE1-CB 4.2Å; F27-C174 HydrophobicContact CZ-CB 4.21Å; L170-C174 WeakPolarHBondContact O-CB 3.21Å; L170-C174 PolarHBondContact O-N 2.8Å; L170-C174 PolarHBondContact O-SG 2.89Å; C171-C174 PolarHBondContact O-N 2.96Å; C174-L177 PolarHBondContact O-N 2.96Å; C174-A178 WeakPolarHBondContact O-CB 3.28Å; C174-A178 PolarHBondContact O-N 3.44Å; C174-L209 HydrophobicContact CB-CD1 3.99Å; C174-L209 WeakPolarHBondContact O-CD1 3.24Å; C174-W212 WeakPolarHBondContact SG-CB 3.42Å |
| 175 | L | 95.1 | Very high | 93.5 | Very high | 2 Ų | 2 | 10 Ų | 10 | 1% | 0.01 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -65.6 | -41.9 | -178.9 | -68.3 | 171 | 0 | 0 | 0 | 111.6 | F27 H28 L31 C171 L172 E179 W240 | F27-L175 HydrophobicContact CD1-CD2 3.86Å; F27-L175 HydrophobicContact CE1-CD2 4.07Å; H28-L175 HydrophobicContact CB-CD2 3.92Å; L31-L175 HydrophobicContact CD2-CD1 4.04Å; L31-L175 HydrophobicContact CD2-CD2 4.01Å; L31-L175 HydrophobicContact CD2-CG 3.76Å; C171-L175 VanDerWaalsContact O-CG 3.32Å; C171-L175 WeakPolarHBondContact O-CG 3.47Å; C171-L175 PolarHBondContact O-N 3.06Å; L172-L175 PolarHBondContact O-N 3.48Å; L175-E179 WeakPolarHBondContact O-CB 3.12Å; L175-E179 PolarHBondContact O-N 3.33Å; L175-W240 HydrophobicContact CB-CB 3.97Å; L175-W240 HydrophobicContact CB-CD2 4.27Å; L175-W240 HydrophobicContact CB-CG 3.68Å; L175-W240 HydrophobicContact CD1-CB 3.59Å; L175-W240 HydrophobicContact CD1-CD2 4.13Å; L175-W240 HydrophobicContact CD1-CE3 4.27Å; L175-W240 HydrophobicContact CD1-CG 3.84Å; L175-W240 HydrophobicContact CD2-CD2 4.29Å; L175-W240 HydrophobicContact CD2-CE3 4.47Å; L175-W240 HydrophobicContact CG-CB 4.38Å; L175-W240 HydrophobicContact CG-CD2 4.47Å; L175-W240 HydrophobicContact CG-CG 4.22Å |
| 176 | L | 95 | Very high | 93.2 | Very high | 1 Ų | 1 | 7.8 Ų | 7.8 | 1% | 0.005 | 5% | 0.045 | C | C | . | . | H | α-helix | trans | -62.1 | -48.3 | 175.3 | -176.3 | 149.7 | 0 | 0 | 0 | 111.2 | W67 T70 V74 L99 A102 L172 C173 A178 E179 E180 | W67-L176 HydrophobicContact CH2-CD1 4.11Å; W67-L176 HydrophobicContact CZ3-CD1 4.29Å; T70-L176 HydrophobicContact CG2-CD2 3.92Å; V74-L176 HydrophobicContact CB-CD2 4.45Å; V74-L176 HydrophobicContact CG1-CD2 4.01Å; V74-L176 HydrophobicContact CG2-CD2 4.41Å; L99-L176 HydrophobicContact CD1-CD2 4.49Å; L99-L176 HydrophobicContact CG-CD2 4.45Å; A102-L176 HydrophobicContact CB-CD1 3.62Å; L172-L176 VanDerWaalsContact O-CB 3.23Å; L172-L176 WeakPolarHBondContact O-CB 3.19Å; L172-L176 PolarHBondContact O-N 3.47Å; C173-L176 PolarHBondContact O-N 3.04Å; L176-A178 PolarHBondContact O-N 2.97Å; L176-E179 PolarHBondContact O-N 2.86Å; L176-E180 HydrophobicContact CD2-CG 4.17Å; L176-E180 HydrophobicContact CG-CG 4.39Å; L176-E180 WeakPolarHBondContact O-CB 3.23Å; L176-E180 WeakPolarHBondContact O-CG 3.36Å; L176-E180 PolarHBondContact O-N 3.48Å |
| 177 | L | 95.5 | Very high | 93 | Very high | 0 Ų | 0 | 5.8 Ų | 5.8 | 0% | 0 | 3% | 0.033 | C | C | . | . | H | α-helix | trans | -58 | -51 | 177.6 | -114.9 | 85.3 | 0 | 0 | 0 | 111.2 | T70 V74 C173 C174 E179 E180 T181 C205 L208 L209 | T70-L177 HydrophobicContact CG2-CD1 3.55Å; V74-L177 HydrophobicContact CG2-CD1 3.25Å; V74-L177 HydrophobicContact CG2-CG 3.58Å; C173-L177 WeakPolarHBondContact O-CB 3.38Å; C173-L177 PolarHBondContact O-N 3.36Å; C174-L177 PolarHBondContact O-N 2.96Å; L177-E179 VanDerWaalsContact C-N 3.29Å; L177-E179 PolarHBondContact O-N 3.41Å; L177-E180 PolarHBondContact O-N 3.43Å; L177-T181 VanDerWaalsContact O-CB 3.29Å; L177-T181 WeakPolarHBondContact O-CB 3.38Å; L177-T181 VanDerWaalsContact O-CG2 3.26Å; L177-T181 WeakPolarHBondContact O-CG2 3.23Å; L177-T181 PolarHBondContact O-N 2.92Å; L177-T181 PolarHBondContact O-OG1 3.42Å; L177-C205 HydrophobicContact CD2-CB 4.41Å; L177-C205 WeakPolarHBondContact CD2-O 3.48Å; L177-L208 HydrophobicContact CD1-CD2 4.19Å; L177-L208 HydrophobicContact CD2-CB 4.09Å; L177-L208 HydrophobicContact CD2-CD2 4.24Å; L177-L208 HydrophobicContact CD2-CG 4.41Å; L177-L209 HydrophobicContact CB-CD1 4.09Å; L177-L209 HydrophobicContact CD2-CB 3.62Å |
| 178 | A | 94.5 | Very high | 92.7 | Very high | 7 Ų | 7 | 7.4 Ų | 7.4 | 6% | 0.058 | 4% | 0.042 | C | C | . | . | H | α-helix | trans | -59 | -42.6 | -177.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | F23 F27 C174 L176 T181 S182 L209 | F23-A178 HydrophobicContact CE1-CB 4.21Å; F27-A178 HydrophobicContact CD1-CB 3.51Å; F27-A178 HydrophobicContact CE1-CB 3.55Å; F27-A178 HydrophobicContact CG-CB 4.11Å; F27-A178 HydrophobicContact CZ-CB 4.16Å; C174-A178 WeakPolarHBondContact O-CB 3.28Å; C174-A178 PolarHBondContact O-N 3.44Å; L176-A178 PolarHBondContact O-N 2.97Å; A178-T181 PolarHBondContact O-OG1 3.49Å; A178-S182 VanDerWaalsContact O-CB 3.23Å; A178-S182 WeakPolarHBondContact O-CB 3.29Å; A178-S182 PolarHBondContact O-N 3.4Å; A178-L209 HydrophobicContact CB-CD2 4.43Å |
| 179 | E | 93.2 | Very high | 92.3 | Very high | 24 Ų | 24 | 16.1 Ų | 16.1 | 11% | 0.112 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -71.1 | -47 | -178.4 | -164.7 | 67.1 | -160.6 | 0 | 0 | 112.1 | L175 L176 L177 T181 S182 Y244 P260 | L175-E179 WeakPolarHBondContact O-CB 3.12Å; L175-E179 PolarHBondContact O-N 3.33Å; L176-E179 PolarHBondContact O-N 2.86Å; L177-E179 VanDerWaalsContact C-N 3.29Å; L177-E179 PolarHBondContact O-N 3.41Å; E179-T181 PolarHBondContact O-N 3.19Å; E179-S182 PolarHBondContact O-N 3.04Å; E179-S182 PolarHBondContact O-OG 3.24Å; E179-Y244 HydrophobicContact CB-CD1 4.21Å; E179-Y244 HydrophobicContact CB-CE1 4.12Å; E179-Y244 HydrophobicContact CG-CD1 3.39Å; E179-Y244 HydrophobicContact CG-CE1 3.68Å; E179-Y244 HydrophobicContact CG-CG 3.97Å; E179-P260 HydrophobicContact CG-CG 4.14Å |
| 180 | E | 93 | Very high | 91.7 | Very high | 3 Ų | 3 | 18.7 Ų | 18.7 | 1% | 0.014 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -66.1 | -38.1 | -179.9 | -67.1 | -63.7 | 153.3 | 0 | 0 | 112.4 | V74 V78 R98 L176 L177 Y244 | V74-E180 HydrophobicContact CG1-CB 3.74Å; V74-E180 HydrophobicContact CG1-CG 3.91Å; V78-E180 HydrophobicContact CG2-CB 4.3Å; V78-E180 HydrophobicContact CG2-CG 4.47Å; V78-E180 WeakPolarHBondContact CG2-OE2 3.32Å; R98-E180 IonicContact CZ-OE1 3.48Å; R98-E180 IonicContact CZ-OE2 3.39Å; R98-E180 IonicContact NE-OE1 2.79Å; R98-E180 PolarHBondContact NE-OE1 3.08Å; R98-E180 IonicContact NE-OE2 3.42Å; R98-E180 PolarHBondContact NE-OE2 3.45Å; R98-E180 IonicContact NH2-OE1 3.58Å; R98-E180 IonicContact NH2-OE2 2.67Å; R98-E180 PolarHBondContact NH2-OE2 2.83Å; L176-E180 HydrophobicContact CD2-CG 4.17Å; L176-E180 HydrophobicContact CG-CG 4.39Å; L176-E180 WeakPolarHBondContact O-CB 3.23Å; L176-E180 WeakPolarHBondContact O-CG 3.36Å; L176-E180 PolarHBondContact O-N 3.48Å; L177-E180 PolarHBondContact O-N 3.43Å; E180-Y244 WeakPolarHBondContact OE1-CE1 3.06Å; E180-Y244 PolarHBondContact OE1-OH 3.32Å |
| 181 | T | 92.7 | Very high | 91 | Very high | 2 Ų | 2 | 20.9 Ų | 20.9 | 1% | 0.012 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -80.2 | -23.4 | -179.6 | 58.8 | 0 | 0 | 0 | 0 | 113.3 | L18 F77 L177 A178 E179 V183 F184 C205 | L18-T181 VanDerWaalsContact CD2-OG1 3.28Å; L18-T181 WeakPolarHBondContact CD2-OG1 3.38Å; F77-T181 HydrophobicContact CE1-CG2 4.47Å; L177-T181 VanDerWaalsContact O-CB 3.29Å; L177-T181 WeakPolarHBondContact O-CB 3.38Å; L177-T181 VanDerWaalsContact O-CG2 3.26Å; L177-T181 WeakPolarHBondContact O-CG2 3.23Å; L177-T181 PolarHBondContact O-N 2.92Å; L177-T181 PolarHBondContact O-OG1 3.42Å; A178-T181 PolarHBondContact O-OG1 3.49Å; E179-T181 PolarHBondContact O-N 3.19Å; T181-V183 PolarHBondContact O-N 2.92Å; T181-F184 WeakPolarHBondContact O-CB 3.38Å; T181-F184 PolarHBondContact O-N 2.96Å; T181-F184 VanDerWaalsContact O-N 3.11Å; T181-C205 HydrophobicContact CG2-CB 3.66Å |
| 182 | S | 91.1 | Very high | 90.3 | Very high | 2 Ų | 2 | 21.4 Ų | 21.4 | 1% | 0.014 | 12% | 0.118 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -60.5 | -19.6 | 179.2 | 72.6 | 0 | 0 | 0 | 0 | 114.1 | L18 A178 E179 F184 P186 | L18-S182 WeakPolarHBondContact O-CB 3.44Å; A178-S182 VanDerWaalsContact O-CB 3.23Å; A178-S182 WeakPolarHBondContact O-CB 3.29Å; A178-S182 PolarHBondContact O-N 3.4Å; E179-S182 PolarHBondContact O-N 3.04Å; E179-S182 PolarHBondContact O-OG 3.24Å; S182-F184 VanDerWaalsContact C-N 3.26Å; S182-F184 PolarHBondContact O-N 2.67Å; S182-P186 WeakPolarHBondContact O-CD 3.29Å |
| 183 | V | 90.2 | Very high | 89.6 | Confident | 11 Ų | 11 | 25.7 Ų | 25.7 | 7% | 0.067 | 14% | 0.144 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -69.6 | -25.2 | 179.1 | -175.9 | 0 | 0 | 0 | 0 | 112.2 | L81 T181 G185 P186 Y187 P260 | L81-V183 HydrophobicContact CD2-CG1 4.37Å; T181-V183 PolarHBondContact O-N 2.92Å; V183-G185 PolarHBondContact O-N 2.94Å; V183-P186 WeakPolarHBondContact O-CD 3.45Å; V183-Y187 WeakPolarHBondContact O-CB 3.49Å; V183-Y187 PolarHBondContact O-N 3.26Å; V183-Y187 VanDerWaalsContact O-N 3.12Å; V183-P260 HydrophobicContact CG2-CB 3.36Å |
| 184 | F | 90.3 | Very high | 89 | Confident | 0 Ų | 0 | 26.7 Ų | 26.7 | 0% | 0 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -66.7 | -38.1 | -173.9 | -164.4 | -125.3 | 0 | 0 | 0 | 113.1 | A15 F77 L81 T181 S182 Y187 L188 S194 L198 R199 F202 | A15-F184 HydrophobicContact CB-CD1 3.74Å; A15-F184 HydrophobicContact CB-CE1 4.33Å; F77-F184 HydrophobicContact CE2-CD2 4.11Å; F77-F184 HydrophobicContact CE2-CG 4.33Å; F77-F184 HydrophobicContact CZ-CB 3.97Å; F77-F184 HydrophobicContact CZ-CD2 4.14Å; F77-F184 HydrophobicContact CZ-CG 4.2Å; L81-F184 HydrophobicContact CD1-CD2 4.39Å; T181-F184 WeakPolarHBondContact O-CB 3.38Å; T181-F184 PolarHBondContact O-N 2.96Å; T181-F184 VanDerWaalsContact O-N 3.11Å; S182-F184 VanDerWaalsContact C-N 3.26Å; S182-F184 PolarHBondContact O-N 2.67Å; F184-Y187 AromaticContact CD2-CD1 3.96Å; F184-Y187 HydrophobicContact CD2-CD1 3.96Å; F184-Y187 AromaticContact CE2-CD1 3.98Å; F184-Y187 HydrophobicContact CE2-CD1 3.98Å; F184-Y187 HydrophobicContact CE2-CE1 4.3Å; F184-Y187 WeakPolarHBondContact O-CB 3.33Å; F184-Y187 PolarHBondContact O-N 3.2Å; F184-L188 HydrophobicContact CD1-CD1 3.98Å; F184-L188 HydrophobicContact CD1-CG 4.41Å; F184-L188 HydrophobicContact CE1-CD1 3.61Å; F184-L188 HydrophobicContact CE1-CD2 4.44Å; F184-L188 HydrophobicContact CE1-CG 4.14Å; F184-L188 HydrophobicContact CE2-CD2 4.22Å; F184-L188 HydrophobicContact CE2-CG 4.31Å; F184-L188 HydrophobicContact CZ-CD1 3.98Å; F184-L188 HydrophobicContact CZ-CD2 3.96Å; F184-L188 HydrophobicContact CZ-CG 4.08Å; F184-L188 WeakPolarHBondContact O-CG 3.37Å; F184-L188 PolarHBondContact O-N 3.43Å; F184-S194 WeakPolarHBondContact CZ-OG 3.28Å; F184-L198 HydrophobicContact CE2-CD2 3.81Å; F184-L198 HydrophobicContact CE2-CG 3.95Å; F184-L198 HydrophobicContact CZ-CG 4.44Å; F184-R199 HydrophobicContact CZ-CG 4.39Å; F184-F202 HydrophobicContact CB-CD2 3.84Å; F184-F202 HydrophobicContact CB-CE2 3.74Å; F184-F202 HydrophobicContact CB-CZ 4.48Å; F184-F202 HydrophobicContact CD1-CB 4.16Å; F184-F202 AromaticContact CD1-CD1 3.68Å; F184-F202 HydrophobicContact CD1-CD1 3.68Å; F184-F202 AromaticContact CD1-CD2 3.51Å; F184-F202 HydrophobicContact CD1-CD2 3.51Å; F184-F202 AromaticContact CD1-CE1 3.88Å; F184-F202 HydrophobicContact CD1-CE1 3.88Å; F184-F202 AromaticContact CD1-CE2 3.73Å; F184-F202 HydrophobicContact CD1-CE2 3.73Å; F184-F202 AromaticContact CD1-CG 3.49Å; F184-F202 HydrophobicContact CD1-CG 3.49Å; F184-F202 VanDerWaalsContact CD1-CG 3.49Å; F184-F202 AromaticContact CD1-CZ 3.92Å; F184-F202 HydrophobicContact CD1-CZ 3.92Å; F184-F202 HydrophobicContact CE1-CB 4.09Å; F184-F202 AromaticContact CE1-CD1 3.82Å; F184-F202 HydrophobicContact CE1-CD1 3.82Å; F184-F202 HydrophobicContact CE1-CD2 4.27Å; F184-F202 HydrophobicContact CE1-CE1 4.33Å; F184-F202 AromaticContact CE1-CG 3.79Å; F184-F202 HydrophobicContact CE1-CG 3.79Å; F184-F202 AromaticContact CG-CD2 3.84Å; F184-F202 HydrophobicContact CG-CD2 3.84Å; F184-F202 HydrophobicContact CG-CE2 4.1Å; F184-F202 HydrophobicContact CG-CG 4.18Å |
| 185 | G | 88.1 | Confident | 88.6 | Confident | 4 Ų | 4 | 31 Ų | 31 | 4% | 0.041 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -59 | -56.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | A15 V183 Y187 L188 R189 | A15-G185 VanDerWaalsContact O-CA 3.29Å; A15-G185 WeakPolarHBondContact O-CA 3.22Å; V183-G185 PolarHBondContact O-N 2.94Å; G185-Y187 VanDerWaalsContact C-N 3.27Å; G185-Y187 PolarHBondContact O-N 3.15Å; G185-L188 PolarHBondContact O-N 3.4Å; G185-R189 WeakPolarHBondContact O-CG 3.35Å; G185-R189 PolarHBondContact O-N 3.45Å; G185-R189 VanDerWaalsContact O-N 3.13Å |
| 186 | P | 86.7 | Confident | 88.2 | Confident | 31 Ų | 31 | 33.1 Ų | 33.1 | 20% | 0.201 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -57.1 | -37.6 | 172.7 | -27.2 | 35.6 | 0 | 0 | 0 | 113.6 | S182 V183 R189 L190 L265 | S182-P186 WeakPolarHBondContact O-CD 3.29Å; V183-P186 WeakPolarHBondContact O-CD 3.45Å; P186-R189 PolarHBondContact O-N 3.16Å; P186-L190 WeakPolarHBondContact O-CG 3.37Å; P186-L190 PolarHBondContact O-N 2.96Å; P186-L190 VanDerWaalsContact O-N 3.16Å; P186-L265 HydrophobicContact CB-CD1 3.98Å; P186-L265 HydrophobicContact CB-CD2 3.98Å |
| 187 | Y | 86.6 | Confident | 88 | Confident | 14 Ų | 14 | 37 Ų | 37 | 6% | 0.055 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -60.6 | -45.7 | 177 | 171 | -103.5 | 0 | 0 | 0 | 112.6 | L81 I85 V183 F184 G185 L190 G192 V193 L198 | L81-Y187 HydrophobicContact CD1-CD1 3.86Å; L81-Y187 HydrophobicContact CD1-CD2 4.27Å; L81-Y187 HydrophobicContact CD1-CE1 3.87Å; L81-Y187 HydrophobicContact CD1-CE2 4.29Å; L81-Y187 HydrophobicContact CD1-CG 4.04Å; I85-Y187 HydrophobicContact CD1-CD2 3.78Å; I85-Y187 HydrophobicContact CD1-CE2 3.5Å; I85-Y187 HydrophobicContact CG1-CD2 4.38Å; I85-Y187 HydrophobicContact CG1-CE2 3.61Å; V183-Y187 WeakPolarHBondContact O-CB 3.49Å; V183-Y187 PolarHBondContact O-N 3.26Å; V183-Y187 VanDerWaalsContact O-N 3.12Å; F184-Y187 AromaticContact CD2-CD1 3.96Å; F184-Y187 HydrophobicContact CD2-CD1 3.96Å; F184-Y187 AromaticContact CE2-CD1 3.98Å; F184-Y187 HydrophobicContact CE2-CD1 3.98Å; F184-Y187 HydrophobicContact CE2-CE1 4.3Å; F184-Y187 WeakPolarHBondContact O-CB 3.33Å; F184-Y187 PolarHBondContact O-N 3.2Å; G185-Y187 VanDerWaalsContact C-N 3.27Å; G185-Y187 PolarHBondContact O-N 3.15Å; Y187-L190 PolarHBondContact O-N 3.09Å; Y187-G192 VanDerWaalsContact CZ-CA 3.44Å; Y187-G192 PolarHBondContact O-N 3.08Å; Y187-G192 VanDerWaalsContact O-N 3.11Å; Y187-V193 PolarHBondContact OH-N 3.18Å; Y187-V193 PolarHBondContact OH-O 3.06Å; Y187-L198 HydrophobicContact CE1-CD2 4.36Å |
| 188 | L | 87.7 | Confident | 87.8 | Confident | 33 Ų | 33 | 37.3 Ų | 37.3 | 17% | 0.173 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -64.9 | -39 | 176 | -69.3 | 178.6 | 0 | 0 | 0 | 112.2 | A15 F184 G185 L190 G191 S194 | A15-L188 HydrophobicContact CB-CD1 3.81Å; F184-L188 HydrophobicContact CD1-CD1 3.98Å; F184-L188 HydrophobicContact CD1-CG 4.41Å; F184-L188 HydrophobicContact CE1-CD1 3.61Å; F184-L188 HydrophobicContact CE1-CD2 4.44Å; F184-L188 HydrophobicContact CE1-CG 4.14Å; F184-L188 HydrophobicContact CE2-CD2 4.22Å; F184-L188 HydrophobicContact CE2-CG 4.31Å; F184-L188 HydrophobicContact CZ-CD1 3.98Å; F184-L188 HydrophobicContact CZ-CD2 3.96Å; F184-L188 HydrophobicContact CZ-CG 4.08Å; F184-L188 WeakPolarHBondContact O-CG 3.37Å; F184-L188 PolarHBondContact O-N 3.43Å; G185-L188 PolarHBondContact O-N 3.4Å; L188-L190 PolarHBondContact O-N 3.12Å; L188-G191 PolarHBondContact O-N 2.97Å; L188-G191 VanDerWaalsContact O-N 3.08Å; L188-S194 VanDerWaalsContact CD2-CB 3.47Å |
| 189 | R | 84.9 | Confident | 87.8 | Confident | 184 Ų | 184 | 38.4 Ų | 38.4 | 69% | 0.694 | 22% | 0.221 | S | C | * | . | H | α-helix | trans | -63.3 | -27.5 | 177.6 | -69.9 | -177 | -169.6 | -161.3 | 3.5 | 113.2 | G185 P186 G191 | G185-R189 WeakPolarHBondContact O-CG 3.35Å; G185-R189 PolarHBondContact O-N 3.45Å; G185-R189 VanDerWaalsContact O-N 3.13Å; P186-R189 PolarHBondContact O-N 3.16Å; R189-G191 VanDerWaalsContact C-N 3.25Å; R189-G191 PolarHBondContact O-N 2.87Å |
| 190 | L | 83.8 | Confident | 87.8 | Confident | 64 Ų | 64 | 41.3 Ų | 41.3 | 34% | 0.335 | 24% | 0.236 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -85.7 | 11.8 | 176.3 | -68.7 | 168.2 | 0 | 0 | 0 | 113.2 | P186 Y187 L188 L265 K268 | P186-L190 WeakPolarHBondContact O-CG 3.37Å; P186-L190 PolarHBondContact O-N 2.96Å; P186-L190 VanDerWaalsContact O-N 3.16Å; Y187-L190 PolarHBondContact O-N 3.09Å; L188-L190 PolarHBondContact O-N 3.12Å; L190-L265 HydrophobicContact CD1-CB 4.03Å; L190-L265 HydrophobicContact CD1-CD2 3.47Å; L190-L265 VanDerWaalsContact CD1-CD2 3.47Å; L190-L265 HydrophobicContact CD1-CG 4.31Å; L190-K268 HydrophobicContact CB-CG 4.01Å; L190-K268 WeakPolarHBondContact O-CE 3.36Å |
| 191 | G | 79.9 | Confident | 87.9 | Confident | 51 Ų | 51 | 42 Ų | 42 | 53% | 0.526 | 24% | 0.24 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 69.8 | 35 | -177.9 | 0 | 0 | 0 | 0 | 0 | 113 | L188 R189 K268 | L188-G191 PolarHBondContact O-N 2.97Å; L188-G191 VanDerWaalsContact O-N 3.08Å; R189-G191 VanDerWaalsContact C-N 3.25Å; R189-G191 PolarHBondContact O-N 2.87Å; G191-K268 VanDerWaalsContact O-CE 3.31Å; G191-K268 WeakPolarHBondContact O-CE 3.49Å; G191-K268 PolarHBondContact O-NZ 3.32Å |
| 192 | G | 80 | Confident | 88 | Confident | 12 Ų | 12 | 42 Ų | 42 | 12% | 0.124 | 24% | 0.24 | C | C | . | . | trans | -64.2 | 137.8 | 171.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y187 S194 | Y187-G192 VanDerWaalsContact CZ-CA 3.44Å; Y187-G192 PolarHBondContact O-N 3.08Å; Y187-G192 VanDerWaalsContact O-N 3.11Å; G192-S194 PolarHBondContact O-N 2.82Å | ||
| 193 | V | 81.8 | Confident | 88.2 | Confident | 94 Ų | 94 | 43.1 Ų | 43.1 | 57% | 0.57 | 25% | 0.246 | S | C | * | . | trans | -72.1 | 119.7 | 178.1 | -146.8 | 0 | 0 | 0 | 0 | 108.6 | Y187 | Y187-V193 PolarHBondContact OH-N 3.18Å; Y187-V193 PolarHBondContact OH-O 3.06Å | ||
| 194 | S | 83.6 | Confident | 88.5 | Confident | 21 Ų | 21 | 45.9 Ų | 45.9 | 15% | 0.147 | 26% | 0.259 | C | S | . | . | trans | -121.7 | 88 | -172.8 | -173 | 0 | 0 | 0 | 0 | 110.9 | F184 L188 G192 R199 | F184-S194 WeakPolarHBondContact CZ-OG 3.28Å; L188-S194 VanDerWaalsContact CD2-CB 3.47Å; G192-S194 PolarHBondContact O-N 2.82Å; S194-R199 PolarHBondContact O-NE 3.45Å; S194-R199 WeakPolarHBondContact OG-CG 3.16Å; S194-R199 PolarHBondContact OG-NE 3.17Å | ||
| 195 | D | 86.1 | Confident | 88.8 | Confident | 91 Ų | 91 | 45.9 Ų | 45.9 | 49% | 0.487 | 26% | 0.259 | S | S | . | . | trans | -65.9 | 153.4 | 176.6 | -57.5 | -41.6 | 0 | 0 | 0 | 111.2 | P197 L198 R199 | D195-P197 VanDerWaalsContact C-CD 3.49Å; D195-P197 HydrophobicContact CB-CG 4.06Å; D195-L198 PolarHBondContact O-N 3.47Å; D195-L198 VanDerWaalsContact O-N 3.12Å; D195-R199 PolarHBondContact O-N 2.87Å; D195-R199 VanDerWaalsContact O-N 3.15Å | ||
| 196 | A | 88.3 | Confident | 89.2 | Confident | 47 Ų | 47 | 47.5 Ų | 47.5 | 39% | 0.388 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -48 | -46.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 114.6 | L7 L198 R199 I200 | L7-A196 HydrophobicContact CD2-CB 4.49Å; A196-L198 PolarHBondContact O-N 3.39Å; A196-R199 PolarHBondContact O-N 3.46Å; A196-I200 VanDerWaalsContact O-CG1 3.28Å; A196-I200 WeakPolarHBondContact O-CG1 3.36Å; A196-I200 PolarHBondContact O-N 2.96Å |
| 197 | P | 90.9 | Very high | 89.6 | Confident | 81 Ų | 81 | 51.9 Ų | 51.9 | 53% | 0.526 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -61.2 | -39.3 | 178.5 | 21.9 | -34.9 | 0 | 0 | 0 | 113.5 | D195 R199 I200 L201 | D195-P197 VanDerWaalsContact C-CD 3.49Å; D195-P197 HydrophobicContact CB-CG 4.06Å; P197-R199 VanDerWaalsContact C-N 3.35Å; P197-I200 PolarHBondContact O-N 3.35Å; P197-L201 VanDerWaalsContact O-CB 3.28Å; P197-L201 WeakPolarHBondContact O-CB 3.16Å; P197-L201 PolarHBondContact O-N 2.94Å |
| 198 | L | 91.5 | Very high | 90 | Very high | 7 Ų | 7 | 51.8 Ų | 51.8 | 4% | 0.037 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -65.8 | -40.8 | 178.3 | -178.3 | 63.1 | 0 | 0 | 0 | 111.1 | F77 L80 L81 F184 Y187 D195 A196 L201 F202 | F77-L198 HydrophobicContact CD2-CD1 3.94Å; F77-L198 HydrophobicContact CE2-CD1 3.91Å; L80-L198 HydrophobicContact CB-CD1 4.11Å; L81-L198 HydrophobicContact CB-CD1 4.18Å; L81-L198 HydrophobicContact CD1-CD2 4.14Å; F184-L198 HydrophobicContact CE2-CD2 3.81Å; F184-L198 HydrophobicContact CE2-CG 3.95Å; F184-L198 HydrophobicContact CZ-CG 4.44Å; Y187-L198 HydrophobicContact CE1-CD2 4.36Å; D195-L198 PolarHBondContact O-N 3.47Å; D195-L198 VanDerWaalsContact O-N 3.12Å; A196-L198 PolarHBondContact O-N 3.39Å; L198-L201 PolarHBondContact O-N 3.46Å; L198-F202 WeakPolarHBondContact O-CB 3.39Å; L198-F202 PolarHBondContact O-N 3.42Å |
| 199 | R | 92.8 | Very high | 90.4 | Very high | 30 Ų | 30 | 50.6 Ų | 50.6 | 11% | 0.113 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -64.1 | -46.5 | 176.1 | -73.5 | -174.8 | -179.6 | -92 | 1.6 | 112.4 | L7 T11 D12 F184 S194 D195 A196 P197 L201 F202 L203 | L7-R199 HydrophobicContact CD1-CB 4.37Å; L7-R199 HydrophobicContact CD2-CB 4.42Å; L7-R199 HydrophobicContact CG-CB 4.33Å; T11-R199 HydrophobicContact CG2-CB 3.74Å; T11-R199 HydrophobicContact CG2-CG 4.25Å; T11-R199 PolarHBondContact OG1-NH1 3.39Å; D12-R199 IonicContact OD1-CZ 2.73Å; D12-R199 IonicContact OD1-NH1 2.7Å; D12-R199 PolarHBondContact OD1-NH1 3.32Å; D12-R199 IonicContact OD1-NH2 3.67Å; F184-R199 HydrophobicContact CZ-CG 4.39Å; S194-R199 PolarHBondContact O-NE 3.45Å; S194-R199 WeakPolarHBondContact OG-CG 3.16Å; S194-R199 PolarHBondContact OG-NE 3.17Å; D195-R199 PolarHBondContact O-N 2.87Å; D195-R199 VanDerWaalsContact O-N 3.15Å; A196-R199 PolarHBondContact O-N 3.46Å; P197-R199 VanDerWaalsContact C-N 3.35Å; R199-L201 VanDerWaalsContact C-N 3.31Å; R199-L201 PolarHBondContact O-N 2.92Å; R199-F202 PolarHBondContact O-N 2.95Å; R199-L203 PolarHBondContact O-N 2.95Å |
| 200 | I | 93.9 | Very high | 90.9 | Very high | 86 Ų | 86 | 43.8 Ų | 43.8 | 44% | 0.441 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -60.2 | -45.7 | 177.1 | -69.2 | 164.9 | 0 | 0 | 0 | 110 | L7 A196 P197 F202 L203 L204 | L7-I200 HydrophobicContact CD1-CG1 4.07Å; L7-I200 HydrophobicContact CD2-CD1 4.48Å; L7-I200 HydrophobicContact CD2-CG1 4.01Å; A196-I200 VanDerWaalsContact O-CG1 3.28Å; A196-I200 WeakPolarHBondContact O-CG1 3.36Å; A196-I200 PolarHBondContact O-N 2.96Å; P197-I200 PolarHBondContact O-N 3.35Å; I200-F202 PolarHBondContact O-N 3.5Å; I200-L203 WeakPolarHBondContact O-CB 3.38Å; I200-L203 PolarHBondContact O-N 3.46Å; I200-L203 VanDerWaalsContact O-N 3.17Å; I200-L204 HydrophobicContact CG2-CD1 4.12Å; I200-L204 HydrophobicContact CG2-CG 4.5Å; I200-L204 WeakPolarHBondContact O-CG 3.39Å; I200-L204 PolarHBondContact O-N 3.06Å |
| 201 | L | 94.9 | Very high | 91.4 | Very high | 18 Ų | 18 | 43.5 Ų | 43.5 | 9% | 0.094 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -66.8 | -38.4 | -178.9 | -171 | 58.7 | 0 | 0 | 0 | 112.6 | F73 F77 L80 P197 L198 R199 L203 L204 C205 | F73-L201 HydrophobicContact CD1-CD1 4.07Å; F77-L201 VanDerWaalsContact CA-CD2 3.47Å; F77-L201 HydrophobicContact CB-CD2 4.05Å; F77-L201 HydrophobicContact CB-CG 4.01Å; F77-L201 VanDerWaalsContact N-CD2 3.29Å; L80-L201 HydrophobicContact CD1-CD2 3.77Å; P197-L201 VanDerWaalsContact O-CB 3.28Å; P197-L201 WeakPolarHBondContact O-CB 3.16Å; P197-L201 PolarHBondContact O-N 2.94Å; L198-L201 PolarHBondContact O-N 3.46Å; R199-L201 VanDerWaalsContact C-N 3.31Å; R199-L201 PolarHBondContact O-N 2.92Å; L201-L203 VanDerWaalsContact C-N 3.34Å; L201-L203 PolarHBondContact O-N 2.93Å; L201-L204 HydrophobicContact CD1-CD1 4.4Å; L201-L204 PolarHBondContact O-N 3.49Å; L201-C205 PolarHBondContact O-N 2.96Å; L201-C205 PolarHBondContact O-SG 3.26Å; L201-C205 VanDerWaalsContact O-SG 3.37Å |
| 202 | F | 95.2 | Very high | 92.1 | Very high | 0 Ų | 0 | 41.1 Ų | 41.1 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -58.5 | -44.8 | 170.5 | 174 | -102.1 | 0 | 0 | 0 | 111.7 | A14 A15 L18 F77 F184 L198 R199 I200 L204 C205 V206 | A14-F202 HydrophobicContact CB-CE1 3.8Å; A14-F202 HydrophobicContact CB-CZ 4.37Å; A15-F202 HydrophobicContact CB-CE1 4.05Å; A15-F202 HydrophobicContact CB-CZ 4Å; L18-F202 HydrophobicContact CD2-CE2 4.21Å; L18-F202 HydrophobicContact CD2-CZ 4.11Å; F77-F202 HydrophobicContact CD2-CB 4.21Å; F77-F202 HydrophobicContact CE2-CB 3.92Å; F77-F202 HydrophobicContact CE2-CD2 4.01Å; F77-F202 HydrophobicContact CE2-CG 4.44Å; F77-F202 HydrophobicContact CZ-CD2 4.14Å; F184-F202 HydrophobicContact CB-CD2 3.84Å; F184-F202 HydrophobicContact CB-CE2 3.74Å; F184-F202 HydrophobicContact CB-CZ 4.48Å; F184-F202 HydrophobicContact CD1-CB 4.16Å; F184-F202 AromaticContact CD1-CD1 3.68Å; F184-F202 HydrophobicContact CD1-CD1 3.68Å; F184-F202 AromaticContact CD1-CD2 3.51Å; F184-F202 HydrophobicContact CD1-CD2 3.51Å; F184-F202 AromaticContact CD1-CE1 3.88Å; F184-F202 HydrophobicContact CD1-CE1 3.88Å; F184-F202 AromaticContact CD1-CE2 3.73Å; F184-F202 HydrophobicContact CD1-CE2 3.73Å; F184-F202 AromaticContact CD1-CG 3.49Å; F184-F202 HydrophobicContact CD1-CG 3.49Å; F184-F202 VanDerWaalsContact CD1-CG 3.49Å; F184-F202 AromaticContact CD1-CZ 3.92Å; F184-F202 HydrophobicContact CD1-CZ 3.92Å; F184-F202 HydrophobicContact CE1-CB 4.09Å; F184-F202 AromaticContact CE1-CD1 3.82Å; F184-F202 HydrophobicContact CE1-CD1 3.82Å; F184-F202 HydrophobicContact CE1-CD2 4.27Å; F184-F202 HydrophobicContact CE1-CE1 4.33Å; F184-F202 AromaticContact CE1-CG 3.79Å; F184-F202 HydrophobicContact CE1-CG 3.79Å; F184-F202 AromaticContact CG-CD2 3.84Å; F184-F202 HydrophobicContact CG-CD2 3.84Å; F184-F202 HydrophobicContact CG-CE2 4.1Å; F184-F202 HydrophobicContact CG-CG 4.18Å; L198-F202 WeakPolarHBondContact O-CB 3.39Å; L198-F202 PolarHBondContact O-N 3.42Å; R199-F202 PolarHBondContact O-N 2.95Å; I200-F202 PolarHBondContact O-N 3.5Å; F202-L204 PolarHBondContact O-N 2.98Å; F202-C205 WeakPolarHBondContact O-CB 3.2Å; F202-C205 PolarHBondContact O-N 3.46Å; F202-V206 HydrophobicContact CD1-CG2 4.34Å; F202-V206 HydrophobicContact CE1-CG2 3.89Å; F202-V206 HydrophobicContact CE2-CG2 4.25Å; F202-V206 HydrophobicContact CZ-CG2 3.81Å; F202-V206 WeakPolarHBondContact O-CG2 3.42Å; F202-V206 PolarHBondContact O-N 3.13Å |
| 203 | L | 95.4 | Very high | 92.8 | Very high | 27 Ų | 27 | 42.8 Ų | 42.8 | 14% | 0.141 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -63.4 | -40.3 | 175.6 | -70.9 | -178.5 | 0 | 0 | 0 | 112.6 | L7 L10 T11 R199 I200 L201 C205 V206 L207 | L7-L203 HydrophobicContact CD1-CD1 3.54Å; L10-L203 HydrophobicContact CD2-CD1 3.88Å; L10-L203 HydrophobicContact CD2-CD2 4.09Å; L10-L203 HydrophobicContact CG-CD1 4.39Å; L10-L203 HydrophobicContact CG-CD2 3.94Å; T11-L203 HydrophobicContact CG2-CD1 3.67Å; T11-L203 HydrophobicContact CG2-CD2 3.75Å; T11-L203 HydrophobicContact CG2-CG 3.45Å; T11-L203 VanDerWaalsContact CG2-CG 3.45Å; R199-L203 PolarHBondContact O-N 2.95Å; I200-L203 WeakPolarHBondContact O-CB 3.38Å; I200-L203 PolarHBondContact O-N 3.46Å; I200-L203 VanDerWaalsContact O-N 3.17Å; L201-L203 VanDerWaalsContact C-N 3.34Å; L201-L203 PolarHBondContact O-N 2.93Å; L203-C205 VanDerWaalsContact C-N 3.27Å; L203-C205 PolarHBondContact O-N 3.08Å; L203-V206 PolarHBondContact O-N 3.11Å; L203-V206 VanDerWaalsContact O-N 3.1Å; L203-L207 WeakPolarHBondContact O-CG 3.49Å; L203-L207 PolarHBondContact O-N 3.44Å |
| 204 | L | 96.2 | Very high | 93.3 | Very high | 68 Ų | 68 | 42.8 Ų | 42.8 | 36% | 0.356 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -59.5 | -40.6 | 174.8 | -70.3 | 169.9 | 0 | 0 | 0 | 111 | F73 I200 L201 F202 L207 L208 | F73-L204 HydrophobicContact CD1-CB 4Å; F73-L204 HydrophobicContact CD1-CD1 4.24Å; F73-L204 HydrophobicContact CE1-CB 4.18Å; F73-L204 HydrophobicContact CE1-CD1 3.92Å; F73-L204 HydrophobicContact CE1-CG 4.47Å; I200-L204 HydrophobicContact CG2-CD1 4.12Å; I200-L204 HydrophobicContact CG2-CG 4.5Å; I200-L204 WeakPolarHBondContact O-CG 3.39Å; I200-L204 PolarHBondContact O-N 3.06Å; L201-L204 HydrophobicContact CD1-CD1 4.4Å; L201-L204 PolarHBondContact O-N 3.49Å; F202-L204 PolarHBondContact O-N 2.98Å; L204-L207 PolarHBondContact O-N 2.69Å; L204-L208 VanDerWaalsContact O-CB 3.27Å; L204-L208 WeakPolarHBondContact O-CB 3.13Å; L204-L208 PolarHBondContact O-N 3.38Å |
| 205 | C | 96.3 | Very high | 93.6 | Very high | 0 Ų | 0 | 42.3 Ų | 42.3 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -62.1 | -45.2 | 171.7 | -65.8 | 0 | 0 | 0 | 0 | 111.9 | L177 T181 L201 F202 L203 L207 L208 L209 | L177-C205 HydrophobicContact CD2-CB 4.41Å; L177-C205 WeakPolarHBondContact CD2-O 3.48Å; T181-C205 HydrophobicContact CG2-CB 3.66Å; L201-C205 PolarHBondContact O-N 2.96Å; L201-C205 PolarHBondContact O-SG 3.26Å; L201-C205 VanDerWaalsContact O-SG 3.37Å; F202-C205 WeakPolarHBondContact O-CB 3.2Å; F202-C205 PolarHBondContact O-N 3.46Å; L203-C205 VanDerWaalsContact C-N 3.27Å; L203-C205 PolarHBondContact O-N 3.08Å; C205-L207 VanDerWaalsContact C-N 3.34Å; C205-L207 PolarHBondContact O-N 3.32Å; C205-L208 WeakPolarHBondContact O-CB 3.46Å; C205-L208 PolarHBondContact O-N 3.12Å; C205-L209 PolarHBondContact O-N 3.29Å |
| 206 | V | 96.1 | Very high | 93.9 | Very high | 38 Ų | 38 | 38 Ų | 38 | 23% | 0.23 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -61.7 | -42.4 | 178.3 | 175 | 0 | 0 | 0 | 0 | 111.8 | A14 L18 F202 L203 L208 L209 G210 | A14-V206 HydrophobicContact CB-CG2 4.37Å; L18-V206 HydrophobicContact CD2-CG2 3.82Å; F202-V206 HydrophobicContact CD1-CG2 4.34Å; F202-V206 HydrophobicContact CE1-CG2 3.89Å; F202-V206 HydrophobicContact CE2-CG2 4.25Å; F202-V206 HydrophobicContact CZ-CG2 3.81Å; F202-V206 WeakPolarHBondContact O-CG2 3.42Å; F202-V206 PolarHBondContact O-N 3.13Å; L203-V206 PolarHBondContact O-N 3.11Å; L203-V206 VanDerWaalsContact O-N 3.1Å; V206-L208 VanDerWaalsContact C-N 3.34Å; V206-L209 WeakPolarHBondContact O-CB 3.29Å; V206-L209 PolarHBondContact O-N 3.3Å; V206-G210 PolarHBondContact O-N 3.46Å |
| 207 | L | 95.9 | Very high | 94.1 | Very high | 124 Ų | 124 | 38.5 Ų | 38.5 | 65% | 0.649 | 21% | 0.211 | S | C | * | . | H | α-helix | trans | -63.4 | -41.4 | 175.1 | -69 | 173.7 | 0 | 0 | 0 | 111.3 | L203 L204 C205 G210 L211 | L203-L207 WeakPolarHBondContact O-CG 3.49Å; L203-L207 PolarHBondContact O-N 3.44Å; L204-L207 PolarHBondContact O-N 2.69Å; C205-L207 VanDerWaalsContact C-N 3.34Å; C205-L207 PolarHBondContact O-N 3.32Å; L207-G210 PolarHBondContact O-N 2.77Å; L207-L211 WeakPolarHBondContact O-CB 3.32Å; L207-L211 PolarHBondContact O-N 2.81Å |
| 208 | L | 95.8 | Very high | 94 | Very high | 11 Ų | 11 | 35.1 Ų | 35.1 | 6% | 0.058 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -64.4 | -39.2 | 176.5 | -168.7 | 75 | 0 | 0 | 0 | 111.8 | W69 F73 L177 L204 C205 V206 L211 W212 | W69-L208 HydrophobicContact CB-CD1 4.21Å; F73-L208 HydrophobicContact CB-CD2 4.28Å; F73-L208 HydrophobicContact CD2-CD1 4.26Å; F73-L208 HydrophobicContact CD2-CD2 3.84Å; F73-L208 HydrophobicContact CE2-CD1 4.44Å; L177-L208 HydrophobicContact CD1-CD2 4.19Å; L177-L208 HydrophobicContact CD2-CB 4.09Å; L177-L208 HydrophobicContact CD2-CD2 4.24Å; L177-L208 HydrophobicContact CD2-CG 4.41Å; L204-L208 VanDerWaalsContact O-CB 3.27Å; L204-L208 WeakPolarHBondContact O-CB 3.13Å; L204-L208 PolarHBondContact O-N 3.38Å; C205-L208 WeakPolarHBondContact O-CB 3.46Å; C205-L208 PolarHBondContact O-N 3.12Å; V206-L208 VanDerWaalsContact C-N 3.34Å; L208-L211 HydrophobicContact CD1-CD2 4.36Å; L208-L211 WeakPolarHBondContact O-CB 3.31Å; L208-L211 PolarHBondContact O-N 3.34Å; L208-W212 HydrophobicContact CD1-CH2 4.32Å; L208-W212 HydrophobicContact CD1-CZ2 3.6Å; L208-W212 HydrophobicContact CD2-CZ2 4.24Å; L208-W212 HydrophobicContact CG-CZ2 3.95Å; L208-W212 VanDerWaalsContact O-CD1 3.24Å; L208-W212 VanDerWaalsContact O-CG 3.31Å; L208-W212 PolarHBondContact O-N 3.49Å |
| 209 | L | 95.9 | Very high | 93.9 | Very high | 8 Ų | 8 | 35 Ų | 35 | 4% | 0.042 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -60.3 | -46.9 | 173.3 | -178.9 | 58.5 | 0 | 0 | 0 | 111.1 | F27 C174 L177 A178 C205 V206 L211 W212 I213 | F27-L209 HydrophobicContact CZ-CD1 3.97Å; C174-L209 HydrophobicContact CB-CD1 3.99Å; C174-L209 WeakPolarHBondContact O-CD1 3.24Å; L177-L209 HydrophobicContact CB-CD1 4.09Å; L177-L209 HydrophobicContact CD2-CB 3.62Å; A178-L209 HydrophobicContact CB-CD2 4.43Å; C205-L209 PolarHBondContact O-N 3.29Å; V206-L209 WeakPolarHBondContact O-CB 3.29Å; V206-L209 PolarHBondContact O-N 3.3Å; L209-L211 VanDerWaalsContact C-N 3.3Å; L209-L211 PolarHBondContact O-N 2.99Å; L209-W212 PolarHBondContact O-N 3.44Å; L209-I213 HydrophobicContact CD1-CD1 4.23Å; L209-I213 HydrophobicContact CD1-CG1 4.49Å; L209-I213 HydrophobicContact CG-CD1 4.1Å; L209-I213 WeakPolarHBondContact O-CG1 3.2Å; L209-I213 PolarHBondContact O-N 2.83Å |
| 210 | G | 95.1 | Very high | 93.8 | Very high | 41 Ų | 41 | 33.7 Ų | 33.7 | 42% | 0.423 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -59.3 | -42.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | V206 L207 I213 F214 | V206-G210 PolarHBondContact O-N 3.46Å; L207-G210 PolarHBondContact O-N 2.77Å; G210-I213 PolarHBondContact O-N 3.26Å; G210-F214 WeakPolarHBondContact O-CB 3.43Å; G210-F214 PolarHBondContact O-N 2.94Å |
| 211 | L | 93.8 | Very high | 93.6 | Very high | 59 Ų | 59 | 30 Ų | 30 | 31% | 0.309 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -61.8 | -43.8 | 175.7 | -176.2 | 68.4 | 0 | 0 | 0 | 111.9 | F62 L207 L208 L209 F214 L215 | F62-L211 HydrophobicContact CD1-CD2 3.93Å; F62-L211 HydrophobicContact CE1-CD2 3.93Å; L207-L211 WeakPolarHBondContact O-CB 3.32Å; L207-L211 PolarHBondContact O-N 2.81Å; L208-L211 HydrophobicContact CD1-CD2 4.36Å; L208-L211 WeakPolarHBondContact O-CB 3.31Å; L208-L211 PolarHBondContact O-N 3.34Å; L209-L211 VanDerWaalsContact C-N 3.3Å; L209-L211 PolarHBondContact O-N 2.99Å; L211-F214 PolarHBondContact O-N 2.95Å; L211-L215 HydrophobicContact CD1-CD1 4.46Å; L211-L215 HydrophobicContact CD1-CG 4.5Å; L211-L215 HydrophobicContact CG-CD1 4.1Å; L211-L215 WeakPolarHBondContact O-CB 3.33Å; L211-L215 WeakPolarHBondContact O-CG 3.45Å; L211-L215 PolarHBondContact O-N 3.42Å |
| 212 | W | 94.8 | Very high | 93.2 | Very high | 0 Ų | 0 | 31 Ų | 31 | 0% | 0 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -65 | -41.7 | 177.9 | -63.4 | 143.6 | 0 | 0 | 0 | 112.8 | G66 W69 T70 L170 C174 L208 L209 F214 L215 L216 | G66-W212 WeakPolarHBondContact O-CZ2 3.45Å; W69-W212 HydrophobicContact CB-CH2 4.41Å; W69-W212 HydrophobicContact CB-CZ2 4.03Å; T70-W212 PolarHBondContact OG1-NE1 3.35Å; L170-W212 HydrophobicContact CD2-CB 4.19Å; L170-W212 HydrophobicContact CD2-CD2 4.05Å; L170-W212 HydrophobicContact CD2-CE3 3.43Å; L170-W212 VanDerWaalsContact CD2-CE3 3.43Å; L170-W212 HydrophobicContact CD2-CG 4.38Å; L170-W212 HydrophobicContact CD2-CZ3 4.23Å; C174-W212 WeakPolarHBondContact SG-CB 3.42Å; L208-W212 HydrophobicContact CD1-CH2 4.32Å; L208-W212 HydrophobicContact CD1-CZ2 3.6Å; L208-W212 HydrophobicContact CD2-CZ2 4.24Å; L208-W212 HydrophobicContact CG-CZ2 3.95Å; L208-W212 VanDerWaalsContact O-CD1 3.24Å; L208-W212 VanDerWaalsContact O-CG 3.31Å; L208-W212 PolarHBondContact O-N 3.49Å; L209-W212 PolarHBondContact O-N 3.44Å; W212-F214 VanDerWaalsContact C-N 3.33Å; W212-L215 HydrophobicContact CE3-CD1 3.71Å; W212-L215 HydrophobicContact CZ3-CD1 3.64Å; W212-L215 PolarHBondContact O-N 3.42Å; W212-L216 WeakPolarHBondContact O-CB 3.34Å; W212-L216 PolarHBondContact O-N 3.47Å |
| 213 | I | 94.2 | Very high | 92.7 | Very high | 47 Ų | 47 | 32.7 Ų | 32.7 | 24% | 0.241 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -63.3 | -42.5 | 174.7 | -65.8 | 168.8 | 0 | 0 | 0 | 110.4 | F27 L209 G210 L216 L217 | F27-I213 HydrophobicContact CE2-CD1 4.09Å; F27-I213 HydrophobicContact CZ-CD1 4.18Å; L209-I213 HydrophobicContact CD1-CD1 4.23Å; L209-I213 HydrophobicContact CD1-CG1 4.49Å; L209-I213 HydrophobicContact CG-CD1 4.1Å; L209-I213 WeakPolarHBondContact O-CG1 3.2Å; L209-I213 PolarHBondContact O-N 2.83Å; G210-I213 PolarHBondContact O-N 3.26Å; I213-L216 PolarHBondContact O-N 2.87Å; I213-L217 HydrophobicContact CG2-CD1 4.17Å; I213-L217 WeakPolarHBondContact O-CG 3.4Å; I213-L217 PolarHBondContact O-N 3.48Å |
| 214 | F | 92 | Very high | 92.2 | Very high | 95 Ų | 95 | 34.1 Ų | 34.1 | 42% | 0.417 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -62.9 | -45.6 | 177 | 174.7 | -100.8 | 0 | 0 | 0 | 112.2 | F51 G210 L211 W212 L216 L217 C218 | F51-F214 HydrophobicContact CE1-CE1 4.4Å; F51-F214 HydrophobicContact CZ-CE1 4.42Å; F51-F214 HydrophobicContact CZ-CZ 4.32Å; G210-F214 WeakPolarHBondContact O-CB 3.43Å; G210-F214 PolarHBondContact O-N 2.94Å; L211-F214 PolarHBondContact O-N 2.95Å; W212-F214 VanDerWaalsContact C-N 3.33Å; F214-L216 VanDerWaalsContact C-N 3.33Å; F214-L216 PolarHBondContact O-N 2.94Å; F214-L217 PolarHBondContact O-N 3.32Å; F214-C218 VanDerWaalsContact CZ-SG 3.51Å; F214-C218 PolarHBondContact O-N 2.91Å; F214-C218 PolarHBondContact O-SG 2.72Å |
| 215 | L | 91.5 | Very high | 91.6 | Very high | 11 Ų | 11 | 34.6 Ų | 34.6 | 6% | 0.058 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -64 | -38.9 | 176.8 | -74.7 | 172.7 | 0 | 0 | 0 | 111.7 | Y59 F62 L63 L170 L211 W212 C218 L219 | Y59-L215 HydrophobicContact CD2-CD2 4.23Å; F62-L215 HydrophobicContact CB-CD1 4.05Å; L63-L215 HydrophobicContact CD2-CB 4.4Å; L170-L215 HydrophobicContact CD1-CB 4.39Å; L170-L215 HydrophobicContact CD2-CB 4.36Å; L211-L215 HydrophobicContact CD1-CD1 4.46Å; L211-L215 HydrophobicContact CD1-CG 4.5Å; L211-L215 HydrophobicContact CG-CD1 4.1Å; L211-L215 WeakPolarHBondContact O-CB 3.33Å; L211-L215 WeakPolarHBondContact O-CG 3.45Å; L211-L215 PolarHBondContact O-N 3.42Å; W212-L215 HydrophobicContact CE3-CD1 3.71Å; W212-L215 HydrophobicContact CZ3-CD1 3.64Å; W212-L215 PolarHBondContact O-N 3.42Å; L215-C218 PolarHBondContact O-N 2.88Å; L215-L219 PolarHBondContact O-N 3.41Å |
| 216 | L | 92.5 | Very high | 91 | Very high | 0 Ų | 0 | 39.9 Ų | 39.9 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -61.3 | -47.5 | 173.7 | 179.4 | 62.8 | 0 | 0 | 0 | 111.3 | L31 V34 L35 V167 L170 W212 I213 F214 C218 L219 L220 | L31-L216 HydrophobicContact CD1-CD2 3.43Å; L31-L216 VanDerWaalsContact CD1-CD2 3.43Å; V34-L216 HydrophobicContact CG1-CD2 4.18Å; V34-L216 HydrophobicContact CG1-CG 4.47Å; L35-L216 HydrophobicContact CD2-CD1 4.17Å; V167-L216 HydrophobicContact CB-CD1 4.49Å; V167-L216 HydrophobicContact CG1-CD1 3.92Å; V167-L216 HydrophobicContact CG2-CD1 4.28Å; L170-L216 HydrophobicContact CD1-CB 4.13Å; L170-L216 HydrophobicContact CD1-CD1 4.37Å; W212-L216 WeakPolarHBondContact O-CB 3.34Å; W212-L216 PolarHBondContact O-N 3.47Å; I213-L216 PolarHBondContact O-N 2.87Å; F214-L216 VanDerWaalsContact C-N 3.33Å; F214-L216 PolarHBondContact O-N 2.94Å; L216-C218 VanDerWaalsContact C-N 3.31Å; L216-C218 PolarHBondContact O-N 3.48Å; L216-L219 WeakPolarHBondContact O-CB 3.45Å; L216-L219 PolarHBondContact O-N 2.97Å; L216-L219 VanDerWaalsContact O-N 3.16Å; L216-L220 HydrophobicContact CD1-CD1 4.17Å; L216-L220 HydrophobicContact CD1-CG 4.32Å; L216-L220 HydrophobicContact CG-CD1 4.04Å; L216-L220 VanDerWaalsContact O-CG 3.28Å; L216-L220 WeakPolarHBondContact O-CG 3.31Å; L216-L220 PolarHBondContact O-N 3.41Å |
| 217 | L | 91.7 | Very high | 90.6 | Very high | 57 Ų | 57 | 41.7 Ų | 41.7 | 30% | 0.298 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -60 | -41.6 | 175.7 | -76 | 167.9 | 0 | 0 | 0 | 111.9 | V34 L41 I213 F214 L219 L220 A221 | V34-L217 HydrophobicContact CG1-CD2 3.69Å; V34-L217 HydrophobicContact CG1-CG 4.22Å; L41-L217 HydrophobicContact CD1-CD2 4.04Å; I213-L217 HydrophobicContact CG2-CD1 4.17Å; I213-L217 WeakPolarHBondContact O-CG 3.4Å; I213-L217 PolarHBondContact O-N 3.48Å; F214-L217 PolarHBondContact O-N 3.32Å; L217-L219 VanDerWaalsContact C-N 3.34Å; L217-L220 PolarHBondContact O-N 2.88Å; L217-A221 VanDerWaalsContact O-CB 3.22Å; L217-A221 WeakPolarHBondContact O-CB 3.17Å; L217-A221 PolarHBondContact O-N 3.29Å |
| 218 | C | 89 | Confident | 90.3 | Very high | 11 Ų | 11 | 37.2 Ų | 37.2 | 7% | 0.074 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -61.8 | -43.3 | 174.8 | -67.9 | 0 | 0 | 0 | 0 | 111.5 | F214 L215 L216 L220 A221 Y222 | F214-C218 VanDerWaalsContact CZ-SG 3.51Å; F214-C218 PolarHBondContact O-N 2.91Å; F214-C218 PolarHBondContact O-SG 2.72Å; L215-C218 PolarHBondContact O-N 2.88Å; L216-C218 VanDerWaalsContact C-N 3.31Å; L216-C218 PolarHBondContact O-N 3.48Å; C218-L220 VanDerWaalsContact C-N 3.32Å; C218-L220 PolarHBondContact O-N 3.43Å; C218-A221 PolarHBondContact O-N 3.29Å; C218-Y222 HydrophobicContact CB-CD2 4.22Å; C218-Y222 WeakPolarHBondContact O-CB 3.29Å; C218-Y222 WeakPolarHBondContact O-CD2 3.45Å; C218-Y222 PolarHBondContact O-N 3.39Å |
| 219 | L | 89.6 | Confident | 90.1 | Very high | 5 Ų | 5 | 36.8 Ų | 36.8 | 3% | 0.026 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -57.9 | -47.8 | 177.6 | -133 | 103.8 | 0 | 0 | 0 | 111.1 | Y59 L63 D166 V167 L170 L215 L216 L217 F223 | Y59-L219 HydrophobicContact CE2-CD1 3.91Å; Y59-L219 WeakPolarHBondContact OH-CD1 3.27Å; Y59-L219 VanDerWaalsContact OH-CG 3.29Å; Y59-L219 WeakPolarHBondContact OH-CG 3.36Å; L63-L219 HydrophobicContact CD1-CD1 3.63Å; L63-L219 HydrophobicContact CD2-CD1 3.91Å; L63-L219 HydrophobicContact CG-CD1 4.45Å; D166-L219 HydrophobicContact CB-CD1 4.36Å; D166-L219 HydrophobicContact CB-CD2 3.95Å; V167-L219 HydrophobicContact CG2-CD2 3.32Å; L170-L219 HydrophobicContact CD1-CD1 4.36Å; L215-L219 PolarHBondContact O-N 3.41Å; L216-L219 WeakPolarHBondContact O-CB 3.45Å; L216-L219 PolarHBondContact O-N 2.97Å; L216-L219 VanDerWaalsContact O-N 3.16Å; L217-L219 VanDerWaalsContact C-N 3.34Å; L219-F223 CarbonylContact O-C 3.56Å; L219-F223 VanDerWaalsContact O-C 3.32Å; L219-F223 WeakPolarHBondContact O-CA 3.36Å; L219-F223 PolarHBondContact O-N 3.39Å |
| 220 | L | 91.1 | Very high | 90 | Very high | 1 Ų | 1 | 39.9 Ų | 39.9 | 1% | 0.005 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -70.3 | -36.9 | -177.6 | -65.4 | 172.2 | 0 | 0 | 0 | 112.1 | V34 L35 P39 L216 L217 C218 Q229 | V34-L220 HydrophobicContact CG1-CD1 3.92Å; V34-L220 WeakPolarHBondContact O-CD1 3.41Å; L35-L220 HydrophobicContact CD2-CD1 4.29Å; L35-L220 HydrophobicContact CD2-CD2 4.34Å; P39-L220 WeakPolarHBondContact CA-O 3.45Å; P39-L220 HydrophobicContact CG-CB 4.02Å; P39-L220 HydrophobicContact CG-CD2 3.93Å; P39-L220 HydrophobicContact CG-CG 4.5Å; L216-L220 HydrophobicContact CD1-CD1 4.17Å; L216-L220 HydrophobicContact CD1-CG 4.32Å; L216-L220 HydrophobicContact CG-CD1 4.04Å; L216-L220 VanDerWaalsContact O-CG 3.28Å; L216-L220 WeakPolarHBondContact O-CG 3.31Å; L216-L220 PolarHBondContact O-N 3.41Å; L217-L220 PolarHBondContact O-N 2.88Å; C218-L220 VanDerWaalsContact C-N 3.32Å; C218-L220 PolarHBondContact O-N 3.43Å; L220-Q229 HydrophobicContact CD2-CB 4.23Å |
| 221 | A | 89.3 | Confident | 89.9 | Confident | 8 Ų | 8 | 40.4 Ų | 40.4 | 7% | 0.066 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -79.6 | -43.3 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | L41 S42 V45 L217 C218 | L41-A221 HydrophobicContact CB-CB 3.9Å; S42-A221 VanDerWaalsContact CA-O 3.3Å; S42-A221 WeakPolarHBondContact CA-O 3.47Å; S42-A221 WeakPolarHBondContact CB-O 3.26Å; V45-A221 HydrophobicContact CG2-CB 4.2Å; L217-A221 VanDerWaalsContact O-CB 3.22Å; L217-A221 WeakPolarHBondContact O-CB 3.17Å; L217-A221 PolarHBondContact O-N 3.29Å; C218-A221 PolarHBondContact O-N 3.29Å |
| 222 | Y | 85.5 | Confident | 89.9 | Confident | 39 Ų | 39 | 37.6 Ų | 37.6 | 15% | 0.153 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -90.6 | -27.4 | -175.8 | -70.2 | -78 | 0 | 0 | 0 | 113.6 | V45 S49 F51 A52 C218 P224 | V45-Y222 HydrophobicContact CG1-CD1 3.71Å; V45-Y222 HydrophobicContact CG1-CE1 3.11Å; V45-Y222 HydrophobicContact CG1-CE2 4Å; V45-Y222 HydrophobicContact CG1-CG 4.39Å; V45-Y222 WeakPolarHBondContact CG1-OH 3.47Å; S49-Y222 WeakPolarHBondContact CB-OH 3.25Å; S49-Y222 PolarHBondContact OG-OH 3.24Å; F51-Y222 HydrophobicContact CB-CD2 4.05Å; F51-Y222 HydrophobicContact CB-CE1 4.49Å; F51-Y222 HydrophobicContact CB-CE2 3.57Å; A52-Y222 VanDerWaalsContact CA-CD1 3.47Å; A52-Y222 HydrophobicContact CB-CD1 3.61Å; A52-Y222 HydrophobicContact CB-CE1 3.81Å; C218-Y222 HydrophobicContact CB-CD2 4.22Å; C218-Y222 WeakPolarHBondContact O-CB 3.29Å; C218-Y222 WeakPolarHBondContact O-CD2 3.45Å; C218-Y222 PolarHBondContact O-N 3.39Å; Y222-P224 VanDerWaalsContact C-CD 3.42Å |
| 223 | F | 85.6 | Confident | 89.9 | Confident | 36 Ų | 36 | 37.6 Ų | 37.6 | 16% | 0.158 | 19% | 0.193 | C | C | . | . | S | Bend | trans | -129.1 | 59.6 | -178.3 | -52.7 | -69.9 | 0 | 0 | 0 | 111.2 | A52 R54 Y59 L219 Q225 Q229 | A52-F223 WeakPolarHBondContact O-CZ 3.29Å; R54-F223 HydrophobicContact CB-CD1 4.49Å; R54-F223 HydrophobicContact CB-CE1 3.62Å; R54-F223 HydrophobicContact CB-CE2 4.28Å; R54-F223 HydrophobicContact CB-CZ 3.5Å; R54-F223 HydrophobicContact CG-CE1 4.13Å; R54-F223 HydrophobicContact CG-CE2 4.35Å; R54-F223 HydrophobicContact CG-CZ 4.01Å; Y59-F223 HydrophobicContact CE1-CE2 4.33Å; Y59-F223 WeakPolarHBondContact OH-CD2 3.47Å; L219-F223 CarbonylContact O-C 3.56Å; L219-F223 VanDerWaalsContact O-C 3.32Å; L219-F223 WeakPolarHBondContact O-CA 3.36Å; L219-F223 PolarHBondContact O-N 3.39Å; F223-Q225 PolarHBondContact O-N 3.47Å; F223-Q225 VanDerWaalsContact O-N 3.17Å; F223-Q229 PolarHBondContact O-NE2 3.24Å; F223-Q229 PolarHBondContact O-OE1 2.99Å |
| 224 | P | 85.2 | Confident | 89.9 | Confident | 57 Ų | 57 | 37.4 Ų | 37.4 | 37% | 0.37 | 20% | 0.199 | S | C | . | . | trans | -63.9 | 118.5 | 179.6 | 28.5 | -35.6 | 0 | 0 | 0 | 110.4 | P39 Y222 | P39-P224 HydrophobicContact CB-CB 4.01Å; Y222-P224 VanDerWaalsContact C-CD 3.42Å | ||
| 225 | Q | 83.5 | Confident | 90.1 | Very high | 78 Ų | 78 | 34.6 Ų | 34.6 | 36% | 0.364 | 19% | 0.188 | S | C | . | . | trans | -134.1 | 92 | 177.7 | -65.6 | -174.2 | -44.9 | 0 | 0 | 109.1 | F223 T228 Q229 | F223-Q225 PolarHBondContact O-N 3.47Å; F223-Q225 VanDerWaalsContact O-N 3.17Å; Q225-T228 WeakPolarHBondContact CB-OG1 3.25Å; Q225-T228 PolarHBondContact O-N 3.36Å; Q225-T228 PolarHBondContact O-OG1 3.09Å; Q225-Q229 HydrophobicContact CB-CG 4.06Å; Q225-Q229 WeakPolarHBondContact O-CB 3.2Å; Q225-Q229 VanDerWaalsContact O-CG 3.31Å; Q225-Q229 WeakPolarHBondContact O-CG 3.42Å; Q225-Q229 PolarHBondContact O-N 2.97Å | ||
| 226 | F | 82.3 | Confident | 90.2 | Very high | 112 Ų | 112 | 34.1 Ų | 34.1 | 49% | 0.491 | 19% | 0.185 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -98.1 | 141.2 | 173.9 | -70.5 | -75.2 | 0 | 0 | 0 | 111.2 | P39 | P39-F226 HydrophobicContact CB-CD2 4.11Å; P39-F226 HydrophobicContact CB-CE1 4.37Å; P39-F226 HydrophobicContact CB-CE2 3.04Å; P39-F226 HydrophobicContact CB-CZ 3.24Å; P39-F226 HydrophobicContact CG-CD2 4.4Å; P39-F226 HydrophobicContact CG-CE1 3.87Å; P39-F226 HydrophobicContact CG-CE2 3.45Å; P39-F226 VanDerWaalsContact CG-CE2 3.45Å; P39-F226 HydrophobicContact CG-CZ 3.13Å |
| 227 | P | 87.5 | Confident | 90.2 | Very high | 75 Ų | 75 | 34.8 Ų | 34.8 | 49% | 0.487 | 19% | 0.19 | S | C | . | . | T | Hydrogen-bonded Turn | cis | -90 | 2.2 | 1.5 | 35 | -35.6 | 0 | 0 | 0 | 114.6 | Q229 L230 L231 | P227-Q229 VanDerWaalsContact C-N 3.32Å; P227-Q229 PolarHBondContact O-N 2.87Å; P227-L230 WeakPolarHBondContact O-CB 3.47Å; P227-L230 PolarHBondContact O-N 3.11Å; P227-L231 HydrophobicContact CB-CD1 4.26Å; P227-L231 HydrophobicContact CG-CD1 4.27Å; P227-L231 WeakPolarHBondContact O-CD1 3.35Å; P227-L231 WeakPolarHBondContact O-CG 3.27Å; P227-L231 PolarHBondContact O-N 2.67Å |
| 228 | T | 89.8 | Confident | 90.4 | Very high | 30 Ų | 30 | 37.3 Ų | 37.3 | 18% | 0.184 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -58 | -39.4 | -169.2 | 67.8 | 0 | 0 | 0 | 0 | 113.5 | E162 S164 Q225 G232 | E162-T228 WeakPolarHBondContact O-CB 3.26Å; E162-T228 WeakPolarHBondContact O-CG2 3.44Å; S164-T228 PolarHBondContact N-O 3.21Å; S164-T228 VanDerWaalsContact N-O 3.11Å; Q225-T228 WeakPolarHBondContact CB-OG1 3.25Å; Q225-T228 PolarHBondContact O-N 3.36Å; Q225-T228 PolarHBondContact O-OG1 3.09Å; T228-G232 PolarHBondContact O-N 3.46Å; T228-G232 VanDerWaalsContact O-N 3.16Å |
| 229 | Q | 92.6 | Very high | 90.6 | Very high | 3 Ų | 3 | 37 Ų | 37 | 1% | 0.014 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -70.1 | -38.6 | 175.9 | -70.6 | 177.3 | -37.4 | 0 | 0 | 112.8 | V167 L220 F223 Q225 P227 L231 G232 G233 | V167-Q229 WeakPolarHBondContact CG1-O 3.3Å; V167-Q229 HydrophobicContact CG2-CB 4.02Å; V167-Q229 HydrophobicContact CG2-CG 3.87Å; L220-Q229 HydrophobicContact CD2-CB 4.23Å; F223-Q229 PolarHBondContact O-NE2 3.24Å; F223-Q229 PolarHBondContact O-OE1 2.99Å; Q225-Q229 HydrophobicContact CB-CG 4.06Å; Q225-Q229 WeakPolarHBondContact O-CB 3.2Å; Q225-Q229 VanDerWaalsContact O-CG 3.31Å; Q225-Q229 WeakPolarHBondContact O-CG 3.42Å; Q225-Q229 PolarHBondContact O-N 2.97Å; P227-Q229 VanDerWaalsContact C-N 3.32Å; P227-Q229 PolarHBondContact O-N 2.87Å; Q229-L231 VanDerWaalsContact C-N 3.32Å; Q229-L231 PolarHBondContact O-N 3.39Å; Q229-G232 PolarHBondContact O-N 2.86Å; Q229-G233 PolarHBondContact O-N 2.89Å |
| 230 | L | 93.4 | Very high | 90.8 | Very high | 73 Ų | 73 | 37.2 Ų | 37.2 | 38% | 0.382 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -64.6 | -40.4 | 178.1 | -176.9 | 63 | 0 | 0 | 0 | 110.8 | L35 V36 P227 G233 A234 | L35-L230 HydrophobicContact CB-CD1 4.43Å; V36-L230 HydrophobicContact CG2-CD1 4.19Å; P227-L230 WeakPolarHBondContact O-CB 3.47Å; P227-L230 PolarHBondContact O-N 3.11Å; L230-G233 PolarHBondContact O-N 3.3Å; L230-A234 WeakPolarHBondContact O-CB 3.44Å; L230-A234 PolarHBondContact O-N 3.04Å |
| 231 | L | 93.6 | Very high | 90.9 | Very high | 51 Ų | 51 | 42.3 Ų | 42.3 | 27% | 0.267 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -64.9 | -44.3 | 176.6 | -67.8 | 156.7 | 0 | 0 | 0 | 111.9 | Y161 V163 P227 Q229 G233 A234 L235 | Y161-L231 HydrophobicContact CE1-CD1 3.96Å; Y161-L231 HydrophobicContact CE2-CD1 4.13Å; Y161-L231 VanDerWaalsContact CZ-CD1 3.41Å; Y161-L231 WeakPolarHBondContact OH-CD1 3.43Å; Y161-L231 VanDerWaalsContact OH-CD2 3.32Å; Y161-L231 WeakPolarHBondContact OH-CD2 3.31Å; V163-L231 HydrophobicContact CG1-CB 4.17Å; V163-L231 HydrophobicContact CG2-CB 4.42Å; P227-L231 HydrophobicContact CB-CD1 4.26Å; P227-L231 HydrophobicContact CG-CD1 4.27Å; P227-L231 WeakPolarHBondContact O-CD1 3.35Å; P227-L231 WeakPolarHBondContact O-CG 3.27Å; P227-L231 PolarHBondContact O-N 2.67Å; Q229-L231 VanDerWaalsContact C-N 3.32Å; Q229-L231 PolarHBondContact O-N 3.39Å; L231-G233 VanDerWaalsContact C-N 3.34Å; L231-G233 PolarHBondContact O-N 3.16Å; L231-A234 PolarHBondContact O-N 3.24Å; L231-L235 WeakPolarHBondContact O-CG 3.48Å; L231-L235 PolarHBondContact O-N 3.41Å |
| 232 | G | 93.6 | Very high | 91 | Very high | 0 Ų | 0 | 44 Ų | 44 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -58.9 | -46.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | F168 T228 Q229 A234 L235 G236 | F168-G232 VanDerWaalsContact CA-O 3.28Å; F168-G232 WeakPolarHBondContact CA-O 3.38Å; F168-G232 WeakPolarHBondContact CB-O 3.42Å; T228-G232 PolarHBondContact O-N 3.46Å; T228-G232 VanDerWaalsContact O-N 3.16Å; Q229-G232 PolarHBondContact O-N 2.86Å; G232-A234 PolarHBondContact O-N 3.42Å; G232-L235 PolarHBondContact O-N 2.79Å; G232-G236 PolarHBondContact O-N 2.98Å |
| 233 | G | 94.2 | Very high | 91.3 | Very high | 0 Ų | 0 | 42.4 Ų | 42.4 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -64.9 | -36.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | Q229 L230 L231 G236 C237 | Q229-G233 PolarHBondContact O-N 2.89Å; L230-G233 PolarHBondContact O-N 3.3Å; L231-G233 VanDerWaalsContact C-N 3.34Å; L231-G233 PolarHBondContact O-N 3.16Å; G233-G236 PolarHBondContact O-N 3.33Å; G233-C237 PolarHBondContact O-N 3.34Å; G233-C237 PolarHBondContact O-SG 3.2Å |
| 234 | A | 94.6 | Very high | 91.3 | Very high | 43 Ų | 43 | 40.9 Ų | 40.9 | 36% | 0.355 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -65.1 | -44.7 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | L230 L231 G232 G236 C237 L238 | L230-A234 WeakPolarHBondContact O-CB 3.44Å; L230-A234 PolarHBondContact O-N 3.04Å; L231-A234 PolarHBondContact O-N 3.24Å; G232-A234 PolarHBondContact O-N 3.42Å; A234-G236 VanDerWaalsContact C-N 3.29Å; A234-G236 PolarHBondContact O-N 2.86Å; A234-C237 WeakPolarHBondContact O-CB 3.46Å; A234-C237 PolarHBondContact O-N 3.1Å; A234-L238 WeakPolarHBondContact O-CB 3.09Å; A234-L238 VanDerWaalsContact O-CG 3.3Å; A234-L238 WeakPolarHBondContact O-CG 3.43Å; A234-L238 PolarHBondContact O-N 2.81Å |
| 235 | L | 95.1 | Very high | 91.4 | Very high | 37 Ų | 37 | 41.9 Ų | 41.9 | 19% | 0.194 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -57.7 | -43.4 | 173.1 | -71.8 | 176.3 | 0 | 0 | 0 | 111 | F109 L113 V163 F168 L231 G232 C237 L238 S239 | F109-L235 HydrophobicContact CE1-CD2 4.25Å; L113-L235 HydrophobicContact CD1-CD1 3.92Å; L113-L235 HydrophobicContact CD2-CD1 4.21Å; V163-L235 HydrophobicContact CG1-CD1 3.94Å; F168-L235 HydrophobicContact CD2-CB 3.86Å; F168-L235 HydrophobicContact CE2-CB 4.04Å; F168-L235 HydrophobicContact CG-CB 4.46Å; L231-L235 WeakPolarHBondContact O-CG 3.48Å; L231-L235 PolarHBondContact O-N 3.41Å; G232-L235 PolarHBondContact O-N 2.79Å; L235-C237 PolarHBondContact O-N 3.37Å; L235-L238 PolarHBondContact O-N 3.17Å; L235-S239 WeakPolarHBondContact O-CB 3.34Å; L235-S239 PolarHBondContact O-N 3.26Å; L235-S239 PolarHBondContact O-OG 2.84Å |
| 236 | G | 94.1 | Very high | 91.5 | Very high | 0 Ų | 0 | 39.8 Ų | 39.8 | 0% | 0 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -58.9 | -46.1 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | F168 G232 G233 A234 W240 | F168-G236 VanDerWaalsContact CD2-N 3.31Å; G232-G236 PolarHBondContact O-N 2.98Å; G233-G236 PolarHBondContact O-N 3.33Å; A234-G236 VanDerWaalsContact C-N 3.29Å; A234-G236 PolarHBondContact O-N 2.86Å; G236-W240 PolarHBondContact O-N 3.37Å; G236-W240 VanDerWaalsContact O-N 3.08Å |
| 237 | C | 93.6 | Very high | 91.7 | Very high | 15 Ų | 15 | 38.9 Ų | 38.9 | 10% | 0.101 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -62.6 | -42.5 | 175.2 | -68.6 | 0 | 0 | 0 | 0 | 112.6 | G233 A234 L235 W240 R241 | G233-C237 PolarHBondContact O-N 3.34Å; G233-C237 PolarHBondContact O-SG 3.2Å; A234-C237 WeakPolarHBondContact O-CB 3.46Å; A234-C237 PolarHBondContact O-N 3.1Å; L235-C237 PolarHBondContact O-N 3.37Å; C237-W240 PolarHBondContact O-N 3.26Å; C237-R241 WeakPolarHBondContact O-CB 3.32Å; C237-R241 WeakPolarHBondContact O-CG 3.32Å; C237-R241 PolarHBondContact O-N 3.4Å |
| 238 | L | 94.4 | Very high | 91.6 | Very high | 110 Ų | 110 | 35.3 Ų | 35.3 | 58% | 0.576 | 20% | 0.196 | S | C | * | . | H | α-helix | trans | -67.2 | -44.7 | 179.7 | -72.6 | 173.5 | 0 | 0 | 0 | 111.7 | A234 L235 W240 R241 G242 | A234-L238 WeakPolarHBondContact O-CB 3.09Å; A234-L238 VanDerWaalsContact O-CG 3.3Å; A234-L238 WeakPolarHBondContact O-CG 3.43Å; A234-L238 PolarHBondContact O-N 2.81Å; L235-L238 PolarHBondContact O-N 3.17Å; L238-W240 VanDerWaalsContact C-N 3.33Å; L238-W240 PolarHBondContact O-N 3.4Å; L238-R241 PolarHBondContact O-N 3.37Å; L238-G242 PolarHBondContact O-N 3.07Å |
| 239 | S | 94.3 | Very high | 91.2 | Very high | 5 Ų | 5 | 41.4 Ų | 41.4 | 4% | 0.035 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -57.5 | -47 | 174.7 | -59.2 | 0 | 0 | 0 | 0 | 110.9 | F109 L235 G242 L243 | F109-S239 WeakPolarHBondContact CE2-OG 3.47Å; L235-S239 WeakPolarHBondContact O-CB 3.34Å; L235-S239 PolarHBondContact O-N 3.26Å; L235-S239 PolarHBondContact O-OG 2.84Å; S239-G242 PolarHBondContact O-N 3.34Å; S239-L243 WeakPolarHBondContact O-CB 2.79Å; S239-L243 VanDerWaalsContact O-CG 3.31Å; S239-L243 WeakPolarHBondContact O-CG 3.18Å; S239-L243 PolarHBondContact O-N 2.9Å |
| 240 | W | 94.3 | Very high | 90.4 | Very high | 8 Ų | 8 | 48.6 Ų | 48.6 | 3% | 0.03 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -62.3 | -46.1 | 176 | 167.6 | 80.8 | 0 | 0 | 0 | 112.6 | H28 L175 G236 C237 L238 G242 L243 Y244 Q245 | H28-W240 HydrophobicContact CB-CE3 4.39Å; H28-W240 HydrophobicContact CB-CH2 4.02Å; H28-W240 HydrophobicContact CB-CZ3 3.72Å; H28-W240 AromaticContact CG-CZ3 3.87Å; H28-W240 AromaticContact ND1-CH2 3.94Å; L175-W240 HydrophobicContact CB-CB 3.97Å; L175-W240 HydrophobicContact CB-CD2 4.27Å; L175-W240 HydrophobicContact CB-CG 3.68Å; L175-W240 HydrophobicContact CD1-CB 3.59Å; L175-W240 HydrophobicContact CD1-CD2 4.13Å; L175-W240 HydrophobicContact CD1-CE3 4.27Å; L175-W240 HydrophobicContact CD1-CG 3.84Å; L175-W240 HydrophobicContact CD2-CD2 4.29Å; L175-W240 HydrophobicContact CD2-CE3 4.47Å; L175-W240 HydrophobicContact CG-CB 4.38Å; L175-W240 HydrophobicContact CG-CD2 4.47Å; L175-W240 HydrophobicContact CG-CG 4.22Å; G236-W240 PolarHBondContact O-N 3.37Å; G236-W240 VanDerWaalsContact O-N 3.08Å; C237-W240 PolarHBondContact O-N 3.26Å; L238-W240 VanDerWaalsContact C-N 3.33Å; L238-W240 PolarHBondContact O-N 3.4Å; W240-G242 PolarHBondContact O-N 3.26Å; W240-L243 PolarHBondContact O-N 3.33Å; W240-Y244 AromaticContact CD1-CD2 3.34Å; W240-Y244 AromaticContact CD1-CG 3.94Å; W240-Y244 HydrophobicContact CG-CD2 4.26Å; W240-Y244 AromaticContact NE1-CD2 3.8Å; W240-Y244 AromaticContact NE1-CG 3.91Å; W240-Y244 PolarHBondContact O-N 2.84Å; W240-Q245 HydrophobicContact CH2-CG 4.32Å |
| 241 | R | 92.6 | Very high | 89.1 | Confident | 108 Ų | 108 | 45.9 Ų | 45.9 | 41% | 0.408 | 24% | 0.241 | S | C | . | . | I | π-helix | trans | -60 | -47.2 | 177.4 | -77.3 | -175.3 | 176 | -168.1 | -2.7 | 110.9 | H28 C237 L238 L243 Q245 G246 | H28-R241 PolarHBondContact CD2-NH2 3.48Å; H28-R241 PolarHBondContact NE2-NH2 3Å; H28-R241 VanDerWaalsContact NE2-NH2 3.14Å; C237-R241 WeakPolarHBondContact O-CB 3.32Å; C237-R241 WeakPolarHBondContact O-CG 3.32Å; C237-R241 PolarHBondContact O-N 3.4Å; L238-R241 PolarHBondContact O-N 3.37Å; R241-L243 VanDerWaalsContact C-N 3.34Å; R241-L243 PolarHBondContact O-N 2.92Å; R241-Q245 CarbonylContact O-C 3.32Å; R241-Q245 VanDerWaalsContact O-CA 3.29Å; R241-Q245 WeakPolarHBondContact O-CA 3.42Å; R241-Q245 VanDerWaalsContact O-CB 3.26Å; R241-Q245 WeakPolarHBondContact O-CB 3.19Å; R241-Q245 PolarHBondContact O-N 2.9Å; R241-G246 PolarHBondContact O-N 2.82Å |
| 242 | G | 91.3 | Very high | 87.9 | Confident | 43 Ų | 43 | 47.7 Ų | 47.7 | 44% | 0.443 | 26% | 0.255 | S | S | . | . | I | π-helix | trans | -56.9 | -46.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | L238 S239 W240 G246 W247 | L238-G242 PolarHBondContact O-N 3.07Å; S239-G242 PolarHBondContact O-N 3.34Å; W240-G242 PolarHBondContact O-N 3.26Å; G242-G246 CarbonylContact O-C 3.41Å; G242-G246 VanDerWaalsContact O-CA 3.32Å; G242-G246 WeakPolarHBondContact O-CA 3.37Å; G242-G246 PolarHBondContact O-N 3Å; G242-W247 PolarHBondContact O-N 3.47Å |
| 243 | L | 91.4 | Very high | 86.8 | Confident | 7 Ų | 7 | 50.1 Ų | 50.1 | 4% | 0.037 | 27% | 0.272 | C | S | . | . | I | π-helix | trans | -71.7 | -63.4 | 179 | -67.4 | 178.4 | 0 | 0 | 0 | 112.5 | V101 A102 L105 S239 W240 R241 W247 Y248 | V101-L243 HydrophobicContact CG1-CD2 3.59Å; A102-L243 HydrophobicContact CB-CD1 3.91Å; L105-L243 HydrophobicContact CD2-CD1 3.8Å; L105-L243 HydrophobicContact CD2-CD2 4.15Å; L105-L243 HydrophobicContact CD2-CG 3.88Å; S239-L243 WeakPolarHBondContact O-CB 2.79Å; S239-L243 VanDerWaalsContact O-CG 3.31Å; S239-L243 WeakPolarHBondContact O-CG 3.18Å; S239-L243 PolarHBondContact O-N 2.9Å; W240-L243 PolarHBondContact O-N 3.33Å; R241-L243 VanDerWaalsContact C-N 3.34Å; R241-L243 PolarHBondContact O-N 2.92Å; L243-W247 HydrophobicContact CD2-CE3 3.78Å; L243-W247 HydrophobicContact CD2-CZ3 4.25Å; L243-W247 PolarHBondContact O-N 3.22Å; L243-Y248 HydrophobicContact CB-CE2 4.12Å; L243-Y248 VanDerWaalsContact O-CB 3.32Å; L243-Y248 WeakPolarHBondContact O-CB 3.5Å; L243-Y248 PolarHBondContact O-N 3.35Å |
| 244 | Y | 86.7 | Confident | 85.4 | Confident | 3 Ų | 3 | 61.9 Ų | 61.9 | 1% | 0.012 | 32% | 0.317 | C | S | . | . | I | π-helix | trans | -83.7 | -32.4 | -167.7 | -74.5 | -87 | 0 | 0 | 0 | 114.2 | E179 E180 W240 Y248 R259 P260 | E179-Y244 HydrophobicContact CB-CD1 4.21Å; E179-Y244 HydrophobicContact CB-CE1 4.12Å; E179-Y244 HydrophobicContact CG-CD1 3.39Å; E179-Y244 HydrophobicContact CG-CE1 3.68Å; E179-Y244 HydrophobicContact CG-CG 3.97Å; E180-Y244 WeakPolarHBondContact OE1-CE1 3.06Å; E180-Y244 PolarHBondContact OE1-OH 3.32Å; W240-Y244 AromaticContact CD1-CD2 3.34Å; W240-Y244 AromaticContact CD1-CG 3.94Å; W240-Y244 HydrophobicContact CG-CD2 4.26Å; W240-Y244 AromaticContact NE1-CD2 3.8Å; W240-Y244 AromaticContact NE1-CG 3.91Å; W240-Y244 PolarHBondContact O-N 2.84Å; Y244-Y248 AromaticContact CD1-CD2 3.68Å; Y244-Y248 HydrophobicContact CD1-CD2 3.68Å; Y244-Y248 HydrophobicContact CD1-CE2 4.12Å; Y244-Y248 HydrophobicContact CD2-CD2 4.46Å; Y244-Y248 HydrophobicContact CD2-CE2 4.35Å; Y244-Y248 AromaticContact CE1-CD2 3.92Å; Y244-Y248 HydrophobicContact CE1-CD2 3.92Å; Y244-Y248 AromaticContact CE1-CE2 3.97Å; Y244-Y248 HydrophobicContact CE1-CE2 3.97Å; Y244-Y248 HydrophobicContact CE2-CE2 4.2Å; Y244-Y248 AromaticContact CG-CD2 4Å; Y244-Y248 HydrophobicContact CG-CD2 4Å; Y244-Y248 HydrophobicContact CG-CE2 4.33Å; Y244-R259 PolarHBondContact O-NE 3.2Å; Y244-P260 HydrophobicContact CD1-CG 4.01Å; Y244-P260 HydrophobicContact CE1-CG 3.65Å |
| 245 | Q | 86.5 | Confident | 84 | Confident | 78 Ų | 78 | 68.8 Ų | 68.8 | 36% | 0.364 | 34% | 0.335 | S | S | . | . | I | π-helix | trans | -96.8 | -18.7 | 177.7 | -56 | -170.4 | -6.5 | 0 | 0 | 113.5 | W240 R241 R249 | W240-Q245 HydrophobicContact CH2-CG 4.32Å; R241-Q245 CarbonylContact O-C 3.32Å; R241-Q245 VanDerWaalsContact O-CA 3.29Å; R241-Q245 WeakPolarHBondContact O-CA 3.42Å; R241-Q245 VanDerWaalsContact O-CB 3.26Å; R241-Q245 WeakPolarHBondContact O-CB 3.19Å; R241-Q245 PolarHBondContact O-N 2.9Å; Q245-R249 WeakPolarHBondContact O-CD 3.39Å; Q245-R249 WeakPolarHBondContact O-CG 3.19Å |
| 246 | G | 86.5 | Confident | 83 | Confident | 34 Ų | 34 | 67.5 Ų | 67.5 | 35% | 0.351 | 33% | 0.329 | S | S | . | . | I | π-helix | trans | -102 | -85.2 | 175 | 0 | 0 | 0 | 0 | 0 | 111.6 | R241 G242 Y248 R249 | R241-G246 PolarHBondContact O-N 2.82Å; G242-G246 CarbonylContact O-C 3.41Å; G242-G246 VanDerWaalsContact O-CA 3.32Å; G242-G246 WeakPolarHBondContact O-CA 3.37Å; G242-G246 PolarHBondContact O-N 3Å; G246-Y248 PolarHBondContact O-N 3.1Å; G246-R249 WeakPolarHBondContact O-CB 3.48Å; G246-R249 PolarHBondContact O-N 3.44Å; G246-R249 VanDerWaalsContact O-N 3.17Å |
| 247 | W | 86.1 | Confident | 81.9 | Confident | 94 Ų | 94 | 67.8 Ų | 67.8 | 36% | 0.356 | 33% | 0.331 | S | S | . | . | G | 310 helix | trans | -61.1 | -46.7 | -167.8 | -170.8 | 11.8 | 0 | 0 | 0 | 113.2 | V101 G242 L243 R249 M250 Y255 C256 | V101-W247 HydrophobicContact CG1-CE3 4.11Å; V101-W247 HydrophobicContact CG1-CH2 4.21Å; V101-W247 HydrophobicContact CG1-CZ3 3.44Å; V101-W247 VanDerWaalsContact CG1-CZ3 3.44Å; V101-W247 HydrophobicContact CG2-CH2 4.36Å; V101-W247 HydrophobicContact CG2-CZ3 4.38Å; G242-W247 PolarHBondContact O-N 3.47Å; L243-W247 HydrophobicContact CD2-CE3 3.78Å; L243-W247 HydrophobicContact CD2-CZ3 4.25Å; L243-W247 PolarHBondContact O-N 3.22Å; W247-R249 PolarHBondContact O-N 3.32Å; W247-M250 WeakPolarHBondContact O-CB 3.29Å; W247-M250 PolarHBondContact O-N 3.42Å; W247-M250 VanDerWaalsContact O-N 3.13Å; W247-Y255 VanDerWaalsContact CZ2-O 3.29Å; W247-Y255 WeakPolarHBondContact CZ2-O 3.34Å; W247-C256 PolarHBondContact NE1-SG 3.39Å |
| 248 | Y | 85.3 | Confident | 81.1 | Confident | 0 Ų | 0 | 67.3 Ų | 67.3 | 0% | 0 | 33% | 0.328 | C | S | . | . | G | 310 helix | trans | -71.6 | -13.4 | -177.4 | -60.9 | -12.9 | 0 | 0 | 0 | 113.2 | R98 L243 Y244 G246 M250 P257 R259 | R98-Y248 WeakPolarHBondContact CA-OH 3.46Å; R98-Y248 HydrophobicContact CB-CE2 4.04Å; R98-Y248 HydrophobicContact CG-CD2 4.38Å; R98-Y248 HydrophobicContact CG-CE2 3.76Å; R98-Y248 PolarHBondContact O-OH 3.5Å; L243-Y248 HydrophobicContact CB-CE2 4.12Å; L243-Y248 VanDerWaalsContact O-CB 3.32Å; L243-Y248 WeakPolarHBondContact O-CB 3.5Å; L243-Y248 PolarHBondContact O-N 3.35Å; Y244-Y248 AromaticContact CD1-CD2 3.68Å; Y244-Y248 HydrophobicContact CD1-CD2 3.68Å; Y244-Y248 HydrophobicContact CD1-CE2 4.12Å; Y244-Y248 HydrophobicContact CD2-CD2 4.46Å; Y244-Y248 HydrophobicContact CD2-CE2 4.35Å; Y244-Y248 AromaticContact CE1-CD2 3.92Å; Y244-Y248 HydrophobicContact CE1-CD2 3.92Å; Y244-Y248 AromaticContact CE1-CE2 3.97Å; Y244-Y248 HydrophobicContact CE1-CE2 3.97Å; Y244-Y248 HydrophobicContact CE2-CE2 4.2Å; Y244-Y248 AromaticContact CG-CD2 4Å; Y244-Y248 HydrophobicContact CG-CD2 4Å; Y244-Y248 HydrophobicContact CG-CE2 4.33Å; G246-Y248 PolarHBondContact O-N 3.1Å; Y248-M250 VanDerWaalsContact C-N 3.32Å; Y248-P257 HydrophobicContact CD1-CG 3.73Å; Y248-P257 HydrophobicContact CE1-CG 3.41Å; Y248-P257 VanDerWaalsContact CE1-CG 3.41Å; Y248-R259 WeakPolarHBondContact O-CG 3.44Å; Y248-R259 PolarHBondContact O-N 3.29Å |
| 249 | R | 81.5 | Confident | 80.4 | Confident | 158 Ų | 158 | 65.6 Ų | 65.6 | 60% | 0.596 | 31% | 0.314 | S | S | * | . | G | 310 helix | trans | -71.6 | -24.2 | 171.1 | -81.1 | -179.6 | 95 | 173.7 | -1.6 | 113.6 | Q245 G246 W247 G251 | Q245-R249 WeakPolarHBondContact O-CD 3.39Å; Q245-R249 WeakPolarHBondContact O-CG 3.19Å; G246-R249 WeakPolarHBondContact O-CB 3.48Å; G246-R249 PolarHBondContact O-N 3.44Å; G246-R249 VanDerWaalsContact O-N 3.17Å; W247-R249 PolarHBondContact O-N 3.32Å; R249-G251 PolarHBondContact O-N 3.18Å |
| 250 | M | 75.4 | Confident | 79.6 | Confident | 153 Ų | 153 | 66.1 Ų | 66.1 | 75% | 0.754 | 32% | 0.318 | S | S | * | . | G | 310 helix | trans | -68.4 | 5.5 | -176.2 | -63.8 | -175.8 | 161 | 0 | 0 | 113.5 | W247 Y248 | W247-M250 WeakPolarHBondContact O-CB 3.29Å; W247-M250 PolarHBondContact O-N 3.42Å; W247-M250 VanDerWaalsContact O-N 3.13Å; Y248-M250 VanDerWaalsContact C-N 3.32Å |
| 251 | G | 66.6 | Low | 78.2 | Confident | 17 Ų | 17 | 66 Ų | 66 | 18% | 0.175 | 32% | 0.319 | C | S | . | . | trans | 82.2 | 170 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | R249 S253 C256 | R249-G251 PolarHBondContact O-N 3.18Å; G251-S253 PolarHBondContact O-N 3.06Å; G251-S253 VanDerWaalsContact O-N 3.11Å; G251-C256 WeakPolarHBondContact O-CB 3.46Å | ||
| 252 | P | 67.9 | Low | 76.9 | Confident | 88 Ų | 88 | 65.5 Ų | 65.5 | 57% | 0.571 | 32% | 0.321 | S | S | * | . | S | Bend | trans | -75.7 | 97.9 | 179.3 | 29.4 | -31.8 | 0 | 0 | 0 | 111 | R94 C256 | R94-P252 VanDerWaalsContact NH2-CA 3.25Å; R94-P252 VanDerWaalsContact NH2-CB 3.35Å; R94-P252 PolarHBondContact NH2-O 3.4Å; R94-P252 VanDerWaalsContact NH2-O 3.15Å; P252-C256 WeakPolarHBondContact CA-O 3.41Å |
| 253 | S | 69.6 | Low | 75.4 | Confident | 52 Ų | 52 | 64.8 Ų | 64.8 | 36% | 0.364 | 31% | 0.314 | S | S | . | . | trans | -109.5 | 169.5 | 166.8 | 77.5 | 0 | 0 | 0 | 0 | 112 | R94 G251 Y255 C256 | R94-S253 PolarHBondContact NH2-O 3.38Å; G251-S253 PolarHBondContact O-N 3.06Å; G251-S253 VanDerWaalsContact O-N 3.11Å; S253-Y255 PolarHBondContact O-N 3.04Å; S253-Y255 PolarHBondContact OG-N 3.44Å; S253-C256 PolarHBondContact N-O 3.11Å; S253-C256 CarbonylContact O-C 3.51Å; S253-C256 PolarHBondContact O-N 3.1Å; S253-C256 WeakPolarHBondContact OG-CB 3.43Å; S253-C256 PolarHBondContact OG-N 2.91Å; S253-C256 PolarHBondContact OG-SG 2.88Å; S253-C256 VanDerWaalsContact OG-SG 3.38Å | ||
| 254 | W | 65 | Low | 73.9 | Confident | 246 Ų | 246 | 65 Ų | 65 | 93% | 0.932 | 32% | 0.315 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -48.9 | -32.3 | 177 | -173.6 | -92.7 | 0 | 0 | 0 | 113.3 | ||
| 255 | Y | 65.4 | Low | 72.6 | Confident | 189 Ų | 189 | 66.8 Ų | 66.8 | 74% | 0.741 | 33% | 0.325 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.1 | -13.9 | 177.3 | -91.3 | -95.2 | 0 | 0 | 0 | 115 | W247 S253 | W247-Y255 VanDerWaalsContact CZ2-O 3.29Å; W247-Y255 WeakPolarHBondContact CZ2-O 3.34Å; S253-Y255 PolarHBondContact O-N 3.04Å; S253-Y255 PolarHBondContact OG-N 3.44Å |
| 256 | C | 73.9 | Confident | 71.4 | Confident | 10 Ų | 10 | 68.2 Ų | 68.2 | 7% | 0.068 | 34% | 0.335 | C | S | . | . | trans | -120.2 | 122.8 | -173.6 | -59.7 | 0 | 0 | 0 | 0 | 111.5 | R94 W247 G251 P252 S253 G258 | R94-C256 PolarHBondContact NE-O 3.29Å; R94-C256 PolarHBondContact NH2-O 3.13Å; W247-C256 PolarHBondContact NE1-SG 3.39Å; G251-C256 WeakPolarHBondContact O-CB 3.46Å; P252-C256 WeakPolarHBondContact CA-O 3.41Å; S253-C256 PolarHBondContact N-O 3.11Å; S253-C256 CarbonylContact O-C 3.51Å; S253-C256 PolarHBondContact O-N 3.1Å; S253-C256 WeakPolarHBondContact OG-CB 3.43Å; S253-C256 PolarHBondContact OG-N 2.91Å; S253-C256 PolarHBondContact OG-SG 2.88Å; S253-C256 VanDerWaalsContact OG-SG 3.38Å; C256-G258 VanDerWaalsContact C-N 3.27Å; C256-G258 PolarHBondContact O-N 2.92Å | ||
| 257 | P | 72.3 | Confident | 70.1 | Confident | 6 Ų | 6 | 71.2 Ų | 71.2 | 4% | 0.039 | 34% | 0.341 | C | S | . | . | trans | -72.7 | -19.5 | 177.7 | 27.7 | -33.5 | 0 | 0 | 0 | 113.4 | R94 R98 Y248 | R94-P257 HydrophobicContact CG-CB 4.36Å; R94-P257 WeakPolarHBondContact O-CB 3.27Å; R98-P257 HydrophobicContact CG-CB 3.64Å; R98-P257 HydrophobicContact CG-CG 3.5Å; Y248-P257 HydrophobicContact CD1-CG 3.73Å; Y248-P257 HydrophobicContact CE1-CG 3.41Å; Y248-P257 VanDerWaalsContact CE1-CG 3.41Å | ||
| 258 | G | 77.2 | Confident | 68.8 | Low | 4 Ų | 4 | 70.2 Ų | 70.2 | 4% | 0.041 | 34% | 0.339 | C | S | . | . | trans | 79.7 | 164.3 | 179.5 | 0 | 0 | 0 | 0 | 0 | 114 | R98 C256 | R98-G258 PolarHBondContact NH1-O 2.8Å; C256-G258 VanDerWaalsContact C-N 3.27Å; C256-G258 PolarHBondContact O-N 2.92Å | ||
| 259 | R | 79.3 | Confident | 67.6 | Low | 75 Ų | 75 | 74 Ų | 74 | 28% | 0.283 | 36% | 0.362 | S | S | . | . | trans | -62.7 | 147.1 | -176.4 | -73.4 | -168.8 | 150.4 | 179.5 | -7.4 | 113.5 | Y244 Y248 G261 Q262 | Y244-R259 PolarHBondContact O-NE 3.2Å; Y248-R259 WeakPolarHBondContact O-CG 3.44Å; Y248-R259 PolarHBondContact O-N 3.29Å; R259-G261 PolarHBondContact O-N 3.42Å; R259-Q262 HydrophobicContact CB-CB 3.96Å; R259-Q262 WeakPolarHBondContact O-CB 3.12Å; R259-Q262 PolarHBondContact O-N 3.38Å; R259-Q262 VanDerWaalsContact O-N 3.1Å | ||
| 260 | P | 76.3 | Confident | 66.6 | Low | 16 Ų | 16 | 70.6 Ų | 70.6 | 10% | 0.104 | 36% | 0.362 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -53.3 | 131 | 167.7 | -25.7 | 36.5 | 0 | 0 | 0 | 111.2 | E179 V183 Y244 Q262 | E179-P260 HydrophobicContact CG-CG 4.14Å; V183-P260 HydrophobicContact CG2-CB 3.36Å; Y244-P260 HydrophobicContact CD1-CG 4.01Å; Y244-P260 HydrophobicContact CE1-CG 3.65Å; P260-Q262 PolarHBondContact O-N 3.16Å |
| 261 | G | 66.7 | Low | 65.8 | Low | 6 Ų | 6 | 66.2 Ų | 66.2 | 6% | 0.062 | 35% | 0.347 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 79.9 | -14.8 | -178.4 | 0 | 0 | 0 | 0 | 0 | 115.9 | R259 G263 L264 L265 | R259-G261 PolarHBondContact O-N 3.42Å; G261-G263 PolarHBondContact O-N 3.48Å; G261-L264 PolarHBondContact O-N 3.42Å; G261-L265 WeakPolarHBondContact O-CG 3.41Å; G261-L265 PolarHBondContact O-N 3.29Å; G261-L265 VanDerWaalsContact O-N 3.1Å |
| 262 | Q | 65.2 | Low | 65.5 | Low | 97 Ų | 97 | 67.5 Ų | 67.5 | 45% | 0.453 | 36% | 0.356 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.5 | 123.3 | 178.4 | -161.3 | 146.1 | 8.9 | 0 | 0 | 110 | R259 P260 L264 | R259-Q262 HydrophobicContact CB-CB 3.96Å; R259-Q262 WeakPolarHBondContact O-CB 3.12Å; R259-Q262 PolarHBondContact O-N 3.38Å; R259-Q262 VanDerWaalsContact O-N 3.1Å; P260-Q262 PolarHBondContact O-N 3.16Å; Q262-L264 VanDerWaalsContact C-N 3.32Å; Q262-L264 PolarHBondContact O-N 2.97Å |
| 263 | G | 58.8 | Low | 65.1 | Low | 28 Ų | 28 | 65.1 Ų | 65.1 | 29% | 0.289 | 35% | 0.347 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 90 | -33.7 | -170.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | G261 M267 | G261-G263 PolarHBondContact O-N 3.48Å; G263-M267 WeakPolarHBondContact O-CB 3.38Å |
| 264 | L | 59.5 | Low | 64.6 | Low | 10 Ų | 10 | 65.3 Ų | 65.3 | 5% | 0.052 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -74.2 | -44.5 | 175.6 | -67.1 | 175.3 | 0 | 0 | 0 | 112.2 | I85 G261 Q262 | I85-L264 HydrophobicContact CB-CD2 3.96Å; I85-L264 HydrophobicContact CD1-CB 4.11Å; I85-L264 HydrophobicContact CD1-CD1 4.15Å; I85-L264 HydrophobicContact CD1-CD2 3.72Å; I85-L264 HydrophobicContact CD1-CG 4.2Å; I85-L264 HydrophobicContact CG1-CD2 4.44Å; I85-L264 HydrophobicContact CG2-CD2 3.76Å; G261-L264 PolarHBondContact O-N 3.42Å; Q262-L264 VanDerWaalsContact C-N 3.32Å; Q262-L264 PolarHBondContact O-N 2.97Å |
| 265 | L | 60.5 | Low | 64.3 | Low | 42 Ų | 42 | 59.4 Ų | 59.4 | 22% | 0.22 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -76.8 | -41 | -179 | -59.4 | 172.9 | 0 | 0 | 0 | 111.9 | P186 L190 G261 M267 K268 T269 | P186-L265 HydrophobicContact CB-CD1 3.98Å; P186-L265 HydrophobicContact CB-CD2 3.98Å; L190-L265 HydrophobicContact CD1-CB 4.03Å; L190-L265 HydrophobicContact CD1-CD2 3.47Å; L190-L265 VanDerWaalsContact CD1-CD2 3.47Å; L190-L265 HydrophobicContact CD1-CG 4.31Å; G261-L265 WeakPolarHBondContact O-CG 3.41Å; G261-L265 PolarHBondContact O-N 3.29Å; G261-L265 VanDerWaalsContact O-N 3.1Å; L265-M267 VanDerWaalsContact C-N 3.3Å; L265-M267 PolarHBondContact O-N 3.05Å; L265-K268 PolarHBondContact O-N 3.38Å; L265-T269 PolarHBondContact O-N 3.25Å; L265-T269 VanDerWaalsContact O-N 3.1Å; L265-T269 PolarHBondContact O-OG1 3.23Å |
| 266 | N | 60.8 | Low | 64 | Low | 108 Ų | 108 | 56 Ų | 56 | 58% | 0.578 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -59.9 | -39.2 | 180 | -75.7 | 4 | 0 | 0 | 0 | 112.4 | T269 S270 | N266-T269 PolarHBondContact O-N 3.04Å; N266-S270 PolarHBondContact O-N 2.86Å; N266-S270 PolarHBondContact O-OG 2.63Å; N266-S270 VanDerWaalsContact O-OG 3.13Å |
| 267 | M | 58.4 | Low | 63.4 | Low | 97 Ų | 97 | 59.5 Ų | 59.5 | 48% | 0.478 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -70.3 | -38 | -177.5 | -162.8 | -179.7 | 125.5 | 0 | 0 | 112.5 | R86 G263 L265 S270 S271 | R86-M267 HydrophobicContact CG-SD 4.34Å; G263-M267 WeakPolarHBondContact O-CB 3.38Å; L265-M267 VanDerWaalsContact C-N 3.3Å; L265-M267 PolarHBondContact O-N 3.05Å; M267-S270 PolarHBondContact O-N 2.93Å; M267-S271 WeakPolarHBondContact O-CB 3.34Å; M267-S271 PolarHBondContact O-N 3.11Å |
| 268 | K | 60.1 | Low | 62.8 | Low | 72 Ų | 72 | 65.2 Ų | 65.2 | 31% | 0.313 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -68.1 | -39.2 | 175 | -173.2 | 71.9 | 171.7 | 178.6 | 0 | 111.1 | L190 G191 L265 S271 A272 | L190-K268 HydrophobicContact CB-CG 4.01Å; L190-K268 WeakPolarHBondContact O-CE 3.36Å; G191-K268 VanDerWaalsContact O-CE 3.31Å; G191-K268 WeakPolarHBondContact O-CE 3.49Å; G191-K268 PolarHBondContact O-NZ 3.32Å; L265-K268 PolarHBondContact O-N 3.38Å; K268-S271 PolarHBondContact O-N 3.32Å; K268-A272 WeakPolarHBondContact O-CB 3.48Å; K268-A272 PolarHBondContact O-N 3.15Å |
| 269 | T | 60 | Low | 61.9 | Low | 79 Ų | 79 | 69.4 Ų | 69.4 | 49% | 0.485 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -61.1 | -42.9 | 172.7 | -51.9 | 0 | 0 | 0 | 0 | 111.7 | L265 N266 G273 | L265-T269 PolarHBondContact O-N 3.25Å; L265-T269 VanDerWaalsContact O-N 3.1Å; L265-T269 PolarHBondContact O-OG1 3.23Å; N266-T269 PolarHBondContact O-N 3.04Å; T269-G273 PolarHBondContact O-N 3.28Å |
| 270 | S | 59.6 | Low | 60.9 | Low | 87 Ų | 87 | 71.8 Ų | 71.8 | 61% | 0.608 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -65.1 | -39.9 | 175.2 | -62 | 0 | 0 | 0 | 0 | 112.9 | N266 M267 A274 | N266-S270 PolarHBondContact O-N 2.86Å; N266-S270 PolarHBondContact O-OG 2.63Å; N266-S270 VanDerWaalsContact O-OG 3.13Å; M267-S270 PolarHBondContact O-N 2.93Å; S270-A274 WeakPolarHBondContact O-CB 3.42Å; S270-A274 PolarHBondContact O-N 3.19Å |
| 271 | S | 59.3 | Low | 60.2 | Low | 62 Ų | 62 | 76.7 Ų | 76.7 | 43% | 0.434 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -65.3 | -44.5 | 176.5 | -173.1 | 0 | 0 | 0 | 0 | 112.2 | M267 K268 A274 E275 | M267-S271 WeakPolarHBondContact O-CB 3.34Å; M267-S271 PolarHBondContact O-N 3.11Å; K268-S271 PolarHBondContact O-N 3.32Å; S271-A274 PolarHBondContact O-N 3.45Å; S271-E275 PolarHBondContact O-N 3.04Å |
| 272 | A | 59 | Low | 59.5 | Low | 43 Ų | 43 | 84 Ų | 84 | 36% | 0.355 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -64.5 | -41.8 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | K268 A274 E275 D276 | K268-A272 WeakPolarHBondContact O-CB 3.48Å; K268-A272 PolarHBondContact O-N 3.15Å; A272-A274 VanDerWaalsContact C-N 3.31Å; A272-A274 PolarHBondContact O-N 3.07Å; A272-E275 PolarHBondContact O-N 3.38Å; A272-D276 PolarHBondContact O-N 3.42Å; A272-D276 VanDerWaalsContact O-N 3.07Å |
| 273 | G | 59.5 | Low | 58.9 | Low | 38 Ų | 38 | 89.3 Ų | 89.3 | 39% | 0.392 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65.5 | -31.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | T269 T277 | T269-G273 PolarHBondContact O-N 3.28Å; G273-T277 PolarHBondContact O-N 3.04Å; G273-T277 PolarHBondContact O-OG1 3.48Å |
| 274 | A | 59.8 | Low | 58.4 | Low | 57 Ų | 57 | 96.6 Ų | 96.6 | 47% | 0.471 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -72.6 | -37.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | S270 S271 A272 T277 L278 | S270-A274 WeakPolarHBondContact O-CB 3.42Å; S270-A274 PolarHBondContact O-N 3.19Å; S271-A274 PolarHBondContact O-N 3.45Å; A272-A274 VanDerWaalsContact C-N 3.31Å; A272-A274 PolarHBondContact O-N 3.07Å; A274-T277 WeakPolarHBondContact CA-OG1 3.46Å; A274-T277 PolarHBondContact O-OG1 3.02Å; A274-T277 VanDerWaalsContact O-OG1 3.13Å; A274-L278 WeakPolarHBondContact O-CB 3.37Å; A274-L278 PolarHBondContact O-N 3.13Å |
| 275 | E | 58.7 | Low | 58.4 | Low | 122 Ų | 122 | 101 Ų | 101 | 57% | 0.57 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -66.4 | -41.2 | 173.6 | -78.3 | 178.9 | 151.7 | 0 | 0 | 111.9 | S271 A272 T277 L278 N279 | S271-E275 PolarHBondContact O-N 3.04Å; A272-E275 PolarHBondContact O-N 3.38Å; E275-T277 PolarHBondContact O-N 2.72Å; E275-L278 PolarHBondContact O-N 2.99Å; E275-N279 WeakPolarHBondContact O-CB 3.41Å; E275-N279 VanDerWaalsContact O-CG 3.29Å; E275-N279 PolarHBondContact O-N 3.35Å; E275-N279 PolarHBondContact O-ND2 3.35Å |
| 276 | D | 59.6 | Low | 58.2 | Low | 116 Ų | 116 | 104.1 Ų | 104.1 | 62% | 0.62 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -64.4 | -39 | 176.7 | -82.1 | -18.8 | 0 | 0 | 0 | 112.5 | A272 H280 | A272-D276 PolarHBondContact O-N 3.42Å; A272-D276 VanDerWaalsContact O-N 3.07Å; D276-H280 WeakPolarHBondContact O-CB 3.47Å; D276-H280 PolarHBondContact O-N 3.38Å |
| 277 | T | 61.6 | Low | 58.1 | Low | 84 Ų | 84 | 103.8 Ų | 103.8 | 52% | 0.515 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -71.2 | -36.5 | 176.6 | 31.5 | 0 | 0 | 0 | 0 | 112.8 | G273 A274 E275 H280 N281 | G273-T277 PolarHBondContact O-N 3.04Å; G273-T277 PolarHBondContact O-OG1 3.48Å; A274-T277 WeakPolarHBondContact CA-OG1 3.46Å; A274-T277 PolarHBondContact O-OG1 3.02Å; A274-T277 VanDerWaalsContact O-OG1 3.13Å; E275-T277 PolarHBondContact O-N 2.72Å; T277-H280 PolarHBondContact O-N 3.35Å; T277-N281 PolarHBondContact O-N 3.05Å; T277-N281 PolarHBondContact O-ND2 3.13Å |
| 278 | L | 58.2 | Low | 58.1 | Low | 126 Ų | 126 | 104.2 Ų | 104.2 | 66% | 0.66 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -65.2 | -43 | 174.7 | -163.3 | 89.1 | 0 | 0 | 0 | 111.4 | A274 E275 N281 H282 | A274-L278 WeakPolarHBondContact O-CB 3.37Å; A274-L278 PolarHBondContact O-N 3.13Å; E275-L278 PolarHBondContact O-N 2.99Å; L278-N281 PolarHBondContact O-N 3Å; L278-H282 PolarHBondContact O-N 3.2Å |
| 279 | N | 58.2 | Low | 58 | Low | 92 Ų | 92 | 106.3 Ų | 106.3 | 49% | 0.492 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -64.2 | -40.6 | 176.9 | -72.9 | -24.9 | 0 | 0 | 0 | 111.4 | E275 N281 H282 Y283 | E275-N279 WeakPolarHBondContact O-CB 3.41Å; E275-N279 VanDerWaalsContact O-CG 3.29Å; E275-N279 PolarHBondContact O-N 3.35Å; E275-N279 PolarHBondContact O-ND2 3.35Å; N279-N281 VanDerWaalsContact C-N 3.3Å; N279-N281 PolarHBondContact O-N 3.24Å; N279-H282 PolarHBondContact O-N 3.29Å; N279-Y283 WeakPolarHBondContact O-CD2 3.43Å |
| 280 | H | 58.1 | Low | 57.8 | Low | 126 Ų | 126 | 108.1 Ų | 108.1 | 58% | 0.583 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -66.3 | -30.6 | 178.6 | -158.1 | -41.9 | 0 | 0 | 0 | 113.3 | D276 T277 H282 | D276-H280 WeakPolarHBondContact O-CB 3.47Å; D276-H280 PolarHBondContact O-N 3.38Å; T277-H280 PolarHBondContact O-N 3.35Å; H280-H282 VanDerWaalsContact C-N 3.34Å |
| 281 | N | 61.8 | Low | 57.7 | Low | 118 Ų | 118 | 109.6 Ų | 109.6 | 63% | 0.631 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -78.8 | -15.6 | 177.4 | -70.1 | -23.3 | 0 | 0 | 0 | 113.7 | T277 L278 N279 | T277-N281 PolarHBondContact O-N 3.05Å; T277-N281 PolarHBondContact O-ND2 3.13Å; L278-N281 PolarHBondContact O-N 3Å; N279-N281 VanDerWaalsContact C-N 3.3Å; N279-N281 PolarHBondContact O-N 3.24Å |
| 282 | H | 53.8 | Low | 57.6 | Low | 160 Ų | 160 | 113.2 Ų | 113.2 | 74% | 0.741 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -88 | -11.7 | 180 | -152.6 | -41.6 | 0 | 0 | 0 | 112.9 | L278 N279 H280 | L278-H282 PolarHBondContact O-N 3.2Å; N279-H282 PolarHBondContact O-N 3.29Å; H280-H282 VanDerWaalsContact C-N 3.34Å |
| 283 | Y | 52.6 | Low | 57.4 | Low | 209 Ų | 209 | 119.1 Ų | 119.1 | 82% | 0.82 | 62% | 0.622 | S | S | * | * | trans | -107.4 | 3.5 | 179.2 | -76.5 | -81.1 | 0 | 0 | 0 | 114.3 | N279 | N279-Y283 WeakPolarHBondContact O-CD2 3.43Š| ||
| 284 | N | 47.4 | Very low | 57.3 | Low | 181 Ų | 181 | 126.5 Ų | 126.5 | 97% | 0.968 | 64% | 0.643 | S | S | * | * | trans | -111.2 | 0 | 169.7 | -81 | -19.1 | 0 | 0 | 0 | 109.9 |
Retrieved 284 of 284 residues in 333 ms
(Link to these results)