| 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 | 67.6 | Low | 90.3 | Very high | 186 Ų | 186 | 89.7 Ų | 89.7 | 92% | 0.916 | 49% | 0.492 | S | S | * | . | 0 | -55.1 | 0 | -63.4 | -51.3 | -156.6 | 0 | 0 | 113.7 | M3 A4 N5 | M1-M3 PolarHBondContact O-N 2.93Å; M1-A4 PolarHBondContact O-N 3.02Å; M1-A4 VanDerWaalsContact O-N 3.16Å; M1-N5 PolarHBondContact O-N 3.1Å; M1-N5 VanDerWaalsContact O-N 3.08Å | |||
| 2 | P | 82.8 | Confident | 90.8 | Very high | 109 Ų | 109 | 87.8 Ų | 87.8 | 71% | 0.708 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -64.5 | -40.5 | -174 | 24.9 | -33.9 | 0 | 0 | 0 | 113 | A4 N5 L6 | P2-A4 VanDerWaalsContact C-N 3.32Å; P2-A4 PolarHBondContact O-N 3.3Å; P2-N5 PolarHBondContact O-N 3.1Å; P2-L6 PolarHBondContact O-N 2.98Å |
| 3 | M | 90.4 | Very high | 91.2 | Very high | 122 Ų | 122 | 81.8 Ų | 81.8 | 60% | 0.601 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -64.5 | -36.1 | 176.8 | -170.3 | 61.9 | -173.6 | 0 | 0 | 112.7 | M1 L6 L7 | M1-M3 PolarHBondContact O-N 2.93Å; M3-L6 PolarHBondContact O-N 3.42Å; M3-L6 HydrophobicContact SD-CD2 4.45Å; M3-L7 HydrophobicContact CE-CD1 4.39Å; M3-L7 HydrophobicContact CE-CD2 4.45Å; M3-L7 HydrophobicContact CE-CG 4.3Å; M3-L7 HydrophobicContact CG-CD1 4.43Å; M3-L7 WeakPolarHBondContact O-CG 3.37Å; M3-L7 PolarHBondContact O-N 3.24Å |
| 4 | A | 93.1 | Very high | 91.5 | Very high | 46 Ų | 46 | 80.1 Ų | 80.1 | 38% | 0.38 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -66.2 | -44.5 | 176.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | M1 P2 L6 L7 L8 | M1-A4 PolarHBondContact O-N 3.02Å; M1-A4 VanDerWaalsContact O-N 3.16Å; P2-A4 VanDerWaalsContact C-N 3.32Å; P2-A4 PolarHBondContact O-N 3.3Å; A4-L6 VanDerWaalsContact C-N 3.32Å; A4-L6 PolarHBondContact O-N 3.22Å; A4-L7 PolarHBondContact O-N 3.11Å; A4-L8 WeakPolarHBondContact O-CB 3.43Å; A4-L8 WeakPolarHBondContact O-CD1 3.07Å; A4-L8 PolarHBondContact O-N 3.17Å |
| 5 | N | 92.5 | Very high | 91.7 | Very high | 89 Ų | 89 | 80.1 Ų | 80.1 | 48% | 0.476 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -61.7 | -39.5 | 175.8 | -72.8 | 5 | 0 | 0 | 0 | 112.2 | M1 P2 L8 L9 L95 | M1-N5 PolarHBondContact O-N 3.1Å; M1-N5 VanDerWaalsContact O-N 3.08Å; P2-N5 PolarHBondContact O-N 3.1Å; N5-L8 PolarHBondContact O-N 3.14Å; N5-L9 PolarHBondContact O-N 3.4Å; N5-L95 HydrophobicContact CB-CD1 3.74Å |
| 6 | L | 93.8 | Very high | 92 | Very high | 64 Ų | 64 | 77.9 Ų | 77.9 | 34% | 0.335 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -63.9 | -43.1 | 176.4 | -175.9 | 149.2 | 0 | 0 | 0 | 111.6 | P2 M3 A4 L9 I10 | P2-L6 PolarHBondContact O-N 2.98Å; M3-L6 PolarHBondContact O-N 3.42Å; M3-L6 HydrophobicContact SD-CD2 4.45Å; A4-L6 VanDerWaalsContact C-N 3.32Å; A4-L6 PolarHBondContact O-N 3.22Å; L6-L9 PolarHBondContact O-N 2.96Å; L6-I10 HydrophobicContact CD2-CD1 3.4Å; L6-I10 VanDerWaalsContact CD2-CD1 3.4Å; L6-I10 HydrophobicContact CD2-CG1 4.32Å; L6-I10 HydrophobicContact CG-CD1 4.01Å; L6-I10 WeakPolarHBondContact O-CG1 3.48Å; L6-I10 PolarHBondContact O-N 3.43Å |
| 7 | L | 93.6 | Very high | 92.2 | Very high | 88 Ų | 88 | 73.7 Ų | 73.7 | 46% | 0.461 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -64.8 | -41.4 | 174.9 | -72.5 | 167.4 | 0 | 0 | 0 | 111.9 | M3 A4 L9 I10 V11 | M3-L7 HydrophobicContact CE-CD1 4.39Å; M3-L7 HydrophobicContact CE-CD2 4.45Å; M3-L7 HydrophobicContact CE-CG 4.3Å; M3-L7 HydrophobicContact CG-CD1 4.43Å; M3-L7 WeakPolarHBondContact O-CG 3.37Å; M3-L7 PolarHBondContact O-N 3.24Å; A4-L7 PolarHBondContact O-N 3.11Å; L7-L9 PolarHBondContact O-N 2.65Å; L7-I10 PolarHBondContact O-N 2.94Å; L7-V11 WeakPolarHBondContact O-CB 3.33Å; L7-V11 WeakPolarHBondContact O-CG2 3.31Å; L7-V11 PolarHBondContact O-N 3.13Å |
| 8 | L | 94.3 | Very high | 92.3 | Very high | 124 Ų | 124 | 70.7 Ų | 70.7 | 65% | 0.649 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -64 | -22.9 | 174.5 | -86.6 | 152.2 | 0 | 0 | 0 | 113.1 | A4 N5 P12 | A4-L8 WeakPolarHBondContact O-CB 3.43Å; A4-L8 WeakPolarHBondContact O-CD1 3.07Å; A4-L8 PolarHBondContact O-N 3.17Å; N5-L8 PolarHBondContact O-N 3.14Å; L8-P12 WeakPolarHBondContact O-CD 3.17Å; L8-P12 WeakPolarHBondContact O-CG 3.31Å |
| 9 | L | 94.2 | Very high | 92.5 | Very high | 39 Ų | 39 | 70.5 Ų | 70.5 | 20% | 0.204 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -81.4 | -54.6 | 171.6 | -176.8 | 70.9 | 0 | 0 | 0 | 110.7 | N5 L6 L7 P12 I13 W86 L95 | N5-L9 PolarHBondContact O-N 3.4Å; L6-L9 PolarHBondContact O-N 2.96Å; L7-L9 PolarHBondContact O-N 2.65Å; L9-P12 WeakPolarHBondContact O-CD 3.03Å; L9-I13 HydrophobicContact CD1-CD1 3.91Å; L9-I13 HydrophobicContact CG-CD1 3.73Å; L9-I13 WeakPolarHBondContact O-CD1 3.32Å; L9-I13 WeakPolarHBondContact O-CG1 3.08Å; L9-I13 PolarHBondContact O-N 3.37Å; L9-W86 HydrophobicContact CD2-CB 4.26Å; L9-L95 HydrophobicContact CD2-CB 4.29Å; L9-L95 HydrophobicContact CD2-CD2 3.99Å |
| 10 | I | 95.2 | Very high | 92.7 | Very high | 46 Ų | 46 | 67.6 Ų | 67.6 | 24% | 0.236 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -68.2 | -43.1 | -169.9 | -65.1 | 176.7 | 0 | 0 | 0 | 112.2 | L6 L7 I13 L14 L83 | L6-I10 HydrophobicContact CD2-CD1 3.4Å; L6-I10 VanDerWaalsContact CD2-CD1 3.4Å; L6-I10 HydrophobicContact CD2-CG1 4.32Å; L6-I10 HydrophobicContact CG-CD1 4.01Å; L6-I10 WeakPolarHBondContact O-CG1 3.48Å; L6-I10 PolarHBondContact O-N 3.43Å; L7-I10 PolarHBondContact O-N 2.94Å; I10-I13 PolarHBondContact O-N 3.44Å; I10-L14 HydrophobicContact CG2-CD1 3.96Å; I10-L14 HydrophobicContact CG2-CG 4.34Å; I10-L14 WeakPolarHBondContact O-CG 3.34Å; I10-L14 PolarHBondContact O-N 2.88Å; I10-L83 HydrophobicContact CG2-CD1 4.16Å; I10-L83 HydrophobicContact CG2-CD2 4.2Å |
| 11 | V | 95.9 | Very high | 92.7 | Very high | 74 Ų | 74 | 66.3 Ų | 66.3 | 45% | 0.448 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -63.6 | -49.5 | -174.6 | 172.8 | 0 | 0 | 0 | 0 | 111.5 | L7 I13 L14 I15 | L7-V11 WeakPolarHBondContact O-CB 3.33Å; L7-V11 WeakPolarHBondContact O-CG2 3.31Å; L7-V11 PolarHBondContact O-N 3.13Å; V11-I13 VanDerWaalsContact C-N 3.32Å; V11-I13 PolarHBondContact O-N 3.47Å; V11-L14 PolarHBondContact O-N 3.29Å; V11-I15 HydrophobicContact CG1-CD1 3.8Å; V11-I15 VanDerWaalsContact O-CG1 3.32Å; V11-I15 WeakPolarHBondContact O-CG1 3.21Å; V11-I15 PolarHBondContact O-N 3.43Å |
| 12 | P | 95.8 | Very high | 94 | Very high | 67 Ų | 67 | 57.8 Ų | 57.8 | 44% | 0.435 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -61.7 | -34.6 | 174.9 | -27.8 | 39.2 | 0 | 0 | 0 | 114.1 | L8 L9 I15 A16 | L8-P12 WeakPolarHBondContact O-CD 3.17Å; L8-P12 WeakPolarHBondContact O-CG 3.31Å; L9-P12 WeakPolarHBondContact O-CD 3.03Å; P12-I15 PolarHBondContact O-N 3.12Å; P12-A16 VanDerWaalsContact O-CB 3.27Å; P12-A16 WeakPolarHBondContact O-CB 3.17Å; P12-A16 PolarHBondContact O-N 2.87Å |
| 13 | I | 95.9 | Very high | 94.6 | Very high | 10 Ų | 10 | 55.5 Ų | 55.5 | 5% | 0.051 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -63.3 | -45.3 | 176.8 | -67.9 | 162.8 | 0 | 0 | 0 | 110.8 | L9 I10 V11 I15 A16 M17 L83 W86 T229 | L9-I13 HydrophobicContact CD1-CD1 3.91Å; L9-I13 HydrophobicContact CG-CD1 3.73Å; L9-I13 WeakPolarHBondContact O-CD1 3.32Å; L9-I13 WeakPolarHBondContact O-CG1 3.08Å; L9-I13 PolarHBondContact O-N 3.37Å; I10-I13 PolarHBondContact O-N 3.44Å; V11-I13 VanDerWaalsContact C-N 3.32Å; V11-I13 PolarHBondContact O-N 3.47Å; I13-I15 VanDerWaalsContact C-N 3.31Å; I13-I15 PolarHBondContact O-N 3.41Å; I13-A16 PolarHBondContact O-N 3.41Å; I13-M17 WeakPolarHBondContact O-CB 3.38Å; I13-M17 PolarHBondContact O-N 3.47Å; I13-L83 HydrophobicContact CG2-CD2 4.35Å; I13-W86 HydrophobicContact CD1-CB 3.86Å; I13-W86 HydrophobicContact CD1-CD2 3.38Å; I13-W86 HydrophobicContact CD1-CE3 3.5Å; I13-W86 VanDerWaalsContact CD1-CE3 3.5Å; I13-W86 HydrophobicContact CD1-CG 3.54Å; I13-W86 HydrophobicContact CD1-CZ3 4.13Å; I13-W86 HydrophobicContact CG1-CD2 3.95Å; I13-W86 HydrophobicContact CG1-CE3 3.82Å; I13-W86 HydrophobicContact CG1-CH2 4.15Å; I13-W86 HydrophobicContact CG1-CZ2 4.31Å; I13-W86 HydrophobicContact CG1-CZ3 3.9Å; I13-W86 HydrophobicContact CG2-CD2 4.37Å; I13-W86 HydrophobicContact CG2-CH2 4.39Å; I13-W86 HydrophobicContact CG2-CZ2 3.85Å; I13-T229 HydrophobicContact CG2-CG2 3.92Å |
| 14 | L | 95.2 | Very high | 94.8 | Very high | 57 Ų | 57 | 49.9 Ų | 49.9 | 30% | 0.298 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -64.4 | -38.1 | 177.3 | -68.1 | 175.1 | 0 | 0 | 0 | 111.7 | I10 V11 M17 X18 L83 | I10-L14 HydrophobicContact CG2-CD1 3.96Å; I10-L14 HydrophobicContact CG2-CG 4.34Å; I10-L14 WeakPolarHBondContact O-CG 3.34Å; I10-L14 PolarHBondContact O-N 2.88Å; V11-L14 PolarHBondContact O-N 3.29Å; L14-M17 HydrophobicContact CD2-CE 4.13Å; L14-M17 WeakPolarHBondContact O-CE 3.4Å; L14-A18 PolarHBondContact O-N 3.23Å; L14-L83 HydrophobicContact CD2-CD2 4.45Å |
| 15 | I | 95.9 | Very high | 94.9 | Very high | 80 Ų | 80 | 52.6 Ų | 52.6 | 41% | 0.41 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -66.2 | -44.3 | 174.6 | -65.5 | 167.2 | 0 | 0 | 0 | 110.6 | V11 P12 I13 M17 X18 F19 | V11-I15 HydrophobicContact CG1-CD1 3.8Å; V11-I15 VanDerWaalsContact O-CG1 3.32Å; V11-I15 WeakPolarHBondContact O-CG1 3.21Å; V11-I15 PolarHBondContact O-N 3.43Å; P12-I15 PolarHBondContact O-N 3.12Å; I13-I15 VanDerWaalsContact C-N 3.31Å; I13-I15 PolarHBondContact O-N 3.41Å; I15-M17 VanDerWaalsContact C-N 3.33Å; I15-M17 PolarHBondContact O-N 3.02Å; I15-A18 WeakPolarHBondContact O-CB 2.88Å; I15-A18 PolarHBondContact O-N 3.2Å; I15-A18 VanDerWaalsContact O-N 3.14Å; I15-F19 HydrophobicContact CG2-CD2 3.71Å; I15-F19 HydrophobicContact CG2-CE2 3.66Å; I15-F19 VanDerWaalsContact O-CD2 3.29Å; I15-F19 WeakPolarHBondContact O-CD2 3.05Å; I15-F19 PolarHBondContact O-N 3.23Å |
| 16 | A | 95.8 | Very high | 95 | Very high | 46 Ų | 46 | 50.8 Ų | 50.8 | 38% | 0.38 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -60.4 | -43.2 | 178 | 0 | 0 | 0 | 0 | 0 | 111.4 | P12 I13 X18 F19 L20 I232 | P12-A16 VanDerWaalsContact O-CB 3.27Å; P12-A16 WeakPolarHBondContact O-CB 3.17Å; P12-A16 PolarHBondContact O-N 2.87Å; I13-A16 PolarHBondContact O-N 3.41Å; A16-A18 PolarHBondContact O-N 3.01Å; A16-F19 PolarHBondContact O-N 2.76Å; A16-L20 WeakPolarHBondContact O-CB 3.19Å; A16-L20 PolarHBondContact O-N 2.88Å; A16-I232 HydrophobicContact CB-CD1 4.34Å |
| 17 | M | 95.4 | Very high | 95 | Very high | 6 Ų | 6 | 49.9 Ų | 49.9 | 3% | 0.03 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -59.6 | -44.4 | 173.1 | 169.5 | -81.6 | -62.1 | 0 | 0 | 111.9 | I13 L14 I15 F19 L20 M21 M225 Y228 T229 I232 | I13-M17 WeakPolarHBondContact O-CB 3.38Å; I13-M17 PolarHBondContact O-N 3.47Å; L14-M17 HydrophobicContact CD2-CE 4.13Å; L14-M17 WeakPolarHBondContact O-CE 3.4Å; I15-M17 VanDerWaalsContact C-N 3.33Å; I15-M17 PolarHBondContact O-N 3.02Å; M17-F19 VanDerWaalsContact C-N 3.32Å; M17-F19 PolarHBondContact O-N 3.39Å; M17-L20 WeakPolarHBondContact O-CB 3.48Å; M17-L20 PolarHBondContact O-N 2.81Å; M17-L20 VanDerWaalsContact O-N 3.16Å; M17-M21 PolarHBondContact O-N 3.21Å; M17-M21 HydrophobicContact SD-CE 3.77Å; M17-M225 HydrophobicContact CE-CB 3.72Å; M17-M225 HydrophobicContact CE-CG 3.29Å; M17-M225 HydrophobicContact CE-SD 3.64Å; M17-M225 HydrophobicContact SD-CB 4.26Å; M17-M225 HydrophobicContact SD-CG 3.86Å; M17-Y228 VanDerWaalsContact CG-CB 3.47Å; M17-T229 HydrophobicContact CB-CG2 3.93Å; M17-T229 HydrophobicContact CG-CG2 4.08Å; M17-I232 HydrophobicContact CB-CD1 4.39Å |
| 18 | X | 94.8 | Very high | 95 | Very high | 19 Ų | 19 | 46.9 Ų | 46.9 | 16% | 0.157 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -60.4 | -42.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | L14 I15 A16 M21 P48 | L14-A18 PolarHBondContact O-N 3.23Å; I15-A18 WeakPolarHBondContact O-CB 2.88Å; I15-A18 PolarHBondContact O-N 3.2Å; I15-A18 VanDerWaalsContact O-N 3.14Å; A16-A18 PolarHBondContact O-N 3.01Å; A18-M21 PolarHBondContact O-N 3.08Å; A18-P48 HydrophobicContact CB-CB 3.89Å; A18-P48 VanDerWaalsContact O-CB 3.29Å; A18-P48 WeakPolarHBondContact O-CB 3.39Å; A18-P48 WeakPolarHBondContact O-CG 3.5Å |
| 19 | F | 95.6 | Very high | 94.9 | Very high | 68 Ų | 68 | 41 Ų | 41 | 30% | 0.298 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -73.5 | -28.7 | 176.1 | -77 | -70.5 | 0 | 0 | 0 | 113.5 | I15 A16 M17 M21 L22 T23 L45 F49 | I15-F19 HydrophobicContact CG2-CD2 3.71Å; I15-F19 HydrophobicContact CG2-CE2 3.66Å; I15-F19 VanDerWaalsContact O-CD2 3.29Å; I15-F19 WeakPolarHBondContact O-CD2 3.05Å; I15-F19 PolarHBondContact O-N 3.23Å; A16-F19 PolarHBondContact O-N 2.76Å; M17-F19 VanDerWaalsContact C-N 3.32Å; M17-F19 PolarHBondContact O-N 3.39Å; F19-M21 VanDerWaalsContact C-N 3.26Å; F19-M21 PolarHBondContact O-N 3.44Å; F19-L22 HydrophobicContact CD1-CD2 4.26Å; F19-L22 WeakPolarHBondContact O-CB 3.42Å; F19-L22 PolarHBondContact O-N 3.38Å; F19-T23 WeakPolarHBondContact O-CG2 3.33Å; F19-T23 PolarHBondContact O-N 3.41Å; F19-T23 PolarHBondContact O-OG1 3.28Å; F19-L45 HydrophobicContact CE1-CD2 4.19Å; F19-F49 HydrophobicContact CZ-CE2 4.16Å |
| 20 | L | 95.5 | Very high | 95 | Very high | 12 Ų | 12 | 46.2 Ų | 46.2 | 6% | 0.063 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -60.1 | -37.8 | 173.5 | -170.9 | 103.1 | 0 | 0 | 0 | 111.4 | A16 M17 L22 T23 E24 Y228 I231 I232 T267 | A16-L20 WeakPolarHBondContact O-CB 3.19Å; A16-L20 PolarHBondContact O-N 2.88Å; M17-L20 WeakPolarHBondContact O-CB 3.48Å; M17-L20 PolarHBondContact O-N 2.81Å; M17-L20 VanDerWaalsContact O-N 3.16Å; L20-L22 VanDerWaalsContact C-N 3.3Å; L20-L22 PolarHBondContact O-N 2.93Å; L20-T23 WeakPolarHBondContact CA-OG1 3.19Å; L20-T23 PolarHBondContact O-N 3.02Å; L20-T23 PolarHBondContact O-OG1 2.92Å; L20-E24 VanDerWaalsContact O-CB 3.31Å; L20-E24 WeakPolarHBondContact O-CB 3.45Å; L20-E24 PolarHBondContact O-N 3.14Å; L20-Y228 HydrophobicContact CD2-CD1 3.35Å; L20-Y228 HydrophobicContact CD2-CE1 4.11Å; L20-Y228 HydrophobicContact CD2-CG 4.09Å; L20-I231 HydrophobicContact CD2-CG2 4.48Å; L20-I232 HydrophobicContact CB-CD1 4.21Å; L20-I232 HydrophobicContact CD1-CD1 4.19Å; L20-I232 HydrophobicContact CD1-CG1 3.91Å; L20-I232 HydrophobicContact CD2-CD1 4.39Å; L20-I232 HydrophobicContact CD2-CG1 4.21Å; L20-I232 HydrophobicContact CG-CD1 4.5Å; L20-T267 HydrophobicContact CD1-CG2 4.39Å |
| 21 | M | 93.3 | Very high | 94.9 | Very high | 41 Ų | 41 | 47.9 Ų | 47.9 | 20% | 0.202 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -61.6 | -38.3 | 173.8 | -66.2 | -170.7 | -78.7 | 0 | 0 | 112.4 | M17 X18 F19 R25 Y228 | M17-M21 PolarHBondContact O-N 3.21Å; M17-M21 HydrophobicContact SD-CE 3.77Å; A18-M21 PolarHBondContact O-N 3.08Å; F19-M21 VanDerWaalsContact C-N 3.26Å; F19-M21 PolarHBondContact O-N 3.44Å; M21-R25 WeakPolarHBondContact O-CG 3.43Å; M21-R25 PolarHBondContact O-N 3.09Å; M21-Y228 HydrophobicContact CG-CD2 3.67Å; M21-Y228 HydrophobicContact CG-CE2 3.58Å; M21-Y228 HydrophobicContact CG-CG 4.27Å; M21-Y228 HydrophobicContact SD-CD2 4.03Å; M21-Y228 HydrophobicContact SD-CE2 3.93Å |
| 22 | L | 95.5 | Very high | 94.8 | Very high | 7 Ų | 7 | 49.3 Ų | 49.3 | 4% | 0.037 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -69.1 | -45.5 | 175.9 | 176.1 | 65.4 | 0 | 0 | 0 | 111.4 | F19 L20 E24 R25 K26 P37 G44 L45 Q47 P48 | F19-L22 HydrophobicContact CD1-CD2 4.26Å; F19-L22 WeakPolarHBondContact O-CB 3.42Å; F19-L22 PolarHBondContact O-N 3.38Å; L20-L22 VanDerWaalsContact C-N 3.3Å; L20-L22 PolarHBondContact O-N 2.93Å; L22-E24 VanDerWaalsContact C-N 3.3Å; L22-E24 PolarHBondContact O-N 3.14Å; L22-R25 PolarHBondContact O-N 3.35Å; L22-K26 PolarHBondContact O-N 3.17Å; L22-K26 VanDerWaalsContact O-N 3.09Å; L22-P37 HydrophobicContact CD1-CB 4.32Å; L22-P37 HydrophobicContact CD1-CG 4.47Å; L22-G44 WeakPolarHBondContact CD1-O 3.27Å; L22-G44 WeakPolarHBondContact CD2-O 3.39Å; L22-L45 HydrophobicContact CD2-CD2 4.23Å; L22-Q47 HydrophobicContact CD1-CB 4.11Å; L22-P48 HydrophobicContact CB-CG 3.87Å |
| 23 | T | 94.9 | Very high | 94.8 | Very high | 61 Ų | 61 | 54.3 Ų | 54.3 | 37% | 0.374 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -63 | -41.2 | -179.9 | 58.4 | 0 | 0 | 0 | 0 | 110.5 | F19 L20 K26 I27 | F19-T23 WeakPolarHBondContact O-CG2 3.33Å; F19-T23 PolarHBondContact O-N 3.41Å; F19-T23 PolarHBondContact O-OG1 3.28Å; L20-T23 WeakPolarHBondContact CA-OG1 3.19Å; L20-T23 PolarHBondContact O-N 3.02Å; L20-T23 PolarHBondContact O-OG1 2.92Å; T23-K26 PolarHBondContact O-N 2.83Å; T23-I27 WeakPolarHBondContact O-CB 3.2Å; T23-I27 VanDerWaalsContact O-CG1 3.3Å; T23-I27 WeakPolarHBondContact O-CG1 3.42Å; T23-I27 PolarHBondContact O-N 3.16Å |
| 24 | E | 94.4 | Very high | 94.8 | Very high | 4 Ų | 4 | 60.1 Ų | 60.1 | 2% | 0.019 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -54.1 | -56.7 | 172.6 | 171.7 | 160.9 | -160.9 | 0 | 0 | 111.8 | L20 L22 K26 I27 L28 R195 Y228 L271 R274 | L20-E24 VanDerWaalsContact O-CB 3.31Å; L20-E24 WeakPolarHBondContact O-CB 3.45Å; L20-E24 PolarHBondContact O-N 3.14Å; L22-E24 VanDerWaalsContact C-N 3.3Å; L22-E24 PolarHBondContact O-N 3.14Å; E24-K26 PolarHBondContact O-N 3.34Å; E24-I27 PolarHBondContact O-N 3.48Å; E24-L28 HydrophobicContact CG-CD1 3.46Å; E24-L28 VanDerWaalsContact CG-CD1 3.46Å; E24-L28 HydrophobicContact CG-CG 4.01Å; E24-L28 VanDerWaalsContact O-CB 3.27Å; E24-L28 WeakPolarHBondContact O-CB 3.5Å; E24-L28 WeakPolarHBondContact O-CG 3.4Å; E24-L28 PolarHBondContact O-N 3.32Å; E24-R195 IonicContact OE1-CZ 2.65Å; E24-R195 IonicContact OE1-NH2 3.79Å; E24-R195 PolarHBondContact OE1-NH2 3.4Å; E24-R195 IonicContact OE2-CZ 3.39Å; E24-R195 IonicContact OE2-NH2 3.93Å; E24-R195 PolarHBondContact OE2-NH2 3.29Å; E24-Y228 WeakPolarHBondContact OE2-CE1 3.43Å; E24-Y228 PolarHBondContact OE2-OH 3.15Å; E24-L271 HydrophobicContact CB-CD1 4.28Å; E24-L271 HydrophobicContact CB-CD2 3.68Å; E24-L271 HydrophobicContact CG-CD2 3.74Å; E24-R274 WeakPolarHBondContact OE1-CD 3.42Å; E24-R274 IonicContact OE1-CZ 3.95Å; E24-R274 IonicContact OE1-NE 2.82Å; E24-R274 IonicContact OE1-NH1 3.19Å; E24-R274 PolarHBondContact OE1-NH1 3.49Å |
| 25 | R | 94.7 | Very high | 94.7 | Very high | 102 Ų | 102 | 64.7 Ų | 64.7 | 39% | 0.385 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -60.3 | -32 | -178 | -70.4 | -177.4 | -177.5 | 164.4 | 11.2 | 112.7 | M21 L22 G29 P37 D51 | M21-R25 WeakPolarHBondContact O-CG 3.43Å; M21-R25 PolarHBondContact O-N 3.09Å; L22-R25 PolarHBondContact O-N 3.35Å; R25-G29 PolarHBondContact O-N 3.26Å; R25-G29 VanDerWaalsContact O-N 3.09Å; R25-P37 HydrophobicContact CB-CG 3.97Å; R25-D51 IonicContact CZ-OD2 3.8Å; R25-D51 IonicContact NH1-OD1 3.95Å; R25-D51 IonicContact NH1-OD2 2.74Å; R25-D51 PolarHBondContact NH1-OD2 3.09Å; R25-D51 IonicContact NH2-OD2 2.67Å; R25-D51 PolarHBondContact NH2-OD2 3.32Å |
| 26 | K | 94.6 | Very high | 94.6 | Very high | 51 Ų | 51 | 61.3 Ų | 61.3 | 22% | 0.222 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -73.4 | -49.9 | 175.7 | -76.7 | -172.5 | 172.9 | -178.5 | 0 | 112.4 | L22 T23 E24 G29 Y30 Y43 | L22-K26 PolarHBondContact O-N 3.17Å; L22-K26 VanDerWaalsContact O-N 3.09Å; T23-K26 PolarHBondContact O-N 2.83Å; E24-K26 PolarHBondContact O-N 3.34Å; K26-G29 WeakPolarHBondContact O-CA 3.33Å; K26-G29 PolarHBondContact O-N 3.48Å; K26-G29 VanDerWaalsContact O-N 3.14Å; K26-Y30 HydrophobicContact CB-CE2 4.42Å; K26-Y30 WeakPolarHBondContact O-CD2 3.45Å; K26-Y30 PolarHBondContact O-N 2.89Å; K26-Y43 WeakPolarHBondContact CE-O 3.45Å; K26-Y43 PolarHBondContact NZ-O 3.35Å |
| 27 | I | 94.4 | Very high | 94.4 | Very high | 46 Ų | 46 | 60.5 Ų | 60.5 | 24% | 0.236 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -60.9 | -48.5 | -179.5 | -70.8 | 166.9 | 0 | 0 | 0 | 109.8 | T23 E24 G29 Y30 M31 L271 | T23-I27 WeakPolarHBondContact O-CB 3.2Å; T23-I27 VanDerWaalsContact O-CG1 3.3Å; T23-I27 WeakPolarHBondContact O-CG1 3.42Å; T23-I27 PolarHBondContact O-N 3.16Å; E24-I27 PolarHBondContact O-N 3.48Å; I27-G29 VanDerWaalsContact C-N 3.3Å; I27-G29 PolarHBondContact O-N 2.9Å; I27-Y30 PolarHBondContact O-N 2.89Å; I27-M31 HydrophobicContact CG2-CE 3.55Å; I27-M31 HydrophobicContact CG2-CG 4.49Å; I27-M31 HydrophobicContact CG2-SD 3.64Å; I27-M31 WeakPolarHBondContact O-CB 3.29Å; I27-M31 WeakPolarHBondContact O-CG 3.36Å; I27-M31 PolarHBondContact O-N 3.1Å; I27-L271 HydrophobicContact CD1-CD1 3.62Å; I27-L271 HydrophobicContact CG2-CB 4.21Å |
| 28 | L | 93.2 | Very high | 94.3 | Very high | 24 Ų | 24 | 64.3 Ų | 64.3 | 13% | 0.126 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -55 | -46.2 | 172.6 | -70.6 | 172.5 | 0 | 0 | 0 | 111.4 | E24 M31 Q32 R274 T275 | E24-L28 HydrophobicContact CG-CD1 3.46Å; E24-L28 VanDerWaalsContact CG-CD1 3.46Å; E24-L28 HydrophobicContact CG-CG 4.01Å; E24-L28 VanDerWaalsContact O-CB 3.27Å; E24-L28 WeakPolarHBondContact O-CB 3.5Å; E24-L28 WeakPolarHBondContact O-CG 3.4Å; E24-L28 PolarHBondContact O-N 3.32Å; L28-M31 PolarHBondContact O-N 2.99Å; L28-Q32 VanDerWaalsContact O-CB 3.31Å; L28-Q32 WeakPolarHBondContact O-CB 3.31Å; L28-Q32 WeakPolarHBondContact O-CG 3.3Å; L28-Q32 PolarHBondContact O-N 3.47Å; L28-R274 HydrophobicContact CD2-CG 4.01Å; L28-T275 HydrophobicContact CD2-CG2 3.27Å; L28-T275 HydrophobicContact CG-CG2 4.35Å |
| 29 | G | 93.5 | Very high | 94.3 | Very high | 0 Ų | 0 | 69.4 Ų | 69.4 | 0% | 0 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -56.4 | -55.2 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | R25 K26 I27 M31 Q32 L33 R34 | R25-G29 PolarHBondContact O-N 3.26Å; R25-G29 VanDerWaalsContact O-N 3.09Å; K26-G29 WeakPolarHBondContact O-CA 3.33Å; K26-G29 PolarHBondContact O-N 3.48Å; K26-G29 VanDerWaalsContact O-N 3.14Å; I27-G29 VanDerWaalsContact C-N 3.3Å; I27-G29 PolarHBondContact O-N 2.9Å; G29-M31 PolarHBondContact O-N 3.19Å; G29-Q32 CarbonylContact O-C 3.55Å; G29-Q32 PolarHBondContact O-N 2.97Å; G29-Q32 VanDerWaalsContact O-N 3.1Å; G29-L33 PolarHBondContact O-N 3.31Å; G29-R34 CarbonylContact C-O 3.37Å; G29-R34 CarbonylContact O-C 3.6Å; G29-R34 WeakPolarHBondContact O-CG 3.21Å; G29-R34 PolarHBondContact O-N 2.87Å |
| 30 | Y | 95.3 | Very high | 94 | Very high | 149 Ų | 149 | 68.8 Ų | 68.8 | 58% | 0.584 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -63.7 | -39.2 | -177.7 | -73.7 | -65.2 | 0 | 0 | 0 | 112.7 | K26 I27 Q32 L33 R34 | K26-Y30 HydrophobicContact CB-CE2 4.42Å; K26-Y30 WeakPolarHBondContact O-CD2 3.45Å; K26-Y30 PolarHBondContact O-N 2.89Å; I27-Y30 PolarHBondContact O-N 2.89Å; Y30-Q32 VanDerWaalsContact C-N 3.25Å; Y30-Q32 PolarHBondContact O-N 3.27Å; Y30-L33 PolarHBondContact O-N 3.48Å; Y30-L33 VanDerWaalsContact O-N 3.14Å; Y30-R34 PolarHBondContact N-O 2.92Å |
| 31 | M | 94 | Very high | 93.7 | Very high | 82 Ų | 82 | 69.4 Ų | 69.4 | 40% | 0.404 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -65.2 | -30.5 | 175.2 | -71.8 | 172.8 | 173.7 | 0 | 0 | 112.4 | I27 L28 G29 L33 W272 T275 | I27-M31 HydrophobicContact CG2-CE 3.55Å; I27-M31 HydrophobicContact CG2-CG 4.49Å; I27-M31 HydrophobicContact CG2-SD 3.64Å; I27-M31 WeakPolarHBondContact O-CB 3.29Å; I27-M31 WeakPolarHBondContact O-CG 3.36Å; I27-M31 PolarHBondContact O-N 3.1Å; L28-M31 PolarHBondContact O-N 2.99Å; G29-M31 PolarHBondContact O-N 3.19Å; M31-L33 VanDerWaalsContact C-N 3.29Å; M31-L33 PolarHBondContact O-N 3.37Å; M31-W272 HydrophobicContact CE-CB 3.72Å; M31-W272 HydrophobicContact CE-CG 3.73Å; M31-W272 HydrophobicContact SD-CB 4.46Å; M31-W272 HydrophobicContact SD-CG 4.47Å; M31-T275 HydrophobicContact CB-CG2 3.92Å; M31-T275 HydrophobicContact CG-CG2 4.36Å; M31-T275 HydrophobicContact SD-CG2 3.51Å; M31-T275 VanDerWaalsContact SD-CG2 3.51Å; M31-T275 PolarHBondContact SD-OG1 3.43Å |
| 32 | Q | 93.6 | Very high | 93.7 | Very high | 103 Ų | 103 | 71.6 Ų | 71.6 | 48% | 0.481 | 36% | 0.362 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.3 | 16.5 | 175.1 | -66.5 | 173.6 | -8.7 | 0 | 0 | 113.4 | L28 G29 Y30 R34 | L28-Q32 VanDerWaalsContact O-CB 3.31Å; L28-Q32 WeakPolarHBondContact O-CB 3.31Å; L28-Q32 WeakPolarHBondContact O-CG 3.3Å; L28-Q32 PolarHBondContact O-N 3.47Å; G29-Q32 CarbonylContact O-C 3.55Å; G29-Q32 PolarHBondContact O-N 2.97Å; G29-Q32 VanDerWaalsContact O-N 3.1Å; Y30-Q32 VanDerWaalsContact C-N 3.25Å; Y30-Q32 PolarHBondContact O-N 3.27Å; Q32-R34 HydrophobicContact CB-CG 4.2Å; Q32-R34 PolarHBondContact O-N 3.23Å; Q32-R34 VanDerWaalsContact OE1-CZ 3.31Å |
| 33 | L | 95.5 | Very high | 93.6 | Very high | 173 Ų | 173 | 80 Ų | 80 | 91% | 0.906 | 39% | 0.394 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.8 | 29.4 | -179 | -60.3 | 171.3 | 0 | 0 | 0 | 114.4 | G29 Y30 M31 | G29-L33 PolarHBondContact O-N 3.31Å; Y30-L33 PolarHBondContact O-N 3.48Å; Y30-L33 VanDerWaalsContact O-N 3.14Å; M31-L33 VanDerWaalsContact C-N 3.29Å; M31-L33 PolarHBondContact O-N 3.37Å |
| 34 | R | 96 | Very high | 93.4 | Very high | 132 Ų | 132 | 77.1 Ų | 77.1 | 50% | 0.498 | 38% | 0.376 | S | S | . | . | S | Bend | trans | -128.9 | 171.6 | 174.1 | 64.9 | -178.2 | 180 | 91 | 0.3 | 111.2 | G29 Y30 Q32 | G29-R34 CarbonylContact C-O 3.37Å; G29-R34 CarbonylContact O-C 3.6Å; G29-R34 WeakPolarHBondContact O-CG 3.21Å; G29-R34 PolarHBondContact O-N 2.87Å; Y30-R34 PolarHBondContact N-O 2.92Å; Q32-R34 HydrophobicContact CB-CG 4.2Å; Q32-R34 PolarHBondContact O-N 3.23Å; Q32-R34 VanDerWaalsContact OE1-CZ 3.31Å |
| 35 | K | 92.8 | Very high | 93.4 | Very high | 152 Ų | 152 | 81 Ų | 81 | 66% | 0.661 | 40% | 0.397 | S | S | * | . | trans | -91 | 141.4 | 174.1 | -67.1 | -177.6 | -179 | 178.1 | 0 | 110.3 | ||||
| 36 | G | 93.5 | Very high | 93.4 | Very high | 9 Ų | 9 | 80.5 Ų | 80.5 | 9% | 0.093 | 40% | 0.401 | C | S | . | . | trans | -73.9 | -173.1 | 165 | 0 | 0 | 0 | 0 | 0 | 112.1 | N38 | G36-N38 PolarHBondContact O-N 3Å; G36-N38 VanDerWaalsContact O-N 3.16Å | ||
| 37 | P | 92.6 | Very high | 93.5 | Very high | 29 Ų | 29 | 79.6 Ų | 79.6 | 19% | 0.188 | 40% | 0.398 | C | S | . | . | S | Bend | trans | -56.4 | 120.4 | 178.6 | -22.2 | 32.1 | 0 | 0 | 0 | 111.4 | L22 R25 Q47 | L22-P37 HydrophobicContact CD1-CB 4.32Å; L22-P37 HydrophobicContact CD1-CG 4.47Å; R25-P37 HydrophobicContact CB-CG 3.97Å; P37-Q47 HydrophobicContact CB-CB 4.4Å; P37-Q47 HydrophobicContact CB-CG 4.08Å; P37-Q47 HydrophobicContact CG-CG 4.31Å |
| 38 | N | 93.4 | Very high | 93.4 | Very high | 86 Ų | 86 | 77.6 Ų | 77.6 | 46% | 0.46 | 39% | 0.388 | S | S | . | . | trans | -132.2 | -6.6 | -179.8 | 64.3 | -17.7 | 0 | 0 | 0 | 113.7 | G36 | G36-N38 PolarHBondContact O-N 3Å; G36-N38 VanDerWaalsContact O-N 3.16Å | ||
| 39 | V | 93.1 | Very high | 93.4 | Very high | 126 Ų | 126 | 81.3 Ų | 81.3 | 76% | 0.764 | 40% | 0.403 | S | S | * | . | S | Bend | trans | -90.6 | -44.3 | -175.6 | -175.8 | 0 | 0 | 0 | 0 | 112.5 | G41 | V39-G41 PolarHBondContact O-N 2.95Š|
| 40 | V | 89.4 | Confident | 93.4 | Very high | 56 Ų | 56 | 83.2 Ų | 83.2 | 34% | 0.339 | 42% | 0.419 | S | S | . | . | S | Bend | trans | -77 | 88.6 | -176 | -175.7 | 0 | 0 | 0 | 0 | 110 | G44 L46 Q47 A50 | V40-G44 CarbonylContact O-C 3.52Å; V40-G44 VanDerWaalsContact O-C 3.31Å; V40-G44 WeakPolarHBondContact O-CA 3.28Å; V40-L46 HydrophobicContact CG1-CB 4.3Å; V40-L46 PolarHBondContact O-N 3.31Å; V40-Q47 VanDerWaalsContact CG2-OE1 3.26Å; V40-A50 HydrophobicContact CG1-CB 3.96Å |
| 41 | G | 90.9 | Very high | 93.3 | Very high | 24 Ų | 24 | 77.5 Ų | 77.5 | 25% | 0.247 | 40% | 0.398 | C | S | . | . | S | Bend | trans | 83.6 | 173 | -175.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | V39 Y43 G44 | V39-G41 PolarHBondContact O-N 2.95Å; G41-Y43 PolarHBondContact O-N 3.45Å; G41-Y43 VanDerWaalsContact O-N 3.11Å; G41-G44 PolarHBondContact O-N 3.43Å |
| 42 | P | 93 | Very high | 93.2 | Very high | 88 Ų | 88 | 75.5 Ų | 75.5 | 57% | 0.571 | 40% | 0.395 | S | S | * | . | G | 310 helix | trans | -60.2 | 118.4 | -179.3 | 25.3 | -33 | 0 | 0 | 0 | 109.7 | G44 L45 | P42-G44 PolarHBondContact O-N 2.94Å; P42-G44 VanDerWaalsContact O-N 3.1Å; P42-L45 WeakPolarHBondContact O-CG 3.33Å; P42-L45 PolarHBondContact O-N 2.89Å |
| 43 | Y | 91.8 | Very high | 93.2 | Very high | 184 Ų | 184 | 77.2 Ų | 77.2 | 72% | 0.722 | 41% | 0.405 | S | S | * | . | G | 310 helix | trans | 52 | 28.3 | -173.6 | -57.9 | -80.2 | 0 | 0 | 0 | 114.2 | K26 G41 L45 | K26-Y43 WeakPolarHBondContact CE-O 3.45Å; K26-Y43 PolarHBondContact NZ-O 3.35Å; G41-Y43 PolarHBondContact O-N 3.45Å; G41-Y43 VanDerWaalsContact O-N 3.11Å; Y43-L45 VanDerWaalsContact C-N 3.32Å; Y43-L45 PolarHBondContact O-N 3.47Å |
| 44 | G | 92.5 | Very high | 93.1 | Very high | 0 Ų | 0 | 75.5 Ų | 75.5 | 0% | 0 | 39% | 0.39 | C | S | . | . | G | 310 helix | trans | 76.7 | 9.8 | 178.7 | 0 | 0 | 0 | 0 | 0 | 115.6 | L22 V40 G41 P42 L46 Q47 | L22-G44 WeakPolarHBondContact CD1-O 3.27Å; L22-G44 WeakPolarHBondContact CD2-O 3.39Å; V40-G44 CarbonylContact O-C 3.52Å; V40-G44 VanDerWaalsContact O-C 3.31Å; V40-G44 WeakPolarHBondContact O-CA 3.28Å; G41-G44 PolarHBondContact O-N 3.43Å; P42-G44 PolarHBondContact O-N 2.94Å; P42-G44 VanDerWaalsContact O-N 3.1Å; G44-L46 PolarHBondContact O-N 3.12Å; G44-L46 VanDerWaalsContact O-N 3.14Å; G44-Q47 WeakPolarHBondContact O-CB 3.42Å; G44-Q47 PolarHBondContact O-N 3.43Å |
| 45 | L | 93.9 | Very high | 92.8 | Very high | 86 Ų | 86 | 71.4 Ų | 71.4 | 45% | 0.45 | 38% | 0.378 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.6 | -26.6 | -177.6 | -75.1 | 171.2 | 0 | 0 | 0 | 113.8 | F19 L22 P42 Y43 Q47 P48 | F19-L45 HydrophobicContact CE1-CD2 4.19Å; L22-L45 HydrophobicContact CD2-CD2 4.23Å; P42-L45 WeakPolarHBondContact O-CG 3.33Å; P42-L45 PolarHBondContact O-N 2.89Å; Y43-L45 VanDerWaalsContact C-N 3.32Å; Y43-L45 PolarHBondContact O-N 3.47Å; L45-Q47 VanDerWaalsContact C-N 3.35Å; L45-P48 WeakPolarHBondContact O-CD 3.38Å |
| 46 | L | 94.6 | Very high | 92.7 | Very high | 91 Ų | 91 | 70.2 Ų | 70.2 | 48% | 0.476 | 37% | 0.373 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.6 | -1.6 | 179.8 | -64.2 | 175.2 | 0 | 0 | 0 | 113.3 | V40 G44 F49 A50 | V40-L46 HydrophobicContact CG1-CB 4.3Å; V40-L46 PolarHBondContact O-N 3.31Å; G44-L46 PolarHBondContact O-N 3.12Å; G44-L46 VanDerWaalsContact O-N 3.14Å; L46-F49 HydrophobicContact CD2-CD2 4.18Å; L46-F49 PolarHBondContact O-N 2.98Å; L46-A50 PolarHBondContact O-N 2.91Å; L46-A50 VanDerWaalsContact O-N 3.13Å |
| 47 | Q | 95.6 | Very high | 92.7 | Very high | 31 Ų | 31 | 75.4 Ų | 75.4 | 15% | 0.145 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -57.2 | -45 | -179.5 | -173.3 | 71.2 | 46.7 | 0 | 0 | 113.5 | L22 P37 V40 G44 L45 F49 A50 D51 | L22-Q47 HydrophobicContact CD1-CB 4.11Å; P37-Q47 HydrophobicContact CB-CB 4.4Å; P37-Q47 HydrophobicContact CB-CG 4.08Å; P37-Q47 HydrophobicContact CG-CG 4.31Å; V40-Q47 VanDerWaalsContact CG2-OE1 3.26Å; G44-Q47 WeakPolarHBondContact O-CB 3.42Å; G44-Q47 PolarHBondContact O-N 3.43Å; L45-Q47 VanDerWaalsContact C-N 3.35Å; Q47-F49 VanDerWaalsContact C-N 3.29Å; Q47-F49 PolarHBondContact O-N 3.45Å; Q47-A50 PolarHBondContact O-N 3.19Å; Q47-D51 PolarHBondContact NE2-OD1 2.66Å; Q47-D51 PolarHBondContact O-N 3.11Å |
| 48 | P | 93.8 | Very high | 92.7 | Very high | 5 Ų | 5 | 79.9 Ų | 79.9 | 3% | 0.032 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -62.6 | -36.8 | -178.9 | -24 | 36.2 | 0 | 0 | 0 | 112.9 | X18 L22 L45 D51 A52 | A18-P48 HydrophobicContact CB-CB 3.89Å; A18-P48 VanDerWaalsContact O-CB 3.29Å; A18-P48 WeakPolarHBondContact O-CB 3.39Å; A18-P48 WeakPolarHBondContact O-CG 3.5Å; L22-P48 HydrophobicContact CB-CG 3.87Å; L45-P48 WeakPolarHBondContact O-CD 3.38Å; P48-D51 PolarHBondContact O-N 3.42Å; P48-A52 WeakPolarHBondContact O-CB 3.39Å; P48-A52 PolarHBondContact O-N 3Å |
| 49 | F | 92.8 | Very high | 92.5 | Very high | 102 Ų | 102 | 82.9 Ų | 82.9 | 45% | 0.447 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -68.5 | -39.3 | 177.3 | -63 | -72.2 | 0 | 0 | 0 | 111.8 | F19 L46 Q47 A52 M53 | F19-F49 HydrophobicContact CZ-CE2 4.16Å; L46-F49 HydrophobicContact CD2-CD2 4.18Å; L46-F49 PolarHBondContact O-N 2.98Å; Q47-F49 VanDerWaalsContact C-N 3.29Å; Q47-F49 PolarHBondContact O-N 3.45Å; F49-A52 PolarHBondContact O-N 3.34Å; F49-M53 WeakPolarHBondContact O-CG 3.07Å; F49-M53 PolarHBondContact O-N 3.46Å |
| 50 | A | 94.2 | Very high | 92.1 | Very high | 40 Ų | 40 | 80.3 Ų | 80.3 | 33% | 0.331 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -64 | -42.3 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | V40 L46 Q47 M53 K54 | V40-A50 HydrophobicContact CG1-CB 3.96Å; L46-A50 PolarHBondContact O-N 2.91Å; L46-A50 VanDerWaalsContact O-N 3.13Å; Q47-A50 PolarHBondContact O-N 3.19Å; A50-M53 PolarHBondContact O-N 3.26Å; A50-K54 VanDerWaalsContact O-CB 3.3Å; A50-K54 WeakPolarHBondContact O-CB 3.45Å; A50-K54 PolarHBondContact O-N 2.98Å |
| 51 | D | 92.3 | Very high | 91.8 | Very high | 28 Ų | 28 | 82.8 Ų | 82.8 | 15% | 0.15 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -65.4 | -42 | 177.2 | -72.9 | 1.8 | 0 | 0 | 0 | 111.1 | R25 Q47 P48 K54 L55 | R25-D51 IonicContact CZ-OD2 3.8Å; R25-D51 IonicContact NH1-OD1 3.95Å; R25-D51 IonicContact NH1-OD2 2.74Å; R25-D51 PolarHBondContact NH1-OD2 3.09Å; R25-D51 IonicContact NH2-OD2 2.67Å; R25-D51 PolarHBondContact NH2-OD2 3.32Å; Q47-D51 PolarHBondContact NE2-OD1 2.66Å; Q47-D51 PolarHBondContact O-N 3.11Å; P48-D51 PolarHBondContact O-N 3.42Å; D51-K54 PolarHBondContact O-N 3.22Å; D51-L55 WeakPolarHBondContact O-CG 3.45Å; D51-L55 PolarHBondContact O-N 2.86Å |
| 52 | A | 91.6 | Very high | 91.5 | Very high | 40 Ų | 40 | 88 Ų | 88 | 33% | 0.331 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -61.7 | -50.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | P48 F49 K54 L55 F56 | P48-A52 WeakPolarHBondContact O-CB 3.39Å; P48-A52 PolarHBondContact O-N 3Å; F49-A52 PolarHBondContact O-N 3.34Å; A52-K54 VanDerWaalsContact C-N 3.3Å; A52-K54 PolarHBondContact O-N 3.49Å; A52-L55 PolarHBondContact O-N 2.87Å; A52-F56 WeakPolarHBondContact O-CD2 3.26Å; A52-F56 PolarHBondContact O-N 3.44Å |
| 53 | M | 93 | Very high | 90.9 | Very high | 140 Ų | 140 | 84.9 Ų | 84.9 | 69% | 0.69 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -59.3 | -41.7 | 176.8 | -74.4 | -162.5 | -164.1 | 0 | 0 | 111.9 | F49 A50 L55 F56 T57 | F49-M53 WeakPolarHBondContact O-CG 3.07Å; F49-M53 PolarHBondContact O-N 3.46Å; A50-M53 PolarHBondContact O-N 3.26Å; M53-L55 PolarHBondContact O-N 2.99Å; M53-F56 PolarHBondContact O-N 2.64Å; M53-T57 WeakPolarHBondContact O-CB 3.37Å; M53-T57 VanDerWaalsContact O-CG2 3.23Å; M53-T57 WeakPolarHBondContact O-CG2 3.35Å; M53-T57 PolarHBondContact O-N 3.35Å; M53-T57 PolarHBondContact O-OG1 2.98Å |
| 54 | K | 93.5 | Very high | 90.5 | Very high | 136 Ų | 136 | 81.5 Ų | 81.5 | 59% | 0.591 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -59 | -45.5 | 176.4 | 178.3 | -173.8 | 175.2 | -175.3 | 0 | 111.9 | A50 D51 A52 T57 K58 | A50-K54 VanDerWaalsContact O-CB 3.3Å; A50-K54 WeakPolarHBondContact O-CB 3.45Å; A50-K54 PolarHBondContact O-N 2.98Å; D51-K54 PolarHBondContact O-N 3.22Å; A52-K54 VanDerWaalsContact C-N 3.3Å; A52-K54 PolarHBondContact O-N 3.49Å; K54-T57 PolarHBondContact O-OG1 3.23Å; K54-K58 WeakPolarHBondContact O-CB 3.25Å; K54-K58 PolarHBondContact O-N 2.94Å |
| 55 | L | 91.3 | Very high | 90 | Very high | 46 Ų | 46 | 85.6 Ų | 85.6 | 24% | 0.241 | 46% | 0.458 | C | S | . | . | H | α-helix | trans | -70.1 | -35.6 | -177.3 | -71.2 | 170.1 | 0 | 0 | 0 | 112.5 | D51 A52 M53 A217 G218 F220 A221 | D51-L55 WeakPolarHBondContact O-CG 3.45Å; D51-L55 PolarHBondContact O-N 2.86Å; A52-L55 PolarHBondContact O-N 2.87Å; M53-L55 PolarHBondContact O-N 2.99Å; L55-A217 CarbonylContact O-C 2.87Å; L55-A217 WeakPolarHBondContact O-CA 3.04Å; L55-A217 WeakPolarHBondContact O-CB 3.46Å; L55-G218 PolarHBondContact O-N 3.31Å; L55-F220 HydrophobicContact CD2-CD1 4.3Å; L55-A221 HydrophobicContact CB-CB 4.16Å; L55-A221 HydrophobicContact CD1-CB 3.85Å |
| 56 | F | 90.8 | Very high | 89.6 | Confident | 128 Ų | 128 | 82.1 Ų | 82.1 | 56% | 0.561 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -80.8 | -24.1 | 179.2 | -71.7 | -62 | 0 | 0 | 0 | 114.3 | A52 M53 M225 | A52-F56 WeakPolarHBondContact O-CD2 3.26Å; A52-F56 PolarHBondContact O-N 3.44Å; M53-F56 PolarHBondContact O-N 2.64Å; F56-M225 HydrophobicContact CZ-CE 4.33Å |
| 57 | T | 92.9 | Very high | 89.4 | Confident | 118 Ų | 118 | 80.3 Ų | 80.3 | 72% | 0.724 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -84 | -20.5 | 175.2 | 52.2 | 0 | 0 | 0 | 0 | 113 | M53 K54 | M53-T57 WeakPolarHBondContact O-CB 3.37Å; M53-T57 VanDerWaalsContact O-CG2 3.23Å; M53-T57 WeakPolarHBondContact O-CG2 3.35Å; M53-T57 PolarHBondContact O-N 3.35Å; M53-T57 PolarHBondContact O-OG1 2.98Å; K54-T57 PolarHBondContact O-OG1 3.23Å |
| 58 | K | 92.2 | Very high | 89 | Confident | 122 Ų | 122 | 84 Ų | 84 | 53% | 0.53 | 45% | 0.453 | S | S | . | . | S | Bend | trans | -71.5 | 142.2 | 179.6 | -167.4 | 173.9 | -176.4 | -173.3 | 0 | 110.7 | K54 A217 | K54-K58 WeakPolarHBondContact O-CB 3.25Å; K54-K58 PolarHBondContact O-N 2.94Å; K58-A217 HydrophobicContact CB-CB 3.8Å; K58-A217 HydrophobicContact CG-CB 4.2Å; K58-A217 VanDerWaalsContact O-CB 3.3Å; K58-A217 WeakPolarHBondContact O-CB 2.96Å |
| 59 | E | 89 | Confident | 88.9 | Confident | 150 Ų | 150 | 88.8 Ų | 88.8 | 70% | 0.701 | 48% | 0.482 | S | S | * | . | trans | -59 | 127.9 | 178.8 | -172.5 | 177.9 | 175.5 | 0 | 0 | 111.3 | L61 | E59-L61 PolarHBondContact O-N 3.38Š| ||
| 60 | P | 85.7 | Confident | 88.9 | Confident | 72 Ų | 72 | 85.7 Ų | 85.7 | 47% | 0.468 | 47% | 0.47 | S | S | . | . | trans | -74.7 | 108.6 | 174.1 | 29.3 | -32 | 0 | 0 | 0 | 110 | K62 | P60-K62 PolarHBondContact O-N 3.24Š| ||
| 61 | L | 83.3 | Confident | 88.7 | Confident | 108 Ų | 108 | 84 Ų | 84 | 57% | 0.565 | 46% | 0.456 | S | S | * | . | trans | -70 | 124.6 | 171.4 | -68.8 | 161.4 | 0 | 0 | 0 | 109.7 | E59 Y71 A216 | E59-L61 PolarHBondContact O-N 3.38Å; L61-Y71 PolarHBondContact O-OH 2.79Å; L61-A216 HydrophobicContact CB-CB 3.7Å; L61-A216 HydrophobicContact CD1-CB 3.81Å; L61-A216 HydrophobicContact CG-CB 4Å | ||
| 62 | K | 82.9 | Confident | 88.7 | Confident | 134 Ų | 134 | 86.7 Ų | 86.7 | 58% | 0.583 | 47% | 0.469 | S | S | * | . | trans | -112.9 | 110.8 | 170.7 | -70 | -176.6 | -179 | 178.6 | 0 | 108.2 | P60 | P60-K62 PolarHBondContact O-N 3.24Š| ||
| 63 | P | 82.2 | Confident | 88.8 | Confident | 22 Ų | 22 | 87.5 Ų | 87.5 | 14% | 0.143 | 47% | 0.47 | C | S | . | . | trans | -64 | 137.4 | 179.4 | -13.2 | 23.3 | 0 | 0 | 0 | 110.9 | T65 S66 Y71 E214 | P63-T65 PolarHBondContact O-N 2.85Å; P63-S66 WeakPolarHBondContact O-CB 3.34Å; P63-S66 PolarHBondContact O-N 3.19Å; P63-S66 PolarHBondContact O-OG 3.1Å; P63-Y71 HydrophobicContact CG-CE2 4.27Å; P63-E214 HydrophobicContact CG-CB 3.81Å; P63-E214 HydrophobicContact CG-CG 4.28Å | ||
| 64 | A | 81.6 | Confident | 88.8 | Confident | 112 Ų | 112 | 80.9 Ų | 80.9 | 93% | 0.926 | 44% | 0.437 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.1 | -26.8 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | S66 | A64-S66 VanDerWaalsContact C-N 3.31Š|
| 65 | T | 83.7 | Confident | 88.9 | Confident | 86 Ų | 86 | 74.5 Ų | 74.5 | 53% | 0.528 | 41% | 0.409 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84.3 | -4.6 | 179.7 | 50.3 | 0 | 0 | 0 | 0 | 113.4 | P63 N124 | P63-T65 PolarHBondContact O-N 2.85Å; T65-N124 WeakPolarHBondContact O-CB 3.38Å; T65-N124 PolarHBondContact O-ND2 3.44Å |
| 66 | S | 84.8 | Confident | 89 | Confident | 13 Ų | 13 | 75.4 Ų | 75.4 | 9% | 0.091 | 42% | 0.417 | C | S | . | . | S | Bend | trans | -82.6 | 147.8 | -171.3 | 68.1 | 0 | 0 | 0 | 0 | 113.5 | P63 A64 I68 A122 | P63-S66 WeakPolarHBondContact O-CB 3.34Å; P63-S66 PolarHBondContact O-N 3.19Å; P63-S66 PolarHBondContact O-OG 3.1Å; A64-S66 VanDerWaalsContact C-N 3.31Å; S66-I68 PolarHBondContact O-N 3.08Å; S66-A122 CarbonylContact C-O 3.56Å; S66-A122 WeakPolarHBondContact CA-O 3.45Å; S66-A122 WeakPolarHBondContact CB-O 3.23Å |
| 67 | T | 90.5 | Very high | 89.3 | Confident | 54 Ų | 54 | 71.3 Ų | 71.3 | 33% | 0.331 | 40% | 0.401 | S | S | . | . | trans | -79.7 | 102 | 166.9 | 53.7 | 0 | 0 | 0 | 0 | 109.1 | T69 L70 Y71 W121 A122 | T67-T69 VanDerWaalsContact C-N 3.28Å; T67-T69 PolarHBondContact O-N 2.59Å; T67-L70 PolarHBondContact O-N 3.26Å; T67-Y71 WeakPolarHBondContact O-CB 3.23Å; T67-Y71 PolarHBondContact O-N 3.2Å; T67-W121 HydrophobicContact CG2-CZ3 4.27Å; T67-A122 PolarHBondContact N-O 3.12Å; T67-A122 WeakPolarHBondContact OG1-CA 3.45Å | ||
| 68 | I | 87.8 | Confident | 89.4 | Confident | 109 Ų | 109 | 66 Ų | 66 | 56% | 0.559 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -56.6 | -39.4 | -168.2 | -65.7 | 150.7 | 0 | 0 | 0 | 112.9 | S66 Y71 I72 | S66-I68 PolarHBondContact O-N 3.08Å; I68-Y71 PolarHBondContact O-N 3.43Å; I68-I72 HydrophobicContact CG2-CD1 3.8Å; I68-I72 WeakPolarHBondContact O-CG1 3.15Å; I68-I72 PolarHBondContact O-N 2.87Å; I68-I72 VanDerWaalsContact O-N 3.12Å |
| 69 | T | 91.4 | Very high | 89.5 | Confident | 104 Ų | 104 | 61.6 Ų | 61.6 | 64% | 0.638 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -61.7 | -53.4 | -178.4 | 50.1 | 0 | 0 | 0 | 0 | 111.1 | T67 I72 T73 | T67-T69 VanDerWaalsContact C-N 3.28Å; T67-T69 PolarHBondContact O-N 2.59Å; T69-I72 PolarHBondContact O-N 3.22Å; T69-T73 VanDerWaalsContact O-CG2 3.28Å; T69-T73 WeakPolarHBondContact O-CG2 3.41Å; T69-T73 PolarHBondContact O-N 2.96Å; T69-T73 PolarHBondContact O-OG1 3.41Å |
| 70 | L | 91.8 | Very high | 89.9 | Confident | 37 Ų | 37 | 58 Ų | 58 | 19% | 0.194 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -68.6 | -35.5 | -179.9 | -67.3 | 175.4 | 0 | 0 | 0 | 112.5 | T67 I72 T73 A74 W118 W121 A122 | T67-L70 PolarHBondContact O-N 3.26Å; L70-I72 VanDerWaalsContact C-N 3.28Å; L70-I72 PolarHBondContact O-N 3.13Å; L70-T73 WeakPolarHBondContact CA-OG1 3.38Å; L70-T73 PolarHBondContact O-N 3.35Å; L70-T73 PolarHBondContact O-OG1 3.33Å; L70-A74 VanDerWaalsContact O-CB 3.28Å; L70-A74 WeakPolarHBondContact O-CB 3.44Å; L70-A74 PolarHBondContact O-N 3.13Å; L70-W118 HydrophobicContact CD2-CD2 3.9Å; L70-W118 HydrophobicContact CD2-CE3 3.98Å; L70-W118 HydrophobicContact CD2-CG 4.16Å; L70-W121 HydrophobicContact CD1-CE3 3.39Å; L70-W121 HydrophobicContact CD1-CZ3 3.35Å; L70-A122 HydrophobicContact CB-CB 3.65Å |
| 71 | Y | 90.4 | Very high | 90.4 | Very high | 6 Ų | 6 | 55.2 Ų | 55.2 | 2% | 0.024 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -62.4 | -36.5 | 178 | -173.4 | -94.6 | 0 | 0 | 0 | 112.1 | L61 P63 T67 I68 P75 E214 Y215 | L61-Y71 PolarHBondContact O-OH 2.79Å; P63-Y71 HydrophobicContact CG-CE2 4.27Å; T67-Y71 WeakPolarHBondContact O-CB 3.23Å; T67-Y71 PolarHBondContact O-N 3.2Å; I68-Y71 PolarHBondContact O-N 3.43Å; Y71-P75 WeakPolarHBondContact O-CD 3.46Å; Y71-E214 HydrophobicContact CE2-CB 4.43Å; Y71-E214 PolarHBondContact OH-O 3.17Å; Y71-Y215 WeakPolarHBondContact CA-OH 3.25Å; Y71-Y215 HydrophobicContact CD1-CE1 4.14Å; Y71-Y215 HydrophobicContact CD2-CD1 4.28Å; Y71-Y215 AromaticContact CD2-CE1 3.55Å; Y71-Y215 HydrophobicContact CD2-CE1 3.55Å; Y71-Y215 AromaticContact CD2-CE2 4Å; Y71-Y215 HydrophobicContact CD2-CE2 4Å; Y71-Y215 AromaticContact CD2-CZ 3.38Å; Y71-Y215 WeakPolarHBondContact CD2-OH 3.28Å; Y71-Y215 HydrophobicContact CE1-CD1 4.15Å; Y71-Y215 HydrophobicContact CE1-CE1 4.01Å; Y71-Y215 AromaticContact CE2-CD1 3.63Å; Y71-Y215 HydrophobicContact CE2-CD1 3.63Å; Y71-Y215 AromaticContact CE2-CD2 3.98Å; Y71-Y215 HydrophobicContact CE2-CD2 3.98Å; Y71-Y215 AromaticContact CE2-CE1 3.37Å; Y71-Y215 HydrophobicContact CE2-CE1 3.37Å; Y71-Y215 AromaticContact CE2-CE2 3.75Å; Y71-Y215 HydrophobicContact CE2-CE2 3.75Å; Y71-Y215 AromaticContact CE2-CG 3.94Å; Y71-Y215 HydrophobicContact CE2-CG 3.94Å; Y71-Y215 AromaticContact CE2-CZ 3.44Å; Y71-Y215 VanDerWaalsContact CE2-CZ 3.44Å; Y71-Y215 AromaticContact CG-CE1 3.93Å; Y71-Y215 HydrophobicContact CG-CE1 3.93Å; Y71-Y215 AromaticContact CZ-CD1 3.57Å; Y71-Y215 AromaticContact CZ-CE1 3.64Å; Y71-Y215 WeakPolarHBondContact O-CE1 3.45Å; Y71-Y215 PolarHBondContact O-OH 2.88Å; Y71-Y215 WeakPolarHBondContact OH-CA 3.42Å |
| 72 | I | 91.4 | Very high | 91 | Very high | 84 Ų | 84 | 50.1 Ų | 50.1 | 43% | 0.431 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -81.3 | -37.6 | 177.4 | -64 | 170 | 0 | 0 | 0 | 111.2 | I68 T69 L70 | I68-I72 HydrophobicContact CG2-CD1 3.8Å; I68-I72 WeakPolarHBondContact O-CG1 3.15Å; I68-I72 PolarHBondContact O-N 2.87Å; I68-I72 VanDerWaalsContact O-N 3.12Å; T69-I72 PolarHBondContact O-N 3.22Å; L70-I72 VanDerWaalsContact C-N 3.28Å; L70-I72 PolarHBondContact O-N 3.13Å |
| 73 | T | 93.8 | Very high | 91.7 | Very high | 57 Ų | 57 | 45.2 Ų | 45.2 | 35% | 0.35 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -74.5 | -35.5 | -176.2 | 57.9 | 0 | 0 | 0 | 0 | 112.9 | T69 L70 T76 L77 | T69-T73 VanDerWaalsContact O-CG2 3.28Å; T69-T73 WeakPolarHBondContact O-CG2 3.41Å; T69-T73 PolarHBondContact O-N 2.96Å; T69-T73 PolarHBondContact O-OG1 3.41Å; L70-T73 WeakPolarHBondContact CA-OG1 3.38Å; L70-T73 PolarHBondContact O-N 3.35Å; L70-T73 PolarHBondContact O-OG1 3.33Å; T73-T76 WeakPolarHBondContact CA-OG1 3.32Å; T73-T76 PolarHBondContact O-N 3.37Å; T73-T76 PolarHBondContact O-OG1 3.3Å; T73-L77 WeakPolarHBondContact O-CB 3.41Å; T73-L77 PolarHBondContact O-N 3.01Å |
| 74 | A | 94.1 | Very high | 92.3 | Very high | 0 Ų | 0 | 48.1 Ų | 48.1 | 0% | 0 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -57.8 | -49.6 | -174.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | L70 T76 L77 A78 W118 F223 | L70-A74 VanDerWaalsContact O-CB 3.28Å; L70-A74 WeakPolarHBondContact O-CB 3.44Å; L70-A74 PolarHBondContact O-N 3.13Å; A74-T76 VanDerWaalsContact C-N 3.34Å; A74-T76 PolarHBondContact O-N 3.16Å; A74-L77 PolarHBondContact O-N 3.26Å; A74-A78 PolarHBondContact O-N 3.07Å; A74-W118 HydrophobicContact CB-CB 3.96Å; A74-F223 HydrophobicContact CB-CZ 4.17Å |
| 75 | P | 94.3 | Very high | 93 | Very high | 2 Ų | 2 | 42.8 Ų | 42.8 | 1% | 0.013 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -65.4 | -36 | 177.1 | -12.6 | 22.3 | 0 | 0 | 0 | 113 | Y71 A78 L79 Y215 P219 L222 F223 | Y71-P75 WeakPolarHBondContact O-CD 3.46Å; P75-A78 PolarHBondContact O-N 3.43Å; P75-L79 PolarHBondContact O-N 2.88Å; P75-Y215 HydrophobicContact CG-CD1 4.03Å; P75-Y215 HydrophobicContact CG-CE1 3.56Å; P75-P219 HydrophobicContact CG-CB 4.14Å; P75-L222 HydrophobicContact CB-CB 3.71Å; P75-L222 HydrophobicContact CB-CD1 3.85Å; P75-L222 HydrophobicContact CB-CG 4.44Å; P75-F223 HydrophobicContact CB-CD2 4.14Å; P75-F223 HydrophobicContact CB-CE2 3.83Å; P75-F223 HydrophobicContact CB-CZ 4.03Å; P75-F223 HydrophobicContact CG-CD2 4.27Å; P75-F223 HydrophobicContact CG-CE2 3.57Å; P75-F223 HydrophobicContact CG-CZ 3.88Å |
| 76 | T | 94.8 | Very high | 93.6 | Very high | 65 Ų | 65 | 39.4 Ų | 39.4 | 40% | 0.399 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -66.3 | -40.9 | 176.9 | 62 | 0 | 0 | 0 | 0 | 111.1 | T73 A74 L79 T80 L222 | T73-T76 WeakPolarHBondContact CA-OG1 3.32Å; T73-T76 PolarHBondContact O-N 3.37Å; T73-T76 PolarHBondContact O-OG1 3.3Å; A74-T76 VanDerWaalsContact C-N 3.34Å; A74-T76 PolarHBondContact O-N 3.16Å; T76-L79 PolarHBondContact O-N 3.08Å; T76-T80 VanDerWaalsContact O-CG2 3.24Å; T76-T80 WeakPolarHBondContact O-CG2 3.18Å; T76-T80 PolarHBondContact O-N 2.74Å; T76-T80 PolarHBondContact O-OG1 3.38Å; T76-L222 HydrophobicContact CG2-CD1 4.4Å |
| 77 | L | 96.1 | Very high | 94.1 | Very high | 43 Ų | 43 | 39.9 Ų | 39.9 | 23% | 0.225 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -64.1 | -44.1 | 177.8 | -170.9 | 139.9 | 0 | 0 | 0 | 110.7 | T73 A74 L79 T80 I81 W118 | T73-L77 WeakPolarHBondContact O-CB 3.41Å; T73-L77 PolarHBondContact O-N 3.01Å; A74-L77 PolarHBondContact O-N 3.26Å; L77-L79 PolarHBondContact O-N 3.38Å; L77-T80 WeakPolarHBondContact CA-OG1 3.29Å; L77-T80 PolarHBondContact O-N 3.02Å; L77-T80 PolarHBondContact O-OG1 3.47Å; L77-I81 HydrophobicContact CD2-CD1 3.37Å; L77-I81 HydrophobicContact CD2-CG1 4.33Å; L77-I81 HydrophobicContact CG-CD1 3.99Å; L77-I81 WeakPolarHBondContact O-CG1 3.38Å; L77-I81 PolarHBondContact O-N 3.14Å; L77-W118 HydrophobicContact CD1-CE3 4.43Å; L77-W118 HydrophobicContact CD1-CH2 4.21Å; L77-W118 HydrophobicContact CD1-CZ3 3.73Å |
| 78 | A | 95.1 | Very high | 94.3 | Very high | 6 Ų | 6 | 37.4 Ų | 37.4 | 5% | 0.05 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -53.6 | -51.6 | 175 | 0 | 0 | 0 | 0 | 0 | 112.2 | A74 P75 A82 F223 A226 | A74-A78 PolarHBondContact O-N 3.07Å; P75-A78 PolarHBondContact O-N 3.43Å; A78-A82 WeakPolarHBondContact O-CB 3.27Å; A78-A82 PolarHBondContact O-N 3.49Å; A78-F223 HydrophobicContact CB-CD1 3.85Å; A78-F223 HydrophobicContact CB-CE1 3.85Å; A78-A226 HydrophobicContact CB-CB 3.9Å |
| 79 | L | 95.8 | Very high | 94.6 | Very high | 30 Ų | 30 | 32.5 Ų | 32.5 | 16% | 0.157 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -66.7 | -41.3 | -179.9 | -174.1 | 71 | 0 | 0 | 0 | 112 | P75 T76 L77 I81 A82 L83 L222 M225 | P75-L79 PolarHBondContact O-N 2.88Å; T76-L79 PolarHBondContact O-N 3.08Å; L77-L79 PolarHBondContact O-N 3.38Å; L79-I81 PolarHBondContact O-N 3.32Å; L79-A82 PolarHBondContact O-N 3.26Å; L79-L83 HydrophobicContact CD1-CD1 4.48Å; L79-L83 HydrophobicContact CG-CD1 4.11Å; L79-L83 HydrophobicContact CG-CG 4.49Å; L79-L83 WeakPolarHBondContact O-CG 3.02Å; L79-L83 PolarHBondContact O-N 2.78Å; L79-L222 HydrophobicContact CD2-CD2 3.68Å; L79-M225 HydrophobicContact CD1-CB 4.02Å |
| 80 | T | 96.4 | Very high | 94.6 | Very high | 75 Ų | 75 | 27.5 Ų | 27.5 | 46% | 0.46 | 15% | 0.153 | S | C | . | . | H | α-helix | trans | -62.1 | -43.2 | -179.9 | 55.9 | 0 | 0 | 0 | 0 | 112 | T76 L77 L83 L84 | T76-T80 VanDerWaalsContact O-CG2 3.24Å; T76-T80 WeakPolarHBondContact O-CG2 3.18Å; T76-T80 PolarHBondContact O-N 2.74Å; T76-T80 PolarHBondContact O-OG1 3.38Å; L77-T80 WeakPolarHBondContact CA-OG1 3.29Å; L77-T80 PolarHBondContact O-N 3.02Å; L77-T80 PolarHBondContact O-OG1 3.47Å; T80-L83 PolarHBondContact O-N 3.44Å; T80-L84 WeakPolarHBondContact O-CB 3.13Å; T80-L84 VanDerWaalsContact O-CG 3.24Å; T80-L84 WeakPolarHBondContact O-CG 3.21Å; T80-L84 PolarHBondContact O-N 2.89Å |
| 81 | I | 96.6 | Very high | 94.5 | Very high | 13 Ų | 13 | 28.7 Ų | 28.7 | 7% | 0.067 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -65.5 | -45.1 | 177 | -66.2 | 175.6 | 0 | 0 | 0 | 110.2 | L77 L79 L83 L84 L85 T108 L111 A112 | L77-I81 HydrophobicContact CD2-CD1 3.37Å; L77-I81 HydrophobicContact CD2-CG1 4.33Å; L77-I81 HydrophobicContact CG-CD1 3.99Å; L77-I81 WeakPolarHBondContact O-CG1 3.38Å; L77-I81 PolarHBondContact O-N 3.14Å; L79-I81 PolarHBondContact O-N 3.32Å; I81-L83 PolarHBondContact O-N 3.45Å; I81-L84 PolarHBondContact O-N 3.38Å; I81-L84 VanDerWaalsContact O-N 3.12Å; I81-L85 HydrophobicContact CG2-CD1 4.05Å; I81-L85 WeakPolarHBondContact O-CG 3.47Å; I81-L85 PolarHBondContact O-N 3.03Å; I81-L85 VanDerWaalsContact O-N 3.11Å; I81-T108 VanDerWaalsContact CG2-O 3.24Å; I81-T108 WeakPolarHBondContact CG2-O 3.44Å; I81-L111 HydrophobicContact CD1-CB 3.82Å; I81-L111 WeakPolarHBondContact CD1-O 3.44Å; I81-A112 HydrophobicContact CG2-CB 3.97Å |
| 82 | A | 96.2 | Very high | 94.4 | Very high | 0 Ų | 0 | 28.9 Ų | 28.9 | 0% | 0 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -59.4 | -35 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | A78 L79 W86 A226 T229 N230 | A78-A82 WeakPolarHBondContact O-CB 3.27Å; A78-A82 PolarHBondContact O-N 3.49Å; L79-A82 PolarHBondContact O-N 3.26Å; A82-W86 PolarHBondContact O-NE1 3.22Å; A82-A226 HydrophobicContact CB-CB 4.06Å; A82-T229 VanDerWaalsContact CB-OG1 3.23Å; A82-T229 WeakPolarHBondContact CB-OG1 3.11Å; A82-N230 WeakPolarHBondContact CA-OD1 3.45Å; A82-N230 VanDerWaalsContact CB-OD1 3.31Å; A82-N230 WeakPolarHBondContact CB-OD1 3.47Å |
| 83 | L | 96 | Very high | 94.4 | Very high | 31 Ų | 31 | 30.3 Ų | 30.3 | 16% | 0.162 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -78.6 | -35.2 | 174.7 | -67.4 | 174.2 | 0 | 0 | 0 | 113.1 | I10 I13 L14 L79 T80 I81 L85 W86 | I10-L83 HydrophobicContact CG2-CD1 4.16Å; I10-L83 HydrophobicContact CG2-CD2 4.2Å; I13-L83 HydrophobicContact CG2-CD2 4.35Å; L14-L83 HydrophobicContact CD2-CD2 4.45Å; L79-L83 HydrophobicContact CD1-CD1 4.48Å; L79-L83 HydrophobicContact CG-CD1 4.11Å; L79-L83 HydrophobicContact CG-CG 4.49Å; L79-L83 WeakPolarHBondContact O-CG 3.02Å; L79-L83 PolarHBondContact O-N 2.78Å; T80-L83 PolarHBondContact O-N 3.44Å; I81-L83 PolarHBondContact O-N 3.45Å; L83-L85 VanDerWaalsContact C-N 3.28Å; L83-L85 PolarHBondContact O-N 3.33Å; L83-W86 PolarHBondContact O-N 3.06Å |
| 84 | L | 95.9 | Very high | 94.4 | Very high | 83 Ų | 83 | 28.7 Ų | 28.7 | 44% | 0.435 | 16% | 0.159 | S | C | . | . | H | α-helix | trans | -63.2 | -34.7 | 178.1 | -78.7 | 168.7 | 0 | 0 | 0 | 112.5 | T80 I81 W86 T87 | T80-L84 WeakPolarHBondContact O-CB 3.13Å; T80-L84 VanDerWaalsContact O-CG 3.24Å; T80-L84 WeakPolarHBondContact O-CG 3.21Å; T80-L84 PolarHBondContact O-N 2.89Å; I81-L84 PolarHBondContact O-N 3.38Å; I81-L84 VanDerWaalsContact O-N 3.12Å; L84-W86 PolarHBondContact O-N 3.36Å; L84-W86 VanDerWaalsContact O-N 3.07Å; L84-T87 WeakPolarHBondContact O-CG2 3.31Å; L84-T87 PolarHBondContact O-N 2.94Å; L84-T87 VanDerWaalsContact O-N 3.09Å; L84-T87 PolarHBondContact O-OG1 3.28Å |
| 85 | L | 96.1 | Very high | 94.4 | Very high | 1 Ų | 1 | 31.7 Ų | 31.7 | 1% | 0.005 | 18% | 0.175 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -58.5 | -20.2 | 178.7 | -76.7 | 159 | 0 | 0 | 0 | 113.5 | I81 L83 P88 I105 T108 M233 | I81-L85 HydrophobicContact CG2-CD1 4.05Å; I81-L85 WeakPolarHBondContact O-CG 3.47Å; I81-L85 PolarHBondContact O-N 3.03Å; I81-L85 VanDerWaalsContact O-N 3.11Å; L83-L85 VanDerWaalsContact C-N 3.28Å; L83-L85 PolarHBondContact O-N 3.33Å; L85-P88 WeakPolarHBondContact O-CD 3.2Å; L85-I105 HydrophobicContact CD2-CB 4.32Å; L85-I105 HydrophobicContact CD2-CG2 3.73Å; L85-T108 WeakPolarHBondContact CD2-OG1 3.47Å; L85-M233 HydrophobicContact CB-CE 3.87Å; L85-M233 HydrophobicContact CB-CG 3.84Å; L85-M233 HydrophobicContact CB-SD 3.94Å; L85-M233 HydrophobicContact CD1-CE 3.53Å; L85-M233 HydrophobicContact CD2-CE 4.11Å; L85-M233 HydrophobicContact CD2-SD 4.45Å; L85-M233 HydrophobicContact CG-CE 4.04Å |
| 86 | W | 96.4 | Very high | 94.3 | Very high | 14 Ų | 14 | 34.7 Ų | 34.7 | 5% | 0.053 | 19% | 0.193 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -83.1 | -18.9 | 178.8 | -69.6 | 77.8 | 0 | 0 | 0 | 114.6 | L9 I13 A82 L83 L84 L89 M91 I232 M233 T236 | L9-W86 HydrophobicContact CD2-CB 4.26Å; I13-W86 HydrophobicContact CD1-CB 3.86Å; I13-W86 HydrophobicContact CD1-CD2 3.38Å; I13-W86 HydrophobicContact CD1-CE3 3.5Å; I13-W86 VanDerWaalsContact CD1-CE3 3.5Å; I13-W86 HydrophobicContact CD1-CG 3.54Å; I13-W86 HydrophobicContact CD1-CZ3 4.13Å; I13-W86 HydrophobicContact CG1-CD2 3.95Å; I13-W86 HydrophobicContact CG1-CE3 3.82Å; I13-W86 HydrophobicContact CG1-CH2 4.15Å; I13-W86 HydrophobicContact CG1-CZ2 4.31Å; I13-W86 HydrophobicContact CG1-CZ3 3.9Å; I13-W86 HydrophobicContact CG2-CD2 4.37Å; I13-W86 HydrophobicContact CG2-CH2 4.39Å; I13-W86 HydrophobicContact CG2-CZ2 3.85Å; A82-W86 PolarHBondContact O-NE1 3.22Å; L83-W86 PolarHBondContact O-N 3.06Å; L84-W86 PolarHBondContact O-N 3.36Å; L84-W86 VanDerWaalsContact O-N 3.07Å; W86-L89 HydrophobicContact CD2-CD1 4.27Å; W86-L89 HydrophobicContact CE3-CD1 4.09Å; W86-L89 PolarHBondContact O-N 3.31Å; W86-M91 HydrophobicContact CE3-CE 3.89Å; W86-M91 HydrophobicContact CZ3-CE 3.58Å; W86-I232 HydrophobicContact CH2-CB 4.09Å; W86-I232 HydrophobicContact CH2-CG2 3.54Å; W86-I232 HydrophobicContact CZ2-CB 3.96Å; W86-I232 HydrophobicContact CZ2-CG2 3.95Å; W86-M233 HydrophobicContact CZ2-CB 3.95Å; W86-T236 HydrophobicContact CH2-CG2 4.11Å; W86-T236 HydrophobicContact CZ3-CG2 4.17Å |
| 87 | T | 94.3 | Very high | 94.3 | Very high | 23 Ų | 23 | 36.4 Ų | 36.4 | 14% | 0.141 | 20% | 0.199 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -61.6 | -37.7 | -172.2 | 60 | 0 | 0 | 0 | 0 | 115.1 | L84 L95 V96 | L84-T87 WeakPolarHBondContact O-CG2 3.31Å; L84-T87 PolarHBondContact O-N 2.94Å; L84-T87 VanDerWaalsContact O-N 3.09Å; L84-T87 PolarHBondContact O-OG1 3.28Å; T87-L95 HydrophobicContact CG2-CD2 4.09Å; T87-L95 WeakPolarHBondContact O-CB 3.34Å; T87-L95 PolarHBondContact O-N 3.22Å; T87-V96 PolarHBondContact O-N 2.87Å |
| 88 | P | 95.1 | Very high | 94.1 | Very high | 3 Ų | 3 | 36.9 Ų | 36.9 | 2% | 0.019 | 20% | 0.202 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -89.8 | -5.8 | 178.4 | 39.3 | -41 | 0 | 0 | 0 | 113.8 | L85 P90 P94 L98 F104 I105 L162 | L85-P88 WeakPolarHBondContact O-CD 3.2Å; P88-P90 WeakPolarHBondContact O-CD 3.42Å; P88-P94 WeakPolarHBondContact O-CB 3.37Å; P88-L98 HydrophobicContact CB-CD1 4.41Å; P88-F104 HydrophobicContact CG-CD1 3.92Å; P88-F104 HydrophobicContact CG-CE1 4.27Å; P88-I105 HydrophobicContact CG-CD1 3.8Å; P88-I105 HydrophobicContact CG-CG1 3.66Å; P88-L162 HydrophobicContact CB-CD1 4.14Å; P88-L162 HydrophobicContact CG-CD1 4.28Å; P88-L162 WeakPolarHBondContact O-CD1 3.43Å |
| 89 | L | 94.5 | Very high | 94.1 | Very high | 5 Ų | 5 | 42.3 Ų | 42.3 | 3% | 0.026 | 23% | 0.23 | C | C | . | . | trans | -68.2 | 124.6 | -175.2 | -75.4 | 175.4 | 0 | 0 | 0 | 110.6 | W86 M91 P94 I105 L162 M233 T236 L237 | W86-L89 HydrophobicContact CD2-CD1 4.27Å; W86-L89 HydrophobicContact CE3-CD1 4.09Å; W86-L89 PolarHBondContact O-N 3.31Å; L89-M91 PolarHBondContact O-N 3.34Å; L89-P94 WeakPolarHBondContact O-CA 3.27Å; L89-I105 HydrophobicContact CD2-CD1 4.16Å; L89-L162 HydrophobicContact CD2-CD1 4.39Å; L89-M233 HydrophobicContact CD1-CG 4.12Å; L89-T236 WeakPolarHBondContact CD1-OG1 3.48Å; L89-L237 HydrophobicContact CD2-CB 4.25Å; L89-L237 HydrophobicContact CD2-CD1 4.41Å | ||
| 90 | P | 92.6 | Very high | 94 | Very high | 0 Ų | 0 | 45.5 Ų | 45.5 | 0% | 0 | 25% | 0.247 | C | C | . | . | trans | -78.8 | 120.6 | -178.4 | 32.1 | -36 | 0 | 0 | 0 | 110.6 | P88 P92 L162 I166 T240 | P88-P90 WeakPolarHBondContact O-CD 3.42Å; P90-P92 WeakPolarHBondContact CB-O 3.2Å; P90-L162 HydrophobicContact CG-CB 3.9Å; P90-I166 HydrophobicContact CB-CD1 3.86Å; P90-I166 HydrophobicContact CG-CD1 4.17Å; P90-T240 HydrophobicContact CG-CG2 4.03Å | ||
| 91 | M | 89.1 | Confident | 93.9 | Very high | 61 Ų | 61 | 42 Ų | 42 | 30% | 0.3 | 23% | 0.226 | S | C | . | . | S | Bend | trans | -134 | 85.9 | 171.3 | -62.8 | -164.8 | -164.6 | 0 | 0 | 112.2 | W86 L89 N93 T236 F259 | W86-M91 HydrophobicContact CE3-CE 3.89Å; W86-M91 HydrophobicContact CZ3-CE 3.58Å; L89-M91 PolarHBondContact O-N 3.34Å; M91-N93 PolarHBondContact O-N 3.3Å; M91-T236 HydrophobicContact CE-CG2 4.34Å; M91-F259 HydrophobicContact CE-CE1 4.04Å; M91-F259 HydrophobicContact CG-CD1 4.33Å; M91-F259 HydrophobicContact CG-CE1 4.06Å; M91-F259 HydrophobicContact SD-CE1 4.33Å |
| 92 | P | 88.3 | Confident | 93.8 | Very high | 10 Ų | 10 | 41.5 Ų | 41.5 | 7% | 0.065 | 22% | 0.223 | C | C | . | . | S | Bend | -50.7 | -19.9 | -53.9 | 26.9 | -35.7 | 0 | 0 | 0 | 113.8 | P90 Y247 P252 Y255 T256 | P90-P92 WeakPolarHBondContact CB-O 3.2Å; P92-Y247 HydrophobicContact CB-CD2 3.66Å; P92-Y247 HydrophobicContact CB-CE2 3.67Å; P92-Y247 HydrophobicContact CG-CD2 4.08Å; P92-Y247 HydrophobicContact CG-CE2 3.7Å; P92-P252 HydrophobicContact CG-CB 3.86Å; P92-Y255 HydrophobicContact CB-CD1 3.59Å; P92-Y255 HydrophobicContact CB-CD2 4.38Å; P92-Y255 HydrophobicContact CB-CE1 3.98Å; P92-Y255 HydrophobicContact CB-CG 3.85Å; P92-Y255 HydrophobicContact CG-CD1 4.18Å; P92-Y255 HydrophobicContact CG-CG 4.4Å; P92-T256 VanDerWaalsContact CD-CG2 3.44Å | |
| 93 | N | 91.3 | Very high | 93.7 | Very high | 115 Ų | 115 | 45 Ų | 45 | 62% | 0.615 | 24% | 0.241 | S | C | * | . | S | Bend | trans | -99.2 | 126.6 | 177.1 | -64.6 | -33.6 | 0 | 0 | 0 | 109.5 | M91 | M91-N93 PolarHBondContact O-N 3.3Š|
| 94 | P | 93.9 | Very high | 93.7 | Very high | 23 Ų | 23 | 46.6 Ų | 46.6 | 15% | 0.149 | 25% | 0.247 | C | C | . | . | trans | -72.6 | 156.1 | 175.4 | 31.1 | -35.3 | 0 | 0 | 0 | 111.2 | P88 L89 V96 N97 | P88-P94 WeakPolarHBondContact O-CB 3.37Å; L89-P94 WeakPolarHBondContact O-CA 3.27Å; P94-V96 VanDerWaalsContact C-N 3.31Å; P94-N97 HydrophobicContact CG-CB 3.87Å | ||
| 95 | L | 93.4 | Very high | 93.7 | Very high | 63 Ų | 63 | 43 Ų | 43 | 33% | 0.33 | 23% | 0.228 | S | C | . | . | S | Bend | trans | -62.2 | -44 | 173.5 | -175.4 | 83 | 0 | 0 | 0 | 110.4 | N5 L9 T87 | N5-L95 HydrophobicContact CB-CD1 3.74Å; L9-L95 HydrophobicContact CD2-CB 4.29Å; L9-L95 HydrophobicContact CD2-CD2 3.99Å; T87-L95 HydrophobicContact CG2-CD2 4.09Å; T87-L95 WeakPolarHBondContact O-CB 3.34Å; T87-L95 PolarHBondContact O-N 3.22Å |
| 96 | V | 93.4 | Very high | 93.6 | Very high | 65 Ų | 65 | 44.5 Ų | 44.5 | 39% | 0.394 | 24% | 0.236 | S | C | . | . | S | Bend | trans | -124.9 | 106.7 | 176.2 | -172.6 | 0 | 0 | 0 | 0 | 108.1 | T87 P94 L98 | T87-V96 PolarHBondContact O-N 2.87Å; P94-V96 VanDerWaalsContact C-N 3.31Å; V96-L98 HydrophobicContact CG1-CD2 3.6Å; V96-L98 HydrophobicContact CG1-CG 3.85Å; V96-L98 PolarHBondContact O-N 3.38Å; V96-L98 VanDerWaalsContact O-N 3.16Å |
| 97 | N | 93.2 | Very high | 93.5 | Very high | 100 Ų | 100 | 46.3 Ų | 46.3 | 54% | 0.535 | 25% | 0.254 | S | S | . | . | trans | -76.4 | 103.1 | 175.4 | -169.7 | -2.1 | 0 | 0 | 0 | 109.6 | P94 N161 | P94-N97 HydrophobicContact CG-CB 3.87Å; N97-N161 PolarHBondContact OD1-ND2 3.26Å; N97-N161 VanDerWaalsContact OD1-ND2 3.08Å; N97-N161 PolarHBondContact OD1-OD1 3.18Å | ||
| 98 | L | 93.7 | Very high | 93.5 | Very high | 54 Ų | 54 | 45.9 Ų | 45.9 | 28% | 0.283 | 25% | 0.251 | S | S | . | . | trans | -105 | 130 | 179.4 | -62.6 | 176.5 | 0 | 0 | 0 | 109.7 | P88 V96 L100 G101 F104 N161 | P88-L98 HydrophobicContact CB-CD1 4.41Å; V96-L98 HydrophobicContact CG1-CD2 3.6Å; V96-L98 HydrophobicContact CG1-CG 3.85Å; V96-L98 PolarHBondContact O-N 3.38Å; V96-L98 VanDerWaalsContact O-N 3.16Å; L98-L100 PolarHBondContact O-N 3.24Å; L98-G101 PolarHBondContact O-N 3.16Å; L98-G101 VanDerWaalsContact O-N 3.09Å; L98-F104 HydrophobicContact CD1-CB 4.05Å; L98-F104 HydrophobicContact CD1-CD1 4.23Å; L98-F104 HydrophobicContact CD1-CD2 4.22Å; L98-F104 HydrophobicContact CD1-CG 3.9Å; L98-N161 PolarHBondContact O-OD1 3.48Å | ||
| 99 | N | 94 | Very high | 93.4 | Very high | 119 Ų | 119 | 46 Ų | 46 | 64% | 0.636 | 25% | 0.252 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.2 | -32.4 | 174.6 | -165.1 | 14.8 | 0 | 0 | 0 | 112.2 | F160 N161 | N99-F160 CarbonylContact O-C 3.41Å; N99-N161 PolarHBondContact O-N 2.86Å |
| 100 | L | 94.1 | Very high | 93.2 | Very high | 98 Ų | 98 | 47.7 Ų | 47.7 | 51% | 0.513 | 27% | 0.265 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -107.7 | 40.6 | 176.1 | -55.2 | 177.6 | 0 | 0 | 0 | 111.3 | L98 L102 L103 F104 F160 | L98-L100 PolarHBondContact O-N 3.24Å; L100-L102 VanDerWaalsContact C-N 3.31Å; L100-L102 PolarHBondContact O-N 2.61Å; L100-L103 HydrophobicContact CB-CB 4.34Å; L100-L103 HydrophobicContact CB-CD1 4.19Å; L100-L103 HydrophobicContact CD1-CD1 4.45Å; L100-L103 HydrophobicContact CD2-CD1 4.02Å; L100-L103 HydrophobicContact CG-CD1 4.44Å; L100-L103 PolarHBondContact O-N 2.84Å; L100-F104 PolarHBondContact O-N 3.27Å; L100-F160 HydrophobicContact CD2-CB 4.03Å; L100-F160 HydrophobicContact CD2-CD2 4.12Å; L100-F160 HydrophobicContact CD2-CG 4.33Å |
| 101 | G | 94.1 | Very high | 93.2 | Very high | 1 Ų | 1 | 51.8 Ų | 51.8 | 1% | 0.01 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -57.1 | -40.3 | -175.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | L98 F104 I105 F160 | L98-G101 PolarHBondContact O-N 3.16Å; L98-G101 VanDerWaalsContact O-N 3.09Å; G101-F104 WeakPolarHBondContact O-CB 3.44Å; G101-F104 PolarHBondContact O-N 3.4Å; G101-I105 WeakPolarHBondContact O-CG1 3.18Å; G101-I105 PolarHBondContact O-N 3.3Å; G101-I105 VanDerWaalsContact O-N 3.17Å; G101-F160 PolarHBondContact N-O 3.4Å |
| 102 | L | 94 | Very high | 93.4 | Very high | 2 Ų | 2 | 49.8 Ų | 49.8 | 1% | 0.01 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -71.1 | -39.5 | -178.8 | -151.8 | 150.6 | 0 | 0 | 0 | 112.5 | L100 F104 I105 L106 L150 L154 F160 L162 L165 I241 | L100-L102 VanDerWaalsContact C-N 3.31Å; L100-L102 PolarHBondContact O-N 2.61Å; L102-F104 VanDerWaalsContact C-N 3.29Å; L102-F104 PolarHBondContact O-N 2.66Å; L102-I105 PolarHBondContact O-N 2.92Å; L102-L106 HydrophobicContact CD2-CD1 4.03Å; L102-L106 HydrophobicContact CD2-CG 4.42Å; L102-L106 PolarHBondContact O-N 2.9Å; L102-L150 HydrophobicContact CD1-CD2 3.85Å; L102-L150 HydrophobicContact CD2-CB 3.97Å; L102-L150 HydrophobicContact CD2-CD1 3.62Å; L102-L150 HydrophobicContact CD2-CD2 3.59Å; L102-L150 HydrophobicContact CD2-CG 3.88Å; L102-L150 HydrophobicContact CG-CD2 4.26Å; L102-L154 HydrophobicContact CB-CD1 4.44Å; L102-L154 HydrophobicContact CD1-CD1 4.02Å; L102-L154 HydrophobicContact CD1-CD2 3.78Å; L102-L154 HydrophobicContact CD1-CG 4.14Å; L102-L154 HydrophobicContact CD2-CD1 4.16Å; L102-L154 HydrophobicContact CG-CD1 4.42Å; L102-F160 PolarHBondContact N-O 2.8Å; L102-F160 VanDerWaalsContact N-O 3.08Å; L102-L162 HydrophobicContact CB-CD2 4.2Å; L102-L162 HydrophobicContact CD1-CD2 3.8Å; L102-L162 HydrophobicContact CG-CD2 4.1Å; L102-L165 HydrophobicContact CD1-CD1 4.27Å; L102-I241 HydrophobicContact CD1-CD1 4.43Å |
| 103 | L | 94.5 | Very high | 93.5 | Very high | 74 Ų | 74 | 50.1 Ų | 50.1 | 39% | 0.387 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -63.8 | -35.8 | 173.5 | -75.5 | 162.4 | 0 | 0 | 0 | 111.8 | L100 I105 L106 A107 F160 | L100-L103 HydrophobicContact CB-CB 4.34Å; L100-L103 HydrophobicContact CB-CD1 4.19Å; L100-L103 HydrophobicContact CD1-CD1 4.45Å; L100-L103 HydrophobicContact CD2-CD1 4.02Å; L100-L103 HydrophobicContact CG-CD1 4.44Å; L100-L103 PolarHBondContact O-N 2.84Å; L103-I105 VanDerWaalsContact C-N 3.33Å; L103-I105 PolarHBondContact O-N 3.47Å; L103-L106 PolarHBondContact O-N 3.11Å; L103-A107 WeakPolarHBondContact O-CB 3.19Å; L103-A107 PolarHBondContact O-N 3.39Å; L103-F160 HydrophobicContact CD1-CD1 3.86Å; L103-F160 HydrophobicContact CD1-CD2 4.27Å; L103-F160 HydrophobicContact CD1-CE1 4.1Å; L103-F160 HydrophobicContact CD1-CE2 4.48Å; L103-F160 HydrophobicContact CD1-CG 3.97Å; L103-F160 HydrophobicContact CD1-CZ 4.41Å; L103-F160 HydrophobicContact CD2-CE1 4.39Å; L103-F160 HydrophobicContact CG-CD1 3.8Å; L103-F160 HydrophobicContact CG-CE1 4.08Å; L103-F160 HydrophobicContact CG-CG 4.33Å |
| 104 | F | 96 | Very high | 93.6 | Very high | 65 Ų | 65 | 50.5 Ų | 50.5 | 29% | 0.285 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -60.8 | -42.3 | 173.1 | 172 | -91.8 | 0 | 0 | 0 | 111.6 | P88 L98 L100 G101 L102 A107 T108 | P88-F104 HydrophobicContact CG-CD1 3.92Å; P88-F104 HydrophobicContact CG-CE1 4.27Å; L98-F104 HydrophobicContact CD1-CB 4.05Å; L98-F104 HydrophobicContact CD1-CD1 4.23Å; L98-F104 HydrophobicContact CD1-CD2 4.22Å; L98-F104 HydrophobicContact CD1-CG 3.9Å; L100-F104 PolarHBondContact O-N 3.27Å; G101-F104 WeakPolarHBondContact O-CB 3.44Å; G101-F104 PolarHBondContact O-N 3.4Å; L102-F104 VanDerWaalsContact C-N 3.29Å; L102-F104 PolarHBondContact O-N 2.66Å; F104-A107 PolarHBondContact O-N 3.1Å; F104-T108 HydrophobicContact CD1-CG2 4.42Å; F104-T108 HydrophobicContact CD2-CG2 4.2Å; F104-T108 HydrophobicContact CE1-CG2 4.02Å; F104-T108 HydrophobicContact CE2-CG2 3.77Å; F104-T108 HydrophobicContact CZ-CG2 3.68Å; F104-T108 WeakPolarHBondContact O-CB 3.34Å; F104-T108 WeakPolarHBondContact O-CG2 3.34Å; F104-T108 PolarHBondContact O-N 3.37Å; F104-T108 PolarHBondContact O-OG1 3.01Å |
| 105 | I | 95.5 | Very high | 93.6 | Very high | 7 Ų | 7 | 49.7 Ų | 49.7 | 4% | 0.036 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -63.5 | -47 | 176.4 | -65.2 | -177.5 | 0 | 0 | 0 | 110.9 | L85 P88 L89 G101 L102 L103 A107 T108 S109 L162 L237 | L85-I105 HydrophobicContact CD2-CB 4.32Å; L85-I105 HydrophobicContact CD2-CG2 3.73Å; P88-I105 HydrophobicContact CG-CD1 3.8Å; P88-I105 HydrophobicContact CG-CG1 3.66Å; L89-I105 HydrophobicContact CD2-CD1 4.16Å; G101-I105 WeakPolarHBondContact O-CG1 3.18Å; G101-I105 PolarHBondContact O-N 3.3Å; G101-I105 VanDerWaalsContact O-N 3.17Å; L102-I105 PolarHBondContact O-N 2.92Å; L103-I105 VanDerWaalsContact C-N 3.33Å; L103-I105 PolarHBondContact O-N 3.47Å; I105-A107 VanDerWaalsContact C-N 3.35Å; I105-A107 PolarHBondContact O-N 3.28Å; I105-T108 WeakPolarHBondContact CA-OG1 3.37Å; I105-T108 PolarHBondContact O-N 3.5Å; I105-T108 PolarHBondContact O-OG1 3.36Å; I105-T108 VanDerWaalsContact O-OG1 3.11Å; I105-S109 WeakPolarHBondContact O-CB 3.33Å; I105-S109 PolarHBondContact O-N 3.2Å; I105-S109 PolarHBondContact O-OG 3.47Å; I105-L162 HydrophobicContact CD1-CD1 3.65Å; I105-L237 HydrophobicContact CB-CD1 4.34Å; I105-L237 HydrophobicContact CD1-CD1 3.35Å; I105-L237 HydrophobicContact CG1-CD1 4.42Å; I105-L237 HydrophobicContact CG2-CD1 3.62Å |
| 106 | L | 93.8 | Very high | 93.5 | Very high | 32 Ų | 32 | 47.5 Ų | 47.5 | 17% | 0.168 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -59.4 | -43.5 | 176.7 | -83.1 | 168.3 | 0 | 0 | 0 | 112.7 | L102 L103 T108 S109 S110 L146 A147 L150 | L102-L106 HydrophobicContact CD2-CD1 4.03Å; L102-L106 HydrophobicContact CD2-CG 4.42Å; L102-L106 PolarHBondContact O-N 2.9Å; L103-L106 PolarHBondContact O-N 3.11Å; L106-T108 VanDerWaalsContact C-N 3.35Å; L106-S109 PolarHBondContact O-OG 2.81Å; L106-S110 PolarHBondContact O-N 3.46Å; L106-S110 VanDerWaalsContact O-N 3.15Å; L106-S110 PolarHBondContact O-OG 3.19Å; L106-L146 HydrophobicContact CD2-CD2 3.7Å; L106-L146 HydrophobicContact CD2-CG 4.43Å; L106-A147 HydrophobicContact CD2-CB 4.44Å; L106-L150 HydrophobicContact CD1-CD1 3.8Å; L106-L150 HydrophobicContact CD2-CD1 3.67Å; L106-L150 HydrophobicContact CG-CD1 3.77Å |
| 107 | A | 94.5 | Very high | 93.5 | Very high | 52 Ų | 52 | 46.9 Ų | 46.9 | 43% | 0.43 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -67.8 | -35.9 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112 | L103 F104 I105 S110 L111 | L103-A107 WeakPolarHBondContact O-CB 3.19Å; L103-A107 PolarHBondContact O-N 3.39Å; F104-A107 PolarHBondContact O-N 3.1Å; I105-A107 VanDerWaalsContact C-N 3.35Å; I105-A107 PolarHBondContact O-N 3.28Å; A107-S110 PolarHBondContact O-OG 3.25Å; A107-L111 WeakPolarHBondContact O-CG 3.38Å; A107-L111 PolarHBondContact O-N 2.97Å |
| 108 | T | 94.9 | Very high | 93.5 | Very high | 14 Ų | 14 | 46.4 Ų | 46.4 | 9% | 0.086 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -79.1 | -31.2 | 178.7 | 48.6 | 0 | 0 | 0 | 0 | 112.7 | I81 L85 F104 I105 L106 L111 A112 | I81-T108 VanDerWaalsContact CG2-O 3.24Å; I81-T108 WeakPolarHBondContact CG2-O 3.44Å; L85-T108 WeakPolarHBondContact CD2-OG1 3.47Å; F104-T108 HydrophobicContact CD1-CG2 4.42Å; F104-T108 HydrophobicContact CD2-CG2 4.2Å; F104-T108 HydrophobicContact CE1-CG2 4.02Å; F104-T108 HydrophobicContact CE2-CG2 3.77Å; F104-T108 HydrophobicContact CZ-CG2 3.68Å; F104-T108 WeakPolarHBondContact O-CB 3.34Å; F104-T108 WeakPolarHBondContact O-CG2 3.34Å; F104-T108 PolarHBondContact O-N 3.37Å; F104-T108 PolarHBondContact O-OG1 3.01Å; I105-T108 WeakPolarHBondContact CA-OG1 3.37Å; I105-T108 PolarHBondContact O-N 3.5Å; I105-T108 PolarHBondContact O-OG1 3.36Å; I105-T108 VanDerWaalsContact O-OG1 3.11Å; L106-T108 VanDerWaalsContact C-N 3.35Å; T108-L111 WeakPolarHBondContact O-CB 3.17Å; T108-L111 PolarHBondContact O-N 3.26Å; T108-A112 PolarHBondContact O-N 2.86Å |
| 109 | S | 92.1 | Very high | 93.4 | Very high | 6 Ų | 6 | 43.8 Ų | 43.8 | 4% | 0.042 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -67.5 | -40.4 | 173.5 | 72.9 | 0 | 0 | 0 | 0 | 111.7 | I105 L106 L111 A112 E192 | I105-S109 WeakPolarHBondContact O-CB 3.33Å; I105-S109 PolarHBondContact O-N 3.2Å; I105-S109 PolarHBondContact O-OG 3.47Å; L106-S109 PolarHBondContact O-OG 2.81Å; S109-L111 PolarHBondContact O-N 3.3Å; S109-A112 WeakPolarHBondContact O-CB 3.33Å; S109-A112 PolarHBondContact O-N 3Å; S109-E192 VanDerWaalsContact CB-OE1 3.27Å; S109-E192 WeakPolarHBondContact CB-OE1 3.23Å; S109-E192 PolarHBondContact OG-OE1 2.95Å |
| 110 | S | 91.3 | Very high | 93.2 | Very high | 41 Ų | 41 | 38.1 Ų | 38.1 | 29% | 0.287 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -61.9 | -27.7 | 173.2 | 60.4 | 0 | 0 | 0 | 0 | 113.9 | L106 A107 A112 E143 | L106-S110 PolarHBondContact O-N 3.46Å; L106-S110 VanDerWaalsContact O-N 3.15Å; L106-S110 PolarHBondContact O-OG 3.19Å; A107-S110 PolarHBondContact O-OG 3.25Å; S110-A112 VanDerWaalsContact C-N 3.33Å; S110-E143 VanDerWaalsContact CA-OE1 3.28Å; S110-E143 WeakPolarHBondContact CA-OE1 3.25Å; S110-E143 WeakPolarHBondContact CB-OE2 3.48Å |
| 111 | L | 93.3 | Very high | 93.1 | Very high | 86 Ų | 86 | 40.8 Ų | 40.8 | 45% | 0.45 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -71.5 | -25.8 | 172.5 | -70.3 | 168.7 | 0 | 0 | 0 | 113.1 | I81 A107 T108 S109 V113 Y114 | I81-L111 HydrophobicContact CD1-CB 3.82Å; I81-L111 WeakPolarHBondContact CD1-O 3.44Å; A107-L111 WeakPolarHBondContact O-CG 3.38Å; A107-L111 PolarHBondContact O-N 2.97Å; T108-L111 WeakPolarHBondContact O-CB 3.17Å; T108-L111 PolarHBondContact O-N 3.26Å; S109-L111 PolarHBondContact O-N 3.3Å; L111-V113 PolarHBondContact O-N 3.23Å; L111-Y114 HydrophobicContact CD2-CD2 4.12Å; L111-Y114 HydrophobicContact CD2-CE2 4.11Å; L111-Y114 PolarHBondContact O-N 3.47Å |
| 112 | A | 91.5 | Very high | 93 | Very high | 19 Ų | 19 | 40.7 Ų | 40.7 | 16% | 0.157 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -61.7 | -28.9 | -178.8 | 0 | 0 | 0 | 0 | 0 | 112 | I81 T108 S109 S110 Y114 S115 | I81-A112 HydrophobicContact CG2-CB 3.97Å; T108-A112 PolarHBondContact O-N 2.86Å; S109-A112 WeakPolarHBondContact O-CB 3.33Å; S109-A112 PolarHBondContact O-N 3Å; S110-A112 VanDerWaalsContact C-N 3.33Å; A112-Y114 PolarHBondContact O-N 3.1Å; A112-S115 WeakPolarHBondContact O-CB 3.41Å; A112-S115 PolarHBondContact O-N 2.83Å; A112-S115 VanDerWaalsContact O-N 3.11Å; A112-S115 PolarHBondContact O-OG 3.35Å |
| 113 | V | 92.1 | Very high | 92.6 | Very high | 16 Ų | 16 | 40.6 Ų | 40.6 | 10% | 0.097 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -59.2 | -34.5 | 178.6 | -173.2 | 0 | 0 | 0 | 0 | 112.2 | L111 S115 I116 L117 V136 T139 E143 | L111-V113 PolarHBondContact O-N 3.23Å; V113-S115 VanDerWaalsContact C-N 3.28Å; V113-S115 PolarHBondContact O-N 3.25Å; V113-I116 PolarHBondContact O-N 3.24Å; V113-L117 PolarHBondContact O-N 3.23Å; V113-V136 HydrophobicContact CG1-CB 4.07Å; V113-V136 HydrophobicContact CG1-CG1 3.99Å; V113-V136 HydrophobicContact CG1-CG2 3.72Å; V113-T139 VanDerWaalsContact CG1-OG1 3.23Å; V113-T139 WeakPolarHBondContact CG1-OG1 3.22Å; V113-T139 HydrophobicContact CG2-CG2 4.03Å; V113-T139 WeakPolarHBondContact CG2-OG1 2.96Å; V113-E143 WeakPolarHBondContact CG2-OE1 3.47Å |
| 114 | Y | 93.2 | Very high | 92.3 | Very high | 123 Ų | 123 | 42.3 Ų | 42.3 | 48% | 0.482 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -65.3 | -31.9 | 178.7 | -69.2 | -69.8 | 0 | 0 | 0 | 112.7 | L111 A112 I116 L117 W118 | L111-Y114 HydrophobicContact CD2-CD2 4.12Å; L111-Y114 HydrophobicContact CD2-CE2 4.11Å; L111-Y114 PolarHBondContact O-N 3.47Å; A112-Y114 PolarHBondContact O-N 3.1Å; Y114-I116 VanDerWaalsContact C-N 3.28Å; Y114-I116 PolarHBondContact O-N 3.16Å; Y114-L117 PolarHBondContact O-N 3.21Å; Y114-W118 VanDerWaalsContact O-CB 3.3Å; Y114-W118 WeakPolarHBondContact O-CB 3.43Å; Y114-W118 VanDerWaalsContact O-CG 3.24Å; Y114-W118 PolarHBondContact O-N 2.66Å |
| 115 | S | 93.1 | Very high | 92 | Very high | 6 Ų | 6 | 40.2 Ų | 40.2 | 4% | 0.042 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -60.7 | -42.2 | 175.8 | 72.3 | 0 | 0 | 0 | 0 | 111.3 | A112 V113 S119 | A112-S115 WeakPolarHBondContact O-CB 3.41Å; A112-S115 PolarHBondContact O-N 2.83Å; A112-S115 VanDerWaalsContact O-N 3.11Å; A112-S115 PolarHBondContact O-OG 3.35Å; V113-S115 VanDerWaalsContact C-N 3.28Å; V113-S115 PolarHBondContact O-N 3.25Å; S115-S119 VanDerWaalsContact O-CB 3.27Å; S115-S119 WeakPolarHBondContact O-CB 3.46Å; S115-S119 PolarHBondContact O-N 3.16Å; S115-S119 PolarHBondContact O-OG 2.78Å |
| 116 | I | 91.4 | Very high | 91.6 | Very high | 18 Ų | 18 | 46.1 Ų | 46.1 | 9% | 0.092 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -70.6 | -45.4 | 179.5 | -55.9 | 169.5 | 0 | 0 | 0 | 109.8 | V113 Y114 W118 S119 G120 A135 F211 | V113-I116 PolarHBondContact O-N 3.24Å; Y114-I116 VanDerWaalsContact C-N 3.28Å; Y114-I116 PolarHBondContact O-N 3.16Å; I116-W118 PolarHBondContact O-N 3.47Å; I116-S119 PolarHBondContact O-N 3.06Å; I116-S119 PolarHBondContact O-OG 3.49Å; I116-G120 PolarHBondContact O-N 3.2Å; I116-G120 VanDerWaalsContact O-N 3.12Å; I116-A135 HydrophobicContact CG2-CB 3.69Å; I116-F211 HydrophobicContact CG2-CB 4.12Å; I116-F211 HydrophobicContact CG2-CD1 3.7Å; I116-F211 HydrophobicContact CG2-CD2 4.19Å; I116-F211 HydrophobicContact CG2-CE1 4.1Å; I116-F211 HydrophobicContact CG2-CG 3.74Å; I116-F211 HydrophobicContact CG2-CZ 4.5Å |
| 117 | L | 92.7 | Very high | 91.4 | Very high | 52 Ų | 52 | 51.7 Ų | 51.7 | 27% | 0.272 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -60.5 | -49 | 178.6 | -177.8 | 67.8 | 0 | 0 | 0 | 112.2 | V113 Y114 S119 G120 W121 V136 | V113-L117 PolarHBondContact O-N 3.23Å; Y114-L117 PolarHBondContact O-N 3.21Å; L117-S119 VanDerWaalsContact C-N 3.28Å; L117-S119 PolarHBondContact O-N 2.7Å; L117-G120 PolarHBondContact O-N 2.99Å; L117-W121 PolarHBondContact O-N 3.41Å; L117-V136 HydrophobicContact CB-CG2 3.88Å; L117-V136 HydrophobicContact CD1-CG2 3.96Å; L117-V136 HydrophobicContact CG-CG2 4.42Å |
| 118 | W | 93.6 | Very high | 91.1 | Very high | 89 Ų | 89 | 49.2 Ų | 49.2 | 34% | 0.337 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -63.4 | -38.2 | 178.9 | -70.1 | 0.3 | 0 | 0 | 0 | 111.2 | L70 A74 L77 Y114 I116 G120 A122 | L70-W118 HydrophobicContact CD2-CD2 3.9Å; L70-W118 HydrophobicContact CD2-CE3 3.98Å; L70-W118 HydrophobicContact CD2-CG 4.16Å; A74-W118 HydrophobicContact CB-CB 3.96Å; L77-W118 HydrophobicContact CD1-CE3 4.43Å; L77-W118 HydrophobicContact CD1-CH2 4.21Å; L77-W118 HydrophobicContact CD1-CZ3 3.73Å; Y114-W118 VanDerWaalsContact O-CB 3.3Å; Y114-W118 WeakPolarHBondContact O-CB 3.43Å; Y114-W118 VanDerWaalsContact O-CG 3.24Å; Y114-W118 PolarHBondContact O-N 2.66Å; I116-W118 PolarHBondContact O-N 3.47Å; W118-G120 PolarHBondContact O-N 3.04Å; W118-A122 WeakPolarHBondContact O-CB 3.37Å; W118-A122 PolarHBondContact O-N 2.98Å |
| 119 | S | 91.7 | Very high | 90.9 | Very high | 0 Ų | 0 | 51.6 Ų | 51.6 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -62 | -45.2 | 179 | 75 | 0 | 0 | 0 | 0 | 112.7 | S115 I116 L117 S123 F211 Y215 F223 | S115-S119 VanDerWaalsContact O-CB 3.27Å; S115-S119 WeakPolarHBondContact O-CB 3.46Å; S115-S119 PolarHBondContact O-N 3.16Å; S115-S119 PolarHBondContact O-OG 2.78Å; I116-S119 PolarHBondContact O-N 3.06Å; I116-S119 PolarHBondContact O-OG 3.49Å; L117-S119 VanDerWaalsContact C-N 3.28Å; L117-S119 PolarHBondContact O-N 2.7Å; S119-S123 PolarHBondContact O-N 2.85Å; S119-F211 WeakPolarHBondContact OG-CD2 3.47Å; S119-Y215 WeakPolarHBondContact CA-OH 3.23Å; S119-F223 VanDerWaalsContact CB-CZ 3.5Å |
| 120 | G | 90.1 | Very high | 90.8 | Very high | 0 Ų | 0 | 55.3 Ų | 55.3 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -67.6 | -45.3 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | I116 L117 W118 S123 | I116-G120 PolarHBondContact O-N 3.2Å; I116-G120 VanDerWaalsContact O-N 3.12Å; L117-G120 PolarHBondContact O-N 2.99Å; W118-G120 PolarHBondContact O-N 3.04Å; G120-S123 PolarHBondContact O-OG 3.36Å |
| 121 | W | 91.8 | Very high | 90.7 | Very high | 153 Ų | 153 | 53.3 Ų | 53.3 | 58% | 0.58 | 25% | 0.252 | S | S | * | . | H | α-helix | trans | -67.1 | -40.2 | 178.8 | -168.4 | 74.8 | 0 | 0 | 0 | 112.4 | T67 L70 L117 S123 N124 L129 | T67-W121 HydrophobicContact CG2-CZ3 4.27Å; L70-W121 HydrophobicContact CD1-CE3 3.39Å; L70-W121 HydrophobicContact CD1-CZ3 3.35Å; L117-W121 PolarHBondContact O-N 3.41Å; W121-S123 VanDerWaalsContact C-N 3.28Å; W121-S123 PolarHBondContact O-N 3.37Å; W121-N124 PolarHBondContact O-N 3.13Å; W121-L129 HydrophobicContact CB-CD1 4.5Å |
| 122 | A | 91.6 | Very high | 90.6 | Very high | 0 Ų | 0 | 49.2 Ų | 49.2 | 0% | 0 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -66.5 | -30.7 | -177.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | S66 T67 L70 W118 N124 | S66-A122 CarbonylContact C-O 3.56Å; S66-A122 WeakPolarHBondContact CA-O 3.45Å; S66-A122 WeakPolarHBondContact CB-O 3.23Å; T67-A122 PolarHBondContact N-O 3.12Å; T67-A122 WeakPolarHBondContact OG1-CA 3.45Å; L70-A122 HydrophobicContact CB-CB 3.65Å; W118-A122 WeakPolarHBondContact O-CB 3.37Å; W118-A122 PolarHBondContact O-N 2.98Å; A122-N124 PolarHBondContact O-N 3.37Å |
| 123 | S | 86.5 | Confident | 90.6 | Very high | 0 Ų | 0 | 52.9 Ų | 52.9 | 0% | 0 | 25% | 0.247 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -69.3 | -19.3 | -179.3 | 76.5 | 0 | 0 | 0 | 0 | 113.8 | S119 G120 W121 S125 A128 | S119-S123 PolarHBondContact O-N 2.85Å; G120-S123 PolarHBondContact O-OG 3.36Å; W121-S123 VanDerWaalsContact C-N 3.28Å; W121-S123 PolarHBondContact O-N 3.37Å; S123-S125 PolarHBondContact O-N 2.87Å; S123-A128 WeakPolarHBondContact OG-CB 3.32Å |
| 124 | N | 88.8 | Confident | 90.5 | Very high | 109 Ų | 109 | 54 Ų | 54 | 58% | 0.583 | 25% | 0.25 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 51 | 36 | -179.7 | -155.7 | 14 | 0 | 0 | 0 | 114 | T65 W121 A122 | T65-N124 WeakPolarHBondContact O-CB 3.38Å; T65-N124 PolarHBondContact O-ND2 3.44Å; W121-N124 PolarHBondContact O-N 3.13Å; A122-N124 PolarHBondContact O-N 3.37Å |
| 125 | S | 88 | Confident | 90.3 | Very high | 22 Ų | 22 | 48.2 Ų | 48.2 | 15% | 0.154 | 23% | 0.227 | C | C | . | . | trans | -114.6 | 140.5 | 171 | 75.3 | 0 | 0 | 0 | 0 | 110.3 | S123 Y127 A128 L129 | S123-S125 PolarHBondContact O-N 2.87Å; S125-Y127 VanDerWaalsContact C-N 3.3Å; S125-Y127 PolarHBondContact O-N 3.28Å; S125-A128 PolarHBondContact O-N 3.13Å; S125-A128 WeakPolarHBondContact OG-CB 3.32Å; S125-A128 PolarHBondContact OG-N 2.75Å; S125-L129 PolarHBondContact O-N 3.03Å | ||
| 126 | N | 88 | Confident | 90.2 | Very high | 130 Ų | 130 | 49 Ų | 49 | 70% | 0.695 | 23% | 0.231 | S | C | * | . | H | α-helix | trans | -62.8 | -38.7 | -176.3 | -68.7 | -23.5 | 0 | 0 | 0 | 112 | L129 I130 | N126-L129 PolarHBondContact O-N 3Å; N126-I130 WeakPolarHBondContact O-CD1 3.13Å; N126-I130 VanDerWaalsContact O-CG1 3.27Å; N126-I130 WeakPolarHBondContact O-CG1 3.44Å; N126-I130 PolarHBondContact O-N 2.82Å |
| 127 | Y | 89.6 | Confident | 90.2 | Very high | 149 Ų | 149 | 49.4 Ų | 49.4 | 58% | 0.584 | 24% | 0.238 | S | C | * | . | H | α-helix | trans | -68.2 | -41.5 | 179.7 | -70.5 | -75.4 | 0 | 0 | 0 | 112.4 | S125 L129 I130 G131 L207 | S125-Y127 VanDerWaalsContact C-N 3.3Å; S125-Y127 PolarHBondContact O-N 3.28Å; Y127-L129 VanDerWaalsContact C-N 3.33Å; Y127-L129 PolarHBondContact O-N 3.24Å; Y127-I130 PolarHBondContact O-N 3.23Å; Y127-G131 PolarHBondContact O-N 3.24Å; Y127-L207 HydrophobicContact CD1-CD2 4.11Å |
| 128 | A | 88.9 | Confident | 90.1 | Very high | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -67.6 | -36.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | S123 S125 G131 A132 G210 | S123-A128 WeakPolarHBondContact OG-CB 3.32Å; S125-A128 PolarHBondContact O-N 3.13Å; S125-A128 WeakPolarHBondContact OG-CB 3.32Å; S125-A128 PolarHBondContact OG-N 2.75Å; A128-G131 PolarHBondContact O-N 2.95Å; A128-A132 WeakPolarHBondContact O-CB 3.31Å; A128-A132 PolarHBondContact O-N 3.3Å; A128-G210 WeakPolarHBondContact CA-O 3.34Å; A128-G210 WeakPolarHBondContact CB-O 3.31Å |
| 129 | L | 90.4 | Very high | 89.9 | Confident | 64 Ų | 64 | 43.1 Ų | 43.1 | 34% | 0.335 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -64 | -44.1 | 174.1 | -173.4 | 65 | 0 | 0 | 0 | 111.7 | W121 S125 N126 Y127 A132 L133 | W121-L129 HydrophobicContact CB-CD1 4.5Å; S125-L129 PolarHBondContact O-N 3.03Å; N126-L129 PolarHBondContact O-N 3Å; Y127-L129 VanDerWaalsContact C-N 3.33Å; Y127-L129 PolarHBondContact O-N 3.24Å; L129-A132 PolarHBondContact O-N 3.37Å; L129-L133 HydrophobicContact CG-CD1 4.25Å; L129-L133 WeakPolarHBondContact O-CG 3.48Å; L129-L133 PolarHBondContact O-N 3.26Å |
| 130 | I | 90.1 | Very high | 89.7 | Confident | 84 Ų | 84 | 47.4 Ų | 47.4 | 43% | 0.431 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -62.7 | -43.7 | 176.4 | -67.8 | 164.2 | 0 | 0 | 0 | 110.8 | N126 Y127 L133 R134 L207 | N126-I130 WeakPolarHBondContact O-CD1 3.13Å; N126-I130 VanDerWaalsContact O-CG1 3.27Å; N126-I130 WeakPolarHBondContact O-CG1 3.44Å; N126-I130 PolarHBondContact O-N 2.82Å; Y127-I130 PolarHBondContact O-N 3.23Å; I130-L133 PolarHBondContact O-N 3.45Å; I130-R134 WeakPolarHBondContact O-CG 3.33Å; I130-R134 PolarHBondContact O-N 2.93Å; I130-L207 HydrophobicContact CB-CD2 4.49Å; I130-L207 HydrophobicContact CG2-CD2 4.14Å |
| 131 | G | 88.2 | Confident | 89.8 | Confident | 0 Ų | 0 | 47.7 Ų | 47.7 | 0% | 0 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -60.6 | -45.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | Y127 A128 R134 A135 | Y127-G131 PolarHBondContact O-N 3.24Å; A128-G131 PolarHBondContact O-N 2.95Å; G131-R134 PolarHBondContact O-N 3.36Å; G131-A135 WeakPolarHBondContact O-CB 3.46Å; G131-A135 PolarHBondContact O-N 2.96Å |
| 132 | A | 91.2 | Very high | 89.7 | Confident | 0 Ų | 0 | 40.4 Ų | 40.4 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -64.2 | -42.7 | 178 | 0 | 0 | 0 | 0 | 0 | 112.4 | A128 L129 R134 A135 V136 F211 | A128-A132 WeakPolarHBondContact O-CB 3.31Å; A128-A132 PolarHBondContact O-N 3.3Å; L129-A132 PolarHBondContact O-N 3.37Å; A132-R134 VanDerWaalsContact C-N 3.33Å; A132-R134 PolarHBondContact O-N 2.95Å; A132-A135 PolarHBondContact O-N 3.49Å; A132-V136 WeakPolarHBondContact O-CB 3.4Å; A132-V136 WeakPolarHBondContact O-CG2 3.23Å; A132-V136 PolarHBondContact O-N 2.92Å; A132-F211 HydrophobicContact CB-CB 4.21Å |
| 133 | L | 91.5 | Very high | 89.7 | Confident | 96 Ų | 96 | 42.5 Ų | 42.5 | 50% | 0.503 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -63.7 | -38.3 | 177 | -71.9 | 172.6 | 0 | 0 | 0 | 112.2 | L129 I130 A137 | L129-L133 HydrophobicContact CG-CD1 4.25Å; L129-L133 WeakPolarHBondContact O-CG 3.48Å; L129-L133 PolarHBondContact O-N 3.26Å; I130-L133 PolarHBondContact O-N 3.45Å; L133-A137 WeakPolarHBondContact O-CB 3.37Å; L133-A137 PolarHBondContact O-N 3.03Å |
| 134 | R | 90.4 | Very high | 90.1 | Very high | 40 Ų | 40 | 45.3 Ų | 45.3 | 15% | 0.151 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -65.4 | -44.4 | 174.3 | -74 | 173 | 64.9 | 172.5 | 0.9 | 111.9 | I130 G131 A132 V136 A137 Q138 E206 Y282 | I130-R134 WeakPolarHBondContact O-CG 3.33Å; I130-R134 PolarHBondContact O-N 2.93Å; G131-R134 PolarHBondContact O-N 3.36Å; A132-R134 VanDerWaalsContact C-N 3.33Å; A132-R134 PolarHBondContact O-N 2.95Å; R134-V136 VanDerWaalsContact C-N 3.34Å; R134-V136 PolarHBondContact O-N 3.42Å; R134-A137 PolarHBondContact O-N 3.42Å; R134-Q138 VanDerWaalsContact O-CB 3.25Å; R134-Q138 WeakPolarHBondContact O-CB 3.38Å; R134-Q138 PolarHBondContact O-N 2.98Å; R134-E206 IonicContact CZ-OE2 3.38Å; R134-E206 IonicContact NH1-OE2 2.78Å; R134-E206 PolarHBondContact NH1-OE2 3.18Å; R134-E206 IonicContact NH2-OE2 2.82Å; R134-E206 PolarHBondContact NH2-OE2 3.31Å; R134-Y282 HydrophobicContact CB-CD2 4.49Å; R134-Y282 HydrophobicContact CB-CE2 4.45Å; R134-Y282 HydrophobicContact CG-CD2 4.39Å; R134-Y282 HydrophobicContact CG-CE2 4.45Å |
| 135 | A | 88.8 | Confident | 90.3 | Very high | 0 Ų | 0 | 40.1 Ų | 40.1 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -61.6 | -42.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | I116 G131 A132 Q138 T139 A201 | I116-A135 HydrophobicContact CG2-CB 3.69Å; G131-A135 WeakPolarHBondContact O-CB 3.46Å; G131-A135 PolarHBondContact O-N 2.96Å; A132-A135 PolarHBondContact O-N 3.49Å; A135-Q138 VanDerWaalsContact O-CB 3.31Å; A135-Q138 WeakPolarHBondContact O-CB 3.45Å; A135-Q138 PolarHBondContact O-N 3.43Å; A135-T139 WeakPolarHBondContact O-CG2 3.42Å; A135-T139 PolarHBondContact O-N 2.99Å; A135-T139 PolarHBondContact O-OG1 3.42Å; A135-A201 HydrophobicContact CB-CB 3.63Å |
| 136 | V | 90.5 | Very high | 90.6 | Very high | 22 Ų | 22 | 39.3 Ų | 39.3 | 13% | 0.133 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -65.9 | -44.8 | 178 | 172 | 0 | 0 | 0 | 0 | 111.2 | V113 L117 A132 R134 Q138 T139 I140 | V113-V136 HydrophobicContact CG1-CB 4.07Å; V113-V136 HydrophobicContact CG1-CG1 3.99Å; V113-V136 HydrophobicContact CG1-CG2 3.72Å; L117-V136 HydrophobicContact CB-CG2 3.88Å; L117-V136 HydrophobicContact CD1-CG2 3.96Å; L117-V136 HydrophobicContact CG-CG2 4.42Å; A132-V136 WeakPolarHBondContact O-CB 3.4Å; A132-V136 WeakPolarHBondContact O-CG2 3.23Å; A132-V136 PolarHBondContact O-N 2.92Å; R134-V136 VanDerWaalsContact C-N 3.34Å; R134-V136 PolarHBondContact O-N 3.42Å; V136-Q138 PolarHBondContact O-N 2.98Å; V136-T139 PolarHBondContact O-N 3.47Å; V136-T139 PolarHBondContact O-OG1 3.43Å; V136-T139 VanDerWaalsContact O-OG1 3.04Å; V136-I140 HydrophobicContact CG1-CD1 3.66Å; V136-I140 HydrophobicContact CG1-CG1 4.45Å; V136-I140 WeakPolarHBondContact O-CD1 3.32Å; V136-I140 VanDerWaalsContact O-CG1 3.23Å; V136-I140 WeakPolarHBondContact O-CG1 3.3Å; V136-I140 PolarHBondContact O-N 3.25Å; V136-I140 VanDerWaalsContact O-N 3.11Å |
| 137 | A | 91.2 | Very high | 90.9 | Very high | 28 Ų | 28 | 35 Ų | 35 | 23% | 0.231 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -62 | -38.7 | 176 | 0 | 0 | 0 | 0 | 0 | 111.3 | L133 R134 S141 Y282 M286 | L133-A137 WeakPolarHBondContact O-CB 3.37Å; L133-A137 PolarHBondContact O-N 3.03Å; R134-A137 PolarHBondContact O-N 3.42Å; A137-S141 WeakPolarHBondContact O-CB 3.47Å; A137-S141 PolarHBondContact O-N 2.82Å; A137-S141 PolarHBondContact O-OG 3.07Å; A137-Y282 HydrophobicContact CB-CE2 4.2Å; A137-Y282 WeakPolarHBondContact CB-OH 3.47Å; A137-M286 HydrophobicContact CB-CE 4.01Å; A137-M286 WeakPolarHBondContact O-CE 3.5Å |
| 138 | Q | 90.9 | Very high | 91.2 | Very high | 0 Ų | 0 | 29.3 Ų | 29.3 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -59.8 | -57.8 | 174.6 | -174 | 174.2 | -34.9 | 0 | 0 | 111.3 | R134 A135 V136 I140 S141 Y142 A191 N194 F198 L285 | R134-Q138 VanDerWaalsContact O-CB 3.25Å; R134-Q138 WeakPolarHBondContact O-CB 3.38Å; R134-Q138 PolarHBondContact O-N 2.98Å; A135-Q138 VanDerWaalsContact O-CB 3.31Å; A135-Q138 WeakPolarHBondContact O-CB 3.45Å; A135-Q138 PolarHBondContact O-N 3.43Å; V136-Q138 PolarHBondContact O-N 2.98Å; Q138-I140 PolarHBondContact O-N 2.97Å; Q138-S141 PolarHBondContact O-N 3.3Å; Q138-S141 VanDerWaalsContact O-N 3.15Å; Q138-S141 PolarHBondContact O-OG 2.91Å; Q138-Y142 HydrophobicContact CG-CD2 3.71Å; Q138-Y142 HydrophobicContact CG-CE2 3.36Å; Q138-Y142 WeakPolarHBondContact O-CD2 3.45Å; Q138-Y142 PolarHBondContact O-N 3.48Å; Q138-Y142 VanDerWaalsContact O-N 3.15Å; Q138-A191 PolarHBondContact NE2-O 3.17Å; Q138-N194 PolarHBondContact NE2-OD1 3.31Å; Q138-F198 PolarHBondContact NE2-O 3.11Å; Q138-F198 PolarHBondContact OE1-O 2.73Å; Q138-L285 HydrophobicContact CG-CD1 4.08Å; Q138-L285 HydrophobicContact CG-CD2 4.44Å |
| 139 | T | 89.6 | Confident | 91.6 | Very high | 8 Ų | 8 | 29.3 Ų | 29.3 | 5% | 0.049 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -60 | -45.4 | -175.7 | 53.9 | 0 | 0 | 0 | 0 | 112.2 | V113 A135 V136 S141 Y142 E143 | V113-T139 VanDerWaalsContact CG1-OG1 3.23Å; V113-T139 WeakPolarHBondContact CG1-OG1 3.22Å; V113-T139 HydrophobicContact CG2-CG2 4.03Å; V113-T139 WeakPolarHBondContact CG2-OG1 2.96Å; A135-T139 WeakPolarHBondContact O-CG2 3.42Å; A135-T139 PolarHBondContact O-N 2.99Å; A135-T139 PolarHBondContact O-OG1 3.42Å; V136-T139 PolarHBondContact O-N 3.47Å; V136-T139 PolarHBondContact O-OG1 3.43Å; V136-T139 VanDerWaalsContact O-OG1 3.04Å; T139-S141 VanDerWaalsContact C-N 3.28Å; T139-S141 PolarHBondContact O-N 3.49Å; T139-Y142 PolarHBondContact O-N 3.04Å; T139-Y142 VanDerWaalsContact O-N 3.14Å; T139-E143 WeakPolarHBondContact O-CG 3.44Å; T139-E143 PolarHBondContact O-N 2.75Å |
| 140 | I | 88.9 | Confident | 91.8 | Very high | 91 Ų | 91 | 26.5 Ų | 26.5 | 47% | 0.467 | 15% | 0.147 | S | C | . | . | H | α-helix | trans | -59.1 | -41.9 | 178.5 | -65 | 166.6 | 0 | 0 | 0 | 110.9 | V136 Q138 Y142 E143 | V136-I140 HydrophobicContact CG1-CD1 3.66Å; V136-I140 HydrophobicContact CG1-CG1 4.45Å; V136-I140 WeakPolarHBondContact O-CD1 3.32Å; V136-I140 VanDerWaalsContact O-CG1 3.23Å; V136-I140 WeakPolarHBondContact O-CG1 3.3Å; V136-I140 PolarHBondContact O-N 3.25Å; V136-I140 VanDerWaalsContact O-N 3.11Å; Q138-I140 PolarHBondContact O-N 2.97Å; I140-Y142 VanDerWaalsContact C-N 3.33Å; I140-Y142 PolarHBondContact O-N 3.06Å; I140-E143 PolarHBondContact O-N 3Å |
| 141 | S | 91.2 | Very high | 92 | Very high | 5 Ų | 5 | 26 Ų | 26 | 4% | 0.035 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -66 | -35.6 | -179.6 | 65.5 | 0 | 0 | 0 | 0 | 112.8 | A137 Q138 T139 L289 | A137-S141 WeakPolarHBondContact O-CB 3.47Å; A137-S141 PolarHBondContact O-N 2.82Å; A137-S141 PolarHBondContact O-OG 3.07Å; Q138-S141 PolarHBondContact O-N 3.3Å; Q138-S141 VanDerWaalsContact O-N 3.15Å; Q138-S141 PolarHBondContact O-OG 2.91Å; T139-S141 VanDerWaalsContact C-N 3.28Å; T139-S141 PolarHBondContact O-N 3.49Å; S141-L289 WeakPolarHBondContact OG-CD1 3.1Å |
| 142 | Y | 90 | Very high | 92.4 | Very high | 1 Ų | 1 | 26 Ų | 26 | 0% | 0.004 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -76.3 | -38.5 | 176.7 | -72.3 | -70 | 0 | 0 | 0 | 113 | Q138 T139 I140 V144 T145 L146 A191 F198 L285 L289 | Q138-Y142 HydrophobicContact CG-CD2 3.71Å; Q138-Y142 HydrophobicContact CG-CE2 3.36Å; Q138-Y142 WeakPolarHBondContact O-CD2 3.45Å; Q138-Y142 PolarHBondContact O-N 3.48Å; Q138-Y142 VanDerWaalsContact O-N 3.15Å; T139-Y142 PolarHBondContact O-N 3.04Å; T139-Y142 VanDerWaalsContact O-N 3.14Å; I140-Y142 VanDerWaalsContact C-N 3.33Å; I140-Y142 PolarHBondContact O-N 3.06Å; Y142-V144 PolarHBondContact O-N 2.65Å; Y142-T145 PolarHBondContact O-N 2.86Å; Y142-T145 PolarHBondContact O-OG1 3.49Å; Y142-L146 WeakPolarHBondContact O-CB 3.36Å; Y142-L146 PolarHBondContact O-N 3.41Å; Y142-A191 HydrophobicContact CD1-CB 3.77Å; Y142-A191 HydrophobicContact CD2-CB 3.67Å; Y142-A191 HydrophobicContact CE1-CB 3.27Å; Y142-A191 HydrophobicContact CE2-CB 3.15Å; Y142-A191 HydrophobicContact CG-CB 3.98Å; Y142-A191 VanDerWaalsContact OH-CB 3.23Å; Y142-A191 WeakPolarHBondContact OH-CB 3.33Å; Y142-F198 WeakPolarHBondContact OH-CD1 3.46Å; Y142-L285 HydrophobicContact CE2-CD1 4.08Å; Y142-L285 HydrophobicContact CE2-CD2 3.63Å; Y142-L285 HydrophobicContact CE2-CG 4.22Å; Y142-L285 VanDerWaalsContact OH-CD1 3.25Å; Y142-L285 WeakPolarHBondContact OH-CD1 3.14Å; Y142-L285 WeakPolarHBondContact OH-CD2 3.48Å; Y142-L285 WeakPolarHBondContact OH-CG 3.23Å; Y142-L289 HydrophobicContact CD1-CD1 3.51Å; Y142-L289 HydrophobicContact CD1-CD2 3.18Å; Y142-L289 HydrophobicContact CD1-CG 3.75Å; Y142-L289 HydrophobicContact CD2-CD1 3.91Å; Y142-L289 HydrophobicContact CE1-CD1 3.34Å; Y142-L289 HydrophobicContact CE1-CD2 3.16Å; Y142-L289 HydrophobicContact CE1-CG 3.36Å; Y142-L289 HydrophobicContact CE2-CD1 3.75Å; Y142-L289 HydrophobicContact CG-CD1 3.76Å; Y142-L289 HydrophobicContact CG-CD2 4.16Å; Y142-L289 HydrophobicContact CG-CG 4.48Å; Y142-L289 VanDerWaalsContact CZ-CD1 3.42Å |
| 143 | E | 91.8 | Very high | 92.5 | Very high | 44 Ų | 44 | 26.1 Ų | 26.1 | 21% | 0.206 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -54.3 | -39 | -179.7 | -83.6 | 175.8 | -153.1 | 0 | 0 | 112.6 | S110 V113 T139 I140 L146 A147 | S110-E143 VanDerWaalsContact CA-OE1 3.28Å; S110-E143 WeakPolarHBondContact CA-OE1 3.25Å; S110-E143 WeakPolarHBondContact CB-OE2 3.48Å; V113-E143 WeakPolarHBondContact CG2-OE1 3.47Å; T139-E143 WeakPolarHBondContact O-CG 3.44Å; T139-E143 PolarHBondContact O-N 2.75Å; I140-E143 PolarHBondContact O-N 3Å; E143-L146 PolarHBondContact O-N 3.21Å; E143-A147 WeakPolarHBondContact O-CB 3.38Å; E143-A147 PolarHBondContact O-N 3.1Å |
| 144 | V | 94 | Very high | 92.6 | Very high | 58 Ų | 58 | 22 Ų | 22 | 35% | 0.352 | 12% | 0.124 | S | C | . | . | H | α-helix | trans | -60.8 | -49.9 | 177 | 179.2 | 0 | 0 | 0 | 0 | 110.7 | Y142 I148 L294 | Y142-V144 PolarHBondContact O-N 2.65Å; V144-I148 HydrophobicContact CG1-CD1 4.05Å; V144-I148 WeakPolarHBondContact O-CD1 3.3Å; V144-I148 VanDerWaalsContact O-CG1 3.3Å; V144-I148 WeakPolarHBondContact O-CG1 3.47Å; V144-I148 PolarHBondContact O-N 2.9Å; V144-L294 HydrophobicContact CG1-CD1 3.81Å |
| 145 | T | 93.6 | Very high | 92.8 | Very high | 1 Ų | 1 | 22.7 Ų | 22.7 | 1% | 0.006 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -67.9 | -38.8 | 178.9 | 57.4 | 0 | 0 | 0 | 0 | 112.1 | Y142 A147 I148 I149 L289 F293 L294 | Y142-T145 PolarHBondContact O-N 2.86Å; Y142-T145 PolarHBondContact O-OG1 3.49Å; T145-A147 PolarHBondContact O-N 3.35Å; T145-I148 PolarHBondContact O-N 2.81Å; T145-I149 WeakPolarHBondContact O-CB 3.46Å; T145-I149 WeakPolarHBondContact O-CD1 3.39Å; T145-I149 WeakPolarHBondContact O-CG1 3.47Å; T145-I149 PolarHBondContact O-N 3.36Å; T145-L289 HydrophobicContact CG2-CD2 4.05Å; T145-F293 HydrophobicContact CG2-CB 4.16Å; T145-L294 HydrophobicContact CG2-CB 4.46Å |
| 146 | L | 93.5 | Very high | 93 | Very high | 5 Ų | 5 | 25.4 Ų | 25.4 | 3% | 0.026 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -59.1 | -48 | 178.2 | -165 | 89.4 | 0 | 0 | 0 | 110.6 | L106 Y142 E143 I149 L150 W185 T189 E192 | L106-L146 HydrophobicContact CD2-CD2 3.7Å; L106-L146 HydrophobicContact CD2-CG 4.43Å; Y142-L146 WeakPolarHBondContact O-CB 3.36Å; Y142-L146 PolarHBondContact O-N 3.41Å; E143-L146 PolarHBondContact O-N 3.21Å; L146-I149 PolarHBondContact O-N 3.48Å; L146-L150 HydrophobicContact CD2-CD1 4.44Å; L146-L150 HydrophobicContact CG-CD1 4.21Å; L146-L150 WeakPolarHBondContact O-CB 3.38Å; L146-L150 WeakPolarHBondContact O-CD1 3.46Å; L146-L150 WeakPolarHBondContact O-CG 3.29Å; L146-L150 PolarHBondContact O-N 2.8Å; L146-W185 HydrophobicContact CB-CZ3 4.48Å; L146-W185 HydrophobicContact CD1-CE3 3.87Å; L146-W185 HydrophobicContact CD1-CH2 3.4Å; L146-W185 HydrophobicContact CD1-CZ2 4.15Å; L146-W185 HydrophobicContact CD1-CZ3 3.24Å; L146-W185 HydrophobicContact CD2-CH2 4.31Å; L146-W185 HydrophobicContact CD2-CZ3 4.43Å; L146-W185 HydrophobicContact CG-CE3 4.37Å; L146-W185 HydrophobicContact CG-CH2 3.74Å; L146-W185 HydrophobicContact CG-CZ3 3.44Å; L146-W185 VanDerWaalsContact CG-CZ3 3.44Å; L146-T189 HydrophobicContact CD1-CG2 4.15Å; L146-E192 WeakPolarHBondContact CD2-OE2 3.38Å |
| 147 | A | 95.3 | Very high | 93.1 | Very high | 40 Ų | 40 | 24.6 Ų | 24.6 | 33% | 0.331 | 14% | 0.139 | S | C | . | . | H | α-helix | trans | -64 | -42.1 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | L106 E143 T145 L150 L151 | L106-A147 HydrophobicContact CD2-CB 4.44Å; E143-A147 WeakPolarHBondContact O-CB 3.38Å; E143-A147 PolarHBondContact O-N 3.1Å; T145-A147 PolarHBondContact O-N 3.35Å; A147-L150 PolarHBondContact O-N 3.07Å; A147-L151 WeakPolarHBondContact O-CB 3.48Å; A147-L151 PolarHBondContact O-N 3.18Å |
| 148 | I | 95.8 | Very high | 93.1 | Very high | 28 Ų | 28 | 24.7 Ų | 24.7 | 14% | 0.144 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -67.6 | -43.3 | 178.4 | -63.6 | 165.2 | 0 | 0 | 0 | 110.8 | V144 T145 L151 S152 L298 L301 | V144-I148 HydrophobicContact CG1-CD1 4.05Å; V144-I148 WeakPolarHBondContact O-CD1 3.3Å; V144-I148 VanDerWaalsContact O-CG1 3.3Å; V144-I148 WeakPolarHBondContact O-CG1 3.47Å; V144-I148 PolarHBondContact O-N 2.9Å; T145-I148 PolarHBondContact O-N 2.81Å; I148-L151 PolarHBondContact O-N 3.33Å; I148-S152 PolarHBondContact O-N 3.39Å; I148-S152 PolarHBondContact O-OG 3.31Å; I148-L298 HydrophobicContact CD1-CD2 4.15Å; I148-L301 HydrophobicContact CG2-CB 4.16Å; I148-L301 HydrophobicContact CG2-CD2 4.28Å |
| 149 | I | 96.4 | Very high | 93.3 | Very high | 0 Ų | 0 | 25.3 Ų | 25.3 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -61.1 | -47.8 | 176.7 | -67.8 | 163.3 | 0 | 0 | 0 | 109.9 | T145 L146 L151 S152 T153 L181 M184 W185 T297 | T145-I149 WeakPolarHBondContact O-CB 3.46Å; T145-I149 WeakPolarHBondContact O-CD1 3.39Å; T145-I149 WeakPolarHBondContact O-CG1 3.47Å; T145-I149 PolarHBondContact O-N 3.36Å; L146-I149 PolarHBondContact O-N 3.48Å; I149-L151 PolarHBondContact O-N 3.13Å; I149-S152 WeakPolarHBondContact CA-OG 3.4Å; I149-S152 PolarHBondContact O-N 2.9Å; I149-S152 VanDerWaalsContact O-N 3.16Å; I149-S152 PolarHBondContact O-OG 3.09Å; I149-T153 PolarHBondContact O-N 3.25Å; I149-T153 PolarHBondContact O-OG1 3.21Å; I149-L181 HydrophobicContact CG1-CD2 4.22Å; I149-L181 HydrophobicContact CG2-CB 4.12Å; I149-L181 HydrophobicContact CG2-CD2 4.22Å; I149-M184 HydrophobicContact CD1-CB 3.82Å; I149-W185 HydrophobicContact CB-CE3 4.3Å; I149-W185 HydrophobicContact CG2-CB 4.02Å; I149-W185 HydrophobicContact CG2-CE3 3.87Å; I149-T297 HydrophobicContact CD1-CG2 3.8Å; I149-T297 HydrophobicContact CG1-CG2 3.48Å; I149-T297 VanDerWaalsContact CG1-CG2 3.48Å |
| 150 | L | 95 | Very high | 93.5 | Very high | 5 Ų | 5 | 28.4 Ų | 28.4 | 3% | 0.026 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -57.8 | -48.7 | 177 | -79.6 | 162.9 | 0 | 0 | 0 | 112.1 | L102 L106 L146 A147 S152 T153 L154 W185 I241 | L102-L150 HydrophobicContact CD1-CD2 3.85Å; L102-L150 HydrophobicContact CD2-CB 3.97Å; L102-L150 HydrophobicContact CD2-CD1 3.62Å; L102-L150 HydrophobicContact CD2-CD2 3.59Å; L102-L150 HydrophobicContact CD2-CG 3.88Å; L102-L150 HydrophobicContact CG-CD2 4.26Å; L106-L150 HydrophobicContact CD1-CD1 3.8Å; L106-L150 HydrophobicContact CD2-CD1 3.67Å; L106-L150 HydrophobicContact CG-CD1 3.77Å; L146-L150 HydrophobicContact CD2-CD1 4.44Å; L146-L150 HydrophobicContact CG-CD1 4.21Å; L146-L150 WeakPolarHBondContact O-CB 3.38Å; L146-L150 WeakPolarHBondContact O-CD1 3.46Å; L146-L150 WeakPolarHBondContact O-CG 3.29Å; L146-L150 PolarHBondContact O-N 2.8Å; A147-L150 PolarHBondContact O-N 3.07Å; L150-S152 VanDerWaalsContact C-N 3.28Å; L150-S152 PolarHBondContact O-N 3.16Å; L150-T153 WeakPolarHBondContact CA-OG1 3.44Å; L150-T153 PolarHBondContact O-N 3.14Å; L150-T153 PolarHBondContact O-OG1 3.44Å; L150-L154 WeakPolarHBondContact O-CB 3.07Å; L150-L154 VanDerWaalsContact O-CG 3.26Å; L150-L154 WeakPolarHBondContact O-CG 3.13Å; L150-L154 PolarHBondContact O-N 2.9Å; L150-W185 HydrophobicContact CD1-CH2 3.67Å; L150-W185 HydrophobicContact CD1-CZ3 3.49Å; L150-W185 VanDerWaalsContact CD1-CZ3 3.49Å; L150-W185 HydrophobicContact CD2-CE3 4.36Å; L150-W185 HydrophobicContact CD2-CH2 3.84Å; L150-W185 HydrophobicContact CD2-CZ3 3.66Å; L150-W185 HydrophobicContact CG-CE3 4.17Å; L150-W185 HydrophobicContact CG-CH2 3.83Å; L150-W185 HydrophobicContact CG-CZ3 3.32Å; L150-I241 HydrophobicContact CD2-CD1 3.36Å; L150-I241 HydrophobicContact CD2-CG1 4.49Å |
| 151 | L | 95.3 | Very high | 93.7 | Very high | 75 Ų | 75 | 25 Ų | 25 | 39% | 0.393 | 14% | 0.143 | S | C | . | . | H | α-helix | trans | -55.3 | -47.1 | 176.9 | -176.9 | 65.3 | 0 | 0 | 0 | 111.1 | A147 I148 I149 T153 L154 L155 L301 | A147-L151 WeakPolarHBondContact O-CB 3.48Å; A147-L151 PolarHBondContact O-N 3.18Å; I148-L151 PolarHBondContact O-N 3.33Å; I149-L151 PolarHBondContact O-N 3.13Å; L151-T153 PolarHBondContact O-N 3.08Å; L151-L154 PolarHBondContact O-N 3.12Å; L151-L155 WeakPolarHBondContact O-CG 3.18Å; L151-L155 PolarHBondContact O-N 2.9Å; L151-L155 VanDerWaalsContact O-N 3.15Å; L151-L301 HydrophobicContact CB-CD1 4.38Å; L151-L301 HydrophobicContact CD2-CD1 3.86Å; L151-L301 HydrophobicContact CD2-CD2 4.48Å; L151-L301 HydrophobicContact CG-CD1 4.01Å |
| 152 | S | 95.2 | Very high | 93.8 | Very high | 0 Ų | 0 | 24.9 Ų | 24.9 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -63.5 | -37.1 | 179.8 | 64.3 | 0 | 0 | 0 | 0 | 113.4 | I148 I149 L150 L181 | I148-S152 PolarHBondContact O-N 3.39Å; I148-S152 PolarHBondContact O-OG 3.31Å; I149-S152 WeakPolarHBondContact CA-OG 3.4Å; I149-S152 PolarHBondContact O-N 2.9Å; I149-S152 VanDerWaalsContact O-N 3.16Å; I149-S152 PolarHBondContact O-OG 3.09Å; L150-S152 VanDerWaalsContact C-N 3.28Å; L150-S152 PolarHBondContact O-N 3.16Å; S152-L181 WeakPolarHBondContact OG-CD1 3.46Å; S152-L181 WeakPolarHBondContact OG-CD2 3.45Å |
| 153 | T | 93.8 | Very high | 93.9 | Very high | 1 Ų | 1 | 26.4 Ų | 26.4 | 1% | 0.006 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -69.9 | -38.1 | 173.9 | 57.6 | 0 | 0 | 0 | 0 | 112.4 | I149 L150 L151 L155 M156 L174 L181 I241 F242 | I149-T153 PolarHBondContact O-N 3.25Å; I149-T153 PolarHBondContact O-OG1 3.21Å; L150-T153 WeakPolarHBondContact CA-OG1 3.44Å; L150-T153 PolarHBondContact O-N 3.14Å; L150-T153 PolarHBondContact O-OG1 3.44Å; L151-T153 PolarHBondContact O-N 3.08Å; T153-L155 VanDerWaalsContact C-N 3.28Å; T153-L155 PolarHBondContact O-N 3.23Å; T153-M156 WeakPolarHBondContact O-CB 3.39Å; T153-M156 PolarHBondContact O-N 3.09Å; T153-M156 VanDerWaalsContact O-N 3.13Å; T153-L174 HydrophobicContact CG2-CD2 4.18Å; T153-L181 HydrophobicContact CG2-CB 4.42Å; T153-L181 HydrophobicContact CG2-CD1 4Å; T153-I241 HydrophobicContact CG2-CG2 4.32Å; T153-F242 HydrophobicContact CG2-CE1 3.7Å; T153-F242 HydrophobicContact CG2-CZ 3.71Å |
| 154 | L | 93.7 | Very high | 94 | Very high | 10 Ų | 10 | 25.4 Ų | 25.4 | 5% | 0.052 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -69.7 | -24.8 | -177.7 | -74.5 | 177.1 | 0 | 0 | 0 | 113 | L102 L150 L151 M156 S157 G158 S159 F160 L165 | L102-L154 HydrophobicContact CB-CD1 4.44Å; L102-L154 HydrophobicContact CD1-CD1 4.02Å; L102-L154 HydrophobicContact CD1-CD2 3.78Å; L102-L154 HydrophobicContact CD1-CG 4.14Å; L102-L154 HydrophobicContact CD2-CD1 4.16Å; L102-L154 HydrophobicContact CG-CD1 4.42Å; L150-L154 WeakPolarHBondContact O-CB 3.07Å; L150-L154 VanDerWaalsContact O-CG 3.26Å; L150-L154 WeakPolarHBondContact O-CG 3.13Å; L150-L154 PolarHBondContact O-N 2.9Å; L151-L154 PolarHBondContact O-N 3.12Å; L154-M156 PolarHBondContact O-N 2.97Å; L154-M156 VanDerWaalsContact O-N 3.16Å; L154-S157 WeakPolarHBondContact CA-OG 3.21Å; L154-S157 WeakPolarHBondContact CD2-OG 3.43Å; L154-S157 WeakPolarHBondContact O-CA 3.4Å; L154-S157 PolarHBondContact O-N 2.86Å; L154-S157 PolarHBondContact O-OG 3.43Å; L154-G158 PolarHBondContact O-N 2.95Å; L154-S159 WeakPolarHBondContact CD2-O 3.49Å; L154-F160 HydrophobicContact CD1-CD1 3.33Å; L154-F160 HydrophobicContact CD1-CE1 3.49Å; L154-F160 VanDerWaalsContact CD1-CE1 3.49Å; L154-F160 HydrophobicContact CD1-CG 4.31Å; L154-L165 HydrophobicContact CD2-CD1 4.47Å |
| 155 | L | 94.2 | Very high | 94 | Very high | 55 Ų | 55 | 22.7 Ų | 22.7 | 29% | 0.288 | 13% | 0.133 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -58.9 | -23.4 | 171.8 | -70.3 | 171.1 | 0 | 0 | 0 | 113 | L151 T153 L301 V305 P315 | L151-L155 WeakPolarHBondContact O-CG 3.18Å; L151-L155 PolarHBondContact O-N 2.9Å; L151-L155 VanDerWaalsContact O-N 3.15Å; T153-L155 VanDerWaalsContact C-N 3.28Å; T153-L155 PolarHBondContact O-N 3.23Å; L155-L301 HydrophobicContact CD1-CD1 4.3Å; L155-V305 HydrophobicContact CD1-CB 4.39Å; L155-V305 HydrophobicContact CD1-CG2 3.5Å; L155-P315 WeakPolarHBondContact O-CD 3.17Å; L155-P315 WeakPolarHBondContact O-CG 3.22Å |
| 156 | M | 92.5 | Very high | 94 | Very high | 57 Ų | 57 | 23.3 Ų | 23.3 | 28% | 0.281 | 14% | 0.136 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -82.4 | -20.3 | 172.4 | -62.2 | -172.8 | 60.4 | 0 | 0 | 113.2 | T153 L154 L174 P177 Y304 P315 | T153-M156 WeakPolarHBondContact O-CB 3.39Å; T153-M156 PolarHBondContact O-N 3.09Å; T153-M156 VanDerWaalsContact O-N 3.13Å; L154-M156 PolarHBondContact O-N 2.97Å; L154-M156 VanDerWaalsContact O-N 3.16Å; M156-L174 HydrophobicContact CB-CD1 4.14Å; M156-L174 HydrophobicContact CE-CD1 4.2Å; M156-L174 HydrophobicContact SD-CD1 4.34Å; M156-L174 HydrophobicContact SD-CG 4.41Å; M156-P177 HydrophobicContact CE-CB 3.8Å; M156-P177 HydrophobicContact CE-CG 3.51Å; M156-P177 HydrophobicContact SD-CB 4.3Å; M156-P177 HydrophobicContact SD-CG 4.17Å; M156-Y304 HydrophobicContact CG-CD1 4.2Å; M156-Y304 HydrophobicContact SD-CD1 4.08Å; M156-Y304 HydrophobicContact SD-CE1 3.8Å; M156-P315 WeakPolarHBondContact O-CB 3.48Å; M156-P315 WeakPolarHBondContact O-CG 3.3Å |
| 157 | S | 93.1 | Very high | 93.9 | Very high | 4 Ų | 4 | 27 Ų | 27 | 3% | 0.028 | 16% | 0.159 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -95 | -29 | -179.4 | 73 | 0 | 0 | 0 | 0 | 114.4 | L154 S159 | L154-S157 WeakPolarHBondContact CA-OG 3.21Å; L154-S157 WeakPolarHBondContact CD2-OG 3.43Å; L154-S157 WeakPolarHBondContact O-CA 3.4Å; L154-S157 PolarHBondContact O-N 2.86Å; L154-S157 PolarHBondContact O-OG 3.43Å; S157-S159 VanDerWaalsContact C-N 3.29Å; S157-S159 PolarHBondContact O-N 3.28Å; S157-S159 PolarHBondContact OG-O 3.21Å; S157-S159 VanDerWaalsContact OG-O 3.11Å |
| 158 | G | 92.2 | Very high | 93.8 | Very high | 30 Ų | 30 | 27.2 Ų | 27.2 | 31% | 0.309 | 16% | 0.157 | S | C | . | . | S | Bend | trans | 82.5 | -11.8 | -180 | 0 | 0 | 0 | 0 | 0 | 115.8 | L154 P315 | L154-G158 PolarHBondContact O-N 2.95Å; G158-P315 VanDerWaalsContact N-CG 3.29Å |
| 159 | S | 93.8 | Very high | 93.8 | Very high | 14 Ų | 14 | 26 Ų | 26 | 10% | 0.098 | 15% | 0.15 | C | C | . | . | S | Bend | trans | -144.6 | 158.5 | -176.7 | 56.8 | 0 | 0 | 0 | 0 | 112.5 | L154 S157 N161 T164 | L154-S159 WeakPolarHBondContact CD2-O 3.49Å; S157-S159 VanDerWaalsContact C-N 3.29Å; S157-S159 PolarHBondContact O-N 3.28Å; S157-S159 PolarHBondContact OG-O 3.21Å; S157-S159 VanDerWaalsContact OG-O 3.11Å; S159-N161 VanDerWaalsContact C-N 3.32Å; S159-T164 VanDerWaalsContact OG-CB 3.31Å; S159-T164 WeakPolarHBondContact OG-CB 3.44Å; S159-T164 WeakPolarHBondContact OG-CG2 2.99Å; S159-T164 PolarHBondContact OG-OG1 2.75Å |
| 160 | F | 93.5 | Very high | 93.5 | Very high | 72 Ų | 72 | 30.3 Ų | 30.3 | 32% | 0.316 | 17% | 0.17 | S | C | . | . | S | Bend | trans | -89.1 | 3.3 | 178.3 | -69.5 | -85.1 | 0 | 0 | 0 | 113.6 | N99 L100 G101 L102 L103 L154 | N99-F160 CarbonylContact O-C 3.41Å; L100-F160 HydrophobicContact CD2-CB 4.03Å; L100-F160 HydrophobicContact CD2-CD2 4.12Å; L100-F160 HydrophobicContact CD2-CG 4.33Å; G101-F160 PolarHBondContact N-O 3.4Å; L102-F160 PolarHBondContact N-O 2.8Å; L102-F160 VanDerWaalsContact N-O 3.08Å; L103-F160 HydrophobicContact CD1-CD1 3.86Å; L103-F160 HydrophobicContact CD1-CD2 4.27Å; L103-F160 HydrophobicContact CD1-CE1 4.1Å; L103-F160 HydrophobicContact CD1-CE2 4.48Å; L103-F160 HydrophobicContact CD1-CG 3.97Å; L103-F160 HydrophobicContact CD1-CZ 4.41Å; L103-F160 HydrophobicContact CD2-CE1 4.39Å; L103-F160 HydrophobicContact CG-CD1 3.8Å; L103-F160 HydrophobicContact CG-CE1 4.08Å; L103-F160 HydrophobicContact CG-CG 4.33Å; L154-F160 HydrophobicContact CD1-CD1 3.33Å; L154-F160 HydrophobicContact CD1-CE1 3.49Å; L154-F160 VanDerWaalsContact CD1-CE1 3.49Å; L154-F160 HydrophobicContact CD1-CG 4.31Å |
| 161 | N | 94.4 | Very high | 93.3 | Very high | 21 Ų | 21 | 38.4 Ų | 38.4 | 11% | 0.112 | 21% | 0.208 | C | C | . | . | trans | -76.3 | 136.8 | 178.5 | -166.4 | -12.9 | 0 | 0 | 0 | 109.2 | N97 L98 N99 S159 S163 T164 | N97-N161 PolarHBondContact OD1-ND2 3.26Å; N97-N161 VanDerWaalsContact OD1-ND2 3.08Å; N97-N161 PolarHBondContact OD1-OD1 3.18Å; L98-N161 PolarHBondContact O-OD1 3.48Å; N99-N161 PolarHBondContact O-N 2.86Å; S159-N161 VanDerWaalsContact C-N 3.32Å; N161-S163 VanDerWaalsContact C-N 3.34Å; N161-S163 VanDerWaalsContact CG-OG 3.32Å; N161-S163 PolarHBondContact ND2-OG 3.1Å; N161-S163 VanDerWaalsContact ND2-OG 3.16Å; N161-S163 PolarHBondContact OD1-N 3.48Å; N161-S163 VanDerWaalsContact OD1-N 3.16Å; N161-S163 PolarHBondContact OD1-OG 3.32Å; N161-T164 HydrophobicContact CB-CG2 4.1Å; N161-T164 PolarHBondContact O-OG1 3.42Å | ||
| 162 | L | 92.8 | Very high | 93.2 | Very high | 1 Ų | 1 | 40.4 Ų | 40.4 | 1% | 0.005 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -75.8 | -25 | 178 | -68.1 | 170.2 | 0 | 0 | 0 | 112.1 | P88 L89 P90 L102 I105 T164 L165 | P88-L162 HydrophobicContact CB-CD1 4.14Å; P88-L162 HydrophobicContact CG-CD1 4.28Å; P88-L162 WeakPolarHBondContact O-CD1 3.43Å; L89-L162 HydrophobicContact CD2-CD1 4.39Å; P90-L162 HydrophobicContact CG-CB 3.9Å; L102-L162 HydrophobicContact CB-CD2 4.2Å; L102-L162 HydrophobicContact CD1-CD2 3.8Å; L102-L162 HydrophobicContact CG-CD2 4.1Å; I105-L162 HydrophobicContact CD1-CD1 3.65Å; L162-T164 VanDerWaalsContact C-N 3.33Å; L162-L165 HydrophobicContact CD2-CD1 3.9Å; L162-L165 WeakPolarHBondContact O-CB 3.4Å; L162-L165 PolarHBondContact O-N 3.35Å |
| 163 | S | 92.6 | Very high | 93.2 | Very high | 33 Ų | 33 | 46.2 Ų | 46.2 | 23% | 0.231 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -70.3 | -30.5 | 177.7 | 64.6 | 0 | 0 | 0 | 0 | 112.5 | N161 L165 I166 | N161-S163 VanDerWaalsContact C-N 3.34Å; N161-S163 VanDerWaalsContact CG-OG 3.32Å; N161-S163 PolarHBondContact ND2-OG 3.1Å; N161-S163 VanDerWaalsContact ND2-OG 3.16Å; N161-S163 PolarHBondContact OD1-N 3.48Å; N161-S163 VanDerWaalsContact OD1-N 3.16Å; N161-S163 PolarHBondContact OD1-OG 3.32Å; S163-L165 VanDerWaalsContact C-N 3.28Å; S163-L165 PolarHBondContact O-N 2.78Å; S163-I166 WeakPolarHBondContact O-CB 3.48Å; S163-I166 PolarHBondContact O-N 3.3Å |
| 164 | T | 93.1 | Very high | 93.2 | Very high | 23 Ų | 23 | 46.4 Ų | 46.4 | 14% | 0.141 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -71.5 | -24.1 | 176.7 | 54.5 | 0 | 0 | 0 | 0 | 111.8 | S159 N161 L162 I166 T167 T168 | S159-T164 VanDerWaalsContact OG-CB 3.31Å; S159-T164 WeakPolarHBondContact OG-CB 3.44Å; S159-T164 WeakPolarHBondContact OG-CG2 2.99Å; S159-T164 PolarHBondContact OG-OG1 2.75Å; N161-T164 HydrophobicContact CB-CG2 4.1Å; N161-T164 PolarHBondContact O-OG1 3.42Å; L162-T164 VanDerWaalsContact C-N 3.33Å; T164-I166 PolarHBondContact O-N 2.88Å; T164-T167 PolarHBondContact O-N 2.96Å; T164-T167 PolarHBondContact O-OG1 2.66Å; T164-T168 WeakPolarHBondContact O-CG2 3.07Å; T164-T168 PolarHBondContact O-N 3.16Å |
| 165 | L | 94.2 | Very high | 93.3 | Very high | 1 Ų | 1 | 48.9 Ų | 48.9 | 1% | 0.005 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -61.3 | -28.8 | 171 | -79.1 | 167.1 | 0 | 0 | 0 | 112.4 | L102 L154 L162 S163 T168 Q169 I241 | L102-L165 HydrophobicContact CD1-CD1 4.27Å; L154-L165 HydrophobicContact CD2-CD1 4.47Å; L162-L165 HydrophobicContact CD2-CD1 3.9Å; L162-L165 WeakPolarHBondContact O-CB 3.4Å; L162-L165 PolarHBondContact O-N 3.35Å; S163-L165 VanDerWaalsContact C-N 3.28Å; S163-L165 PolarHBondContact O-N 2.78Å; L165-T168 VanDerWaalsContact CA-OG1 3.32Å; L165-T168 WeakPolarHBondContact CA-OG1 3.18Å; L165-T168 PolarHBondContact O-OG1 3.17Å; L165-Q169 WeakPolarHBondContact O-CG 3.47Å; L165-Q169 PolarHBondContact O-N 3.33Å; L165-Q169 PolarHBondContact O-NE2 2.92Å; L165-I241 HydrophobicContact CD1-CG1 4.1Å |
| 166 | I | 93.6 | Very high | 93.3 | Very high | 14 Ų | 14 | 51.4 Ų | 51.4 | 7% | 0.072 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -65.8 | -48.8 | 175.6 | -58.9 | 176.8 | 0 | 0 | 0 | 110.2 | P90 S163 T164 T168 Q169 Y255 | P90-I166 HydrophobicContact CB-CD1 3.86Å; P90-I166 HydrophobicContact CG-CD1 4.17Å; S163-I166 WeakPolarHBondContact O-CB 3.48Å; S163-I166 PolarHBondContact O-N 3.3Å; T164-I166 PolarHBondContact O-N 2.88Å; I166-T168 VanDerWaalsContact C-N 3.31Å; I166-T168 PolarHBondContact O-N 3.11Å; I166-Q169 PolarHBondContact O-N 3.42Å; I166-Y255 HydrophobicContact CD1-CE1 4.4Å; I166-Y255 HydrophobicContact CD1-CE2 3.92Å; I166-Y255 VanDerWaalsContact CD1-OH 3.26Å; I166-Y255 WeakPolarHBondContact CD1-OH 3.38Å; I166-Y255 HydrophobicContact CG1-CE2 4.17Å; I166-Y255 WeakPolarHBondContact CG1-OH 3.39Å; I166-Y255 HydrophobicContact CG2-CE2 3.72Å |
| 167 | T | 92.1 | Very high | 93.3 | Very high | 82 Ų | 82 | 51.6 Ų | 51.6 | 50% | 0.503 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -66.5 | -35.6 | -179.4 | 58.6 | 0 | 0 | 0 | 0 | 111.4 | T164 Q169 E170 | T164-T167 PolarHBondContact O-N 2.96Å; T164-T167 PolarHBondContact O-OG1 2.66Å; T167-Q169 PolarHBondContact O-N 2.77Å; T167-E170 WeakPolarHBondContact O-CG 3.42Å; T167-E170 PolarHBondContact O-N 3.27Å |
| 168 | T | 93.5 | Very high | 93.4 | Very high | 46 Ų | 46 | 51.4 Ų | 51.4 | 28% | 0.282 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -65 | -22.7 | 177.9 | 64.5 | 0 | 0 | 0 | 0 | 113.7 | T164 L165 I166 | T164-T168 WeakPolarHBondContact O-CG2 3.07Å; T164-T168 PolarHBondContact O-N 3.16Å; L165-T168 VanDerWaalsContact CA-OG1 3.32Å; L165-T168 WeakPolarHBondContact CA-OG1 3.18Å; L165-T168 PolarHBondContact O-OG1 3.17Å; I166-T168 VanDerWaalsContact C-N 3.31Å; I166-T168 PolarHBondContact O-N 3.11Å |
| 169 | Q | 93.9 | Very high | 93.6 | Very high | 2 Ų | 2 | 57.8 Ų | 57.8 | 1% | 0.009 | 29% | 0.286 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -106 | 13.8 | -174.9 | -66.3 | 176.6 | 52.4 | 0 | 0 | 113.4 | L165 I166 T167 H171 L172 L174 T240 I241 | L165-Q169 WeakPolarHBondContact O-CG 3.47Å; L165-Q169 PolarHBondContact O-N 3.33Å; L165-Q169 PolarHBondContact O-NE2 2.92Å; I166-Q169 PolarHBondContact O-N 3.42Å; T167-Q169 PolarHBondContact O-N 2.77Å; Q169-H171 VanDerWaalsContact C-N 3.34Å; Q169-H171 PolarHBondContact O-N 3.16Å; Q169-L172 WeakPolarHBondContact CA-O 3.39Å; Q169-L174 HydrophobicContact CG-CB 4.16Å; Q169-L174 HydrophobicContact CG-CD1 4.36Å; Q169-T240 PolarHBondContact NE2-O 3.21Å; Q169-I241 PolarHBondContact NE2-O 3.42Å |
| 170 | E | 91.1 | Very high | 93.7 | Very high | 90 Ų | 90 | 58.5 Ų | 58.5 | 42% | 0.421 | 29% | 0.291 | S | S | . | . | S | Bend | trans | -61.5 | -40.7 | 179.8 | -77.5 | -178.8 | -173.9 | 0 | 0 | 112.8 | T167 | T167-E170 WeakPolarHBondContact O-CG 3.42Å; T167-E170 PolarHBondContact O-N 3.27Å |
| 171 | H | 90.4 | Very high | 93.8 | Very high | 176 Ų | 176 | 55 Ų | 55 | 82% | 0.815 | 28% | 0.276 | S | S | * | . | S | Bend | trans | -90 | -44.2 | -177.6 | -62.1 | -44.1 | 0 | 0 | 0 | 113.2 | Q169 | Q169-H171 VanDerWaalsContact C-N 3.34Å; Q169-H171 PolarHBondContact O-N 3.16Å |
| 172 | L | 93.6 | Very high | 93.9 | Very high | 116 Ų | 116 | 54.6 Ų | 54.6 | 61% | 0.607 | 28% | 0.275 | S | S | * | . | S | Bend | trans | -141.1 | 138.6 | -174.8 | -69.8 | 170.3 | 0 | 0 | 0 | 109.1 | Q169 L176 | Q169-L172 WeakPolarHBondContact CA-O 3.39Å; L172-L176 HydrophobicContact CD2-CD1 4.25Å |
| 173 | W | 95 | Very high | 94 | Very high | 122 Ų | 122 | 60.3 Ų | 60.3 | 46% | 0.462 | 30% | 0.303 | S | S | . | . | trans | -65.8 | 139 | 172.3 | -63.3 | -17.9 | 0 | 0 | 0 | 110.6 | L175 L176 P177 L243 G244 | W173-L175 PolarHBondContact O-N 2.89Å; W173-L175 VanDerWaalsContact O-N 3.12Å; W173-L176 PolarHBondContact O-N 2.95Å; W173-L176 VanDerWaalsContact O-N 3.13Å; W173-P177 VanDerWaalsContact O-CD 3.23Å; W173-P177 WeakPolarHBondContact O-CD 3.41Å; W173-L243 HydrophobicContact CD2-CD2 4.3Å; W173-L243 HydrophobicContact CE3-CD2 3.86Å; W173-L243 HydrophobicContact CZ3-CD2 4.31Å; W173-G244 PolarHBondContact NE1-O 3.42Å | ||
| 174 | L | 94.9 | Very high | 94.2 | Very high | 6 Ų | 6 | 59.1 Ų | 59.1 | 3% | 0.031 | 29% | 0.294 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -62.7 | -22.5 | 179.1 | -143.1 | 89.2 | 0 | 0 | 0 | 111.9 | T153 M156 Q169 L176 P177 S178 I241 F242 | T153-L174 HydrophobicContact CG2-CD2 4.18Å; M156-L174 HydrophobicContact CB-CD1 4.14Å; M156-L174 HydrophobicContact CE-CD1 4.2Å; M156-L174 HydrophobicContact SD-CD1 4.34Å; M156-L174 HydrophobicContact SD-CG 4.41Å; Q169-L174 HydrophobicContact CG-CB 4.16Å; Q169-L174 HydrophobicContact CG-CD1 4.36Å; L174-L176 PolarHBondContact O-N 3.15Å; L174-P177 VanDerWaalsContact O-CD 3.23Å; L174-P177 WeakPolarHBondContact O-CD 3.42Å; L174-P177 WeakPolarHBondContact O-CG 3.09Å; L174-S178 WeakPolarHBondContact O-CB 3.18Å; L174-S178 PolarHBondContact O-N 3.44Å; L174-S178 VanDerWaalsContact O-N 3.08Å; L174-S178 PolarHBondContact O-OG 3.45Å; L174-I241 VanDerWaalsContact CB-O 3.25Å; L174-I241 WeakPolarHBondContact CB-O 3.32Å; L174-I241 HydrophobicContact CD2-CG2 4.45Å; L174-F242 PolarHBondContact N-O 2.72Å |
| 175 | L | 94.7 | Very high | 94.3 | Very high | 62 Ų | 62 | 58.1 Ų | 58.1 | 33% | 0.325 | 29% | 0.288 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.6 | -36 | 174.6 | -171.1 | 139.9 | 0 | 0 | 0 | 113.1 | W173 S178 W179 A182 F242 L243 | W173-L175 PolarHBondContact O-N 2.89Å; W173-L175 VanDerWaalsContact O-N 3.12Å; L175-S178 CarbonylContact O-C 3.31Å; L175-W179 WeakPolarHBondContact O-CA 3.43Å; L175-W179 VanDerWaalsContact O-CB 3.28Å; L175-W179 WeakPolarHBondContact O-CB 3.4Å; L175-W179 PolarHBondContact O-N 3.37Å; L175-A182 HydrophobicContact CD1-CB 4.38Å; L175-A182 HydrophobicContact CG-CB 4.26Å; L175-F242 HydrophobicContact CB-CB 4.14Å; L175-F242 WeakPolarHBondContact CB-O 3.24Å; L175-F242 PolarHBondContact N-O 2.81Å; L175-F242 VanDerWaalsContact N-O 3.1Å; L175-L243 HydrophobicContact CB-CD2 4.25Å; L175-L243 HydrophobicContact CD1-CD2 3.93Å; L175-L243 HydrophobicContact CD1-CG 4.36Å |
| 176 | L | 93.9 | Very high | 94.4 | Very high | 107 Ų | 107 | 60 Ų | 60 | 56% | 0.56 | 30% | 0.295 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.1 | -54.6 | -176.6 | -67.9 | 172 | 0 | 0 | 0 | 112.9 | L172 W173 L174 S178 | L172-L176 HydrophobicContact CD2-CD1 4.25Å; W173-L176 PolarHBondContact O-N 2.95Å; W173-L176 VanDerWaalsContact O-N 3.13Å; L174-L176 PolarHBondContact O-N 3.15Å; L176-S178 VanDerWaalsContact C-N 3.27Å; L176-S178 PolarHBondContact O-N 3.12Å |
| 177 | P | 93.6 | Very high | 94.4 | Very high | 62 Ų | 62 | 61.5 Ų | 61.5 | 40% | 0.403 | 30% | 0.304 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -72.1 | -21 | 176.8 | 28.8 | -36.1 | 0 | 0 | 0 | 113.2 | M156 W173 L174 Y304 | M156-P177 HydrophobicContact CE-CB 3.8Å; M156-P177 HydrophobicContact CE-CG 3.51Å; M156-P177 HydrophobicContact SD-CB 4.3Å; M156-P177 HydrophobicContact SD-CG 4.17Å; W173-P177 VanDerWaalsContact O-CD 3.23Å; W173-P177 WeakPolarHBondContact O-CD 3.41Å; L174-P177 VanDerWaalsContact O-CD 3.23Å; L174-P177 WeakPolarHBondContact O-CD 3.42Å; L174-P177 WeakPolarHBondContact O-CG 3.09Å; P177-Y304 PolarHBondContact O-OH 3.36Å |
| 178 | S | 95 | Very high | 94.4 | Very high | 0 Ų | 0 | 57.6 Ų | 57.6 | 0% | 0 | 28% | 0.28 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -119.8 | 29.3 | -175.4 | 73.5 | 0 | 0 | 0 | 0 | 115.3 | L174 L175 L176 P180 L181 A182 F242 Y304 | L174-S178 WeakPolarHBondContact O-CB 3.18Å; L174-S178 PolarHBondContact O-N 3.44Å; L174-S178 VanDerWaalsContact O-N 3.08Å; L174-S178 PolarHBondContact O-OG 3.45Å; L175-S178 CarbonylContact O-C 3.31Å; L176-S178 VanDerWaalsContact C-N 3.27Å; L176-S178 PolarHBondContact O-N 3.12Å; S178-P180 VanDerWaalsContact C-N 3.34Å; S178-L181 CarbonylContact O-C 3.58Å; S178-L181 WeakPolarHBondContact O-CA 3.49Å; S178-L181 WeakPolarHBondContact O-CB 3.26Å; S178-L181 PolarHBondContact O-N 2.83Å; S178-A182 PolarHBondContact O-N 3.24Å; S178-F242 WeakPolarHBondContact OG-CE1 3.42Å; S178-Y304 VanDerWaalsContact CA-OH 3.23Å; S178-Y304 WeakPolarHBondContact CA-OH 3.11Å |
| 179 | W | 95.5 | Very high | 94.5 | Very high | 163 Ų | 163 | 55.4 Ų | 55.4 | 62% | 0.617 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -54.3 | -36.8 | -177 | 76 | -94.5 | 0 | 0 | 0 | 115 | L175 A182 M183 | L175-W179 WeakPolarHBondContact O-CA 3.43Å; L175-W179 VanDerWaalsContact O-CB 3.28Å; L175-W179 WeakPolarHBondContact O-CB 3.4Å; L175-W179 PolarHBondContact O-N 3.37Å; W179-A182 PolarHBondContact O-N 3.13Å; W179-M183 PolarHBondContact O-N 3.14Å |
| 180 | P | 96.2 | Very high | 94.4 | Very high | 29 Ų | 29 | 55.6 Ų | 55.6 | 19% | 0.188 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -68.7 | -38.7 | 177.5 | -16.2 | 31.7 | 0 | 0 | 0 | 111.3 | S178 M183 M184 L300 | S178-P180 VanDerWaalsContact C-N 3.34Å; P180-M183 PolarHBondContact O-N 3.34Å; P180-M184 WeakPolarHBondContact O-CG 3.47Å; P180-M184 PolarHBondContact O-N 3.34Å; P180-M184 VanDerWaalsContact O-N 3.1Å; P180-L300 HydrophobicContact CB-CD1 3.97Å |
| 181 | L | 96 | Very high | 94.4 | Very high | 0 Ų | 0 | 51.3 Ų | 51.3 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -65.2 | -43.7 | 174.4 | -68.2 | 177 | 0 | 0 | 0 | 110.7 | I149 S152 T153 S178 M183 M184 W185 L300 Y304 | I149-L181 HydrophobicContact CG1-CD2 4.22Å; I149-L181 HydrophobicContact CG2-CB 4.12Å; I149-L181 HydrophobicContact CG2-CD2 4.22Å; S152-L181 WeakPolarHBondContact OG-CD1 3.46Å; S152-L181 WeakPolarHBondContact OG-CD2 3.45Å; T153-L181 HydrophobicContact CG2-CB 4.42Å; T153-L181 HydrophobicContact CG2-CD1 4Å; S178-L181 CarbonylContact O-C 3.58Å; S178-L181 WeakPolarHBondContact O-CA 3.49Å; S178-L181 WeakPolarHBondContact O-CB 3.26Å; S178-L181 PolarHBondContact O-N 2.83Å; L181-M183 VanDerWaalsContact C-N 3.33Å; L181-M183 PolarHBondContact O-N 3.07Å; L181-M184 HydrophobicContact CD2-CE 3.88Å; L181-M184 PolarHBondContact O-N 3.37Å; L181-W185 WeakPolarHBondContact O-CB 3.43Å; L181-W185 PolarHBondContact O-N 2.92Å; L181-L300 HydrophobicContact CD2-CB 3.91Å; L181-L300 HydrophobicContact CD2-CD1 3.77Å; L181-L300 HydrophobicContact CD2-CG 4.46Å; L181-L300 HydrophobicContact CG-CD1 4.21Å; L181-Y304 HydrophobicContact CD1-CD2 3.55Å; L181-Y304 HydrophobicContact CD1-CE1 4.5Å; L181-Y304 HydrophobicContact CD1-CE2 3.15Å; L181-Y304 HydrophobicContact CD1-CG 4.42Å; L181-Y304 HydrophobicContact CG-CD2 4.45Å; L181-Y304 HydrophobicContact CG-CE2 3.8Å |
| 182 | A | 96 | Very high | 94.4 | Very high | 11 Ų | 11 | 44.1 Ų | 44.1 | 9% | 0.091 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -60.2 | -41.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | L175 S178 W179 W185 F186 F242 | L175-A182 HydrophobicContact CD1-CB 4.38Å; L175-A182 HydrophobicContact CG-CB 4.26Å; S178-A182 PolarHBondContact O-N 3.24Å; W179-A182 PolarHBondContact O-N 3.13Å; A182-W185 WeakPolarHBondContact O-CB 3.36Å; A182-F186 WeakPolarHBondContact O-CB 3.33Å; A182-F186 PolarHBondContact O-N 2.84Å; A182-F242 HydrophobicContact CB-CD1 3.54Å; A182-F242 HydrophobicContact CB-CD2 4.31Å; A182-F242 HydrophobicContact CB-CE1 3.59Å; A182-F242 HydrophobicContact CB-CE2 4.37Å; A182-F242 HydrophobicContact CB-CG 3.9Å; A182-F242 HydrophobicContact CB-CZ 4.02Å |
| 183 | M | 95.2 | Very high | 94.3 | Very high | 121 Ų | 121 | 39 Ų | 39 | 60% | 0.596 | 19% | 0.187 | S | C | * | . | H | α-helix | trans | -67.1 | -46.7 | 177 | -176.8 | 176.8 | -85.1 | 0 | 0 | 111.7 | W179 P180 L181 W185 F186 I187 | W179-M183 PolarHBondContact O-N 3.14Å; P180-M183 PolarHBondContact O-N 3.34Å; L181-M183 VanDerWaalsContact C-N 3.33Å; L181-M183 PolarHBondContact O-N 3.07Å; M183-W185 VanDerWaalsContact C-N 3.32Å; M183-W185 PolarHBondContact O-N 2.94Å; M183-F186 PolarHBondContact O-N 3.46Å; M183-I187 HydrophobicContact CG-CD1 4.39Å; M183-I187 WeakPolarHBondContact O-CG1 3.44Å; M183-I187 PolarHBondContact O-N 3.44Å |
| 184 | M | 96.2 | Very high | 93.8 | Very high | 8 Ų | 8 | 34 Ų | 34 | 4% | 0.039 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -63.9 | -40.1 | 176.9 | -69.3 | -172.4 | -65.1 | 0 | 0 | 111.9 | I149 P180 L181 F186 I187 S188 F293 L296 T297 L300 | I149-M184 HydrophobicContact CD1-CB 3.82Å; P180-M184 WeakPolarHBondContact O-CG 3.47Å; P180-M184 PolarHBondContact O-N 3.34Å; P180-M184 VanDerWaalsContact O-N 3.1Å; L181-M184 HydrophobicContact CD2-CE 3.88Å; L181-M184 PolarHBondContact O-N 3.37Å; M184-F186 VanDerWaalsContact C-N 3.35Å; M184-F186 PolarHBondContact O-N 3.01Å; M184-I187 PolarHBondContact O-N 3.06Å; M184-S188 PolarHBondContact O-N 3.43Å; M184-S188 PolarHBondContact O-OG 3.14Å; M184-F293 HydrophobicContact CG-CD1 4.28Å; M184-F293 HydrophobicContact CG-CE1 4.29Å; M184-F293 HydrophobicContact SD-CD1 4.3Å; M184-L296 HydrophobicContact CE-CD2 4.29Å; M184-L296 HydrophobicContact CE-CG 4.22Å; M184-L296 HydrophobicContact SD-CB 4.19Å; M184-L296 HydrophobicContact SD-CD2 3.64Å; M184-L296 HydrophobicContact SD-CG 3.96Å; M184-T297 HydrophobicContact CE-CG2 3.55Å; M184-T297 HydrophobicContact SD-CG2 3.72Å; M184-L300 HydrophobicContact CE-CD1 3.36Å |
| 185 | W | 96 | Very high | 93.2 | Very high | 3 Ų | 3 | 34.4 Ų | 34.4 | 1% | 0.011 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -57.7 | -46.1 | 175.2 | 172.6 | -94.1 | 0 | 0 | 0 | 112.3 | L146 I149 L150 L181 A182 M183 I187 S188 T189 L237 I241 F242 | L146-W185 HydrophobicContact CB-CZ3 4.48Å; L146-W185 HydrophobicContact CD1-CE3 3.87Å; L146-W185 HydrophobicContact CD1-CH2 3.4Å; L146-W185 HydrophobicContact CD1-CZ2 4.15Å; L146-W185 HydrophobicContact CD1-CZ3 3.24Å; L146-W185 HydrophobicContact CD2-CH2 4.31Å; L146-W185 HydrophobicContact CD2-CZ3 4.43Å; L146-W185 HydrophobicContact CG-CE3 4.37Å; L146-W185 HydrophobicContact CG-CH2 3.74Å; L146-W185 HydrophobicContact CG-CZ3 3.44Å; L146-W185 VanDerWaalsContact CG-CZ3 3.44Å; I149-W185 HydrophobicContact CB-CE3 4.3Å; I149-W185 HydrophobicContact CG2-CB 4.02Å; I149-W185 HydrophobicContact CG2-CE3 3.87Å; L150-W185 HydrophobicContact CD1-CH2 3.67Å; L150-W185 HydrophobicContact CD1-CZ3 3.49Å; L150-W185 VanDerWaalsContact CD1-CZ3 3.49Å; L150-W185 HydrophobicContact CD2-CE3 4.36Å; L150-W185 HydrophobicContact CD2-CH2 3.84Å; L150-W185 HydrophobicContact CD2-CZ3 3.66Å; L150-W185 HydrophobicContact CG-CE3 4.17Å; L150-W185 HydrophobicContact CG-CH2 3.83Å; L150-W185 HydrophobicContact CG-CZ3 3.32Å; L181-W185 WeakPolarHBondContact O-CB 3.43Å; L181-W185 PolarHBondContact O-N 2.92Å; A182-W185 WeakPolarHBondContact O-CB 3.36Å; M183-W185 VanDerWaalsContact C-N 3.32Å; M183-W185 PolarHBondContact O-N 2.94Å; W185-I187 VanDerWaalsContact C-N 3.3Å; W185-I187 PolarHBondContact O-N 3.21Å; W185-S188 WeakPolarHBondContact CA-OG 3.07Å; W185-S188 PolarHBondContact O-N 2.72Å; W185-S188 PolarHBondContact O-OG 3.2Å; W185-T189 HydrophobicContact CD2-CG2 4.21Å; W185-T189 VanDerWaalsContact CE2-CG2 3.5Å; W185-T189 HydrophobicContact CH2-CG2 4.21Å; W185-T189 HydrophobicContact CZ2-CG2 3.44Å; W185-T189 VanDerWaalsContact CZ2-CG2 3.44Å; W185-T189 WeakPolarHBondContact O-CG2 3.1Å; W185-T189 PolarHBondContact O-N 2.86Å; W185-T189 PolarHBondContact O-OG1 3.44Å; W185-L237 HydrophobicContact CH2-CD2 3.57Å; W185-L237 HydrophobicContact CZ2-CD2 3.09Å; W185-I241 HydrophobicContact CH2-CD1 4.41Å; W185-I241 HydrophobicContact CZ2-CD1 4.18Å; W185-F242 HydrophobicContact CB-CE2 3.78Å; W185-F242 HydrophobicContact CB-CZ 3.99Å; W185-F242 AromaticContact CD1-CD2 3.93Å; W185-F242 AromaticContact CD1-CE2 3.37Å; W185-F242 HydrophobicContact CD2-CE2 4.01Å; W185-F242 HydrophobicContact CG-CD2 4.36Å; W185-F242 AromaticContact CG-CE2 3.4Å; W185-F242 HydrophobicContact CG-CE2 3.4Å; W185-F242 HydrophobicContact CG-CZ 4.05Å; W185-F242 AromaticContact NE1-CE2 3.93Å |
| 186 | F | 95.1 | Very high | 92.6 | Very high | 39 Ų | 39 | 32 Ų | 32 | 17% | 0.171 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -65.9 | -36.5 | -179.7 | -173.3 | -98.9 | 0 | 0 | 0 | 111.5 | A182 M183 M184 T189 L190 L266 L269 F270 I273 | A182-F186 WeakPolarHBondContact O-CB 3.33Å; A182-F186 PolarHBondContact O-N 2.84Å; M183-F186 PolarHBondContact O-N 3.46Å; M184-F186 VanDerWaalsContact C-N 3.35Å; M184-F186 PolarHBondContact O-N 3.01Å; F186-T189 WeakPolarHBondContact CA-OG1 3.24Å; F186-T189 PolarHBondContact O-OG1 3.43Å; F186-L190 HydrophobicContact CD1-CD1 3.96Å; F186-L190 HydrophobicContact CE1-CD1 3.78Å; F186-L190 WeakPolarHBondContact O-CG 3.46Å; F186-L190 PolarHBondContact O-N 3.47Å; F186-L190 VanDerWaalsContact O-N 3.12Å; F186-L266 HydrophobicContact CE2-CD2 4.26Å; F186-L269 HydrophobicContact CZ-CB 4.12Å; F186-F270 AromaticContact CD2-CE1 3.94Å; F186-F270 HydrophobicContact CD2-CE1 3.94Å; F186-F270 HydrophobicContact CE1-CD1 4.37Å; F186-F270 HydrophobicContact CE1-CE1 4.26Å; F186-F270 AromaticContact CE2-CD1 3.65Å; F186-F270 HydrophobicContact CE2-CD1 3.65Å; F186-F270 AromaticContact CE2-CE1 3.34Å; F186-F270 HydrophobicContact CE2-CE1 3.34Å; F186-F270 AromaticContact CZ-CD1 3.48Å; F186-F270 HydrophobicContact CZ-CD1 3.48Å; F186-F270 VanDerWaalsContact CZ-CD1 3.48Å; F186-F270 AromaticContact CZ-CE1 3.53Å; F186-F270 HydrophobicContact CZ-CE1 3.53Å; F186-I273 HydrophobicContact CE1-CD1 3.43Å; F186-I273 VanDerWaalsContact CE1-CD1 3.43Å; F186-I273 HydrophobicContact CZ-CD1 4.02Å |
| 187 | I | 93.9 | Very high | 92.2 | Very high | 47 Ų | 47 | 27.2 Ų | 27.2 | 24% | 0.241 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -70.3 | -40 | 174.1 | -61.1 | 169.5 | 0 | 0 | 0 | 111.2 | M183 M184 W185 L190 A191 F198 L288 F293 | M183-I187 HydrophobicContact CG-CD1 4.39Å; M183-I187 WeakPolarHBondContact O-CG1 3.44Å; M183-I187 PolarHBondContact O-N 3.44Å; M184-I187 PolarHBondContact O-N 3.06Å; W185-I187 VanDerWaalsContact C-N 3.3Å; W185-I187 PolarHBondContact O-N 3.21Å; I187-L190 WeakPolarHBondContact O-CB 3.32Å; I187-L190 PolarHBondContact O-N 3.35Å; I187-A191 PolarHBondContact O-N 3.2Å; I187-F198 HydrophobicContact CG2-CE2 3.71Å; I187-F198 HydrophobicContact CG2-CZ 3.69Å; I187-L288 HydrophobicContact CG2-CD2 4.47Å; I187-F293 HydrophobicContact CB-CE2 3.95Å; I187-F293 HydrophobicContact CB-CZ 3.96Å; I187-F293 HydrophobicContact CD1-CZ 3.81Å; I187-F293 HydrophobicContact CG1-CZ 4.5Å; I187-F293 HydrophobicContact CG2-CE2 3.66Å; I187-F293 HydrophobicContact CG2-CZ 3.72Å |
| 188 | S | 93.7 | Very high | 91.9 | Very high | 0 Ų | 0 | 24.5 Ų | 24.5 | 0% | 0 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -66.1 | -38.4 | 177.5 | 60.4 | 0 | 0 | 0 | 0 | 112.2 | M184 W185 A191 E192 | M184-S188 PolarHBondContact O-N 3.43Å; M184-S188 PolarHBondContact O-OG 3.14Å; W185-S188 WeakPolarHBondContact CA-OG 3.07Å; W185-S188 PolarHBondContact O-N 2.72Å; W185-S188 PolarHBondContact O-OG 3.2Å; S188-A191 PolarHBondContact O-N 2.89Å; S188-E192 WeakPolarHBondContact O-CB 3.5Å; S188-E192 PolarHBondContact O-N 2.75Å |
| 189 | T | 94.1 | Very high | 91.3 | Very high | 0 Ų | 0 | 25 Ų | 25 | 0% | 0 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -70 | -35.3 | 176.5 | 49.9 | 0 | 0 | 0 | 0 | 113.2 | L146 W185 F186 A191 T193 M234 T238 | L146-T189 HydrophobicContact CD1-CG2 4.15Å; W185-T189 HydrophobicContact CD2-CG2 4.21Å; W185-T189 VanDerWaalsContact CE2-CG2 3.5Å; W185-T189 HydrophobicContact CH2-CG2 4.21Å; W185-T189 HydrophobicContact CZ2-CG2 3.44Å; W185-T189 VanDerWaalsContact CZ2-CG2 3.44Å; W185-T189 WeakPolarHBondContact O-CG2 3.1Å; W185-T189 PolarHBondContact O-N 2.86Å; W185-T189 PolarHBondContact O-OG1 3.44Å; F186-T189 WeakPolarHBondContact CA-OG1 3.24Å; F186-T189 PolarHBondContact O-OG1 3.43Å; T189-A191 PolarHBondContact O-N 3.3Å; T189-T193 PolarHBondContact O-N 2.98Å; T189-T193 PolarHBondContact O-OG1 2.88Å; T189-M234 HydrophobicContact CG2-CB 4.46Å; T189-M234 HydrophobicContact CG2-SD 4.47Å; T189-T238 HydrophobicContact CG2-CG2 4.1Å |
| 190 | L | 92.6 | Very high | 90.2 | Very high | 6 Ų | 6 | 17.5 Ų | 17.5 | 3% | 0.031 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -56.8 | -37.9 | 169 | -86 | 162.9 | 0 | 0 | 0 | 111.7 | F186 I187 T193 R195 F198 F270 I273 | F186-L190 HydrophobicContact CD1-CD1 3.96Å; F186-L190 HydrophobicContact CE1-CD1 3.78Å; F186-L190 WeakPolarHBondContact O-CG 3.46Å; F186-L190 PolarHBondContact O-N 3.47Å; F186-L190 VanDerWaalsContact O-N 3.12Å; I187-L190 WeakPolarHBondContact O-CB 3.32Å; I187-L190 PolarHBondContact O-N 3.35Å; L190-T193 PolarHBondContact O-OG1 3Å; L190-R195 PolarHBondContact O-N 3.04Å; L190-F198 HydrophobicContact CB-CD2 4.24Å; L190-F198 HydrophobicContact CB-CE2 4.41Å; L190-F270 HydrophobicContact CB-CZ 4.46Å; L190-F270 HydrophobicContact CD2-CB 4.45Å; L190-F270 HydrophobicContact CD2-CD1 3.74Å; L190-F270 HydrophobicContact CD2-CD2 3.8Å; L190-F270 HydrophobicContact CD2-CE1 3.81Å; L190-F270 HydrophobicContact CD2-CE2 3.89Å; L190-F270 HydrophobicContact CD2-CG 3.73Å; L190-F270 HydrophobicContact CD2-CZ 3.89Å; L190-F270 HydrophobicContact CG-CD1 4.1Å; L190-F270 HydrophobicContact CG-CE1 3.69Å; L190-F270 HydrophobicContact CG-CE2 4.24Å; L190-F270 HydrophobicContact CG-CZ 3.77Å; L190-I273 HydrophobicContact CD1-CD1 3.87Å; L190-I273 HydrophobicContact CD1-CG2 4.16Å; L190-I273 HydrophobicContact CD2-CG2 4.38Å |
| 191 | A | 91.4 | Very high | 89 | Confident | 0 Ų | 0 | 16.1 Ų | 16.1 | 0% | 0 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -86.3 | -30.3 | -176.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | Q138 Y142 I187 S188 T189 T193 N194 F198 | Q138-A191 PolarHBondContact NE2-O 3.17Å; Y142-A191 HydrophobicContact CD1-CB 3.77Å; Y142-A191 HydrophobicContact CD2-CB 3.67Å; Y142-A191 HydrophobicContact CE1-CB 3.27Å; Y142-A191 HydrophobicContact CE2-CB 3.15Å; Y142-A191 HydrophobicContact CG-CB 3.98Å; Y142-A191 VanDerWaalsContact OH-CB 3.23Å; Y142-A191 WeakPolarHBondContact OH-CB 3.33Å; I187-A191 PolarHBondContact O-N 3.2Å; S188-A191 PolarHBondContact O-N 2.89Å; T189-A191 PolarHBondContact O-N 3.3Å; A191-T193 VanDerWaalsContact C-N 3.26Å; A191-T193 PolarHBondContact O-N 3.47Å; A191-N194 PolarHBondContact O-N 3.25Å; A191-F198 HydrophobicContact CB-CB 3.81Å; A191-F198 HydrophobicContact CB-CD1 4.43Å; A191-F198 HydrophobicContact CB-CD2 3.54Å; A191-F198 HydrophobicContact CB-CE2 4.19Å; A191-F198 HydrophobicContact CB-CG 3.67Å |
| 192 | E | 90.7 | Very high | 87.9 | Confident | 25 Ų | 25 | 17.4 Ų | 17.4 | 12% | 0.117 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -63.1 | -35.2 | 170.3 | -173.3 | 175.1 | -177 | 0 | 0 | 111.5 | S109 L146 S188 N194 M234 | S109-E192 VanDerWaalsContact CB-OE1 3.27Å; S109-E192 WeakPolarHBondContact CB-OE1 3.23Å; S109-E192 PolarHBondContact OG-OE1 2.95Å; L146-E192 WeakPolarHBondContact CD2-OE2 3.38Å; S188-E192 WeakPolarHBondContact O-CB 3.5Å; S188-E192 PolarHBondContact O-N 2.75Å; E192-N194 PolarHBondContact O-N 3.4Å; E192-M234 HydrophobicContact CG-CE 3.99Å; E192-M234 WeakPolarHBondContact OE1-CE 3.24Å; E192-M234 VanDerWaalsContact OE2-CE 3.29Å; E192-M234 WeakPolarHBondContact OE2-CE 3.34Å |
| 193 | T | 89.9 | Confident | 86.6 | Confident | 8 Ų | 8 | 17 Ų | 17 | 5% | 0.049 | 9% | 0.085 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -81.2 | 7.5 | 176.2 | 53.5 | 0 | 0 | 0 | 0 | 113.9 | T189 L190 A191 R195 N230 I231 M234 | T189-T193 PolarHBondContact O-N 2.98Å; T189-T193 PolarHBondContact O-OG1 2.88Å; L190-T193 PolarHBondContact O-OG1 3Å; A191-T193 VanDerWaalsContact C-N 3.26Å; A191-T193 PolarHBondContact O-N 3.47Å; T193-R195 PolarHBondContact O-N 3.46Å; T193-R195 VanDerWaalsContact O-N 3.17Å; T193-N230 HydrophobicContact CG2-CB 4.45Å; T193-I231 HydrophobicContact CG2-CG1 4.29Å; T193-M234 HydrophobicContact CG2-CB 4.24Å; T193-M234 HydrophobicContact CG2-CG 3.74Å |
| 194 | N | 85.5 | Confident | 84.9 | Confident | 17 Ų | 17 | 17.5 Ų | 17.5 | 9% | 0.091 | 9% | 0.086 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 51.8 | 33.2 | -178.4 | -61.3 | -44.1 | 0 | 0 | 0 | 113.8 | Q138 A191 E192 D199 A201 | Q138-N194 PolarHBondContact NE2-OD1 3.31Å; A191-N194 PolarHBondContact O-N 3.25Å; E192-N194 PolarHBondContact O-N 3.4Å; N194-D199 VanDerWaalsContact O-CA 3.3Å; N194-D199 WeakPolarHBondContact O-CA 3.13Å; N194-D199 VanDerWaalsContact O-CB 3.23Å; N194-D199 WeakPolarHBondContact O-CB 3.18Å; N194-A201 HydrophobicContact CB-CB 4.4Å |
| 195 | R | 82.6 | Confident | 83.2 | Confident | 15 Ų | 15 | 21.9 Ų | 21.9 | 6% | 0.057 | 12% | 0.117 | C | C | . | . | trans | -94.6 | 148.5 | -179.1 | -65.5 | -62 | -79.8 | -160.7 | -14.7 | 111.9 | E24 L190 T193 F198 D199 E227 I231 | E24-R195 IonicContact OE1-CZ 2.65Å; E24-R195 IonicContact OE1-NH2 3.79Å; E24-R195 PolarHBondContact OE1-NH2 3.4Å; E24-R195 IonicContact OE2-CZ 3.39Å; E24-R195 IonicContact OE2-NH2 3.93Å; E24-R195 PolarHBondContact OE2-NH2 3.29Å; L190-R195 PolarHBondContact O-N 3.04Å; T193-R195 PolarHBondContact O-N 3.46Å; T193-R195 VanDerWaalsContact O-N 3.17Å; R195-F198 CarbonylContact O-C 3.44Å; R195-F198 WeakPolarHBondContact O-CA 3.37Å; R195-F198 PolarHBondContact O-N 2.97Å; R195-D199 PolarHBondContact O-N 2.82Å; R195-E227 WeakPolarHBondContact CD-OE1 3.36Å; R195-E227 IonicContact CZ-OE1 3.59Å; R195-E227 IonicContact NE-OE1 2.86Å; R195-E227 IonicContact NH1-OE1 3.84Å; R195-E227 PolarHBondContact NH1-OE1 3.12Å; R195-I231 HydrophobicContact CG-CD1 4Å; R195-I231 HydrophobicContact CG-CG1 4.17Å | ||
| 196 | T | 81.8 | Confident | 81.1 | Confident | 10 Ų | 10 | 26.3 Ų | 26.3 | 6% | 0.061 | 14% | 0.138 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -53.6 | 128.1 | 173.6 | 50.1 | 0 | 0 | 0 | 0 | 109.8 | D199 R274 R279 | T196-D199 HydrophobicContact CG2-CB 3.73Å; T196-R274 WeakPolarHBondContact OG1-CA 3.47Å; T196-R274 WeakPolarHBondContact OG1-CB 3.43Å; T196-R274 WeakPolarHBondContact OG1-CG 3.41Å; T196-R279 HydrophobicContact CG2-CG 4.31Å |
| 197 | P | 84.5 | Confident | 79.9 | Confident | 7 Ų | 7 | 24.8 Ų | 24.8 | 5% | 0.045 | 13% | 0.131 | C | C | . | . | T | Hydrogen-bonded Turn | cis | -88.4 | 1.3 | 21.3 | 36 | -39.1 | 0 | 0 | 0 | 116.3 | P278 R279 F280 | P197-P278 WeakPolarHBondContact CB-O 3.33Å; P197-R279 WeakPolarHBondContact O-CA 3.18Å; P197-F280 HydrophobicContact CB-CD2 3.65Å; P197-F280 HydrophobicContact CB-CE2 3.83Å; P197-F280 HydrophobicContact CG-CD2 3.88Å; P197-F280 HydrophobicContact CG-CE2 3.75Å; P197-F280 PolarHBondContact O-N 2.86Å |
| 198 | F | 87 | Confident | 78.9 | Confident | 6 Ų | 6 | 27.9 Ų | 27.9 | 3% | 0.026 | 15% | 0.152 | C | C | . | . | S | Bend | trans | -103.4 | 23.9 | -177.7 | -51.9 | -67.2 | 0 | 0 | 0 | 114.1 | Q138 Y142 I187 L190 A191 R195 L200 F280 L285 L288 | Q138-F198 PolarHBondContact NE2-O 3.11Å; Q138-F198 PolarHBondContact OE1-O 2.73Å; Y142-F198 WeakPolarHBondContact OH-CD1 3.46Å; I187-F198 HydrophobicContact CG2-CE2 3.71Å; I187-F198 HydrophobicContact CG2-CZ 3.69Å; L190-F198 HydrophobicContact CB-CD2 4.24Å; L190-F198 HydrophobicContact CB-CE2 4.41Å; A191-F198 HydrophobicContact CB-CB 3.81Å; A191-F198 HydrophobicContact CB-CD1 4.43Å; A191-F198 HydrophobicContact CB-CD2 3.54Å; A191-F198 HydrophobicContact CB-CE2 4.19Å; A191-F198 HydrophobicContact CB-CG 3.67Å; R195-F198 CarbonylContact O-C 3.44Å; R195-F198 WeakPolarHBondContact O-CA 3.37Å; R195-F198 PolarHBondContact O-N 2.97Å; F198-L200 VanDerWaalsContact C-N 3.29Å; F198-L200 PolarHBondContact O-N 3.11Å; F198-F280 AromaticContact CD1-CD2 3.91Å; F198-F280 HydrophobicContact CD1-CD2 3.91Å; F198-F280 AromaticContact CE1-CD2 3.5Å; F198-F280 HydrophobicContact CE1-CD2 3.5Å; F198-F280 AromaticContact CE1-CE2 3.91Å; F198-F280 HydrophobicContact CE1-CE2 3.91Å; F198-F280 HydrophobicContact CE1-CG 4.26Å; F198-F280 HydrophobicContact CZ-CD2 4.15Å; F198-F280 HydrophobicContact CZ-CE2 4.13Å; F198-L285 HydrophobicContact CB-CD1 4.05Å; F198-L285 HydrophobicContact CD1-CD1 3.63Å; F198-L285 HydrophobicContact CD1-CG 3.95Å; F198-L285 HydrophobicContact CE1-CG 4.42Å; F198-L285 HydrophobicContact CG-CD1 4.24Å; F198-L288 HydrophobicContact CE1-CD2 4.05Å; F198-L288 HydrophobicContact CZ-CD2 4.03Å |
| 199 | D | 83 | Confident | 78 | Confident | 11 Ų | 11 | 29 Ų | 29 | 6% | 0.059 | 16% | 0.16 | C | C | . | . | trans | -80.8 | 76.3 | 174.7 | -178.9 | 12.8 | 0 | 0 | 0 | 111 | N194 R195 T196 E202 | N194-D199 VanDerWaalsContact O-CA 3.3Å; N194-D199 WeakPolarHBondContact O-CA 3.13Å; N194-D199 VanDerWaalsContact O-CB 3.23Å; N194-D199 WeakPolarHBondContact O-CB 3.18Å; R195-D199 PolarHBondContact O-N 2.82Å; T196-D199 HydrophobicContact CG2-CB 3.73Å; D199-E202 WeakPolarHBondContact OD1-CB 3.38Å; D199-E202 PolarHBondContact OD1-N 3.4Å; D199-E202 VanDerWaalsContact OD1-N 3.15Å | ||
| 200 | L | 73.8 | Confident | 77.5 | Confident | 4 Ų | 4 | 29 Ų | 29 | 2% | 0.021 | 16% | 0.16 | C | C | . | . | trans | -94.3 | -20.7 | 176.5 | -58 | -179.3 | 0 | 0 | 0 | 112.6 | F198 F280 Y282 L285 | F198-L200 VanDerWaalsContact C-N 3.29Å; F198-L200 PolarHBondContact O-N 3.11Å; L200-F280 WeakPolarHBondContact CD2-O 3.36Å; L200-Y282 HydrophobicContact CD1-CD2 3.76Å; L200-Y282 HydrophobicContact CD1-CG 4.29Å; L200-L285 HydrophobicContact CD1-CB 4.31Å; L200-L285 HydrophobicContact CD1-CD1 3.45Å; L200-L285 VanDerWaalsContact CD1-CD1 3.45Å; L200-L285 HydrophobicContact CD1-CG 4.44Å; L200-L285 HydrophobicContact CG-CD1 4.22Å | ||
| 201 | A | 70.9 | Confident | 76.9 | Confident | 1 Ų | 1 | 29.5 Ų | 29.5 | 1% | 0.008 | 16% | 0.162 | C | C | . | . | S | Bend | trans | -75.2 | -39.9 | -176.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | A135 N194 G210 F211 | A135-A201 HydrophobicContact CB-CB 3.63Å; N194-A201 HydrophobicContact CB-CB 4.4Å; A201-G210 VanDerWaalsContact O-CA 3.27Å; A201-G210 WeakPolarHBondContact O-CA 3.39Å; A201-F211 HydrophobicContact CB-CD1 4.14Å; A201-F211 HydrophobicContact CB-CE1 4.14Å |
| 202 | E | 72.4 | Confident | 76.6 | Confident | 27 Ų | 27 | 29.7 Ų | 29.7 | 13% | 0.126 | 16% | 0.163 | C | C | . | . | S | Bend | trans | -102.1 | -6.5 | -178.8 | -175.3 | 164.6 | -135.6 | 0 | 0 | 112.7 | D199 E204 S209 N212 F224 | D199-E202 WeakPolarHBondContact OD1-CB 3.38Å; D199-E202 PolarHBondContact OD1-N 3.4Å; D199-E202 VanDerWaalsContact OD1-N 3.15Å; E202-E204 PolarHBondContact O-N 2.89Å; E202-S209 CarbonylContact O-C 3.39Å; E202-S209 WeakPolarHBondContact O-CA 3.3Å; E202-N212 PolarHBondContact OE1-ND2 3.41Å; E202-F224 WeakPolarHBondContact OE1-CZ 3.42Å |
| 203 | G | 67.6 | Low | 76.3 | Confident | 3 Ų | 3 | 31 Ų | 31 | 3% | 0.031 | 17% | 0.17 | C | C | . | . | trans | -32.2 | 94.2 | -170.1 | 0 | 0 | 0 | 0 | 0 | 115.7 | S205 E206 L207 | G203-S205 PolarHBondContact O-N 3.21Å; G203-S205 VanDerWaalsContact O-N 3.08Å; G203-E206 PolarHBondContact O-N 3.01Å; G203-L207 PolarHBondContact O-N 3.34Å | ||
| 204 | E | 60.7 | Low | 76.1 | Confident | 131 Ų | 131 | 33.9 Ų | 33.9 | 61% | 0.612 | 18% | 0.183 | S | C | * | . | H | α-helix | trans | -54 | -37.1 | -172.5 | -64.7 | 174.8 | 153.2 | 0 | 0 | 113.3 | E202 E206 V208 R279 | E202-E204 PolarHBondContact O-N 2.89Å; E204-E206 VanDerWaalsContact C-N 3.29Å; E204-E206 PolarHBondContact O-N 2.75Å; E204-V208 WeakPolarHBondContact CA-O 3.47Å; E204-V208 WeakPolarHBondContact O-CA 3.37Å; E204-V208 PolarHBondContact O-N 3.17Å; E204-R279 IonicContact OE2-NH2 3.19Å |
| 205 | S | 60 | Low | 76.3 | Confident | 99 Ų | 99 | 33.5 Ų | 33.5 | 69% | 0.692 | 18% | 0.18 | S | C | * | . | H | α-helix | trans | -69.6 | -24.4 | -179.5 | 53.6 | 0 | 0 | 0 | 0 | 113.9 | G203 | G203-S205 PolarHBondContact O-N 3.21Å; G203-S205 VanDerWaalsContact O-N 3.08Å |
| 206 | E | 52.7 | Low | 76.4 | Confident | 97 Ų | 97 | 33.3 Ų | 33.3 | 45% | 0.453 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -109.2 | -35.8 | -173.6 | -63.3 | 178.9 | -175.1 | 0 | 0 | 112 | R134 G203 E204 | R134-E206 IonicContact CZ-OE2 3.38Å; R134-E206 IonicContact NH1-OE2 2.78Å; R134-E206 PolarHBondContact NH1-OE2 3.18Å; R134-E206 IonicContact NH2-OE2 2.82Å; R134-E206 PolarHBondContact NH2-OE2 3.31Å; G203-E206 PolarHBondContact O-N 3.01Å; E204-E206 VanDerWaalsContact C-N 3.29Å; E204-E206 PolarHBondContact O-N 2.75Å |
| 207 | L | 68.6 | Low | 76.7 | Confident | 7 Ų | 7 | 33 Ų | 33 | 4% | 0.037 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -131.1 | 9.9 | -168.1 | -58.8 | 175.3 | 0 | 0 | 0 | 113.6 | Y127 I130 G203 S209 G210 I213 | Y127-L207 HydrophobicContact CD1-CD2 4.11Å; I130-L207 HydrophobicContact CB-CD2 4.49Å; I130-L207 HydrophobicContact CG2-CD2 4.14Å; G203-L207 PolarHBondContact O-N 3.34Å; L207-S209 PolarHBondContact O-N 3.47Å; L207-G210 PolarHBondContact O-N 3.24Å; L207-I213 WeakPolarHBondContact O-CD1 3.45Å |
| 208 | V | 73.7 | Confident | 76.9 | Confident | 112 Ų | 112 | 33.4 Ų | 33.4 | 68% | 0.679 | 19% | 0.185 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 64.2 | -54.6 | -174.3 | -173.9 | 0 | 0 | 0 | 0 | 113.2 | E204 | E204-V208 WeakPolarHBondContact CA-O 3.47Å; E204-V208 WeakPolarHBondContact O-CA 3.37Å; E204-V208 PolarHBondContact O-N 3.17Å |
| 209 | S | 75.1 | Confident | 77.1 | Confident | 22 Ų | 22 | 34.8 Ų | 34.8 | 15% | 0.154 | 20% | 0.195 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -156.6 | 9.4 | 165.6 | 73.8 | 0 | 0 | 0 | 0 | 113.6 | E202 L207 F211 N212 I213 | E202-S209 CarbonylContact O-C 3.39Å; E202-S209 WeakPolarHBondContact O-CA 3.3Å; L207-S209 PolarHBondContact O-N 3.47Å; S209-F211 PolarHBondContact O-N 3.34Å; S209-N212 WeakPolarHBondContact CB-OD1 3.23Å; S209-N212 PolarHBondContact O-OD1 2.82Å; S209-N212 PolarHBondContact OG-OD1 3.06Å; S209-I213 WeakPolarHBondContact OG-CA 3.45Å; S209-I213 WeakPolarHBondContact OG-CG1 3.4Å; S209-I213 PolarHBondContact OG-N 3.38Å |
| 210 | G | 83.1 | Confident | 77.4 | Confident | 0 Ų | 0 | 36.9 Ų | 36.9 | 0% | 0 | 20% | 0.204 | C | C | . | . | G | 310 helix | trans | 69.1 | -125 | 173.4 | 0 | 0 | 0 | 0 | 0 | 115.6 | A128 A201 L207 N212 I213 | A128-G210 WeakPolarHBondContact CA-O 3.34Å; A128-G210 WeakPolarHBondContact CB-O 3.31Å; A201-G210 VanDerWaalsContact O-CA 3.27Å; A201-G210 WeakPolarHBondContact O-CA 3.39Å; L207-G210 PolarHBondContact O-N 3.24Å; G210-N212 PolarHBondContact O-N 3.43Å; G210-I213 WeakPolarHBondContact O-CD1 3.47Å; G210-I213 WeakPolarHBondContact O-CG1 3.43Å |
| 211 | F | 80.7 | Confident | 78.3 | Confident | 18 Ų | 18 | 37 Ų | 37 | 8% | 0.079 | 21% | 0.205 | C | C | . | . | G | 310 helix | trans | -68.3 | -22.6 | -171.8 | 68.5 | -95.1 | 0 | 0 | 0 | 113.7 | I116 S119 A132 A201 S209 F223 | I116-F211 HydrophobicContact CG2-CB 4.12Å; I116-F211 HydrophobicContact CG2-CD1 3.7Å; I116-F211 HydrophobicContact CG2-CD2 4.19Å; I116-F211 HydrophobicContact CG2-CE1 4.1Å; I116-F211 HydrophobicContact CG2-CG 3.74Å; I116-F211 HydrophobicContact CG2-CZ 4.5Å; S119-F211 WeakPolarHBondContact OG-CD2 3.47Å; A132-F211 HydrophobicContact CB-CB 4.21Å; A201-F211 HydrophobicContact CB-CD1 4.14Å; A201-F211 HydrophobicContact CB-CE1 4.14Å; S209-F211 PolarHBondContact O-N 3.34Å; F211-F223 AromaticContact CE2-CD1 3.99Å; F211-F223 HydrophobicContact CE2-CD1 3.99Å; F211-F223 HydrophobicContact CE2-CE1 4.22Å; F211-F223 HydrophobicContact CE2-CG 4.21Å |
| 212 | N | 85.3 | Confident | 79.4 | Confident | 3 Ų | 3 | 38.7 Ų | 38.7 | 2% | 0.016 | 21% | 0.214 | C | C | . | . | G | 310 helix | trans | -97.7 | 5.8 | -174.1 | 70.1 | 13.2 | 0 | 0 | 0 | 113.8 | E202 S209 G210 E214 Y215 | E202-N212 PolarHBondContact OE1-ND2 3.41Å; S209-N212 WeakPolarHBondContact CB-OD1 3.23Å; S209-N212 PolarHBondContact O-OD1 2.82Å; S209-N212 PolarHBondContact OG-OD1 3.06Å; G210-N212 PolarHBondContact O-N 3.43Å; N212-E214 VanDerWaalsContact C-N 3.29Å; N212-E214 PolarHBondContact O-N 3.5Å; N212-Y215 WeakPolarHBondContact O-CB 3.08Å; N212-Y215 PolarHBondContact O-N 3.34Å |
| 213 | I | 83.8 | Confident | 80.3 | Confident | 52 Ų | 52 | 38 Ų | 38 | 27% | 0.267 | 21% | 0.21 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -51.6 | -44.3 | -172.9 | -64.6 | 157.7 | 0 | 0 | 0 | 113.2 | L207 S209 G210 Y215 | L207-I213 WeakPolarHBondContact O-CD1 3.45Å; S209-I213 WeakPolarHBondContact OG-CA 3.45Å; S209-I213 WeakPolarHBondContact OG-CG1 3.4Å; S209-I213 PolarHBondContact OG-N 3.38Å; G210-I213 WeakPolarHBondContact O-CD1 3.47Å; G210-I213 WeakPolarHBondContact O-CG1 3.43Å; I213-Y215 VanDerWaalsContact C-N 3.3Å; I213-Y215 PolarHBondContact O-N 3.17Å |
| 214 | E | 85.9 | Confident | 81.4 | Confident | 69 Ų | 69 | 39.6 Ų | 39.6 | 32% | 0.322 | 22% | 0.217 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -81.4 | -12.3 | -176.2 | -65.4 | -62.3 | 159.8 | 0 | 0 | 112.8 | P63 Y71 N212 A216 | P63-E214 HydrophobicContact CG-CB 3.81Å; P63-E214 HydrophobicContact CG-CG 4.28Å; Y71-E214 HydrophobicContact CE2-CB 4.43Å; Y71-E214 PolarHBondContact OH-O 3.17Å; N212-E214 VanDerWaalsContact C-N 3.29Å; N212-E214 PolarHBondContact O-N 3.5Å; E214-A216 PolarHBondContact O-N 3.03Å |
| 215 | Y | 88.2 | Confident | 82.9 | Confident | 9 Ų | 9 | 35 Ų | 35 | 4% | 0.035 | 20% | 0.196 | C | C | . | . | trans | -80.7 | 121.4 | -178.1 | -71.1 | -91.2 | 0 | 0 | 0 | 111.1 | Y71 P75 S119 N212 I213 P219 F223 | Y71-Y215 WeakPolarHBondContact CA-OH 3.25Å; Y71-Y215 HydrophobicContact CD1-CE1 4.14Å; Y71-Y215 HydrophobicContact CD2-CD1 4.28Å; Y71-Y215 AromaticContact CD2-CE1 3.55Å; Y71-Y215 HydrophobicContact CD2-CE1 3.55Å; Y71-Y215 AromaticContact CD2-CE2 4Å; Y71-Y215 HydrophobicContact CD2-CE2 4Å; Y71-Y215 AromaticContact CD2-CZ 3.38Å; Y71-Y215 WeakPolarHBondContact CD2-OH 3.28Å; Y71-Y215 HydrophobicContact CE1-CD1 4.15Å; Y71-Y215 HydrophobicContact CE1-CE1 4.01Å; Y71-Y215 AromaticContact CE2-CD1 3.63Å; Y71-Y215 HydrophobicContact CE2-CD1 3.63Å; Y71-Y215 AromaticContact CE2-CD2 3.98Å; Y71-Y215 HydrophobicContact CE2-CD2 3.98Å; Y71-Y215 AromaticContact CE2-CE1 3.37Å; Y71-Y215 HydrophobicContact CE2-CE1 3.37Å; Y71-Y215 AromaticContact CE2-CE2 3.75Å; Y71-Y215 HydrophobicContact CE2-CE2 3.75Å; Y71-Y215 AromaticContact CE2-CG 3.94Å; Y71-Y215 HydrophobicContact CE2-CG 3.94Å; Y71-Y215 AromaticContact CE2-CZ 3.44Å; Y71-Y215 VanDerWaalsContact CE2-CZ 3.44Å; Y71-Y215 AromaticContact CG-CE1 3.93Å; Y71-Y215 HydrophobicContact CG-CE1 3.93Å; Y71-Y215 AromaticContact CZ-CD1 3.57Å; Y71-Y215 AromaticContact CZ-CE1 3.64Å; Y71-Y215 WeakPolarHBondContact O-CE1 3.45Å; Y71-Y215 PolarHBondContact O-OH 2.88Å; Y71-Y215 WeakPolarHBondContact OH-CA 3.42Å; P75-Y215 HydrophobicContact CG-CD1 4.03Å; P75-Y215 HydrophobicContact CG-CE1 3.56Å; S119-Y215 WeakPolarHBondContact CA-OH 3.23Å; N212-Y215 WeakPolarHBondContact O-CB 3.08Å; N212-Y215 PolarHBondContact O-N 3.34Å; I213-Y215 VanDerWaalsContact C-N 3.3Å; I213-Y215 PolarHBondContact O-N 3.17Å; Y215-P219 HydrophobicContact CD1-CB 3.66Å; Y215-P219 HydrophobicContact CE1-CB 4.37Å; Y215-F223 HydrophobicContact CD1-CD2 4.48Å; Y215-F223 AromaticContact CD1-CE2 3.92Å; Y215-F223 HydrophobicContact CD1-CE2 3.92Å; Y215-F223 HydrophobicContact CD2-CE2 4.08Å; Y215-F223 AromaticContact CE1-CE2 3.85Å; Y215-F223 HydrophobicContact CE1-CE2 3.85Å; Y215-F223 HydrophobicContact CE2-CE2 4.02Å; Y215-F223 HydrophobicContact CG-CD2 4.39Å; Y215-F223 HydrophobicContact CG-CE2 4.02Å; Y215-F223 AromaticContact CZ-CE2 3.9Å | ||
| 216 | A | 86.3 | Confident | 84.6 | Confident | 12 Ų | 12 | 30.5 Ų | 30.5 | 10% | 0.099 | 16% | 0.164 | C | C | . | . | trans | -111 | 157.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | L61 E214 G218 P219 | L61-A216 HydrophobicContact CB-CB 3.7Å; L61-A216 HydrophobicContact CD1-CB 3.81Å; L61-A216 HydrophobicContact CG-CB 4Å; E214-A216 PolarHBondContact O-N 3.03Å; A216-G218 PolarHBondContact O-N 3.43Å; A216-P219 VanDerWaalsContact O-CD 3.25Å; A216-P219 WeakPolarHBondContact O-CD 3.3Å | ||
| 217 | A | 86.5 | Confident | 86.5 | Confident | 4 Ų | 4 | 27.4 Ų | 27.4 | 3% | 0.033 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | 55.1 | -120 | 163.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | L55 K58 F220 A221 | L55-A217 CarbonylContact O-C 2.87Å; L55-A217 WeakPolarHBondContact O-CA 3.04Å; L55-A217 WeakPolarHBondContact O-CB 3.46Å; K58-A217 HydrophobicContact CB-CB 3.8Å; K58-A217 HydrophobicContact CG-CB 4.2Å; K58-A217 VanDerWaalsContact O-CB 3.3Å; K58-A217 WeakPolarHBondContact O-CB 2.96Å; A217-F220 PolarHBondContact O-N 3.32Å; A217-A221 PolarHBondContact O-N 3.08Å |
| 218 | G | 90 | Very high | 87.7 | Confident | 14 Ų | 14 | 28 Ų | 28 | 14% | 0.144 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -61.3 | -54.3 | -176.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | L55 A216 F220 A221 L222 | L55-G218 PolarHBondContact O-N 3.31Å; A216-G218 PolarHBondContact O-N 3.43Å; G218-F220 VanDerWaalsContact C-N 3.27Å; G218-F220 PolarHBondContact O-N 3.36Å; G218-A221 WeakPolarHBondContact O-CA 3.33Å; G218-A221 VanDerWaalsContact O-CB 3.24Å; G218-A221 WeakPolarHBondContact O-CB 3.49Å; G218-A221 PolarHBondContact O-N 3.3Å; G218-L222 PolarHBondContact O-N 2.95Å |
| 219 | P | 91 | Very high | 88.7 | Confident | 35 Ų | 35 | 22.7 Ų | 22.7 | 23% | 0.227 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -53.9 | -40.1 | 176 | -32.4 | 36.2 | 0 | 0 | 0 | 114.5 | P75 Y215 A216 L222 | P75-P219 HydrophobicContact CG-CB 4.14Å; Y215-P219 HydrophobicContact CD1-CB 3.66Å; Y215-P219 HydrophobicContact CE1-CB 4.37Å; A216-P219 VanDerWaalsContact O-CD 3.25Å; A216-P219 WeakPolarHBondContact O-CD 3.3Å; P219-L222 PolarHBondContact O-N 3.43Å |
| 220 | F | 89.7 | Confident | 89.7 | Confident | 56 Ų | 56 | 23.1 Ų | 23.1 | 25% | 0.246 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -61.5 | -45.9 | 172.4 | 176.3 | -95.5 | 0 | 0 | 0 | 111.4 | L55 A217 G218 L222 F223 F224 | L55-F220 HydrophobicContact CD2-CD1 4.3Å; A217-F220 PolarHBondContact O-N 3.32Å; G218-F220 VanDerWaalsContact C-N 3.27Å; G218-F220 PolarHBondContact O-N 3.36Å; F220-L222 PolarHBondContact O-N 2.91Å; F220-F223 PolarHBondContact O-N 3.23Å; F220-F223 VanDerWaalsContact O-N 3.1Å; F220-F224 AromaticContact CD1-CD2 3.65Å; F220-F224 HydrophobicContact CD1-CD2 3.65Å; F220-F224 AromaticContact CD1-CE2 3.89Å; F220-F224 HydrophobicContact CD1-CE2 3.89Å; F220-F224 HydrophobicContact CD2-CD2 4.12Å; F220-F224 AromaticContact CD2-CE2 3.73Å; F220-F224 HydrophobicContact CD2-CE2 3.73Å; F220-F224 AromaticContact CE1-CD2 3.35Å; F220-F224 HydrophobicContact CE1-CD2 3.35Å; F220-F224 AromaticContact CE1-CE2 3.28Å; F220-F224 HydrophobicContact CE1-CE2 3.28Å; F220-F224 HydrophobicContact CE1-CG 4.31Å; F220-F224 HydrophobicContact CE1-CZ 4.06Å; F220-F224 AromaticContact CE2-CD2 3.89Å; F220-F224 HydrophobicContact CE2-CD2 3.89Å; F220-F224 AromaticContact CE2-CE2 3.12Å; F220-F224 HydrophobicContact CE2-CE2 3.12Å; F220-F224 AromaticContact CE2-CZ 3.93Å; F220-F224 HydrophobicContact CE2-CZ 3.93Å; F220-F224 HydrophobicContact CG-CD2 4.04Å; F220-F224 HydrophobicContact CG-CE2 4.1Å; F220-F224 AromaticContact CZ-CD2 3.51Å; F220-F224 HydrophobicContact CZ-CD2 3.51Å; F220-F224 AromaticContact CZ-CE2 2.86Å; F220-F224 HydrophobicContact CZ-CE2 2.86Å; F220-F224 AromaticContact CZ-CZ 3.47Å; F220-F224 HydrophobicContact CZ-CZ 3.47Å; F220-F224 VanDerWaalsContact CZ-CZ 3.47Å; F220-F224 WeakPolarHBondContact O-CD2 3.11Å; F220-F224 PolarHBondContact O-N 2.85Å |
| 221 | A | 92.1 | Very high | 90.3 | Very high | 5 Ų | 5 | 23.3 Ų | 23.3 | 4% | 0.041 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -56 | -38.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | L55 A217 G218 F223 F224 M225 | L55-A221 HydrophobicContact CB-CB 4.16Å; L55-A221 HydrophobicContact CD1-CB 3.85Å; A217-A221 PolarHBondContact O-N 3.08Å; G218-A221 WeakPolarHBondContact O-CA 3.33Å; G218-A221 VanDerWaalsContact O-CB 3.24Å; G218-A221 WeakPolarHBondContact O-CB 3.49Å; G218-A221 PolarHBondContact O-N 3.3Å; A221-F223 PolarHBondContact O-N 3.18Å; A221-F224 PolarHBondContact O-N 2.86Å; A221-M225 HydrophobicContact CB-CE 4.37Å; A221-M225 WeakPolarHBondContact O-CB 3.29Å; A221-M225 WeakPolarHBondContact O-CG 3.27Å; A221-M225 PolarHBondContact O-N 2.81Å |
| 222 | L | 93.6 | Very high | 91 | Very high | 38 Ų | 38 | 23.3 Ų | 23.3 | 20% | 0.199 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -61.5 | -40 | 178.2 | -67.4 | 169.8 | 0 | 0 | 0 | 112.7 | P75 T76 L79 G218 P219 F220 M225 A226 | P75-L222 HydrophobicContact CB-CB 3.71Å; P75-L222 HydrophobicContact CB-CD1 3.85Å; P75-L222 HydrophobicContact CB-CG 4.44Å; T76-L222 HydrophobicContact CG2-CD1 4.4Å; L79-L222 HydrophobicContact CD2-CD2 3.68Å; G218-L222 PolarHBondContact O-N 2.95Å; P219-L222 PolarHBondContact O-N 3.43Å; F220-L222 PolarHBondContact O-N 2.91Å; L222-M225 HydrophobicContact CD2-CE 3.7Å; L222-M225 HydrophobicContact CG-CE 4.32Å; L222-A226 WeakPolarHBondContact O-CB 3.5Å; L222-A226 PolarHBondContact O-N 3.35Å |
| 223 | F | 92.3 | Very high | 91.5 | Very high | 11 Ų | 11 | 23.2 Ų | 23.2 | 5% | 0.048 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -65.9 | -45.7 | 174.5 | -76.9 | -63.2 | 0 | 0 | 0 | 112.3 | A74 P75 A78 S119 F211 Y215 F220 A221 M225 A226 E227 | A74-F223 HydrophobicContact CB-CZ 4.17Å; P75-F223 HydrophobicContact CB-CD2 4.14Å; P75-F223 HydrophobicContact CB-CE2 3.83Å; P75-F223 HydrophobicContact CB-CZ 4.03Å; P75-F223 HydrophobicContact CG-CD2 4.27Å; P75-F223 HydrophobicContact CG-CE2 3.57Å; P75-F223 HydrophobicContact CG-CZ 3.88Å; A78-F223 HydrophobicContact CB-CD1 3.85Å; A78-F223 HydrophobicContact CB-CE1 3.85Å; S119-F223 VanDerWaalsContact CB-CZ 3.5Å; F211-F223 AromaticContact CE2-CD1 3.99Å; F211-F223 HydrophobicContact CE2-CD1 3.99Å; F211-F223 HydrophobicContact CE2-CE1 4.22Å; F211-F223 HydrophobicContact CE2-CG 4.21Å; Y215-F223 HydrophobicContact CD1-CD2 4.48Å; Y215-F223 AromaticContact CD1-CE2 3.92Å; Y215-F223 HydrophobicContact CD1-CE2 3.92Å; Y215-F223 HydrophobicContact CD2-CE2 4.08Å; Y215-F223 AromaticContact CE1-CE2 3.85Å; Y215-F223 HydrophobicContact CE1-CE2 3.85Å; Y215-F223 HydrophobicContact CE2-CE2 4.02Å; Y215-F223 HydrophobicContact CG-CD2 4.39Å; Y215-F223 HydrophobicContact CG-CE2 4.02Å; Y215-F223 AromaticContact CZ-CE2 3.9Å; F220-F223 PolarHBondContact O-N 3.23Å; F220-F223 VanDerWaalsContact O-N 3.1Å; A221-F223 PolarHBondContact O-N 3.18Å; F223-M225 VanDerWaalsContact C-N 3.33Å; F223-M225 PolarHBondContact O-N 2.83Å; F223-A226 WeakPolarHBondContact O-CB 3.45Å; F223-A226 PolarHBondContact O-N 3.49Å; F223-A226 VanDerWaalsContact O-N 3.17Å; F223-E227 PolarHBondContact O-N 2.91Å |
| 224 | F | 90.3 | Very high | 92 | Very high | 37 Ų | 37 | 21.1 Ų | 21.1 | 16% | 0.162 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -61.7 | -42.9 | 177.4 | -86.1 | -82.8 | 0 | 0 | 0 | 112.1 | E202 F220 A221 A226 E227 Y228 | E202-F224 WeakPolarHBondContact OE1-CZ 3.42Å; F220-F224 AromaticContact CD1-CD2 3.65Å; F220-F224 HydrophobicContact CD1-CD2 3.65Å; F220-F224 AromaticContact CD1-CE2 3.89Å; F220-F224 HydrophobicContact CD1-CE2 3.89Å; F220-F224 HydrophobicContact CD2-CD2 4.12Å; F220-F224 AromaticContact CD2-CE2 3.73Å; F220-F224 HydrophobicContact CD2-CE2 3.73Å; F220-F224 AromaticContact CE1-CD2 3.35Å; F220-F224 HydrophobicContact CE1-CD2 3.35Å; F220-F224 AromaticContact CE1-CE2 3.28Å; F220-F224 HydrophobicContact CE1-CE2 3.28Å; F220-F224 HydrophobicContact CE1-CG 4.31Å; F220-F224 HydrophobicContact CE1-CZ 4.06Å; F220-F224 AromaticContact CE2-CD2 3.89Å; F220-F224 HydrophobicContact CE2-CD2 3.89Å; F220-F224 AromaticContact CE2-CE2 3.12Å; F220-F224 HydrophobicContact CE2-CE2 3.12Å; F220-F224 AromaticContact CE2-CZ 3.93Å; F220-F224 HydrophobicContact CE2-CZ 3.93Å; F220-F224 HydrophobicContact CG-CD2 4.04Å; F220-F224 HydrophobicContact CG-CE2 4.1Å; F220-F224 AromaticContact CZ-CD2 3.51Å; F220-F224 HydrophobicContact CZ-CD2 3.51Å; F220-F224 AromaticContact CZ-CE2 2.86Å; F220-F224 HydrophobicContact CZ-CE2 2.86Å; F220-F224 AromaticContact CZ-CZ 3.47Å; F220-F224 HydrophobicContact CZ-CZ 3.47Å; F220-F224 VanDerWaalsContact CZ-CZ 3.47Å; F220-F224 WeakPolarHBondContact O-CD2 3.11Å; F220-F224 PolarHBondContact O-N 2.85Å; A221-F224 PolarHBondContact O-N 2.86Å; F224-A226 VanDerWaalsContact C-N 3.32Å; F224-A226 PolarHBondContact O-N 2.92Å; F224-E227 PolarHBondContact O-N 3.39Å; F224-Y228 AromaticContact CD1-CE2 3.89Å; F224-Y228 HydrophobicContact CD1-CE2 3.89Å; F224-Y228 WeakPolarHBondContact O-CD2 3.23Å; F224-Y228 PolarHBondContact O-N 3.48Å |
| 225 | M | 93.1 | Very high | 92.5 | Very high | 35 Ų | 35 | 17.9 Ų | 17.9 | 17% | 0.172 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -59.6 | -46.1 | 175.1 | -70.2 | -168.4 | -72 | 0 | 0 | 110.4 | M17 F56 L79 A221 L222 F223 Y228 T229 | M17-M225 HydrophobicContact CE-CB 3.72Å; M17-M225 HydrophobicContact CE-CG 3.29Å; M17-M225 HydrophobicContact CE-SD 3.64Å; M17-M225 HydrophobicContact SD-CB 4.26Å; M17-M225 HydrophobicContact SD-CG 3.86Å; F56-M225 HydrophobicContact CZ-CE 4.33Å; L79-M225 HydrophobicContact CD1-CB 4.02Å; A221-M225 HydrophobicContact CB-CE 4.37Å; A221-M225 WeakPolarHBondContact O-CB 3.29Å; A221-M225 WeakPolarHBondContact O-CG 3.27Å; A221-M225 PolarHBondContact O-N 2.81Å; L222-M225 HydrophobicContact CD2-CE 3.7Å; L222-M225 HydrophobicContact CG-CE 4.32Å; F223-M225 VanDerWaalsContact C-N 3.33Å; F223-M225 PolarHBondContact O-N 2.83Å; M225-Y228 PolarHBondContact O-N 2.94Å; M225-T229 WeakPolarHBondContact O-CB 3.33Å; M225-T229 VanDerWaalsContact O-CG2 3.29Å; M225-T229 WeakPolarHBondContact O-CG2 3.34Å; M225-T229 PolarHBondContact O-N 2.85Å; M225-T229 PolarHBondContact O-OG1 2.98Å |
| 226 | A | 94.4 | Very high | 92.9 | Very high | 4 Ų | 4 | 17.6 Ų | 17.6 | 3% | 0.033 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -60.4 | -48.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | A78 A82 L222 F223 F224 Y228 T229 N230 | A78-A226 HydrophobicContact CB-CB 3.9Å; A82-A226 HydrophobicContact CB-CB 4.06Å; L222-A226 WeakPolarHBondContact O-CB 3.5Å; L222-A226 PolarHBondContact O-N 3.35Å; F223-A226 WeakPolarHBondContact O-CB 3.45Å; F223-A226 PolarHBondContact O-N 3.49Å; F223-A226 VanDerWaalsContact O-N 3.17Å; F224-A226 VanDerWaalsContact C-N 3.32Å; F224-A226 PolarHBondContact O-N 2.92Å; A226-Y228 PolarHBondContact O-N 3.34Å; A226-T229 VanDerWaalsContact CA-OG1 3.3Å; A226-T229 WeakPolarHBondContact CA-OG1 2.96Å; A226-T229 PolarHBondContact O-N 3.28Å; A226-T229 PolarHBondContact O-OG1 3.42Å; A226-N230 WeakPolarHBondContact O-CB 3.44Å; A226-N230 VanDerWaalsContact O-CG 3.3Å; A226-N230 PolarHBondContact O-N 2.93Å; A226-N230 PolarHBondContact O-ND2 3.37Å |
| 227 | E | 92.4 | Very high | 93.3 | Very high | 32 Ų | 32 | 17.1 Ų | 17.1 | 15% | 0.15 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -59.1 | -48.5 | 179 | -172.3 | -166.9 | 143.3 | 0 | 0 | 111.5 | R195 F223 F224 T229 N230 I231 | R195-E227 WeakPolarHBondContact CD-OE1 3.36Å; R195-E227 IonicContact CZ-OE1 3.59Å; R195-E227 IonicContact NE-OE1 2.86Å; R195-E227 IonicContact NH1-OE1 3.84Å; R195-E227 PolarHBondContact NH1-OE1 3.12Å; F223-E227 PolarHBondContact O-N 2.91Å; F224-E227 PolarHBondContact O-N 3.39Å; E227-T229 PolarHBondContact O-N 2.79Å; E227-N230 WeakPolarHBondContact O-CB 3.46Å; E227-N230 PolarHBondContact O-N 3.43Å; E227-N230 VanDerWaalsContact O-N 3.13Å; E227-I231 HydrophobicContact CG-CD1 4.49Å; E227-I231 WeakPolarHBondContact O-CG1 3.24Å; E227-I231 PolarHBondContact O-N 3.32Å |
| 228 | Y | 94.1 | Very high | 93.8 | Very high | 20 Ų | 20 | 17.1 Ų | 17.1 | 8% | 0.078 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -68 | -35.7 | 178.9 | -75 | -59.3 | 0 | 0 | 0 | 113.2 | M17 L20 M21 E24 F224 M225 A226 N230 I231 I232 | M17-Y228 VanDerWaalsContact CG-CB 3.47Å; L20-Y228 HydrophobicContact CD2-CD1 3.35Å; L20-Y228 HydrophobicContact CD2-CE1 4.11Å; L20-Y228 HydrophobicContact CD2-CG 4.09Å; M21-Y228 HydrophobicContact CG-CD2 3.67Å; M21-Y228 HydrophobicContact CG-CE2 3.58Å; M21-Y228 HydrophobicContact CG-CG 4.27Å; M21-Y228 HydrophobicContact SD-CD2 4.03Å; M21-Y228 HydrophobicContact SD-CE2 3.93Å; E24-Y228 WeakPolarHBondContact OE2-CE1 3.43Å; E24-Y228 PolarHBondContact OE2-OH 3.15Å; F224-Y228 AromaticContact CD1-CE2 3.89Å; F224-Y228 HydrophobicContact CD1-CE2 3.89Å; F224-Y228 WeakPolarHBondContact O-CD2 3.23Å; F224-Y228 PolarHBondContact O-N 3.48Å; M225-Y228 PolarHBondContact O-N 2.94Å; A226-Y228 PolarHBondContact O-N 3.34Å; Y228-N230 VanDerWaalsContact C-N 3.29Å; Y228-N230 PolarHBondContact O-N 3Å; Y228-I231 HydrophobicContact CD1-CD1 3.62Å; Y228-I231 HydrophobicContact CE1-CD1 4.05Å; Y228-I231 PolarHBondContact O-N 3.1Å; Y228-I232 WeakPolarHBondContact O-CG1 3.46Å; Y228-I232 PolarHBondContact O-N 3.27Å |
| 229 | T | 95.6 | Very high | 94.2 | Very high | 0 Ų | 0 | 16.5 Ų | 16.5 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -64 | -37 | 171.1 | 50.8 | 0 | 0 | 0 | 0 | 111.7 | I13 M17 A82 M225 A226 E227 I232 M233 | I13-T229 HydrophobicContact CG2-CG2 3.92Å; M17-T229 HydrophobicContact CB-CG2 3.93Å; M17-T229 HydrophobicContact CG-CG2 4.08Å; A82-T229 VanDerWaalsContact CB-OG1 3.23Å; A82-T229 WeakPolarHBondContact CB-OG1 3.11Å; M225-T229 WeakPolarHBondContact O-CB 3.33Å; M225-T229 VanDerWaalsContact O-CG2 3.29Å; M225-T229 WeakPolarHBondContact O-CG2 3.34Å; M225-T229 PolarHBondContact O-N 2.85Å; M225-T229 PolarHBondContact O-OG1 2.98Å; A226-T229 VanDerWaalsContact CA-OG1 3.3Å; A226-T229 WeakPolarHBondContact CA-OG1 2.96Å; A226-T229 PolarHBondContact O-N 3.28Å; A226-T229 PolarHBondContact O-OG1 3.42Å; E227-T229 PolarHBondContact O-N 2.79Å; T229-I232 PolarHBondContact O-N 3.07Å; T229-M233 WeakPolarHBondContact O-CB 3.48Å; T229-M233 PolarHBondContact O-N 2.77Å |
| 230 | N | 94.9 | Very high | 94.4 | Very high | 31 Ų | 31 | 15 Ų | 15 | 17% | 0.166 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -68 | -36.3 | 175.9 | -74.7 | -19.7 | 0 | 0 | 0 | 112.1 | A82 T193 A226 E227 Y228 I232 M233 M234 | A82-N230 WeakPolarHBondContact CA-OD1 3.45Å; A82-N230 VanDerWaalsContact CB-OD1 3.31Å; A82-N230 WeakPolarHBondContact CB-OD1 3.47Å; T193-N230 HydrophobicContact CG2-CB 4.45Å; A226-N230 WeakPolarHBondContact O-CB 3.44Å; A226-N230 VanDerWaalsContact O-CG 3.3Å; A226-N230 PolarHBondContact O-N 2.93Å; A226-N230 PolarHBondContact O-ND2 3.37Å; E227-N230 WeakPolarHBondContact O-CB 3.46Å; E227-N230 PolarHBondContact O-N 3.43Å; E227-N230 VanDerWaalsContact O-N 3.13Å; Y228-N230 VanDerWaalsContact C-N 3.29Å; Y228-N230 PolarHBondContact O-N 3Å; N230-I232 PolarHBondContact O-N 2.98Å; N230-M233 PolarHBondContact O-N 3.06Å; N230-M234 WeakPolarHBondContact O-CB 3.44Å; N230-M234 VanDerWaalsContact O-CG 3.3Å; N230-M234 WeakPolarHBondContact O-CG 3.4Å; N230-M234 PolarHBondContact O-N 3.5Å |
| 231 | I | 95 | Very high | 94.7 | Very high | 5 Ų | 5 | 12.3 Ų | 12.3 | 3% | 0.026 | 6% | 0.062 | C | C | . | . | H | α-helix | trans | -58.9 | -49.7 | 173.7 | -70.4 | 160 | 0 | 0 | 0 | 110.6 | L20 T193 R195 E227 Y228 M233 N235 F270 | L20-I231 HydrophobicContact CD2-CG2 4.48Å; T193-I231 HydrophobicContact CG2-CG1 4.29Å; R195-I231 HydrophobicContact CG-CD1 4Å; R195-I231 HydrophobicContact CG-CG1 4.17Å; E227-I231 HydrophobicContact CG-CD1 4.49Å; E227-I231 WeakPolarHBondContact O-CG1 3.24Å; E227-I231 PolarHBondContact O-N 3.32Å; Y228-I231 HydrophobicContact CD1-CD1 3.62Å; Y228-I231 HydrophobicContact CE1-CD1 4.05Å; Y228-I231 PolarHBondContact O-N 3.1Å; I231-M233 VanDerWaalsContact C-N 3.34Å; I231-N235 WeakPolarHBondContact O-CB 3.37Å; I231-N235 PolarHBondContact O-N 3.25Å; I231-N235 VanDerWaalsContact O-N 3.1Å; I231-N235 PolarHBondContact O-ND2 2.83Å; I231-F270 HydrophobicContact CG2-CD2 3.85Å; I231-F270 HydrophobicContact CG2-CE2 4.41Å |
| 232 | I | 96 | Very high | 94.9 | Very high | 18 Ų | 18 | 12.4 Ų | 12.4 | 9% | 0.092 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -66.9 | -42.7 | -179.1 | -54.9 | 167.6 | 0 | 0 | 0 | 109.4 | A16 M17 L20 W86 Y228 T229 N230 N235 T236 | A16-I232 HydrophobicContact CB-CD1 4.34Å; M17-I232 HydrophobicContact CB-CD1 4.39Å; L20-I232 HydrophobicContact CB-CD1 4.21Å; L20-I232 HydrophobicContact CD1-CD1 4.19Å; L20-I232 HydrophobicContact CD1-CG1 3.91Å; L20-I232 HydrophobicContact CD2-CD1 4.39Å; L20-I232 HydrophobicContact CD2-CG1 4.21Å; L20-I232 HydrophobicContact CG-CD1 4.5Å; W86-I232 HydrophobicContact CH2-CB 4.09Å; W86-I232 HydrophobicContact CH2-CG2 3.54Å; W86-I232 HydrophobicContact CZ2-CB 3.96Å; W86-I232 HydrophobicContact CZ2-CG2 3.95Å; Y228-I232 WeakPolarHBondContact O-CG1 3.46Å; Y228-I232 PolarHBondContact O-N 3.27Å; T229-I232 PolarHBondContact O-N 3.07Å; N230-I232 PolarHBondContact O-N 2.98Å; I232-N235 PolarHBondContact O-N 3.29Å; I232-T236 HydrophobicContact CG2-CG2 4.18Å; I232-T236 WeakPolarHBondContact O-CG2 3.33Å; I232-T236 PolarHBondContact O-N 3.03Å; I232-T236 PolarHBondContact O-OG1 3.47Å |
| 233 | M | 95.8 | Very high | 94.9 | Very high | 0 Ų | 0 | 11.9 Ų | 11.9 | 0% | 0 | 6% | 0.058 | C | C | . | . | H | α-helix | trans | -59.6 | -49.4 | 178.7 | -173.4 | -80.8 | -60.6 | 0 | 0 | 112 | L85 W86 L89 T229 N230 I231 N235 T236 L237 | L85-M233 HydrophobicContact CB-CE 3.87Å; L85-M233 HydrophobicContact CB-CG 3.84Å; L85-M233 HydrophobicContact CB-SD 3.94Å; L85-M233 HydrophobicContact CD1-CE 3.53Å; L85-M233 HydrophobicContact CD2-CE 4.11Å; L85-M233 HydrophobicContact CD2-SD 4.45Å; L85-M233 HydrophobicContact CG-CE 4.04Å; W86-M233 HydrophobicContact CZ2-CB 3.95Å; L89-M233 HydrophobicContact CD1-CG 4.12Å; T229-M233 WeakPolarHBondContact O-CB 3.48Å; T229-M233 PolarHBondContact O-N 2.77Å; N230-M233 PolarHBondContact O-N 3.06Å; I231-M233 VanDerWaalsContact C-N 3.34Å; M233-N235 VanDerWaalsContact C-N 3.31Å; M233-N235 PolarHBondContact O-N 3.49Å; M233-T236 WeakPolarHBondContact CA-OG1 3.46Å; M233-T236 PolarHBondContact O-N 3.23Å; M233-T236 VanDerWaalsContact O-N 3.1Å; M233-T236 PolarHBondContact O-OG1 3.2Å; M233-L237 PolarHBondContact O-N 3.19Å |
| 234 | M | 95.1 | Very high | 94.8 | Very high | 9 Ų | 9 | 11.4 Ų | 11.4 | 4% | 0.044 | 6% | 0.057 | C | C | . | . | H | α-helix | trans | -61.4 | -41.9 | 177.6 | -71.1 | -54.5 | 180 | 0 | 0 | 111.4 | T189 E192 T193 N230 T236 L237 T238 | T189-M234 HydrophobicContact CG2-CB 4.46Å; T189-M234 HydrophobicContact CG2-SD 4.47Å; E192-M234 HydrophobicContact CG-CE 3.99Å; E192-M234 WeakPolarHBondContact OE1-CE 3.24Å; E192-M234 VanDerWaalsContact OE2-CE 3.29Å; E192-M234 WeakPolarHBondContact OE2-CE 3.34Å; T193-M234 HydrophobicContact CG2-CB 4.24Å; T193-M234 HydrophobicContact CG2-CG 3.74Å; N230-M234 WeakPolarHBondContact O-CB 3.44Å; N230-M234 VanDerWaalsContact O-CG 3.3Å; N230-M234 WeakPolarHBondContact O-CG 3.4Å; N230-M234 PolarHBondContact O-N 3.5Å; M234-T236 PolarHBondContact O-N 3.3Å; M234-L237 PolarHBondContact O-N 2.94Å; M234-T238 WeakPolarHBondContact O-CG2 3.44Å; M234-T238 PolarHBondContact O-N 2.72Å |
| 235 | N | 96.3 | Very high | 94.8 | Very high | 0 Ų | 0 | 10 Ų | 10 | 0% | 0 | 5% | 0.051 | C | C | . | . | H | α-helix | trans | -64.7 | -38.7 | 175 | -76.2 | -64 | 0 | 0 | 0 | 112 | I231 I232 M233 L237 T238 T239 L266 T267 F270 | I231-N235 WeakPolarHBondContact O-CB 3.37Å; I231-N235 PolarHBondContact O-N 3.25Å; I231-N235 VanDerWaalsContact O-N 3.1Å; I231-N235 PolarHBondContact O-ND2 2.83Å; I232-N235 PolarHBondContact O-N 3.29Å; M233-N235 VanDerWaalsContact C-N 3.31Å; M233-N235 PolarHBondContact O-N 3.49Å; N235-L237 VanDerWaalsContact C-N 3.32Å; N235-L237 PolarHBondContact O-N 3.38Å; N235-T238 WeakPolarHBondContact CA-OG1 3.38Å; N235-T238 PolarHBondContact O-N 2.81Å; N235-T238 PolarHBondContact O-OG1 3.1Å; N235-T239 PolarHBondContact O-N 3Å; N235-T239 PolarHBondContact O-OG1 3.41Å; N235-L266 HydrophobicContact CB-CB 4.28Å; N235-L266 WeakPolarHBondContact OD1-CB 3.43Å; N235-T267 HydrophobicContact CB-CG2 3.68Å; N235-F270 WeakPolarHBondContact ND2-CD2 3.43Å; N235-F270 WeakPolarHBondContact OD1-CD1 3.37Å; N235-F270 WeakPolarHBondContact OD1-CE1 3.46Å |
| 236 | T | 95.9 | Very high | 94.4 | Very high | 3 Ų | 3 | 12.9 Ų | 12.9 | 2% | 0.018 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -62.5 | -40.6 | 173.4 | 62.2 | 0 | 0 | 0 | 0 | 111.8 | W86 L89 M91 I232 M233 M234 T239 T240 F259 T263 | W86-T236 HydrophobicContact CH2-CG2 4.11Å; W86-T236 HydrophobicContact CZ3-CG2 4.17Å; L89-T236 WeakPolarHBondContact CD1-OG1 3.48Å; M91-T236 HydrophobicContact CE-CG2 4.34Å; I232-T236 HydrophobicContact CG2-CG2 4.18Å; I232-T236 WeakPolarHBondContact O-CG2 3.33Å; I232-T236 PolarHBondContact O-N 3.03Å; I232-T236 PolarHBondContact O-OG1 3.47Å; M233-T236 WeakPolarHBondContact CA-OG1 3.46Å; M233-T236 PolarHBondContact O-N 3.23Å; M233-T236 VanDerWaalsContact O-N 3.1Å; M233-T236 PolarHBondContact O-OG1 3.2Å; M234-T236 PolarHBondContact O-N 3.3Å; T236-T239 WeakPolarHBondContact CA-OG1 3.3Å; T236-T239 PolarHBondContact O-N 2.99Å; T236-T239 PolarHBondContact O-OG1 3.08Å; T236-T240 WeakPolarHBondContact O-CG2 3.45Å; T236-T240 PolarHBondContact O-N 3.18Å; T236-F259 HydrophobicContact CG2-CE1 4.32Å; T236-F259 WeakPolarHBondContact O-CZ 3.48Å; T236-T263 HydrophobicContact CG2-CG2 3.73Å |
| 237 | L | 96.1 | Very high | 94.2 | Very high | 3 Ų | 3 | 17 Ų | 17 | 2% | 0.016 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -68.9 | -38.2 | 176.1 | -173.8 | 138.5 | 0 | 0 | 0 | 112.4 | L89 I105 W185 M233 M234 N235 T239 T240 I241 | L89-L237 HydrophobicContact CD2-CB 4.25Å; L89-L237 HydrophobicContact CD2-CD1 4.41Å; I105-L237 HydrophobicContact CB-CD1 4.34Å; I105-L237 HydrophobicContact CD1-CD1 3.35Å; I105-L237 HydrophobicContact CG1-CD1 4.42Å; I105-L237 HydrophobicContact CG2-CD1 3.62Å; W185-L237 HydrophobicContact CH2-CD2 3.57Å; W185-L237 HydrophobicContact CZ2-CD2 3.09Å; M233-L237 PolarHBondContact O-N 3.19Å; M234-L237 PolarHBondContact O-N 2.94Å; N235-L237 VanDerWaalsContact C-N 3.32Å; N235-L237 PolarHBondContact O-N 3.38Å; L237-T239 VanDerWaalsContact C-N 3.26Å; L237-T239 PolarHBondContact O-N 2.82Å; L237-T240 WeakPolarHBondContact CA-OG1 3.46Å; L237-T240 PolarHBondContact O-N 3.41Å; L237-T240 PolarHBondContact O-OG1 3.19Å; L237-I241 HydrophobicContact CD2-CD1 3.32Å; L237-I241 HydrophobicContact CD2-CG1 4.4Å; L237-I241 HydrophobicContact CG-CD1 3.9Å; L237-I241 VanDerWaalsContact O-CG1 3.32Å; L237-I241 WeakPolarHBondContact O-CG1 3.42Å; L237-I241 PolarHBondContact O-N 3.33Å |
| 238 | T | 96.9 | Very high | 93.9 | Very high | 4 Ų | 4 | 19.4 Ų | 19.4 | 3% | 0.025 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -61.3 | -38 | 173.7 | 69.1 | 0 | 0 | 0 | 0 | 111.1 | T189 M234 N235 F242 L266 | T189-T238 HydrophobicContact CG2-CG2 4.1Å; M234-T238 WeakPolarHBondContact O-CG2 3.44Å; M234-T238 PolarHBondContact O-N 2.72Å; N235-T238 WeakPolarHBondContact CA-OG1 3.38Å; N235-T238 PolarHBondContact O-N 2.81Å; N235-T238 PolarHBondContact O-OG1 3.1Å; T238-F242 PolarHBondContact O-N 2.99Å; T238-L266 WeakPolarHBondContact OG1-CD1 3.37Å |
| 239 | T | 96.7 | Very high | 93.5 | Very high | 0 Ų | 0 | 21.9 Ų | 21.9 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -70.1 | -37.3 | 175.8 | 52.3 | 0 | 0 | 0 | 0 | 113.1 | N235 T236 L237 I241 L243 G244 F259 K262 T263 L266 | N235-T239 PolarHBondContact O-N 3Å; N235-T239 PolarHBondContact O-OG1 3.41Å; T236-T239 WeakPolarHBondContact CA-OG1 3.3Å; T236-T239 PolarHBondContact O-N 2.99Å; T236-T239 PolarHBondContact O-OG1 3.08Å; L237-T239 VanDerWaalsContact C-N 3.26Å; L237-T239 PolarHBondContact O-N 2.82Å; T239-I241 VanDerWaalsContact C-N 3.32Å; T239-I241 PolarHBondContact O-N 3.26Å; T239-L243 CarbonylContact O-C 3.33Å; T239-L243 WeakPolarHBondContact O-CA 3.42Å; T239-L243 PolarHBondContact O-N 2.86Å; T239-G244 PolarHBondContact O-N 2.91Å; T239-F259 WeakPolarHBondContact OG1-CE2 3.3Å; T239-F259 VanDerWaalsContact OG1-CZ 3.25Å; T239-F259 WeakPolarHBondContact OG1-CZ 3.25Å; T239-K262 HydrophobicContact CG2-CB 3.88Å; T239-T263 HydrophobicContact CG2-CG2 3.57Å; T239-T263 WeakPolarHBondContact OG1-CG2 3.38Å; T239-L266 HydrophobicContact CG2-CD1 3.46Å; T239-L266 VanDerWaalsContact CG2-CD1 3.46Å; T239-L266 HydrophobicContact CG2-CG 4.2Å |
| 240 | T | 95.5 | Very high | 93.2 | Very high | 3 Ų | 3 | 29.7 Ų | 29.7 | 2% | 0.018 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -65.8 | -37.8 | 177.2 | 55.4 | 0 | 0 | 0 | 0 | 111.2 | P90 Q169 T236 L237 F259 | P90-T240 HydrophobicContact CG-CG2 4.03Å; Q169-T240 PolarHBondContact NE2-O 3.21Å; T236-T240 WeakPolarHBondContact O-CG2 3.45Å; T236-T240 PolarHBondContact O-N 3.18Å; L237-T240 WeakPolarHBondContact CA-OG1 3.46Å; L237-T240 PolarHBondContact O-N 3.41Å; L237-T240 PolarHBondContact O-OG1 3.19Å; T240-F259 HydrophobicContact CG2-CE2 3.43Å; T240-F259 VanDerWaalsContact CG2-CE2 3.43Å; T240-F259 HydrophobicContact CG2-CZ 3.59Å |
| 241 | I | 95.7 | Very high | 93 | Very high | 1 Ų | 1 | 29.7 Ų | 29.7 | 1% | 0.005 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -77.9 | -43.1 | -176.5 | -63.5 | 167.8 | 0 | 0 | 0 | 112.5 | L102 L150 T153 L165 Q169 L174 W185 L237 T239 | L102-I241 HydrophobicContact CD1-CD1 4.43Å; L150-I241 HydrophobicContact CD2-CD1 3.36Å; L150-I241 HydrophobicContact CD2-CG1 4.49Å; T153-I241 HydrophobicContact CG2-CG2 4.32Å; L165-I241 HydrophobicContact CD1-CG1 4.1Å; Q169-I241 PolarHBondContact NE2-O 3.42Å; L174-I241 VanDerWaalsContact CB-O 3.25Å; L174-I241 WeakPolarHBondContact CB-O 3.32Å; L174-I241 HydrophobicContact CD2-CG2 4.45Å; W185-I241 HydrophobicContact CH2-CD1 4.41Å; W185-I241 HydrophobicContact CZ2-CD1 4.18Å; L237-I241 HydrophobicContact CD2-CD1 3.32Å; L237-I241 HydrophobicContact CD2-CG1 4.4Å; L237-I241 HydrophobicContact CG-CD1 3.9Å; L237-I241 VanDerWaalsContact O-CG1 3.32Å; L237-I241 WeakPolarHBondContact O-CG1 3.42Å; L237-I241 PolarHBondContact O-N 3.33Å; T239-I241 VanDerWaalsContact C-N 3.32Å; T239-I241 PolarHBondContact O-N 3.26Å |
| 242 | F | 96.4 | Very high | 92.9 | Very high | 6 Ų | 6 | 31.9 Ų | 31.9 | 3% | 0.026 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -111.2 | -27.1 | -170 | -65.9 | -72.4 | 0 | 0 | 0 | 114.7 | T153 L174 L175 S178 A182 W185 T238 | T153-F242 HydrophobicContact CG2-CE1 3.7Å; T153-F242 HydrophobicContact CG2-CZ 3.71Å; L174-F242 PolarHBondContact N-O 2.72Å; L175-F242 HydrophobicContact CB-CB 4.14Å; L175-F242 WeakPolarHBondContact CB-O 3.24Å; L175-F242 PolarHBondContact N-O 2.81Å; L175-F242 VanDerWaalsContact N-O 3.1Å; S178-F242 WeakPolarHBondContact OG-CE1 3.42Å; A182-F242 HydrophobicContact CB-CD1 3.54Å; A182-F242 HydrophobicContact CB-CD2 4.31Å; A182-F242 HydrophobicContact CB-CE1 3.59Å; A182-F242 HydrophobicContact CB-CE2 4.37Å; A182-F242 HydrophobicContact CB-CG 3.9Å; A182-F242 HydrophobicContact CB-CZ 4.02Å; W185-F242 HydrophobicContact CB-CE2 3.78Å; W185-F242 HydrophobicContact CB-CZ 3.99Å; W185-F242 AromaticContact CD1-CD2 3.93Å; W185-F242 AromaticContact CD1-CE2 3.37Å; W185-F242 HydrophobicContact CD2-CE2 4.01Å; W185-F242 HydrophobicContact CG-CD2 4.36Å; W185-F242 AromaticContact CG-CE2 3.4Å; W185-F242 HydrophobicContact CG-CE2 3.4Å; W185-F242 HydrophobicContact CG-CZ 4.05Å; W185-F242 AromaticContact NE1-CE2 3.93Å; T238-F242 PolarHBondContact O-N 2.99Å |
| 243 | L | 95.2 | Very high | 92.7 | Very high | 28 Ų | 28 | 38.1 Ų | 38.1 | 15% | 0.147 | 21% | 0.211 | C | C | . | . | S | Bend | trans | -127 | 44 | -169.1 | -64.5 | 174.8 | 0 | 0 | 0 | 112 | W173 L175 T239 K262 L266 | W173-L243 HydrophobicContact CD2-CD2 4.3Å; W173-L243 HydrophobicContact CE3-CD2 3.86Å; W173-L243 HydrophobicContact CZ3-CD2 4.31Å; L175-L243 HydrophobicContact CB-CD2 4.25Å; L175-L243 HydrophobicContact CD1-CD2 3.93Å; L175-L243 HydrophobicContact CD1-CG 4.36Å; T239-L243 CarbonylContact O-C 3.33Å; T239-L243 WeakPolarHBondContact O-CA 3.42Å; T239-L243 PolarHBondContact O-N 2.86Å; L243-K262 HydrophobicContact CB-CD 4.11Å; L243-K262 WeakPolarHBondContact O-CD 3.42Å; L243-K262 PolarHBondContact O-NZ 3.22Å; L243-L266 HydrophobicContact CD1-CD1 4.18Å; L243-L266 HydrophobicContact CD1-CD2 4.35Å; L243-L266 HydrophobicContact CD1-CG 4.47Å |
| 244 | G | 89 | Confident | 92.5 | Very high | 1 Ų | 1 | 42.3 Ų | 42.3 | 1% | 0.01 | 23% | 0.233 | C | C | . | . | trans | -52.1 | 152.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | W173 T239 K262 | W173-G244 PolarHBondContact NE1-O 3.42Å; T239-G244 PolarHBondContact O-N 2.91Å; G244-K262 PolarHBondContact O-NZ 3.08Å | ||
| 245 | T | 90.2 | Very high | 92.5 | Very high | 8 Ų | 8 | 41.9 Ų | 41.9 | 5% | 0.049 | 23% | 0.231 | C | C | . | . | trans | -111.9 | 145.8 | 177.7 | 42.1 | 0 | 0 | 0 | 0 | 108.9 | Y247 Y255 K262 | T245-Y247 PolarHBondContact O-N 3.15Å; T245-Y255 WeakPolarHBondContact O-CE2 3.24Å; T245-Y255 WeakPolarHBondContact OG1-CD2 3.2Å; T245-Y255 WeakPolarHBondContact OG1-CE2 3.16Å; T245-Y255 VanDerWaalsContact OG1-CZ 3.25Å; T245-K262 HydrophobicContact CG2-CD 3.95Å | ||
| 246 | T | 86.2 | Confident | 92.4 | Very high | 94 Ų | 94 | 44.1 Ų | 44.1 | 58% | 0.577 | 25% | 0.245 | S | C | * | . | trans | -62.8 | 131 | 175.3 | 49 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 247 | Y | 88.3 | Confident | 92.3 | Very high | 92 Ų | 92 | 47.6 Ų | 47.6 | 36% | 0.361 | 27% | 0.266 | S | S | . | . | trans | -94.1 | 119.2 | 177.8 | 175.5 | -108.4 | 0 | 0 | 0 | 109.7 | P92 T245 A249 P252 Y255 | P92-Y247 HydrophobicContact CB-CD2 3.66Å; P92-Y247 HydrophobicContact CB-CE2 3.67Å; P92-Y247 HydrophobicContact CG-CD2 4.08Å; P92-Y247 HydrophobicContact CG-CE2 3.7Å; T245-Y247 PolarHBondContact O-N 3.15Å; Y247-A249 HydrophobicContact CE1-CB 4.05Å; Y247-P252 HydrophobicContact CE2-CB 4.43Å; Y247-Y255 HydrophobicContact CD2-CD2 4.38Å | ||
| 248 | D | 87.1 | Confident | 92.3 | Very high | 82 Ų | 82 | 53.6 Ų | 53.6 | 44% | 0.439 | 29% | 0.289 | S | S | . | . | trans | -105.9 | 120.5 | 167.2 | -170 | -10 | 0 | 0 | 0 | 108.7 | L250 S251 | D248-L250 PolarHBondContact O-N 2.64Å; D248-L250 PolarHBondContact OD1-N 3.39Å; D248-S251 CarbonylContact O-C 3Å; D248-S251 PolarHBondContact O-N 2.94Å | ||
| 249 | A | 85.9 | Confident | 92.2 | Very high | 72 Ų | 72 | 53.5 Ų | 53.5 | 60% | 0.595 | 29% | 0.288 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.2 | -26 | -176 | 0 | 0 | 0 | 0 | 0 | 112.9 | Y247 | Y247-A249 HydrophobicContact CE1-CB 4.05Š|
| 250 | L | 89.7 | Confident | 92.2 | Very high | 163 Ų | 163 | 56.6 Ų | 56.6 | 85% | 0.853 | 31% | 0.307 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.4 | -26.8 | 179.5 | -68.3 | 168.9 | 0 | 0 | 0 | 112.4 | D248 | D248-L250 PolarHBondContact O-N 2.64Å; D248-L250 PolarHBondContact OD1-N 3.39Å |
| 251 | S | 91 | Very high | 92.2 | Very high | 32 Ų | 32 | 60 Ų | 60 | 22% | 0.224 | 33% | 0.328 | C | S | . | . | trans | -139 | 74.7 | -175.4 | 58.5 | 0 | 0 | 0 | 0 | 111.3 | D248 E253 L254 | D248-S251 CarbonylContact O-C 3Å; D248-S251 PolarHBondContact O-N 2.94Å; S251-E253 PolarHBondContact O-N 3.28Å; S251-E253 VanDerWaalsContact O-N 3.13Å; S251-L254 PolarHBondContact O-N 2.67Å; S251-L254 VanDerWaalsContact O-N 3.1Å; S251-L254 VanDerWaalsContact OG-CD1 3.31Å; S251-L254 WeakPolarHBondContact OG-CD1 3.34Å | ||
| 252 | P | 91 | Very high | 92.3 | Very high | 50 Ų | 50 | 61.6 Ų | 61.6 | 33% | 0.325 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -62.1 | -22.1 | 179.2 | 25.8 | -34.8 | 0 | 0 | 0 | 112.8 | P92 Y247 L254 Y255 T256 | P92-P252 HydrophobicContact CG-CB 3.86Å; Y247-P252 HydrophobicContact CE2-CB 4.43Å; P252-L254 VanDerWaalsContact C-N 3.29Å; P252-L254 PolarHBondContact O-N 2.78Å; P252-Y255 WeakPolarHBondContact O-CB 3.36Å; P252-Y255 PolarHBondContact O-N 3.33Å; P252-T256 PolarHBondContact O-N 3.15Å |
| 253 | E | 92.4 | Very high | 92.3 | Very high | 150 Ų | 150 | 61.8 Ų | 61.8 | 70% | 0.701 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -65.2 | -29.5 | 176.8 | -62 | 169.8 | -173.1 | 0 | 0 | 112.8 | S251 Y255 T256 T257 | S251-E253 PolarHBondContact O-N 3.28Å; S251-E253 VanDerWaalsContact O-N 3.13Å; E253-Y255 VanDerWaalsContact C-N 3.33Å; E253-T256 WeakPolarHBondContact CA-OG1 3.27Å; E253-T256 PolarHBondContact O-N 3.14Å; E253-T256 PolarHBondContact O-OG1 2.9Å; E253-T257 WeakPolarHBondContact O-CG2 3.18Å; E253-T257 PolarHBondContact O-N 2.87Å; E253-T257 PolarHBondContact O-OG1 2.92Å |
| 254 | L | 92.9 | Very high | 92.3 | Very high | 87 Ų | 87 | 65.4 Ų | 65.4 | 46% | 0.455 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -67.6 | -38.6 | 174.3 | -66.9 | -176.7 | 0 | 0 | 0 | 110.9 | S251 P252 T257 Y258 | S251-L254 PolarHBondContact O-N 2.67Å; S251-L254 VanDerWaalsContact O-N 3.1Å; S251-L254 VanDerWaalsContact OG-CD1 3.31Å; S251-L254 WeakPolarHBondContact OG-CD1 3.34Å; P252-L254 VanDerWaalsContact C-N 3.29Å; P252-L254 PolarHBondContact O-N 2.78Å; L254-T257 WeakPolarHBondContact CA-OG1 3.24Å; L254-T257 PolarHBondContact O-OG1 3.49Å; L254-Y258 HydrophobicContact CB-CE2 4.34Å; L254-Y258 WeakPolarHBondContact O-CD2 3.1Å; L254-Y258 PolarHBondContact O-N 3.3Å; L254-Y258 VanDerWaalsContact O-N 3.12Å |
| 255 | Y | 93.8 | Very high | 92.7 | Very high | 1 Ų | 1 | 70.6 Ų | 70.6 | 0% | 0.004 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -60.3 | -49.8 | 174.2 | -178.9 | -80.4 | 0 | 0 | 0 | 110.7 | P92 I166 T245 Y247 P252 E253 T257 Y258 F259 | P92-Y255 HydrophobicContact CB-CD1 3.59Å; P92-Y255 HydrophobicContact CB-CD2 4.38Å; P92-Y255 HydrophobicContact CB-CE1 3.98Å; P92-Y255 HydrophobicContact CB-CG 3.85Å; P92-Y255 HydrophobicContact CG-CD1 4.18Å; P92-Y255 HydrophobicContact CG-CG 4.4Å; I166-Y255 HydrophobicContact CD1-CE1 4.4Å; I166-Y255 HydrophobicContact CD1-CE2 3.92Å; I166-Y255 VanDerWaalsContact CD1-OH 3.26Å; I166-Y255 WeakPolarHBondContact CD1-OH 3.38Å; I166-Y255 HydrophobicContact CG1-CE2 4.17Å; I166-Y255 WeakPolarHBondContact CG1-OH 3.39Å; I166-Y255 HydrophobicContact CG2-CE2 3.72Å; T245-Y255 WeakPolarHBondContact O-CE2 3.24Å; T245-Y255 WeakPolarHBondContact OG1-CD2 3.2Å; T245-Y255 WeakPolarHBondContact OG1-CE2 3.16Å; T245-Y255 VanDerWaalsContact OG1-CZ 3.25Å; Y247-Y255 HydrophobicContact CD2-CD2 4.38Å; P252-Y255 WeakPolarHBondContact O-CB 3.36Å; P252-Y255 PolarHBondContact O-N 3.33Å; E253-Y255 VanDerWaalsContact C-N 3.33Å; Y255-T257 VanDerWaalsContact C-N 3.35Å; Y255-T257 PolarHBondContact O-N 3.44Å; Y255-Y258 PolarHBondContact O-N 3.14Å; Y255-F259 HydrophobicContact CD1-CB 4.33Å; Y255-F259 HydrophobicContact CE1-CB 4.08Å; Y255-F259 HydrophobicContact CE1-CD2 4.32Å; Y255-F259 HydrophobicContact CE1-CG 4.24Å; Y255-F259 WeakPolarHBondContact O-CB 3.24Å; Y255-F259 PolarHBondContact O-N 3.43Å |
| 256 | T | 94.5 | Very high | 93 | Very high | 47 Ų | 47 | 71.2 Ų | 71.2 | 29% | 0.288 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -63.4 | -40.6 | -177.1 | 59.7 | 0 | 0 | 0 | 0 | 111.9 | P92 P252 E253 F259 V260 | P92-T256 VanDerWaalsContact CD-CG2 3.44Å; P252-T256 PolarHBondContact O-N 3.15Å; E253-T256 WeakPolarHBondContact CA-OG1 3.27Å; E253-T256 PolarHBondContact O-N 3.14Å; E253-T256 PolarHBondContact O-OG1 2.9Å; T256-F259 PolarHBondContact O-N 3.15Å; T256-V260 VanDerWaalsContact O-CB 3.31Å; T256-V260 WeakPolarHBondContact O-CB 3.48Å; T256-V260 WeakPolarHBondContact O-CG2 3.33Å; T256-V260 PolarHBondContact O-N 3.24Å |
| 257 | T | 94.4 | Very high | 93.4 | Very high | 75 Ų | 75 | 67.2 Ų | 67.2 | 46% | 0.46 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -64 | -49.4 | 178.1 | 51.2 | 0 | 0 | 0 | 0 | 112 | E253 L254 Y255 F259 V260 T261 | E253-T257 WeakPolarHBondContact O-CG2 3.18Å; E253-T257 PolarHBondContact O-N 2.87Å; E253-T257 PolarHBondContact O-OG1 2.92Å; L254-T257 WeakPolarHBondContact CA-OG1 3.24Å; L254-T257 PolarHBondContact O-OG1 3.49Å; Y255-T257 VanDerWaalsContact C-N 3.35Å; Y255-T257 PolarHBondContact O-N 3.44Å; T257-F259 PolarHBondContact O-N 3.42Å; T257-V260 PolarHBondContact O-N 2.89Å; T257-T261 WeakPolarHBondContact O-CG2 3.49Å; T257-T261 PolarHBondContact O-N 2.82Å; T257-T261 PolarHBondContact O-OG1 3.26Å |
| 258 | Y | 95.1 | Very high | 93.7 | Very high | 130 Ų | 130 | 64.9 Ų | 64.9 | 51% | 0.51 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -63.3 | -42.7 | 176.8 | -68.6 | -53.8 | 0 | 0 | 0 | 112 | L254 Y255 V260 T261 K262 | L254-Y258 HydrophobicContact CB-CE2 4.34Å; L254-Y258 WeakPolarHBondContact O-CD2 3.1Å; L254-Y258 PolarHBondContact O-N 3.3Å; L254-Y258 VanDerWaalsContact O-N 3.12Å; Y255-Y258 PolarHBondContact O-N 3.14Å; Y258-V260 PolarHBondContact O-N 3.38Å; Y258-T261 PolarHBondContact O-N 3.02Å; Y258-T261 PolarHBondContact O-OG1 3.06Å; Y258-K262 WeakPolarHBondContact O-CG 3.38Å; Y258-K262 PolarHBondContact O-N 3.36Å; Y258-K262 VanDerWaalsContact O-N 3.08Å |
| 259 | F | 95.8 | Very high | 94 | Very high | 1 Ų | 1 | 64.1 Ų | 64.1 | 0% | 0.004 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -58.7 | -48.5 | 176.9 | -178 | -99.6 | 0 | 0 | 0 | 111.4 | M91 T236 T239 T240 Y255 T256 T257 T261 K262 T263 | M91-F259 HydrophobicContact CE-CE1 4.04Å; M91-F259 HydrophobicContact CG-CD1 4.33Å; M91-F259 HydrophobicContact CG-CE1 4.06Å; M91-F259 HydrophobicContact SD-CE1 4.33Å; T236-F259 HydrophobicContact CG2-CE1 4.32Å; T236-F259 WeakPolarHBondContact O-CZ 3.48Å; T239-F259 WeakPolarHBondContact OG1-CE2 3.3Å; T239-F259 VanDerWaalsContact OG1-CZ 3.25Å; T239-F259 WeakPolarHBondContact OG1-CZ 3.25Å; T240-F259 HydrophobicContact CG2-CE2 3.43Å; T240-F259 VanDerWaalsContact CG2-CE2 3.43Å; T240-F259 HydrophobicContact CG2-CZ 3.59Å; Y255-F259 HydrophobicContact CD1-CB 4.33Å; Y255-F259 HydrophobicContact CE1-CB 4.08Å; Y255-F259 HydrophobicContact CE1-CD2 4.32Å; Y255-F259 HydrophobicContact CE1-CG 4.24Å; Y255-F259 WeakPolarHBondContact O-CB 3.24Å; Y255-F259 PolarHBondContact O-N 3.43Å; T256-F259 PolarHBondContact O-N 3.15Å; T257-F259 PolarHBondContact O-N 3.42Å; F259-T261 PolarHBondContact O-N 3.4Å; F259-K262 PolarHBondContact O-N 2.98Å; F259-T263 HydrophobicContact CD1-CG2 4.27Å; F259-T263 HydrophobicContact CE1-CG2 3.9Å; F259-T263 HydrophobicContact CE2-CG2 4.49Å; F259-T263 HydrophobicContact CZ-CG2 4.02Å; F259-T263 WeakPolarHBondContact O-CG2 3.28Å; F259-T263 PolarHBondContact O-N 3.16Å; F259-T263 PolarHBondContact O-OG1 3.38Å |
| 260 | V | 95.5 | Very high | 94.4 | Very high | 65 Ų | 65 | 61.1 Ų | 61.1 | 39% | 0.394 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -63.1 | -39.5 | 178 | 171 | 0 | 0 | 0 | 0 | 111.9 | T256 T257 Y258 K262 T263 L264 | T256-V260 VanDerWaalsContact O-CB 3.31Å; T256-V260 WeakPolarHBondContact O-CB 3.48Å; T256-V260 WeakPolarHBondContact O-CG2 3.33Å; T256-V260 PolarHBondContact O-N 3.24Å; T257-V260 PolarHBondContact O-N 2.89Å; Y258-V260 PolarHBondContact O-N 3.38Å; V260-K262 VanDerWaalsContact C-N 3.33Å; V260-K262 PolarHBondContact O-N 3.15Å; V260-T263 WeakPolarHBondContact CA-OG1 3.33Å; V260-T263 PolarHBondContact O-N 2.65Å; V260-T263 PolarHBondContact O-OG1 3.04Å; V260-L264 HydrophobicContact CG1-CD1 3.91Å; V260-L264 HydrophobicContact CG1-CG 4.28Å; V260-L264 WeakPolarHBondContact O-CB 3.19Å; V260-L264 VanDerWaalsContact O-CG 3.27Å; V260-L264 WeakPolarHBondContact O-CG 3.05Å; V260-L264 PolarHBondContact O-N 3.2Å |
| 261 | T | 96.1 | Very high | 94.6 | Very high | 75 Ų | 75 | 53.7 Ų | 53.7 | 46% | 0.46 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -63.3 | -40.1 | 176.3 | 59.8 | 0 | 0 | 0 | 0 | 112.1 | T257 Y258 F259 L264 L265 | T257-T261 WeakPolarHBondContact O-CG2 3.49Å; T257-T261 PolarHBondContact O-N 2.82Å; T257-T261 PolarHBondContact O-OG1 3.26Å; Y258-T261 PolarHBondContact O-N 3.02Å; Y258-T261 PolarHBondContact O-OG1 3.06Å; F259-T261 PolarHBondContact O-N 3.4Å; T261-L264 PolarHBondContact O-N 3.46Å; T261-L265 WeakPolarHBondContact O-CG 3.25Å; T261-L265 PolarHBondContact O-N 3.27Å |
| 262 | K | 96.9 | Very high | 94.7 | Very high | 34 Ų | 34 | 58.9 Ų | 58.9 | 15% | 0.148 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -66.3 | -40.7 | 176.6 | -67.6 | 179.3 | -177.8 | -168.7 | 0 | 111.9 | T239 L243 G244 T245 Y258 F259 V260 L265 L266 | T239-K262 HydrophobicContact CG2-CB 3.88Å; L243-K262 HydrophobicContact CB-CD 4.11Å; L243-K262 WeakPolarHBondContact O-CD 3.42Å; L243-K262 PolarHBondContact O-NZ 3.22Å; G244-K262 PolarHBondContact O-NZ 3.08Å; T245-K262 HydrophobicContact CG2-CD 3.95Å; Y258-K262 WeakPolarHBondContact O-CG 3.38Å; Y258-K262 PolarHBondContact O-N 3.36Å; Y258-K262 VanDerWaalsContact O-N 3.08Å; F259-K262 PolarHBondContact O-N 2.98Å; V260-K262 VanDerWaalsContact C-N 3.33Å; V260-K262 PolarHBondContact O-N 3.15Å; K262-L265 PolarHBondContact O-N 3.33Å; K262-L266 PolarHBondContact O-N 2.89Å |
| 263 | T | 96.6 | Very high | 94.9 | Very high | 10 Ų | 10 | 57.7 Ų | 57.7 | 6% | 0.061 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -67.3 | -38.4 | 177.2 | 57.8 | 0 | 0 | 0 | 0 | 111.9 | T236 T239 F259 V260 L265 L266 T267 | T236-T263 HydrophobicContact CG2-CG2 3.73Å; T239-T263 HydrophobicContact CG2-CG2 3.57Å; T239-T263 WeakPolarHBondContact OG1-CG2 3.38Å; F259-T263 HydrophobicContact CD1-CG2 4.27Å; F259-T263 HydrophobicContact CE1-CG2 3.9Å; F259-T263 HydrophobicContact CE2-CG2 4.49Å; F259-T263 HydrophobicContact CZ-CG2 4.02Å; F259-T263 WeakPolarHBondContact O-CG2 3.28Å; F259-T263 PolarHBondContact O-N 3.16Å; F259-T263 PolarHBondContact O-OG1 3.38Å; V260-T263 WeakPolarHBondContact CA-OG1 3.33Å; V260-T263 PolarHBondContact O-N 2.65Å; V260-T263 PolarHBondContact O-OG1 3.04Å; T263-L265 VanDerWaalsContact C-N 3.31Å; T263-L265 PolarHBondContact O-N 3.36Å; T263-L266 PolarHBondContact O-N 2.94Å; T263-T267 WeakPolarHBondContact O-CG2 3.01Å; T263-T267 PolarHBondContact O-N 2.99Å; T263-T267 PolarHBondContact O-OG1 3.47Å |
| 264 | L | 96.5 | Very high | 94.8 | Very high | 105 Ų | 105 | 53.9 Ų | 53.9 | 55% | 0.55 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -63 | -37.5 | 173.1 | -72.1 | 173.6 | 0 | 0 | 0 | 112.1 | V260 T261 T267 S268 | V260-L264 HydrophobicContact CG1-CD1 3.91Å; V260-L264 HydrophobicContact CG1-CG 4.28Å; V260-L264 WeakPolarHBondContact O-CB 3.19Å; V260-L264 VanDerWaalsContact O-CG 3.27Å; V260-L264 WeakPolarHBondContact O-CG 3.05Å; V260-L264 PolarHBondContact O-N 3.2Å; T261-L264 PolarHBondContact O-N 3.46Å; L264-T267 VanDerWaalsContact CA-OG1 3.28Å; L264-T267 WeakPolarHBondContact CA-OG1 3.42Å; L264-T267 PolarHBondContact O-OG1 3.41Å; L264-S268 WeakPolarHBondContact O-CB 3.25Å; L264-S268 PolarHBondContact O-N 2.86Å |
| 265 | L | 96.5 | Very high | 94.7 | Very high | 110 Ų | 110 | 51.9 Ų | 51.9 | 58% | 0.576 | 26% | 0.264 | S | S | * | . | H | α-helix | trans | -64.8 | -47.2 | 173.5 | -72.2 | 169 | 0 | 0 | 0 | 111.6 | T261 K262 T263 S268 L269 | T261-L265 WeakPolarHBondContact O-CG 3.25Å; T261-L265 PolarHBondContact O-N 3.27Å; K262-L265 PolarHBondContact O-N 3.33Å; T263-L265 VanDerWaalsContact C-N 3.31Å; T263-L265 PolarHBondContact O-N 3.36Å; L265-S268 PolarHBondContact O-N 3.02Å; L265-S268 PolarHBondContact O-OG 2.94Å; L265-L269 PolarHBondContact O-N 2.87Å |
| 266 | L | 96.1 | Very high | 94.6 | Very high | 21 Ų | 21 | 54.4 Ų | 54.4 | 11% | 0.11 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -65.3 | -40.1 | 178.2 | -67.5 | -173.4 | 0 | 0 | 0 | 113 | F186 N235 T238 T239 L243 K262 T263 S268 L269 F270 | F186-L266 HydrophobicContact CE2-CD2 4.26Å; N235-L266 HydrophobicContact CB-CB 4.28Å; N235-L266 WeakPolarHBondContact OD1-CB 3.43Å; T238-L266 WeakPolarHBondContact OG1-CD1 3.37Å; T239-L266 HydrophobicContact CG2-CD1 3.46Å; T239-L266 VanDerWaalsContact CG2-CD1 3.46Å; T239-L266 HydrophobicContact CG2-CG 4.2Å; L243-L266 HydrophobicContact CD1-CD1 4.18Å; L243-L266 HydrophobicContact CD1-CD2 4.35Å; L243-L266 HydrophobicContact CD1-CG 4.47Å; K262-L266 PolarHBondContact O-N 2.89Å; T263-L266 PolarHBondContact O-N 2.94Å; L266-S268 VanDerWaalsContact C-N 3.3Å; L266-S268 PolarHBondContact O-N 3.24Å; L266-L269 HydrophobicContact CD2-CD1 3.92Å; L266-L269 WeakPolarHBondContact O-CB 3.4Å; L266-L269 PolarHBondContact O-N 3.2Å; L266-L269 VanDerWaalsContact O-N 3.11Å; L266-F270 PolarHBondContact O-N 2.85Å |
| 267 | T | 95.5 | Very high | 94.4 | Very high | 9 Ų | 9 | 59 Ų | 59 | 6% | 0.055 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -63.1 | -37.3 | 173.1 | 53.2 | 0 | 0 | 0 | 0 | 111.5 | L20 N235 T263 L264 L269 F270 L271 | L20-T267 HydrophobicContact CD1-CG2 4.39Å; N235-T267 HydrophobicContact CB-CG2 3.68Å; T263-T267 WeakPolarHBondContact O-CG2 3.01Å; T263-T267 PolarHBondContact O-N 2.99Å; T263-T267 PolarHBondContact O-OG1 3.47Å; L264-T267 VanDerWaalsContact CA-OG1 3.28Å; L264-T267 WeakPolarHBondContact CA-OG1 3.42Å; L264-T267 PolarHBondContact O-OG1 3.41Å; T267-L269 VanDerWaalsContact C-N 3.31Å; T267-L269 PolarHBondContact O-N 3.43Å; T267-F270 WeakPolarHBondContact O-CB 3.33Å; T267-F270 PolarHBondContact O-N 2.71Å; T267-L271 WeakPolarHBondContact O-CG 3.35Å; T267-L271 PolarHBondContact O-N 3.46Å; T267-L271 VanDerWaalsContact O-N 3.1Å |
| 268 | S | 94 | Very high | 94.2 | Very high | 44 Ų | 44 | 60.4 Ų | 60.4 | 31% | 0.308 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -65.1 | -33.7 | 173.1 | 79.6 | 0 | 0 | 0 | 0 | 112.8 | L264 L265 L266 L271 W272 | L264-S268 WeakPolarHBondContact O-CB 3.25Å; L264-S268 PolarHBondContact O-N 2.86Å; L265-S268 PolarHBondContact O-N 3.02Å; L265-S268 PolarHBondContact O-OG 2.94Å; L266-S268 VanDerWaalsContact C-N 3.3Å; L266-S268 PolarHBondContact O-N 3.24Å; S268-L271 PolarHBondContact O-N 3.5Å; S268-W272 WeakPolarHBondContact O-CB 3.27Å; S268-W272 PolarHBondContact O-N 3.48Å |
| 269 | L | 94.9 | Very high | 93.8 | Very high | 65 Ų | 65 | 58.7 Ų | 58.7 | 34% | 0.34 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -66.5 | -41 | 172.4 | -70.3 | 172.1 | 0 | 0 | 0 | 111.6 | F186 L265 L266 T267 L271 W272 I273 | F186-L269 HydrophobicContact CZ-CB 4.12Å; L265-L269 PolarHBondContact O-N 2.87Å; L266-L269 HydrophobicContact CD2-CD1 3.92Å; L266-L269 WeakPolarHBondContact O-CB 3.4Å; L266-L269 PolarHBondContact O-N 3.2Å; L266-L269 VanDerWaalsContact O-N 3.11Å; T267-L269 VanDerWaalsContact C-N 3.31Å; T267-L269 PolarHBondContact O-N 3.43Å; L269-L271 VanDerWaalsContact C-N 3.29Å; L269-L271 PolarHBondContact O-N 3.18Å; L269-W272 HydrophobicContact CD2-CE3 3.78Å; L269-W272 HydrophobicContact CD2-CZ3 4.18Å; L269-W272 PolarHBondContact O-N 3.27Å; L269-I273 WeakPolarHBondContact O-CB 3.47Å; L269-I273 VanDerWaalsContact O-CG1 3.25Å; L269-I273 WeakPolarHBondContact O-CG1 3.3Å; L269-I273 PolarHBondContact O-N 3.4Å |
| 270 | F | 93.5 | Very high | 93.2 | Very high | 9 Ų | 9 | 62.4 Ų | 62.4 | 4% | 0.039 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -55.3 | -45.8 | 172 | -94.5 | 42 | 0 | 0 | 0 | 111.4 | F186 L190 I231 N235 L266 T267 I273 R274 | F186-F270 AromaticContact CD2-CE1 3.94Å; F186-F270 HydrophobicContact CD2-CE1 3.94Å; F186-F270 HydrophobicContact CE1-CD1 4.37Å; F186-F270 HydrophobicContact CE1-CE1 4.26Å; F186-F270 AromaticContact CE2-CD1 3.65Å; F186-F270 HydrophobicContact CE2-CD1 3.65Å; F186-F270 AromaticContact CE2-CE1 3.34Å; F186-F270 HydrophobicContact CE2-CE1 3.34Å; F186-F270 AromaticContact CZ-CD1 3.48Å; F186-F270 HydrophobicContact CZ-CD1 3.48Å; F186-F270 VanDerWaalsContact CZ-CD1 3.48Å; F186-F270 AromaticContact CZ-CE1 3.53Å; F186-F270 HydrophobicContact CZ-CE1 3.53Å; L190-F270 HydrophobicContact CB-CZ 4.46Å; L190-F270 HydrophobicContact CD2-CB 4.45Å; L190-F270 HydrophobicContact CD2-CD1 3.74Å; L190-F270 HydrophobicContact CD2-CD2 3.8Å; L190-F270 HydrophobicContact CD2-CE1 3.81Å; L190-F270 HydrophobicContact CD2-CE2 3.89Å; L190-F270 HydrophobicContact CD2-CG 3.73Å; L190-F270 HydrophobicContact CD2-CZ 3.89Å; L190-F270 HydrophobicContact CG-CD1 4.1Å; L190-F270 HydrophobicContact CG-CE1 3.69Å; L190-F270 HydrophobicContact CG-CE2 4.24Å; L190-F270 HydrophobicContact CG-CZ 3.77Å; I231-F270 HydrophobicContact CG2-CD2 3.85Å; I231-F270 HydrophobicContact CG2-CE2 4.41Å; N235-F270 WeakPolarHBondContact ND2-CD2 3.43Å; N235-F270 WeakPolarHBondContact OD1-CD1 3.37Å; N235-F270 WeakPolarHBondContact OD1-CE1 3.46Å; L266-F270 PolarHBondContact O-N 2.85Å; T267-F270 WeakPolarHBondContact O-CB 3.33Å; T267-F270 PolarHBondContact O-N 2.71Å; F270-I273 PolarHBondContact O-N 3.04Å; F270-R274 PolarHBondContact O-N 3.3Å |
| 271 | L | 93.6 | Very high | 92.8 | Very high | 7 Ų | 7 | 66.4 Ų | 66.4 | 4% | 0.037 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -67.1 | -36.8 | 178.6 | -63.2 | 176.1 | 0 | 0 | 0 | 112.3 | E24 I27 T267 S268 L269 R274 T275 | E24-L271 HydrophobicContact CB-CD1 4.28Å; E24-L271 HydrophobicContact CB-CD2 3.68Å; E24-L271 HydrophobicContact CG-CD2 3.74Å; I27-L271 HydrophobicContact CD1-CD1 3.62Å; I27-L271 HydrophobicContact CG2-CB 4.21Å; T267-L271 WeakPolarHBondContact O-CG 3.35Å; T267-L271 PolarHBondContact O-N 3.46Å; T267-L271 VanDerWaalsContact O-N 3.1Å; S268-L271 PolarHBondContact O-N 3.5Å; L269-L271 VanDerWaalsContact C-N 3.29Å; L269-L271 PolarHBondContact O-N 3.18Å; L271-R274 PolarHBondContact O-N 2.99Å; L271-T275 PolarHBondContact O-N 3.38Å |
| 272 | W | 94.2 | Very high | 92.2 | Very high | 141 Ų | 141 | 66 Ų | 66 | 53% | 0.534 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -66.1 | -45.9 | 176 | -178.6 | 34.3 | 0 | 0 | 0 | 112 | M31 S268 L269 R274 T275 A276 | M31-W272 HydrophobicContact CE-CB 3.72Å; M31-W272 HydrophobicContact CE-CG 3.73Å; M31-W272 HydrophobicContact SD-CB 4.46Å; M31-W272 HydrophobicContact SD-CG 4.47Å; S268-W272 WeakPolarHBondContact O-CB 3.27Å; S268-W272 PolarHBondContact O-N 3.48Å; L269-W272 HydrophobicContact CD2-CE3 3.78Å; L269-W272 HydrophobicContact CD2-CZ3 4.18Å; L269-W272 PolarHBondContact O-N 3.27Å; W272-R274 PolarHBondContact O-N 3.12Å; W272-T275 PolarHBondContact O-N 3Å; W272-T275 PolarHBondContact O-OG1 3.2Å; W272-A276 PolarHBondContact O-N 2.66Å; W272-A276 VanDerWaalsContact O-N 3.11Å |
| 273 | I | 94 | Very high | 91.8 | Very high | 25 Ų | 25 | 67.7 Ų | 67.7 | 13% | 0.128 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -57.8 | -39.6 | 178.5 | -72.5 | 168.7 | 0 | 0 | 0 | 110.9 | F186 L190 L269 F270 T275 A276 Y277 | F186-I273 HydrophobicContact CE1-CD1 3.43Å; F186-I273 VanDerWaalsContact CE1-CD1 3.43Å; F186-I273 HydrophobicContact CZ-CD1 4.02Å; L190-I273 HydrophobicContact CD1-CD1 3.87Å; L190-I273 HydrophobicContact CD1-CG2 4.16Å; L190-I273 HydrophobicContact CD2-CG2 4.38Å; L269-I273 WeakPolarHBondContact O-CB 3.47Å; L269-I273 VanDerWaalsContact O-CG1 3.25Å; L269-I273 WeakPolarHBondContact O-CG1 3.3Å; L269-I273 PolarHBondContact O-N 3.4Å; F270-I273 PolarHBondContact O-N 3.04Å; I273-T275 VanDerWaalsContact C-N 3.26Å; I273-T275 PolarHBondContact O-N 3.41Å; I273-A276 PolarHBondContact O-N 3.36Å; I273-Y277 HydrophobicContact CB-CD2 4.32Å; I273-Y277 HydrophobicContact CB-CE2 4.5Å; I273-Y277 HydrophobicContact CG1-CE2 4.23Å; I273-Y277 HydrophobicContact CG2-CD2 3.78Å; I273-Y277 HydrophobicContact CG2-CE2 4.22Å; I273-Y277 WeakPolarHBondContact O-CD2 3.4Å; I273-Y277 PolarHBondContact O-N 3.11Å |
| 274 | R | 90.5 | Very high | 91.5 | Very high | 71 Ų | 71 | 71.8 Ų | 71.8 | 27% | 0.268 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -56.6 | -36.8 | 172.8 | 166.7 | 163.4 | -163.3 | 165.6 | 16.8 | 113.4 | E24 L28 T196 F270 L271 W272 | E24-R274 WeakPolarHBondContact OE1-CD 3.42Å; E24-R274 IonicContact OE1-CZ 3.95Å; E24-R274 IonicContact OE1-NE 2.82Å; E24-R274 IonicContact OE1-NH1 3.19Å; E24-R274 PolarHBondContact OE1-NH1 3.49Å; L28-R274 HydrophobicContact CD2-CG 4.01Å; T196-R274 WeakPolarHBondContact OG1-CA 3.47Å; T196-R274 WeakPolarHBondContact OG1-CB 3.43Å; T196-R274 WeakPolarHBondContact OG1-CG 3.41Å; F270-R274 PolarHBondContact O-N 3.3Å; L271-R274 PolarHBondContact O-N 2.99Å; W272-R274 PolarHBondContact O-N 3.12Å |
| 275 | T | 90 | Very high | 91.1 | Very high | 44 Ų | 44 | 66.8 Ų | 66.8 | 27% | 0.27 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -79.9 | -27.7 | 178.5 | 62.1 | 0 | 0 | 0 | 0 | 114.2 | L28 M31 L271 W272 I273 | L28-T275 HydrophobicContact CD2-CG2 3.27Å; L28-T275 HydrophobicContact CG-CG2 4.35Å; M31-T275 HydrophobicContact CB-CG2 3.92Å; M31-T275 HydrophobicContact CG-CG2 4.36Å; M31-T275 HydrophobicContact SD-CG2 3.51Å; M31-T275 VanDerWaalsContact SD-CG2 3.51Å; M31-T275 PolarHBondContact SD-OG1 3.43Å; L271-T275 PolarHBondContact O-N 3.38Å; W272-T275 PolarHBondContact O-N 3Å; W272-T275 PolarHBondContact O-OG1 3.2Å; I273-T275 VanDerWaalsContact C-N 3.26Å; I273-T275 PolarHBondContact O-N 3.41Å |
| 276 | A | 91.5 | Very high | 90.9 | Very high | 55 Ų | 55 | 62.9 Ų | 62.9 | 46% | 0.455 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -88.2 | -35.5 | -168.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | W272 I273 | W272-A276 PolarHBondContact O-N 2.66Å; W272-A276 VanDerWaalsContact O-N 3.11Å; I273-A276 PolarHBondContact O-N 3.36Å |
| 277 | Y | 91.1 | Very high | 90.7 | Very high | 142 Ų | 142 | 66.4 Ų | 66.4 | 56% | 0.557 | 31% | 0.314 | S | S | * | . | trans | -110.1 | 142.4 | -167.4 | -62.2 | -71.3 | 0 | 0 | 0 | 113.9 | I273 | I273-Y277 HydrophobicContact CB-CD2 4.32Å; I273-Y277 HydrophobicContact CB-CE2 4.5Å; I273-Y277 HydrophobicContact CG1-CE2 4.23Å; I273-Y277 HydrophobicContact CG2-CD2 3.78Å; I273-Y277 HydrophobicContact CG2-CE2 4.22Å; I273-Y277 WeakPolarHBondContact O-CD2 3.4Å; I273-Y277 PolarHBondContact O-N 3.11Å | ||
| 278 | P | 89.6 | Confident | 90.6 | Very high | 105 Ų | 105 | 67.9 Ų | 67.9 | 68% | 0.682 | 32% | 0.322 | S | S | * | . | P | Polyproline II helix | trans | -70.5 | 160.6 | 169.3 | 31.8 | -34.6 | 0 | 0 | 0 | 111 | P197 | P197-P278 WeakPolarHBondContact CB-O 3.33Š|
| 279 | R | 86.6 | Confident | 90.5 | Very high | 95 Ų | 95 | 65.9 Ų | 65.9 | 36% | 0.358 | 31% | 0.308 | S | S | . | . | P | Polyproline II helix | trans | -68.2 | 141 | 175.2 | -58.6 | -177.4 | -163.1 | 171.3 | 0.6 | 110.5 | T196 P197 E204 | T196-R279 HydrophobicContact CG2-CG 4.31Å; P197-R279 WeakPolarHBondContact O-CA 3.18Å; E204-R279 IonicContact OE2-NH2 3.19Å |
| 280 | F | 85.1 | Confident | 90.5 | Very high | 79 Ų | 79 | 69.2 Ų | 69.2 | 35% | 0.346 | 32% | 0.315 | S | S | . | . | P | Polyproline II helix | trans | -76.6 | 154 | 170.3 | -78.6 | -76.3 | 0 | 0 | 0 | 111 | P197 F198 L200 Q284 | P197-F280 HydrophobicContact CB-CD2 3.65Å; P197-F280 HydrophobicContact CB-CE2 3.83Å; P197-F280 HydrophobicContact CG-CD2 3.88Å; P197-F280 HydrophobicContact CG-CE2 3.75Å; P197-F280 PolarHBondContact O-N 2.86Å; F198-F280 AromaticContact CD1-CD2 3.91Å; F198-F280 HydrophobicContact CD1-CD2 3.91Å; F198-F280 AromaticContact CE1-CD2 3.5Å; F198-F280 HydrophobicContact CE1-CD2 3.5Å; F198-F280 AromaticContact CE1-CE2 3.91Å; F198-F280 HydrophobicContact CE1-CE2 3.91Å; F198-F280 HydrophobicContact CE1-CG 4.26Å; F198-F280 HydrophobicContact CZ-CD2 4.15Å; F198-F280 HydrophobicContact CZ-CE2 4.13Å; L200-F280 WeakPolarHBondContact CD2-O 3.36Å; F280-Q284 HydrophobicContact CD1-CB 4.21Å |
| 281 | R | 85.4 | Confident | 90.5 | Very high | 148 Ų | 148 | 75.2 Ų | 75.2 | 56% | 0.558 | 34% | 0.342 | S | S | * | . | P | Polyproline II helix | trans | -77.3 | 148.2 | 163.5 | -166.4 | 169.5 | 76.5 | -150.1 | 0.9 | 109.8 | D283 Q284 L285 | R281-D283 VanDerWaalsContact C-N 3.29Å; R281-D283 IonicContact CZ-OD2 2.75Å; R281-D283 IonicContact NE-OD2 3Å; R281-D283 PolarHBondContact NE-OD2 3.27Å; R281-D283 IonicContact NH2-OD2 3.16Å; R281-D283 PolarHBondContact NH2-OD2 3.22Å; R281-D283 VanDerWaalsContact NH2-OD2 3.16Å; R281-D283 PolarHBondContact O-N 3.18Å; R281-Q284 HydrophobicContact CB-CG 4.21Å; R281-Q284 WeakPolarHBondContact O-CB 2.99Å; R281-Q284 PolarHBondContact O-N 3.33Å; R281-L285 PolarHBondContact O-N 3.44Å |
| 282 | Y | 84.7 | Confident | 90.6 | Very high | 66 Ų | 66 | 79.5 Ų | 79.5 | 26% | 0.259 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -49.8 | -44.6 | 177.5 | 177.3 | -94.7 | 0 | 0 | 0 | 113.6 | R134 A137 L200 Q284 L285 M286 | R134-Y282 HydrophobicContact CB-CD2 4.49Å; R134-Y282 HydrophobicContact CB-CE2 4.45Å; R134-Y282 HydrophobicContact CG-CD2 4.39Å; R134-Y282 HydrophobicContact CG-CE2 4.45Å; A137-Y282 HydrophobicContact CB-CE2 4.2Å; A137-Y282 WeakPolarHBondContact CB-OH 3.47Å; L200-Y282 HydrophobicContact CD1-CD2 3.76Å; L200-Y282 HydrophobicContact CD1-CG 4.29Å; Y282-Q284 VanDerWaalsContact C-N 3.31Å; Y282-Q284 PolarHBondContact O-N 3.05Å; Y282-L285 WeakPolarHBondContact O-CB 3.08Å; Y282-L285 PolarHBondContact O-N 3.39Å; Y282-M286 HydrophobicContact CD1-CG 4.43Å; Y282-M286 HydrophobicContact CD2-CE 4.4Å; Y282-M286 HydrophobicContact CE1-CE 4.48Å; Y282-M286 HydrophobicContact CE1-CG 3.97Å; Y282-M286 HydrophobicContact CE2-CE 3.48Å; Y282-M286 VanDerWaalsContact CE2-CE 3.48Å; Y282-M286 HydrophobicContact CE2-CG 4.37Å; Y282-M286 PolarHBondContact O-N 3.28Å; Y282-M286 WeakPolarHBondContact OH-CE 3.09Å |
| 283 | D | 88.2 | Confident | 90.6 | Very high | 71 Ų | 71 | 73.6 Ų | 73.6 | 38% | 0.38 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -64.7 | -36.3 | 179.3 | -38.5 | -37.5 | 0 | 0 | 0 | 112.5 | R281 L285 M286 H287 | R281-D283 VanDerWaalsContact C-N 3.29Å; R281-D283 IonicContact CZ-OD2 2.75Å; R281-D283 IonicContact NE-OD2 3Å; R281-D283 PolarHBondContact NE-OD2 3.27Å; R281-D283 IonicContact NH2-OD2 3.16Å; R281-D283 PolarHBondContact NH2-OD2 3.22Å; R281-D283 VanDerWaalsContact NH2-OD2 3.16Å; R281-D283 PolarHBondContact O-N 3.18Å; D283-L285 VanDerWaalsContact C-N 3.33Å; D283-M286 PolarHBondContact O-N 2.88Å; D283-H287 WeakPolarHBondContact O-CB 3.27Å; D283-H287 PolarHBondContact O-CD2 3.04Å; D283-H287 PolarHBondContact O-N 3.24Å |
| 284 | Q | 90.8 | Very high | 90.6 | Very high | 96 Ų | 96 | 74.2 Ų | 74.2 | 45% | 0.449 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -68.9 | -38.4 | 179.6 | -66.2 | 174.2 | -24.7 | 0 | 0 | 110.6 | F280 R281 Y282 H287 L288 | F280-Q284 HydrophobicContact CD1-CB 4.21Å; R281-Q284 HydrophobicContact CB-CG 4.21Å; R281-Q284 WeakPolarHBondContact O-CB 2.99Å; R281-Q284 PolarHBondContact O-N 3.33Å; Y282-Q284 VanDerWaalsContact C-N 3.31Å; Y282-Q284 PolarHBondContact O-N 3.05Å; Q284-H287 PolarHBondContact O-N 3.3Å; Q284-L288 WeakPolarHBondContact O-CB 3.43Å; Q284-L288 PolarHBondContact O-N 3.39Å |
| 285 | L | 88.4 | Confident | 90.9 | Very high | 0 Ų | 0 | 73.9 Ų | 73.9 | 0% | 0 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -59.8 | -50.5 | 173.1 | -173.3 | 163.8 | 0 | 0 | 0 | 110.5 | Q138 Y142 F198 L200 R281 Y282 D283 H287 L288 L289 | Q138-L285 HydrophobicContact CG-CD1 4.08Å; Q138-L285 HydrophobicContact CG-CD2 4.44Å; Y142-L285 HydrophobicContact CE2-CD1 4.08Å; Y142-L285 HydrophobicContact CE2-CD2 3.63Å; Y142-L285 HydrophobicContact CE2-CG 4.22Å; Y142-L285 VanDerWaalsContact OH-CD1 3.25Å; Y142-L285 WeakPolarHBondContact OH-CD1 3.14Å; Y142-L285 WeakPolarHBondContact OH-CD2 3.48Å; Y142-L285 WeakPolarHBondContact OH-CG 3.23Å; F198-L285 HydrophobicContact CB-CD1 4.05Å; F198-L285 HydrophobicContact CD1-CD1 3.63Å; F198-L285 HydrophobicContact CD1-CG 3.95Å; F198-L285 HydrophobicContact CE1-CG 4.42Å; F198-L285 HydrophobicContact CG-CD1 4.24Å; L200-L285 HydrophobicContact CD1-CB 4.31Å; L200-L285 HydrophobicContact CD1-CD1 3.45Å; L200-L285 VanDerWaalsContact CD1-CD1 3.45Å; L200-L285 HydrophobicContact CD1-CG 4.44Å; L200-L285 HydrophobicContact CG-CD1 4.22Å; R281-L285 PolarHBondContact O-N 3.44Å; Y282-L285 WeakPolarHBondContact O-CB 3.08Å; Y282-L285 PolarHBondContact O-N 3.39Å; D283-L285 VanDerWaalsContact C-N 3.33Å; L285-H287 VanDerWaalsContact C-N 3.31Å; L285-H287 PolarHBondContact O-N 2.95Å; L285-L288 WeakPolarHBondContact O-CB 3.39Å; L285-L288 PolarHBondContact O-N 2.9Å; L285-L288 VanDerWaalsContact O-N 3.16Å; L285-L289 HydrophobicContact CD2-CD1 3.82Å; L285-L289 HydrophobicContact CD2-CG 4.49Å; L285-L289 PolarHBondContact O-N 3.49Å; L285-L289 VanDerWaalsContact O-N 3.08Å |
| 286 | M | 90.6 | Very high | 91.2 | Very high | 28 Ų | 28 | 75.9 Ų | 75.9 | 14% | 0.138 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -62 | -39.1 | 178.1 | -70.4 | -62 | 166 | 0 | 0 | 111.9 | A137 Y282 D283 W290 | A137-M286 HydrophobicContact CB-CE 4.01Å; A137-M286 WeakPolarHBondContact O-CE 3.5Å; Y282-M286 HydrophobicContact CD1-CG 4.43Å; Y282-M286 HydrophobicContact CD2-CE 4.4Å; Y282-M286 HydrophobicContact CE1-CE 4.48Å; Y282-M286 HydrophobicContact CE1-CG 3.97Å; Y282-M286 HydrophobicContact CE2-CE 3.48Å; Y282-M286 VanDerWaalsContact CE2-CE 3.48Å; Y282-M286 HydrophobicContact CE2-CG 4.37Å; Y282-M286 PolarHBondContact O-N 3.28Å; Y282-M286 WeakPolarHBondContact OH-CE 3.09Å; D283-M286 PolarHBondContact O-N 2.88Å; M286-W290 WeakPolarHBondContact O-CB 3.45Å; M286-W290 VanDerWaalsContact O-CD1 3.25Å; M286-W290 PolarHBondContact O-N 3.4Å |
| 287 | H | 93.2 | Very high | 91.5 | Very high | 95 Ų | 95 | 73.2 Ų | 73.2 | 44% | 0.44 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -65.1 | -40.9 | 173.8 | -77.8 | -34.7 | 0 | 0 | 0 | 113.2 | D283 Q284 L285 L289 K291 | D283-H287 WeakPolarHBondContact O-CB 3.27Å; D283-H287 PolarHBondContact O-CD2 3.04Å; D283-H287 PolarHBondContact O-N 3.24Å; Q284-H287 PolarHBondContact O-N 3.3Å; L285-H287 VanDerWaalsContact C-N 3.31Å; L285-H287 PolarHBondContact O-N 2.95Å; H287-L289 VanDerWaalsContact C-N 3.35Å; H287-L289 PolarHBondContact O-N 3.21Å; H287-K291 PolarHBondContact CE1-NZ 2.89Å; H287-K291 VanDerWaalsContact CE1-NZ 3.32Å; H287-K291 WeakPolarHBondContact ND1-CE 3.42Å; H287-K291 WeakPolarHBondContact O-CA 3.4Å; H287-K291 VanDerWaalsContact O-CB 3.27Å; H287-K291 WeakPolarHBondContact O-CB 3.21Å; H287-K291 PolarHBondContact O-N 2.97Å |
| 288 | L | 93.2 | Very high | 91.7 | Very high | 40 Ų | 40 | 70.2 Ų | 70.2 | 21% | 0.209 | 33% | 0.333 | C | S | . | . | I | π-helix | trans | -57.6 | -49.9 | 176.8 | -179.9 | 70 | 0 | 0 | 0 | 110.6 | I187 F198 Q284 L285 N292 F293 | I187-L288 HydrophobicContact CG2-CD2 4.47Å; F198-L288 HydrophobicContact CE1-CD2 4.05Å; F198-L288 HydrophobicContact CZ-CD2 4.03Å; Q284-L288 WeakPolarHBondContact O-CB 3.43Å; Q284-L288 PolarHBondContact O-N 3.39Å; L285-L288 WeakPolarHBondContact O-CB 3.39Å; L285-L288 PolarHBondContact O-N 2.9Å; L285-L288 VanDerWaalsContact O-N 3.16Å; L288-N292 HydrophobicContact CD1-CB 4.47Å; L288-N292 WeakPolarHBondContact O-CA 3.45Å; L288-N292 VanDerWaalsContact O-CB 3.24Å; L288-N292 WeakPolarHBondContact O-CB 3.19Å; L288-N292 PolarHBondContact O-N 3.16Å; L288-N292 VanDerWaalsContact O-N 3.15Å; L288-F293 HydrophobicContact CD1-CD1 4.42Å; L288-F293 HydrophobicContact CD1-CE1 3.93Å; L288-F293 HydrophobicContact CD1-CZ 4.17Å; L288-F293 HydrophobicContact CD2-CE2 4.29Å; L288-F293 HydrophobicContact CD2-CZ 4.11Å; L288-F293 HydrophobicContact CG-CE1 4.19Å; L288-F293 HydrophobicContact CG-CE2 4.33Å; L288-F293 HydrophobicContact CG-CZ 4.09Å; L288-F293 PolarHBondContact O-N 3.11Å |
| 289 | L | 91.8 | Very high | 92.1 | Very high | 2 Ų | 2 | 68 Ų | 68 | 1% | 0.01 | 32% | 0.324 | C | S | . | . | I | π-helix | trans | -68 | -55.7 | -178.1 | -79.3 | 173.9 | 0 | 0 | 0 | 113 | S141 Y142 T145 L285 H287 F293 L294 | S141-L289 WeakPolarHBondContact OG-CD1 3.1Å; Y142-L289 HydrophobicContact CD1-CD1 3.51Å; Y142-L289 HydrophobicContact CD1-CD2 3.18Å; Y142-L289 HydrophobicContact CD1-CG 3.75Å; Y142-L289 HydrophobicContact CD2-CD1 3.91Å; Y142-L289 HydrophobicContact CE1-CD1 3.34Å; Y142-L289 HydrophobicContact CE1-CD2 3.16Å; Y142-L289 HydrophobicContact CE1-CG 3.36Å; Y142-L289 HydrophobicContact CE2-CD1 3.75Å; Y142-L289 HydrophobicContact CG-CD1 3.76Å; Y142-L289 HydrophobicContact CG-CD2 4.16Å; Y142-L289 HydrophobicContact CG-CG 4.48Å; Y142-L289 VanDerWaalsContact CZ-CD1 3.42Å; T145-L289 HydrophobicContact CG2-CD2 4.05Å; L285-L289 HydrophobicContact CD2-CD1 3.82Å; L285-L289 HydrophobicContact CD2-CG 4.49Å; L285-L289 PolarHBondContact O-N 3.49Å; L285-L289 VanDerWaalsContact O-N 3.08Å; H287-L289 VanDerWaalsContact C-N 3.35Å; H287-L289 PolarHBondContact O-N 3.21Å; L289-F293 HydrophobicContact CD2-CB 4.5Å; L289-F293 HydrophobicContact CD2-CD2 3.81Å; L289-F293 PolarHBondContact O-N 3.16Å; L289-L294 WeakPolarHBondContact O-CB 3.4Å; L289-L294 PolarHBondContact O-N 3.35Å |
| 290 | W | 94.6 | Very high | 92.5 | Very high | 134 Ų | 134 | 64.7 Ų | 64.7 | 51% | 0.508 | 31% | 0.313 | S | S | . | . | I | π-helix | trans | -76.8 | -35.4 | -169.5 | -74 | 97.5 | 0 | 0 | 0 | 112.9 | M286 L294 | M286-W290 WeakPolarHBondContact O-CB 3.45Å; M286-W290 VanDerWaalsContact O-CD1 3.25Å; M286-W290 PolarHBondContact O-N 3.4Å; W290-L294 HydrophobicContact CE3-CD1 4.24Å; W290-L294 HydrophobicContact CZ3-CD1 4.21Å |
| 291 | K | 94.1 | Very high | 93.1 | Very high | 135 Ų | 135 | 62.4 Ų | 62.4 | 59% | 0.587 | 30% | 0.304 | S | S | * | . | I | π-helix | trans | -97.2 | -27.4 | -176.2 | -60.9 | -174.9 | 174 | 176.1 | 0 | 113.5 | H287 P295 | H287-K291 PolarHBondContact CE1-NZ 2.89Å; H287-K291 VanDerWaalsContact CE1-NZ 3.32Å; H287-K291 WeakPolarHBondContact ND1-CE 3.42Å; H287-K291 WeakPolarHBondContact O-CA 3.4Å; H287-K291 VanDerWaalsContact O-CB 3.27Å; H287-K291 WeakPolarHBondContact O-CB 3.21Å; H287-K291 PolarHBondContact O-N 2.97Å; K291-P295 WeakPolarHBondContact O-CG 3.31Å |
| 292 | N | 94.6 | Very high | 93.7 | Very high | 97 Ų | 97 | 61.8 Ų | 61.8 | 52% | 0.519 | 31% | 0.309 | S | S | . | . | I | π-helix | trans | -106.1 | -57.2 | -178.2 | -54 | -18.1 | 0 | 0 | 0 | 111.7 | L288 L296 | L288-N292 HydrophobicContact CD1-CB 4.47Å; L288-N292 WeakPolarHBondContact O-CA 3.45Å; L288-N292 VanDerWaalsContact O-CB 3.24Å; L288-N292 WeakPolarHBondContact O-CB 3.19Å; L288-N292 PolarHBondContact O-N 3.16Å; L288-N292 VanDerWaalsContact O-N 3.15Å; N292-L296 WeakPolarHBondContact O-CB 3.41Å; N292-L296 PolarHBondContact O-N 3.12Å |
| 293 | F | 94 | Very high | 94.2 | Very high | 18 Ų | 18 | 65.2 Ų | 65.2 | 8% | 0.079 | 32% | 0.322 | C | S | . | . | I | π-helix | trans | -72.1 | -43.7 | -173.4 | -72 | 0.4 | 0 | 0 | 0 | 112.7 | T145 M184 I187 L288 L289 L296 T297 | T145-F293 HydrophobicContact CG2-CB 4.16Å; M184-F293 HydrophobicContact CG-CD1 4.28Å; M184-F293 HydrophobicContact CG-CE1 4.29Å; M184-F293 HydrophobicContact SD-CD1 4.3Å; I187-F293 HydrophobicContact CB-CE2 3.95Å; I187-F293 HydrophobicContact CB-CZ 3.96Å; I187-F293 HydrophobicContact CD1-CZ 3.81Å; I187-F293 HydrophobicContact CG1-CZ 4.5Å; I187-F293 HydrophobicContact CG2-CE2 3.66Å; I187-F293 HydrophobicContact CG2-CZ 3.72Å; L288-F293 HydrophobicContact CD1-CD1 4.42Å; L288-F293 HydrophobicContact CD1-CE1 3.93Å; L288-F293 HydrophobicContact CD1-CZ 4.17Å; L288-F293 HydrophobicContact CD2-CE2 4.29Å; L288-F293 HydrophobicContact CD2-CZ 4.11Å; L288-F293 HydrophobicContact CG-CE1 4.19Å; L288-F293 HydrophobicContact CG-CE2 4.33Å; L288-F293 HydrophobicContact CG-CZ 4.09Å; L288-F293 PolarHBondContact O-N 3.11Å; L289-F293 HydrophobicContact CD2-CB 4.5Å; L289-F293 HydrophobicContact CD2-CD2 3.81Å; L289-F293 PolarHBondContact O-N 3.16Å; F293-L296 PolarHBondContact O-N 3.32Å; F293-T297 WeakPolarHBondContact O-CB 3.23Å; F293-T297 VanDerWaalsContact O-CG2 3.24Å; F293-T297 WeakPolarHBondContact O-CG2 3.46Å; F293-T297 PolarHBondContact O-N 3.3Å; F293-T297 PolarHBondContact O-OG1 3.15Å |
| 294 | L | 94.8 | Very high | 94.5 | Very high | 37 Ų | 37 | 62.4 Ų | 62.4 | 19% | 0.194 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -62.5 | -46.7 | -176.2 | -172.4 | 129.2 | 0 | 0 | 0 | 113 | V144 T145 L289 W290 L296 T297 L298 | V144-L294 HydrophobicContact CG1-CD1 3.81Å; T145-L294 HydrophobicContact CG2-CB 4.46Å; L289-L294 WeakPolarHBondContact O-CB 3.4Å; L289-L294 PolarHBondContact O-N 3.35Å; W290-L294 HydrophobicContact CE3-CD1 4.24Å; W290-L294 HydrophobicContact CZ3-CD1 4.21Å; L294-L296 VanDerWaalsContact C-N 3.35Å; L294-L296 PolarHBondContact O-N 3.5Å; L294-T297 WeakPolarHBondContact CA-OG1 3.42Å; L294-T297 PolarHBondContact O-N 3.06Å; L294-T297 PolarHBondContact O-OG1 2.94Å; L294-L298 HydrophobicContact CD2-CD1 3.9Å; L294-L298 HydrophobicContact CG-CD1 4.3Å; L294-L298 WeakPolarHBondContact O-CB 3.11Å; L294-L298 WeakPolarHBondContact O-CG 3.37Å; L294-L298 PolarHBondContact O-N 3.38Å |
| 295 | P | 96.8 | Very high | 94.8 | Very high | 65 Ų | 65 | 61.1 Ų | 61.1 | 42% | 0.422 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -62.5 | -40.3 | 174.9 | -25.4 | 37.1 | 0 | 0 | 0 | 113.1 | K291 A299 | K291-P295 WeakPolarHBondContact O-CG 3.31Å; P295-A299 WeakPolarHBondContact O-CB 3.35Å; P295-A299 PolarHBondContact O-N 3.39Å |
| 296 | L | 96.8 | Very high | 95.1 | Very high | 85 Ų | 85 | 63.4 Ų | 63.4 | 45% | 0.445 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -69.9 | -41.6 | -179 | -174.8 | 61.1 | 0 | 0 | 0 | 112.1 | M184 N292 F293 L294 A299 L300 | M184-L296 HydrophobicContact CE-CD2 4.29Å; M184-L296 HydrophobicContact CE-CG 4.22Å; M184-L296 HydrophobicContact SD-CB 4.19Å; M184-L296 HydrophobicContact SD-CD2 3.64Å; M184-L296 HydrophobicContact SD-CG 3.96Å; N292-L296 WeakPolarHBondContact O-CB 3.41Å; N292-L296 PolarHBondContact O-N 3.12Å; F293-L296 PolarHBondContact O-N 3.32Å; L294-L296 VanDerWaalsContact C-N 3.35Å; L294-L296 PolarHBondContact O-N 3.5Å; L296-A299 PolarHBondContact O-N 2.76Å; L296-L300 HydrophobicContact CD1-CD1 4.35Å; L296-L300 HydrophobicContact CG-CD1 4.04Å; L296-L300 WeakPolarHBondContact O-CB 3.38Å; L296-L300 WeakPolarHBondContact O-CG 3.38Å; L296-L300 PolarHBondContact O-N 3.35Å |
| 297 | T | 96.2 | Very high | 95.3 | Very high | 0 Ų | 0 | 64.6 Ų | 64.6 | 0% | 0 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -65.3 | -38.2 | 176.8 | 50.4 | 0 | 0 | 0 | 0 | 111.8 | I149 M184 F293 L294 L300 L301 | I149-T297 HydrophobicContact CD1-CG2 3.8Å; I149-T297 HydrophobicContact CG1-CG2 3.48Å; I149-T297 VanDerWaalsContact CG1-CG2 3.48Å; M184-T297 HydrophobicContact CE-CG2 3.55Å; M184-T297 HydrophobicContact SD-CG2 3.72Å; F293-T297 WeakPolarHBondContact O-CB 3.23Å; F293-T297 VanDerWaalsContact O-CG2 3.24Å; F293-T297 WeakPolarHBondContact O-CG2 3.46Å; F293-T297 PolarHBondContact O-N 3.3Å; F293-T297 PolarHBondContact O-OG1 3.15Å; L294-T297 WeakPolarHBondContact CA-OG1 3.42Å; L294-T297 PolarHBondContact O-N 3.06Å; L294-T297 PolarHBondContact O-OG1 2.94Å; T297-L300 PolarHBondContact O-N 2.84Å; T297-L301 WeakPolarHBondContact O-CB 3.4Å; T297-L301 PolarHBondContact O-N 2.97Å |
| 298 | L | 96.6 | Very high | 95.3 | Very high | 78 Ų | 78 | 60.8 Ų | 60.8 | 41% | 0.408 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -65.4 | -43.8 | 172.4 | -73.1 | 171.3 | 0 | 0 | 0 | 112.3 | I148 L294 L300 L301 M302 | I148-L298 HydrophobicContact CD1-CD2 4.15Å; L294-L298 HydrophobicContact CD2-CD1 3.9Å; L294-L298 HydrophobicContact CG-CD1 4.3Å; L294-L298 WeakPolarHBondContact O-CB 3.11Å; L294-L298 WeakPolarHBondContact O-CG 3.37Å; L294-L298 PolarHBondContact O-N 3.38Å; L298-L300 VanDerWaalsContact C-N 3.31Å; L298-L300 PolarHBondContact O-N 3.43Å; L298-L301 WeakPolarHBondContact O-CB 3.23Å; L298-L301 PolarHBondContact O-N 3.27Å; L298-M302 WeakPolarHBondContact O-CG 3.37Å; L298-M302 PolarHBondContact O-N 3.34Å; L298-M302 VanDerWaalsContact O-N 3.1Å |
| 299 | A | 97.1 | Very high | 95.4 | Very high | 60 Ų | 60 | 64.1 Ų | 64.1 | 50% | 0.496 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -61 | -42.3 | 176 | 0 | 0 | 0 | 0 | 0 | 111.5 | P295 L296 M302 W303 | P295-A299 WeakPolarHBondContact O-CB 3.35Å; P295-A299 PolarHBondContact O-N 3.39Å; L296-A299 PolarHBondContact O-N 2.76Å; A299-M302 PolarHBondContact O-N 3.18Å; A299-W303 PolarHBondContact O-N 3.28Å; A299-W303 VanDerWaalsContact O-N 3.12Å |
| 300 | L | 96.6 | Very high | 95.6 | Very high | 25 Ų | 25 | 69 Ų | 69 | 13% | 0.131 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -68 | -38.1 | 175.9 | -72 | 165.8 | 0 | 0 | 0 | 111.8 | P180 L181 M184 L296 T297 L298 M302 W303 Y304 | P180-L300 HydrophobicContact CB-CD1 3.97Å; L181-L300 HydrophobicContact CD2-CB 3.91Å; L181-L300 HydrophobicContact CD2-CD1 3.77Å; L181-L300 HydrophobicContact CD2-CG 4.46Å; L181-L300 HydrophobicContact CG-CD1 4.21Å; M184-L300 HydrophobicContact CE-CD1 3.36Å; L296-L300 HydrophobicContact CD1-CD1 4.35Å; L296-L300 HydrophobicContact CG-CD1 4.04Å; L296-L300 WeakPolarHBondContact O-CB 3.38Å; L296-L300 WeakPolarHBondContact O-CG 3.38Å; L296-L300 PolarHBondContact O-N 3.35Å; T297-L300 PolarHBondContact O-N 2.84Å; L298-L300 VanDerWaalsContact C-N 3.31Å; L298-L300 PolarHBondContact O-N 3.43Å; L300-M302 VanDerWaalsContact C-N 3.3Å; L300-M302 PolarHBondContact O-N 3.28Å; L300-W303 CarbonylContact O-C 3.59Å; L300-W303 WeakPolarHBondContact O-CA 3.38Å; L300-W303 WeakPolarHBondContact O-CB 3.28Å; L300-W303 PolarHBondContact O-N 3.5Å; L300-Y304 HydrophobicContact CB-CD2 4.31Å; L300-Y304 HydrophobicContact CB-CE2 4.25Å; L300-Y304 HydrophobicContact CD2-CE2 4.2Å; L300-Y304 WeakPolarHBondContact O-CD2 3.06Å; L300-Y304 PolarHBondContact O-N 2.89Å |
| 301 | L | 97 | Very high | 95.6 | Very high | 30 Ų | 30 | 67.2 Ų | 67.2 | 16% | 0.157 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -55.7 | -47.1 | 173.2 | -178.1 | 71.7 | 0 | 0 | 0 | 110.9 | I148 L151 L155 T297 L298 W303 Y304 V305 | I148-L301 HydrophobicContact CG2-CB 4.16Å; I148-L301 HydrophobicContact CG2-CD2 4.28Å; L151-L301 HydrophobicContact CB-CD1 4.38Å; L151-L301 HydrophobicContact CD2-CD1 3.86Å; L151-L301 HydrophobicContact CD2-CD2 4.48Å; L151-L301 HydrophobicContact CG-CD1 4.01Å; L155-L301 HydrophobicContact CD1-CD1 4.3Å; T297-L301 WeakPolarHBondContact O-CB 3.4Å; T297-L301 PolarHBondContact O-N 2.97Å; L298-L301 WeakPolarHBondContact O-CB 3.23Å; L298-L301 PolarHBondContact O-N 3.27Å; L301-W303 VanDerWaalsContact C-N 3.26Å; L301-W303 PolarHBondContact O-N 3.36Å; L301-Y304 PolarHBondContact O-N 3.41Å; L301-V305 VanDerWaalsContact O-CG2 3.3Å; L301-V305 WeakPolarHBondContact O-CG2 3.49Å; L301-V305 PolarHBondContact O-N 3.33Å |
| 302 | M | 96.9 | Very high | 95.6 | Very high | 135 Ų | 135 | 66.2 Ų | 66.2 | 67% | 0.665 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -61.2 | -36.1 | 176.8 | -65.1 | -59.6 | -67.2 | 0 | 0 | 112.5 | L298 A299 L300 S306 | L298-M302 WeakPolarHBondContact O-CG 3.37Å; L298-M302 PolarHBondContact O-N 3.34Å; L298-M302 VanDerWaalsContact O-N 3.1Å; A299-M302 PolarHBondContact O-N 3.18Å; L300-M302 VanDerWaalsContact C-N 3.3Å; L300-M302 PolarHBondContact O-N 3.28Å; M302-S306 PolarHBondContact O-N 2.92Å; M302-S306 VanDerWaalsContact O-N 3.14Å; M302-S306 PolarHBondContact O-OG 3.07Å |
| 303 | W | 96 | Very high | 95.5 | Very high | 138 Ų | 138 | 64.7 Ų | 64.7 | 52% | 0.523 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -65.6 | -49.7 | 173.7 | 178.5 | -101.9 | 0 | 0 | 0 | 112 | A299 L300 L301 V305 S306 M307 | A299-W303 PolarHBondContact O-N 3.28Å; A299-W303 VanDerWaalsContact O-N 3.12Å; L300-W303 CarbonylContact O-C 3.59Å; L300-W303 WeakPolarHBondContact O-CA 3.38Å; L300-W303 WeakPolarHBondContact O-CB 3.28Å; L300-W303 PolarHBondContact O-N 3.5Å; L301-W303 VanDerWaalsContact C-N 3.26Å; L301-W303 PolarHBondContact O-N 3.36Å; W303-V305 VanDerWaalsContact C-N 3.27Å; W303-V305 PolarHBondContact O-N 3.04Å; W303-S306 PolarHBondContact O-N 3.46Å; W303-S306 VanDerWaalsContact O-N 3.14Å; W303-S306 PolarHBondContact O-OG 3.49Å; W303-S306 VanDerWaalsContact O-OG 3.13Å; W303-M307 HydrophobicContact CD2-CG 3.55Å; W303-M307 HydrophobicContact CD2-SD 4.16Å; W303-M307 VanDerWaalsContact CE2-SD 3.57Å; W303-M307 HydrophobicContact CE3-CG 4.09Å; W303-M307 HydrophobicContact CE3-SD 4.36Å; W303-M307 HydrophobicContact CG-CG 3.94Å; W303-M307 HydrophobicContact CH2-CE 4.07Å; W303-M307 HydrophobicContact CH2-CG 4.2Å; W303-M307 HydrophobicContact CH2-SD 3.48Å; W303-M307 WeakPolarHBondContact CH2-SD 3.48Å; W303-M307 HydrophobicContact CZ2-CE 3.3Å; W303-M307 HydrophobicContact CZ2-CG 3.69Å; W303-M307 HydrophobicContact CZ2-SD 3.23Å; W303-M307 WeakPolarHBondContact CZ2-SD 3.27Å; W303-M307 HydrophobicContact CZ3-CG 4.38Å; W303-M307 HydrophobicContact CZ3-SD 4.05Å; W303-M307 WeakPolarHBondContact O-CB 3.3Å; W303-M307 VanDerWaalsContact O-CG 3.24Å; W303-M307 WeakPolarHBondContact O-CG 3.28Å; W303-M307 PolarHBondContact O-N 3.06Å |
| 304 | Y | 95.2 | Very high | 95.5 | Very high | 13 Ų | 13 | 69.5 Ų | 69.5 | 5% | 0.051 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -70.6 | -20.1 | -179.8 | -74.1 | -74.8 | 0 | 0 | 0 | 113.8 | M156 P177 S178 L181 L300 L301 P308 | M156-Y304 HydrophobicContact CG-CD1 4.2Å; M156-Y304 HydrophobicContact SD-CD1 4.08Å; M156-Y304 HydrophobicContact SD-CE1 3.8Å; P177-Y304 PolarHBondContact O-OH 3.36Å; S178-Y304 VanDerWaalsContact CA-OH 3.23Å; S178-Y304 WeakPolarHBondContact CA-OH 3.11Å; L181-Y304 HydrophobicContact CD1-CD2 3.55Å; L181-Y304 HydrophobicContact CD1-CE1 4.5Å; L181-Y304 HydrophobicContact CD1-CE2 3.15Å; L181-Y304 HydrophobicContact CD1-CG 4.42Å; L181-Y304 HydrophobicContact CG-CD2 4.45Å; L181-Y304 HydrophobicContact CG-CE2 3.8Å; L300-Y304 HydrophobicContact CB-CD2 4.31Å; L300-Y304 HydrophobicContact CB-CE2 4.25Å; L300-Y304 HydrophobicContact CD2-CE2 4.2Å; L300-Y304 WeakPolarHBondContact O-CD2 3.06Å; L300-Y304 PolarHBondContact O-N 2.89Å; L301-Y304 PolarHBondContact O-N 3.41Å; Y304-P308 WeakPolarHBondContact O-CD 3.33Å; Y304-P308 VanDerWaalsContact O-CG 3.3Å; Y304-P308 WeakPolarHBondContact O-CG 3.36Å |
| 305 | V | 96 | Very high | 95.4 | Very high | 68 Ų | 68 | 69 Ų | 69 | 41% | 0.412 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -73.6 | -44.4 | 167.8 | 172.2 | 0 | 0 | 0 | 0 | 110.9 | L155 L301 W303 I309 | L155-V305 HydrophobicContact CD1-CB 4.39Å; L155-V305 HydrophobicContact CD1-CG2 3.5Å; L301-V305 VanDerWaalsContact O-CG2 3.3Å; L301-V305 WeakPolarHBondContact O-CG2 3.49Å; L301-V305 PolarHBondContact O-N 3.33Å; W303-V305 VanDerWaalsContact C-N 3.27Å; W303-V305 PolarHBondContact O-N 3.04Å; V305-I309 WeakPolarHBondContact O-CD1 3.34Å; V305-I309 WeakPolarHBondContact O-CG1 3.05Å |
| 306 | S | 96.1 | Very high | 95.3 | Very high | 49 Ų | 49 | 70.3 Ų | 70.3 | 34% | 0.343 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -80.1 | -35.8 | -174.1 | 58.5 | 0 | 0 | 0 | 0 | 113.8 | M302 W303 I309 T310 | M302-S306 PolarHBondContact O-N 2.92Å; M302-S306 VanDerWaalsContact O-N 3.14Å; M302-S306 PolarHBondContact O-OG 3.07Å; W303-S306 PolarHBondContact O-N 3.46Å; W303-S306 VanDerWaalsContact O-N 3.14Å; W303-S306 PolarHBondContact O-OG 3.49Å; W303-S306 VanDerWaalsContact O-OG 3.13Å; S306-I309 PolarHBondContact O-N 3.19Å; S306-T310 WeakPolarHBondContact O-CG2 3.43Å; S306-T310 PolarHBondContact O-N 2.69Å; S306-T310 PolarHBondContact O-OG1 2.99Å |
| 307 | M | 94.3 | Very high | 94.8 | Very high | 53 Ų | 53 | 74.1 Ų | 74.1 | 26% | 0.261 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -59.2 | -51.3 | -175.3 | -79.1 | -74.4 | -81.9 | 0 | 0 | 114.2 | W303 I309 T310 I311 | W303-M307 HydrophobicContact CD2-CG 3.55Å; W303-M307 HydrophobicContact CD2-SD 4.16Å; W303-M307 VanDerWaalsContact CE2-SD 3.57Å; W303-M307 HydrophobicContact CE3-CG 4.09Å; W303-M307 HydrophobicContact CE3-SD 4.36Å; W303-M307 HydrophobicContact CG-CG 3.94Å; W303-M307 HydrophobicContact CH2-CE 4.07Å; W303-M307 HydrophobicContact CH2-CG 4.2Å; W303-M307 HydrophobicContact CH2-SD 3.48Å; W303-M307 WeakPolarHBondContact CH2-SD 3.48Å; W303-M307 HydrophobicContact CZ2-CE 3.3Å; W303-M307 HydrophobicContact CZ2-CG 3.69Å; W303-M307 HydrophobicContact CZ2-SD 3.23Å; W303-M307 WeakPolarHBondContact CZ2-SD 3.27Å; W303-M307 HydrophobicContact CZ3-CG 4.38Å; W303-M307 HydrophobicContact CZ3-SD 4.05Å; W303-M307 WeakPolarHBondContact O-CB 3.3Å; W303-M307 VanDerWaalsContact O-CG 3.24Å; W303-M307 WeakPolarHBondContact O-CG 3.28Å; W303-M307 PolarHBondContact O-N 3.06Å; M307-I309 PolarHBondContact O-N 3.29Å; M307-T310 PolarHBondContact O-N 3.41Å; M307-T310 PolarHBondContact O-OG1 3.23Å; M307-I311 HydrophobicContact CE-CD1 3.63Å; M307-I311 PolarHBondContact O-N 3.44Å; M307-I311 HydrophobicContact SD-CD1 3.96Å |
| 308 | P | 93.3 | Very high | 94.2 | Very high | 14 Ų | 14 | 82.6 Ų | 82.6 | 9% | 0.091 | 46% | 0.464 | C | S | . | . | H | α-helix | trans | -59.7 | -34.3 | 178.2 | -24.2 | 35 | 0 | 0 | 0 | 112.7 | Y304 S312 S313 I314 | Y304-P308 WeakPolarHBondContact O-CD 3.33Å; Y304-P308 VanDerWaalsContact O-CG 3.3Å; Y304-P308 WeakPolarHBondContact O-CG 3.36Å; P308-S312 CarbonylContact O-C 3.41Å; P308-S312 WeakPolarHBondContact O-CA 3.34Å; P308-S312 PolarHBondContact O-N 2.96Å; P308-S312 VanDerWaalsContact O-N 3.13Å; P308-S313 PolarHBondContact O-N 3.36Å; P308-I314 HydrophobicContact CB-CG1 4.17Å |
| 309 | I | 95.6 | Very high | 94 | Very high | 111 Ų | 111 | 82.8 Ų | 82.8 | 57% | 0.569 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -69.6 | -48.7 | 178.3 | -57.3 | 171.8 | 0 | 0 | 0 | 110.3 | V305 S306 M307 I311 S312 I314 | V305-I309 WeakPolarHBondContact O-CD1 3.34Å; V305-I309 WeakPolarHBondContact O-CG1 3.05Å; S306-I309 PolarHBondContact O-N 3.19Å; M307-I309 PolarHBondContact O-N 3.29Å; I309-I311 PolarHBondContact O-N 3.18Å; I309-S312 PolarHBondContact O-N 3.03Å; I309-I314 HydrophobicContact CG1-CD1 4.28Å |
| 310 | T | 96 | Very high | 93.9 | Very high | 104 Ų | 104 | 84 Ų | 84 | 64% | 0.638 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -66.1 | -35.3 | -177.6 | 57.3 | 0 | 0 | 0 | 0 | 113.5 | S306 M307 S312 | S306-T310 WeakPolarHBondContact O-CG2 3.43Å; S306-T310 PolarHBondContact O-N 2.69Å; S306-T310 PolarHBondContact O-OG1 2.99Å; M307-T310 PolarHBondContact O-N 3.41Å; M307-T310 PolarHBondContact O-OG1 3.23Å; T310-S312 VanDerWaalsContact C-N 3.33Å |
| 311 | I | 94.4 | Very high | 93.7 | Very high | 96 Ų | 96 | 87.3 Ų | 87.3 | 49% | 0.492 | 48% | 0.483 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -91.5 | 0.6 | -179.1 | -58.9 | 162.7 | 0 | 0 | 0 | 111.1 | M307 I309 S313 | M307-I311 HydrophobicContact CE-CD1 3.63Å; M307-I311 PolarHBondContact O-N 3.44Å; M307-I311 HydrophobicContact SD-CD1 3.96Å; I309-I311 PolarHBondContact O-N 3.18Å; I311-S313 PolarHBondContact O-N 3.31Å |
| 312 | S | 93.5 | Very high | 93.5 | Very high | 115 Ų | 115 | 90.6 Ų | 90.6 | 80% | 0.804 | 50% | 0.502 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.5 | 38.1 | -173.1 | 62.1 | 0 | 0 | 0 | 0 | 113.5 | P308 I309 T310 | P308-S312 CarbonylContact O-C 3.41Å; P308-S312 WeakPolarHBondContact O-CA 3.34Å; P308-S312 PolarHBondContact O-N 2.96Å; P308-S312 VanDerWaalsContact O-N 3.13Å; I309-S312 PolarHBondContact O-N 3.03Å; T310-S312 VanDerWaalsContact C-N 3.33Å |
| 313 | S | 92.7 | Very high | 93.3 | Very high | 64 Ų | 64 | 87.9 Ų | 87.9 | 45% | 0.448 | 49% | 0.492 | S | S | . | . | trans | -113.4 | 35.2 | -177.3 | 54.1 | 0 | 0 | 0 | 0 | 112.4 | P308 I311 P315 | P308-S313 PolarHBondContact O-N 3.36Å; I311-S313 PolarHBondContact O-N 3.31Å; S313-P315 WeakPolarHBondContact O-CD 3.1Å | ||
| 314 | I | 93.8 | Very high | 93.2 | Very high | 119 Ų | 119 | 84.5 Ų | 84.5 | 61% | 0.61 | 49% | 0.49 | S | S | * | . | P | Polyproline II helix | trans | -65.1 | 121.9 | 176.5 | -58.7 | 174.7 | 0 | 0 | 0 | 108.4 | P308 I309 | P308-I314 HydrophobicContact CB-CG1 4.17Å; I309-I314 HydrophobicContact CG1-CD1 4.28Å |
| 315 | P | 93.2 | Very high | 93 | Very high | 26 Ų | 26 | 89.6 Ų | 89.6 | 17% | 0.169 | 52% | 0.522 | C | S | . | . | P | Polyproline II helix | trans | -68.6 | 153.2 | 179.7 | 29.7 | -37.3 | 0 | 0 | 0 | 111.6 | L155 M156 G158 S313 | L155-P315 WeakPolarHBondContact O-CD 3.17Å; L155-P315 WeakPolarHBondContact O-CG 3.22Å; M156-P315 WeakPolarHBondContact O-CB 3.48Å; M156-P315 WeakPolarHBondContact O-CG 3.3Å; G158-P315 VanDerWaalsContact N-CG 3.29Å; S313-P315 WeakPolarHBondContact O-CD 3.1Å |
| 316 | P | 93.4 | Very high | 92.8 | Very high | 93 Ų | 93 | 91.3 Ų | 91.3 | 60% | 0.604 | 53% | 0.53 | S | S | * | . | P | Polyproline II helix | trans | -67.4 | 150.6 | 175.7 | 30.4 | -35.2 | 0 | 0 | 0 | 111.1 | ||
| 317 | Q | 87.8 | Confident | 92.5 | Very high | 166 Ų | 166 | 94.8 Ų | 94.8 | 78% | 0.776 | 55% | 0.546 | S | S | * | . | trans | -78.7 | -23.6 | 174.7 | -168.3 | 176.9 | 5.9 | 0 | 0 | 112.5 | ||||
| 318 | T | 82.1 | Confident | 92.3 | Very high | 177 Ų | 177 | 98.6 Ų | 98.6 | 100% | 1.086 | 57% | 0.572 | S | S | * | * | trans | -122.2 | 0 | -174.5 | 56.4 | 0 | 0 | 0 | 0 | 111.5 |
Retrieved 318 of 318 residues in 94.2 ms
(Link to these results)