| 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 | 35 | Very low | 36.7 | Very low | 245 Ų | 245 | 137.5 Ų | 137.5 | 100% | 1.207 | 78% | 0.783 | S | S | * | * | 0 | 119.7 | 0 | -78 | 167.8 | 157.3 | 0 | 0 | 108.1 | |||||
| 2 | H | 33.8 | Very low | 38.4 | Very low | 195 Ų | 195 | 135.7 Ų | 135.7 | 90% | 0.903 | 78% | 0.78 | S | S | * | * | trans | -94.6 | 116.5 | 178.1 | -71.9 | -60.2 | 0 | 0 | 0 | 110.4 | R4 | H2-R4 PolarHBondContact O-N 2.73Š| ||
| 3 | A | 32.8 | Very low | 40.4 | Very low | 107 Ų | 107 | 129.1 Ų | 129.1 | 88% | 0.884 | 75% | 0.752 | S | S | * | * | trans | -81.5 | 91.4 | 163.2 | 0 | 0 | 0 | 0 | 0 | 108.5 | G5 | A3-G5 PolarHBondContact O-N 3.35Š| ||
| 4 | R | 39.3 | Very low | 43.1 | Very low | 204 Ų | 204 | 123.9 Ų | 123.9 | 77% | 0.77 | 72% | 0.719 | S | S | * | * | trans | -77 | 99.7 | 171.1 | -176.4 | 151 | -165.5 | 147.2 | 7.2 | 109 | H2 H7 | H2-R4 PolarHBondContact O-N 2.73Å; R4-H7 PolarHBondContact NH2-NE2 3.3Å | ||
| 5 | G | 29.3 | Very low | 45.8 | Very low | 54 Ų | 54 | 116.1 Ų | 116.1 | 56% | 0.557 | 67% | 0.674 | S | S | * | * | trans | -60.4 | 137.5 | 167.5 | 0 | 0 | 0 | 0 | 0 | 110.6 | A3 | A3-G5 PolarHBondContact O-N 3.35Š| ||
| 6 | P | 37.3 | Very low | 48.2 | Very low | 124 Ų | 124 | 109.4 Ų | 109.4 | 81% | 0.805 | 64% | 0.635 | S | S | * | * | trans | -72.7 | 138 | -177.7 | 29.2 | -33.9 | 0 | 0 | 0 | 111.3 | G8 | P6-G8 VanDerWaalsContact C-N 3.26Å; P6-G8 PolarHBondContact O-N 3.28Å | ||
| 7 | H | 37.4 | Very low | 50.3 | Low | 166 Ų | 166 | 103.5 Ų | 103.5 | 77% | 0.769 | 60% | 0.602 | S | S | * | * | trans | -71.3 | 86.2 | 162.7 | -63.3 | -83.4 | 0 | 0 | 0 | 108.3 | R4 | R4-H7 PolarHBondContact NH2-NE2 3.3Š| ||
| 8 | G | 33.3 | Very low | 52.4 | Low | 48 Ų | 48 | 97.8 Ų | 97.8 | 50% | 0.495 | 57% | 0.569 | S | S | . | * | trans | -64.2 | 152.3 | 163.3 | 0 | 0 | 0 | 0 | 0 | 110.1 | P6 L10 | P6-G8 VanDerWaalsContact C-N 3.26Å; P6-G8 PolarHBondContact O-N 3.28Å; G8-L10 PolarHBondContact O-N 3.29Å | ||
| 9 | P | 36.2 | Very low | 54.3 | Low | 129 Ų | 129 | 93.7 Ų | 93.7 | 84% | 0.838 | 55% | 0.546 | S | S | * | . | trans | -60.2 | 115.7 | 172.5 | 26.6 | -33 | 0 | 0 | 0 | 108.4 | S11 | P9-S11 PolarHBondContact O-N 3.46Š| ||
| 10 | L | 42.4 | Very low | 56 | Low | 171 Ų | 171 | 92.2 Ų | 92.2 | 90% | 0.895 | 54% | 0.538 | S | S | * | . | trans | -60.5 | 106.1 | 172.6 | -75.1 | 164 | 0 | 0 | 0 | 107.6 | G8 | G8-L10 PolarHBondContact O-N 3.29Š| ||
| 11 | S | 46.9 | Very low | 57.6 | Low | 70 Ų | 70 | 88.8 Ų | 88.8 | 49% | 0.49 | 52% | 0.518 | S | S | . | . | trans | -53.3 | 137.2 | 170.9 | -46.9 | 0 | 0 | 0 | 0 | 108.4 | P9 A13 | P9-S11 PolarHBondContact O-N 3.46Å; S11-A13 PolarHBondContact O-N 2.9Å | ||
| 12 | P | 57.5 | Low | 60.3 | Low | 115 Ų | 115 | 79.2 Ų | 79.2 | 75% | 0.747 | 47% | 0.47 | S | S | * | . | trans | -60.1 | 108.9 | 179.4 | 24.8 | -33.1 | 0 | 0 | 0 | 108.5 | L14 | P12-L14 PolarHBondContact O-N 2.88Š| ||
| 13 | A | 64.4 | Low | 63 | Low | 50 Ų | 50 | 76 Ų | 76 | 41% | 0.413 | 46% | 0.459 | S | S | . | . | P | Polyproline II helix | trans | -66.9 | 124.2 | -179.4 | 0 | 0 | 0 | 0 | 0 | 108.5 | S11 R212 | S11-A13 PolarHBondContact O-N 2.9Å; A13-R212 HydrophobicContact CB-CB 3.91Å |
| 14 | L | 78 | Confident | 65.8 | Low | 56 Ų | 56 | 74 Ų | 74 | 29% | 0.293 | 43% | 0.433 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.4 | 126.5 | -176.5 | -55.8 | 178 | 0 | 0 | 0 | 108.2 | P12 W78 P210 L211 R212 | P12-L14 PolarHBondContact O-N 2.88Å; L14-W78 HydrophobicContact CD2-CH2 3.69Å; L14-W78 HydrophobicContact CD2-CZ2 3.74Å; L14-W78 HydrophobicContact CD2-CZ3 4.45Å; L14-P210 HydrophobicContact CD1-CG 4.46Å; L14-P210 PolarHBondContact N-O 3.28Å; L14-L211 HydrophobicContact CB-CD2 4.44Å; L14-L211 WeakPolarHBondContact O-CA 3.5Å; L14-R212 PolarHBondContact O-N 2.96Å |
| 15 | P | 82.7 | Confident | 68.3 | Low | 7 Ų | 7 | 64.3 Ų | 64.3 | 5% | 0.045 | 40% | 0.397 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.1 | 137 | -178.1 | 33.7 | -38.6 | 0 | 0 | 0 | 109.8 | S19 W78 E81 L214 | P15-S19 PolarHBondContact O-N 3.25Å; P15-S19 PolarHBondContact O-OG 3.46Å; P15-W78 HydrophobicContact CG-CB 3.94Å; P15-W78 HydrophobicContact CG-CD2 4.35Å; P15-W78 HydrophobicContact CG-CG 3.57Å; P15-E81 HydrophobicContact CB-CB 4.21Å; P15-E81 HydrophobicContact CB-CG 4.13Å; P15-L214 HydrophobicContact CB-CD1 3.83Å |
| 16 | L | 84.1 | Confident | 71.2 | Confident | 10 Ų | 10 | 63.6 Ų | 63.6 | 5% | 0.052 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -72.2 | -45.5 | -154.2 | -173.7 | 145.3 | 0 | 0 | 0 | 114.4 | S19 V20 E81 T86 L205 L211 R212 L213 | L16-S19 PolarHBondContact O-N 3.28Å; L16-V20 HydrophobicContact CD2-CG2 3.92Å; L16-V20 HydrophobicContact CG-CG2 4.2Å; L16-V20 WeakPolarHBondContact O-CB 3.34Å; L16-V20 VanDerWaalsContact O-CG2 3.28Å; L16-V20 WeakPolarHBondContact O-CG2 3.32Å; L16-V20 PolarHBondContact O-N 3.22Å; L16-E81 PolarHBondContact N-OE1 2.98Å; L16-T86 HydrophobicContact CB-CG2 4.49Å; L16-L205 HydrophobicContact CD1-CB 3.79Å; L16-L205 HydrophobicContact CD1-CD2 4.15Å; L16-L205 HydrophobicContact CD1-CG 4.44Å; L16-L205 HydrophobicContact CD2-CD1 4.37Å; L16-L211 HydrophobicContact CB-CB 4.26Å; L16-L211 HydrophobicContact CD1-CB 3.75Å; L16-L211 HydrophobicContact CD1-CD1 4.4Å; L16-L211 HydrophobicContact CG-CB 4Å; L16-L211 HydrophobicContact CG-CD1 4.32Å; L16-R212 WeakPolarHBondContact CB-O 3.36Å; L16-R212 PolarHBondContact N-O 3.33Å; L16-R212 VanDerWaalsContact N-O 3.16Å; L16-L213 HydrophobicContact CD1-CG 4.19Å |
| 17 | A | 85.2 | Confident | 73.8 | Confident | 9 Ų | 9 | 60 Ų | 60 | 7% | 0.074 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -66.8 | -43.8 | -173.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | S19 V20 L21 E81 T86 F89 | A17-S19 VanDerWaalsContact C-N 3.34Å; A17-S19 PolarHBondContact O-N 3.49Å; A17-V20 PolarHBondContact O-N 3.15Å; A17-L21 WeakPolarHBondContact O-CB 3.14Å; A17-L21 PolarHBondContact O-N 3.3Å; A17-E81 PolarHBondContact N-OE1 3.29Å; A17-E81 PolarHBondContact N-OE2 3.15Å; A17-T86 HydrophobicContact CB-CG2 3.7Å; A17-F89 HydrophobicContact CB-CD1 3.88Å; A17-F89 HydrophobicContact CB-CE1 4.13Å |
| 18 | S | 87.5 | Confident | 76.3 | Confident | 0 Ų | 0 | 54 Ų | 54 | 0% | 0 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -59.3 | -44.5 | 177.5 | -57.1 | 0 | 0 | 0 | 0 | 111.6 | L21 M22 G77 E81 | S18-L21 PolarHBondContact O-N 3.11Å; S18-M22 VanDerWaalsContact O-CG 3.29Å; S18-M22 WeakPolarHBondContact O-CG 3.39Å; S18-M22 PolarHBondContact O-N 3.29Å; S18-G77 PolarHBondContact OG-O 3.46Å; S18-E81 VanDerWaalsContact CB-OE2 3.3Å; S18-E81 WeakPolarHBondContact CB-OE2 3.47Å; S18-E81 PolarHBondContact N-OE2 3.44Å; S18-E81 PolarHBondContact OG-OE2 2.76Å |
| 19 | S | 88.6 | Confident | 79 | Confident | 20 Ų | 20 | 55.9 Ų | 55.9 | 14% | 0.14 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -70.5 | -40.4 | 179.3 | -66.8 | 0 | 0 | 0 | 0 | 113.2 | P15 L16 A17 L21 M22 L23 L211 | P15-S19 PolarHBondContact O-N 3.25Å; P15-S19 PolarHBondContact O-OG 3.46Å; L16-S19 PolarHBondContact O-N 3.28Å; A17-S19 VanDerWaalsContact C-N 3.34Å; A17-S19 PolarHBondContact O-N 3.49Å; S19-L21 VanDerWaalsContact C-N 3.33Å; S19-M22 PolarHBondContact O-N 3.35Å; S19-L23 PolarHBondContact O-N 3.03Å; S19-L211 VanDerWaalsContact CB-CD2 3.42Å |
| 20 | V | 88.8 | Confident | 81.6 | Confident | 63 Ų | 63 | 56.2 Ų | 56.2 | 38% | 0.382 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -63.4 | -41.7 | 173.7 | 168.2 | 0 | 0 | 0 | 0 | 110.6 | L16 A17 L23 L24 L211 | L16-V20 HydrophobicContact CD2-CG2 3.92Å; L16-V20 HydrophobicContact CG-CG2 4.2Å; L16-V20 WeakPolarHBondContact O-CB 3.34Å; L16-V20 VanDerWaalsContact O-CG2 3.28Å; L16-V20 WeakPolarHBondContact O-CG2 3.32Å; L16-V20 PolarHBondContact O-N 3.22Å; A17-V20 PolarHBondContact O-N 3.15Å; V20-L23 PolarHBondContact O-N 3.13Å; V20-L24 WeakPolarHBondContact O-CB 3.33Å; V20-L24 PolarHBondContact O-N 3.33Å; V20-L211 HydrophobicContact CG2-CD1 4.25Å |
| 21 | L | 89.4 | Confident | 83.8 | Confident | 22 Ų | 22 | 53.8 Ų | 53.8 | 12% | 0.115 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -63 | -46.8 | 176.6 | 179.7 | 66.5 | 0 | 0 | 0 | 111.4 | A17 S18 S19 L23 L24 M25 L58 L73 Y121 | A17-L21 WeakPolarHBondContact O-CB 3.14Å; A17-L21 PolarHBondContact O-N 3.3Å; S18-L21 PolarHBondContact O-N 3.11Å; S19-L21 VanDerWaalsContact C-N 3.33Å; L21-L23 VanDerWaalsContact C-N 3.33Å; L21-L23 PolarHBondContact O-N 2.97Å; L21-L24 WeakPolarHBondContact O-CB 3.38Å; L21-L24 PolarHBondContact O-N 2.89Å; L21-L24 VanDerWaalsContact O-N 3.13Å; L21-M25 HydrophobicContact CD1-CE 3.66Å; L21-M25 HydrophobicContact CD1-SD 4.12Å; L21-M25 VanDerWaalsContact O-CG 3.3Å; L21-M25 WeakPolarHBondContact O-CG 3.44Å; L21-M25 PolarHBondContact O-N 3.43Å; L21-L58 HydrophobicContact CD1-CD2 3.66Å; L21-L73 HydrophobicContact CD2-CD1 3.88Å; L21-L73 HydrophobicContact CD2-CD2 3.55Å; L21-L73 HydrophobicContact CD2-CG 4.4Å; L21-L73 HydrophobicContact CG-CD1 4.02Å; L21-L73 HydrophobicContact CG-CD2 4.5Å; L21-Y121 HydrophobicContact CD1-CD2 4.21Å; L21-Y121 HydrophobicContact CD1-CE2 4.16Å; L21-Y121 HydrophobicContact CD2-CD2 3.73Å; L21-Y121 HydrophobicContact CD2-CE1 4.23Å; L21-Y121 HydrophobicContact CD2-CE2 3.23Å; L21-Y121 HydrophobicContact CD2-CG 4.47Å; L21-Y121 HydrophobicContact CG-CD2 4.4Å; L21-Y121 HydrophobicContact CG-CE2 4.25Å |
| 22 | M | 91.7 | Very high | 85.7 | Confident | 43 Ų | 43 | 53 Ų | 53 | 21% | 0.212 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -56.3 | -45.5 | 174.3 | -73.2 | 174.8 | 71.2 | 0 | 0 | 112.4 | S18 S19 L24 M25 S26 L70 L73 P74 | S18-M22 VanDerWaalsContact O-CG 3.29Å; S18-M22 WeakPolarHBondContact O-CG 3.39Å; S18-M22 PolarHBondContact O-N 3.29Å; S19-M22 PolarHBondContact O-N 3.35Å; M22-L24 VanDerWaalsContact C-N 3.31Å; M22-L24 PolarHBondContact O-N 3.17Å; M22-M25 PolarHBondContact O-N 3.02Å; M22-S26 WeakPolarHBondContact O-CB 3.27Å; M22-S26 PolarHBondContact O-N 3.27Å; M22-S26 PolarHBondContact O-OG 3.25Å; M22-L70 HydrophobicContact CB-CD2 3.82Å; M22-L70 HydrophobicContact CE-CD2 4.19Å; M22-L70 WeakPolarHBondContact CE-O 3.42Å; M22-L70 HydrophobicContact CG-CD2 3.92Å; M22-L73 HydrophobicContact CG-CB 3.68Å; M22-L73 HydrophobicContact CG-CD1 3.58Å; M22-L73 HydrophobicContact CG-CG 4.25Å; M22-L73 HydrophobicContact SD-CB 3.97Å; M22-P74 HydrophobicContact CE-CG 3.68Å; M22-P74 HydrophobicContact SD-CG 3.67Å |
| 23 | L | 91.1 | Very high | 87 | Confident | 128 Ų | 128 | 48.2 Ų | 48.2 | 67% | 0.67 | 29% | 0.285 | S | S | * | . | H | α-helix | trans | -61 | -42.4 | 176.5 | -169.4 | 93.6 | 0 | 0 | 0 | 111 | S19 V20 L21 S26 S27 | S19-L23 PolarHBondContact O-N 3.03Å; V20-L23 PolarHBondContact O-N 3.13Å; L21-L23 VanDerWaalsContact C-N 3.33Å; L21-L23 PolarHBondContact O-N 2.97Å; L23-S26 PolarHBondContact O-N 3.38Å; L23-S27 WeakPolarHBondContact O-CB 3.14Å; L23-S27 PolarHBondContact O-N 3.24Å; L23-S27 PolarHBondContact O-OG 3.28Å |
| 24 | L | 91.5 | Very high | 87.7 | Confident | 65 Ų | 65 | 45.9 Ų | 45.9 | 34% | 0.34 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -65.7 | -41.8 | 178.6 | -173.4 | 61 | 0 | 0 | 0 | 112.1 | V20 L21 M22 S26 S27 L28 L58 | V20-L24 WeakPolarHBondContact O-CB 3.33Å; V20-L24 PolarHBondContact O-N 3.33Å; L21-L24 WeakPolarHBondContact O-CB 3.38Å; L21-L24 PolarHBondContact O-N 2.89Å; L21-L24 VanDerWaalsContact O-N 3.13Å; M22-L24 VanDerWaalsContact C-N 3.31Å; M22-L24 PolarHBondContact O-N 3.17Å; L24-S26 VanDerWaalsContact C-N 3.33Å; L24-S26 PolarHBondContact O-N 2.81Å; L24-S27 PolarHBondContact O-N 2.96Å; L24-S27 PolarHBondContact O-OG 3.46Å; L24-S27 VanDerWaalsContact O-OG 3.12Å; L24-L28 HydrophobicContact CD1-CD1 3.93Å; L24-L28 HydrophobicContact CD1-CG 4.12Å; L24-L28 HydrophobicContact CG-CD1 3.88Å; L24-L28 HydrophobicContact CG-CG 4.46Å; L24-L28 WeakPolarHBondContact O-CB 3.44Å; L24-L28 VanDerWaalsContact O-CG 3.25Å; L24-L28 WeakPolarHBondContact O-CG 3.41Å; L24-L28 PolarHBondContact O-N 3.45Å; L24-L58 HydrophobicContact CD2-CD1 4.09Å; L24-L58 HydrophobicContact CD2-CD2 4.39Å |
| 25 | M | 91 | Very high | 87.9 | Confident | 0 Ų | 0 | 47.7 Ų | 47.7 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -61.8 | -46.8 | 175.5 | -56.7 | -52.6 | 73.8 | 0 | 0 | 110.1 | L21 M22 S27 W29 L58 L66 L70 | L21-M25 HydrophobicContact CD1-CE 3.66Å; L21-M25 HydrophobicContact CD1-SD 4.12Å; L21-M25 VanDerWaalsContact O-CG 3.3Å; L21-M25 WeakPolarHBondContact O-CG 3.44Å; L21-M25 PolarHBondContact O-N 3.43Å; M22-M25 PolarHBondContact O-N 3.02Å; M25-S27 PolarHBondContact O-N 2.93Å; M25-W29 VanDerWaalsContact O-CB 3.27Å; M25-W29 WeakPolarHBondContact O-CB 3.48Å; M25-W29 PolarHBondContact O-N 3.26Å; M25-L58 VanDerWaalsContact CE-CA 3.4Å; M25-L58 HydrophobicContact CE-CB 3.56Å; M25-L58 HydrophobicContact CE-CD2 3.65Å; M25-L58 HydrophobicContact CE-CG 4.16Å; M25-L58 WeakPolarHBondContact CE-O 3.5Å; M25-L58 HydrophobicContact SD-CB 4.44Å; M25-L66 HydrophobicContact CB-CD1 3.7Å; M25-L70 HydrophobicContact CB-CD2 4.48Å |
| 26 | S | 91.1 | Very high | 87.8 | Confident | 39 Ų | 39 | 50.7 Ų | 50.7 | 27% | 0.273 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -64 | -43 | -178.1 | -54.4 | 0 | 0 | 0 | 0 | 111.3 | M22 L23 L24 L30 | M22-S26 WeakPolarHBondContact O-CB 3.27Å; M22-S26 PolarHBondContact O-N 3.27Å; M22-S26 PolarHBondContact O-OG 3.25Å; L23-S26 PolarHBondContact O-N 3.38Å; L24-S26 VanDerWaalsContact C-N 3.33Å; L24-S26 PolarHBondContact O-N 2.81Å; S26-L30 WeakPolarHBondContact O-CB 3.22Å; S26-L30 WeakPolarHBondContact O-CG 3.48Å; S26-L30 PolarHBondContact O-N 3.27Å |
| 27 | S | 90.9 | Very high | 87.7 | Confident | 49 Ų | 49 | 51.3 Ų | 51.3 | 34% | 0.343 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -70.7 | -42.8 | 179.7 | 67.3 | 0 | 0 | 0 | 0 | 112.7 | L23 L24 M25 W29 L30 V31 | L23-S27 WeakPolarHBondContact O-CB 3.14Å; L23-S27 PolarHBondContact O-N 3.24Å; L23-S27 PolarHBondContact O-OG 3.28Å; L24-S27 PolarHBondContact O-N 2.96Å; L24-S27 PolarHBondContact O-OG 3.46Å; L24-S27 VanDerWaalsContact O-OG 3.12Å; M25-S27 PolarHBondContact O-N 2.93Å; S27-W29 VanDerWaalsContact C-N 3.32Å; S27-W29 PolarHBondContact O-N 3.35Å; S27-L30 PolarHBondContact O-N 3.24Å; S27-V31 VanDerWaalsContact O-CG2 3.31Å; S27-V31 WeakPolarHBondContact O-CG2 3.29Å; S27-V31 PolarHBondContact O-N 3.07Å |
| 28 | L | 89.9 | Confident | 87.6 | Confident | 40 Ų | 40 | 52.1 Ų | 52.1 | 21% | 0.209 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -63.9 | -37.4 | 175.9 | -71.7 | 171.2 | 0 | 0 | 0 | 112 | L24 G32 A33 L37 L58 | L24-L28 HydrophobicContact CD1-CD1 3.93Å; L24-L28 HydrophobicContact CD1-CG 4.12Å; L24-L28 HydrophobicContact CG-CD1 3.88Å; L24-L28 HydrophobicContact CG-CG 4.46Å; L24-L28 WeakPolarHBondContact O-CB 3.44Å; L24-L28 VanDerWaalsContact O-CG 3.25Å; L24-L28 WeakPolarHBondContact O-CG 3.41Å; L24-L28 PolarHBondContact O-N 3.45Å; L28-G32 PolarHBondContact O-N 3.4Å; L28-A33 HydrophobicContact CB-CB 4.38Å; L28-A33 HydrophobicContact CD2-CB 4Å; L28-A33 WeakPolarHBondContact O-CB 3.35Å; L28-A33 PolarHBondContact O-N 3.02Å; L28-L37 HydrophobicContact CD1-CD1 4Å; L28-L37 HydrophobicContact CD2-CD1 4.34Å; L28-L58 HydrophobicContact CD1-CB 3.81Å |
| 29 | W | 90.1 | Very high | 87.3 | Confident | 88 Ų | 88 | 52.1 Ų | 52.1 | 33% | 0.333 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -67.3 | -44.8 | 174.1 | -174.6 | 83 | 0 | 0 | 0 | 112.2 | M25 S27 V31 G32 L63 L66 | M25-W29 VanDerWaalsContact O-CB 3.27Å; M25-W29 WeakPolarHBondContact O-CB 3.48Å; M25-W29 PolarHBondContact O-N 3.26Å; S27-W29 VanDerWaalsContact C-N 3.32Å; S27-W29 PolarHBondContact O-N 3.35Å; W29-V31 VanDerWaalsContact C-N 3.28Å; W29-V31 PolarHBondContact O-N 2.88Å; W29-G32 PolarHBondContact O-N 2.89Å; W29-L63 HydrophobicContact CH2-CD1 3.89Å; W29-L63 HydrophobicContact CZ2-CB 4.1Å; W29-L63 HydrophobicContact CZ2-CD1 3.9Å; W29-L63 HydrophobicContact CZ2-CG 4.41Å; W29-L66 HydrophobicContact CB-CD1 4.41Å; W29-L66 HydrophobicContact CB-CD2 3.91Å; W29-L66 HydrophobicContact CD2-CD2 3.68Å; W29-L66 HydrophobicContact CE3-CD2 4.06Å; W29-L66 HydrophobicContact CG-CD2 3.59Å |
| 30 | L | 89.8 | Confident | 86.8 | Confident | 136 Ų | 136 | 52.4 Ų | 52.4 | 71% | 0.712 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -61.8 | -32.9 | 175.9 | -75.4 | 168.8 | 0 | 0 | 0 | 113.3 | S26 S27 G32 | S26-L30 WeakPolarHBondContact O-CB 3.22Å; S26-L30 WeakPolarHBondContact O-CG 3.48Å; S26-L30 PolarHBondContact O-N 3.27Å; S27-L30 PolarHBondContact O-N 3.24Å; L30-G32 VanDerWaalsContact C-N 3.25Å |
| 31 | V | 90.5 | Very high | 86.1 | Confident | 120 Ų | 120 | 51.1 Ų | 51.1 | 73% | 0.727 | 31% | 0.307 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.4 | -11.4 | 174.1 | 172.7 | 0 | 0 | 0 | 0 | 112.1 | S27 W29 A33 | S27-V31 VanDerWaalsContact O-CG2 3.31Å; S27-V31 WeakPolarHBondContact O-CG2 3.29Å; S27-V31 PolarHBondContact O-N 3.07Å; W29-V31 VanDerWaalsContact C-N 3.28Å; W29-V31 PolarHBondContact O-N 2.88Å; V31-A33 VanDerWaalsContact C-N 3.31Å |
| 32 | G | 85 | Confident | 85.4 | Confident | 52 Ų | 52 | 57.4 Ų | 57.4 | 54% | 0.536 | 34% | 0.335 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 72.2 | 23.1 | -176 | 0 | 0 | 0 | 0 | 0 | 113.5 | L28 W29 L30 G34 P35 | L28-G32 PolarHBondContact O-N 3.4Å; W29-G32 PolarHBondContact O-N 2.89Å; L30-G32 VanDerWaalsContact C-N 3.25Å; G32-G34 PolarHBondContact O-N 3.44Å; G32-P35 WeakPolarHBondContact O-CD 3.39Å |
| 33 | A | 84.9 | Confident | 84.2 | Confident | 15 Ų | 15 | 58.6 Ų | 58.6 | 12% | 0.124 | 34% | 0.342 | C | S | . | . | trans | -72.9 | -11.4 | -176.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | L28 V31 S36 L37 | L28-A33 HydrophobicContact CB-CB 4.38Å; L28-A33 HydrophobicContact CD2-CB 4Å; L28-A33 WeakPolarHBondContact O-CB 3.35Å; L28-A33 PolarHBondContact O-N 3.02Å; V31-A33 VanDerWaalsContact C-N 3.31Å; A33-S36 PolarHBondContact O-N 2.71Å; A33-S36 PolarHBondContact O-OG 3.3Å; A33-L37 HydrophobicContact CB-CD1 4.44Å; A33-L37 PolarHBondContact O-N 3.37Å | ||
| 34 | G | 79.8 | Confident | 83.2 | Confident | 2 Ų | 2 | 53.9 Ų | 53.9 | 2% | 0.021 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -43.2 | -57.6 | -177.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | G32 S36 L37 V38 | G32-G34 PolarHBondContact O-N 3.44Å; G34-S36 VanDerWaalsContact C-N 3.29Å; G34-S36 PolarHBondContact O-N 3.22Å; G34-L37 PolarHBondContact O-N 3.33Å; G34-L37 VanDerWaalsContact O-N 3.07Å; G34-V38 PolarHBondContact O-N 3.42Å |
| 35 | P | 81.8 | Confident | 82.2 | Confident | 93 Ų | 93 | 57.8 Ų | 57.8 | 60% | 0.604 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -60.2 | -32.7 | -179.9 | -24.6 | 35.2 | 0 | 0 | 0 | 114.2 | G32 L37 V38 | G32-P35 WeakPolarHBondContact O-CD 3.39Å; P35-L37 PolarHBondContact O-N 2.87Å; P35-V38 PolarHBondContact O-N 2.98Å |
| 36 | S | 81.6 | Confident | 81.5 | Confident | 71 Ų | 71 | 61.7 Ų | 61.7 | 50% | 0.497 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -75 | -15.8 | 179.6 | 75.5 | 0 | 0 | 0 | 0 | 112.8 | A33 G34 R52 | A33-S36 PolarHBondContact O-N 2.71Å; A33-S36 PolarHBondContact O-OG 3.3Å; G34-S36 VanDerWaalsContact C-N 3.29Å; G34-S36 PolarHBondContact O-N 3.22Å; S36-R52 PolarHBondContact O-NH1 3.02Å |
| 37 | L | 80.8 | Confident | 80.5 | Confident | 22 Ų | 22 | 64.8 Ų | 64.8 | 12% | 0.115 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -100.9 | -4.9 | 178.4 | -57.9 | 179.8 | 0 | 0 | 0 | 113.7 | L28 A33 G34 P35 H56 | L28-L37 HydrophobicContact CD1-CD1 4Å; L28-L37 HydrophobicContact CD2-CD1 4.34Å; A33-L37 HydrophobicContact CB-CD1 4.44Å; A33-L37 PolarHBondContact O-N 3.37Å; G34-L37 PolarHBondContact O-N 3.33Å; G34-L37 VanDerWaalsContact O-N 3.07Å; P35-L37 PolarHBondContact O-N 2.87Å; L37-H56 WeakPolarHBondContact O-CA 3.41Å; L37-H56 WeakPolarHBondContact O-CB 3.3Å |
| 38 | V | 84.2 | Confident | 79.7 | Confident | 26 Ų | 26 | 73.4 Ų | 73.4 | 16% | 0.158 | 40% | 0.404 | C | S | . | . | S | Bend | trans | -56.6 | 142 | -179 | 170.8 | 0 | 0 | 0 | 0 | 112.1 | G34 P35 A40 R52 T61 G117 C119 | G34-V38 PolarHBondContact O-N 3.42Å; P35-V38 PolarHBondContact O-N 2.98Å; V38-A40 PolarHBondContact O-N 3.47Å; V38-R52 PolarHBondContact O-NH1 3.18Å; V38-T61 HydrophobicContact CG2-CG2 4.39Å; V38-G117 WeakPolarHBondContact CG1-O 3.24Å; V38-C119 HydrophobicContact CG2-CB 4.17Å |
| 39 | L | 80.9 | Confident | 79.3 | Confident | 0 Ų | 0 | 73.2 Ų | 73.2 | 0% | 0 | 40% | 0.402 | C | S | . | . | trans | -74 | 87.3 | 178.7 | -161.3 | 78.7 | 0 | 0 | 0 | 111.2 | L44 L53 H56 A104 V105 G117 S118 | L39-L44 HydrophobicContact CD1-CD1 4.3Å; L39-L53 HydrophobicContact CD1-CD1 4.23Å; L39-H56 HydrophobicContact CB-CB 3.92Å; L39-H56 HydrophobicContact CD1-CB 3.96Å; L39-A104 HydrophobicContact CD2-CB 3.86Å; L39-V105 HydrophobicContact CD1-CG2 4.46Å; L39-V105 HydrophobicContact CD2-CG2 3.92Å; L39-V105 HydrophobicContact CG-CG2 4.06Å; L39-G117 WeakPolarHBondContact O-CA 3.29Å; L39-G117 PolarHBondContact O-N 3.03Å; L39-S118 WeakPolarHBondContact CB-O 3.42Å; L39-S118 PolarHBondContact N-O 3.5Å | ||
| 40 | A | 78.9 | Confident | 78.9 | Confident | 27 Ų | 27 | 72.6 Ų | 72.6 | 22% | 0.223 | 41% | 0.407 | C | S | . | . | trans | -99.2 | 117.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | V38 E42 L43 L44 | V38-A40 PolarHBondContact O-N 3.47Å; A40-E42 PolarHBondContact O-N 3.06Å; A40-L43 HydrophobicContact CB-CB 4.18Å; A40-L43 HydrophobicContact CB-CD1 3.94Å; A40-L43 HydrophobicContact CB-CG 4.04Å; A40-L43 PolarHBondContact O-N 3.05Å; A40-L44 PolarHBondContact O-N 2.94Å | ||
| 41 | P | 73.4 | Confident | 78.6 | Confident | 36 Ų | 36 | 70.9 Ų | 70.9 | 23% | 0.234 | 40% | 0.395 | C | S | . | . | G | 310 helix | trans | -58.8 | -43.9 | -179 | -25.1 | 35 | 0 | 0 | 0 | 113.2 | L43 L44 A108 A116 | P41-L43 PolarHBondContact O-N 3.11Å; P41-L44 PolarHBondContact O-N 3.36Å; P41-A108 HydrophobicContact CG-CB 3.73Å; P41-A116 HydrophobicContact CG-CB 3.47Å; P41-A116 VanDerWaalsContact CG-CB 3.47Å |
| 42 | E | 73.6 | Confident | 78.4 | Confident | 153 Ų | 153 | 66.7 Ų | 66.7 | 72% | 0.715 | 37% | 0.366 | S | S | * | . | G | 310 helix | trans | -57.5 | -35.2 | -179.5 | -50.8 | -52.8 | 145.7 | 0 | 0 | 112.7 | A40 | A40-E42 PolarHBondContact O-N 3.06Š|
| 43 | L | 67.8 | Low | 78.5 | Confident | 68 Ų | 68 | 65 Ų | 65 | 36% | 0.356 | 35% | 0.345 | S | S | . | . | G | 310 helix | trans | -84 | -13.5 | -178.4 | -62.1 | -179.3 | 0 | 0 | 0 | 113 | A40 P41 L45 Q49 | A40-L43 HydrophobicContact CB-CB 4.18Å; A40-L43 HydrophobicContact CB-CD1 3.94Å; A40-L43 HydrophobicContact CB-CG 4.04Å; A40-L43 PolarHBondContact O-N 3.05Å; P41-L43 PolarHBondContact O-N 3.11Å; L43-L45 VanDerWaalsContact C-N 3.31Å; L43-Q49 WeakPolarHBondContact O-CB 3.39Å |
| 44 | L | 70.4 | Confident | 78.5 | Confident | 29 Ų | 29 | 67.8 Ų | 67.8 | 15% | 0.152 | 36% | 0.358 | C | S | . | . | G | 310 helix | trans | -81.4 | -10.4 | 179.5 | -78.3 | 163.7 | 0 | 0 | 0 | 113.4 | L39 A40 P41 D46 R52 L53 V105 | L39-L44 HydrophobicContact CD1-CD1 4.3Å; A40-L44 PolarHBondContact O-N 2.94Å; P41-L44 PolarHBondContact O-N 3.36Å; L44-D46 VanDerWaalsContact C-N 3.25Å; L44-R52 HydrophobicContact CD2-CB 4.14Å; L44-L53 HydrophobicContact CD1-CD1 4.47Å; L44-L53 HydrophobicContact CD2-CB 4.38Å; L44-V105 HydrophobicContact CD1-CG1 4.3Å; L44-V105 HydrophobicContact CD1-CG2 3.43Å; L44-V105 VanDerWaalsContact CD1-CG2 3.43Å |
| 45 | L | 69.8 | Low | 78.9 | Confident | 147 Ų | 147 | 69 Ų | 69 | 77% | 0.77 | 37% | 0.365 | S | S | * | . | G | 310 helix | trans | -70.6 | -22.3 | 172.5 | -64.8 | 172 | 0 | 0 | 0 | 112.3 | L43 | L43-L45 VanDerWaalsContact C-N 3.31Š|
| 46 | D | 76.8 | Confident | 79.2 | Confident | 82 Ų | 82 | 64.6 Ų | 64.6 | 44% | 0.439 | 34% | 0.336 | S | S | . | . | S | Bend | trans | -76.9 | 123.2 | 171.2 | -78.1 | -32.2 | 0 | 0 | 0 | 110.9 | L44 W48 Q49 | L44-D46 VanDerWaalsContact C-N 3.25Å; D46-W48 PolarHBondContact O-N 3.5Å; D46-Q49 HydrophobicContact CB-CB 4.11Å; D46-Q49 HydrophobicContact CB-CG 3.81Å; D46-Q49 PolarHBondContact O-N 3.18Å; D46-Q49 PolarHBondContact OD2-NE2 3.13Å |
| 47 | P | 70.8 | Confident | 79.5 | Confident | 104 Ų | 104 | 61.4 Ų | 61.4 | 68% | 0.675 | 31% | 0.313 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.4 | -23 | -176.3 | 24 | -34 | 0 | 0 | 0 | 113.7 | Q49 | P47-Q49 VanDerWaalsContact C-N 3.33Š|
| 48 | W | 72.8 | Confident | 79.8 | Confident | 231 Ų | 231 | 62.1 Ų | 62.1 | 88% | 0.875 | 32% | 0.317 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.5 | -16.6 | 176.3 | -69.9 | 96.1 | 0 | 0 | 0 | 113.8 | D46 H51 | D46-W48 PolarHBondContact O-N 3.5Å; W48-H51 PolarHBondContact O-CE1 3.16Å; W48-H51 PolarHBondContact O-ND1 3.24Å |
| 49 | Q | 82.3 | Confident | 79.9 | Confident | 36 Ų | 36 | 60.9 Ų | 60.9 | 17% | 0.168 | 31% | 0.31 | C | S | . | . | S | Bend | trans | -101.3 | -0.5 | -173.2 | -61.6 | -155.2 | 66.6 | 0 | 0 | 113.8 | L43 D46 P47 H51 R52 | L43-Q49 WeakPolarHBondContact O-CB 3.39Å; D46-Q49 HydrophobicContact CB-CB 4.11Å; D46-Q49 HydrophobicContact CB-CG 3.81Å; D46-Q49 PolarHBondContact O-N 3.18Å; D46-Q49 PolarHBondContact OD2-NE2 3.13Å; P47-Q49 VanDerWaalsContact C-N 3.33Å; Q49-H51 PolarHBondContact O-N 2.86Å; Q49-R52 VanDerWaalsContact O-CB 3.28Å; Q49-R52 WeakPolarHBondContact O-CB 3.37Å; Q49-R52 VanDerWaalsContact O-CG 3.25Å; Q49-R52 WeakPolarHBondContact O-CG 3.35Å; Q49-R52 PolarHBondContact O-N 3.12Å |
| 50 | V | 82.2 | Confident | 80.1 | Confident | 74 Ų | 74 | 61.3 Ų | 61.3 | 45% | 0.448 | 31% | 0.312 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -54.5 | -26.2 | 176.1 | -178.7 | 0 | 0 | 0 | 0 | 112.6 | R52 L53 | V50-R52 PolarHBondContact O-N 3.08Å; V50-R52 VanDerWaalsContact O-N 3.12Å; V50-L53 WeakPolarHBondContact O-CB 3.47Å; V50-L53 PolarHBondContact O-N 2.97Å |
| 51 | H | 83.6 | Confident | 80.4 | Confident | 101 Ų | 101 | 62.5 Ų | 62.5 | 47% | 0.468 | 32% | 0.316 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.5 | -28.5 | 174.4 | 69.8 | -95.3 | 0 | 0 | 0 | 113.4 | W48 Q49 L53 L54 T55 | W48-H51 PolarHBondContact O-CE1 3.16Å; W48-H51 PolarHBondContact O-ND1 3.24Å; Q49-H51 PolarHBondContact O-N 2.86Å; H51-L53 PolarHBondContact O-N 2.88Å; H51-L54 PolarHBondContact O-N 3.23Å; H51-T55 PolarHBondContact O-N 3.49Å; H51-T55 PolarHBondContact O-OG1 2.92Å |
| 52 | R | 85.8 | Confident | 80.9 | Confident | 31 Ų | 31 | 61.9 Ų | 61.9 | 12% | 0.117 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -53.2 | -34.6 | 173.7 | -68.6 | 175.1 | 177.1 | -71.3 | -12.7 | 112.6 | S36 V38 L44 Q49 V50 L54 T55 H56 | S36-R52 PolarHBondContact O-NH1 3.02Å; V38-R52 PolarHBondContact O-NH1 3.18Å; L44-R52 HydrophobicContact CD2-CB 4.14Å; Q49-R52 VanDerWaalsContact O-CB 3.28Å; Q49-R52 WeakPolarHBondContact O-CB 3.37Å; Q49-R52 VanDerWaalsContact O-CG 3.25Å; Q49-R52 WeakPolarHBondContact O-CG 3.35Å; Q49-R52 PolarHBondContact O-N 3.12Å; V50-R52 PolarHBondContact O-N 3.08Å; V50-R52 VanDerWaalsContact O-N 3.12Å; R52-L54 PolarHBondContact O-N 2.73Å; R52-T55 WeakPolarHBondContact CA-OG1 3.32Å; R52-T55 PolarHBondContact O-N 3.02Å; R52-H56 VanDerWaalsContact O-CB 3.32Å; R52-H56 WeakPolarHBondContact O-CB 3.49Å; R52-H56 PolarHBondContact O-N 3.4Å |
| 53 | L | 85.7 | Confident | 81.6 | Confident | 17 Ų | 17 | 58.7 Ų | 58.7 | 9% | 0.089 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -60.2 | -30.4 | 179 | -161.7 | 74.7 | 0 | 0 | 0 | 112.3 | L39 L44 V50 H51 H56 L98 L102 | L39-L53 HydrophobicContact CD1-CD1 4.23Å; L44-L53 HydrophobicContact CD1-CD1 4.47Å; L44-L53 HydrophobicContact CD2-CB 4.38Å; V50-L53 WeakPolarHBondContact O-CB 3.47Å; V50-L53 PolarHBondContact O-N 2.97Å; H51-L53 PolarHBondContact O-N 2.88Å; L53-H56 PolarHBondContact O-CE1 3.09Å; L53-H56 PolarHBondContact O-ND1 3.21Å; L53-L98 HydrophobicContact CB-CD2 4.17Å; L53-L98 HydrophobicContact CD2-CD2 3.65Å; L53-L98 HydrophobicContact CG-CD2 3.92Å; L53-L102 HydrophobicContact CD1-CD2 4.14Å; L53-L102 HydrophobicContact CD1-CG 4.2Å; L53-L102 HydrophobicContact CD2-CD1 4.48Å; L53-L102 HydrophobicContact CD2-CD2 3.76Å; L53-L102 HydrophobicContact CD2-CG 3.84Å; L53-L102 HydrophobicContact CG-CG 4.46Å |
| 54 | L | 86.1 | Confident | 82.5 | Confident | 74 Ų | 74 | 58 Ų | 58 | 39% | 0.387 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -94.3 | -40.9 | 173.3 | -173 | 65 | 0 | 0 | 0 | 111.9 | H51 R52 H56 A94 A97 L98 | H51-L54 PolarHBondContact O-N 3.23Å; R52-L54 PolarHBondContact O-N 2.73Å; L54-H56 PolarHBondContact O-N 3.32Å; L54-A94 HydrophobicContact CD1-CB 3.95Å; L54-A97 HydrophobicContact CD1-CB 3.97Å; L54-L98 HydrophobicContact CB-CD2 4.24Å; L54-L98 HydrophobicContact CD1-CG 4.33Å |
| 55 | T | 87.6 | Confident | 83.3 | Confident | 28 Ų | 28 | 57 Ų | 57 | 17% | 0.172 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -79 | -14.4 | -173.3 | 62.2 | 0 | 0 | 0 | 0 | 114.7 | H51 R52 V57 L58 G59 | H51-T55 PolarHBondContact O-N 3.49Å; H51-T55 PolarHBondContact O-OG1 2.92Å; R52-T55 WeakPolarHBondContact CA-OG1 3.32Å; R52-T55 PolarHBondContact O-N 3.02Å; T55-V57 PolarHBondContact O-N 2.92Å; T55-L58 HydrophobicContact CG2-CD1 4.16Å; T55-L58 WeakPolarHBondContact O-CA 3.48Å; T55-L58 VanDerWaalsContact O-CB 3.31Å; T55-L58 WeakPolarHBondContact O-CB 3.39Å; T55-L58 PolarHBondContact O-N 3.37Å; T55-G59 PolarHBondContact O-N 3.04Å |
| 56 | H | 87.9 | Confident | 84.2 | Confident | 0 Ų | 0 | 50.4 Ų | 50.4 | 0% | 0 | 26% | 0.263 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -60 | -29.2 | 174.8 | 81.3 | -77.5 | 0 | 0 | 0 | 113.1 | L37 L39 R52 L53 L54 L58 G59 C119 G120 Q167 | L37-H56 WeakPolarHBondContact O-CA 3.41Å; L37-H56 WeakPolarHBondContact O-CB 3.3Å; L39-H56 HydrophobicContact CB-CB 3.92Å; L39-H56 HydrophobicContact CD1-CB 3.96Å; R52-H56 VanDerWaalsContact O-CB 3.32Å; R52-H56 WeakPolarHBondContact O-CB 3.49Å; R52-H56 PolarHBondContact O-N 3.4Å; L53-H56 PolarHBondContact O-CE1 3.09Å; L53-H56 PolarHBondContact O-ND1 3.21Å; L54-H56 PolarHBondContact O-N 3.32Å; H56-L58 PolarHBondContact O-N 2.99Å; H56-G59 PolarHBondContact O-N 3.08Å; H56-C119 CarbonylContact O-C 3.33Å; H56-C119 VanDerWaalsContact O-CA 3.25Å; H56-C119 WeakPolarHBondContact O-CA 3.23Å; H56-C119 VanDerWaalsContact O-CB 3.25Å; H56-C119 WeakPolarHBondContact O-CB 3.42Å; H56-G120 PolarHBondContact O-N 3.24Å; H56-Q167 PolarHBondContact NE2-NE2 3.19Å; H56-Q167 VanDerWaalsContact NE2-NE2 3.19Å |
| 57 | V | 89.2 | Confident | 84.9 | Confident | 3 Ų | 3 | 51.3 Ų | 51.3 | 2% | 0.018 | 27% | 0.267 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -70.3 | -23.5 | 176.2 | -168 | 0 | 0 | 0 | 0 | 111.1 | T55 A97 G120 Y121 V124 | T55-V57 PolarHBondContact O-N 2.92Å; V57-A97 HydrophobicContact CB-CB 4.36Å; V57-A97 HydrophobicContact CG2-CB 3.47Å; V57-A97 VanDerWaalsContact CG2-CB 3.47Å; V57-G120 CarbonylContact O-C 3.45Å; V57-Y121 HydrophobicContact CG1-CD2 3.32Å; V57-Y121 HydrophobicContact CG1-CE2 3.89Å; V57-Y121 HydrophobicContact CG1-CG 3.89Å; V57-Y121 PolarHBondContact O-N 2.88Å; V57-V124 HydrophobicContact CG1-CB 4.24Å; V57-V124 HydrophobicContact CG1-CG2 3.55Å; V57-V124 HydrophobicContact CG2-CG2 4.13Å |
| 58 | L | 86.9 | Confident | 85.7 | Confident | 37 Ų | 37 | 47.4 Ų | 47.4 | 19% | 0.194 | 24% | 0.24 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -89.5 | -16.2 | -178.7 | -45.8 | 177.8 | 0 | 0 | 0 | 113.7 | L21 L24 M25 L28 T55 H56 | L21-L58 HydrophobicContact CD1-CD2 3.66Å; L24-L58 HydrophobicContact CD2-CD1 4.09Å; L24-L58 HydrophobicContact CD2-CD2 4.39Å; M25-L58 VanDerWaalsContact CE-CA 3.4Å; M25-L58 HydrophobicContact CE-CB 3.56Å; M25-L58 HydrophobicContact CE-CD2 3.65Å; M25-L58 HydrophobicContact CE-CG 4.16Å; M25-L58 WeakPolarHBondContact CE-O 3.5Å; M25-L58 HydrophobicContact SD-CB 4.44Å; L28-L58 HydrophobicContact CD1-CB 3.81Å; T55-L58 HydrophobicContact CG2-CD1 4.16Å; T55-L58 WeakPolarHBondContact O-CA 3.48Å; T55-L58 VanDerWaalsContact O-CB 3.31Å; T55-L58 WeakPolarHBondContact O-CB 3.39Å; T55-L58 PolarHBondContact O-N 3.37Å; H56-L58 PolarHBondContact O-N 2.99Å |
| 59 | G | 84.9 | Confident | 86.5 | Confident | 0 Ų | 0 | 36.4 Ų | 36.4 | 0% | 0 | 20% | 0.199 | C | C | . | . | trans | -88.3 | 140.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | T55 H56 C119 G120 | T55-G59 PolarHBondContact O-N 3.04Å; H56-G59 PolarHBondContact O-N 3.08Å; G59-C119 CarbonylContact O-C 3.51Å; G59-C119 VanDerWaalsContact O-CB 3.25Å; G59-C119 WeakPolarHBondContact O-CB 3.39Å; G59-C119 PolarHBondContact O-SG 2.96Å; G59-C119 VanDerWaalsContact O-SG 3.33Å; G59-G120 WeakPolarHBondContact O-CA 3.39Å; G59-G120 PolarHBondContact O-N 3.18Å | ||
| 60 | H | 86 | Confident | 87 | Confident | 10 Ų | 10 | 36.3 Ų | 36.3 | 5% | 0.046 | 20% | 0.199 | C | C | . | . | trans | -129.5 | 132.6 | 164.9 | -67.5 | 85.7 | 0 | 0 | 0 | 108.9 | L66 S69 Y121 | H60-L66 HydrophobicContact CB-CB 4.05Å; H60-L66 HydrophobicContact CB-CD1 4.21Å; H60-L66 PolarHBondContact CD2-N 2.99Å; H60-S69 PolarHBondContact NE2-OG 3.02Å; H60-Y121 PolarHBondContact NE2-N 3.26Å | ||
| 61 | T | 84.5 | Confident | 87.3 | Confident | 52 Ų | 52 | 38 Ų | 38 | 32% | 0.319 | 21% | 0.206 | S | C | . | . | S | Bend | trans | -91.4 | -46.7 | 172.7 | 37.8 | 0 | 0 | 0 | 0 | 110.7 | V38 C119 E162 | V38-T61 HydrophobicContact CG2-CG2 4.39Å; T61-C119 PolarHBondContact N-SG 3Å; T61-E162 VanDerWaalsContact CB-OE2 3.26Å; T61-E162 WeakPolarHBondContact CB-OE2 3.34Å; T61-E162 PolarHBondContact OG1-OE1 3.43Å; T61-E162 PolarHBondContact OG1-OE2 2.83Å |
| 62 | A | 85 | Confident | 87.5 | Confident | 22 Ų | 22 | 34.2 Ų | 34.2 | 18% | 0.182 | 19% | 0.188 | C | C | . | . | S | Bend | trans | -93.7 | 131.2 | 179.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | P64 G65 L66 E162 | A62-P64 HydrophobicContact CB-CG 4.16Å; A62-G65 PolarHBondContact O-N 2.99Å; A62-L66 PolarHBondContact O-N 3.29Å; A62-L66 VanDerWaalsContact O-N 3.12Å; A62-E162 HydrophobicContact CB-CB 4.46Å |
| 63 | L | 87.5 | Confident | 87.6 | Confident | 86 Ų | 86 | 32.7 Ų | 32.7 | 45% | 0.45 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -54.7 | -43.2 | 171.5 | -179.2 | 146.3 | 0 | 0 | 0 | 114.5 | W29 G65 L66 L67 | W29-L63 HydrophobicContact CH2-CD1 3.89Å; W29-L63 HydrophobicContact CZ2-CB 4.1Å; W29-L63 HydrophobicContact CZ2-CD1 3.9Å; W29-L63 HydrophobicContact CZ2-CG 4.41Å; L63-G65 PolarHBondContact O-N 3Å; L63-L66 WeakPolarHBondContact O-CB 3.27Å; L63-L66 PolarHBondContact O-N 3.27Å; L63-L67 HydrophobicContact CD2-CD1 3.55Å; L63-L67 HydrophobicContact CD2-CG 4.02Å; L63-L67 HydrophobicContact CG-CD1 4.42Å; L63-L67 HydrophobicContact CG-CG 4.4Å; L63-L67 WeakPolarHBondContact O-CG 3.11Å; L63-L67 PolarHBondContact O-N 3.12Å |
| 64 | P | 87.4 | Confident | 87.6 | Confident | 55 Ų | 55 | 33.4 Ų | 33.4 | 36% | 0.357 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -61.6 | -39.6 | 176.3 | 20.8 | -33.1 | 0 | 0 | 0 | 113.2 | A62 L66 L67 L68 | A62-P64 HydrophobicContact CB-CG 4.16Å; P64-L66 PolarHBondContact O-N 2.8Å; P64-L67 PolarHBondContact O-N 2.87Å; P64-L68 WeakPolarHBondContact O-CB 3.17Å; P64-L68 PolarHBondContact O-N 3.44Å |
| 65 | G | 86 | Confident | 87.5 | Confident | 7 Ų | 7 | 33.6 Ų | 33.6 | 7% | 0.072 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -64.2 | -37.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113 | A62 L63 S69 S160 | A62-G65 PolarHBondContact O-N 2.99Å; L63-G65 PolarHBondContact O-N 3Å; G65-S69 WeakPolarHBondContact O-CB 3.24Å; G65-S69 PolarHBondContact O-N 2.83Å; G65-S69 VanDerWaalsContact O-N 3.11Å; G65-S69 PolarHBondContact O-OG 3.17Å; G65-S160 PolarHBondContact N-OG 3.44Å |
| 66 | L | 89.9 | Confident | 87.2 | Confident | 9 Ų | 9 | 34.2 Ų | 34.2 | 5% | 0.047 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -63.6 | -52.9 | 171.8 | -179.9 | 73.8 | 0 | 0 | 0 | 111.1 | M25 W29 H60 A62 L63 P64 L68 S69 L70 | M25-L66 HydrophobicContact CB-CD1 3.7Å; W29-L66 HydrophobicContact CB-CD1 4.41Å; W29-L66 HydrophobicContact CB-CD2 3.91Å; W29-L66 HydrophobicContact CD2-CD2 3.68Å; W29-L66 HydrophobicContact CE3-CD2 4.06Å; W29-L66 HydrophobicContact CG-CD2 3.59Å; H60-L66 HydrophobicContact CB-CB 4.05Å; H60-L66 HydrophobicContact CB-CD1 4.21Å; H60-L66 PolarHBondContact CD2-N 2.99Å; A62-L66 PolarHBondContact O-N 3.29Å; A62-L66 VanDerWaalsContact O-N 3.12Å; L63-L66 WeakPolarHBondContact O-CB 3.27Å; L63-L66 PolarHBondContact O-N 3.27Å; P64-L66 PolarHBondContact O-N 2.8Å; L66-L68 VanDerWaalsContact C-N 3.31Å; L66-L68 PolarHBondContact O-N 2.86Å; L66-S69 WeakPolarHBondContact O-CB 3.32Å; L66-S69 PolarHBondContact O-N 3.09Å; L66-S69 VanDerWaalsContact O-N 3.08Å; L66-L70 HydrophobicContact CD1-CD1 4.21Å; L66-L70 HydrophobicContact CD1-CG 4.29Å; L66-L70 HydrophobicContact CD2-CD1 4.25Å; L66-L70 HydrophobicContact CG-CD1 3.84Å; L66-L70 HydrophobicContact CG-CG 4.25Å; L66-L70 WeakPolarHBondContact O-CG 3.38Å; L66-L70 PolarHBondContact O-N 3.46Å |
| 67 | L | 90.3 | Very high | 87 | Confident | 101 Ų | 101 | 34.2 Ų | 34.2 | 53% | 0.529 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -57.9 | -42.3 | -179.6 | -73.4 | -177.1 | 0 | 0 | 0 | 112.1 | L63 P64 S69 L70 L71 | L63-L67 HydrophobicContact CD2-CD1 3.55Å; L63-L67 HydrophobicContact CD2-CG 4.02Å; L63-L67 HydrophobicContact CG-CD1 4.42Å; L63-L67 HydrophobicContact CG-CG 4.4Å; L63-L67 WeakPolarHBondContact O-CG 3.11Å; L63-L67 PolarHBondContact O-N 3.12Å; P64-L67 PolarHBondContact O-N 2.87Å; L67-S69 VanDerWaalsContact C-N 3.34Å; L67-S69 PolarHBondContact O-N 3.45Å; L67-L70 PolarHBondContact O-N 3.3Å; L67-L71 WeakPolarHBondContact O-CB 3.44Å; L67-L71 PolarHBondContact O-N 2.97Å |
| 68 | L | 88.9 | Confident | 86.9 | Confident | 21 Ų | 21 | 37.5 Ų | 37.5 | 11% | 0.11 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -63.6 | -41 | 176.7 | -169.1 | 62.2 | 0 | 0 | 0 | 111 | P64 L66 L71 L72 M122 T156 | P64-L68 WeakPolarHBondContact O-CB 3.17Å; P64-L68 PolarHBondContact O-N 3.44Å; L66-L68 VanDerWaalsContact C-N 3.31Å; L66-L68 PolarHBondContact O-N 2.86Å; L68-L71 PolarHBondContact O-N 3.11Å; L68-L72 HydrophobicContact CD1-CD1 3.79Å; L68-L72 HydrophobicContact CG-CD1 4.16Å; L68-L72 WeakPolarHBondContact O-CB 3.43Å; L68-L72 VanDerWaalsContact O-CD1 3.27Å; L68-L72 WeakPolarHBondContact O-CD1 3.44Å; L68-L72 PolarHBondContact O-N 3.36Å; L68-M122 HydrophobicContact CB-CE 3.87Å; L68-M122 HydrophobicContact CD2-CE 3.8Å; L68-M122 HydrophobicContact CD2-SD 4.2Å; L68-M122 HydrophobicContact CG-CE 3.58Å; L68-M122 HydrophobicContact CG-SD 4.33Å; L68-T156 HydrophobicContact CD2-CG2 4.26Å |
| 69 | S | 89.6 | Confident | 86.6 | Confident | 1 Ų | 1 | 41 Ų | 41 | 1% | 0.007 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -65.3 | -41.9 | 175.2 | -52.8 | 0 | 0 | 0 | 0 | 112.1 | H60 G65 L66 L67 L71 L72 L73 M122 | H60-S69 PolarHBondContact NE2-OG 3.02Å; G65-S69 WeakPolarHBondContact O-CB 3.24Å; G65-S69 PolarHBondContact O-N 2.83Å; G65-S69 VanDerWaalsContact O-N 3.11Å; G65-S69 PolarHBondContact O-OG 3.17Å; L66-S69 WeakPolarHBondContact O-CB 3.32Å; L66-S69 PolarHBondContact O-N 3.09Å; L66-S69 VanDerWaalsContact O-N 3.08Å; L67-S69 VanDerWaalsContact C-N 3.34Å; L67-S69 PolarHBondContact O-N 3.45Å; S69-L71 VanDerWaalsContact C-N 3.26Å; S69-L71 PolarHBondContact O-N 3.06Å; S69-L72 PolarHBondContact O-N 3.01Å; S69-L73 WeakPolarHBondContact O-CG 3.39Å; S69-L73 PolarHBondContact O-N 3.11Å; S69-M122 WeakPolarHBondContact OG-CE 3.29Å |
| 70 | L | 91.1 | Very high | 86.5 | Confident | 33 Ų | 33 | 41.5 Ų | 41.5 | 17% | 0.173 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -69 | -20.7 | 176.4 | -68.1 | 176.9 | 0 | 0 | 0 | 113.3 | M22 M25 L66 L67 P74 | M22-L70 HydrophobicContact CB-CD2 3.82Å; M22-L70 HydrophobicContact CE-CD2 4.19Å; M22-L70 WeakPolarHBondContact CE-O 3.42Å; M22-L70 HydrophobicContact CG-CD2 3.92Å; M25-L70 HydrophobicContact CB-CD2 4.48Å; L66-L70 HydrophobicContact CD1-CD1 4.21Å; L66-L70 HydrophobicContact CD1-CG 4.29Å; L66-L70 HydrophobicContact CD2-CD1 4.25Å; L66-L70 HydrophobicContact CG-CD1 3.84Å; L66-L70 HydrophobicContact CG-CG 4.25Å; L66-L70 WeakPolarHBondContact O-CG 3.38Å; L66-L70 PolarHBondContact O-N 3.46Å; L67-L70 PolarHBondContact O-N 3.3Å; L70-P74 WeakPolarHBondContact O-CD 3.49Å; L70-P74 WeakPolarHBondContact O-CG 3.49Å |
| 71 | L | 89.8 | Confident | 86.5 | Confident | 111 Ų | 111 | 41 Ų | 41 | 58% | 0.581 | 22% | 0.222 | S | C | * | . | H | α-helix | trans | -86.6 | -34.6 | 173.1 | -174.2 | 65.5 | 0 | 0 | 0 | 112.3 | L67 L68 S69 T75 | L67-L71 WeakPolarHBondContact O-CB 3.44Å; L67-L71 PolarHBondContact O-N 2.97Å; L68-L71 PolarHBondContact O-N 3.11Å; S69-L71 VanDerWaalsContact C-N 3.26Å; S69-L71 PolarHBondContact O-N 3.06Å; L71-T75 WeakPolarHBondContact O-CG2 3.27Å; L71-T75 PolarHBondContact O-OG1 3.41Å |
| 72 | L | 87.6 | Confident | 86.3 | Confident | 20 Ų | 20 | 41.8 Ų | 41.8 | 11% | 0.105 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -78.6 | -28 | 178.7 | -92.1 | 69.8 | 0 | 0 | 0 | 113.3 | L68 S69 T75 L76 G77 M122 H125 L152 | L68-L72 HydrophobicContact CD1-CD1 3.79Å; L68-L72 HydrophobicContact CG-CD1 4.16Å; L68-L72 WeakPolarHBondContact O-CB 3.43Å; L68-L72 VanDerWaalsContact O-CD1 3.27Å; L68-L72 WeakPolarHBondContact O-CD1 3.44Å; L68-L72 PolarHBondContact O-N 3.36Å; S69-L72 PolarHBondContact O-N 3.01Å; L72-T75 WeakPolarHBondContact CA-OG1 3.19Å; L72-T75 PolarHBondContact O-N 3.24Å; L72-T75 PolarHBondContact O-OG1 3.35Å; L72-L76 HydrophobicContact CB-CD1 4.37Å; L72-L76 HydrophobicContact CD2-CD1 3.91Å; L72-L76 HydrophobicContact CG-CD1 3.96Å; L72-L76 WeakPolarHBondContact O-CB 3.49Å; L72-L76 PolarHBondContact O-N 3.19Å; L72-G77 PolarHBondContact O-N 3.36Å; L72-M122 HydrophobicContact CD2-CE 4.45Å; L72-M122 HydrophobicContact CD2-SD 3.76Å; L72-H125 VanDerWaalsContact CB-NE2 3.32Å; L72-H125 WeakPolarHBondContact CB-NE2 3.33Å; L72-H125 HydrophobicContact CD2-CB 4.03Å; L72-L152 HydrophobicContact CD2-CD1 3.74Å; L72-L152 HydrophobicContact CD2-CD2 3.76Å; L72-L152 HydrophobicContact CD2-CG 4.43Å |
| 73 | L | 88.3 | Confident | 85.8 | Confident | 0 Ų | 0 | 46.9 Ų | 46.9 | 0% | 0 | 25% | 0.249 | C | C | . | . | I | π-helix | trans | -63.4 | -45.6 | 176.2 | -78.5 | 167.5 | 0 | 0 | 0 | 113.7 | L21 M22 S69 G77 W78 Y121 | L21-L73 HydrophobicContact CD2-CD1 3.88Å; L21-L73 HydrophobicContact CD2-CD2 3.55Å; L21-L73 HydrophobicContact CD2-CG 4.4Å; L21-L73 HydrophobicContact CG-CD1 4.02Å; L21-L73 HydrophobicContact CG-CD2 4.5Å; M22-L73 HydrophobicContact CG-CB 3.68Å; M22-L73 HydrophobicContact CG-CD1 3.58Å; M22-L73 HydrophobicContact CG-CG 4.25Å; M22-L73 HydrophobicContact SD-CB 3.97Å; S69-L73 WeakPolarHBondContact O-CG 3.39Å; S69-L73 PolarHBondContact O-N 3.11Å; L73-G77 CarbonylContact O-C 3.55Å; L73-G77 WeakPolarHBondContact O-CA 3.29Å; L73-G77 PolarHBondContact O-N 3.1Å; L73-W78 PolarHBondContact O-N 2.94Å; L73-Y121 HydrophobicContact CD2-CD1 4.38Å; L73-Y121 HydrophobicContact CD2-CE1 3.94Å |
| 74 | P | 85.9 | Confident | 85.4 | Confident | 31 Ų | 31 | 45.4 Ų | 45.4 | 20% | 0.201 | 24% | 0.241 | C | C | . | . | I | π-helix | trans | -68.5 | -29.9 | 173.4 | -24.6 | 35.4 | 0 | 0 | 0 | 114.8 | M22 L70 W78 | M22-P74 HydrophobicContact CE-CG 3.68Å; M22-P74 HydrophobicContact SD-CG 3.67Å; L70-P74 WeakPolarHBondContact O-CD 3.49Å; L70-P74 WeakPolarHBondContact O-CG 3.49Å; P74-W78 HydrophobicContact CB-CD2 4.1Å; P74-W78 HydrophobicContact CB-CE3 3.84Å; P74-W78 HydrophobicContact CB-CH2 4.07Å; P74-W78 HydrophobicContact CB-CZ2 4.32Å; P74-W78 HydrophobicContact CB-CZ3 3.82Å; P74-W78 WeakPolarHBondContact O-CB 3.39Å |
| 75 | T | 82.8 | Confident | 85.1 | Confident | 78 Ų | 78 | 42.8 Ų | 42.8 | 48% | 0.479 | 22% | 0.224 | S | C | . | . | I | π-helix | trans | -90 | -39.5 | -173.4 | 50.5 | 0 | 0 | 0 | 0 | 112.9 | L71 L72 Q79 | L71-T75 WeakPolarHBondContact O-CG2 3.27Å; L71-T75 PolarHBondContact O-OG1 3.41Å; L72-T75 WeakPolarHBondContact CA-OG1 3.19Å; L72-T75 PolarHBondContact O-N 3.24Å; L72-T75 PolarHBondContact O-OG1 3.35Å; T75-Q79 WeakPolarHBondContact O-CG 3.39Å |
| 76 | L | 82.3 | Confident | 85 | Confident | 41 Ų | 41 | 42.7 Ų | 42.7 | 22% | 0.215 | 22% | 0.222 | C | C | . | . | I | π-helix | trans | -105.9 | -48.2 | 179.4 | -57.2 | 176.6 | 0 | 0 | 0 | 111.8 | L72 W78 Q79 Q80 L129 | L72-L76 HydrophobicContact CB-CD1 4.37Å; L72-L76 HydrophobicContact CD2-CD1 3.91Å; L72-L76 HydrophobicContact CG-CD1 3.96Å; L72-L76 WeakPolarHBondContact O-CB 3.49Å; L72-L76 PolarHBondContact O-N 3.19Å; L76-W78 PolarHBondContact O-N 3.15Å; L76-Q79 PolarHBondContact O-N 3.05Å; L76-Q80 PolarHBondContact O-N 3.25Å; L76-L129 HydrophobicContact CD1-CD1 3.87Å; L76-L129 HydrophobicContact CD1-CD2 4.05Å; L76-L129 HydrophobicContact CD1-CG 4.04Å; L76-L129 HydrophobicContact CD2-CD2 4.04Å |
| 77 | G | 82.8 | Confident | 84.7 | Confident | 0 Ų | 0 | 43.4 Ų | 43.4 | 0% | 0 | 23% | 0.226 | C | C | . | . | I | π-helix | trans | -57.8 | -48 | -177.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | S18 L72 L73 Q79 Q80 E81 | S18-G77 PolarHBondContact OG-O 3.46Å; L72-G77 PolarHBondContact O-N 3.36Å; L73-G77 CarbonylContact O-C 3.55Å; L73-G77 WeakPolarHBondContact O-CA 3.29Å; L73-G77 PolarHBondContact O-N 3.1Å; G77-Q79 PolarHBondContact O-N 3.09Å; G77-Q80 PolarHBondContact O-N 2.87Å; G77-E81 WeakPolarHBondContact O-CB 3.45Å; G77-E81 PolarHBondContact O-N 3.21Å |
| 78 | W | 86.7 | Confident | 84.4 | Confident | 73 Ų | 73 | 41 Ų | 41 | 28% | 0.277 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -59.6 | -41.4 | 175.4 | -71.9 | -7.3 | 0 | 0 | 0 | 113.6 | L14 P15 L73 P74 L76 C82 | L14-W78 HydrophobicContact CD2-CH2 3.69Å; L14-W78 HydrophobicContact CD2-CZ2 3.74Å; L14-W78 HydrophobicContact CD2-CZ3 4.45Å; P15-W78 HydrophobicContact CG-CB 3.94Å; P15-W78 HydrophobicContact CG-CD2 4.35Å; P15-W78 HydrophobicContact CG-CG 3.57Å; L73-W78 PolarHBondContact O-N 2.94Å; P74-W78 HydrophobicContact CB-CD2 4.1Å; P74-W78 HydrophobicContact CB-CE3 3.84Å; P74-W78 HydrophobicContact CB-CH2 4.07Å; P74-W78 HydrophobicContact CB-CZ2 4.32Å; P74-W78 HydrophobicContact CB-CZ3 3.82Å; P74-W78 WeakPolarHBondContact O-CB 3.39Å; L76-W78 PolarHBondContact O-N 3.15Å; W78-C82 WeakPolarHBondContact O-CB 3.48Å; W78-C82 PolarHBondContact O-N 3.06Å; W78-C82 PolarHBondContact O-SG 2.94Å |
| 79 | Q | 82.4 | Confident | 84.3 | Confident | 111 Ų | 111 | 40 Ų | 40 | 52% | 0.519 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -66.1 | -43.2 | 178 | -63.5 | -62.1 | -35.3 | 0 | 0 | 111 | T75 L76 G77 C82 H83 | T75-Q79 WeakPolarHBondContact O-CG 3.39Å; L76-Q79 PolarHBondContact O-N 3.05Å; G77-Q79 PolarHBondContact O-N 3.09Å; Q79-C82 PolarHBondContact O-N 3.41Å; Q79-H83 WeakPolarHBondContact O-CB 3.26Å; Q79-H83 PolarHBondContact O-CD2 2.86Å; Q79-H83 PolarHBondContact O-N 3.47Å |
| 80 | Q | 82.4 | Confident | 84.2 | Confident | 10 Ų | 10 | 44.7 Ų | 44.7 | 5% | 0.047 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -68.6 | -38.5 | 177.4 | -69 | -161 | -0.7 | 0 | 0 | 113.1 | L76 G77 C82 H83 L84 F89 M128 E132 | L76-Q80 PolarHBondContact O-N 3.25Å; G77-Q80 PolarHBondContact O-N 2.87Å; Q80-C82 VanDerWaalsContact C-N 3.29Å; Q80-C82 PolarHBondContact O-N 3.36Å; Q80-H83 PolarHBondContact O-N 3.24Å; Q80-L84 WeakPolarHBondContact O-CB 3.41Å; Q80-L84 WeakPolarHBondContact O-CG 3.16Å; Q80-L84 PolarHBondContact O-N 2.86Å; Q80-F89 HydrophobicContact CB-CD2 3.98Å; Q80-F89 HydrophobicContact CB-CE2 4.2Å; Q80-M128 PolarHBondContact NE2-O 3.47Å; Q80-M128 PolarHBondContact OE1-SD 3.32Å; Q80-M128 VanDerWaalsContact OE1-SD 3.38Å; Q80-E132 WeakPolarHBondContact CG-OE1 3.33Å; Q80-E132 PolarHBondContact NE2-OE1 3.16Å |
| 81 | E | 85.9 | Confident | 84.1 | Confident | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -64.8 | -35.6 | 175.3 | -156.7 | 178.5 | 155.4 | 0 | 0 | 111.4 | P15 L16 A17 S18 G77 G85 T86 F89 | P15-E81 HydrophobicContact CB-CB 4.21Å; P15-E81 HydrophobicContact CB-CG 4.13Å; L16-E81 PolarHBondContact N-OE1 2.98Å; A17-E81 PolarHBondContact N-OE1 3.29Å; A17-E81 PolarHBondContact N-OE2 3.15Å; S18-E81 VanDerWaalsContact CB-OE2 3.3Å; S18-E81 WeakPolarHBondContact CB-OE2 3.47Å; S18-E81 PolarHBondContact N-OE2 3.44Å; S18-E81 PolarHBondContact OG-OE2 2.76Å; G77-E81 WeakPolarHBondContact O-CB 3.45Å; G77-E81 PolarHBondContact O-N 3.21Å; E81-G85 CarbonylContact O-C 3.4Å; E81-G85 WeakPolarHBondContact O-CA 3.4Å; E81-G85 PolarHBondContact O-N 3.3Å; E81-T86 VanDerWaalsContact OE1-CB 3.29Å; E81-T86 WeakPolarHBondContact OE1-CB 3.17Å; E81-T86 WeakPolarHBondContact OE1-CG2 3.3Å; E81-T86 PolarHBondContact OE1-OG1 2.93Å; E81-F89 HydrophobicContact CB-CB 4.41Å; E81-F89 HydrophobicContact CB-CD1 4.35Å; E81-F89 HydrophobicContact CB-CG 4.19Å; E81-F89 HydrophobicContact CG-CB 4.15Å; E81-F89 HydrophobicContact CG-CD1 4.1Å; E81-F89 HydrophobicContact CG-CG 4.19Å |
| 82 | C | 79.3 | Confident | 84 | Confident | 67 Ų | 67 | 41 Ų | 41 | 45% | 0.453 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -68 | -35.8 | 170.5 | -70.9 | 0 | 0 | 0 | 0 | 113.8 | W78 Q79 Q80 L214 | W78-C82 WeakPolarHBondContact O-CB 3.48Å; W78-C82 PolarHBondContact O-N 3.06Å; W78-C82 PolarHBondContact O-SG 2.94Å; Q79-C82 PolarHBondContact O-N 3.41Å; Q80-C82 VanDerWaalsContact C-N 3.29Å; Q80-C82 PolarHBondContact O-N 3.36Å; C82-L214 HydrophobicContact CB-CD2 4.07Å; C82-L214 WeakPolarHBondContact SG-CD2 3.49Å |
| 83 | H | 75.9 | Confident | 84.2 | Confident | 130 Ų | 130 | 40.6 Ų | 40.6 | 60% | 0.602 | 21% | 0.208 | S | C | * | . | H | α-helix | trans | -83.7 | -26.8 | -178.6 | -79 | -55.6 | 0 | 0 | 0 | 114.6 | Q79 Q80 P217 | Q79-H83 WeakPolarHBondContact O-CB 3.26Å; Q79-H83 PolarHBondContact O-CD2 2.86Å; Q79-H83 PolarHBondContact O-N 3.47Å; Q80-H83 PolarHBondContact O-N 3.24Å; H83-P217 WeakPolarHBondContact O-CG 3.36Å |
| 84 | L | 77.8 | Confident | 84.3 | Confident | 54 Ų | 54 | 42 Ų | 42 | 28% | 0.283 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -109.2 | -20.8 | -176.3 | -61.8 | 171 | 0 | 0 | 0 | 113 | Q80 R88 | Q80-L84 WeakPolarHBondContact O-CB 3.41Å; Q80-L84 WeakPolarHBondContact O-CG 3.16Å; Q80-L84 PolarHBondContact O-N 2.86Å; L84-R88 HydrophobicContact CB-CB 4.23Å; L84-R88 WeakPolarHBondContact O-CB 3.42Å; L84-R88 WeakPolarHBondContact O-CD 3.28Å |
| 85 | G | 81.8 | Confident | 84.5 | Confident | 1 Ų | 1 | 41.3 Ų | 41.3 | 1% | 0.01 | 21% | 0.214 | C | C | . | . | trans | 81.4 | 149.9 | -166.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | E81 L87 R88 F89 L214 | E81-G85 CarbonylContact O-C 3.4Å; E81-G85 WeakPolarHBondContact O-CA 3.4Å; E81-G85 PolarHBondContact O-N 3.3Å; G85-L87 VanDerWaalsContact C-N 3.33Å; G85-L87 PolarHBondContact O-N 2.9Å; G85-R88 PolarHBondContact O-N 2.96Å; G85-F89 WeakPolarHBondContact O-CB 3.35Å; G85-F89 PolarHBondContact O-N 3Å; G85-L214 WeakPolarHBondContact CA-O 3.49Å | ||
| 86 | T | 84.2 | Confident | 84.9 | Confident | 4 Ų | 4 | 37.7 Ų | 37.7 | 3% | 0.025 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -54.2 | -43.9 | -170.7 | -62 | 0 | 0 | 0 | 0 | 113.5 | L16 A17 E81 L90 L213 L214 | L16-T86 HydrophobicContact CB-CG2 4.49Å; A17-T86 HydrophobicContact CB-CG2 3.7Å; E81-T86 VanDerWaalsContact OE1-CB 3.29Å; E81-T86 WeakPolarHBondContact OE1-CB 3.17Å; E81-T86 WeakPolarHBondContact OE1-CG2 3.3Å; E81-T86 PolarHBondContact OE1-OG1 2.93Å; T86-L90 WeakPolarHBondContact O-CB 3.38Å; T86-L90 PolarHBondContact O-N 3.22Å; T86-L213 HydrophobicContact CG2-CD2 3.65Å; T86-L214 PolarHBondContact N-O 3.42Å; T86-L214 PolarHBondContact OG1-N 2.93Å |
| 87 | L | 82.8 | Confident | 85.4 | Confident | 25 Ų | 25 | 35.9 Ų | 35.9 | 13% | 0.131 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -73.6 | -37.3 | -176.1 | -64.5 | 179.4 | 0 | 0 | 0 | 112.9 | G85 L90 H91 L193 L196 Q197 | G85-L87 VanDerWaalsContact C-N 3.33Å; G85-L87 PolarHBondContact O-N 2.9Å; L87-L90 PolarHBondContact O-N 3.16Å; L87-H91 WeakPolarHBondContact O-CB 3.32Å; L87-H91 PolarHBondContact O-N 3.47Å; L87-L193 HydrophobicContact CB-CD1 3.48Å; L87-L193 VanDerWaalsContact CB-CD1 3.48Å; L87-L193 HydrophobicContact CB-CG 4.22Å; L87-L193 HydrophobicContact CD1-CD1 4.12Å; L87-L193 HydrophobicContact CD1-CG 4.2Å; L87-L193 HydrophobicContact CG-CD1 4.46Å; L87-L196 HydrophobicContact CD1-CB 4.33Å; L87-L196 HydrophobicContact CD1-CD2 4.21Å; L87-L196 HydrophobicContact CD1-CG 4.4Å; L87-L196 HydrophobicContact CD2-CD2 3.9Å; L87-L196 HydrophobicContact CD2-CG 4.49Å; L87-Q197 HydrophobicContact CD1-CB 4.06Å |
| 88 | R | 84.5 | Confident | 85.8 | Confident | 49 Ų | 49 | 38.8 Ų | 38.8 | 19% | 0.185 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -73 | -36.3 | 177.2 | -62.9 | -178.4 | 60.6 | 106.5 | 8.5 | 110.9 | L84 G85 H91 A92 E187 E190 L193 S216 | L84-R88 HydrophobicContact CB-CB 4.23Å; L84-R88 WeakPolarHBondContact O-CB 3.42Å; L84-R88 WeakPolarHBondContact O-CD 3.28Å; G85-R88 PolarHBondContact O-N 2.96Å; R88-H91 PolarHBondContact O-N 3.39Å; R88-A92 VanDerWaalsContact O-CB 3.26Å; R88-A92 WeakPolarHBondContact O-CB 3.46Å; R88-A92 PolarHBondContact O-N 3.43Å; R88-E187 IonicContact CZ-OE1 3.69Å; R88-E187 IonicContact NH1-OE1 3.83Å; R88-E187 IonicContact NH2-OE1 3.75Å; R88-E187 PolarHBondContact NH2-OE1 2.96Å; R88-E190 IonicContact CZ-OE1 3.99Å; R88-E190 IonicContact NH1-OE1 2.78Å; R88-E190 PolarHBondContact NH1-OE1 2.65Å; R88-L193 HydrophobicContact CG-CD1 4.13Å; R88-L193 HydrophobicContact CG-CD2 3.71Å; R88-S216 WeakPolarHBondContact CD-OG 3.47Å |
| 89 | F | 87.3 | Confident | 86 | Confident | 2 Ų | 2 | 35.9 Ų | 35.9 | 1% | 0.009 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -60.6 | -48.1 | 169.7 | 172.2 | -99.6 | 0 | 0 | 0 | 112 | A17 Q80 E81 G85 H91 A92 S93 M128 | A17-F89 HydrophobicContact CB-CD1 3.88Å; A17-F89 HydrophobicContact CB-CE1 4.13Å; Q80-F89 HydrophobicContact CB-CD2 3.98Å; Q80-F89 HydrophobicContact CB-CE2 4.2Å; E81-F89 HydrophobicContact CB-CB 4.41Å; E81-F89 HydrophobicContact CB-CD1 4.35Å; E81-F89 HydrophobicContact CB-CG 4.19Å; E81-F89 HydrophobicContact CG-CB 4.15Å; E81-F89 HydrophobicContact CG-CD1 4.1Å; E81-F89 HydrophobicContact CG-CG 4.19Å; G85-F89 WeakPolarHBondContact O-CB 3.35Å; G85-F89 PolarHBondContact O-N 3Å; F89-H91 VanDerWaalsContact C-N 3.34Å; F89-H91 PolarHBondContact O-N 2.93Å; F89-A92 PolarHBondContact O-N 3.48Å; F89-S93 WeakPolarHBondContact O-CB 3.43Å; F89-S93 PolarHBondContact O-N 2.98Å; F89-S93 PolarHBondContact O-OG 3.23Å; F89-M128 HydrophobicContact CD2-SD 4.33Å; F89-M128 HydrophobicContact CE2-CE 4.22Å; F89-M128 HydrophobicContact CE2-SD 3.69Å; F89-M128 HydrophobicContact CZ-SD 4.46Å |
| 90 | L | 87.7 | Confident | 86.5 | Confident | 98 Ų | 98 | 30.6 Ų | 30.6 | 51% | 0.513 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -62.2 | -41.3 | 177.9 | -171.6 | 67.6 | 0 | 0 | 0 | 111.7 | T86 L87 S93 A94 | T86-L90 WeakPolarHBondContact O-CB 3.38Å; T86-L90 PolarHBondContact O-N 3.22Å; L87-L90 PolarHBondContact O-N 3.16Å; L90-S93 WeakPolarHBondContact CA-OG 3.47Å; L90-S93 PolarHBondContact O-OG 3.21Å; L90-A94 WeakPolarHBondContact O-CB 3.5Å; L90-A94 PolarHBondContact O-N 2.98Å |
| 91 | H | 88.2 | Confident | 86.8 | Confident | 62 Ų | 62 | 30.1 Ų | 30.1 | 29% | 0.287 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -66.3 | -45 | 176.2 | -173.8 | 82.7 | 0 | 0 | 0 | 112.8 | L87 R88 F89 A94 L95 L186 | L87-H91 WeakPolarHBondContact O-CB 3.32Å; L87-H91 PolarHBondContact O-N 3.47Å; R88-H91 PolarHBondContact O-N 3.39Å; F89-H91 VanDerWaalsContact C-N 3.34Å; F89-H91 PolarHBondContact O-N 2.93Å; H91-A94 PolarHBondContact O-N 2.78Å; H91-L95 VanDerWaalsContact NE2-CD1 3.33Å; H91-L95 WeakPolarHBondContact NE2-CD1 3.38Å; H91-L95 WeakPolarHBondContact O-CG 3.19Å; H91-L95 PolarHBondContact O-N 3.46Å; H91-L186 PolarHBondContact CE1-O 3.45Å; H91-L186 PolarHBondContact NE2-O 2.82Å |
| 92 | A | 88.3 | Confident | 87 | Confident | 6 Ų | 6 | 34.5 Ų | 34.5 | 5% | 0.05 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -63 | -46 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | R88 F89 A94 L95 L96 | R88-A92 VanDerWaalsContact O-CB 3.26Å; R88-A92 WeakPolarHBondContact O-CB 3.46Å; R88-A92 PolarHBondContact O-N 3.43Å; F89-A92 PolarHBondContact O-N 3.48Å; A92-A94 VanDerWaalsContact C-N 3.33Å; A92-A94 PolarHBondContact O-N 2.78Å; A92-L95 PolarHBondContact O-N 2.86Å; A92-L96 WeakPolarHBondContact O-CB 3.42Å; A92-L96 VanDerWaalsContact O-CG 3.25Å; A92-L96 WeakPolarHBondContact O-CG 3.26Å; A92-L96 PolarHBondContact O-N 3.33Å |
| 93 | S | 90.4 | Very high | 87.6 | Confident | 11 Ų | 11 | 33.6 Ų | 33.6 | 8% | 0.077 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -61.2 | -39.5 | 176.2 | 63.6 | 0 | 0 | 0 | 0 | 112.3 | F89 L90 A97 Y121 | F89-S93 WeakPolarHBondContact O-CB 3.43Å; F89-S93 PolarHBondContact O-N 2.98Å; F89-S93 PolarHBondContact O-OG 3.23Å; L90-S93 WeakPolarHBondContact CA-OG 3.47Å; L90-S93 PolarHBondContact O-OG 3.21Å; S93-A97 VanDerWaalsContact O-CB 3.22Å; S93-A97 WeakPolarHBondContact O-CB 3.26Å; S93-A97 PolarHBondContact O-N 3.48Å; S93-Y121 VanDerWaalsContact CB-OH 3.29Å; S93-Y121 WeakPolarHBondContact CB-OH 3.37Å |
| 94 | A | 90.8 | Very high | 88.2 | Confident | 29 Ų | 29 | 27.4 Ų | 27.4 | 24% | 0.24 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -66.1 | -42.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | L54 L90 H91 A92 A97 L98 | L54-A94 HydrophobicContact CD1-CB 3.95Å; L90-A94 WeakPolarHBondContact O-CB 3.5Å; L90-A94 PolarHBondContact O-N 2.98Å; H91-A94 PolarHBondContact O-N 2.78Å; A92-A94 VanDerWaalsContact C-N 3.33Å; A92-A94 PolarHBondContact O-N 2.78Å; A94-A97 WeakPolarHBondContact O-CB 3.5Å; A94-A97 PolarHBondContact O-N 3.3Å; A94-L98 VanDerWaalsContact O-CG 3.26Å; A94-L98 WeakPolarHBondContact O-CG 3.46Å; A94-L98 PolarHBondContact O-N 2.94Å |
| 95 | L | 90.8 | Very high | 88.8 | Confident | 17 Ų | 17 | 26.4 Ų | 26.4 | 9% | 0.089 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -63.3 | -43.7 | 174.9 | -76.4 | -176.3 | 0 | 0 | 0 | 111.9 | H91 A92 L98 A99 Y178 F183 L186 | H91-L95 VanDerWaalsContact NE2-CD1 3.33Å; H91-L95 WeakPolarHBondContact NE2-CD1 3.38Å; H91-L95 WeakPolarHBondContact O-CG 3.19Å; H91-L95 PolarHBondContact O-N 3.46Å; A92-L95 PolarHBondContact O-N 2.86Å; L95-L98 PolarHBondContact O-N 3.05Å; L95-A99 VanDerWaalsContact O-CB 3.27Å; L95-A99 WeakPolarHBondContact O-CB 3.25Å; L95-A99 PolarHBondContact O-N 2.89Å; L95-Y178 HydrophobicContact CD1-CE2 4.47Å; L95-F183 HydrophobicContact CD1-CB 4.41Å; L95-L186 HydrophobicContact CD1-CB 4.09Å; L95-L186 HydrophobicContact CD2-CB 4.04Å; L95-L186 HydrophobicContact CD2-CD1 4.39Å; L95-L186 HydrophobicContact CD2-CD2 4.4Å |
| 96 | L | 91.1 | Very high | 89.1 | Confident | 2 Ų | 2 | 31.7 Ų | 31.7 | 1% | 0.01 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -69.6 | -34.3 | 179.5 | -66.4 | 175.1 | 0 | 0 | 0 | 111.9 | A92 S100 V124 A127 M128 Y178 | A92-L96 WeakPolarHBondContact O-CB 3.42Å; A92-L96 VanDerWaalsContact O-CG 3.25Å; A92-L96 WeakPolarHBondContact O-CG 3.26Å; A92-L96 PolarHBondContact O-N 3.33Å; L96-S100 VanDerWaalsContact O-CB 3.31Å; L96-S100 WeakPolarHBondContact O-CB 3.14Å; L96-S100 PolarHBondContact O-N 2.96Å; L96-S100 PolarHBondContact O-OG 2.92Å; L96-V124 HydrophobicContact CB-CG1 4.29Å; L96-A127 HydrophobicContact CB-CB 4.06Å; L96-A127 HydrophobicContact CD1-CB 3.87Å; L96-A127 HydrophobicContact CD2-CB 4Å; L96-A127 HydrophobicContact CG-CB 4.18Å; L96-M128 HydrophobicContact CD1-CB 4.46Å; L96-M128 HydrophobicContact CD1-CG 3.57Å; L96-Y178 HydrophobicContact CD2-CD2 4.19Å; L96-Y178 HydrophobicContact CD2-CG 3.97Å |
| 97 | A | 92.3 | Very high | 89.3 | Confident | 3 Ų | 3 | 33.4 Ų | 33.4 | 3% | 0.025 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -58.9 | -52.6 | 169 | 0 | 0 | 0 | 0 | 0 | 111.6 | L54 V57 S93 A94 S100 G101 V124 | L54-A97 HydrophobicContact CD1-CB 3.97Å; V57-A97 HydrophobicContact CB-CB 4.36Å; V57-A97 HydrophobicContact CG2-CB 3.47Å; V57-A97 VanDerWaalsContact CG2-CB 3.47Å; S93-A97 VanDerWaalsContact O-CB 3.22Å; S93-A97 WeakPolarHBondContact O-CB 3.26Å; S93-A97 PolarHBondContact O-N 3.48Å; A94-A97 WeakPolarHBondContact O-CB 3.5Å; A94-A97 PolarHBondContact O-N 3.3Å; A97-S100 PolarHBondContact O-OG 2.86Å; A97-G101 PolarHBondContact O-N 2.97Å; A97-V124 HydrophobicContact CB-CG2 4.06Å |
| 98 | L | 91.9 | Very high | 89.5 | Confident | 61 Ų | 61 | 33.5 Ų | 33.5 | 32% | 0.319 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -62.8 | -45.1 | 178.8 | -68 | 167.9 | 0 | 0 | 0 | 111.7 | L53 L54 A94 L95 G101 L102 | L53-L98 HydrophobicContact CB-CD2 4.17Å; L53-L98 HydrophobicContact CD2-CD2 3.65Å; L53-L98 HydrophobicContact CG-CD2 3.92Å; L54-L98 HydrophobicContact CB-CD2 4.24Å; L54-L98 HydrophobicContact CD1-CG 4.33Å; A94-L98 VanDerWaalsContact O-CG 3.26Å; A94-L98 WeakPolarHBondContact O-CG 3.46Å; A94-L98 PolarHBondContact O-N 2.94Å; L95-L98 PolarHBondContact O-N 3.05Å; L98-G101 PolarHBondContact O-N 3.24Å; L98-L102 WeakPolarHBondContact O-CB 3.33Å; L98-L102 WeakPolarHBondContact O-CG 3.41Å; L98-L102 PolarHBondContact O-N 3.32Å |
| 99 | A | 91.3 | Very high | 89.4 | Confident | 12 Ų | 12 | 34.5 Ų | 34.5 | 10% | 0.099 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -65 | -44.5 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | L95 L103 A174 F183 | L95-A99 VanDerWaalsContact O-CB 3.27Å; L95-A99 WeakPolarHBondContact O-CB 3.25Å; L95-A99 PolarHBondContact O-N 2.89Å; A99-L103 WeakPolarHBondContact O-CB 3.43Å; A99-L103 PolarHBondContact O-N 3.4Å; A99-A174 HydrophobicContact CB-CB 3.84Å; A99-F183 HydrophobicContact CB-CE1 4.24Å; A99-F183 HydrophobicContact CB-CE2 4.14Å; A99-F183 HydrophobicContact CB-CZ 3.57Å |
| 100 | S | 91.3 | Very high | 89.4 | Confident | 0 Ų | 0 | 41.3 Ų | 41.3 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -68.2 | -40.4 | 176.9 | 57.2 | 0 | 0 | 0 | 0 | 112 | L96 A97 L103 A104 | L96-S100 VanDerWaalsContact O-CB 3.31Å; L96-S100 WeakPolarHBondContact O-CB 3.14Å; L96-S100 PolarHBondContact O-N 2.96Å; L96-S100 PolarHBondContact O-OG 2.92Å; A97-S100 PolarHBondContact O-OG 2.86Å; S100-L103 PolarHBondContact O-N 3.03Å; S100-A104 WeakPolarHBondContact O-CB 3.4Å; S100-A104 PolarHBondContact O-N 3.28Å |
| 101 | G | 89.8 | Confident | 89.1 | Confident | 0 Ų | 0 | 39.7 Ų | 39.7 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -63.4 | -43.4 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | A97 L98 A104 V105 | A97-G101 PolarHBondContact O-N 2.97Å; L98-G101 PolarHBondContact O-N 3.24Å; G101-A104 PolarHBondContact O-N 3.41Å; G101-V105 VanDerWaalsContact O-CG2 3.25Å; G101-V105 WeakPolarHBondContact O-CG2 3.49Å; G101-V105 PolarHBondContact O-N 2.67Å |
| 102 | L | 90.7 | Very high | 88.9 | Confident | 91 Ų | 91 | 39.4 Ų | 39.4 | 48% | 0.476 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -62.1 | -45.3 | 175.2 | -76.4 | 169.4 | 0 | 0 | 0 | 111.4 | L53 L98 A104 V105 L106 | L53-L102 HydrophobicContact CD1-CD2 4.14Å; L53-L102 HydrophobicContact CD1-CG 4.2Å; L53-L102 HydrophobicContact CD2-CD1 4.48Å; L53-L102 HydrophobicContact CD2-CD2 3.76Å; L53-L102 HydrophobicContact CD2-CG 3.84Å; L53-L102 HydrophobicContact CG-CG 4.46Å; L98-L102 WeakPolarHBondContact O-CB 3.33Å; L98-L102 WeakPolarHBondContact O-CG 3.41Å; L98-L102 PolarHBondContact O-N 3.32Å; L102-A104 VanDerWaalsContact C-N 3.35Å; L102-A104 PolarHBondContact O-N 3.43Å; L102-V105 PolarHBondContact O-N 2.81Å; L102-L106 WeakPolarHBondContact O-CB 3.36Å; L102-L106 VanDerWaalsContact O-CG 3.26Å; L102-L106 WeakPolarHBondContact O-CG 3.4Å; L102-L106 PolarHBondContact O-N 3.43Å |
| 103 | L | 90.5 | Very high | 88.4 | Confident | 48 Ų | 48 | 44.7 Ų | 44.7 | 25% | 0.251 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -63.9 | -41.8 | 179.7 | -170.7 | 57.1 | 0 | 0 | 0 | 111.2 | A99 S100 V105 L106 L107 C170 L173 | A99-L103 WeakPolarHBondContact O-CB 3.43Å; A99-L103 PolarHBondContact O-N 3.4Å; S100-L103 PolarHBondContact O-N 3.03Å; L103-V105 PolarHBondContact O-N 3Å; L103-L106 PolarHBondContact O-N 2.88Å; L103-L107 HydrophobicContact CD1-CD1 3.84Å; L103-L107 HydrophobicContact CG-CD1 3.95Å; L103-L107 WeakPolarHBondContact O-CD1 3.33Å; L103-L107 PolarHBondContact O-N 2.91Å; L103-C170 HydrophobicContact CB-CB 4.16Å; L103-C170 HydrophobicContact CD2-CB 4.09Å; L103-C170 HydrophobicContact CG-CB 4.14Å; L103-L173 HydrophobicContact CD2-CB 3.78Å; L103-L173 HydrophobicContact CD2-CD1 4.13Å |
| 104 | A | 89.3 | Confident | 87.6 | Confident | 0 Ų | 0 | 45.8 Ų | 45.8 | 0% | 0 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -60.6 | -43.4 | 174 | 0 | 0 | 0 | 0 | 0 | 113.3 | L39 S100 G101 L102 L107 A108 A115 | L39-A104 HydrophobicContact CD2-CB 3.86Å; S100-A104 WeakPolarHBondContact O-CB 3.4Å; S100-A104 PolarHBondContact O-N 3.28Å; G101-A104 PolarHBondContact O-N 3.41Å; L102-A104 VanDerWaalsContact C-N 3.35Å; L102-A104 PolarHBondContact O-N 3.43Å; A104-L107 PolarHBondContact O-N 3.31Å; A104-A108 WeakPolarHBondContact O-CB 3.46Å; A104-A108 PolarHBondContact O-N 2.88Å; A104-A115 WeakPolarHBondContact CB-O 3.31Å |
| 105 | V | 89.2 | Confident | 86.8 | Confident | 34 Ų | 34 | 44.4 Ų | 44.4 | 21% | 0.206 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -67.6 | -38.6 | 176.5 | 172.2 | 0 | 0 | 0 | 0 | 111.4 | L39 L44 G101 L102 L103 A108 G109 | L39-V105 HydrophobicContact CD1-CG2 4.46Å; L39-V105 HydrophobicContact CD2-CG2 3.92Å; L39-V105 HydrophobicContact CG-CG2 4.06Å; L44-V105 HydrophobicContact CD1-CG1 4.3Å; L44-V105 HydrophobicContact CD1-CG2 3.43Å; L44-V105 VanDerWaalsContact CD1-CG2 3.43Å; G101-V105 VanDerWaalsContact O-CG2 3.25Å; G101-V105 WeakPolarHBondContact O-CG2 3.49Å; G101-V105 PolarHBondContact O-N 2.67Å; L102-V105 PolarHBondContact O-N 2.81Å; L103-V105 PolarHBondContact O-N 3Å; V105-A108 PolarHBondContact O-N 3.45Å; V105-G109 PolarHBondContact O-N 3.35Å |
| 106 | L | 88.8 | Confident | 85.9 | Confident | 112 Ų | 112 | 44.6 Ų | 44.6 | 59% | 0.586 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -62.1 | -46.2 | 173.5 | -74.3 | 166.6 | 0 | 0 | 0 | 111.4 | L102 L103 A108 G109 L110 | L102-L106 WeakPolarHBondContact O-CB 3.36Å; L102-L106 VanDerWaalsContact O-CG 3.26Å; L102-L106 WeakPolarHBondContact O-CG 3.4Å; L102-L106 PolarHBondContact O-N 3.43Å; L103-L106 PolarHBondContact O-N 2.88Å; L106-A108 VanDerWaalsContact C-N 3.35Å; L106-A108 PolarHBondContact O-N 3.02Å; L106-G109 PolarHBondContact O-N 3.35Å; L106-L110 VanDerWaalsContact O-CG 3.29Å; L106-L110 WeakPolarHBondContact O-CG 3.31Å; L106-L110 PolarHBondContact O-N 2.99Å |
| 107 | L | 88.6 | Confident | 85.1 | Confident | 40 Ų | 40 | 46.7 Ų | 46.7 | 21% | 0.209 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -62.2 | -40.7 | 174.9 | -90.4 | 88.6 | 0 | 0 | 0 | 112.1 | L103 A104 L110 G111 V112 A115 | L103-L107 HydrophobicContact CD1-CD1 3.84Å; L103-L107 HydrophobicContact CG-CD1 3.95Å; L103-L107 WeakPolarHBondContact O-CD1 3.33Å; L103-L107 PolarHBondContact O-N 2.91Å; A104-L107 PolarHBondContact O-N 3.31Å; L107-L110 PolarHBondContact O-N 2.91Å; L107-G111 PolarHBondContact O-N 3.02Å; L107-V112 HydrophobicContact CB-CB 4.23Å; L107-V112 HydrophobicContact CB-CG2 4.4Å; L107-V112 HydrophobicContact CD2-CG1 4.4Å; L107-V112 HydrophobicContact CD2-CG2 4.49Å; L107-V112 VanDerWaalsContact O-CB 3.29Å; L107-V112 WeakPolarHBondContact O-CB 3.46Å; L107-V112 WeakPolarHBondContact O-CG2 3.25Å; L107-V112 PolarHBondContact O-N 2.98Å; L107-A115 HydrophobicContact CB-CB 3.5Å; L107-A115 VanDerWaalsContact CB-CB 3.5Å; L107-A115 HydrophobicContact CD2-CB 4.45Å |
| 108 | A | 86.7 | Confident | 84.4 | Confident | 26 Ų | 26 | 46.7 Ų | 46.7 | 22% | 0.215 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -65.3 | -40.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | P41 A104 V105 L106 L110 G111 A115 A116 | P41-A108 HydrophobicContact CG-CB 3.73Å; A104-A108 WeakPolarHBondContact O-CB 3.46Å; A104-A108 PolarHBondContact O-N 2.88Å; V105-A108 PolarHBondContact O-N 3.45Å; L106-A108 VanDerWaalsContact C-N 3.35Å; L106-A108 PolarHBondContact O-N 3.02Å; A108-L110 VanDerWaalsContact C-N 3.26Å; A108-L110 PolarHBondContact O-N 2.85Å; A108-G111 WeakPolarHBondContact O-CA 3.32Å; A108-G111 PolarHBondContact O-N 2.87Å; A108-A115 HydrophobicContact CB-CB 4.39Å; A108-A116 HydrophobicContact CB-CB 3.52Å |
| 109 | G | 82.9 | Confident | 84.1 | Confident | 71 Ų | 71 | 44.1 Ų | 44.1 | 73% | 0.732 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -65.8 | -25.2 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | V105 L106 G111 | V105-G109 PolarHBondContact O-N 3.35Å; L106-G109 PolarHBondContact O-N 3.35Å; G109-G111 PolarHBondContact O-N 3.42Å |
| 110 | L | 86.6 | Confident | 83.9 | Confident | 144 Ų | 144 | 43.6 Ų | 43.6 | 75% | 0.754 | 30% | 0.302 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.7 | 4.9 | 169 | -68 | 169.8 | 0 | 0 | 0 | 113.4 | L106 L107 A108 | L106-L110 VanDerWaalsContact O-CG 3.29Å; L106-L110 WeakPolarHBondContact O-CG 3.31Å; L106-L110 PolarHBondContact O-N 2.99Å; L107-L110 PolarHBondContact O-N 2.91Å; A108-L110 VanDerWaalsContact C-N 3.26Å; A108-L110 PolarHBondContact O-N 2.85Å |
| 111 | G | 81.5 | Confident | 83.8 | Confident | 65 Ų | 65 | 43.8 Ų | 43.8 | 67% | 0.67 | 30% | 0.302 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 82.5 | 10.6 | 178.7 | 0 | 0 | 0 | 0 | 0 | 114.9 | L107 A108 G109 S113 | L107-G111 PolarHBondContact O-N 3.02Å; A108-G111 WeakPolarHBondContact O-CA 3.32Å; A108-G111 PolarHBondContact O-N 2.87Å; G109-G111 PolarHBondContact O-N 3.42Å; G111-S113 PolarHBondContact O-N 3.05Å; G111-S113 VanDerWaalsContact O-N 3.08Å |
| 112 | V | 84.3 | Confident | 83.9 | Confident | 56 Ų | 56 | 44 Ų | 44 | 34% | 0.339 | 30% | 0.303 | S | S | . | . | trans | -77.4 | 97.9 | 177.6 | -169.8 | 0 | 0 | 0 | 0 | 109.7 | L107 A115 L166 | L107-V112 HydrophobicContact CB-CB 4.23Å; L107-V112 HydrophobicContact CB-CG2 4.4Å; L107-V112 HydrophobicContact CD2-CG1 4.4Å; L107-V112 HydrophobicContact CD2-CG2 4.49Å; L107-V112 VanDerWaalsContact O-CB 3.29Å; L107-V112 WeakPolarHBondContact O-CB 3.46Å; L107-V112 WeakPolarHBondContact O-CG2 3.25Å; L107-V112 PolarHBondContact O-N 2.98Å; V112-A115 HydrophobicContact CB-CB 4.4Å; V112-A115 VanDerWaalsContact O-CB 3.32Å; V112-A115 WeakPolarHBondContact O-CB 3.29Å; V112-A115 PolarHBondContact O-N 2.93Å; V112-L166 HydrophobicContact CG1-CD1 3.59Å | ||
| 113 | S | 77.3 | Confident | 83.9 | Confident | 117 Ų | 117 | 39.7 Ų | 39.7 | 82% | 0.818 | 28% | 0.281 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.2 | 138.4 | 177.6 | -170.2 | 0 | 0 | 0 | 0 | 111.9 | G111 A115 L166 | G111-S113 PolarHBondContact O-N 3.05Å; G111-S113 VanDerWaalsContact O-N 3.08Å; S113-A115 VanDerWaalsContact C-N 3.31Å; S113-A115 PolarHBondContact O-N 3.03Å; S113-L166 WeakPolarHBondContact O-CD1 3.37Å |
| 114 | G | 73.9 | Confident | 84 | Confident | 33 Ų | 33 | 37.4 Ų | 37.4 | 34% | 0.34 | 27% | 0.269 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 78.4 | 5.3 | -177.9 | 0 | 0 | 0 | 0 | 0 | 115.5 | P164 | G114-P164 WeakPolarHBondContact O-CB 3.3Å; G114-P164 WeakPolarHBondContact O-CG 3.39Å |
| 115 | A | 73.4 | Confident | 84 | Confident | 0 Ų | 0 | 37.5 Ų | 37.5 | 0% | 0 | 27% | 0.269 | C | S | . | . | S | Bend | trans | -75.7 | -41.1 | 170.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | A104 L107 A108 V112 S113 L166 Q167 | A104-A115 WeakPolarHBondContact CB-O 3.31Å; L107-A115 HydrophobicContact CB-CB 3.5Å; L107-A115 VanDerWaalsContact CB-CB 3.5Å; L107-A115 HydrophobicContact CD2-CB 4.45Å; A108-A115 HydrophobicContact CB-CB 4.39Å; V112-A115 HydrophobicContact CB-CB 4.4Å; V112-A115 VanDerWaalsContact O-CB 3.32Å; V112-A115 WeakPolarHBondContact O-CB 3.29Å; V112-A115 PolarHBondContact O-N 2.93Å; S113-A115 VanDerWaalsContact C-N 3.31Å; S113-A115 PolarHBondContact O-N 3.03Å; A115-L166 HydrophobicContact CB-CB 4.41Å; A115-L166 HydrophobicContact CB-CD1 4.24Å; A115-Q167 PolarHBondContact O-OE1 2.92Å; A115-Q167 VanDerWaalsContact O-OE1 3.04Å |
| 116 | A | 71.6 | Confident | 84.1 | Confident | 21 Ų | 21 | 35.9 Ų | 35.9 | 17% | 0.174 | 26% | 0.259 | C | S | . | . | S | Bend | trans | -113 | 173.5 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | P41 A108 | P41-A116 HydrophobicContact CG-CB 3.47Å; P41-A116 VanDerWaalsContact CG-CB 3.47Å; A108-A116 HydrophobicContact CB-CB 3.52Å |
| 117 | G | 74.6 | Confident | 84.2 | Confident | 46 Ų | 46 | 30.5 Ų | 30.5 | 47% | 0.474 | 23% | 0.232 | S | C | . | . | S | Bend | trans | 93.4 | 18 | -174 | 0 | 0 | 0 | 0 | 0 | 114.3 | V38 L39 | V38-G117 WeakPolarHBondContact CG1-O 3.24Å; L39-G117 WeakPolarHBondContact O-CA 3.29Å; L39-G117 PolarHBondContact O-N 3.03Å |
| 118 | S | 79.2 | Confident | 84.3 | Confident | 4 Ų | 4 | 29.1 Ų | 29.1 | 3% | 0.028 | 22% | 0.224 | C | C | . | . | trans | -122.5 | 164.8 | 178.3 | 72.3 | 0 | 0 | 0 | 0 | 113.4 | L39 P164 Q167 | L39-S118 WeakPolarHBondContact CB-O 3.42Å; L39-S118 PolarHBondContact N-O 3.5Å; S118-P164 WeakPolarHBondContact OG-CD 3.45Å; S118-Q167 WeakPolarHBondContact OG-CG 3.37Å | ||
| 119 | C | 83.8 | Confident | 84.3 | Confident | 6 Ų | 6 | 28.4 Ų | 28.4 | 4% | 0.041 | 22% | 0.216 | C | C | . | . | trans | -140.2 | 157.4 | 176.1 | 64.7 | 0 | 0 | 0 | 0 | 110.5 | V38 H56 G59 T61 | V38-C119 HydrophobicContact CG2-CB 4.17Å; H56-C119 CarbonylContact O-C 3.33Å; H56-C119 VanDerWaalsContact O-CA 3.25Å; H56-C119 WeakPolarHBondContact O-CA 3.23Å; H56-C119 VanDerWaalsContact O-CB 3.25Å; H56-C119 WeakPolarHBondContact O-CB 3.42Å; G59-C119 CarbonylContact O-C 3.51Å; G59-C119 VanDerWaalsContact O-CB 3.25Å; G59-C119 WeakPolarHBondContact O-CB 3.39Å; G59-C119 PolarHBondContact O-SG 2.96Å; G59-C119 VanDerWaalsContact O-SG 3.33Å; T61-C119 PolarHBondContact N-SG 3Å | ||
| 120 | G | 88.1 | Confident | 84.5 | Confident | 2 Ų | 2 | 25 Ų | 25 | 2% | 0.021 | 18% | 0.182 | C | C | . | . | trans | 131.9 | 157.4 | 171.3 | 0 | 0 | 0 | 0 | 0 | 114.6 | H56 V57 G59 M122 P123 | H56-G120 PolarHBondContact O-N 3.24Å; V57-G120 CarbonylContact O-C 3.45Å; G59-G120 WeakPolarHBondContact O-CA 3.39Å; G59-G120 PolarHBondContact O-N 3.18Å; G120-M122 VanDerWaalsContact C-N 3.32Å; G120-M122 PolarHBondContact O-N 3.24Å; G120-P123 VanDerWaalsContact O-CD 3.24Å; G120-P123 WeakPolarHBondContact O-CD 3.25Å | ||
| 121 | Y | 89.8 | Confident | 84.2 | Confident | 4 Ų | 4 | 18.6 Ų | 18.6 | 2% | 0.016 | 15% | 0.151 | C | C | . | . | S | Bend | trans | -78.1 | -9.5 | -173.6 | -160.7 | -86.5 | 0 | 0 | 0 | 115 | L21 V57 H60 L73 S93 V124 H125 M128 | L21-Y121 HydrophobicContact CD1-CD2 4.21Å; L21-Y121 HydrophobicContact CD1-CE2 4.16Å; L21-Y121 HydrophobicContact CD2-CD2 3.73Å; L21-Y121 HydrophobicContact CD2-CE1 4.23Å; L21-Y121 HydrophobicContact CD2-CE2 3.23Å; L21-Y121 HydrophobicContact CD2-CG 4.47Å; L21-Y121 HydrophobicContact CG-CD2 4.4Å; L21-Y121 HydrophobicContact CG-CE2 4.25Å; V57-Y121 HydrophobicContact CG1-CD2 3.32Å; V57-Y121 HydrophobicContact CG1-CE2 3.89Å; V57-Y121 HydrophobicContact CG1-CG 3.89Å; V57-Y121 PolarHBondContact O-N 2.88Å; H60-Y121 PolarHBondContact NE2-N 3.26Å; L73-Y121 HydrophobicContact CD2-CD1 4.38Å; L73-Y121 HydrophobicContact CD2-CE1 3.94Å; S93-Y121 VanDerWaalsContact CB-OH 3.29Å; S93-Y121 WeakPolarHBondContact CB-OH 3.37Å; Y121-V124 HydrophobicContact CD1-CB 4.36Å; Y121-V124 HydrophobicContact CE1-CB 4.09Å; Y121-V124 HydrophobicContact CE1-CG1 3.99Å; Y121-V124 HydrophobicContact CE2-CB 4.35Å; Y121-V124 HydrophobicContact CE2-CG1 4.17Å; Y121-V124 PolarHBondContact O-N 2.89Å; Y121-H125 AromaticContact CD1-CD2 3.54Å; Y121-H125 AromaticContact CD1-CE1 3.73Å; Y121-H125 AromaticContact CD1-CG 3.9Å; Y121-H125 AromaticContact CD1-NE2 3.41Å; Y121-H125 WeakPolarHBondContact CD1-NE2 3.1Å; Y121-H125 AromaticContact CE1-CE1 3.63Å; Y121-H125 AromaticContact CE1-ND1 3.79Å; Y121-H125 AromaticContact CE1-NE2 3.83Å; Y121-H125 PolarHBondContact O-N 3.41Å; Y121-H125 VanDerWaalsContact O-N 3.16Å; Y121-M128 HydrophobicContact CE1-CE 3.85Å |
| 122 | M | 91.2 | Very high | 83.9 | Confident | 3 Ų | 3 | 17.6 Ų | 17.6 | 2% | 0.015 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -60.5 | -39.2 | -173.3 | -153 | 54.6 | 51.3 | 0 | 0 | 116.2 | L68 S69 L72 G120 V124 H125 L126 L152 T156 P163 L168 | L68-M122 HydrophobicContact CB-CE 3.87Å; L68-M122 HydrophobicContact CD2-CE 3.8Å; L68-M122 HydrophobicContact CD2-SD 4.2Å; L68-M122 HydrophobicContact CG-CE 3.58Å; L68-M122 HydrophobicContact CG-SD 4.33Å; S69-M122 WeakPolarHBondContact OG-CE 3.29Å; L72-M122 HydrophobicContact CD2-CE 4.45Å; L72-M122 HydrophobicContact CD2-SD 3.76Å; G120-M122 VanDerWaalsContact C-N 3.32Å; G120-M122 PolarHBondContact O-N 3.24Å; M122-V124 PolarHBondContact O-N 3.34Å; M122-H125 PolarHBondContact O-N 3.13Å; M122-H125 HydrophobicContact SD-CB 4.25Å; M122-L126 WeakPolarHBondContact O-CB 3.32Å; M122-L126 PolarHBondContact O-N 2.87Å; M122-L152 HydrophobicContact SD-CD1 3.86Å; M122-L152 HydrophobicContact SD-CD2 4.05Å; M122-L152 HydrophobicContact SD-CG 4.24Å; M122-T156 HydrophobicContact CB-CG2 4.42Å; M122-T156 HydrophobicContact CG-CG2 3.7Å; M122-P163 HydrophobicContact CB-CG 4.28Å; M122-L168 HydrophobicContact CB-CD2 3.94Å; M122-L168 HydrophobicContact CG-CD2 3.86Å |
| 123 | P | 90.4 | Very high | 83.1 | Confident | 2 Ų | 2 | 16.7 Ų | 16.7 | 1% | 0.013 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -60 | -32.7 | 174.3 | -22.1 | 34.4 | 0 | 0 | 0 | 112.5 | G120 A127 Q167 L168 G171 | G120-P123 VanDerWaalsContact O-CD 3.24Å; G120-P123 WeakPolarHBondContact O-CD 3.25Å; P123-A127 VanDerWaalsContact O-CB 3.25Å; P123-A127 WeakPolarHBondContact O-CB 3.42Å; P123-A127 PolarHBondContact O-N 3.46Å; P123-Q167 HydrophobicContact CB-CG 4.43Å; P123-Q167 HydrophobicContact CG-CG 3.56Å; P123-L168 HydrophobicContact CG-CD2 4.38Å; P123-G171 WeakPolarHBondContact O-CA 3.32Å |
| 124 | V | 92 | Very high | 82.3 | Confident | 0 Ų | 0 | 16.7 Ų | 16.7 | 0% | 0 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -75.4 | -40 | 177.8 | -180 | 0 | 0 | 0 | 0 | 111.1 | V57 L96 A97 Y121 M122 L126 A127 M128 | V57-V124 HydrophobicContact CG1-CB 4.24Å; V57-V124 HydrophobicContact CG1-CG2 3.55Å; V57-V124 HydrophobicContact CG2-CG2 4.13Å; L96-V124 HydrophobicContact CB-CG1 4.29Å; A97-V124 HydrophobicContact CB-CG2 4.06Å; Y121-V124 HydrophobicContact CD1-CB 4.36Å; Y121-V124 HydrophobicContact CE1-CB 4.09Å; Y121-V124 HydrophobicContact CE1-CG1 3.99Å; Y121-V124 HydrophobicContact CE2-CB 4.35Å; Y121-V124 HydrophobicContact CE2-CG1 4.17Å; Y121-V124 PolarHBondContact O-N 2.89Å; M122-V124 PolarHBondContact O-N 3.34Å; V124-L126 VanDerWaalsContact C-N 3.31Å; V124-L126 PolarHBondContact O-N 2.69Å; V124-A127 PolarHBondContact O-N 3.11Å; V124-M128 HydrophobicContact CG1-CE 4.15Å; V124-M128 HydrophobicContact CG1-CG 4.31Å; V124-M128 HydrophobicContact CG1-SD 4.14Å; V124-M128 VanDerWaalsContact O-CB 3.31Å; V124-M128 WeakPolarHBondContact O-CB 3.49Å; V124-M128 VanDerWaalsContact O-CG 3.22Å; V124-M128 WeakPolarHBondContact O-CG 3.27Å; V124-M128 PolarHBondContact O-N 3.32Å |
| 125 | H | 91.2 | Very high | 81.7 | Confident | 1 Ų | 1 | 21.3 Ų | 21.3 | 1% | 0.005 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -56.9 | -45.3 | 169.2 | -78.7 | -49.7 | 0 | 0 | 0 | 112.4 | L72 Y121 M122 M128 L129 L152 | L72-H125 VanDerWaalsContact CB-NE2 3.32Å; L72-H125 WeakPolarHBondContact CB-NE2 3.33Å; L72-H125 HydrophobicContact CD2-CB 4.03Å; Y121-H125 AromaticContact CD1-CD2 3.54Å; Y121-H125 AromaticContact CD1-CE1 3.73Å; Y121-H125 AromaticContact CD1-CG 3.9Å; Y121-H125 AromaticContact CD1-NE2 3.41Å; Y121-H125 WeakPolarHBondContact CD1-NE2 3.1Å; Y121-H125 AromaticContact CE1-CE1 3.63Å; Y121-H125 AromaticContact CE1-ND1 3.79Å; Y121-H125 AromaticContact CE1-NE2 3.83Å; Y121-H125 PolarHBondContact O-N 3.41Å; Y121-H125 VanDerWaalsContact O-N 3.16Å; M122-H125 PolarHBondContact O-N 3.13Å; M122-H125 HydrophobicContact SD-CB 4.25Å; H125-M128 PolarHBondContact O-N 2.94Å; H125-L129 WeakPolarHBondContact O-CG 3.47Å; H125-L129 PolarHBondContact O-N 3.45Å; H125-L152 HydrophobicContact CB-CD2 4.16Å |
| 126 | L | 91.1 | Very high | 80.7 | Confident | 0 Ų | 0 | 27.3 Ų | 27.3 | 0% | 0 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -65.4 | -41.7 | 178.9 | -178.2 | 55.2 | 0 | 0 | 0 | 111.9 | M122 V124 L129 A130 P149 L152 L153 L168 L172 | M122-L126 WeakPolarHBondContact O-CB 3.32Å; M122-L126 PolarHBondContact O-N 2.87Å; V124-L126 VanDerWaalsContact C-N 3.31Å; V124-L126 PolarHBondContact O-N 2.69Å; L126-L129 PolarHBondContact O-N 3.12Å; L126-A130 WeakPolarHBondContact O-CB 3.28Å; L126-A130 PolarHBondContact O-N 2.87Å; L126-P149 HydrophobicContact CD1-CB 3.53Å; L126-P149 WeakPolarHBondContact CD1-O 3.46Å; L126-L152 HydrophobicContact CB-CD2 4.24Å; L126-L152 HydrophobicContact CD1-CB 4.39Å; L126-L153 HydrophobicContact CD1-CB 4.44Å; L126-L153 HydrophobicContact CD2-CB 4.06Å; L126-L153 HydrophobicContact CD2-CD1 4.05Å; L126-L168 HydrophobicContact CD2-CB 3.95Å; L126-L168 HydrophobicContact CD2-CD2 4.45Å; L126-L168 VanDerWaalsContact CD2-O 3.22Å; L126-L168 WeakPolarHBondContact CD2-O 3.22Å; L126-L172 HydrophobicContact CD1-CD1 4.35Å; L126-L172 HydrophobicContact CD2-CB 4.08Å; L126-L172 HydrophobicContact CG-CB 4.1Å |
| 127 | A | 90.9 | Very high | 80.1 | Confident | 0 Ų | 0 | 36.1 Ų | 36.1 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -62.3 | -44 | 175 | 0 | 0 | 0 | 0 | 0 | 112.4 | L96 P123 V124 A130 G131 G171 G175 | L96-A127 HydrophobicContact CB-CB 4.06Å; L96-A127 HydrophobicContact CD1-CB 3.87Å; L96-A127 HydrophobicContact CD2-CB 4Å; L96-A127 HydrophobicContact CG-CB 4.18Å; P123-A127 VanDerWaalsContact O-CB 3.25Å; P123-A127 WeakPolarHBondContact O-CB 3.42Å; P123-A127 PolarHBondContact O-N 3.46Å; V124-A127 PolarHBondContact O-N 3.11Å; A127-A130 PolarHBondContact O-N 3.44Å; A127-G131 PolarHBondContact O-N 3.28Å; A127-G171 WeakPolarHBondContact CA-O 3.25Å; A127-G171 WeakPolarHBondContact CB-O 3.22Å; A127-G175 VanDerWaalsContact O-CA 3.24Å; A127-G175 WeakPolarHBondContact O-CA 3.33Å |
| 128 | M | 89.3 | Confident | 79.3 | Confident | 10 Ų | 10 | 39 Ų | 39 | 5% | 0.049 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -64.3 | -39.7 | 177.6 | -76.1 | -173.4 | -47.4 | 0 | 0 | 112.2 | Q80 F89 L96 Y121 V124 H125 G131 E132 | Q80-M128 PolarHBondContact NE2-O 3.47Å; Q80-M128 PolarHBondContact OE1-SD 3.32Å; Q80-M128 VanDerWaalsContact OE1-SD 3.38Å; F89-M128 HydrophobicContact CD2-SD 4.33Å; F89-M128 HydrophobicContact CE2-CE 4.22Å; F89-M128 HydrophobicContact CE2-SD 3.69Å; F89-M128 HydrophobicContact CZ-SD 4.46Å; L96-M128 HydrophobicContact CD1-CB 4.46Å; L96-M128 HydrophobicContact CD1-CG 3.57Å; Y121-M128 HydrophobicContact CE1-CE 3.85Å; V124-M128 HydrophobicContact CG1-CE 4.15Å; V124-M128 HydrophobicContact CG1-CG 4.31Å; V124-M128 HydrophobicContact CG1-SD 4.14Å; V124-M128 VanDerWaalsContact O-CB 3.31Å; V124-M128 WeakPolarHBondContact O-CB 3.49Å; V124-M128 VanDerWaalsContact O-CG 3.22Å; V124-M128 WeakPolarHBondContact O-CG 3.27Å; V124-M128 PolarHBondContact O-N 3.32Å; H125-M128 PolarHBondContact O-N 2.94Å; M128-G131 PolarHBondContact O-N 3.09Å; M128-E132 PolarHBondContact O-N 2.98Å |
| 129 | L | 88.3 | Confident | 78.2 | Confident | 11 Ų | 11 | 43.8 Ų | 43.8 | 6% | 0.058 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -66.6 | -39.2 | 172.6 | -76.4 | 173.5 | 0 | 0 | 0 | 112.7 | L76 H125 L126 G131 E132 V133 P148 P149 L152 | L76-L129 HydrophobicContact CD1-CD1 3.87Å; L76-L129 HydrophobicContact CD1-CD2 4.05Å; L76-L129 HydrophobicContact CD1-CG 4.04Å; L76-L129 HydrophobicContact CD2-CD2 4.04Å; H125-L129 WeakPolarHBondContact O-CG 3.47Å; H125-L129 PolarHBondContact O-N 3.45Å; L126-L129 PolarHBondContact O-N 3.12Å; L129-G131 VanDerWaalsContact C-N 3.3Å; L129-G131 PolarHBondContact O-N 3.19Å; L129-E132 PolarHBondContact O-N 3.49Å; L129-V133 WeakPolarHBondContact O-CG2 3.41Å; L129-P148 HydrophobicContact CD1-CB 4.42Å; L129-P148 HydrophobicContact CD2-CB 4.4Å; L129-P149 HydrophobicContact CB-CB 4.15Å; L129-L152 HydrophobicContact CD1-CD2 3.83Å |
| 130 | A | 86.4 | Confident | 76.3 | Confident | 1 Ų | 1 | 56 Ų | 56 | 1% | 0.008 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -66.3 | -33 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | L126 A127 V133 L172 L176 | L126-A130 WeakPolarHBondContact O-CB 3.28Å; L126-A130 PolarHBondContact O-N 2.87Å; A127-A130 PolarHBondContact O-N 3.44Å; A130-V133 WeakPolarHBondContact O-CG2 3.49Å; A130-V133 PolarHBondContact O-N 3.46Å; A130-L172 HydrophobicContact CB-CD1 3.7Å; A130-L176 HydrophobicContact CB-CD2 4.4Å; A130-L176 HydrophobicContact CB-CG 4.33Å |
| 131 | G | 79.4 | Confident | 75 | Confident | 9 Ų | 9 | 59.9 Ų | 59.9 | 9% | 0.093 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -56.5 | -48.7 | 168.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | A127 M128 L129 V133 | A127-G131 PolarHBondContact O-N 3.28Å; M128-G131 PolarHBondContact O-N 3.09Å; L129-G131 VanDerWaalsContact C-N 3.3Å; L129-G131 PolarHBondContact O-N 3.19Å; G131-V133 VanDerWaalsContact C-N 3.26Å; G131-V133 PolarHBondContact O-N 2.89Å |
| 132 | E | 76.9 | Confident | 73.7 | Confident | 44 Ų | 44 | 62.4 Ų | 62.4 | 21% | 0.206 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -64.9 | -21.4 | -177 | -75.8 | -174.4 | -172 | 0 | 0 | 115 | Q80 M128 L129 H134 H135 R138 | Q80-E132 WeakPolarHBondContact CG-OE1 3.33Å; Q80-E132 PolarHBondContact NE2-OE1 3.16Å; M128-E132 PolarHBondContact O-N 2.98Å; L129-E132 PolarHBondContact O-N 3.49Å; E132-H134 PolarHBondContact O-N 3.41Å; E132-H135 PolarHBondContact O-N 2.97Å; E132-R138 IonicContact OE2-CZ 2.98Å; E132-R138 IonicContact OE2-NH2 2.69Å; E132-R138 PolarHBondContact OE2-NH2 2.86Å |
| 133 | V | 67.1 | Low | 72.7 | Confident | 37 Ų | 37 | 67.9 Ų | 67.9 | 22% | 0.224 | 36% | 0.359 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -55.4 | -29 | -174.6 | -175.6 | 0 | 0 | 0 | 0 | 112.3 | L129 A130 G131 P145 W146 P149 | L129-V133 WeakPolarHBondContact O-CG2 3.41Å; A130-V133 WeakPolarHBondContact O-CG2 3.49Å; A130-V133 PolarHBondContact O-N 3.46Å; G131-V133 VanDerWaalsContact C-N 3.26Å; G131-V133 PolarHBondContact O-N 2.89Å; V133-P145 HydrophobicContact CG1-CB 4.47Å; V133-W146 HydrophobicContact CG1-CB 4.08Å; V133-P149 HydrophobicContact CG2-CG 4.16Å |
| 134 | H | 60.2 | Low | 72 | Confident | 116 Ų | 116 | 70.4 Ų | 70.4 | 54% | 0.537 | 38% | 0.376 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.9 | 1.1 | -175 | -61.9 | 84.2 | 0 | 0 | 0 | 114 | E132 P136 A179 | E132-H134 PolarHBondContact O-N 3.41Å; H134-P136 WeakPolarHBondContact O-CD 3.21Å; H134-A179 WeakPolarHBondContact ND1-CB 3.34Å |
| 135 | H | 60.6 | Low | 71 | Confident | 130 Ų | 130 | 73 Ų | 73 | 60% | 0.602 | 39% | 0.392 | S | S | * | . | trans | -89.9 | 116.1 | 179.4 | -72.1 | -38.9 | 0 | 0 | 0 | 112.2 | E132 K137 | E132-H135 PolarHBondContact O-N 2.97Å; H135-K137 PolarHBondContact O-N 3.49Å; H135-K137 VanDerWaalsContact O-N 3.12Å | ||
| 136 | P | 53.7 | Low | 70.4 | Confident | 127 Ų | 127 | 79.9 Ų | 79.9 | 83% | 0.825 | 42% | 0.418 | S | S | * | . | S | Bend | trans | -75.4 | -1.2 | -172.5 | 30.4 | -36.8 | 0 | 0 | 0 | 114.9 | H134 R138 | H134-P136 WeakPolarHBondContact O-CD 3.21Å; P136-R138 PolarHBondContact O-N 3.39Å |
| 137 | K | 58.6 | Low | 70.1 | Confident | 206 Ų | 206 | 82.6 Ų | 82.6 | 90% | 0.896 | 43% | 0.432 | S | S | * | . | trans | -95.3 | 30 | -172.9 | -72.2 | -173.4 | 174.5 | 179.2 | 0 | 114.6 | H135 | H135-K137 PolarHBondContact O-N 3.49Å; H135-K137 VanDerWaalsContact O-N 3.12Å | ||
| 138 | R | 57.8 | Low | 69.8 | Low | 106 Ų | 106 | 84 Ų | 84 | 40% | 0.4 | 44% | 0.441 | S | S | . | . | trans | -85.5 | 135 | 175.8 | -150.3 | 171 | -154.1 | 151.3 | 23.8 | 111 | E132 P136 A142 | E132-R138 IonicContact OE2-CZ 2.98Å; E132-R138 IonicContact OE2-NH2 2.69Å; E132-R138 PolarHBondContact OE2-NH2 2.86Å; P136-R138 PolarHBondContact O-N 3.39Å; R138-A142 HydrophobicContact CG-CB 4.28Å | ||
| 139 | P | 56.5 | Low | 69.6 | Low | 104 Ų | 104 | 83.7 Ų | 83.7 | 68% | 0.675 | 44% | 0.44 | S | S | * | . | trans | -60.5 | 140 | -179.7 | 22.2 | -33.8 | 0 | 0 | 0 | 112.6 | G141 A142 | P139-G141 PolarHBondContact O-N 3.48Å; P139-G141 VanDerWaalsContact O-N 3.16Å; P139-A142 PolarHBondContact O-N 3.13Å | ||
| 140 | R | 43.8 | Very low | 69.5 | Low | 262 Ų | 262 | 89.7 Ų | 89.7 | 99% | 0.989 | 46% | 0.462 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.6 | 114.2 | 178.4 | -68.6 | 179.8 | 179.4 | 174.5 | -0 | 109.7 | ||
| 141 | G | 59.9 | Low | 69.5 | Low | 85 Ų | 85 | 94.4 Ų | 94.4 | 88% | 0.876 | 49% | 0.486 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 130.6 | -12.2 | 180 | 0 | 0 | 0 | 0 | 0 | 115.1 | P139 | P139-G141 PolarHBondContact O-N 3.48Å; P139-G141 VanDerWaalsContact O-N 3.16Å |
| 142 | A | 63.3 | Low | 69.8 | Low | 56 Ų | 56 | 94.7 Ų | 94.7 | 46% | 0.463 | 49% | 0.486 | S | S | . | . | S | Bend | trans | -72 | 156.7 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | R138 P139 | R138-A142 HydrophobicContact CG-CB 4.28Å; P139-A142 PolarHBondContact O-N 3.13Å |
| 143 | L | 68.4 | Low | 70.3 | Confident | 118 Ų | 118 | 92.8 Ų | 92.8 | 62% | 0.618 | 48% | 0.477 | S | S | * | . | P | Polyproline II helix | trans | -49.5 | 149.8 | 169.3 | -81.1 | 144.3 | 0 | 0 | 0 | 111.5 | L147 | L143-L147 HydrophobicContact CD2-CD1 4.49Å; L143-L147 HydrophobicContact CD2-CD2 4.3Å |
| 144 | P | 75.9 | Confident | 71.3 | Confident | 56 Ų | 56 | 95.2 Ų | 95.2 | 36% | 0.364 | 49% | 0.492 | S | S | . | . | P | Polyproline II helix | trans | -51.3 | 131.9 | 179 | -24.3 | 32.7 | 0 | 0 | 0 | 110.6 | W146 L147 P148 | P144-W146 HydrophobicContact CB-CD2 4.39Å; P144-W146 HydrophobicContact CB-CG 4.49Å; P144-W146 HydrophobicContact CB-CZ2 4.18Å; P144-W146 PolarHBondContact O-N 2.9Å; P144-L147 HydrophobicContact CB-CB 4.33Å; P144-L147 WeakPolarHBondContact O-CB 3.38Å; P144-L147 PolarHBondContact O-N 3.4Å; P144-P148 WeakPolarHBondContact O-CD 3.4Å |
| 145 | P | 72.6 | Confident | 72.6 | Confident | 53 Ų | 53 | 92.9 Ų | 92.9 | 34% | 0.344 | 48% | 0.483 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.6 | -26.8 | -164.8 | 23.2 | -34.3 | 0 | 0 | 0 | 113.4 | V133 | V133-P145 HydrophobicContact CG1-CB 4.47Š|
| 146 | W | 78.5 | Confident | 73.7 | Confident | 147 Ų | 147 | 86.7 Ų | 86.7 | 56% | 0.557 | 45% | 0.454 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.8 | -22.1 | 175.3 | 53.5 | -89.1 | 0 | 0 | 0 | 114.1 | V133 P144 P149 | V133-W146 HydrophobicContact CG1-CB 4.08Å; P144-W146 HydrophobicContact CB-CD2 4.39Å; P144-W146 HydrophobicContact CB-CG 4.49Å; P144-W146 HydrophobicContact CB-CZ2 4.18Å; P144-W146 PolarHBondContact O-N 2.9Å; W146-P149 VanDerWaalsContact O-CD 3.28Å; W146-P149 WeakPolarHBondContact O-CD 3.42Å; W146-P149 VanDerWaalsContact O-CG 3.28Å; W146-P149 WeakPolarHBondContact O-CG 3.44Å |
| 147 | L | 83.2 | Confident | 75.2 | Confident | 56 Ų | 56 | 83 Ų | 83 | 29% | 0.293 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -70.8 | -43.7 | -172.5 | -168.5 | 156.4 | 0 | 0 | 0 | 113.9 | L143 P144 W150 L151 | L143-L147 HydrophobicContact CD2-CD1 4.49Å; L143-L147 HydrophobicContact CD2-CD2 4.3Å; P144-L147 HydrophobicContact CB-CB 4.33Å; P144-L147 WeakPolarHBondContact O-CB 3.38Å; P144-L147 PolarHBondContact O-N 3.4Å; L147-W150 PolarHBondContact O-N 2.96Å; L147-L151 HydrophobicContact CD2-CB 4.2Å; L147-L151 HydrophobicContact CD2-CD2 4.36Å; L147-L151 WeakPolarHBondContact O-CB 3.2Å; L147-L151 PolarHBondContact O-N 3.36Å |
| 148 | P | 85.2 | Confident | 76.4 | Confident | 30 Ų | 30 | 79.6 Ų | 79.6 | 20% | 0.195 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -53 | -46.9 | 179.1 | -27.6 | 34.6 | 0 | 0 | 0 | 116.2 | L129 P144 L151 L152 | L129-P148 HydrophobicContact CD1-CB 4.42Å; L129-P148 HydrophobicContact CD2-CB 4.4Å; P144-P148 WeakPolarHBondContact O-CD 3.4Å; P148-L151 PolarHBondContact O-N 3.05Å; P148-L152 WeakPolarHBondContact O-CB 3.27Å; P148-L152 PolarHBondContact O-N 3.47Å |
| 149 | P | 85.3 | Confident | 77.6 | Confident | 3 Ų | 3 | 79.1 Ų | 79.1 | 2% | 0.019 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -65.5 | -40.7 | 177.6 | 23.4 | -32.7 | 0 | 0 | 0 | 112.6 | L126 L129 V133 W146 L151 L152 L153 L172 | L126-P149 HydrophobicContact CD1-CB 3.53Å; L126-P149 WeakPolarHBondContact CD1-O 3.46Å; L129-P149 HydrophobicContact CB-CB 4.15Å; V133-P149 HydrophobicContact CG2-CG 4.16Å; W146-P149 VanDerWaalsContact O-CD 3.28Å; W146-P149 WeakPolarHBondContact O-CD 3.42Å; W146-P149 VanDerWaalsContact O-CG 3.28Å; W146-P149 WeakPolarHBondContact O-CG 3.44Å; P149-L151 PolarHBondContact O-N 3.04Å; P149-L152 PolarHBondContact O-N 3.44Å; P149-L153 WeakPolarHBondContact O-CB 3.38Å; P149-L153 PolarHBondContact O-N 2.87Å; P149-L172 HydrophobicContact CB-CD1 4.2Å |
| 150 | W | 86.4 | Confident | 78.6 | Confident | 138 Ų | 138 | 74.3 Ų | 74.3 | 52% | 0.523 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -63.6 | -41 | 175.1 | -69.3 | 116.6 | 0 | 0 | 0 | 112.3 | L147 L153 V154 L172 | L147-W150 PolarHBondContact O-N 2.96Å; W150-L153 HydrophobicContact CE3-CD2 3.85Å; W150-L153 HydrophobicContact CZ3-CD2 3.83Å; W150-L153 PolarHBondContact O-N 2.72Å; W150-V154 WeakPolarHBondContact O-CG2 2.95Å; W150-V154 PolarHBondContact O-N 3Å; W150-V154 VanDerWaalsContact O-N 3.12Å; W150-L172 HydrophobicContact CE3-CD2 4.31Å; W150-L172 HydrophobicContact CH2-CD2 3.96Å; W150-L172 HydrophobicContact CZ2-CD2 4.43Å; W150-L172 HydrophobicContact CZ3-CD2 3.9Å |
| 151 | L | 87.2 | Confident | 80 | Confident | 99 Ų | 99 | 67.7 Ų | 67.7 | 52% | 0.518 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -61.5 | -44.8 | 175 | -178.3 | 63.5 | 0 | 0 | 0 | 111.2 | L147 P148 P149 V154 L155 | L147-L151 HydrophobicContact CD2-CB 4.2Å; L147-L151 HydrophobicContact CD2-CD2 4.36Å; L147-L151 WeakPolarHBondContact O-CB 3.2Å; L147-L151 PolarHBondContact O-N 3.36Å; P148-L151 PolarHBondContact O-N 3.05Å; P149-L151 PolarHBondContact O-N 3.04Å; L151-V154 PolarHBondContact O-N 2.86Å; L151-L155 WeakPolarHBondContact O-CB 3.37Å; L151-L155 PolarHBondContact O-N 3.44Å |
| 152 | L | 85.4 | Confident | 80.6 | Confident | 15 Ų | 15 | 67 Ų | 67 | 8% | 0.079 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -66.3 | -37.5 | 178.9 | -173.6 | 62.5 | 0 | 0 | 0 | 112.6 | L72 M122 H125 L126 L129 P148 P149 T156 | L72-L152 HydrophobicContact CD2-CD1 3.74Å; L72-L152 HydrophobicContact CD2-CD2 3.76Å; L72-L152 HydrophobicContact CD2-CG 4.43Å; M122-L152 HydrophobicContact SD-CD1 3.86Å; M122-L152 HydrophobicContact SD-CD2 4.05Å; M122-L152 HydrophobicContact SD-CG 4.24Å; H125-L152 HydrophobicContact CB-CD2 4.16Å; L126-L152 HydrophobicContact CB-CD2 4.24Å; L126-L152 HydrophobicContact CD1-CB 4.39Å; L129-L152 HydrophobicContact CD1-CD2 3.83Å; P148-L152 WeakPolarHBondContact O-CB 3.27Å; P148-L152 PolarHBondContact O-N 3.47Å; P149-L152 PolarHBondContact O-N 3.44Å; L152-T156 WeakPolarHBondContact O-CB 3.42Å; L152-T156 PolarHBondContact O-N 3.43Å; L152-T156 PolarHBondContact O-OG1 3.49Å |
| 153 | L | 87.6 | Confident | 81.1 | Confident | 4 Ų | 4 | 64.7 Ų | 64.7 | 2% | 0.021 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -62.6 | -38.7 | 175.8 | 175.6 | 62.2 | 0 | 0 | 0 | 112.2 | L126 P149 W150 P157 F165 L168 L172 | L126-L153 HydrophobicContact CD1-CB 4.44Å; L126-L153 HydrophobicContact CD2-CB 4.06Å; L126-L153 HydrophobicContact CD2-CD1 4.05Å; P149-L153 WeakPolarHBondContact O-CB 3.38Å; P149-L153 PolarHBondContact O-N 2.87Å; W150-L153 HydrophobicContact CE3-CD2 3.85Å; W150-L153 HydrophobicContact CZ3-CD2 3.83Å; W150-L153 PolarHBondContact O-N 2.72Å; L153-P157 WeakPolarHBondContact O-CD 3.17Å; L153-F165 HydrophobicContact CD1-CD2 3.91Å; L153-F165 HydrophobicContact CD1-CE2 3.63Å; L153-F165 HydrophobicContact CD1-CZ 4.3Å; L153-F165 HydrophobicContact CD2-CE2 4.11Å; L153-F165 HydrophobicContact CD2-CZ 4.31Å; L153-F165 HydrophobicContact CG-CD2 4.44Å; L153-F165 HydrophobicContact CG-CE2 3.78Å; L153-F165 HydrophobicContact CG-CZ 4.46Å; L153-L168 HydrophobicContact CD1-CB 3.51Å; L153-L168 HydrophobicContact CD1-CD1 4.4Å; L153-L172 HydrophobicContact CD2-CD2 3.8Å |
| 154 | V | 87.6 | Confident | 81.8 | Confident | 88 Ų | 88 | 60.9 Ų | 60.9 | 53% | 0.533 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -80.6 | -41.5 | 176.3 | 177.4 | 0 | 0 | 0 | 0 | 111.7 | W150 L151 P157 L158 | W150-V154 WeakPolarHBondContact O-CG2 2.95Å; W150-V154 PolarHBondContact O-N 3Å; W150-V154 VanDerWaalsContact O-N 3.12Å; L151-V154 PolarHBondContact O-N 2.86Å; V154-P157 WeakPolarHBondContact O-CD 3.25Å; V154-L158 HydrophobicContact CG1-CD1 4.44Å; V154-L158 WeakPolarHBondContact O-CD1 3.48Å |
| 155 | L | 86.1 | Confident | 82.2 | Confident | 67 Ų | 67 | 63.2 Ų | 63.2 | 35% | 0.351 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -71.6 | -33.9 | -174.1 | -168.8 | 69.6 | 0 | 0 | 0 | 112.5 | L151 L158 L159 | L151-L155 WeakPolarHBondContact O-CB 3.37Å; L151-L155 PolarHBondContact O-N 3.44Å; L155-L158 PolarHBondContact O-N 2.81Å; L155-L159 HydrophobicContact CD1-CD1 3.55Å; L155-L159 HydrophobicContact CD1-CD2 4.44Å; L155-L159 HydrophobicContact CD2-CD2 4.36Å; L155-L159 HydrophobicContact CG-CD1 3.9Å; L155-L159 HydrophobicContact CG-CD2 4.1Å; L155-L159 PolarHBondContact O-N 3.4Å |
| 156 | T | 85.3 | Confident | 82.9 | Confident | 1 Ų | 1 | 62.8 Ų | 62.8 | 1% | 0.006 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -61 | -52.3 | -177 | -58.3 | 0 | 0 | 0 | 0 | 112.5 | L68 M122 L152 L158 L159 S160 L168 | L68-T156 HydrophobicContact CD2-CG2 4.26Å; M122-T156 HydrophobicContact CB-CG2 4.42Å; M122-T156 HydrophobicContact CG-CG2 3.7Å; L152-T156 WeakPolarHBondContact O-CB 3.42Å; L152-T156 PolarHBondContact O-N 3.43Å; L152-T156 PolarHBondContact O-OG1 3.49Å; T156-L158 PolarHBondContact O-N 3.27Å; T156-L159 PolarHBondContact O-N 3.17Å; T156-S160 PolarHBondContact O-N 3.18Å; T156-L168 HydrophobicContact CG2-CD1 3.83Å; T156-L168 HydrophobicContact CG2-CD2 4.22Å |
| 157 | P | 84.8 | Confident | 83.4 | Confident | 50 Ų | 50 | 55.9 Ų | 55.9 | 33% | 0.325 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -65.1 | -23 | 176.7 | -22.7 | 35.7 | 0 | 0 | 0 | 114.3 | L153 V154 S160 F165 L168 | L153-P157 WeakPolarHBondContact O-CD 3.17Å; V154-P157 WeakPolarHBondContact O-CD 3.25Å; P157-S160 WeakPolarHBondContact CA-O 3.32Å; P157-F165 HydrophobicContact CG-CD2 4.47Å; P157-L168 HydrophobicContact CG-CD1 3.8Å |
| 158 | L | 84.6 | Confident | 83.8 | Confident | 133 Ų | 133 | 53.2 Ų | 53.2 | 70% | 0.696 | 29% | 0.285 | S | S | * | . | H | α-helix | trans | -75.3 | -33.2 | 175 | -97.7 | 72.9 | 0 | 0 | 0 | 112.4 | V154 L155 T156 | V154-L158 HydrophobicContact CG1-CD1 4.44Å; V154-L158 WeakPolarHBondContact O-CD1 3.48Å; L155-L158 PolarHBondContact O-N 2.81Å; T156-L158 PolarHBondContact O-N 3.27Å |
| 159 | L | 81.9 | Confident | 84.1 | Confident | 96 Ų | 96 | 54.4 Ų | 54.4 | 50% | 0.503 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -95.1 | -21.7 | -178.4 | -90.4 | 58.3 | 0 | 0 | 0 | 113.4 | L155 T156 | L155-L159 HydrophobicContact CD1-CD1 3.55Å; L155-L159 HydrophobicContact CD1-CD2 4.44Å; L155-L159 HydrophobicContact CD2-CD2 4.36Å; L155-L159 HydrophobicContact CG-CD1 3.9Å; L155-L159 HydrophobicContact CG-CD2 4.1Å; L155-L159 PolarHBondContact O-N 3.4Å; T156-L159 PolarHBondContact O-N 3.17Å |
| 160 | S | 76.6 | Confident | 84.3 | Confident | 4 Ų | 4 | 54.3 Ų | 54.3 | 3% | 0.028 | 29% | 0.289 | C | S | . | . | trans | -146.4 | 130.8 | -177.1 | -170.9 | 0 | 0 | 0 | 0 | 110.6 | G65 T156 P157 E162 | G65-S160 PolarHBondContact N-OG 3.44Å; T156-S160 PolarHBondContact O-N 3.18Å; P157-S160 WeakPolarHBondContact CA-O 3.32Å; S160-E162 VanDerWaalsContact CB-O 3.28Å; S160-E162 WeakPolarHBondContact CB-O 3.41Å; S160-E162 PolarHBondContact O-N 2.88Å; S160-E162 PolarHBondContact OG-O 3.48Å | ||
| 161 | S | 73.5 | Confident | 84.5 | Confident | 122 Ų | 122 | 47.8 Ų | 47.8 | 85% | 0.853 | 26% | 0.264 | S | S | * | . | S | Bend | trans | -69.2 | -11.4 | 176.9 | -51.9 | 0 | 0 | 0 | 0 | 113.7 | ||
| 162 | E | 73 | Confident | 84.8 | Confident | 72 Ų | 72 | 43.3 Ų | 43.3 | 34% | 0.336 | 24% | 0.241 | S | C | . | . | trans | -134.7 | 142.3 | 175 | -58.3 | -179.3 | 119.3 | 0 | 0 | 109.2 | T61 A62 S160 | T61-E162 VanDerWaalsContact CB-OE2 3.26Å; T61-E162 WeakPolarHBondContact CB-OE2 3.34Å; T61-E162 PolarHBondContact OG1-OE1 3.43Å; T61-E162 PolarHBondContact OG1-OE2 2.83Å; A62-E162 HydrophobicContact CB-CB 4.46Å; S160-E162 VanDerWaalsContact CB-O 3.28Å; S160-E162 WeakPolarHBondContact CB-O 3.41Å; S160-E162 PolarHBondContact O-N 2.88Å; S160-E162 PolarHBondContact OG-O 3.48Å | ||
| 163 | P | 75.1 | Confident | 85.1 | Confident | 6 Ų | 6 | 46.6 Ų | 46.6 | 4% | 0.039 | 26% | 0.258 | C | S | . | . | S | Bend | cis | -78.2 | 161.3 | 1.8 | 33.7 | -37.7 | 0 | 0 | 0 | 113.5 | M122 Q167 L168 | M122-P163 HydrophobicContact CB-CG 4.28Å; P163-Q167 HydrophobicContact CB-CB 4.25Å; P163-Q167 HydrophobicContact CB-CG 4.31Å; P163-L168 HydrophobicContact CG-CD2 3.8Å; P163-L168 HydrophobicContact CG-CG 4.05Å |
| 164 | P | 81.6 | Confident | 85.3 | Confident | 39 Ų | 39 | 46.6 Ų | 46.6 | 25% | 0.253 | 26% | 0.258 | S | S | . | . | trans | -65.7 | 151.7 | 177.7 | 29.1 | -34.6 | 0 | 0 | 0 | 111.5 | G114 S118 L166 Q167 L168 | G114-P164 WeakPolarHBondContact O-CB 3.3Å; G114-P164 WeakPolarHBondContact O-CG 3.39Å; S118-P164 WeakPolarHBondContact OG-CD 3.45Å; P164-L166 PolarHBondContact O-N 3.23Å; P164-L166 VanDerWaalsContact O-N 3.1Å; P164-Q167 HydrophobicContact CG-CB 4.03Å; P164-Q167 WeakPolarHBondContact O-CB 3.38Å; P164-Q167 PolarHBondContact O-N 2.96Å; P164-L168 PolarHBondContact O-N 3.23Å | ||
| 165 | F | 85.8 | Confident | 85.4 | Confident | 104 Ų | 104 | 42.4 Ų | 42.4 | 46% | 0.456 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -52.4 | -36.2 | -179 | 178 | -95.4 | 0 | 0 | 0 | 113.5 | L153 P157 L168 L169 | L153-F165 HydrophobicContact CD1-CD2 3.91Å; L153-F165 HydrophobicContact CD1-CE2 3.63Å; L153-F165 HydrophobicContact CD1-CZ 4.3Å; L153-F165 HydrophobicContact CD2-CE2 4.11Å; L153-F165 HydrophobicContact CD2-CZ 4.31Å; L153-F165 HydrophobicContact CG-CD2 4.44Å; L153-F165 HydrophobicContact CG-CE2 3.78Å; L153-F165 HydrophobicContact CG-CZ 4.46Å; P157-F165 HydrophobicContact CG-CD2 4.47Å; F165-L168 PolarHBondContact O-N 3.21Å; F165-L169 HydrophobicContact CE1-CD2 4.37Å; F165-L169 WeakPolarHBondContact O-CB 3.08Å; F165-L169 PolarHBondContact O-N 3.32Å |
| 166 | L | 87.2 | Confident | 85.5 | Confident | 45 Ų | 45 | 42.5 Ų | 42.5 | 24% | 0.236 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -65 | -38.4 | 178.1 | -68.1 | 172.6 | 0 | 0 | 0 | 112.8 | V112 S113 A115 P164 L168 L169 C170 | V112-L166 HydrophobicContact CG1-CD1 3.59Å; S113-L166 WeakPolarHBondContact O-CD1 3.37Å; A115-L166 HydrophobicContact CB-CB 4.41Å; A115-L166 HydrophobicContact CB-CD1 4.24Å; P164-L166 PolarHBondContact O-N 3.23Å; P164-L166 VanDerWaalsContact O-N 3.1Å; L166-L168 VanDerWaalsContact C-N 3.33Å; L166-L168 PolarHBondContact O-N 3.38Å; L166-L169 PolarHBondContact O-N 3.12Å; L166-C170 PolarHBondContact O-N 3.12Å; L166-C170 PolarHBondContact O-SG 3.42Å |
| 167 | Q | 88.9 | Confident | 85.7 | Confident | 1 Ų | 1 | 44 Ų | 44 | 1% | 0.005 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -64.5 | -40.2 | 175.1 | -172.7 | 77.3 | 4.8 | 0 | 0 | 110.8 | H56 A115 S118 P123 P163 P164 C170 G171 | H56-Q167 PolarHBondContact NE2-NE2 3.19Å; H56-Q167 VanDerWaalsContact NE2-NE2 3.19Å; A115-Q167 PolarHBondContact O-OE1 2.92Å; A115-Q167 VanDerWaalsContact O-OE1 3.04Å; S118-Q167 WeakPolarHBondContact OG-CG 3.37Å; P123-Q167 HydrophobicContact CB-CG 4.43Å; P123-Q167 HydrophobicContact CG-CG 3.56Å; P163-Q167 HydrophobicContact CB-CB 4.25Å; P163-Q167 HydrophobicContact CB-CG 4.31Å; P164-Q167 HydrophobicContact CG-CB 4.03Å; P164-Q167 WeakPolarHBondContact O-CB 3.38Å; P164-Q167 PolarHBondContact O-N 2.96Å; Q167-C170 WeakPolarHBondContact O-CB 3.44Å; Q167-C170 PolarHBondContact O-N 3.18Å; Q167-G171 PolarHBondContact O-N 3Å |
| 168 | L | 90.8 | Very high | 85.8 | Confident | 0 Ų | 0 | 45.2 Ų | 45.2 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -65.4 | -44 | 175 | -63.8 | 171.2 | 0 | 0 | 0 | 111.2 | M122 P123 L126 L153 T156 P157 P163 P164 F165 L166 C170 G171 L172 | M122-L168 HydrophobicContact CB-CD2 3.94Å; M122-L168 HydrophobicContact CG-CD2 3.86Å; P123-L168 HydrophobicContact CG-CD2 4.38Å; L126-L168 HydrophobicContact CD2-CB 3.95Å; L126-L168 HydrophobicContact CD2-CD2 4.45Å; L126-L168 VanDerWaalsContact CD2-O 3.22Å; L126-L168 WeakPolarHBondContact CD2-O 3.22Å; L153-L168 HydrophobicContact CD1-CB 3.51Å; L153-L168 HydrophobicContact CD1-CD1 4.4Å; T156-L168 HydrophobicContact CG2-CD1 3.83Å; T156-L168 HydrophobicContact CG2-CD2 4.22Å; P157-L168 HydrophobicContact CG-CD1 3.8Å; P163-L168 HydrophobicContact CG-CD2 3.8Å; P163-L168 HydrophobicContact CG-CG 4.05Å; P164-L168 PolarHBondContact O-N 3.23Å; F165-L168 PolarHBondContact O-N 3.21Å; L166-L168 VanDerWaalsContact C-N 3.33Å; L166-L168 PolarHBondContact O-N 3.38Å; L168-C170 VanDerWaalsContact C-N 3.28Å; L168-C170 PolarHBondContact O-N 2.8Å; L168-G171 WeakPolarHBondContact O-CA 3.25Å; L168-G171 PolarHBondContact O-N 3.05Å; L168-L172 PolarHBondContact O-N 3.17Å |
| 169 | L | 90.6 | Very high | 85.8 | Confident | 55 Ų | 55 | 40.4 Ų | 40.4 | 29% | 0.288 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -60.5 | -38.4 | 174.3 | -175 | 62.2 | 0 | 0 | 0 | 111.7 | F165 L166 G171 L172 L173 | F165-L169 HydrophobicContact CE1-CD2 4.37Å; F165-L169 WeakPolarHBondContact O-CB 3.08Å; F165-L169 PolarHBondContact O-N 3.32Å; L166-L169 PolarHBondContact O-N 3.12Å; L169-G171 VanDerWaalsContact C-N 3.34Å; L169-G171 PolarHBondContact O-N 3.36Å; L169-L172 HydrophobicContact CD1-CD2 4.4Å; L169-L172 PolarHBondContact O-N 2.96Å; L169-L173 HydrophobicContact CG-CD1 4.22Å; L169-L173 WeakPolarHBondContact O-CB 3.21Å; L169-L173 VanDerWaalsContact O-CG 3.32Å; L169-L173 WeakPolarHBondContact O-CG 3.24Å; L169-L173 PolarHBondContact O-N 2.96Å |
| 170 | C | 90.7 | Very high | 85.9 | Confident | 2 Ų | 2 | 40.1 Ų | 40.1 | 1% | 0.014 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -62.2 | -40 | 172.5 | -67 | 0 | 0 | 0 | 0 | 112 | L103 L166 Q167 L168 A174 | L103-C170 HydrophobicContact CB-CB 4.16Å; L103-C170 HydrophobicContact CD2-CB 4.09Å; L103-C170 HydrophobicContact CG-CB 4.14Å; L166-C170 PolarHBondContact O-N 3.12Å; L166-C170 PolarHBondContact O-SG 3.42Å; Q167-C170 WeakPolarHBondContact O-CB 3.44Å; Q167-C170 PolarHBondContact O-N 3.18Å; L168-C170 VanDerWaalsContact C-N 3.28Å; L168-C170 PolarHBondContact O-N 2.8Å; C170-A174 VanDerWaalsContact O-CB 3.27Å; C170-A174 WeakPolarHBondContact O-CB 3.43Å; C170-A174 PolarHBondContact O-N 2.95Å |
| 171 | G | 91.3 | Very high | 86.2 | Confident | 0 Ų | 0 | 41 Ų | 41 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -60.1 | -49.3 | 170.9 | 0 | 0 | 0 | 0 | 0 | 113 | P123 A127 Q167 L168 L169 L173 A174 G175 | P123-G171 WeakPolarHBondContact O-CA 3.32Å; A127-G171 WeakPolarHBondContact CA-O 3.25Å; A127-G171 WeakPolarHBondContact CB-O 3.22Å; Q167-G171 PolarHBondContact O-N 3Å; L168-G171 WeakPolarHBondContact O-CA 3.25Å; L168-G171 PolarHBondContact O-N 3.05Å; L169-G171 VanDerWaalsContact C-N 3.34Å; L169-G171 PolarHBondContact O-N 3.36Å; G171-L173 PolarHBondContact O-N 3Å; G171-A174 PolarHBondContact O-N 3.18Å; G171-G175 PolarHBondContact O-N 3.46Å |
| 172 | L | 92.2 | Very high | 86.4 | Confident | 6 Ų | 6 | 38.5 Ų | 38.5 | 3% | 0.031 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -57.5 | -47.8 | 177.3 | 180 | 57.4 | 0 | 0 | 0 | 111.8 | L126 A130 P149 W150 L153 L168 L169 G175 L176 | L126-L172 HydrophobicContact CD1-CD1 4.35Å; L126-L172 HydrophobicContact CD2-CB 4.08Å; L126-L172 HydrophobicContact CG-CB 4.1Å; A130-L172 HydrophobicContact CB-CD1 3.7Å; P149-L172 HydrophobicContact CB-CD1 4.2Å; W150-L172 HydrophobicContact CE3-CD2 4.31Å; W150-L172 HydrophobicContact CH2-CD2 3.96Å; W150-L172 HydrophobicContact CZ2-CD2 4.43Å; W150-L172 HydrophobicContact CZ3-CD2 3.9Å; L153-L172 HydrophobicContact CD2-CD2 3.8Å; L168-L172 PolarHBondContact O-N 3.17Å; L169-L172 HydrophobicContact CD1-CD2 4.4Å; L169-L172 PolarHBondContact O-N 2.96Å; L172-G175 PolarHBondContact O-N 2.89Å; L172-L176 HydrophobicContact CD1-CD1 4.39Å; L172-L176 HydrophobicContact CD1-CG 4.48Å; L172-L176 HydrophobicContact CG-CD1 4.32Å; L172-L176 WeakPolarHBondContact O-CG 3.25Å; L172-L176 PolarHBondContact O-N 2.84Å |
| 173 | L | 91.6 | Very high | 86.6 | Confident | 84 Ų | 84 | 37.4 Ų | 37.4 | 44% | 0.44 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -65 | -40.5 | 178.1 | -69.4 | 172.3 | 0 | 0 | 0 | 112.3 | L103 L169 G171 G175 L176 A177 | L103-L173 HydrophobicContact CD2-CB 3.78Å; L103-L173 HydrophobicContact CD2-CD1 4.13Å; L169-L173 HydrophobicContact CG-CD1 4.22Å; L169-L173 WeakPolarHBondContact O-CB 3.21Å; L169-L173 VanDerWaalsContact O-CG 3.32Å; L169-L173 WeakPolarHBondContact O-CG 3.24Å; L169-L173 PolarHBondContact O-N 2.96Å; G171-L173 PolarHBondContact O-N 3Å; L173-G175 VanDerWaalsContact C-N 3.34Å; L173-G175 PolarHBondContact O-N 2.89Å; L173-L176 PolarHBondContact O-N 3.16Å; L173-A177 WeakPolarHBondContact O-CB 3.22Å; L173-A177 PolarHBondContact O-N 2.99Å |
| 174 | A | 92 | Very high | 86.6 | Confident | 4 Ų | 4 | 46 Ų | 46 | 3% | 0.033 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -62 | -40.6 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | A99 C170 G171 A177 Y178 | A99-A174 HydrophobicContact CB-CB 3.84Å; C170-A174 VanDerWaalsContact O-CB 3.27Å; C170-A174 WeakPolarHBondContact O-CB 3.43Å; C170-A174 PolarHBondContact O-N 2.95Å; G171-A174 PolarHBondContact O-N 3.18Å; A174-A177 PolarHBondContact O-N 3.2Å; A174-Y178 WeakPolarHBondContact O-CB 3.13Å; A174-Y178 PolarHBondContact O-N 2.87Å |
| 175 | G | 89.9 | Confident | 86.4 | Confident | 0 Ų | 0 | 56.3 Ų | 56.3 | 0% | 0 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -66.5 | -40 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | A127 G171 L172 L173 Y178 A179 | A127-G175 VanDerWaalsContact O-CA 3.24Å; A127-G175 WeakPolarHBondContact O-CA 3.33Å; G171-G175 PolarHBondContact O-N 3.46Å; L172-G175 PolarHBondContact O-N 2.89Å; L173-G175 VanDerWaalsContact C-N 3.34Å; L173-G175 PolarHBondContact O-N 2.89Å; G175-Y178 WeakPolarHBondContact O-CB 3.25Å; G175-Y178 PolarHBondContact O-N 2.84Å; G175-A179 PolarHBondContact O-N 3.47Å |
| 176 | L | 88.5 | Confident | 85.9 | Confident | 69 Ų | 69 | 56.1 Ų | 56.1 | 36% | 0.361 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -66.5 | -40.5 | 173.4 | -69.7 | 172.4 | 0 | 0 | 0 | 112 | A130 L172 L173 Y178 A179 A180 | A130-L176 HydrophobicContact CB-CD2 4.4Å; A130-L176 HydrophobicContact CB-CG 4.33Å; L172-L176 HydrophobicContact CD1-CD1 4.39Å; L172-L176 HydrophobicContact CD1-CG 4.48Å; L172-L176 HydrophobicContact CG-CD1 4.32Å; L172-L176 WeakPolarHBondContact O-CG 3.25Å; L172-L176 PolarHBondContact O-N 2.84Å; L173-L176 PolarHBondContact O-N 3.16Å; L176-Y178 VanDerWaalsContact C-N 3.3Å; L176-Y178 PolarHBondContact O-N 3.21Å; L176-A179 PolarHBondContact O-N 3.41Å; L176-A180 WeakPolarHBondContact O-CB 3.31Å; L176-A180 PolarHBondContact O-N 3.05Å |
| 177 | A | 89.4 | Confident | 85.5 | Confident | 33 Ų | 33 | 58.2 Ų | 58.2 | 27% | 0.273 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -63.8 | -36.3 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112 | L173 A174 A180 G181 A182 F183 | L173-A177 WeakPolarHBondContact O-CB 3.22Å; L173-A177 PolarHBondContact O-N 2.99Å; A174-A177 PolarHBondContact O-N 3.2Å; A177-A180 PolarHBondContact O-N 3.5Å; A177-G181 PolarHBondContact O-N 3.33Å; A177-A182 HydrophobicContact CB-CB 4.28Å; A177-A182 WeakPolarHBondContact O-CB 3.24Å; A177-A182 PolarHBondContact O-N 3.42Å; A177-F183 HydrophobicContact CB-CE2 4.11Å |
| 178 | Y | 87.3 | Confident | 84.7 | Confident | 74 Ų | 74 | 59.5 Ų | 59.5 | 29% | 0.29 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -65.5 | -45.2 | 171.9 | -175.6 | -91.9 | 0 | 0 | 0 | 112.1 | L95 L96 A174 G175 L176 A180 G181 F183 | L95-Y178 HydrophobicContact CD1-CE2 4.47Å; L96-Y178 HydrophobicContact CD2-CD2 4.19Å; L96-Y178 HydrophobicContact CD2-CG 3.97Å; A174-Y178 WeakPolarHBondContact O-CB 3.13Å; A174-Y178 PolarHBondContact O-N 2.87Å; G175-Y178 WeakPolarHBondContact O-CB 3.25Å; G175-Y178 PolarHBondContact O-N 2.84Å; L176-Y178 VanDerWaalsContact C-N 3.3Å; L176-Y178 PolarHBondContact O-N 3.21Å; Y178-A180 VanDerWaalsContact C-N 3.32Å; Y178-A180 PolarHBondContact O-N 2.99Å; Y178-G181 PolarHBondContact O-N 3.26Å; Y178-F183 HydrophobicContact CD2-CB 4.21Å; Y178-F183 AromaticContact CD2-CD2 3.92Å; Y178-F183 HydrophobicContact CD2-CD2 3.92Å; Y178-F183 HydrophobicContact CD2-CG 4.48Å; Y178-F183 HydrophobicContact CG-CD2 4.41Å |
| 179 | A | 84.8 | Confident | 83.9 | Confident | 32 Ų | 32 | 62.6 Ų | 62.6 | 26% | 0.264 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -59.8 | -40 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | H134 G175 L176 G181 | H134-A179 WeakPolarHBondContact ND1-CB 3.34Å; G175-A179 PolarHBondContact O-N 3.47Å; L176-A179 PolarHBondContact O-N 3.41Å; A179-G181 PolarHBondContact O-N 3.19Å |
| 180 | A | 84.1 | Confident | 83.1 | Confident | 90 Ų | 90 | 64.3 Ų | 64.3 | 74% | 0.744 | 34% | 0.341 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.4 | -4.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | L176 A177 Y178 | L176-A180 WeakPolarHBondContact O-CB 3.31Å; L176-A180 PolarHBondContact O-N 3.05Å; A177-A180 PolarHBondContact O-N 3.5Å; Y178-A180 VanDerWaalsContact C-N 3.32Å; Y178-A180 PolarHBondContact O-N 2.99Å |
| 181 | G | 81.6 | Confident | 82.1 | Confident | 23 Ų | 23 | 74.6 Ų | 74.6 | 24% | 0.237 | 38% | 0.379 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 80.1 | 17.1 | 177.1 | 0 | 0 | 0 | 0 | 0 | 115.1 | A177 Y178 A179 F183 R184 | A177-G181 PolarHBondContact O-N 3.33Å; Y178-G181 PolarHBondContact O-N 3.26Å; A179-G181 PolarHBondContact O-N 3.19Å; G181-F183 PolarHBondContact O-N 2.93Å; G181-F183 VanDerWaalsContact O-N 3.16Å; G181-R184 WeakPolarHBondContact O-CB 3.31Å; G181-R184 VanDerWaalsContact O-CG 3.25Å; G181-R184 WeakPolarHBondContact O-CG 3.25Å; G181-R184 PolarHBondContact O-N 2.94Å; G181-R184 VanDerWaalsContact O-N 3.13Å |
| 182 | A | 78.9 | Confident | 81.2 | Confident | 69 Ų | 69 | 83.6 Ų | 83.6 | 57% | 0.57 | 41% | 0.413 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.4 | -29.5 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | A177 | A177-A182 HydrophobicContact CB-CB 4.28Å; A177-A182 WeakPolarHBondContact O-CB 3.24Å; A177-A182 PolarHBondContact O-N 3.42Å |
| 183 | F | 76.8 | Confident | 80.2 | Confident | 50 Ų | 50 | 83.9 Ų | 83.9 | 22% | 0.219 | 41% | 0.414 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -96.6 | 11.9 | -179.4 | -56.7 | -68.9 | 0 | 0 | 0 | 114.6 | L95 A99 A177 Y178 G181 W185 L186 E187 | L95-F183 HydrophobicContact CD1-CB 4.41Å; A99-F183 HydrophobicContact CB-CE1 4.24Å; A99-F183 HydrophobicContact CB-CE2 4.14Å; A99-F183 HydrophobicContact CB-CZ 3.57Å; A177-F183 HydrophobicContact CB-CE2 4.11Å; Y178-F183 HydrophobicContact CD2-CB 4.21Å; Y178-F183 AromaticContact CD2-CD2 3.92Å; Y178-F183 HydrophobicContact CD2-CD2 3.92Å; Y178-F183 HydrophobicContact CD2-CG 4.48Å; Y178-F183 HydrophobicContact CG-CD2 4.41Å; G181-F183 PolarHBondContact O-N 2.93Å; G181-F183 VanDerWaalsContact O-N 3.16Å; F183-W185 PolarHBondContact O-N 3.23Å; F183-W185 VanDerWaalsContact O-N 3.11Å; F183-L186 HydrophobicContact CD1-CD1 3.99Å; F183-L186 WeakPolarHBondContact O-CA 3.34Å; F183-L186 WeakPolarHBondContact O-CB 3.35Å; F183-L186 PolarHBondContact O-N 3.35Å; F183-E187 PolarHBondContact O-N 3.31Å |
| 184 | R | 75.9 | Confident | 79.2 | Confident | 186 Ų | 186 | 84.5 Ų | 84.5 | 70% | 0.702 | 42% | 0.415 | S | S | * | . | G | 310 helix | trans | -58.1 | -26.3 | -179.3 | -75.6 | 177.6 | 73 | -163.7 | 1.8 | 114.4 | G181 L186 E187 | G181-R184 WeakPolarHBondContact O-CB 3.31Å; G181-R184 VanDerWaalsContact O-CG 3.25Å; G181-R184 WeakPolarHBondContact O-CG 3.25Å; G181-R184 PolarHBondContact O-N 2.94Å; G181-R184 VanDerWaalsContact O-N 3.13Å; R184-L186 VanDerWaalsContact C-N 3.27Å; R184-L186 PolarHBondContact O-N 2.97Å; R184-E187 WeakPolarHBondContact O-CB 3.27Å; R184-E187 PolarHBondContact O-N 2.92Å |
| 185 | W | 76.1 | Confident | 78.2 | Confident | 256 Ų | 256 | 87.2 Ų | 87.2 | 97% | 0.97 | 44% | 0.438 | S | S | * | . | G | 310 helix | trans | -70.6 | -20.5 | 173.3 | -85.6 | 83 | 0 | 0 | 0 | 114.2 | F183 | F183-W185 PolarHBondContact O-N 3.23Å; F183-W185 VanDerWaalsContact O-N 3.11Å |
| 186 | L | 76.2 | Confident | 77.2 | Confident | 99 Ų | 99 | 92.1 Ų | 92.1 | 52% | 0.518 | 46% | 0.463 | S | S | . | . | G | 310 helix | trans | -99.4 | 3.2 | 178.7 | -75.3 | 147.9 | 0 | 0 | 0 | 112.1 | H91 L95 F183 R184 | H91-L186 PolarHBondContact CE1-O 3.45Å; H91-L186 PolarHBondContact NE2-O 2.82Å; L95-L186 HydrophobicContact CD1-CB 4.09Å; L95-L186 HydrophobicContact CD2-CB 4.04Å; L95-L186 HydrophobicContact CD2-CD1 4.39Å; L95-L186 HydrophobicContact CD2-CD2 4.4Å; F183-L186 HydrophobicContact CD1-CD1 3.99Å; F183-L186 WeakPolarHBondContact O-CA 3.34Å; F183-L186 WeakPolarHBondContact O-CB 3.35Å; F183-L186 PolarHBondContact O-N 3.35Å; R184-L186 VanDerWaalsContact C-N 3.27Å; R184-L186 PolarHBondContact O-N 2.97Å |
| 187 | E | 77.5 | Confident | 76.4 | Confident | 89 Ų | 89 | 92.3 Ų | 92.3 | 42% | 0.416 | 46% | 0.462 | S | S | . | . | S | Bend | trans | -71 | 129.3 | 177.6 | -160.3 | 172.6 | 168.3 | 0 | 0 | 110 | R88 F183 R184 S189 | R88-E187 IonicContact CZ-OE1 3.69Å; R88-E187 IonicContact NH1-OE1 3.83Å; R88-E187 IonicContact NH2-OE1 3.75Å; R88-E187 PolarHBondContact NH2-OE1 2.96Å; F183-E187 PolarHBondContact O-N 3.31Å; R184-E187 WeakPolarHBondContact O-CB 3.27Å; R184-E187 PolarHBondContact O-N 2.92Å; E187-S189 PolarHBondContact O-N 3.4Å |
| 188 | P | 71.7 | Confident | 75.5 | Confident | 29 Ų | 29 | 97.4 Ų | 97.4 | 19% | 0.188 | 48% | 0.48 | C | S | . | . | P | Polyproline II helix | trans | -72.4 | 131.9 | -173.6 | 29.3 | -32.2 | 0 | 0 | 0 | 109.3 | L193 | P188-L193 HydrophobicContact CG-CD1 4.45Š|
| 189 | S | 73.9 | Confident | 74.7 | Confident | 65 Ų | 65 | 95 Ų | 95 | 46% | 0.455 | 48% | 0.479 | S | S | . | . | P | Polyproline II helix | trans | -65.9 | 140.4 | 174.8 | 61.5 | 0 | 0 | 0 | 0 | 110.7 | E187 R191 R192 L193 | E187-S189 PolarHBondContact O-N 3.4Å; S189-R191 PolarHBondContact O-N 3.32Å; S189-R192 WeakPolarHBondContact O-CB 3.44Å; S189-R192 PolarHBondContact O-N 3.07Å; S189-L193 PolarHBondContact O-N 3.27Å; S189-L193 VanDerWaalsContact O-N 3.16Å |
| 190 | E | 75.9 | Confident | 73.5 | Confident | 91 Ų | 91 | 99.4 Ų | 99.4 | 43% | 0.425 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -51.1 | -33.6 | -178.5 | -65.7 | -60.1 | 147.1 | 0 | 0 | 112.7 | R88 R192 L193 Q194 | R88-E190 IonicContact CZ-OE1 3.99Å; R88-E190 IonicContact NH1-OE1 2.78Å; R88-E190 PolarHBondContact NH1-OE1 2.65Å; E190-R192 PolarHBondContact O-N 3Å; E190-L193 WeakPolarHBondContact O-CB 3.43Å; E190-L193 PolarHBondContact O-N 3.49Å; E190-Q194 WeakPolarHBondContact O-CB 3.26Å; E190-Q194 PolarHBondContact O-N 3.35Å |
| 191 | R | 68.4 | Low | 72.5 | Confident | 217 Ų | 217 | 101.7 Ų | 101.7 | 82% | 0.819 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -61.6 | -38.8 | 174.5 | -63 | -175.4 | -176.4 | 179.2 | 1.3 | 113.6 | S189 A195 | S189-R191 PolarHBondContact O-N 3.32Å; R191-A195 WeakPolarHBondContact O-CB 3.43Å; R191-A195 PolarHBondContact O-N 3.33Å; R191-A195 VanDerWaalsContact O-N 3.09Å |
| 192 | R | 72.3 | Confident | 71.6 | Confident | 190 Ų | 190 | 101.2 Ų | 101.2 | 72% | 0.717 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -73.5 | -36.9 | 175.6 | -70.1 | -175.3 | -177.6 | -172.7 | 3.4 | 111.1 | S189 E190 A195 L196 | S189-R192 WeakPolarHBondContact O-CB 3.44Å; S189-R192 PolarHBondContact O-N 3.07Å; E190-R192 PolarHBondContact O-N 3Å; R192-A195 PolarHBondContact O-N 3.48Å; R192-L196 WeakPolarHBondContact O-CB 3.39Å; R192-L196 PolarHBondContact O-N 3.31Å |
| 193 | L | 70.9 | Confident | 70.8 | Confident | 11 Ų | 11 | 100.3 Ų | 100.3 | 6% | 0.058 | 49% | 0.491 | C | S | . | . | H | α-helix | trans | -62 | -47 | 176.4 | -156.9 | 74.6 | 0 | 0 | 0 | 110.8 | L87 R88 P188 S189 E190 L196 Q197 | L87-L193 HydrophobicContact CB-CD1 3.48Å; L87-L193 VanDerWaalsContact CB-CD1 3.48Å; L87-L193 HydrophobicContact CB-CG 4.22Å; L87-L193 HydrophobicContact CD1-CD1 4.12Å; L87-L193 HydrophobicContact CD1-CG 4.2Å; L87-L193 HydrophobicContact CG-CD1 4.46Å; R88-L193 HydrophobicContact CG-CD1 4.13Å; R88-L193 HydrophobicContact CG-CD2 3.71Å; P188-L193 HydrophobicContact CG-CD1 4.45Å; S189-L193 PolarHBondContact O-N 3.27Å; S189-L193 VanDerWaalsContact O-N 3.16Å; E190-L193 WeakPolarHBondContact O-CB 3.43Å; E190-L193 PolarHBondContact O-N 3.49Å; L193-L196 PolarHBondContact O-N 3.42Å; L193-Q197 WeakPolarHBondContact O-CB 3.43Å; L193-Q197 PolarHBondContact O-N 3.25Å |
| 194 | Q | 71.1 | Confident | 70.1 | Confident | 97 Ų | 97 | 101.9 Ų | 101.9 | 45% | 0.453 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.8 | -47.1 | 175.8 | -177 | 172.3 | -7.5 | 0 | 0 | 112 | E190 L196 Q197 E198 | E190-Q194 WeakPolarHBondContact O-CB 3.26Å; E190-Q194 PolarHBondContact O-N 3.35Å; Q194-L196 PolarHBondContact O-N 2.89Å; Q194-Q197 PolarHBondContact O-N 2.91Å; Q194-Q197 VanDerWaalsContact O-N 3.12Å; Q194-E198 HydrophobicContact CG-CG 4.44Å; Q194-E198 VanDerWaalsContact CG-OE1 3.23Å; Q194-E198 WeakPolarHBondContact CG-OE1 3.44Å; Q194-E198 PolarHBondContact NE2-OE1 3.34Å; Q194-E198 WeakPolarHBondContact O-CB 3.36Å; Q194-E198 WeakPolarHBondContact O-CG 3.48Å; Q194-E198 PolarHBondContact O-N 2.99Å |
| 195 | A | 70.9 | Confident | 69.4 | Low | 62 Ų | 62 | 95.8 Ų | 95.8 | 51% | 0.512 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -61.1 | -32 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | R191 R192 G199 | R191-A195 WeakPolarHBondContact O-CB 3.43Å; R191-A195 PolarHBondContact O-N 3.33Å; R191-A195 VanDerWaalsContact O-N 3.09Å; R192-A195 PolarHBondContact O-N 3.48Å; A195-G199 PolarHBondContact O-N 2.96Å |
| 196 | L | 69.6 | Low | 68.6 | Low | 103 Ų | 103 | 86.6 Ų | 86.6 | 54% | 0.539 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -75 | -37.2 | 174.8 | -169 | 68.9 | 0 | 0 | 0 | 111.9 | L87 R192 L193 Q194 G199 C202 | L87-L196 HydrophobicContact CD1-CB 4.33Å; L87-L196 HydrophobicContact CD1-CD2 4.21Å; L87-L196 HydrophobicContact CD1-CG 4.4Å; L87-L196 HydrophobicContact CD2-CD2 3.9Å; L87-L196 HydrophobicContact CD2-CG 4.49Å; R192-L196 WeakPolarHBondContact O-CB 3.39Å; R192-L196 PolarHBondContact O-N 3.31Å; L193-L196 PolarHBondContact O-N 3.42Å; Q194-L196 PolarHBondContact O-N 2.89Å; L196-G199 PolarHBondContact O-N 3.34Å; L196-C202 PolarHBondContact O-SG 3.29Å |
| 197 | Q | 71.9 | Confident | 67.7 | Low | 73 Ų | 73 | 85 Ų | 85 | 34% | 0.341 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -68 | -37.1 | 175.5 | -176.5 | 176.7 | -21.7 | 0 | 0 | 112.4 | L87 L193 Q194 G199 C202 | L87-Q197 HydrophobicContact CD1-CB 4.06Å; L193-Q197 WeakPolarHBondContact O-CB 3.43Å; L193-Q197 PolarHBondContact O-N 3.25Å; Q194-Q197 PolarHBondContact O-N 2.91Å; Q194-Q197 VanDerWaalsContact O-N 3.12Å; Q197-G199 PolarHBondContact O-N 2.85Å; Q197-C202 VanDerWaalsContact O-CB 3.3Å; Q197-C202 WeakPolarHBondContact O-CB 3.41Å |
| 198 | E | 69.3 | Low | 66.9 | Low | 139 Ų | 139 | 83.8 Ų | 83.8 | 65% | 0.65 | 47% | 0.473 | S | S | * | . | S | Bend | trans | -73.9 | -10.8 | 171.8 | -69.4 | 172.2 | -168.2 | 0 | 0 | 112.6 | Q194 | Q194-E198 HydrophobicContact CG-CG 4.44Å; Q194-E198 VanDerWaalsContact CG-OE1 3.23Å; Q194-E198 WeakPolarHBondContact CG-OE1 3.44Å; Q194-E198 PolarHBondContact NE2-OE1 3.34Å; Q194-E198 WeakPolarHBondContact O-CB 3.36Å; Q194-E198 WeakPolarHBondContact O-CG 3.48Å; Q194-E198 PolarHBondContact O-N 2.99Å |
| 199 | G | 70.9 | Confident | 65.9 | Low | 25 Ų | 25 | 92.3 Ų | 92.3 | 26% | 0.258 | 50% | 0.501 | S | S | . | . | S | Bend | trans | -68.3 | 146.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | A195 L196 Q197 L201 C202 G203 | A195-G199 PolarHBondContact O-N 2.96Å; L196-G199 PolarHBondContact O-N 3.34Å; Q197-G199 PolarHBondContact O-N 2.85Å; G199-L201 PolarHBondContact O-N 3.02Å; G199-L201 VanDerWaalsContact O-N 3.08Å; G199-C202 PolarHBondContact O-N 3.41Å; G199-G203 PolarHBondContact O-N 3.39Å |
| 200 | V | 59.3 | Low | 65.2 | Low | 124 Ų | 124 | 92 Ų | 92 | 75% | 0.752 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -54.1 | -34.1 | -176.1 | -178 | 0 | 0 | 0 | 0 | 113 | G203 T204 | V200-G203 PolarHBondContact O-N 2.9Å; V200-T204 HydrophobicContact CG1-CG2 4.28Å; V200-T204 WeakPolarHBondContact O-CG2 3.47Å; V200-T204 PolarHBondContact O-N 3.06Å; V200-T204 PolarHBondContact O-OG1 3.37Å; V200-T204 VanDerWaalsContact O-OG1 3.04Å |
| 201 | L | 62.5 | Low | 64.5 | Low | 138 Ų | 138 | 89.7 Ų | 89.7 | 72% | 0.723 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -62.5 | -45.9 | 175.3 | -84.3 | 155.6 | 0 | 0 | 0 | 112.6 | G199 T204 L205 | G199-L201 PolarHBondContact O-N 3.02Å; G199-L201 VanDerWaalsContact O-N 3.08Å; L201-T204 PolarHBondContact O-OG1 3.21Å; L201-T204 VanDerWaalsContact O-OG1 3.09Å; L201-L205 VanDerWaalsContact O-CB 3.27Å; L201-L205 WeakPolarHBondContact O-CB 3.26Å; L201-L205 WeakPolarHBondContact O-CD1 3.4Å; L201-L205 WeakPolarHBondContact O-CG 3.49Å; L201-L205 PolarHBondContact O-N 3.27Å; L201-L205 VanDerWaalsContact O-N 3.1Å |
| 202 | C | 63.1 | Low | 64.6 | Low | 13 Ų | 13 | 87.2 Ų | 87.2 | 9% | 0.088 | 48% | 0.478 | C | S | . | . | H | α-helix | trans | -70.2 | -37.4 | 175.1 | -71.7 | 0 | 0 | 0 | 0 | 111.2 | L196 Q197 G199 L205 A206 L213 | L196-C202 PolarHBondContact O-SG 3.29Å; Q197-C202 VanDerWaalsContact O-CB 3.3Å; Q197-C202 WeakPolarHBondContact O-CB 3.41Å; G199-C202 PolarHBondContact O-N 3.41Å; C202-L205 PolarHBondContact O-N 3.42Å; C202-A206 VanDerWaalsContact O-CB 3.24Å; C202-A206 WeakPolarHBondContact O-CB 3.46Å; C202-A206 PolarHBondContact O-N 2.82Å; C202-L213 HydrophobicContact CB-CD1 3.96Å; C202-L213 WeakPolarHBondContact O-CD1 3.49Å |
| 203 | G | 63.3 | Low | 64.4 | Low | 50 Ų | 50 | 79.7 Ų | 79.7 | 52% | 0.515 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -60.9 | -43.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | G199 V200 | G199-G203 PolarHBondContact O-N 3.39Å; V200-G203 PolarHBondContact O-N 2.9Å |
| 204 | T | 61.5 | Low | 64.2 | Low | 82 Ų | 82 | 81.1 Ų | 81.1 | 50% | 0.503 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -70.4 | -44.7 | 176.4 | 51.9 | 0 | 0 | 0 | 0 | 111.7 | V200 L201 A206 G207 C208 | V200-T204 HydrophobicContact CG1-CG2 4.28Å; V200-T204 WeakPolarHBondContact O-CG2 3.47Å; V200-T204 PolarHBondContact O-N 3.06Å; V200-T204 PolarHBondContact O-OG1 3.37Å; V200-T204 VanDerWaalsContact O-OG1 3.04Å; L201-T204 PolarHBondContact O-OG1 3.21Å; L201-T204 VanDerWaalsContact O-OG1 3.09Å; T204-A206 VanDerWaalsContact C-N 3.28Å; T204-A206 PolarHBondContact O-N 3.16Å; T204-G207 PolarHBondContact O-N 3.26Å; T204-G207 VanDerWaalsContact O-N 3.11Å; T204-C208 PolarHBondContact O-SG 3.4Å; T204-C208 VanDerWaalsContact O-SG 3.36Å |
| 205 | L | 62.2 | Low | 63.8 | Low | 59 Ų | 59 | 79 Ų | 79 | 31% | 0.309 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -62.4 | -31.9 | 177 | -74.4 | 169.3 | 0 | 0 | 0 | 113 | L16 L201 C202 G207 C208 L213 | L16-L205 HydrophobicContact CD1-CB 3.79Å; L16-L205 HydrophobicContact CD1-CD2 4.15Å; L16-L205 HydrophobicContact CD1-CG 4.44Å; L16-L205 HydrophobicContact CD2-CD1 4.37Å; L201-L205 VanDerWaalsContact O-CB 3.27Å; L201-L205 WeakPolarHBondContact O-CB 3.26Å; L201-L205 WeakPolarHBondContact O-CD1 3.4Å; L201-L205 WeakPolarHBondContact O-CG 3.49Å; L201-L205 PolarHBondContact O-N 3.27Å; L201-L205 VanDerWaalsContact O-N 3.1Å; C202-L205 PolarHBondContact O-N 3.42Å; L205-G207 PolarHBondContact O-N 3.19Å; L205-C208 PolarHBondContact O-N 2.95Å; L205-L213 HydrophobicContact CB-CD1 3.82Å |
| 206 | A | 58.9 | Low | 62.9 | Low | 62 Ų | 62 | 76.6 Ų | 76.6 | 51% | 0.512 | 43% | 0.434 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.4 | -19.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | C202 T204 L213 | C202-A206 VanDerWaalsContact O-CB 3.24Å; C202-A206 WeakPolarHBondContact O-CB 3.46Å; C202-A206 PolarHBondContact O-N 2.82Å; T204-A206 VanDerWaalsContact C-N 3.28Å; T204-A206 PolarHBondContact O-N 3.16Å; A206-L213 HydrophobicContact CB-CD1 4.05Å |
| 207 | G | 56.2 | Low | 62 | Low | 66 Ų | 66 | 75.2 Ų | 75.2 | 68% | 0.68 | 43% | 0.431 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.3 | -9.5 | 173.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | T204 L205 W209 | T204-G207 PolarHBondContact O-N 3.26Å; T204-G207 VanDerWaalsContact O-N 3.11Å; L205-G207 PolarHBondContact O-N 3.19Å; G207-W209 PolarHBondContact O-N 2.7Å |
| 208 | C | 60.9 | Low | 60.8 | Low | 63 Ų | 63 | 75.2 Ų | 75.2 | 43% | 0.426 | 45% | 0.451 | S | S | . | . | S | Bend | trans | -87.5 | 82.4 | -172.5 | -68.3 | 0 | 0 | 0 | 0 | 113 | T204 L205 L211 | T204-C208 PolarHBondContact O-SG 3.4Å; T204-C208 VanDerWaalsContact O-SG 3.36Å; L205-C208 PolarHBondContact O-N 2.95Å; C208-L211 WeakPolarHBondContact O-CB 3.27Å; C208-L211 PolarHBondContact O-N 2.88Å |
| 209 | W | 50.8 | Low | 59.8 | Low | 209 Ų | 209 | 69.6 Ų | 69.6 | 79% | 0.792 | 43% | 0.427 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.9 | 134.6 | 170 | -156.1 | 84 | 0 | 0 | 0 | 111 | G207 | G207-W209 PolarHBondContact O-N 2.7Š|
| 210 | P | 60.1 | Low | 58.6 | Low | 57 Ų | 57 | 75 Ų | 75 | 37% | 0.37 | 45% | 0.449 | S | S | . | . | T | Hydrogen-bonded Turn | cis | -96 | 8.2 | 10.9 | 39.2 | -37.7 | 0 | 0 | 0 | 115.3 | L14 | L14-P210 HydrophobicContact CD1-CG 4.46Å; L14-P210 PolarHBondContact N-O 3.28Å |
| 211 | L | 60.4 | Low | 57.8 | Low | 44 Ų | 44 | 73.3 Ų | 73.3 | 23% | 0.23 | 45% | 0.448 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.2 | 139 | -177.2 | -58.4 | 172.2 | 0 | 0 | 0 | 110.4 | L14 L16 S19 V20 C208 | L14-L211 HydrophobicContact CB-CD2 4.44Å; L14-L211 WeakPolarHBondContact O-CA 3.5Å; L16-L211 HydrophobicContact CB-CB 4.26Å; L16-L211 HydrophobicContact CD1-CB 3.75Å; L16-L211 HydrophobicContact CD1-CD1 4.4Å; L16-L211 HydrophobicContact CG-CB 4Å; L16-L211 HydrophobicContact CG-CD1 4.32Å; S19-L211 VanDerWaalsContact CB-CD2 3.42Å; V20-L211 HydrophobicContact CG2-CD1 4.25Å; C208-L211 WeakPolarHBondContact O-CB 3.27Å; C208-L211 PolarHBondContact O-N 2.88Å |
| 212 | R | 70.1 | Confident | 56.8 | Low | 164 Ų | 164 | 73.1 Ų | 73.1 | 62% | 0.619 | 44% | 0.444 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -129.2 | 129.5 | 175.8 | -161.8 | 172.9 | -171.6 | -171.3 | -0 | 110.9 | A13 L14 L16 L214 | A13-R212 HydrophobicContact CB-CB 3.91Å; L14-R212 PolarHBondContact O-N 2.96Å; L16-R212 WeakPolarHBondContact CB-O 3.36Å; L16-R212 PolarHBondContact N-O 3.33Å; L16-R212 VanDerWaalsContact N-O 3.16Å; R212-L214 HydrophobicContact CB-CD1 4.37Å; R212-L214 VanDerWaalsContact O-CD1 3.27Å; R212-L214 WeakPolarHBondContact O-CD1 3.41Å; R212-L214 PolarHBondContact O-N 3.43Å |
| 213 | L | 68.4 | Low | 55.5 | Low | 33 Ų | 33 | 78.2 Ų | 78.2 | 17% | 0.173 | 47% | 0.47 | C | S | . | . | P | Polyproline II helix | trans | -70.1 | 121.7 | 165.4 | -86.7 | 150.7 | 0 | 0 | 0 | 108.6 | L16 T86 C202 L205 A206 | L16-L213 HydrophobicContact CD1-CG 4.19Å; T86-L213 HydrophobicContact CG2-CD2 3.65Å; C202-L213 HydrophobicContact CB-CD1 3.96Å; C202-L213 WeakPolarHBondContact O-CD1 3.49Å; L205-L213 HydrophobicContact CB-CD1 3.82Å; A206-L213 HydrophobicContact CB-CD1 4.05Å |
| 214 | L | 66.1 | Low | 54.3 | Low | 40 Ų | 40 | 81.2 Ų | 81.2 | 21% | 0.209 | 48% | 0.48 | C | S | . | . | P | Polyproline II helix | trans | -92.5 | 120.2 | 172.7 | -83.3 | 70 | 0 | 0 | 0 | 108.5 | P15 C82 G85 T86 R212 | P15-L214 HydrophobicContact CB-CD1 3.83Å; C82-L214 HydrophobicContact CB-CD2 4.07Å; C82-L214 WeakPolarHBondContact SG-CD2 3.49Å; G85-L214 WeakPolarHBondContact CA-O 3.49Å; T86-L214 PolarHBondContact N-O 3.42Å; T86-L214 PolarHBondContact OG1-N 2.93Å; R212-L214 HydrophobicContact CB-CD1 4.37Å; R212-L214 VanDerWaalsContact O-CD1 3.27Å; R212-L214 WeakPolarHBondContact O-CD1 3.41Å; R212-L214 PolarHBondContact O-N 3.43Å |
| 215 | P | 64.4 | Low | 53.1 | Low | 53 Ų | 53 | 83.3 Ų | 83.3 | 34% | 0.344 | 49% | 0.492 | S | S | . | . | P | Polyproline II helix | trans | -65.2 | 156.9 | 175.8 | 29.5 | -34.5 | 0 | 0 | 0 | 110.5 | ||
| 216 | S | 51.4 | Low | 52 | Low | 11 Ų | 11 | 86.5 Ų | 86.5 | 8% | 0.077 | 51% | 0.514 | C | S | . | . | P | Polyproline II helix | trans | -63.8 | 129.1 | 172.7 | -176.5 | 0 | 0 | 0 | 0 | 109.7 | R88 G218 S219 | R88-S216 WeakPolarHBondContact CD-OG 3.47Å; S216-G218 PolarHBondContact O-N 2.99Å; S216-S219 WeakPolarHBondContact O-CB 3.33Å; S216-S219 PolarHBondContact O-N 3.39Å; S216-S219 PolarHBondContact O-OG 3.45Å |
| 217 | P | 51.1 | Low | 50.8 | Low | 74 Ų | 74 | 91.7 Ų | 91.7 | 48% | 0.481 | 53% | 0.528 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.7 | 122.1 | 176.2 | 24.7 | -31.6 | 0 | 0 | 0 | 109.5 | H83 | H83-P217 WeakPolarHBondContact O-CG 3.36Š|
| 218 | G | 46.4 | Very low | 49.9 | Very low | 73 Ų | 73 | 94.2 Ų | 94.2 | 75% | 0.753 | 53% | 0.532 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 100.6 | -1.6 | -171.9 | 0 | 0 | 0 | 0 | 0 | 115.3 | S216 | S216-G218 PolarHBondContact O-N 2.99Š|
| 219 | S | 48.1 | Very low | 49.1 | Very low | 22 Ų | 22 | 96.6 Ų | 96.6 | 15% | 0.154 | 56% | 0.556 | C | S | . | * | trans | -63.2 | 141.3 | 164.2 | 68.9 | 0 | 0 | 0 | 0 | 110.5 | S216 A221 E222 | S216-S219 WeakPolarHBondContact O-CB 3.33Å; S216-S219 PolarHBondContact O-N 3.39Å; S216-S219 PolarHBondContact O-OG 3.45Å; S219-A221 PolarHBondContact O-N 2.73Å; S219-E222 PolarHBondContact O-N 3.48Å | ||
| 220 | L | 44.6 | Very low | 48.8 | Very low | 138 Ų | 138 | 90 Ų | 90 | 72% | 0.723 | 55% | 0.553 | S | S | * | * | G | 310 helix | trans | -58.4 | -10.6 | -173.1 | -91.5 | 161.6 | 0 | 0 | 0 | 115.4 | E222 L223 | L220-E222 VanDerWaalsContact C-N 3.25Å; L220-E222 PolarHBondContact O-N 3.35Å; L220-L223 HydrophobicContact CD2-CD1 4.02Å |
| 221 | A | 42.6 | Very low | 47.6 | Very low | 89 Ų | 89 | 93.9 Ų | 93.9 | 74% | 0.736 | 58% | 0.575 | S | S | * | * | G | 310 helix | trans | -72.2 | -14.1 | 174.6 | 0 | 0 | 0 | 0 | 0 | 114 | S219 | S219-A221 PolarHBondContact O-N 2.73Š|
| 222 | E | 42.1 | Very low | 46.4 | Very low | 134 Ų | 134 | 102.4 Ų | 102.4 | 63% | 0.626 | 61% | 0.605 | S | S | * | * | G | 310 helix | trans | -110.9 | 30.9 | -177.8 | -146 | 169.2 | -140.4 | 0 | 0 | 113.4 | S219 L220 | S219-E222 PolarHBondContact O-N 3.48Å; L220-E222 VanDerWaalsContact C-N 3.25Å; L220-E222 PolarHBondContact O-N 3.35Å |
| 223 | L | 36.5 | Very low | 44.8 | Very low | 120 Ų | 120 | 99.5 Ų | 99.5 | 63% | 0.628 | 61% | 0.607 | S | S | * | * | S | Bend | trans | -66.6 | 131.5 | 154.6 | -76.4 | 167.4 | 0 | 0 | 0 | 108.3 | L220 V225 | L220-L223 HydrophobicContact CD2-CD1 4.02Å; L223-V225 PolarHBondContact O-N 2.99Å |
| 224 | P | 37 | Very low | 43.2 | Very low | 112 Ų | 112 | 103.7 Ų | 103.7 | 73% | 0.727 | 64% | 0.636 | S | S | * | * | trans | -59.7 | 116.3 | 169.9 | 25.2 | -32.1 | 0 | 0 | 0 | 107.6 | T226 | P224-T226 PolarHBondContact O-N 3.5Š| ||
| 225 | V | 36.5 | Very low | 41.8 | Very low | 127 Ų | 127 | 108.8 Ų | 108.8 | 77% | 0.77 | 66% | 0.662 | S | S | * | * | trans | -58.6 | 103.6 | 175.7 | 177.2 | 0 | 0 | 0 | 0 | 107.1 | L223 H227 | L223-V225 PolarHBondContact O-N 2.99Å; V225-H227 PolarHBondContact O-N 3.31Å | ||
| 226 | T | 38.5 | Very low | 40.5 | Very low | 126 Ų | 126 | 111.9 Ų | 111.9 | 77% | 0.773 | 68% | 0.682 | S | S | * | * | trans | -60.4 | 112.3 | 170.9 | 41.4 | 0 | 0 | 0 | 0 | 106.3 | P224 | P224-T226 PolarHBondContact O-N 3.5Š| ||
| 227 | H | 35.2 | Very low | 39.5 | Very low | 171 Ų | 171 | 114.9 Ų | 114.9 | 79% | 0.792 | 72% | 0.715 | S | S | * | * | trans | -50.2 | 131.3 | 174.6 | -69.5 | -65 | 0 | 0 | 0 | 108.2 | V225 A229 | V225-H227 PolarHBondContact O-N 3.31Å; H227-A229 PolarHBondContact O-N 2.96Å; H227-A229 VanDerWaalsContact O-N 3.09Å | ||
| 228 | P | 37.1 | Very low | 38.3 | Very low | 118 Ų | 118 | 123 Ų | 123 | 77% | 0.766 | 74% | 0.736 | S | S | * | * | trans | -55.9 | 123.5 | -178.8 | 21.6 | -32.4 | 0 | 0 | 0 | 109 | G230 | P228-G230 PolarHBondContact O-N 3.42Š| ||
| 229 | A | 44.3 | Very low | 38 | Very low | 114 Ų | 114 | 124.9 Ų | 124.9 | 94% | 0.942 | 73% | 0.734 | S | S | * | * | S | Bend | trans | -63.4 | 101.5 | -175.4 | 0 | 0 | 0 | 0 | 0 | 109.7 | H227 | H227-A229 PolarHBondContact O-N 2.96Å; H227-A229 VanDerWaalsContact O-N 3.09Å |
| 230 | G | 44.2 | Very low | 37.1 | Very low | 70 Ų | 70 | 134.3 Ų | 134.3 | 72% | 0.722 | 77% | 0.768 | S | S | * | * | trans | -172.5 | -8.6 | -173.1 | 0 | 0 | 0 | 0 | 0 | 118.4 | P228 | P228-G230 PolarHBondContact O-N 3.42Š| ||
| 231 | V | 35.1 | Very low | 36.7 | Very low | 138 Ų | 138 | 134 Ų | 134 | 84% | 0.836 | 77% | 0.772 | S | S | * | * | trans | -127.6 | 98.3 | 178.7 | -172.4 | 0 | 0 | 0 | 0 | 110.9 | P233 | V231-P233 WeakPolarHBondContact O-CD 3.43Š| ||
| 232 | R | 34.9 | Very low | 36 | Very low | 224 Ų | 224 | 134.5 Ų | 134.5 | 85% | 0.845 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -73.6 | 116.6 | 170.3 | 170.3 | -172.7 | -93.4 | 171.2 | -7.5 | 109 | ||
| 233 | P | 35.9 | Very low | 35.4 | Very low | 103 Ų | 103 | 133.2 Ų | 133.2 | 67% | 0.669 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 146 | 165.4 | 28.3 | -30 | 0 | 0 | 0 | 109.8 | V231 | V231-P233 WeakPolarHBondContact O-CD 3.43Š|
| 234 | P | 34.8 | Very low | 35.2 | Very low | 120 Ų | 120 | 133.2 Ų | 133.2 | 78% | 0.779 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 141.9 | -179.7 | 28 | -34.3 | 0 | 0 | 0 | 111 | P236 | P234-P236 VanDerWaalsContact O-CD 3.32Å; P234-P236 WeakPolarHBondContact O-CD 3.46Å |
| 235 | I | 36.8 | Very low | 34.7 | Very low | 147 Ų | 147 | 134.9 Ų | 134.9 | 75% | 0.754 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -76.7 | 126.4 | -177.7 | -62.8 | 161.9 | 0 | 0 | 0 | 110.5 | ||
| 236 | P | 37.3 | Very low | 34.4 | Very low | 119 Ų | 119 | 136.5 Ų | 136.5 | 77% | 0.773 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -95.4 | 135.5 | 152.5 | -0.2 | 22.5 | 0 | 0 | 0 | 109 | P234 | P234-P236 VanDerWaalsContact O-CD 3.32Å; P234-P236 WeakPolarHBondContact O-CD 3.46Å |
| 237 | G | 29.8 | Very low | 33.8 | Very low | 74 Ų | 74 | 142.9 Ų | 142.9 | 76% | 0.763 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -71.1 | 152.7 | -172.2 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||
| 238 | R | 27.3 | Very low | 33.3 | Very low | 245 Ų | 245 | 139.5 Ų | 139.5 | 93% | 0.925 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 153.8 | 151.7 | -94.5 | -178.9 | 176.7 | 172.4 | -0.8 | 108.8 | ||
| 239 | P | 38.9 | Very low | 32.7 | Very low | 111 Ų | 111 | 143.3 Ų | 143.3 | 72% | 0.721 | 81% | 0.808 | S | S | * | * | cis | -144.8 | 150.2 | 43.1 | 38.8 | -19.8 | 0 | 0 | 0 | 117.8 | ||||
| 240 | Y | 29.4 | Very low | 31.7 | Very low | 221 Ų | 221 | 144.5 Ų | 144.5 | 87% | 0.867 | 81% | 0.808 | S | S | * | * | -165.4 | 166.7 | 111.4 | -129.8 | -103.8 | 0 | 0 | 0 | 111.8 | |||||
| 241 | V | 37.1 | Very low | 31 | Very low | 131 Ų | 131 | 150.4 Ų | 150.4 | 79% | 0.794 | 82% | 0.817 | S | S | * | * | trans | -91.5 | 134 | 176.4 | 175.6 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 242 | A | 28.5 | Very low | 30.5 | Very low | 99 Ų | 99 | 147.6 Ų | 147.6 | 82% | 0.818 | 82% | 0.816 | S | S | * | * | trans | -148.8 | 136.8 | 165.1 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 243 | S | 28.9 | Very low | 30.2 | Very low | 107 Ų | 107 | 142.7 Ų | 142.7 | 75% | 0.748 | 82% | 0.816 | S | S | * | * | trans | -79 | 165.5 | -176.8 | -65.9 | 0 | 0 | 0 | 0 | 113 | ||||
| 244 | P | 32.4 | Very low | 29.7 | Very low | 121 Ų | 121 | 142 Ų | 142 | 79% | 0.786 | 82% | 0.818 | S | S | * | * | trans | -92.5 | 109.3 | -176.6 | 34.3 | -29.6 | 0 | 0 | 0 | 112.4 | ||||
| 245 | D | 27 | Very low | 29.4 | Very low | 147 Ų | 147 | 144.4 Ų | 144.4 | 79% | 0.786 | 82% | 0.824 | S | S | * | * | trans | -151.2 | 113.2 | 164.7 | -83.9 | -53.2 | 0 | 0 | 0 | 109.7 | ||||
| 246 | L | 29 | Very low | 28.8 | Very low | 161 Ų | 161 | 143 Ų | 143 | 84% | 0.843 | 83% | 0.827 | S | S | * | * | trans | -157.5 | 37.5 | 171.1 | -150.6 | 104.6 | 0 | 0 | 0 | 115.5 | ||||
| 247 | W | 26.7 | Very low | 28.7 | Very low | 260 Ų | 260 | 143.1 Ų | 143.1 | 99% | 0.985 | 83% | 0.828 | S | S | * | * | trans | -139.7 | 61.2 | 168.9 | -80.2 | 85.3 | 0 | 0 | 0 | 112.2 | ||||
| 248 | S | 24.1 | Very low | 29 | Very low | 100 Ų | 100 | 146 Ų | 146 | 70% | 0.699 | 83% | 0.833 | S | S | * | * | trans | -156.5 | 91.6 | 167.2 | 47.7 | 0 | 0 | 0 | 0 | 113 | ||||
| 249 | H | 24.8 | Very low | 28.9 | Very low | 197 Ų | 197 | 137.6 Ų | 137.6 | 91% | 0.912 | 82% | 0.823 | S | S | * | * | trans | -145.3 | 95.3 | 155.1 | -96.5 | -45.2 | 0 | 0 | 0 | 110.6 | ||||
| 250 | C | 23.8 | Very low | 28.4 | Very low | 139 Ų | 139 | 140.8 Ų | 140.8 | 94% | 0.939 | 83% | 0.833 | S | S | * | * | trans | -165.7 | 72 | 153.3 | -117.4 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 251 | E | 28.9 | Very low | 28.2 | Very low | 194 Ų | 194 | 141.5 Ų | 141.5 | 91% | 0.907 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -99.2 | 123.7 | 168.5 | -73.6 | -170.7 | 131.4 | 0 | 0 | 110 | ||
| 252 | G | 24.6 | Very low | 28.3 | Very low | 80 Ų | 80 | 140.4 Ų | 140.4 | 83% | 0.825 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -101.1 | 122.8 | 159.7 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||
| 253 | S | 28.2 | Very low | 28.2 | Very low | 121 Ų | 121 | 141.9 Ų | 141.9 | 85% | 0.846 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -69.8 | 146.3 | -164.9 | -41.3 | 0 | 0 | 0 | 0 | 115.4 | ||
| 254 | A | 25.9 | Very low | 28.4 | Very low | 87 Ų | 87 | 145 Ų | 145 | 72% | 0.719 | 83% | 0.831 | S | S | * | * | -177.1 | 123.2 | 118.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 255 | L | 28.7 | Very low | 28.4 | Very low | 171 Ų | 171 | 145 Ų | 145 | 90% | 0.895 | 83% | 0.831 | S | S | * | * | trans | 39.8 | 118.4 | 151.5 | -69.7 | 86.8 | 0 | 0 | 0 | 121.3 | ||||
| 256 | S | 24.1 | Very low | 28.4 | Very low | 117 Ų | 117 | 143 Ų | 143 | 82% | 0.818 | 83% | 0.825 | S | S | * | * | trans | -78.6 | 161 | 152.1 | -46 | 0 | 0 | 0 | 0 | 112 | ||||
| 257 | P | 34.2 | Very low | 28.3 | Very low | 123 Ų | 123 | 146.8 Ų | 146.8 | 80% | 0.799 | 83% | 0.828 | S | S | * | * | -136.6 | 172.2 | 107.4 | 30.4 | -13.9 | 0 | 0 | 0 | 113.7 | |||||
| 258 | P | 36.2 | Very low | 28.2 | Very low | 133 Ų | 133 | 142.4 Ų | 142.4 | 86% | 0.864 | 82% | 0.818 | S | S | * | * | trans | -106.1 | 162.5 | -156.1 | 39.3 | -35.3 | 0 | 0 | 0 | 115.9 | ||||
| 259 | G | 24.9 | Very low | 28.3 | Very low | 69 Ų | 69 | 140.4 Ų | 140.4 | 71% | 0.711 | 81% | 0.813 | S | S | * | * | trans | 134 | 153.1 | 150.7 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 260 | L | 28.7 | Very low | 28.4 | Very low | 179 Ų | 179 | 136.6 Ų | 136.6 | 94% | 0.937 | 81% | 0.809 | S | S | * | * | trans | 82.3 | 107.7 | 164.1 | -51.7 | 176.9 | 0 | 0 | 0 | 119.1 | ||||
| 261 | R | 25.6 | Very low | 28.6 | Very low | 236 Ų | 236 | 134.7 Ų | 134.7 | 89% | 0.891 | 80% | 0.797 | S | S | * | * | trans | -52.5 | 165.7 | 138.9 | -119.2 | -170.6 | 169.2 | 175.6 | -3.4 | 109.3 | ||||
| 262 | P | 38.3 | Very low | 28.5 | Very low | 108 Ų | 108 | 134.3 Ų | 134.3 | 70% | 0.701 | 80% | 0.795 | S | S | * | * | cis | -148.4 | -161.2 | 26 | 27.7 | 1 | 0 | 0 | 0 | 116.4 | ||||
| 263 | V | 27.3 | Very low | 28.5 | Very low | 130 Ų | 130 | 135.4 Ų | 135.4 | 79% | 0.788 | 80% | 0.797 | S | S | * | * | trans | 103.6 | 120.3 | 149.6 | -173.4 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 264 | Q | 32.6 | Very low | 28.3 | Very low | 171 Ų | 171 | 133.6 Ų | 133.6 | 80% | 0.799 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -83.5 | 156.8 | 161.5 | -59.9 | 163.6 | -64.6 | 0 | 0 | 110.2 | ||
| 265 | P | 32.7 | Very low | 28.4 | Very low | 122 Ų | 122 | 137.4 Ų | 137.4 | 79% | 0.792 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -95.7 | 120.4 | 147.2 | 25 | -11.6 | 0 | 0 | 0 | 110.7 | ||
| 266 | T | 26.8 | Very low | 28.3 | Very low | 106 Ų | 106 | 135.5 Ų | 135.5 | 65% | 0.65 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 151.3 | 161.1 | 28 | 0 | 0 | 0 | 0 | 111.8 | ||
| 267 | W | 26.5 | Very low | 28.4 | Very low | 240 Ų | 240 | 142.1 Ų | 142.1 | 91% | 0.909 | 79% | 0.79 | S | S | * | * | trans | -144.5 | 83.2 | 159.4 | -116.9 | 99.2 | 0 | 0 | 0 | 109.4 | ||||
| 268 | E | 26.2 | Very low | 28.2 | Very low | 167 Ų | 167 | 141.1 Ų | 141.1 | 78% | 0.78 | 79% | 0.791 | S | S | * | * | trans | -71.2 | 134.7 | 159.6 | -101.4 | 85.9 | -165.8 | 0 | 0 | 109.3 | ||||
| 269 | G | 25.6 | Very low | 28 | Very low | 58 Ų | 58 | 138.6 Ų | 138.6 | 60% | 0.598 | 79% | 0.789 | S | S | * | * | trans | 179.9 | 60.3 | -177 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 270 | S | 26.2 | Very low | 28.3 | Very low | 118 Ų | 118 | 138.2 Ų | 138.2 | 83% | 0.825 | 78% | 0.78 | S | S | * | * | trans | 79.5 | 105.9 | 150.4 | -51.2 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 271 | S | 27.6 | Very low | 28.6 | Very low | 98 Ų | 98 | 136.1 Ų | 136.1 | 69% | 0.685 | 78% | 0.78 | S | S | * | * | 58.5 | 100.8 | 127.9 | -62.5 | 0 | 0 | 0 | 0 | 122.5 | |||||
| 272 | E | 26.7 | Very low | 29.2 | Very low | 186 Ų | 186 | 132 Ų | 132 | 87% | 0.869 | 77% | 0.769 | S | S | * | * | 50.7 | 108 | 107.9 | -62.8 | 168.7 | 124.3 | 0 | 0 | 120 | |||||
| 273 | A | 25.8 | Very low | 29.3 | Very low | 104 Ų | 104 | 131.3 Ų | 131.3 | 86% | 0.86 | 77% | 0.767 | S | S | * | * | trans | -136.7 | 116.1 | 137.3 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 274 | S | 23.6 | Very low | 30 | Very low | 83 Ų | 83 | 131.3 Ų | 131.3 | 58% | 0.58 | 77% | 0.769 | S | S | * | * | trans | -69 | 141.1 | -175.2 | -173.5 | 0 | 0 | 0 | 0 | 112.8 | D276 | S274-D276 PolarHBondContact OG-N 3.03Å; S274-D276 PolarHBondContact OG-OD1 3.49Å; S274-D276 PolarHBondContact OG-OD2 3.43Å | ||
| 275 | L | 27.9 | Very low | 30.7 | Very low | 167 Ų | 167 | 126.8 Ų | 126.8 | 87% | 0.874 | 77% | 0.769 | S | S | * | * | trans | -136 | 98.7 | 147.1 | -92.6 | 172.3 | 0 | 0 | 0 | 108.4 | W277 | L275-W277 PolarHBondContact O-N 2.92Š| ||
| 276 | D | 27.3 | Very low | 31.6 | Very low | 130 Ų | 130 | 124.9 Ų | 124.9 | 70% | 0.695 | 76% | 0.755 | S | S | * | * | trans | -66 | 114.2 | -173.1 | -65.7 | -77.7 | 0 | 0 | 0 | 113.5 | S274 | S274-D276 PolarHBondContact OG-N 3.03Å; S274-D276 PolarHBondContact OG-OD1 3.49Å; S274-D276 PolarHBondContact OG-OD2 3.43Å | ||
| 277 | W | 26.5 | Very low | 33.4 | Very low | 257 Ų | 257 | 122.7 Ų | 122.7 | 97% | 0.973 | 74% | 0.742 | S | S | * | * | trans | -117.5 | 61.9 | 156.2 | -79.7 | 102.6 | 0 | 0 | 0 | 110 | L275 G279 | L275-W277 PolarHBondContact O-N 2.92Å; W277-G279 PolarHBondContact O-N 3.27Å | ||
| 278 | A | 28.5 | Very low | 35 | Very low | 101 Ų | 101 | 119.3 Ų | 119.3 | 84% | 0.835 | 74% | 0.739 | S | S | * | * | trans | -86.1 | 98.1 | 172 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 279 | G | 31.9 | Very low | 36.4 | Very low | 80 Ų | 80 | 120.3 Ų | 120.3 | 83% | 0.825 | 74% | 0.736 | S | S | * | * | trans | -158.1 | 8.4 | -177.2 | 0 | 0 | 0 | 0 | 0 | 116.2 | W277 | W277-G279 PolarHBondContact O-N 3.27Š| ||
| 280 | A | 32.6 | Very low | 38.5 | Very low | 62 Ų | 62 | 119.7 Ų | 119.7 | 51% | 0.512 | 72% | 0.72 | S | S | . | * | trans | -146 | 117.6 | 173.2 | 0 | 0 | 0 | 0 | 0 | 109.8 | F282 | A280-F282 VanDerWaalsContact C-N 3.32Å; A280-F282 HydrophobicContact CB-CD2 4.15Å; A280-F282 HydrophobicContact CB-CE2 3.58Å; A280-F282 HydrophobicContact CB-CZ 3.91Å; A280-F282 WeakPolarHBondContact O-CD2 3.43Å; A280-F282 PolarHBondContact O-N 2.97Å | ||
| 281 | S | 34.4 | Very low | 40.6 | Very low | 135 Ų | 135 | 115.4 Ų | 115.4 | 94% | 0.944 | 69% | 0.692 | S | S | * | * | trans | -77.2 | 76.4 | -176.6 | -51.5 | 0 | 0 | 0 | 0 | 111.2 | S283 | S281-S283 PolarHBondContact O-N 3.37Š| ||
| 282 | F | 38.9 | Very low | 42.9 | Very low | 150 Ų | 150 | 116.3 Ų | 116.3 | 66% | 0.658 | 69% | 0.688 | S | S | * | * | trans | -69.1 | 122.8 | 175.5 | -66.5 | -72.3 | 0 | 0 | 0 | 111 | A280 A291 | A280-F282 VanDerWaalsContact C-N 3.32Å; A280-F282 HydrophobicContact CB-CD2 4.15Å; A280-F282 HydrophobicContact CB-CE2 3.58Å; A280-F282 HydrophobicContact CB-CZ 3.91Å; A280-F282 WeakPolarHBondContact O-CD2 3.43Å; A280-F282 PolarHBondContact O-N 2.97Å; F282-A291 HydrophobicContact CD1-CB 4.45Å; F282-A291 HydrophobicContact CE1-CB 4.24Å | ||
| 283 | S | 39.5 | Very low | 45.5 | Very low | 92 Ų | 92 | 112.3 Ų | 112.3 | 64% | 0.643 | 67% | 0.673 | S | S | * | * | trans | -67.5 | 128.5 | 175.5 | -166.8 | 0 | 0 | 0 | 0 | 110.2 | S281 G285 | S281-S283 PolarHBondContact O-N 3.37Å; S283-G285 PolarHBondContact O-N 3.31Å | ||
| 284 | P | 43 | Very low | 48 | Very low | 131 Ų | 131 | 113.3 Ų | 113.3 | 85% | 0.851 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.6 | 103.6 | -173.5 | 28.2 | -34 | 0 | 0 | 0 | 111.2 | ||
| 285 | G | 46 | Very low | 50.7 | Low | 76 Ų | 76 | 114.3 Ų | 114.3 | 78% | 0.784 | 66% | 0.655 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 157.7 | -24.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | S283 | S283-G285 PolarHBondContact O-N 3.31Š|
| 286 | T | 53.2 | Low | 53.1 | Low | 81 Ų | 81 | 112.8 Ų | 112.8 | 50% | 0.497 | 65% | 0.645 | S | S | . | * | S | Bend | trans | -90.6 | 123.5 | -176.9 | -36.5 | 0 | 0 | 0 | 0 | 110.8 | V290 | T286-V290 HydrophobicContact CG2-CB 3.8Å; T286-V290 HydrophobicContact CG2-CG1 3.62Å |
| 287 | P | 64 | Low | 55.8 | Low | 60 Ų | 60 | 111.9 Ų | 111.9 | 39% | 0.39 | 64% | 0.64 | S | S | . | * | trans | -70.6 | 143.1 | -179.2 | 29.5 | -34.7 | 0 | 0 | 0 | 111.2 | W289 V290 | P287-W289 HydrophobicContact CG-CD2 4.5Å; P287-W289 HydrophobicContact CG-CZ2 3.76Å; P287-W289 PolarHBondContact O-N 2.92Å; P287-V290 HydrophobicContact CG-CG2 3.9Å; P287-V290 PolarHBondContact O-N 3.48Å | ||
| 288 | M | 58.8 | Low | 58.3 | Low | 170 Ų | 170 | 105.3 Ų | 105.3 | 84% | 0.837 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -46.8 | -34 | -169.4 | -173.7 | -172 | -70.2 | 0 | 0 | 115.4 | L292 | M288-L292 PolarHBondContact O-N 2.93Å |
| 289 | W | 55.8 | Low | 60.8 | Low | 188 Ų | 188 | 105.7 Ų | 105.7 | 71% | 0.712 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -71.6 | -30.7 | 179.6 | 54.8 | -93.3 | 0 | 0 | 0 | 113.8 | P287 D293 | P287-W289 HydrophobicContact CG-CD2 4.5Å; P287-W289 HydrophobicContact CG-CZ2 3.76Å; P287-W289 PolarHBondContact O-N 2.92Å; W289-D293 WeakPolarHBondContact O-CB 3.1Å; W289-D293 PolarHBondContact O-N 2.89Å |
| 290 | V | 70 | Confident | 63.1 | Low | 44 Ų | 44 | 103.5 Ų | 103.5 | 27% | 0.267 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -70.4 | -42.3 | 174.6 | 174.6 | 0 | 0 | 0 | 0 | 110.4 | T286 P287 L292 D293 E294 | T286-V290 HydrophobicContact CG2-CB 3.8Å; T286-V290 HydrophobicContact CG2-CG1 3.62Å; P287-V290 HydrophobicContact CG-CG2 3.9Å; P287-V290 PolarHBondContact O-N 3.48Å; V290-L292 VanDerWaalsContact C-N 3.29Å; V290-L292 PolarHBondContact O-N 3.44Å; V290-D293 PolarHBondContact O-N 3.34Å; V290-E294 PolarHBondContact O-N 3.03Å |
| 291 | A | 71.6 | Confident | 65.1 | Low | 28 Ų | 28 | 104.9 Ų | 104.9 | 23% | 0.231 | 58% | 0.58 | C | S | . | * | H | α-helix | trans | -63.1 | -37.6 | 178 | 0 | 0 | 0 | 0 | 0 | 111.9 | F282 Q295 | F282-A291 HydrophobicContact CD1-CB 4.45Å; F282-A291 HydrophobicContact CE1-CB 4.24Å; A291-Q295 WeakPolarHBondContact O-CB 3.45Å; A291-Q295 PolarHBondContact O-N 3Å; A291-Q295 VanDerWaalsContact O-N 3.09Å |
| 292 | L | 75.3 | Confident | 67 | Low | 117 Ų | 117 | 103.8 Ų | 103.8 | 61% | 0.613 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -71.6 | -35.9 | 176.2 | -161.9 | 71.9 | 0 | 0 | 0 | 112.5 | M288 V290 M296 | M288-L292 PolarHBondContact O-N 2.93Å; V290-L292 VanDerWaalsContact C-N 3.29Å; V290-L292 PolarHBondContact O-N 3.44Å; L292-M296 WeakPolarHBondContact O-CB 3.48Å; L292-M296 PolarHBondContact O-N 3.23Å |
| 293 | D | 80.4 | Confident | 68.6 | Low | 102 Ų | 102 | 99.2 Ų | 99.2 | 55% | 0.545 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -68.9 | -44.3 | 176.9 | -165.3 | 53.4 | 0 | 0 | 0 | 111.6 | W289 V290 Q295 M296 L297 | W289-D293 WeakPolarHBondContact O-CB 3.1Å; W289-D293 PolarHBondContact O-N 2.89Å; V290-D293 PolarHBondContact O-N 3.34Å; D293-Q295 PolarHBondContact O-N 3.5Å; D293-M296 PolarHBondContact O-N 3.12Å; D293-L297 WeakPolarHBondContact O-CB 3.38Å; D293-L297 PolarHBondContact O-N 2.87Å |
| 294 | E | 79.2 | Confident | 70 | Confident | 125 Ų | 125 | 99.2 Ų | 99.2 | 58% | 0.584 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -61.3 | -42.5 | 172.2 | -76.2 | -139.2 | 141.2 | 0 | 0 | 112.2 | V290 L297 Q298 | V290-E294 PolarHBondContact O-N 3.03Å; E294-L297 PolarHBondContact O-N 3.31Å; E294-Q298 WeakPolarHBondContact O-CB 3.45Å; E294-Q298 WeakPolarHBondContact O-CG 3.48Å; E294-Q298 PolarHBondContact O-N 2.86Å |
| 295 | Q | 80.3 | Confident | 70.9 | Confident | 104 Ų | 104 | 99.3 Ų | 99.3 | 49% | 0.486 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -63.2 | -43.9 | 177.1 | -171.9 | 178.5 | -21.8 | 0 | 0 | 111.1 | A291 D293 L297 Q298 E299 | A291-Q295 WeakPolarHBondContact O-CB 3.45Å; A291-Q295 PolarHBondContact O-N 3Å; A291-Q295 VanDerWaalsContact O-N 3.09Å; D293-Q295 PolarHBondContact O-N 3.5Å; Q295-L297 VanDerWaalsContact C-N 3.32Å; Q295-L297 PolarHBondContact O-N 3.34Å; Q295-Q298 PolarHBondContact O-N 3.46Å; Q295-E299 WeakPolarHBondContact O-CG 3.47Å; Q295-E299 PolarHBondContact O-N 2.9Å |
| 296 | M | 78.3 | Confident | 71.6 | Confident | 136 Ų | 136 | 102.5 Ų | 102.5 | 67% | 0.67 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -66.4 | -34 | 177.1 | -161.6 | -176.3 | 73 | 0 | 0 | 112.2 | L292 D293 G300 | L292-M296 WeakPolarHBondContact O-CB 3.48Å; L292-M296 PolarHBondContact O-N 3.23Å; D293-M296 PolarHBondContact O-N 3.12Å; M296-G300 PolarHBondContact O-N 2.9Å |
| 297 | L | 83.1 | Confident | 71.6 | Confident | 111 Ų | 111 | 105.9 Ų | 105.9 | 58% | 0.581 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -67.4 | -42.5 | 173.7 | -171.4 | 70.1 | 0 | 0 | 0 | 111.6 | D293 E294 Q295 G300 I301 | D293-L297 WeakPolarHBondContact O-CB 3.38Å; D293-L297 PolarHBondContact O-N 2.87Å; E294-L297 PolarHBondContact O-N 3.31Å; Q295-L297 VanDerWaalsContact C-N 3.32Å; Q295-L297 PolarHBondContact O-N 3.34Å; L297-G300 PolarHBondContact O-N 3.27Å; L297-I301 HydrophobicContact CG-CD1 4.21Å; L297-I301 WeakPolarHBondContact O-CD1 3.32Å; L297-I301 VanDerWaalsContact O-CG1 3.26Å; L297-I301 WeakPolarHBondContact O-CG1 3.42Å; L297-I301 PolarHBondContact O-N 2.89Å |
| 298 | Q | 80.4 | Confident | 70.8 | Confident | 118 Ų | 118 | 104.9 Ų | 104.9 | 55% | 0.551 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -64.1 | -45.1 | 176.1 | -77.4 | -179.7 | -44.7 | 0 | 0 | 112.2 | E294 Q295 G300 I301 Q302 | E294-Q298 WeakPolarHBondContact O-CB 3.45Å; E294-Q298 WeakPolarHBondContact O-CG 3.48Å; E294-Q298 PolarHBondContact O-N 2.86Å; Q295-Q298 PolarHBondContact O-N 3.46Å; Q298-G300 VanDerWaalsContact C-N 3.33Å; Q298-G300 PolarHBondContact O-N 2.93Å; Q298-I301 PolarHBondContact O-N 2.94Å; Q298-Q302 PolarHBondContact O-N 3.41Å |
| 299 | E | 80.4 | Confident | 70 | Confident | 109 Ų | 109 | 102.7 Ų | 102.7 | 51% | 0.509 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -62.7 | -39 | 174.1 | -67.8 | -61.6 | 145.2 | 0 | 0 | 111.5 | Q295 I301 Q302 A303 | Q295-E299 WeakPolarHBondContact O-CG 3.47Å; Q295-E299 PolarHBondContact O-N 2.9Å; E299-I301 PolarHBondContact O-N 3.37Å; E299-Q302 PolarHBondContact O-N 3.37Å; E299-A303 WeakPolarHBondContact O-CB 3.38Å; E299-A303 PolarHBondContact O-N 2.89Å |
| 300 | G | 80.7 | Confident | 69.3 | Low | 34 Ų | 34 | 98.6 Ų | 98.6 | 35% | 0.351 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -63.9 | -36.2 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | M296 L297 Q298 S304 | M296-G300 PolarHBondContact O-N 2.9Å; L297-G300 PolarHBondContact O-N 3.27Å; Q298-G300 VanDerWaalsContact C-N 3.33Å; Q298-G300 PolarHBondContact O-N 2.93Å; G300-S304 WeakPolarHBondContact O-CB 3.47Å; G300-S304 PolarHBondContact O-N 3.49Å; G300-S304 PolarHBondContact O-OG 3.49Å |
| 301 | I | 74.6 | Confident | 67.8 | Low | 92 Ų | 92 | 106 Ų | 106 | 47% | 0.472 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -69.2 | -43.1 | 173.4 | -68.7 | 161.7 | 0 | 0 | 0 | 110.6 | L297 Q298 E299 S304 L305 | L297-I301 HydrophobicContact CG-CD1 4.21Å; L297-I301 WeakPolarHBondContact O-CD1 3.32Å; L297-I301 VanDerWaalsContact O-CG1 3.26Å; L297-I301 WeakPolarHBondContact O-CG1 3.42Å; L297-I301 PolarHBondContact O-N 2.89Å; Q298-I301 PolarHBondContact O-N 2.94Å; E299-I301 PolarHBondContact O-N 3.37Å; I301-S304 PolarHBondContact O-N 3.25Å; I301-L305 HydrophobicContact CG2-CD1 4.03Å; I301-L305 WeakPolarHBondContact O-CG 3.4Å; I301-L305 PolarHBondContact O-N 2.94Å |
| 302 | Q | 74 | Confident | 65.9 | Low | 112 Ų | 112 | 107.5 Ų | 107.5 | 52% | 0.523 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -63.7 | -44.9 | 176 | -73 | -164.2 | 25.2 | 0 | 0 | 112 | Q298 E299 S304 L305 L306 | Q298-Q302 PolarHBondContact O-N 3.41Å; E299-Q302 PolarHBondContact O-N 3.37Å; Q302-S304 VanDerWaalsContact C-N 3.32Å; Q302-S304 PolarHBondContact O-N 3.12Å; Q302-L305 PolarHBondContact O-N 3.3Å; Q302-L305 VanDerWaalsContact O-N 3.11Å; Q302-L306 WeakPolarHBondContact O-CG 3.29Å; Q302-L306 PolarHBondContact O-N 3.38Å |
| 303 | A | 72.1 | Confident | 64.3 | Low | 53 Ų | 53 | 107.8 Ų | 107.8 | 44% | 0.438 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -57.7 | -44.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | E299 L305 L306 D307 | E299-A303 WeakPolarHBondContact O-CB 3.38Å; E299-A303 PolarHBondContact O-N 2.89Å; A303-L305 VanDerWaalsContact C-N 3.26Å; A303-L305 PolarHBondContact O-N 3.35Å; A303-L306 PolarHBondContact O-N 3.08Å; A303-L306 VanDerWaalsContact O-N 3.17Å; A303-D307 PolarHBondContact O-N 2.83Å |
| 304 | S | 68.7 | Low | 62.3 | Low | 93 Ų | 93 | 111.9 Ų | 111.9 | 65% | 0.65 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -65.3 | -25.2 | 177.3 | -57.3 | 0 | 0 | 0 | 0 | 113.9 | G300 I301 Q302 | G300-S304 WeakPolarHBondContact O-CB 3.47Å; G300-S304 PolarHBondContact O-N 3.49Å; G300-S304 PolarHBondContact O-OG 3.49Å; I301-S304 PolarHBondContact O-N 3.25Å; Q302-S304 VanDerWaalsContact C-N 3.32Å; Q302-S304 PolarHBondContact O-N 3.12Å |
| 305 | L | 62 | Low | 59.9 | Low | 132 Ų | 132 | 111.7 Ų | 111.7 | 69% | 0.691 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -82.3 | -30.9 | 174.2 | -73.5 | 166.5 | 0 | 0 | 0 | 112.4 | I301 Q302 A303 G308 | I301-L305 HydrophobicContact CG2-CD1 4.03Å; I301-L305 WeakPolarHBondContact O-CG 3.4Å; I301-L305 PolarHBondContact O-N 2.94Å; Q302-L305 PolarHBondContact O-N 3.3Å; Q302-L305 VanDerWaalsContact O-N 3.11Å; A303-L305 VanDerWaalsContact C-N 3.26Å; A303-L305 PolarHBondContact O-N 3.35Å; L305-G308 PolarHBondContact O-N 3.32Å |
| 306 | L | 61.1 | Low | 57.7 | Low | 144 Ų | 144 | 110.7 Ų | 110.7 | 75% | 0.754 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -77.8 | -26.9 | 176.9 | -69.8 | 170.2 | 0 | 0 | 0 | 113.1 | Q302 A303 G308 | Q302-L306 WeakPolarHBondContact O-CG 3.29Å; Q302-L306 PolarHBondContact O-N 3.38Å; A303-L306 PolarHBondContact O-N 3.08Å; A303-L306 VanDerWaalsContact O-N 3.17Å; L306-G308 PolarHBondContact O-N 3.49Å |
| 307 | D | 53.3 | Low | 55.6 | Low | 151 Ų | 151 | 109.4 Ų | 109.4 | 81% | 0.807 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.3 | 4.6 | 169.1 | -89.5 | -23.7 | 0 | 0 | 0 | 113.5 | A303 | A303-D307 PolarHBondContact O-N 2.83Š|
| 308 | G | 47.4 | Very low | 53 | Low | 40 Ų | 40 | 115.8 Ų | 115.8 | 41% | 0.412 | 68% | 0.676 | S | S | . | * | S | Bend | trans | -67.9 | 134.3 | 165.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | L305 L306 A310 | L305-G308 PolarHBondContact O-N 3.32Å; L306-G308 PolarHBondContact O-N 3.49Å; G308-A310 PolarHBondContact O-N 3.47Å |
| 309 | P | 42 | Very low | 50.8 | Low | 124 Ų | 124 | 117.4 Ų | 117.4 | 81% | 0.805 | 69% | 0.688 | S | S | * | * | P | Polyproline II helix | trans | -62.7 | 122.6 | -173.7 | 24.6 | -34 | 0 | 0 | 0 | 111.7 | Q311 | P309-Q311 PolarHBondContact O-N 2.84Š|
| 310 | A | 40.3 | Very low | 48.3 | Very low | 102 Ų | 102 | 116.8 Ų | 116.8 | 84% | 0.843 | 70% | 0.696 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 121.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111 | G308 G312 | G308-A310 PolarHBondContact O-N 3.47Å; A310-G312 PolarHBondContact O-N 2.57Å |
| 311 | Q | 38.9 | Very low | 46.3 | Very low | 198 Ų | 198 | 125 Ų | 125 | 93% | 0.925 | 72% | 0.721 | S | S | * | * | trans | -71.7 | 99.7 | -179.4 | -71.7 | -174.4 | 0.9 | 0 | 0 | 111.3 | P309 | P309-Q311 PolarHBondContact O-N 2.84Š| ||
| 312 | G | 31.5 | Very low | 44.7 | Very low | 60 Ų | 60 | 125.4 Ų | 125.4 | 62% | 0.619 | 73% | 0.732 | S | S | * | * | trans | -74 | 147.1 | 149.4 | 0 | 0 | 0 | 0 | 0 | 110.2 | A310 | A310-G312 PolarHBondContact O-N 2.57Š| ||
| 313 | P | 42.7 | Very low | 43.4 | Very low | 123 Ų | 123 | 125.3 Ų | 125.3 | 80% | 0.799 | 75% | 0.745 | S | S | * | * | S | Bend | trans | -74.7 | 146.4 | -177.2 | 30.7 | -34.9 | 0 | 0 | 0 | 112.1 | ||
| 314 | Q | 36.8 | Very low | 42.2 | Very low | 188 Ų | 188 | 125.5 Ų | 125.5 | 88% | 0.879 | 74% | 0.74 | S | S | * | * | trans | 71.6 | 86.3 | 171.3 | -53 | -167.8 | 68 | 0 | 0 | 118 | ||||
| 315 | S | 29.9 | Very low | 41.7 | Very low | 121 Ų | 121 | 123.3 Ų | 123.3 | 85% | 0.846 | 73% | 0.725 | S | S | * | * | -170.5 | 146.1 | 119.5 | 33.7 | 0 | 0 | 0 | 0 | 110.3 | |||||
| 316 | A | 33.8 | Very low | 41.8 | Very low | 83 Ų | 83 | 121.7 Ų | 121.7 | 69% | 0.686 | 72% | 0.724 | S | S | * | * | trans | -67.7 | 130.5 | -176.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | W318 | A316-W318 PolarHBondContact O-N 3.41Å; A316-W318 VanDerWaalsContact O-N 3.15Å | ||
| 317 | P | 34.2 | Very low | 42.1 | Very low | 109 Ų | 109 | 120 Ų | 120 | 71% | 0.708 | 72% | 0.716 | S | S | * | * | trans | -69.5 | 113.6 | 176.1 | 27.7 | -32.7 | 0 | 0 | 0 | 109.6 | L319 | P317-L319 VanDerWaalsContact C-N 3.3Å; P317-L319 PolarHBondContact O-N 2.72Å | ||
| 318 | W | 28.6 | Very low | 42.8 | Very low | 246 Ų | 246 | 118 Ų | 118 | 93% | 0.932 | 70% | 0.697 | S | S | * | * | trans | -67.5 | 89.2 | 169.1 | -80.1 | 75.5 | 0 | 0 | 0 | 109.5 | A316 S320 | A316-W318 PolarHBondContact O-N 3.41Å; A316-W318 VanDerWaalsContact O-N 3.15Å; W318-S320 PolarHBondContact O-N 2.92Å | ||
| 319 | L | 33.8 | Very low | 44.1 | Very low | 152 Ų | 152 | 117.6 Ų | 117.6 | 80% | 0.796 | 69% | 0.685 | S | S | * | * | trans | -67.7 | 117.7 | 175 | -76.2 | 167.3 | 0 | 0 | 0 | 110.1 | P317 K321 | P317-L319 VanDerWaalsContact C-N 3.3Å; P317-L319 PolarHBondContact O-N 2.72Å; L319-K321 PolarHBondContact O-N 3.11Å | ||
| 320 | S | 27.4 | Very low | 45.5 | Very low | 96 Ų | 96 | 116.3 Ų | 116.3 | 67% | 0.671 | 67% | 0.668 | S | S | * | * | trans | -53.9 | 124.1 | 177.4 | -58.6 | 0 | 0 | 0 | 0 | 111.6 | W318 S322 | W318-S320 PolarHBondContact O-N 2.92Å; S320-S322 PolarHBondContact O-N 3.47Å | ||
| 321 | K | 38.5 | Very low | 47.2 | Very low | 205 Ų | 205 | 115.8 Ų | 115.8 | 89% | 0.891 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.7 | 17.9 | -173.1 | -64.6 | -175.9 | 173.2 | -176.6 | 0 | 115.9 | L319 | L319-K321 PolarHBondContact O-N 3.11Š|
| 322 | S | 42.2 | Very low | 48.8 | Very low | 101 Ų | 101 | 106.3 Ų | 106.3 | 71% | 0.706 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107.8 | 3.3 | -165.5 | 58.4 | 0 | 0 | 0 | 0 | 115.9 | S320 | S320-S322 PolarHBondContact O-N 3.47Š|
| 323 | S | 46.1 | Very low | 50.8 | Low | 111 Ų | 111 | 107.7 Ų | 107.7 | 78% | 0.776 | 59% | 0.594 | S | S | * | * | trans | -116.3 | 26.8 | -172.1 | -56.6 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 324 | V | 47.6 | Very low | 52.3 | Low | 57 Ų | 57 | 111.4 Ų | 111.4 | 35% | 0.345 | 59% | 0.592 | S | S | . | * | trans | -90.3 | 109.5 | 170.5 | -172.5 | 0 | 0 | 0 | 0 | 108.8 | S326 L329 L346 | V324-S326 PolarHBondContact O-N 2.96Å; V324-L329 HydrophobicContact CG1-CB 4.48Å; V324-L329 HydrophobicContact CG1-CD1 3.98Å; V324-L346 HydrophobicContact CG1-CD2 4.43Å | ||
| 325 | S | 57.7 | Low | 53.6 | Low | 47 Ų | 47 | 107.4 Ų | 107.4 | 33% | 0.329 | 58% | 0.575 | S | S | . | * | trans | -65.6 | 107.5 | 177.8 | 57.6 | 0 | 0 | 0 | 0 | 110.3 | L327 R328 L329 | S325-L327 PolarHBondContact O-N 3.04Å; S325-R328 PolarHBondContact O-N 3.33Å; S325-R328 VanDerWaalsContact OG-CD 3.24Å; S325-R328 WeakPolarHBondContact OG-CD 3.38Å; S325-R328 VanDerWaalsContact OG-CG 3.29Å; S325-R328 WeakPolarHBondContact OG-CG 3.46Å; S325-L329 PolarHBondContact O-N 2.95Å | ||
| 326 | S | 64.2 | Low | 55.5 | Low | 97 Ų | 97 | 104.8 Ų | 104.8 | 68% | 0.678 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -49.3 | -36.8 | -175.9 | 53 | 0 | 0 | 0 | 0 | 113.8 | V324 R328 L329 Q330 | V324-S326 PolarHBondContact O-N 2.96Å; S326-R328 VanDerWaalsContact C-N 3.34Å; S326-R328 PolarHBondContact O-N 3.29Å; S326-L329 PolarHBondContact O-N 2.99Å; S326-Q330 WeakPolarHBondContact O-CB 3.29Å; S326-Q330 PolarHBondContact O-N 2.98Å |
| 327 | L | 68.1 | Low | 57.4 | Low | 110 Ų | 110 | 103.2 Ų | 103.2 | 58% | 0.576 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -61 | -37 | 178.2 | -171.9 | 147.7 | 0 | 0 | 0 | 113.5 | S325 Q331 | S325-L327 PolarHBondContact O-N 3.04Å; L327-Q331 WeakPolarHBondContact O-CG 3.08Å; L327-Q331 PolarHBondContact O-N 3.01Å; L327-Q331 VanDerWaalsContact O-N 3.11Å |
| 328 | R | 67.9 | Low | 59.4 | Low | 109 Ų | 109 | 101.3 Ų | 101.3 | 41% | 0.411 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -77.8 | -33.8 | 179.5 | -64.4 | -175.1 | -172.3 | 162.3 | 1.2 | 112.2 | S325 S326 Q331 L332 L346 G350 V352 | S325-R328 PolarHBondContact O-N 3.33Å; S325-R328 VanDerWaalsContact OG-CD 3.24Å; S325-R328 WeakPolarHBondContact OG-CD 3.38Å; S325-R328 VanDerWaalsContact OG-CG 3.29Å; S325-R328 WeakPolarHBondContact OG-CG 3.46Å; S326-R328 VanDerWaalsContact C-N 3.34Å; S326-R328 PolarHBondContact O-N 3.29Å; R328-Q331 PolarHBondContact O-N 2.95Å; R328-L332 PolarHBondContact O-N 3.42Å; R328-L346 HydrophobicContact CB-CD1 3.74Å; R328-G350 PolarHBondContact NH1-O 2.89Å; R328-V352 HydrophobicContact CB-CG2 3.78Å; R328-V352 HydrophobicContact CG-CG2 3.75Å |
| 329 | L | 73.8 | Confident | 61.4 | Low | 31 Ų | 31 | 92.2 Ų | 92.2 | 16% | 0.162 | 50% | 0.504 | C | S | . | . | H | α-helix | trans | -65.4 | -46 | 172 | -164.4 | 166.3 | 0 | 0 | 0 | 109.8 | V324 S325 S326 Q331 L332 E333 V343 | V324-L329 HydrophobicContact CG1-CB 4.48Å; V324-L329 HydrophobicContact CG1-CD1 3.98Å; S325-L329 PolarHBondContact O-N 2.95Å; S326-L329 PolarHBondContact O-N 2.99Å; L329-Q331 PolarHBondContact O-N 3.49Å; L329-L332 WeakPolarHBondContact O-CB 3.28Å; L329-L332 PolarHBondContact O-N 3.13Å; L329-E333 HydrophobicContact CD2-CG 3.91Å; L329-E333 WeakPolarHBondContact CD2-OE1 3.33Å; L329-E333 PolarHBondContact O-N 3.27Å; L329-V343 HydrophobicContact CD1-CG2 3.52Å; L329-V343 HydrophobicContact CG-CG2 4.36Å |
| 330 | Q | 72 | Confident | 63.3 | Low | 96 Ų | 96 | 91.4 Ų | 91.4 | 45% | 0.449 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.2 | -26.9 | 175.4 | -165.9 | 178.2 | 25.8 | 0 | 0 | 113.5 | S326 R334 | S326-Q330 WeakPolarHBondContact O-CB 3.29Å; S326-Q330 PolarHBondContact O-N 2.98Å; Q330-R334 WeakPolarHBondContact O-CG 3.17Å; Q330-R334 PolarHBondContact O-N 3.16Å; Q330-R334 VanDerWaalsContact O-N 3.17Å |
| 331 | Q | 76.1 | Confident | 65.3 | Low | 91 Ų | 91 | 89.4 Ų | 89.4 | 43% | 0.425 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -70.7 | -40.2 | 171 | -78.6 | 171.6 | -30.9 | 0 | 0 | 112.2 | L327 R328 L329 R334 M335 | L327-Q331 WeakPolarHBondContact O-CG 3.08Å; L327-Q331 PolarHBondContact O-N 3.01Å; L327-Q331 VanDerWaalsContact O-N 3.11Å; R328-Q331 PolarHBondContact O-N 2.95Å; L329-Q331 PolarHBondContact O-N 3.49Å; Q331-R334 PolarHBondContact O-N 3.06Å; Q331-M335 PolarHBondContact O-N 2.88Å |
| 332 | L | 70.9 | Confident | 66.9 | Low | 0 Ų | 0 | 79.6 Ų | 79.6 | 0% | 0 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -67.7 | -40.5 | 174.9 | -68 | 175.6 | 0 | 0 | 0 | 111.9 | R328 L329 R334 M335 G336 F337 A342 L346 V352 A355 V356 L359 | R328-L332 PolarHBondContact O-N 3.42Å; L329-L332 WeakPolarHBondContact O-CB 3.28Å; L329-L332 PolarHBondContact O-N 3.13Å; L332-R334 PolarHBondContact O-N 3.39Å; L332-M335 HydrophobicContact CD2-CE 3.77Å; L332-M335 CarbonylContact O-C 3.58Å; L332-M335 PolarHBondContact O-N 2.93Å; L332-M335 VanDerWaalsContact O-N 3.07Å; L332-G336 PolarHBondContact O-N 2.88Å; L332-F337 HydrophobicContact CD2-CD2 4.32Å; L332-F337 PolarHBondContact O-N 3.49Å; L332-A342 HydrophobicContact CB-CB 3.97Å; L332-A342 HydrophobicContact CD1-CB 3.73Å; L332-A342 HydrophobicContact CG-CB 4.5Å; L332-L346 HydrophobicContact CD1-CB 4.45Å; L332-L346 HydrophobicContact CD1-CD1 3.82Å; L332-V352 HydrophobicContact CD2-CG1 3.92Å; L332-V352 HydrophobicContact CG-CG1 4.27Å; L332-A355 HydrophobicContact CD1-CB 4.02Å; L332-V356 HydrophobicContact CD2-CG2 3.46Å; L332-V356 VanDerWaalsContact CD2-CG2 3.46Å; L332-L359 HydrophobicContact CD1-CD1 4.39Å; L332-L359 HydrophobicContact CD2-CD1 4.28Å |
| 333 | E | 74.9 | Confident | 68.3 | Low | 88 Ų | 88 | 77.3 Ų | 77.3 | 41% | 0.411 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -57.2 | -45.6 | 172.6 | -73.9 | 172.8 | 172.1 | 0 | 0 | 111.9 | L329 M335 G336 T339 | L329-E333 HydrophobicContact CD2-CG 3.91Å; L329-E333 WeakPolarHBondContact CD2-OE1 3.33Å; L329-E333 PolarHBondContact O-N 3.27Å; E333-M335 PolarHBondContact O-N 3.3Å; E333-G336 PolarHBondContact O-N 3.43Å; E333-T339 HydrophobicContact CG-CG2 3.99Å; E333-T339 WeakPolarHBondContact OE1-CG2 3.46Å |
| 334 | R | 73.3 | Confident | 69.5 | Low | 202 Ų | 202 | 73.7 Ų | 73.7 | 76% | 0.762 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -65.5 | -19.2 | 176.7 | -76.6 | -174.9 | -168.4 | -178.2 | 6.7 | 113.9 | Q330 Q331 L332 G336 | Q330-R334 WeakPolarHBondContact O-CG 3.17Å; Q330-R334 PolarHBondContact O-N 3.16Å; Q330-R334 VanDerWaalsContact O-N 3.17Å; Q331-R334 PolarHBondContact O-N 3.06Å; L332-R334 PolarHBondContact O-N 3.39Å; R334-G336 VanDerWaalsContact C-N 3.32Å |
| 335 | M | 64.8 | Low | 70.6 | Confident | 103 Ų | 103 | 71 Ų | 71 | 51% | 0.507 | 37% | 0.372 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90.3 | 4.5 | 171.9 | -67.3 | -172.6 | -66.2 | 0 | 0 | 112.8 | Q331 L332 E333 F337 V352 V356 | Q331-M335 PolarHBondContact O-N 2.88Å; L332-M335 HydrophobicContact CD2-CE 3.77Å; L332-M335 CarbonylContact O-C 3.58Å; L332-M335 PolarHBondContact O-N 2.93Å; L332-M335 VanDerWaalsContact O-N 3.07Å; E333-M335 PolarHBondContact O-N 3.3Å; M335-F337 HydrophobicContact CB-CD2 3.85Å; M335-F337 HydrophobicContact CB-CE2 3.81Å; M335-V352 HydrophobicContact CE-CG1 4.35Å; M335-V356 HydrophobicContact CE-CG2 3.61Å |
| 336 | G | 70.6 | Confident | 71.3 | Confident | 67 Ų | 67 | 69.3 Ų | 69.3 | 69% | 0.691 | 36% | 0.359 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 86.9 | 10.3 | 173.1 | 0 | 0 | 0 | 0 | 0 | 115.3 | L332 E333 R334 | L332-G336 PolarHBondContact O-N 2.88Å; E333-G336 PolarHBondContact O-N 3.43Å; R334-G336 VanDerWaalsContact C-N 3.32Å |
| 337 | F | 72.3 | Confident | 71.7 | Confident | 49 Ų | 49 | 68.4 Ų | 68.4 | 22% | 0.215 | 36% | 0.358 | C | S | . | . | trans | -83.1 | 140.9 | 179.1 | -64 | -73.5 | 0 | 0 | 0 | 112.1 | L332 M335 V356 L359 V360 | L332-F337 HydrophobicContact CD2-CD2 4.32Å; L332-F337 PolarHBondContact O-N 3.49Å; M335-F337 HydrophobicContact CB-CD2 3.85Å; M335-F337 HydrophobicContact CB-CE2 3.81Å; F337-V356 HydrophobicContact CE2-CG1 4.44Å; F337-V356 HydrophobicContact CE2-CG2 4.35Å; F337-V356 HydrophobicContact CZ-CG1 4.38Å; F337-L359 HydrophobicContact CB-CD1 4.04Å; F337-L359 HydrophobicContact CD1-CB 3.82Å; F337-L359 HydrophobicContact CD1-CD1 4.01Å; F337-L359 HydrophobicContact CD1-CG 4.38Å; F337-L359 HydrophobicContact CD2-CD1 4.31Å; F337-L359 HydrophobicContact CE1-CB 3.83Å; F337-L359 HydrophobicContact CG-CB 4.5Å; F337-L359 HydrophobicContact CG-CD1 3.86Å; F337-V360 HydrophobicContact CE1-CG2 4.15Å; F337-V360 HydrophobicContact CZ-CG2 3.84Å | ||
| 338 | P | 76.8 | Confident | 71.8 | Confident | 69 Ų | 69 | 66.1 Ų | 66.1 | 45% | 0.448 | 36% | 0.355 | S | S | . | . | trans | -68.1 | 138.2 | 179.1 | 27.6 | -33.6 | 0 | 0 | 0 | 111.6 | E340 Q341 A342 | P338-E340 PolarHBondContact O-N 3Å; P338-Q341 HydrophobicContact CG-CB 4.17Å; P338-Q341 HydrophobicContact CG-CG 4.11Å; P338-Q341 VanDerWaalsContact CG-OE1 3.27Å; P338-Q341 PolarHBondContact O-N 3.42Å; P338-A342 WeakPolarHBondContact O-CB 3.39Å; P338-A342 PolarHBondContact O-N 2.95Å | ||
| 339 | T | 71.1 | Confident | 71.8 | Confident | 55 Ų | 55 | 63.3 Ų | 63.3 | 34% | 0.337 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -54.1 | -45.8 | -172 | 51.2 | 0 | 0 | 0 | 0 | 113.4 | E333 Q341 A342 V343 | E333-T339 HydrophobicContact CG-CG2 3.99Å; E333-T339 WeakPolarHBondContact OE1-CG2 3.46Å; T339-Q341 PolarHBondContact O-N 3.39Å; T339-A342 PolarHBondContact O-N 3.24Å; T339-V343 WeakPolarHBondContact O-CG2 3.22Å; T339-V343 PolarHBondContact O-N 3.48Å |
| 340 | E | 72.9 | Confident | 71.5 | Confident | 135 Ų | 135 | 63.6 Ų | 63.6 | 63% | 0.631 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -63.1 | -44.4 | -176.1 | -54.3 | -46.8 | 124.3 | 0 | 0 | 112.1 | P338 V344 | P338-E340 PolarHBondContact O-N 3Å; E340-V344 WeakPolarHBondContact O-CG2 3.5Å; E340-V344 PolarHBondContact O-N 3.44Å |
| 341 | Q | 69.9 | Low | 71.5 | Confident | 54 Ų | 54 | 67.8 Ų | 67.8 | 25% | 0.252 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -71.7 | -37.2 | 177.1 | -61.3 | 178.5 | -15.2 | 0 | 0 | 111 | P338 T339 V343 V344 A345 L359 V364 | P338-Q341 HydrophobicContact CG-CB 4.17Å; P338-Q341 HydrophobicContact CG-CG 4.11Å; P338-Q341 VanDerWaalsContact CG-OE1 3.27Å; P338-Q341 PolarHBondContact O-N 3.42Å; T339-Q341 PolarHBondContact O-N 3.39Å; Q341-V343 VanDerWaalsContact C-N 3.34Å; Q341-V343 PolarHBondContact O-N 2.98Å; Q341-V344 PolarHBondContact O-N 2.93Å; Q341-A345 VanDerWaalsContact O-CB 3.32Å; Q341-A345 WeakPolarHBondContact O-CB 3.38Å; Q341-A345 PolarHBondContact O-N 3.34Å; Q341-L359 HydrophobicContact CB-CD2 3.52Å; Q341-V364 HydrophobicContact CB-CB 4.48Å; Q341-V364 HydrophobicContact CB-CG1 3.87Å; Q341-V364 HydrophobicContact CG-CG1 4.21Å |
| 342 | A | 72.3 | Confident | 71.2 | Confident | 0 Ų | 0 | 64.3 Ų | 64.3 | 0% | 0 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -61.2 | -40.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | L332 P338 T339 L346 | L332-A342 HydrophobicContact CB-CB 3.97Å; L332-A342 HydrophobicContact CD1-CB 3.73Å; L332-A342 HydrophobicContact CG-CB 4.5Å; P338-A342 WeakPolarHBondContact O-CB 3.39Å; P338-A342 PolarHBondContact O-N 2.95Å; T339-A342 PolarHBondContact O-N 3.24Å; A342-L346 WeakPolarHBondContact O-CB 3.28Å; A342-L346 PolarHBondContact O-N 3.5Å |
| 343 | V | 71.1 | Confident | 71.2 | Confident | 52 Ų | 52 | 70.7 Ų | 70.7 | 32% | 0.315 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -61.7 | -48.1 | 173.9 | 170.3 | 0 | 0 | 0 | 0 | 111.1 | L329 T339 Q341 L346 A347 | L329-V343 HydrophobicContact CD1-CG2 3.52Å; L329-V343 HydrophobicContact CG-CG2 4.36Å; T339-V343 WeakPolarHBondContact O-CG2 3.22Å; T339-V343 PolarHBondContact O-N 3.48Å; Q341-V343 VanDerWaalsContact C-N 3.34Å; Q341-V343 PolarHBondContact O-N 2.98Å; V343-L346 PolarHBondContact O-N 3.26Å; V343-A347 VanDerWaalsContact O-CB 3.27Å; V343-A347 WeakPolarHBondContact O-CB 3.45Å; V343-A347 PolarHBondContact O-N 2.62Å |
| 344 | V | 72.2 | Confident | 71.1 | Confident | 36 Ų | 36 | 67.7 Ų | 67.7 | 22% | 0.218 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -65.1 | -45.7 | -179 | 175.8 | 0 | 0 | 0 | 0 | 111.4 | E340 Q341 L346 A347 A348 V364 V370 | E340-V344 WeakPolarHBondContact O-CG2 3.5Å; E340-V344 PolarHBondContact O-N 3.44Å; Q341-V344 PolarHBondContact O-N 2.93Å; V344-L346 VanDerWaalsContact C-N 3.33Å; V344-L346 PolarHBondContact O-N 2.93Å; V344-A347 PolarHBondContact O-N 3.35Å; V344-A348 WeakPolarHBondContact O-CB 3.16Å; V344-A348 PolarHBondContact O-N 3.21Å; V344-V364 HydrophobicContact CB-CG1 4.02Å; V344-V364 HydrophobicContact CG1-CG1 3.97Å; V344-V370 HydrophobicContact CG1-CG2 4.16Å |
| 345 | A | 69.3 | Low | 71 | Confident | 0 Ų | 0 | 58 Ų | 58 | 0% | 0 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -63.4 | -37.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q341 T349 A355 L358 L359 V364 | Q341-A345 VanDerWaalsContact O-CB 3.32Å; Q341-A345 WeakPolarHBondContact O-CB 3.38Å; Q341-A345 PolarHBondContact O-N 3.34Å; A345-T349 WeakPolarHBondContact O-CG2 3.28Å; A345-T349 PolarHBondContact O-N 3.04Å; A345-T349 PolarHBondContact O-OG1 3.3Å; A345-A355 HydrophobicContact CB-CB 3.9Å; A345-L358 HydrophobicContact CB-CB 4.48Å; A345-L359 HydrophobicContact CB-CD1 4.2Å; A345-L359 HydrophobicContact CB-CD2 4.16Å; A345-L359 HydrophobicContact CB-CG 3.87Å; A345-V364 HydrophobicContact CB-CG2 4.14Å |
| 346 | L | 73.8 | Confident | 71.2 | Confident | 11 Ų | 11 | 55 Ų | 55 | 6% | 0.058 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -79.6 | -32.8 | -180 | -159.7 | 154.9 | 0 | 0 | 0 | 112 | V324 R328 L332 A342 V343 V344 A348 G350 A355 | V324-L346 HydrophobicContact CG1-CD2 4.43Å; R328-L346 HydrophobicContact CB-CD1 3.74Å; L332-L346 HydrophobicContact CD1-CB 4.45Å; L332-L346 HydrophobicContact CD1-CD1 3.82Å; A342-L346 WeakPolarHBondContact O-CB 3.28Å; A342-L346 PolarHBondContact O-N 3.5Å; V343-L346 PolarHBondContact O-N 3.26Å; V344-L346 VanDerWaalsContact C-N 3.33Å; V344-L346 PolarHBondContact O-N 2.93Å; L346-A348 VanDerWaalsContact C-N 3.34Å; L346-G350 WeakPolarHBondContact O-CA 3.4Å; L346-G350 PolarHBondContact O-N 3.44Å; L346-A355 HydrophobicContact CB-CB 4.15Å |
| 347 | A | 72.8 | Confident | 71.3 | Confident | 79 Ų | 79 | 55.7 Ų | 55.7 | 65% | 0.653 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -64.3 | -37.2 | 168.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | V343 V344 | V343-A347 VanDerWaalsContact O-CB 3.27Å; V343-A347 WeakPolarHBondContact O-CB 3.45Å; V343-A347 PolarHBondContact O-N 2.62Å; V344-A347 PolarHBondContact O-N 3.35Å |
| 348 | A | 69.2 | Low | 71.2 | Confident | 61 Ų | 61 | 55 Ų | 55 | 50% | 0.504 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -73.2 | -28.5 | 178.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | V344 L346 L358 V370 | V344-A348 WeakPolarHBondContact O-CB 3.16Å; V344-A348 PolarHBondContact O-N 3.21Å; L346-A348 VanDerWaalsContact C-N 3.34Å; A348-L358 HydrophobicContact CB-CD1 4.37Å; A348-V370 HydrophobicContact CB-CG2 4.49Å |
| 349 | T | 67.9 | Low | 70.9 | Confident | 50 Ų | 50 | 52.5 Ų | 52.5 | 31% | 0.307 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -118 | -20.3 | -170.1 | 58.5 | 0 | 0 | 0 | 0 | 115 | A345 R351 A355 L358 | A345-T349 WeakPolarHBondContact O-CG2 3.28Å; A345-T349 PolarHBondContact O-N 3.04Å; A345-T349 PolarHBondContact O-OG1 3.3Å; T349-R351 PolarHBondContact O-N 2.99Å; T349-R351 PolarHBondContact OG1-O 3.45Å; T349-A355 PolarHBondContact OG1-N 2.75Å; T349-L358 HydrophobicContact CG2-CD1 3.45Å; T349-L358 VanDerWaalsContact CG2-CD1 3.45Å; T349-L358 HydrophobicContact CG2-CG 4.2Å |
| 350 | G | 66.9 | Low | 70.9 | Confident | 38 Ų | 38 | 55 Ų | 55 | 39% | 0.392 | 32% | 0.321 | S | S | . | . | S | Bend | trans | 65.4 | -3.9 | -178.4 | 0 | 0 | 0 | 0 | 0 | 116 | R328 L346 | R328-G350 PolarHBondContact NH1-O 2.89Å; L346-G350 WeakPolarHBondContact O-CA 3.4Å; L346-G350 PolarHBondContact O-N 3.44Å |
| 351 | R | 71.9 | Confident | 70.4 | Confident | 184 Ų | 184 | 50.8 Ų | 50.8 | 69% | 0.694 | 31% | 0.314 | S | S | * | . | S | Bend | trans | -134.5 | 147.5 | -176.3 | -61.8 | -170.4 | -175.5 | -167.1 | 2.6 | 110.5 | T349 E353 A355 | T349-R351 PolarHBondContact O-N 2.99Å; T349-R351 PolarHBondContact OG1-O 3.45Å; R351-E353 PolarHBondContact O-N 2.99Å; R351-A355 PolarHBondContact O-N 3.1Å; R351-A355 VanDerWaalsContact O-N 3.13Å |
| 352 | V | 69.9 | Low | 70.1 | Confident | 17 Ų | 17 | 51.3 Ų | 51.3 | 10% | 0.103 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -69.8 | -38.7 | -172.4 | -173 | 0 | 0 | 0 | 0 | 111 | R328 L332 M335 G354 A355 V356 | R328-V352 HydrophobicContact CB-CG2 3.78Å; R328-V352 HydrophobicContact CG-CG2 3.75Å; L332-V352 HydrophobicContact CD2-CG1 3.92Å; L332-V352 HydrophobicContact CG-CG1 4.27Å; M335-V352 HydrophobicContact CE-CG1 4.35Å; V352-G354 PolarHBondContact O-N 3.34Å; V352-A355 PolarHBondContact O-N 3.28Å; V352-V356 HydrophobicContact CG1-CG2 4.44Å; V352-V356 WeakPolarHBondContact O-CG2 3.45Å; V352-V356 PolarHBondContact O-N 3.5Å |
| 353 | E | 71.9 | Confident | 69.3 | Low | 134 Ų | 134 | 56.7 Ų | 56.7 | 63% | 0.626 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -66.8 | -39.7 | -176.7 | -53.6 | 72.5 | -157.2 | 0 | 0 | 111.1 | R351 S357 | R351-E353 PolarHBondContact O-N 2.99Å; E353-S357 WeakPolarHBondContact O-CB 3.32Å; E353-S357 PolarHBondContact O-N 2.94Å; E353-S357 VanDerWaalsContact O-N 3.12Å; E353-S357 PolarHBondContact O-OG 2.88Å |
| 354 | G | 71.8 | Confident | 68.5 | Low | 25 Ų | 25 | 54.7 Ų | 54.7 | 26% | 0.258 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -65.9 | -44.2 | 171.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | V352 S357 L358 | V352-G354 PolarHBondContact O-N 3.34Å; G354-S357 WeakPolarHBondContact O-CB 3.4Å; G354-S357 PolarHBondContact O-N 3.26Å; G354-S357 VanDerWaalsContact O-N 3.16Å; G354-L358 PolarHBondContact O-N 2.92Å; G354-L358 VanDerWaalsContact O-N 3.08Å |
| 355 | A | 72.6 | Confident | 67.6 | Low | 0 Ų | 0 | 54.9 Ų | 54.9 | 0% | 0 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -61.1 | -45.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | L332 A345 L346 T349 R351 V352 S357 L358 L359 | L332-A355 HydrophobicContact CD1-CB 4.02Å; A345-A355 HydrophobicContact CB-CB 3.9Å; L346-A355 HydrophobicContact CB-CB 4.15Å; T349-A355 PolarHBondContact OG1-N 2.75Å; R351-A355 PolarHBondContact O-N 3.1Å; R351-A355 VanDerWaalsContact O-N 3.13Å; V352-A355 PolarHBondContact O-N 3.28Å; A355-S357 VanDerWaalsContact C-N 3.27Å; A355-S357 PolarHBondContact O-N 3.39Å; A355-L358 PolarHBondContact O-N 3.48Å; A355-L359 WeakPolarHBondContact O-CB 3.1Å; A355-L359 WeakPolarHBondContact O-CD1 3.11Å; A355-L359 WeakPolarHBondContact O-CG 3.44Å; A355-L359 PolarHBondContact O-N 2.9Å |
| 356 | V | 68.3 | Low | 66.6 | Low | 38 Ų | 38 | 60.8 Ų | 60.8 | 23% | 0.23 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -57.8 | -41.4 | 173.4 | 172.5 | 0 | 0 | 0 | 0 | 110.9 | L332 M335 F337 V352 L358 L359 V360 | L332-V356 HydrophobicContact CD2-CG2 3.46Å; L332-V356 VanDerWaalsContact CD2-CG2 3.46Å; M335-V356 HydrophobicContact CE-CG2 3.61Å; F337-V356 HydrophobicContact CE2-CG1 4.44Å; F337-V356 HydrophobicContact CE2-CG2 4.35Å; F337-V356 HydrophobicContact CZ-CG1 4.38Å; V352-V356 HydrophobicContact CG1-CG2 4.44Å; V352-V356 WeakPolarHBondContact O-CG2 3.45Å; V352-V356 PolarHBondContact O-N 3.5Å; V356-L358 PolarHBondContact O-N 3.3Å; V356-L359 PolarHBondContact O-N 2.88Å; V356-V360 HydrophobicContact CG1-CG2 4.01Å; V356-V360 WeakPolarHBondContact O-CB 3.32Å; V356-V360 VanDerWaalsContact O-CG2 3.29Å; V356-V360 WeakPolarHBondContact O-CG2 3.5Å; V356-V360 PolarHBondContact O-N 3.48Å |
| 357 | S | 72 | Confident | 65.3 | Low | 83 Ų | 83 | 67.9 Ų | 67.9 | 58% | 0.58 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -65.5 | -38.9 | -178 | -56.7 | 0 | 0 | 0 | 0 | 112.5 | E353 G354 A355 G361 | E353-S357 WeakPolarHBondContact O-CB 3.32Å; E353-S357 PolarHBondContact O-N 2.94Å; E353-S357 VanDerWaalsContact O-N 3.12Å; E353-S357 PolarHBondContact O-OG 2.88Å; G354-S357 WeakPolarHBondContact O-CB 3.4Å; G354-S357 PolarHBondContact O-N 3.26Å; G354-S357 VanDerWaalsContact O-N 3.16Å; A355-S357 VanDerWaalsContact C-N 3.27Å; A355-S357 PolarHBondContact O-N 3.39Å; S357-G361 PolarHBondContact O-N 3.28Å |
| 358 | L | 70.6 | Confident | 64.1 | Low | 34 Ų | 34 | 70.2 Ų | 70.2 | 18% | 0.178 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -70.4 | -38 | 174.2 | -67.8 | -178.7 | 0 | 0 | 0 | 112.9 | A345 A348 T349 G354 A355 V356 G361 G362 Q363 V364 | A345-L358 HydrophobicContact CB-CB 4.48Å; A348-L358 HydrophobicContact CB-CD1 4.37Å; T349-L358 HydrophobicContact CG2-CD1 3.45Å; T349-L358 VanDerWaalsContact CG2-CD1 3.45Å; T349-L358 HydrophobicContact CG2-CG 4.2Å; G354-L358 PolarHBondContact O-N 2.92Å; G354-L358 VanDerWaalsContact O-N 3.08Å; A355-L358 PolarHBondContact O-N 3.48Å; V356-L358 PolarHBondContact O-N 3.3Å; L358-G361 PolarHBondContact O-N 3.39Å; L358-G362 PolarHBondContact O-N 3.33Å; L358-Q363 HydrophobicContact CD2-CB 4.45Å; L358-Q363 PolarHBondContact O-N 3.4Å; L358-Q363 VanDerWaalsContact O-N 3.11Å; L358-V364 HydrophobicContact CB-CG2 3.97Å |
| 359 | L | 70.4 | Confident | 62.8 | Low | 17 Ų | 17 | 73.7 Ų | 73.7 | 9% | 0.089 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -67.9 | -46.3 | 178.1 | -70.4 | 165.5 | 0 | 0 | 0 | 111.8 | L332 F337 Q341 A345 A355 V356 G361 G362 V364 | L332-L359 HydrophobicContact CD1-CD1 4.39Å; L332-L359 HydrophobicContact CD2-CD1 4.28Å; F337-L359 HydrophobicContact CB-CD1 4.04Å; F337-L359 HydrophobicContact CD1-CB 3.82Å; F337-L359 HydrophobicContact CD1-CD1 4.01Å; F337-L359 HydrophobicContact CD1-CG 4.38Å; F337-L359 HydrophobicContact CD2-CD1 4.31Å; F337-L359 HydrophobicContact CE1-CB 3.83Å; F337-L359 HydrophobicContact CG-CB 4.5Å; F337-L359 HydrophobicContact CG-CD1 3.86Å; Q341-L359 HydrophobicContact CB-CD2 3.52Å; A345-L359 HydrophobicContact CB-CD1 4.2Å; A345-L359 HydrophobicContact CB-CD2 4.16Å; A345-L359 HydrophobicContact CB-CG 3.87Å; A355-L359 WeakPolarHBondContact O-CB 3.1Å; A355-L359 WeakPolarHBondContact O-CD1 3.11Å; A355-L359 WeakPolarHBondContact O-CG 3.44Å; A355-L359 PolarHBondContact O-N 2.9Å; V356-L359 PolarHBondContact O-N 2.88Å; L359-G361 VanDerWaalsContact C-N 3.31Å; L359-G361 PolarHBondContact O-N 3.06Å; L359-G362 PolarHBondContact O-N 3.08Å; L359-V364 HydrophobicContact CD2-CB 4.46Å; L359-V364 HydrophobicContact CD2-CG2 4.35Å |
| 360 | V | 70.9 | Confident | 61.3 | Low | 108 Ų | 108 | 74.5 Ų | 74.5 | 66% | 0.655 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -67.2 | -33.3 | 175.9 | 173.8 | 0 | 0 | 0 | 0 | 111.3 | F337 V356 G362 | F337-V360 HydrophobicContact CE1-CG2 4.15Å; F337-V360 HydrophobicContact CZ-CG2 3.84Å; V356-V360 HydrophobicContact CG1-CG2 4.01Å; V356-V360 WeakPolarHBondContact O-CB 3.32Å; V356-V360 VanDerWaalsContact O-CG2 3.29Å; V356-V360 WeakPolarHBondContact O-CG2 3.5Å; V356-V360 PolarHBondContact O-N 3.48Å; V360-G362 PolarHBondContact O-N 2.79Å |
| 361 | G | 62.9 | Low | 59.8 | Low | 46 Ų | 46 | 77.8 Ų | 77.8 | 47% | 0.474 | 46% | 0.458 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -74.2 | -4 | 174.5 | 0 | 0 | 0 | 0 | 0 | 115.3 | S357 L358 L359 Q363 | S357-G361 PolarHBondContact O-N 3.28Å; L358-G361 PolarHBondContact O-N 3.39Å; L359-G361 VanDerWaalsContact C-N 3.31Å; L359-G361 PolarHBondContact O-N 3.06Å; G361-Q363 PolarHBondContact O-N 2.88Å |
| 362 | G | 62.4 | Low | 58 | Low | 65 Ų | 65 | 77.8 Ų | 77.8 | 67% | 0.67 | 47% | 0.466 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 67.6 | 17 | -179.6 | 0 | 0 | 0 | 0 | 0 | 115 | L358 L359 V360 V364 | L358-G362 PolarHBondContact O-N 3.33Å; L359-G362 PolarHBondContact O-N 3.08Å; V360-G362 PolarHBondContact O-N 2.79Å; G362-V364 VanDerWaalsContact C-N 3.27Å; G362-V364 PolarHBondContact O-N 3.18Å |
| 363 | Q | 56.4 | Low | 56.2 | Low | 112 Ų | 112 | 81 Ų | 81 | 52% | 0.523 | 50% | 0.502 | S | S | . | . | trans | -89.3 | 19.1 | -171.9 | -60.8 | -174.2 | 5.6 | 0 | 0 | 113.7 | L358 G361 | L358-Q363 HydrophobicContact CD2-CB 4.45Å; L358-Q363 PolarHBondContact O-N 3.4Å; L358-Q363 VanDerWaalsContact O-N 3.11Å; G361-Q363 PolarHBondContact O-N 2.88Å | ||
| 364 | V | 54.8 | Low | 54.2 | Low | 11 Ų | 11 | 83.9 Ų | 83.9 | 7% | 0.067 | 51% | 0.513 | C | S | . | . | trans | -127.2 | 98.8 | -174.6 | -171.9 | 0 | 0 | 0 | 0 | 109.7 | Q341 V344 A345 L358 L359 G362 | Q341-V364 HydrophobicContact CB-CB 4.48Å; Q341-V364 HydrophobicContact CB-CG1 3.87Å; Q341-V364 HydrophobicContact CG-CG1 4.21Å; V344-V364 HydrophobicContact CB-CG1 4.02Å; V344-V364 HydrophobicContact CG1-CG1 3.97Å; A345-V364 HydrophobicContact CB-CG2 4.14Å; L358-V364 HydrophobicContact CB-CG2 3.97Å; L359-V364 HydrophobicContact CD2-CB 4.46Å; L359-V364 HydrophobicContact CD2-CG2 4.35Å; G362-V364 VanDerWaalsContact C-N 3.27Å; G362-V364 PolarHBondContact O-N 3.18Å | ||
| 365 | G | 52.9 | Low | 52.2 | Low | 40 Ų | 40 | 86.4 Ų | 86.4 | 41% | 0.412 | 54% | 0.539 | S | S | . | . | trans | -69.8 | 159.8 | 171.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | E367 | G365-E367 PolarHBondContact O-N 3.01Š| ||
| 366 | T | 48.9 | Very low | 50.3 | Low | 124 Ų | 124 | 89.8 Ų | 89.8 | 76% | 0.761 | 57% | 0.574 | S | S | * | * | S | Bend | trans | -74.6 | -6.1 | 177.5 | 46.3 | 0 | 0 | 0 | 0 | 114.2 | ||
| 367 | E | 45.7 | Very low | 49 | Very low | 160 Ų | 160 | 94.2 Ų | 94.2 | 75% | 0.748 | 60% | 0.603 | S | S | * | * | S | Bend | trans | -119 | 153 | 169.8 | -62.2 | -168.6 | 178 | 0 | 0 | 109.3 | G365 L369 | G365-E367 PolarHBondContact O-N 3.01Å; E367-L369 PolarHBondContact O-N 3.27Å |
| 368 | T | 48 | Very low | 47 | Very low | 128 Ų | 128 | 95 Ų | 95 | 79% | 0.785 | 61% | 0.614 | S | S | * | * | S | Bend | trans | -73.9 | 60.5 | -160 | 53.3 | 0 | 0 | 0 | 0 | 114.9 | ||
| 369 | L | 40.4 | Very low | 45.1 | Very low | 134 Ų | 134 | 102.1 Ų | 102.1 | 70% | 0.702 | 65% | 0.647 | S | S | * | * | trans | -135.7 | 97.7 | 176 | -78.6 | 165.1 | 0 | 0 | 0 | 109.3 | E367 T371 | E367-L369 PolarHBondContact O-N 3.27Å; L369-T371 PolarHBondContact O-N 3.22Å; L369-T371 VanDerWaalsContact O-N 3.15Å | ||
| 370 | V | 36.5 | Very low | 43.2 | Very low | 67 Ų | 67 | 105.9 Ų | 105.9 | 41% | 0.406 | 67% | 0.674 | S | S | . | * | trans | -72.1 | 103.1 | 161.2 | 177.2 | 0 | 0 | 0 | 0 | 106.8 | V344 A348 Q372 | V344-V370 HydrophobicContact CG1-CG2 4.16Å; A348-V370 HydrophobicContact CB-CG2 4.49Å; V370-Q372 PolarHBondContact O-N 2.81Å | ||
| 371 | T | 36 | Very low | 41.3 | Very low | 107 Ų | 107 | 109.4 Ų | 109.4 | 66% | 0.656 | 68% | 0.684 | S | S | * | * | trans | -68.3 | 103.2 | 178 | 48.9 | 0 | 0 | 0 | 0 | 109.7 | L369 G373 | L369-T371 PolarHBondContact O-N 3.22Å; L369-T371 VanDerWaalsContact O-N 3.15Å; T371-G373 PolarHBondContact O-N 3.37Å; T371-G373 VanDerWaalsContact O-N 3.13Å | ||
| 372 | Q | 35.1 | Very low | 39.8 | Very low | 183 Ų | 183 | 110.1 Ų | 110.1 | 86% | 0.855 | 69% | 0.691 | S | S | * | * | trans | -60.8 | 115.6 | 171.7 | -173.5 | -177.6 | 65.5 | 0 | 0 | 109 | V370 K374 | V370-Q372 PolarHBondContact O-N 2.81Å; Q372-K374 PolarHBondContact O-N 3.12Å | ||
| 373 | G | 31 | Very low | 38.9 | Very low | 84 Ų | 84 | 113.3 Ų | 113.3 | 87% | 0.866 | 70% | 0.7 | S | S | * | * | trans | -65.5 | 100.5 | -179.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | T371 | T371-G373 PolarHBondContact O-N 3.37Å; T371-G373 VanDerWaalsContact O-N 3.13Å | ||
| 374 | K | 30.5 | Very low | 37.6 | Very low | 195 Ų | 195 | 111.2 Ų | 111.2 | 85% | 0.848 | 71% | 0.708 | S | S | * | * | trans | -100.8 | 121.7 | 164.3 | -170 | 169.5 | -177 | 175.1 | 0 | 108.2 | Q372 | Q372-K374 PolarHBondContact O-N 3.12Š| ||
| 375 | G | 30.1 | Very low | 36.9 | Very low | 78 Ų | 78 | 116.4 Ų | 116.4 | 80% | 0.804 | 74% | 0.742 | S | S | * | * | trans | -72.1 | 152.3 | -176.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 376 | G | 31.7 | Very low | 36.4 | Very low | 72 Ų | 72 | 123.9 Ų | 123.9 | 74% | 0.742 | 78% | 0.784 | S | S | * | * | trans | 90.6 | 144.5 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 377 | P | 41.8 | Very low | 35.8 | Very low | 131 Ų | 131 | 123.9 Ų | 123.9 | 85% | 0.851 | 79% | 0.785 | S | S | * | * | cis | -135.4 | -179.3 | 31.8 | 41.3 | -25 | 0 | 0 | 0 | 116 | ||||
| 378 | A | 30.8 | Very low | 35.3 | Very low | 98 Ų | 98 | 122 Ų | 122 | 81% | 0.81 | 79% | 0.787 | S | S | * | * | trans | -136.6 | 149.2 | 154.1 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 379 | H | 29.5 | Very low | 34.6 | Very low | 185 Ų | 185 | 121.7 Ų | 121.7 | 86% | 0.856 | 79% | 0.787 | S | S | * | * | trans | -70.7 | 170.8 | 178.5 | -56.4 | -53.3 | 0 | 0 | 0 | 112 | ||||
| 380 | S | 30.9 | Very low | 34.2 | Very low | 96 Ų | 96 | 120.9 Ų | 120.9 | 67% | 0.671 | 79% | 0.792 | S | S | * | * | cis | -141.4 | -162.4 | 10.6 | -55.8 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 381 | E | 31.4 | Very low | 34.1 | Very low | 181 Ų | 181 | 124.3 Ų | 124.3 | 85% | 0.846 | 82% | 0.816 | S | S | * | * | cis | -154.2 | -165 | -0.9 | -148.4 | 130.8 | 94.7 | 0 | 0 | 110.5 | ||||
| 382 | G | 30.4 | Very low | 33.9 | Very low | 62 Ų | 62 | 125.5 Ų | 125.5 | 64% | 0.639 | 83% | 0.827 | S | S | * | * | trans | -108.2 | -169.4 | 163.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 383 | P | 44.1 | Very low | 33.9 | Very low | 132 Ų | 132 | 121.4 Ų | 121.4 | 86% | 0.857 | 83% | 0.825 | S | S | * | * | cis | -137.7 | 177.8 | 7.8 | 43.1 | -26.6 | 0 | 0 | 0 | 116.1 | ||||
| 384 | G | 28.4 | Very low | 34.1 | Very low | 67 Ų | 67 | 124.2 Ų | 124.2 | 69% | 0.691 | 82% | 0.822 | S | S | * | * | trans | 97.7 | 135.3 | 144.3 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 385 | P | 41.3 | Very low | 34.4 | Very low | 121 Ų | 121 | 118.3 Ų | 118.3 | 79% | 0.786 | 82% | 0.819 | S | S | * | * | trans | -89.6 | -178.5 | 172 | 44.1 | -39.3 | 0 | 0 | 0 | 110.5 | ||||
| 386 | P | 42.4 | Very low | 34.8 | Very low | 197 Ų | 197 | 122 Ų | 122 | 100% | 1.279 | 82% | 0.821 | S | S | * | * | cis | -95 | 0 | 35 | 36.5 | -37.4 | 0 | 0 | 0 | 116.6 |
Retrieved 386 of 386 residues in 1702.2 ms
(Link to these results)