| 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 | 56.8 | Low | 67.6 | Low | 205 Ų | 205 | 120.1 Ų | 120.1 | 100% | 1.01 | 61% | 0.613 | S | S | * | * | 0 | -45.3 | 0 | -64.5 | -138.6 | -77.6 | 0 | 0 | 113.6 | E3 | M1-E3 PolarHBondContact O-N 3.01Š| |||
| 2 | A | 61.6 | Low | 68.3 | Low | 87 Ų | 87 | 120.6 Ų | 120.6 | 72% | 0.719 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -65.4 | -34.2 | -179.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | A6 | A2-A6 PolarHBondContact O-N 2.89Å |
| 3 | E | 66.6 | Low | 68.7 | Low | 164 Ų | 164 | 115.9 Ų | 115.9 | 77% | 0.766 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -72.5 | -29.9 | -177.6 | -63 | -175.9 | 163.1 | 0 | 0 | 113.3 | M1 Q7 | M1-E3 PolarHBondContact O-N 3.01Å; E3-Q7 PolarHBondContact O-N 3.45Å |
| 4 | E | 65.3 | Low | 69.5 | Low | 132 Ų | 132 | 115.9 Ų | 115.9 | 62% | 0.617 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -73.1 | -39.2 | 179.4 | -65.1 | -178.9 | 144.6 | 0 | 0 | 111.6 | A6 Q7 I8 | E4-A6 VanDerWaalsContact C-N 3.31Å; E4-A6 PolarHBondContact O-N 3.49Å; E4-Q7 PolarHBondContact O-N 3.28Å; E4-I8 WeakPolarHBondContact O-CG1 3.31Å; E4-I8 PolarHBondContact O-N 3.33Å; E4-I8 VanDerWaalsContact O-N 3.07Å |
| 5 | A | 63.3 | Low | 70 | Confident | 56 Ų | 56 | 111.7 Ų | 111.7 | 46% | 0.463 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -60.6 | -41.1 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q7 I8 T9 | A5-Q7 PolarHBondContact O-N 3.03Å; A5-I8 PolarHBondContact O-N 3.21Å; A5-T9 PolarHBondContact O-N 3.46Å; A5-T9 PolarHBondContact O-OG1 3.18Å; A5-T9 VanDerWaalsContact O-OG1 3.13Å |
| 6 | A | 65.3 | Low | 70.2 | Confident | 48 Ų | 48 | 108.1 Ų | 108.1 | 40% | 0.397 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -64.6 | -38.6 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | A2 E4 R10 | A2-A6 PolarHBondContact O-N 2.89Å; E4-A6 VanDerWaalsContact C-N 3.31Å; E4-A6 PolarHBondContact O-N 3.49Å; A6-R10 WeakPolarHBondContact O-CB 3.48Å; A6-R10 VanDerWaalsContact O-CG 3.31Å; A6-R10 WeakPolarHBondContact O-CG 3.49Å; A6-R10 PolarHBondContact O-N 3.09Å |
| 7 | Q | 68.6 | Low | 70.5 | Confident | 110 Ų | 110 | 110.1 Ų | 110.1 | 51% | 0.514 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -67 | -39.3 | 175.5 | -73.6 | -160.2 | 25.8 | 0 | 0 | 112.5 | E3 E4 A5 R10 R11 | E3-Q7 PolarHBondContact O-N 3.45Å; E4-Q7 PolarHBondContact O-N 3.28Å; A5-Q7 PolarHBondContact O-N 3.03Å; Q7-R10 PolarHBondContact O-N 3.29Å; Q7-R11 WeakPolarHBondContact O-CG 3.4Å; Q7-R11 PolarHBondContact O-N 3.18Å |
| 8 | I | 70.3 | Confident | 71 | Confident | 91 Ų | 91 | 110.2 Ų | 110.2 | 47% | 0.467 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -64.3 | -43.8 | 178.3 | -66.7 | 163.7 | 0 | 0 | 0 | 110.4 | E4 A5 R10 R11 K12 | E4-I8 WeakPolarHBondContact O-CG1 3.31Å; E4-I8 PolarHBondContact O-N 3.33Å; E4-I8 VanDerWaalsContact O-N 3.07Å; A5-I8 PolarHBondContact O-N 3.21Å; I8-R10 PolarHBondContact O-N 3.43Å; I8-R11 PolarHBondContact O-N 3.14Å; I8-K12 HydrophobicContact CG2-CD 4.12Å; I8-K12 WeakPolarHBondContact O-CG 3.5Å; I8-K12 PolarHBondContact O-N 3.23Å |
| 9 | T | 75.4 | Confident | 71.3 | Confident | 74 Ų | 74 | 109.7 Ų | 109.7 | 45% | 0.454 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -63.3 | -41.8 | 176.1 | -53.9 | 0 | 0 | 0 | 0 | 111.3 | A5 R11 K12 T13 | A5-T9 PolarHBondContact O-N 3.46Å; A5-T9 PolarHBondContact O-OG1 3.18Å; A5-T9 VanDerWaalsContact O-OG1 3.13Å; T9-R11 PolarHBondContact O-N 3.22Å; T9-K12 PolarHBondContact O-N 2.8Å; T9-T13 HydrophobicContact CG2-CG2 4.47Å; T9-T13 WeakPolarHBondContact O-CG2 3.4Å; T9-T13 PolarHBondContact O-N 3.4Å; T9-T13 PolarHBondContact O-OG1 3.44Å |
| 10 | R | 74.6 | Confident | 71.6 | Confident | 182 Ų | 182 | 108.3 Ų | 108.3 | 69% | 0.687 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -62 | -39.3 | 174.7 | -75 | 178.2 | -175.8 | -163.2 | 2.7 | 113.3 | A6 Q7 I8 T13 L14 | A6-R10 WeakPolarHBondContact O-CB 3.48Å; A6-R10 VanDerWaalsContact O-CG 3.31Å; A6-R10 WeakPolarHBondContact O-CG 3.49Å; A6-R10 PolarHBondContact O-N 3.09Å; Q7-R10 PolarHBondContact O-N 3.29Å; I8-R10 PolarHBondContact O-N 3.43Å; R10-T13 WeakPolarHBondContact CA-OG1 3.41Å; R10-T13 PolarHBondContact O-OG1 3.12Å; R10-L14 WeakPolarHBondContact O-CB 3.43Å; R10-L14 VanDerWaalsContact O-CG 3.24Å; R10-L14 WeakPolarHBondContact O-CG 3.38Å; R10-L14 PolarHBondContact O-N 3.23Å |
| 11 | R | 75.6 | Confident | 71.8 | Confident | 172 Ų | 172 | 105.9 Ų | 105.9 | 65% | 0.649 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -68.3 | -38.7 | 176.4 | -70.3 | 177.8 | -168.7 | -172 | 6.6 | 111.6 | Q7 I8 T9 A15 | Q7-R11 WeakPolarHBondContact O-CG 3.4Å; Q7-R11 PolarHBondContact O-N 3.18Å; I8-R11 PolarHBondContact O-N 3.14Å; T9-R11 PolarHBondContact O-N 3.22Å; R11-A15 WeakPolarHBondContact O-CB 3.36Å; R11-A15 PolarHBondContact O-N 2.85Å |
| 12 | K | 75.8 | Confident | 72.5 | Confident | 126 Ų | 126 | 99.7 Ų | 99.7 | 55% | 0.548 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -65.7 | -43.8 | 175.3 | -71.8 | 172.8 | 178.2 | 176.1 | 0 | 112 | I8 T9 A15 V16 | I8-K12 HydrophobicContact CG2-CD 4.12Å; I8-K12 WeakPolarHBondContact O-CG 3.5Å; I8-K12 PolarHBondContact O-N 3.23Å; T9-K12 PolarHBondContact O-N 2.8Å; K12-A15 PolarHBondContact O-N 2.95Å; K12-V16 PolarHBondContact O-N 3.3Å |
| 13 | T | 74.4 | Confident | 72.8 | Confident | 60 Ų | 60 | 98.1 Ų | 98.1 | 37% | 0.368 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65.1 | -41.4 | 176.7 | 55.8 | 0 | 0 | 0 | 0 | 111.4 | T9 R10 A15 V16 F17 W122 | T9-T13 HydrophobicContact CG2-CG2 4.47Å; T9-T13 WeakPolarHBondContact O-CG2 3.4Å; T9-T13 PolarHBondContact O-N 3.4Å; T9-T13 PolarHBondContact O-OG1 3.44Å; R10-T13 WeakPolarHBondContact CA-OG1 3.41Å; R10-T13 PolarHBondContact O-OG1 3.12Å; T13-A15 PolarHBondContact O-N 2.93Å; T13-V16 PolarHBondContact O-N 3.38Å; T13-F17 WeakPolarHBondContact O-CB 3.1Å; T13-F17 PolarHBondContact O-N 2.86Å; T13-W122 HydrophobicContact CG2-CH2 4.23Å; T13-W122 HydrophobicContact CG2-CZ3 3.9Å |
| 14 | L | 79.2 | Confident | 72.9 | Confident | 115 Ų | 115 | 92.4 Ų | 92.4 | 60% | 0.602 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -61.9 | -41.1 | 173.1 | -75.1 | 171.8 | 0 | 0 | 0 | 112.1 | R10 V16 F17 L18 | R10-L14 WeakPolarHBondContact O-CB 3.43Å; R10-L14 VanDerWaalsContact O-CG 3.24Å; R10-L14 WeakPolarHBondContact O-CG 3.38Å; R10-L14 PolarHBondContact O-N 3.23Å; L14-V16 PolarHBondContact O-N 3.47Å; L14-F17 PolarHBondContact O-N 3.44Å; L14-L18 VanDerWaalsContact O-CB 3.29Å; L14-L18 WeakPolarHBondContact O-CB 3.3Å; L14-L18 PolarHBondContact O-N 3.38Å |
| 15 | A | 77.7 | Confident | 73.1 | Confident | 54 Ų | 54 | 90.5 Ų | 90.5 | 45% | 0.446 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62 | -43.3 | 176 | 0 | 0 | 0 | 0 | 0 | 111.7 | R11 K12 T13 L18 V19 | R11-A15 WeakPolarHBondContact O-CB 3.36Å; R11-A15 PolarHBondContact O-N 2.85Å; K12-A15 PolarHBondContact O-N 2.95Å; T13-A15 PolarHBondContact O-N 2.93Å; A15-L18 PolarHBondContact O-N 2.91Å; A15-V19 VanDerWaalsContact O-CG2 3.3Å; A15-V19 WeakPolarHBondContact O-CG2 3.33Å; A15-V19 PolarHBondContact O-N 3.47Å |
| 16 | V | 73.6 | Confident | 73.1 | Confident | 53 Ų | 53 | 91.7 Ų | 91.7 | 32% | 0.321 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -65.1 | -43.6 | 174.3 | 171.7 | 0 | 0 | 0 | 0 | 111.5 | K12 T13 L14 L18 V19 V20 W122 | K12-V16 PolarHBondContact O-N 3.3Å; T13-V16 PolarHBondContact O-N 3.38Å; L14-V16 PolarHBondContact O-N 3.47Å; V16-L18 VanDerWaalsContact C-N 3.27Å; V16-L18 PolarHBondContact O-N 2.96Å; V16-V19 PolarHBondContact O-N 3.2Å; V16-V20 HydrophobicContact CG1-CG2 4.13Å; V16-V20 WeakPolarHBondContact O-CB 3.36Å; V16-V20 VanDerWaalsContact O-CG2 3.26Å; V16-V20 WeakPolarHBondContact O-CG2 3.23Å; V16-V20 PolarHBondContact O-N 3.22Å; V16-W122 HydrophobicContact CB-CH2 4.23Å; V16-W122 HydrophobicContact CB-CZ2 4.18Å; V16-W122 HydrophobicContact CG2-CH2 3.69Å; V16-W122 HydrophobicContact CG2-CZ2 3.24Å |
| 17 | F | 75.2 | Confident | 73 | Confident | 143 Ų | 143 | 91.5 Ų | 91.5 | 63% | 0.627 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -60.8 | -39.1 | 176.9 | -161.9 | -93.5 | 0 | 0 | 0 | 111.4 | T13 L14 V20 T21 | T13-F17 WeakPolarHBondContact O-CB 3.1Å; T13-F17 PolarHBondContact O-N 2.86Å; L14-F17 PolarHBondContact O-N 3.44Å; F17-V20 PolarHBondContact O-N 2.89Å; F17-T21 WeakPolarHBondContact O-CB 3.32Å; F17-T21 PolarHBondContact O-N 3.46Å; F17-T21 PolarHBondContact O-OG1 2.88Å |
| 18 | L | 79.4 | Confident | 72.6 | Confident | 111 Ų | 111 | 92.7 Ų | 92.7 | 58% | 0.581 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -65 | -47 | 175 | -157 | 171.6 | 0 | 0 | 0 | 110.6 | L14 A15 V16 V20 T21 V22 | L14-L18 VanDerWaalsContact O-CB 3.29Å; L14-L18 WeakPolarHBondContact O-CB 3.3Å; L14-L18 PolarHBondContact O-N 3.38Å; A15-L18 PolarHBondContact O-N 2.91Å; V16-L18 VanDerWaalsContact C-N 3.27Å; V16-L18 PolarHBondContact O-N 2.96Å; L18-V20 PolarHBondContact O-N 3.43Å; L18-T21 PolarHBondContact O-N 2.85Å; L18-V22 HydrophobicContact CD2-CG2 3.55Å; L18-V22 WeakPolarHBondContact O-CB 3.44Å; L18-V22 WeakPolarHBondContact O-CG2 3.45Å; L18-V22 PolarHBondContact O-N 2.83Å |
| 19 | V | 76.7 | Confident | 72.2 | Confident | 101 Ų | 101 | 91.3 Ų | 91.3 | 61% | 0.612 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -61.6 | -43.6 | 176.6 | 171.6 | 0 | 0 | 0 | 0 | 111.5 | A15 V16 S23 | A15-V19 VanDerWaalsContact O-CG2 3.3Å; A15-V19 WeakPolarHBondContact O-CG2 3.33Å; A15-V19 PolarHBondContact O-N 3.47Å; V16-V19 PolarHBondContact O-N 3.2Å; V19-S23 WeakPolarHBondContact O-CB 3.47Å; V19-S23 PolarHBondContact O-N 3.29Å |
| 20 | V | 76.3 | Confident | 71.4 | Confident | 82 Ų | 82 | 95.5 Ų | 95.5 | 50% | 0.497 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.8 | -42.6 | 176.1 | 172.1 | 0 | 0 | 0 | 0 | 110.7 | V16 F17 L18 S23 A24 | V16-V20 HydrophobicContact CG1-CG2 4.13Å; V16-V20 WeakPolarHBondContact O-CB 3.36Å; V16-V20 VanDerWaalsContact O-CG2 3.26Å; V16-V20 WeakPolarHBondContact O-CG2 3.23Å; V16-V20 PolarHBondContact O-N 3.22Å; F17-V20 PolarHBondContact O-N 2.89Å; L18-V20 PolarHBondContact O-N 3.43Å; V20-S23 PolarHBondContact O-N 2.85Å; V20-A24 VanDerWaalsContact O-CB 3.3Å; V20-A24 WeakPolarHBondContact O-CB 3.27Å; V20-A24 PolarHBondContact O-N 3.46Å |
| 21 | T | 75.2 | Confident | 70.4 | Confident | 57 Ų | 57 | 91.2 Ų | 91.2 | 35% | 0.35 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -69.6 | -42.2 | 179.9 | -56.1 | 0 | 0 | 0 | 0 | 111.4 | F17 L18 A24 V25 | F17-T21 WeakPolarHBondContact O-CB 3.32Å; F17-T21 PolarHBondContact O-N 3.46Å; F17-T21 PolarHBondContact O-OG1 2.88Å; L18-T21 PolarHBondContact O-N 2.85Å; T21-A24 CarbonylContact O-C 3.54Å; T21-A24 WeakPolarHBondContact O-CB 3.35Å; T21-A24 PolarHBondContact O-N 3.46Å; T21-V25 HydrophobicContact CG2-CG2 4.24Å; T21-V25 WeakPolarHBondContact O-CB 3.34Å; T21-V25 WeakPolarHBondContact O-CG2 3.43Å; T21-V25 PolarHBondContact O-N 3.42Å |
| 22 | V | 72.3 | Confident | 69.5 | Low | 75 Ų | 75 | 85.1 Ų | 85.1 | 46% | 0.455 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -67 | -40.5 | 175 | 168.9 | 0 | 0 | 0 | 0 | 110.5 | L18 A24 V25 V26 | L18-V22 HydrophobicContact CD2-CG2 3.55Å; L18-V22 WeakPolarHBondContact O-CB 3.44Å; L18-V22 WeakPolarHBondContact O-CG2 3.45Å; L18-V22 PolarHBondContact O-N 2.83Å; V22-A24 VanDerWaalsContact C-N 3.32Å; V22-A24 PolarHBondContact O-N 2.92Å; V22-V25 CarbonylContact O-C 3.57Å; V22-V25 PolarHBondContact O-N 3.45Å; V22-V26 HydrophobicContact CG1-CG2 4.11Å; V22-V26 WeakPolarHBondContact O-CB 3.29Å; V22-V26 VanDerWaalsContact O-CG2 3.22Å; V22-V26 WeakPolarHBondContact O-CG2 3.37Å; V22-V26 PolarHBondContact O-N 2.75Å |
| 23 | S | 68.5 | Low | 68.5 | Low | 55 Ų | 55 | 84.8 Ų | 84.8 | 39% | 0.385 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -58.4 | -47.5 | 170.4 | -179 | 0 | 0 | 0 | 0 | 110.2 | V19 V20 V25 V26 V27 | V19-S23 WeakPolarHBondContact O-CB 3.47Å; V19-S23 PolarHBondContact O-N 3.29Å; V20-S23 PolarHBondContact O-N 2.85Å; S23-V25 PolarHBondContact O-N 2.83Å; S23-V26 PolarHBondContact O-N 3.29Å; S23-V27 WeakPolarHBondContact O-CB 3.43Å; S23-V27 WeakPolarHBondContact O-CG2 3.3Å; S23-V27 PolarHBondContact O-N 3.22Å |
| 24 | A | 67.8 | Low | 67.6 | Low | 44 Ų | 44 | 86 Ų | 86 | 36% | 0.364 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -61.4 | -41.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | V20 T21 V22 Y28 | V20-A24 VanDerWaalsContact O-CB 3.3Å; V20-A24 WeakPolarHBondContact O-CB 3.27Å; V20-A24 PolarHBondContact O-N 3.46Å; T21-A24 CarbonylContact O-C 3.54Å; T21-A24 WeakPolarHBondContact O-CB 3.35Å; T21-A24 PolarHBondContact O-N 3.46Å; V22-A24 VanDerWaalsContact C-N 3.32Å; V22-A24 PolarHBondContact O-N 2.92Å; A24-Y28 WeakPolarHBondContact O-CA 3.36Å; A24-Y28 WeakPolarHBondContact O-CB 3.43Å; A24-Y28 PolarHBondContact O-N 3.36Å |
| 25 | V | 69.7 | Low | 66.4 | Low | 92 Ų | 92 | 86.8 Ų | 86.8 | 56% | 0.558 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -79.1 | -15.8 | -179.8 | 172.9 | 0 | 0 | 0 | 0 | 113.2 | T21 V22 S23 P29 | T21-V25 HydrophobicContact CG2-CG2 4.24Å; T21-V25 WeakPolarHBondContact O-CB 3.34Å; T21-V25 WeakPolarHBondContact O-CG2 3.43Å; T21-V25 PolarHBondContact O-N 3.42Å; V22-V25 CarbonylContact O-C 3.57Å; V22-V25 PolarHBondContact O-N 3.45Å; S23-V25 PolarHBondContact O-N 2.83Å; V25-P29 WeakPolarHBondContact O-CD 3.31Å; V25-P29 WeakPolarHBondContact O-CG 3.32Å |
| 26 | V | 63.8 | Low | 65.3 | Low | 81 Ų | 81 | 87.2 Ų | 87.2 | 49% | 0.491 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -92.5 | -32.2 | 171.1 | 173 | 0 | 0 | 0 | 0 | 110.4 | V22 S23 | V22-V26 HydrophobicContact CG1-CG2 4.11Å; V22-V26 WeakPolarHBondContact O-CB 3.29Å; V22-V26 VanDerWaalsContact O-CG2 3.22Å; V22-V26 WeakPolarHBondContact O-CG2 3.37Å; V22-V26 PolarHBondContact O-N 2.75Å; S23-V26 PolarHBondContact O-N 3.29Å |
| 27 | V | 63.4 | Low | 64.3 | Low | 44 Ų | 44 | 89.4 Ų | 89.4 | 27% | 0.267 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -80.5 | -37.2 | 175.9 | 176.6 | 0 | 0 | 0 | 0 | 111.2 | S23 K30 F31 I111 | S23-V27 WeakPolarHBondContact O-CB 3.43Å; S23-V27 WeakPolarHBondContact O-CG2 3.3Å; S23-V27 PolarHBondContact O-N 3.22Å; V27-K30 PolarHBondContact O-N 2.91Å; V27-K30 VanDerWaalsContact O-N 3.16Å; V27-F31 HydrophobicContact CB-CD2 4.46Å; V27-F31 HydrophobicContact CG1-CD2 3.6Å; V27-F31 HydrophobicContact CG1-CE2 4.2Å; V27-F31 HydrophobicContact CG1-CG 4.32Å; V27-F31 WeakPolarHBondContact O-CB 3.45Å; V27-F31 WeakPolarHBondContact O-CD2 3.17Å; V27-F31 PolarHBondContact O-N 2.82Å; V27-I111 HydrophobicContact CG1-CD1 4.44Å |
| 28 | Y | 59.1 | Low | 63.2 | Low | 134 Ų | 134 | 87.5 Ų | 87.5 | 53% | 0.525 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -57.4 | -51 | 177.3 | -122 | -108.6 | 0 | 0 | 0 | 110.6 | A24 K30 F31 I32 L36 | A24-Y28 WeakPolarHBondContact O-CA 3.36Å; A24-Y28 WeakPolarHBondContact O-CB 3.43Å; A24-Y28 PolarHBondContact O-N 3.36Å; Y28-K30 PolarHBondContact O-N 3.49Å; Y28-F31 PolarHBondContact O-N 3.39Å; Y28-I32 HydrophobicContact CD1-CB 4.13Å; Y28-I32 HydrophobicContact CD1-CD1 3.94Å; Y28-I32 HydrophobicContact CD1-CG2 3.63Å; Y28-I32 HydrophobicContact CD2-CD1 3.41Å; Y28-I32 VanDerWaalsContact CD2-CD1 3.41Å; Y28-I32 HydrophobicContact CE1-CB 4.43Å; Y28-I32 HydrophobicContact CE1-CD1 3.91Å; Y28-I32 HydrophobicContact CE1-CG2 3.66Å; Y28-I32 HydrophobicContact CE2-CD1 3.35Å; Y28-I32 HydrophobicContact CG-CB 4.37Å; Y28-I32 HydrophobicContact CG-CD1 3.69Å; Y28-I32 HydrophobicContact CG-CG2 4.34Å; Y28-I32 WeakPolarHBondContact O-CA 3.38Å; Y28-I32 WeakPolarHBondContact O-CB 3.36Å; Y28-I32 PolarHBondContact O-N 3.15Å; Y28-L36 HydrophobicContact CE1-CD1 4.2Å |
| 29 | P | 63.5 | Low | 62.1 | Low | 62 Ų | 62 | 86 Ų | 86 | 40% | 0.403 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -67.7 | -27.4 | -179.3 | -21.7 | 33.6 | 0 | 0 | 0 | 112.7 | V25 H33 | V25-P29 WeakPolarHBondContact O-CD 3.31Å; V25-P29 WeakPolarHBondContact O-CG 3.32Å; P29-H33 WeakPolarHBondContact O-CB 3.31Å |
| 30 | K | 56.7 | Low | 61 | Low | 162 Ų | 162 | 86.2 Ų | 86.2 | 70% | 0.704 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -86 | -24.2 | -179.4 | -78.1 | -169.4 | 166.4 | 167.3 | 0 | 114.8 | V27 Y28 | V27-K30 PolarHBondContact O-N 2.91Å; V27-K30 VanDerWaalsContact O-N 3.16Å; Y28-K30 PolarHBondContact O-N 3.49Å |
| 31 | F | 55.3 | Low | 59.6 | Low | 93 Ų | 93 | 85.5 Ų | 85.5 | 41% | 0.408 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -115.8 | -16.3 | -176.4 | -73.8 | -87.8 | 0 | 0 | 0 | 114 | V27 Y28 | V27-F31 HydrophobicContact CB-CD2 4.46Å; V27-F31 HydrophobicContact CG1-CD2 3.6Å; V27-F31 HydrophobicContact CG1-CE2 4.2Å; V27-F31 HydrophobicContact CG1-CG 4.32Å; V27-F31 WeakPolarHBondContact O-CB 3.45Å; V27-F31 WeakPolarHBondContact O-CD2 3.17Å; V27-F31 PolarHBondContact O-N 2.82Å; Y28-F31 PolarHBondContact O-N 3.39Å |
| 32 | I | 56.8 | Low | 58.3 | Low | 44 Ų | 44 | 89.6 Ų | 89.6 | 23% | 0.226 | 50% | 0.504 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -116.6 | -18 | -168.8 | -78.2 | 163.7 | 0 | 0 | 0 | 113.1 | Y28 K35 L36 F37 | Y28-I32 HydrophobicContact CD1-CB 4.13Å; Y28-I32 HydrophobicContact CD1-CD1 3.94Å; Y28-I32 HydrophobicContact CD1-CG2 3.63Å; Y28-I32 HydrophobicContact CD2-CD1 3.41Å; Y28-I32 VanDerWaalsContact CD2-CD1 3.41Å; Y28-I32 HydrophobicContact CE1-CB 4.43Å; Y28-I32 HydrophobicContact CE1-CD1 3.91Å; Y28-I32 HydrophobicContact CE1-CG2 3.66Å; Y28-I32 HydrophobicContact CE2-CD1 3.35Å; Y28-I32 HydrophobicContact CG-CB 4.37Å; Y28-I32 HydrophobicContact CG-CD1 3.69Å; Y28-I32 HydrophobicContact CG-CG2 4.34Å; Y28-I32 WeakPolarHBondContact O-CA 3.38Å; Y28-I32 WeakPolarHBondContact O-CB 3.36Å; Y28-I32 PolarHBondContact O-N 3.15Å; I32-K35 PolarHBondContact O-N 3.37Å; I32-L36 HydrophobicContact CB-CD1 4.05Å; I32-L36 HydrophobicContact CB-CG 4.19Å; I32-L36 HydrophobicContact CD1-CD1 3.97Å; I32-L36 HydrophobicContact CG1-CD1 3.85Å; I32-L36 HydrophobicContact CG1-CG 4.02Å; I32-L36 HydrophobicContact CG2-CB 3.67Å; I32-L36 HydrophobicContact CG2-CD1 3.15Å; I32-L36 HydrophobicContact CG2-CG 3.49Å; I32-L36 VanDerWaalsContact CG2-CG 3.49Å; I32-L36 PolarHBondContact O-N 2.85Å; I32-F37 PolarHBondContact O-N 3.43Å |
| 33 | H | 53.2 | Low | 57 | Low | 119 Ų | 119 | 92.2 Ų | 92.2 | 55% | 0.551 | 51% | 0.51 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.5 | -16.1 | 172.8 | -101.1 | -67.7 | 0 | 0 | 0 | 116.6 | P29 F37 | P29-H33 WeakPolarHBondContact O-CB 3.31Å; H33-F37 AromaticContact CE1-CE2 3.9Å; H33-F37 AromaticContact ND1-CD2 3.74Å; H33-F37 AromaticContact ND1-CE2 3.73Å; H33-F37 WeakPolarHBondContact O-CB 3.33Å |
| 34 | P | 55.8 | Low | 55.6 | Low | 84 Ų | 84 | 100.5 Ų | 100.5 | 55% | 0.545 | 53% | 0.532 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -106.3 | -20.5 | 164.8 | 4.9 | 14.1 | 0 | 0 | 0 | 113.6 | S38 | P34-S38 WeakPolarHBondContact O-CB 3.37Å; P34-S38 PolarHBondContact O-OG 3.37Å |
| 35 | K | 55.1 | Low | 54.4 | Low | 132 Ų | 132 | 106.1 Ų | 106.1 | 57% | 0.574 | 55% | 0.551 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.8 | -35.8 | -171.4 | -71.4 | -153.1 | 174.9 | -176.5 | 0 | 115.8 | I32 A39 | I32-K35 PolarHBondContact O-N 3.37Å; K35-A39 VanDerWaalsContact O-CB 3.27Å; K35-A39 WeakPolarHBondContact O-CB 3.24Å; K35-A39 PolarHBondContact O-N 2.83Å; K35-A39 VanDerWaalsContact O-N 3.1Å |
| 36 | L | 53.4 | Low | 53.1 | Low | 63 Ų | 63 | 107.9 Ų | 107.9 | 33% | 0.33 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -82.5 | -24.5 | 165 | -60.6 | 175.9 | 0 | 0 | 0 | 111.2 | Y28 I32 S38 A39 L40 | Y28-L36 HydrophobicContact CE1-CD1 4.2Å; I32-L36 HydrophobicContact CB-CD1 4.05Å; I32-L36 HydrophobicContact CB-CG 4.19Å; I32-L36 HydrophobicContact CD1-CD1 3.97Å; I32-L36 HydrophobicContact CG1-CD1 3.85Å; I32-L36 HydrophobicContact CG1-CG 4.02Å; I32-L36 HydrophobicContact CG2-CB 3.67Å; I32-L36 HydrophobicContact CG2-CD1 3.15Å; I32-L36 HydrophobicContact CG2-CG 3.49Å; I32-L36 VanDerWaalsContact CG2-CG 3.49Å; I32-L36 PolarHBondContact O-N 2.85Å; L36-S38 PolarHBondContact O-N 3.39Å; L36-A39 PolarHBondContact O-N 2.85Å; L36-L40 HydrophobicContact CB-CD1 4.22Å; L36-L40 VanDerWaalsContact O-CB 3.25Å; L36-L40 WeakPolarHBondContact O-CB 3.22Å; L36-L40 PolarHBondContact O-N 2.88Å |
| 37 | F | 52.5 | Low | 52.3 | Low | 99 Ų | 99 | 110.3 Ų | 110.3 | 43% | 0.434 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -68.3 | -21.1 | 170.1 | -117.7 | -92.9 | 0 | 0 | 0 | 113.3 | I32 H33 F43 | I32-F37 PolarHBondContact O-N 3.43Å; H33-F37 AromaticContact CE1-CE2 3.9Å; H33-F37 AromaticContact ND1-CD2 3.74Å; H33-F37 AromaticContact ND1-CE2 3.73Å; H33-F37 WeakPolarHBondContact O-CB 3.33Å; F37-F43 HydrophobicContact CD1-CB 4.21Å; F37-F43 HydrophobicContact CD1-CD2 4.06Å; F37-F43 HydrophobicContact CD1-CG 4.46Å; F37-F43 HydrophobicContact CE1-CB 3.86Å; F37-F43 AromaticContact CE1-CD2 3.22Å; F37-F43 HydrophobicContact CE1-CD2 3.22Å; F37-F43 AromaticContact CE1-CE2 3.89Å; F37-F43 HydrophobicContact CE1-CE2 3.89Å; F37-F43 AromaticContact CE1-CG 3.67Å; F37-F43 HydrophobicContact CE1-CG 3.67Å; F37-F43 AromaticContact CZ-CD2 3.59Å; F37-F43 HydrophobicContact CZ-CD2 3.59Å; F37-F43 AromaticContact CZ-CE2 3.76Å; F37-F43 HydrophobicContact CZ-CE2 3.76Å; F37-F43 HydrophobicContact CZ-CG 4.37Å |
| 38 | S | 53 | Low | 51.1 | Low | 104 Ų | 104 | 114.1 Ų | 114.1 | 73% | 0.727 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -94.7 | -25.1 | 169 | -83.7 | 0 | 0 | 0 | 0 | 114.3 | P34 L36 | P34-S38 WeakPolarHBondContact O-CB 3.37Å; P34-S38 PolarHBondContact O-OG 3.37Å; L36-S38 PolarHBondContact O-N 3.39Å |
| 39 | A | 57 | Low | 50.3 | Low | 78 Ų | 78 | 113.6 Ų | 113.6 | 65% | 0.645 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -90 | -28.4 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | K35 L36 | K35-A39 VanDerWaalsContact O-CB 3.27Å; K35-A39 WeakPolarHBondContact O-CB 3.24Å; K35-A39 PolarHBondContact O-N 2.83Å; K35-A39 VanDerWaalsContact O-N 3.1Å; L36-A39 PolarHBondContact O-N 2.85Å |
| 40 | L | 52.5 | Low | 49.4 | Very low | 107 Ų | 107 | 119.8 Ų | 119.8 | 56% | 0.56 | 62% | 0.618 | S | S | * | * | S | Bend | trans | -94.6 | 88.8 | 164.7 | -64.2 | 160.5 | 0 | 0 | 0 | 106.3 | L36 L42 | L36-L40 HydrophobicContact CB-CD1 4.22Å; L36-L40 VanDerWaalsContact O-CB 3.25Å; L36-L40 WeakPolarHBondContact O-CB 3.22Å; L36-L40 PolarHBondContact O-N 2.88Å; L40-L42 PolarHBondContact O-N 3.44Å |
| 41 | G | 47.7 | Very low | 48.7 | Very low | 67 Ų | 67 | 121.2 Ų | 121.2 | 69% | 0.691 | 63% | 0.625 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.5 | 42.8 | -177.1 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||
| 42 | L | 47.8 | Very low | 47.9 | Very low | 143 Ų | 143 | 124.4 Ų | 124.4 | 75% | 0.749 | 65% | 0.646 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.2 | -6.8 | -175.8 | -84.6 | 152.5 | 0 | 0 | 0 | 113.9 | L40 | L40-L42 PolarHBondContact O-N 3.44Š|
| 43 | F | 45.1 | Very low | 47.3 | Very low | 129 Ų | 129 | 129.2 Ų | 129.2 | 57% | 0.566 | 67% | 0.672 | S | S | * | * | trans | -119.4 | 62.6 | 165 | -72.5 | -82.6 | 0 | 0 | 0 | 110.9 | F37 Q45 | F37-F43 HydrophobicContact CD1-CB 4.21Å; F37-F43 HydrophobicContact CD1-CD2 4.06Å; F37-F43 HydrophobicContact CD1-CG 4.46Å; F37-F43 HydrophobicContact CE1-CB 3.86Å; F37-F43 AromaticContact CE1-CD2 3.22Å; F37-F43 HydrophobicContact CE1-CD2 3.22Å; F37-F43 AromaticContact CE1-CE2 3.89Å; F37-F43 HydrophobicContact CE1-CE2 3.89Å; F37-F43 AromaticContact CE1-CG 3.67Å; F37-F43 HydrophobicContact CE1-CG 3.67Å; F37-F43 AromaticContact CZ-CD2 3.59Å; F37-F43 HydrophobicContact CZ-CD2 3.59Å; F37-F43 AromaticContact CZ-CE2 3.76Å; F37-F43 HydrophobicContact CZ-CE2 3.76Å; F37-F43 HydrophobicContact CZ-CG 4.37Å; F43-Q45 PolarHBondContact O-N 2.8Å | ||
| 44 | R | 38.7 | Very low | 46.9 | Very low | 229 Ų | 229 | 128.6 Ų | 128.6 | 86% | 0.864 | 68% | 0.677 | S | S | * | * | trans | -66.7 | 60 | 150 | -167.1 | -176 | -173.7 | 179.5 | 2 | 108.5 | K46 | R44-K46 PolarHBondContact O-N 3.47Š| ||
| 45 | Q | 43.3 | Very low | 46.1 | Very low | 163 Ų | 163 | 134.5 Ų | 134.5 | 76% | 0.762 | 69% | 0.688 | S | S | * | * | trans | -80.8 | 85.1 | 163.9 | -96.4 | -171.9 | -26.7 | 0 | 0 | 107.2 | F43 | F43-Q45 PolarHBondContact O-N 2.8Š| ||
| 46 | K | 41.6 | Very low | 45.4 | Very low | 128 Ų | 128 | 135.2 Ų | 135.2 | 56% | 0.557 | 70% | 0.698 | S | S | * | * | trans | -39.2 | 122.2 | 157.4 | -144.3 | 172 | 174.8 | -156.8 | 0 | 108.2 | R44 E48 | R44-K46 PolarHBondContact O-N 3.47Å; K46-E48 HydrophobicContact CB-CG 3.87Å; K46-E48 HydrophobicContact CD-CG 3.43Å; K46-E48 VanDerWaalsContact CD-CG 3.43Å; K46-E48 WeakPolarHBondContact CD-OE2 3.31Å; K46-E48 WeakPolarHBondContact CE-OE1 3.27Å; K46-E48 WeakPolarHBondContact CE-OE2 3.27Å; K46-E48 HydrophobicContact CG-CG 3.4Å; K46-E48 IonicContact NZ-OE1 2.8Å; K46-E48 PolarHBondContact NZ-OE1 2.82Å; K46-E48 IonicContact NZ-OE2 2.61Å; K46-E48 PolarHBondContact NZ-OE2 3.22Å; K46-E48 PolarHBondContact O-N 3.17Å | ||
| 47 | P | 46.5 | Very low | 44.7 | Very low | 133 Ų | 133 | 135.7 Ų | 135.7 | 86% | 0.864 | 72% | 0.718 | S | S | * | * | trans | -73.2 | 81 | 161.2 | 29.8 | -27.7 | 0 | 0 | 0 | 106.4 | ||||
| 48 | E | 38.9 | Very low | 44.2 | Very low | 124 Ų | 124 | 141.3 Ų | 141.3 | 58% | 0.579 | 74% | 0.736 | S | S | * | * | trans | -100.6 | 107.4 | 163.3 | -56.9 | -152.7 | 126 | 0 | 0 | 107.5 | K46 | K46-E48 HydrophobicContact CB-CG 3.87Å; K46-E48 HydrophobicContact CD-CG 3.43Å; K46-E48 VanDerWaalsContact CD-CG 3.43Å; K46-E48 WeakPolarHBondContact CD-OE2 3.31Å; K46-E48 WeakPolarHBondContact CE-OE1 3.27Å; K46-E48 WeakPolarHBondContact CE-OE2 3.27Å; K46-E48 HydrophobicContact CG-CG 3.4Å; K46-E48 IonicContact NZ-OE1 2.8Å; K46-E48 PolarHBondContact NZ-OE1 2.82Å; K46-E48 IonicContact NZ-OE2 2.61Å; K46-E48 PolarHBondContact NZ-OE2 3.22Å; K46-E48 PolarHBondContact O-N 3.17Å | ||
| 49 | T | 41.6 | Very low | 43.8 | Very low | 123 Ų | 123 | 143.9 Ų | 143.9 | 76% | 0.755 | 74% | 0.737 | S | S | * | * | trans | -167.3 | 57.1 | 151.8 | 9.8 | 0 | 0 | 0 | 0 | 107 | F51 | T49-F51 PolarHBondContact O-N 3.28Š| ||
| 50 | E | 44.6 | Very low | 42.9 | Very low | 192 Ų | 192 | 149 Ų | 149 | 90% | 0.897 | 75% | 0.748 | S | S | * | * | trans | -76.3 | 112.4 | 154.9 | -167.1 | 170.2 | -168.8 | 0 | 0 | 105.3 | D52 | E50-D52 PolarHBondContact O-N 2.93Å; E50-D52 VanDerWaalsContact O-N 3.1Å | ||
| 51 | F | 42.7 | Very low | 42.4 | Very low | 191 Ų | 191 | 149.1 Ų | 149.1 | 84% | 0.838 | 76% | 0.755 | S | S | * | * | trans | -62.4 | 109 | 178.1 | -83 | -99.4 | 0 | 0 | 0 | 108.9 | T49 D53 | T49-F51 PolarHBondContact O-N 3.28Å; F51-D53 PolarHBondContact O-N 3.49Å | ||
| 52 | D | 38.2 | Very low | 42 | Very low | 161 Ų | 161 | 156.6 Ų | 156.6 | 86% | 0.861 | 76% | 0.762 | S | S | * | * | trans | -72.9 | 103.7 | 168.7 | -152.5 | -8.1 | 0 | 0 | 0 | 107.4 | E50 | E50-D52 PolarHBondContact O-N 2.93Å; E50-D52 VanDerWaalsContact O-N 3.1Å | ||
| 53 | D | 44.7 | Very low | 41.7 | Very low | 144 Ų | 144 | 156.8 Ų | 156.8 | 77% | 0.77 | 76% | 0.763 | S | S | * | * | trans | -136.5 | 109 | 165 | -129.8 | -5 | 0 | 0 | 0 | 109.6 | F51 | F51-D53 PolarHBondContact O-N 3.49Š| ||
| 54 | V | 44.1 | Very low | 41.7 | Very low | 107 Ų | 107 | 159 Ų | 159 | 65% | 0.648 | 78% | 0.775 | S | S | * | * | trans | 80.5 | 91.8 | 144.6 | -171.8 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 55 | R | 38.5 | Very low | 41.8 | Very low | 208 Ų | 208 | 156.6 Ų | 156.6 | 79% | 0.785 | 77% | 0.774 | S | S | * | * | 87.9 | 117.4 | 111.5 | -167.7 | 173.4 | -175.6 | 172.3 | 2.2 | 118.1 | |||||
| 56 | N | 40.3 | Very low | 41.7 | Very low | 147 Ų | 147 | 154.8 Ų | 154.8 | 79% | 0.786 | 77% | 0.774 | S | S | * | * | trans | 80.1 | 115.3 | 145.7 | -69.6 | -7.5 | 0 | 0 | 0 | 118.7 | ||||
| 57 | G | 38.8 | Very low | 41.5 | Very low | 72 Ų | 72 | 156.7 Ų | 156.7 | 74% | 0.742 | 78% | 0.784 | S | S | * | * | 134.6 | 76.6 | 128.5 | 0 | 0 | 0 | 0 | 0 | 116.8 | |||||
| 58 | R | 41.7 | Very low | 41.3 | Very low | 217 Ų | 217 | 160.8 Ų | 160.8 | 82% | 0.819 | 78% | 0.783 | S | S | * | * | trans | 58.8 | 119.3 | 131.6 | -75.1 | -171.9 | 177.9 | -163 | 0.4 | 119.7 | ||||
| 59 | Q | 45.1 | Very low | 41.6 | Very low | 158 Ų | 158 | 160.1 Ų | 160.1 | 74% | 0.738 | 79% | 0.789 | S | S | * | * | 90.4 | 97.9 | 128.7 | -67.2 | 172.6 | -7.5 | 0 | 0 | 118.5 | |||||
| 60 | Q | 38.8 | Very low | 41.3 | Very low | 186 Ų | 186 | 162.5 Ų | 162.5 | 87% | 0.869 | 79% | 0.785 | S | S | * | * | -68.8 | 145.5 | 129.8 | -82.9 | -165.7 | -12.4 | 0 | 0 | 108.5 | |||||
| 61 | P | 42.7 | Very low | 41.3 | Very low | 110 Ų | 110 | 160.7 Ų | 160.7 | 71% | 0.714 | 78% | 0.782 | S | S | * | * | -153.6 | 151.5 | 82.6 | 35.3 | -13.7 | 0 | 0 | 0 | 117.6 | |||||
| 62 | R | 38 | Very low | 41.3 | Very low | 223 Ų | 223 | 157.8 Ų | 157.8 | 84% | 0.842 | 77% | 0.771 | S | S | * | * | trans | 28.4 | 132.4 | 138.7 | -67.7 | -175.5 | 174.2 | 160.3 | -1.3 | 121 | ||||
| 63 | L | 42.5 | Very low | 41.7 | Very low | 147 Ų | 147 | 157.3 Ų | 157.3 | 77% | 0.77 | 77% | 0.774 | S | S | * | * | trans | 51 | 106.7 | 141.5 | -84.3 | 95.3 | 0 | 0 | 0 | 117.9 | ||||
| 64 | Q | 44 | Very low | 41.4 | Very low | 175 Ų | 175 | 154 Ų | 154 | 82% | 0.818 | 77% | 0.773 | S | S | * | * | 169.3 | 109.5 | 119 | -90.9 | 165.3 | 35.9 | 0 | 0 | 105.6 | |||||
| 65 | Q | 40.6 | Very low | 41.1 | Very low | 179 Ų | 179 | 160.2 Ų | 160.2 | 84% | 0.836 | 79% | 0.785 | S | S | * | * | 56.6 | 125.7 | 96.8 | -100.6 | -172.8 | -18.4 | 0 | 0 | 113.2 | |||||
| 66 | V | 41.5 | Very low | 41.4 | Very low | 125 Ų | 125 | 160.1 Ų | 160.1 | 76% | 0.758 | 79% | 0.791 | S | S | * | * | trans | 108.4 | 117.3 | 152.4 | -165.7 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 67 | H | 38.2 | Very low | 41.5 | Very low | 168 Ų | 168 | 157.4 Ų | 157.4 | 78% | 0.778 | 79% | 0.788 | S | S | * | * | trans | 81.2 | 106.8 | 155.4 | -103.9 | -66.5 | 0 | 0 | 0 | 121.8 | ||||
| 68 | R | 42.1 | Very low | 41.5 | Very low | 220 Ų | 220 | 164.6 Ų | 164.6 | 83% | 0.83 | 80% | 0.795 | S | S | * | * | trans | -84.8 | 144.4 | 148.1 | -154.3 | -178.3 | -167.7 | 154.7 | 2.9 | 108.3 | ||||
| 69 | P | 44.3 | Very low | 41.6 | Very low | 110 Ų | 110 | 161.1 Ų | 161.1 | 71% | 0.714 | 79% | 0.792 | S | S | * | * | -142.6 | 133 | 105.2 | 30.4 | -12.3 | 0 | 0 | 0 | 111.5 | |||||
| 70 | Y | 36.2 | Very low | 41.9 | Very low | 172 Ų | 172 | 161.1 Ų | 161.1 | 68% | 0.675 | 79% | 0.792 | S | S | * | * | 58.3 | 99.8 | 95.2 | -143.5 | -91.4 | 0 | 0 | 0 | 114.6 | E72 | Y70-E72 HydrophobicContact CD1-CG 3.83Å; Y70-E72 HydrophobicContact CE1-CG 3.41Å; Y70-E72 VanDerWaalsContact CE1-CG 3.41Å | |||
| 71 | D | 44 | Very low | 42.7 | Very low | 155 Ų | 155 | 160 Ų | 160 | 83% | 0.829 | 79% | 0.791 | S | S | * | * | trans | -150.9 | 104.1 | 150.3 | -99.2 | -31.5 | 0 | 0 | 0 | 103.8 | ||||
| 72 | E | 43.5 | Very low | 43 | Very low | 130 Ų | 130 | 160.1 Ų | 160.1 | 61% | 0.607 | 79% | 0.792 | S | S | * | * | 53.6 | 123.1 | 80.3 | -64.6 | -159.4 | 154.6 | 0 | 0 | 114 | Y70 | Y70-E72 HydrophobicContact CD1-CG 3.83Å; Y70-E72 HydrophobicContact CE1-CG 3.41Å; Y70-E72 VanDerWaalsContact CE1-CG 3.41Å | |||
| 73 | T | 45.3 | Very low | 43.9 | Very low | 150 Ų | 150 | 157.2 Ų | 157.2 | 92% | 0.92 | 79% | 0.792 | S | S | * | * | trans | 87.5 | 132.3 | 169.9 | 76.6 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 74 | G | 40.1 | Very low | 44.1 | Very low | 74 Ų | 74 | 156.4 Ų | 156.4 | 76% | 0.763 | 79% | 0.789 | S | S | * | * | trans | 130.9 | 61.5 | 158.7 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 75 | R | 37.5 | Very low | 44.2 | Very low | 239 Ų | 239 | 158.4 Ų | 158.4 | 90% | 0.902 | 79% | 0.79 | S | S | * | * | trans | -48.9 | 155.1 | 164.3 | -68 | 172.1 | 167.7 | -173.9 | -4.1 | 112.6 | ||||
| 76 | K | 43.2 | Very low | 44.6 | Very low | 206 Ų | 206 | 152.8 Ų | 152.8 | 90% | 0.896 | 78% | 0.78 | S | S | * | * | trans | 111.2 | 133.7 | 159.4 | -63.5 | 166.6 | -177.8 | -175.5 | 0 | 112.1 | ||||
| 77 | A | 44.4 | Very low | 44.8 | Very low | 89 Ų | 89 | 150.5 Ų | 150.5 | 74% | 0.736 | 78% | 0.775 | S | S | * | * | cis | -162.7 | 154.3 | -3.8 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 78 | Y | 37.8 | Very low | 45.2 | Very low | 223 Ų | 223 | 151.5 Ų | 151.5 | 88% | 0.875 | 78% | 0.779 | S | S | * | * | trans | -40 | 131 | 167.2 | -73.4 | -100 | 0 | 0 | 0 | 114 | ||||
| 79 | D | 44.1 | Very low | 45.4 | Very low | 144 Ų | 144 | 149.2 Ų | 149.2 | 77% | 0.77 | 78% | 0.783 | S | S | * | * | trans | -179.1 | 131.9 | 146.7 | -76.8 | -34.1 | 0 | 0 | 0 | 100.5 | ||||
| 80 | H | 50.9 | Low | 45.6 | Very low | 159 Ų | 159 | 147.6 Ų | 147.6 | 74% | 0.736 | 78% | 0.778 | S | S | * | * | cis | -175.7 | 127.4 | 37 | 24.7 | -86.6 | 0 | 0 | 0 | 107.1 | ||||
| 81 | L | 55.9 | Low | 45.7 | Very low | 163 Ų | 163 | 142.4 Ų | 142.4 | 85% | 0.853 | 78% | 0.777 | S | S | * | * | trans | 64.1 | 130.3 | 155.3 | -68.7 | 90.1 | 0 | 0 | 0 | 121.4 | L83 | L81-L83 PolarHBondContact O-N 3.48Š| ||
| 82 | P | 49.3 | Very low | 45.9 | Very low | 111 Ų | 111 | 140.2 Ų | 140.2 | 72% | 0.721 | 77% | 0.771 | S | S | * | * | trans | -80.5 | 107.9 | 171.9 | 32.9 | -28.9 | 0 | 0 | 0 | 109.9 | N84 | P82-N84 PolarHBondContact O-N 2.94Å; P82-N84 VanDerWaalsContact O-N 3.17Å | ||
| 83 | L | 56 | Low | 46.1 | Very low | 162 Ų | 162 | 145.1 Ų | 145.1 | 85% | 0.848 | 78% | 0.784 | S | S | * | * | trans | -77.1 | 104.9 | 177.9 | -159.4 | 73.2 | 0 | 0 | 0 | 110.5 | L81 | L81-L83 PolarHBondContact O-N 3.48Š| ||
| 84 | N | 47.6 | Very low | 46.1 | Very low | 130 Ų | 130 | 148.2 Ų | 148.2 | 70% | 0.695 | 78% | 0.779 | S | S | * | * | trans | 62.5 | 90.4 | 156 | -80.7 | -49 | 0 | 0 | 0 | 118.4 | P82 G86 | P82-N84 PolarHBondContact O-N 2.94Å; P82-N84 VanDerWaalsContact O-N 3.17Å; N84-G86 PolarHBondContact O-N 2.91Å | ||
| 85 | Y | 45.9 | Very low | 46.7 | Very low | 218 Ų | 218 | 152.6 Ų | 152.6 | 86% | 0.855 | 78% | 0.78 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -48.1 | 110.4 | 142.6 | -72.3 | -94.4 | 0 | 0 | 0 | 110.2 | ||
| 86 | G | 47.8 | Very low | 47.5 | Very low | 60 Ų | 60 | 150.6 Ų | 150.6 | 62% | 0.619 | 78% | 0.777 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 163.5 | -22.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | N84 H88 | N84-G86 PolarHBondContact O-N 2.91Å; G86-H88 PolarHBondContact O-N 3.05Å |
| 87 | A | 46.3 | Very low | 48.1 | Very low | 78 Ų | 78 | 143.2 Ų | 143.2 | 65% | 0.645 | 76% | 0.76 | S | S | * | * | G | 310 helix | trans | -74.3 | -8.3 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | L89 A90 | A87-L89 VanDerWaalsContact C-N 3.31Å; A87-L89 PolarHBondContact O-N 2.73Å; A87-A90 PolarHBondContact O-N 2.88Å |
| 88 | H | 46.3 | Very low | 48.7 | Very low | 189 Ų | 189 | 147 Ų | 147 | 88% | 0.875 | 76% | 0.76 | S | S | * | * | G | 310 helix | trans | -80.1 | -1.3 | 178.4 | -80.3 | -83 | 0 | 0 | 0 | 115.1 | G86 | G86-H88 PolarHBondContact O-N 3.05Š|
| 89 | L | 46 | Very low | 49.4 | Very low | 172 Ų | 172 | 146 Ų | 146 | 90% | 0.901 | 76% | 0.755 | S | S | * | * | G | 310 helix | trans | -103.6 | -3.1 | 168 | -63.9 | 179.3 | 0 | 0 | 0 | 113.3 | A87 G91 | A87-L89 VanDerWaalsContact C-N 3.31Å; A87-L89 PolarHBondContact O-N 2.73Å; L89-G91 PolarHBondContact O-N 3.44Å |
| 90 | A | 48.9 | Very low | 50 | Low | 76 Ų | 76 | 143.3 Ų | 143.3 | 63% | 0.628 | 75% | 0.747 | S | S | * | * | trans | -90.2 | 38.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | A87 P92 | A87-A90 PolarHBondContact O-N 2.88Å; A90-P92 VanDerWaalsContact O-CD 3.31Å; A90-P92 WeakPolarHBondContact O-CD 3.34Å | ||
| 91 | G | 39.8 | Very low | 50.5 | Low | 62 Ų | 62 | 138.8 Ų | 138.8 | 64% | 0.639 | 73% | 0.733 | S | S | * | * | trans | -62 | 113.4 | 171.1 | 0 | 0 | 0 | 0 | 0 | 110 | L89 | L89-G91 PolarHBondContact O-N 3.44Š| ||
| 92 | P | 47.9 | Very low | 50.9 | Low | 110 Ų | 110 | 135.9 Ų | 135.9 | 71% | 0.714 | 72% | 0.718 | S | S | * | * | trans | -80 | 156.2 | -178 | 34.7 | -32.6 | 0 | 0 | 0 | 109.4 | A90 | A90-P92 VanDerWaalsContact O-CD 3.31Å; A90-P92 WeakPolarHBondContact O-CD 3.34Å | ||
| 93 | R | 46.7 | Very low | 51.4 | Low | 232 Ų | 232 | 136.3 Ų | 136.3 | 88% | 0.875 | 71% | 0.714 | S | S | * | * | trans | 68.2 | 92.6 | 159.2 | -66.7 | 170.6 | 160 | -140.3 | -4.8 | 116.3 | ||||
| 94 | R | 45 | Very low | 52.1 | Low | 216 Ų | 216 | 130.4 Ų | 130.4 | 82% | 0.815 | 69% | 0.685 | S | S | * | * | S | Bend | 174.2 | 130.8 | 124.5 | -90.6 | 154.4 | -172.3 | -170.2 | 1.6 | 108.1 | K96 | R94-K96 PolarHBondContact O-N 2.85Š| |
| 95 | E | 53.7 | Low | 53.2 | Low | 166 Ų | 166 | 130.7 Ų | 130.7 | 78% | 0.776 | 68% | 0.68 | S | S | * | * | S | Bend | trans | 83.6 | -4 | 155.5 | -58.1 | 160.3 | -136.9 | 0 | 0 | 121.7 | G97 | E95-G97 VanDerWaalsContact C-N 3.34Å; E95-G97 PolarHBondContact O-N 2.74Å |
| 96 | K | 53.7 | Low | 54.5 | Low | 197 Ų | 197 | 129 Ų | 129 | 86% | 0.857 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83 | 16.6 | -177.9 | -73.4 | 163.9 | 175.5 | 171.5 | 0 | 117.2 | R94 | R94-K96 PolarHBondContact O-N 2.85Š|
| 97 | G | 56.9 | Low | 55.7 | Low | 51 Ų | 51 | 127.2 Ų | 127.2 | 53% | 0.526 | 65% | 0.652 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -101 | -21.3 | -168.5 | 0 | 0 | 0 | 0 | 0 | 117.8 | E95 | E95-G97 VanDerWaalsContact C-N 3.34Å; E95-G97 PolarHBondContact O-N 2.74Å |
| 98 | F | 56.2 | Low | 57.1 | Low | 169 Ų | 169 | 128.8 Ų | 128.8 | 74% | 0.741 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -77.3 | -39.6 | -170.7 | -71.9 | -82 | 0 | 0 | 0 | 113.2 | S100 S101 L102 | F98-S100 PolarHBondContact O-N 3.24Å; F98-S101 PolarHBondContact O-N 3.38Å; F98-S101 VanDerWaalsContact O-N 3.16Å; F98-L102 PolarHBondContact O-N 2.81Å |
| 99 | W | 51.7 | Low | 58.8 | Low | 202 Ų | 202 | 121.5 Ų | 121.5 | 77% | 0.765 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -67.4 | -35.6 | -178.3 | -62.1 | 90 | 0 | 0 | 0 | 112.6 | S101 L102 L103 | W99-S101 VanDerWaalsContact C-N 3.25Å; W99-S101 PolarHBondContact O-N 2.94Å; W99-L102 PolarHBondContact O-N 3.01Å; W99-L103 VanDerWaalsContact O-CD1 3.23Å; W99-L103 WeakPolarHBondContact O-CD1 3.47Å; W99-L103 PolarHBondContact O-N 2.96Å |
| 100 | S | 58.2 | Low | 60.5 | Low | 87 Ų | 87 | 116.3 Ų | 116.3 | 61% | 0.608 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -71.8 | -20.9 | 176.3 | -165.5 | 0 | 0 | 0 | 0 | 113.1 | F98 | F98-S100 PolarHBondContact O-N 3.24Å |
| 101 | S | 60.9 | Low | 61.9 | Low | 63 Ų | 63 | 116.3 Ų | 116.3 | 44% | 0.441 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -84.9 | -30 | 172.5 | -164.1 | 0 | 0 | 0 | 0 | 111.9 | F98 W99 P104 F105 | F98-S101 PolarHBondContact O-N 3.38Å; F98-S101 VanDerWaalsContact O-N 3.16Å; W99-S101 VanDerWaalsContact C-N 3.25Å; W99-S101 PolarHBondContact O-N 2.94Å; S101-P104 WeakPolarHBondContact O-CD 3.45Å; S101-P104 WeakPolarHBondContact O-CG 3.32Å; S101-F105 VanDerWaalsContact O-CD2 3.28Å; S101-F105 WeakPolarHBondContact O-CD2 3.42Å |
| 102 | L | 63.8 | Low | 63.7 | Low | 103 Ų | 103 | 116.2 Ų | 116.2 | 54% | 0.539 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -77.1 | -27.2 | -179.4 | -158.2 | 69.6 | 0 | 0 | 0 | 113.5 | F98 W99 F105 Y106 | F98-L102 PolarHBondContact O-N 2.81Å; W99-L102 PolarHBondContact O-N 3.01Å; L102-F105 HydrophobicContact CD1-CB 4.36Å; L102-F105 PolarHBondContact O-N 2.87Å; L102-Y106 PolarHBondContact O-N 2.9Å |
| 103 | L | 60.8 | Low | 65.3 | Low | 120 Ų | 120 | 117.3 Ų | 117.3 | 63% | 0.628 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -47.1 | -50.8 | 175.3 | -107.6 | 85.4 | 0 | 0 | 0 | 114.1 | W99 Y106 S107 | W99-L103 VanDerWaalsContact O-CD1 3.23Å; W99-L103 WeakPolarHBondContact O-CD1 3.47Å; W99-L103 PolarHBondContact O-N 2.96Å; L103-Y106 PolarHBondContact O-N 3.01Å; L103-S107 PolarHBondContact O-N 3.45Å |
| 104 | P | 69.3 | Low | 66.8 | Low | 38 Ų | 38 | 111.1 Ų | 111.1 | 25% | 0.247 | 56% | 0.559 | C | S | . | * | H | α-helix | trans | -71 | -24.4 | 177.6 | 25.2 | -35 | 0 | 0 | 0 | 114.3 | S101 S107 I108 | S101-P104 WeakPolarHBondContact O-CD 3.45Å; S101-P104 WeakPolarHBondContact O-CG 3.32Å; P104-S107 WeakPolarHBondContact CA-OG 3.46Å; P104-S107 PolarHBondContact O-OG 3.38Å; P104-I108 WeakPolarHBondContact O-CB 3.39Å; P104-I108 PolarHBondContact O-N 3.28Å |
| 105 | F | 72 | Confident | 68.4 | Low | 136 Ų | 136 | 103.2 Ų | 103.2 | 60% | 0.596 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -70.9 | -36 | 173.6 | -76.3 | -77.9 | 0 | 0 | 0 | 111.5 | S101 L102 G109 | S101-F105 VanDerWaalsContact O-CD2 3.28Å; S101-F105 WeakPolarHBondContact O-CD2 3.42Å; L102-F105 HydrophobicContact CD1-CB 4.36Å; L102-F105 PolarHBondContact O-N 2.87Å; F105-G109 PolarHBondContact O-N 2.84Å |
| 106 | Y | 72.4 | Confident | 69.6 | Low | 181 Ų | 181 | 101.5 Ų | 101.5 | 71% | 0.71 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -64.9 | -42.9 | 174.1 | -172.9 | -97.9 | 0 | 0 | 0 | 111.5 | L102 L103 G109 V110 | L102-Y106 PolarHBondContact O-N 2.9Å; L103-Y106 PolarHBondContact O-N 3.01Å; Y106-G109 PolarHBondContact O-N 3.26Å; Y106-V110 HydrophobicContact CD1-CG2 4.07Å; Y106-V110 HydrophobicContact CE1-CG2 3.71Å; Y106-V110 WeakPolarHBondContact O-CG2 3.42Å; Y106-V110 PolarHBondContact O-N 3.26Å |
| 107 | S | 72.6 | Confident | 70.6 | Confident | 24 Ų | 24 | 94.4 Ų | 94.4 | 17% | 0.168 | 50% | 0.501 | C | S | . | . | H | α-helix | trans | -65.9 | -43 | 177.3 | 64.8 | 0 | 0 | 0 | 0 | 112.2 | L103 P104 G109 V110 I111 | L103-S107 PolarHBondContact O-N 3.45Å; P104-S107 WeakPolarHBondContact CA-OG 3.46Å; P104-S107 PolarHBondContact O-OG 3.38Å; S107-G109 VanDerWaalsContact C-N 3.28Å; S107-G109 PolarHBondContact O-N 3.3Å; S107-V110 PolarHBondContact O-N 2.93Å; S107-I111 WeakPolarHBondContact O-CD1 3.42Å; S107-I111 WeakPolarHBondContact O-CG1 3.48Å; S107-I111 PolarHBondContact O-N 2.9Å |
| 108 | I | 77.2 | Confident | 71.5 | Confident | 110 Ų | 110 | 95.6 Ų | 95.6 | 56% | 0.564 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -59 | -41.7 | 172.9 | -113.7 | 70.2 | 0 | 0 | 0 | 111.1 | P104 I111 A112 | P104-I108 WeakPolarHBondContact O-CB 3.39Å; P104-I108 PolarHBondContact O-N 3.28Å; I108-I111 PolarHBondContact O-N 3Å; I108-A112 VanDerWaalsContact O-CB 3.3Å; I108-A112 WeakPolarHBondContact O-CB 3.23Å; I108-A112 PolarHBondContact O-N 2.93Å |
| 109 | G | 81.7 | Confident | 72.4 | Confident | 37 Ų | 37 | 91.3 Ų | 91.3 | 38% | 0.381 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -63.6 | -45.2 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | F105 Y106 S107 I111 A112 F113 | F105-G109 PolarHBondContact O-N 2.84Å; Y106-G109 PolarHBondContact O-N 3.26Å; S107-G109 VanDerWaalsContact C-N 3.28Å; S107-G109 PolarHBondContact O-N 3.3Å; G109-I111 PolarHBondContact O-N 3.26Å; G109-A112 PolarHBondContact O-N 2.88Å; G109-F113 WeakPolarHBondContact O-CB 3.29Å; G109-F113 PolarHBondContact O-N 3.35Å |
| 110 | V | 80.1 | Confident | 73.4 | Confident | 62 Ų | 62 | 86.9 Ų | 86.9 | 38% | 0.376 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -63.1 | -42.1 | 175.9 | 174.2 | 0 | 0 | 0 | 0 | 110.9 | Y106 S107 F113 L114 | Y106-V110 HydrophobicContact CD1-CG2 4.07Å; Y106-V110 HydrophobicContact CE1-CG2 3.71Å; Y106-V110 WeakPolarHBondContact O-CG2 3.42Å; Y106-V110 PolarHBondContact O-N 3.26Å; S107-V110 PolarHBondContact O-N 2.93Å; V110-F113 PolarHBondContact O-N 3.47Å; V110-L114 WeakPolarHBondContact O-CB 3.37Å; V110-L114 PolarHBondContact O-N 2.96Å |
| 111 | I | 78.9 | Confident | 73.9 | Confident | 77 Ų | 77 | 86.8 Ų | 86.8 | 40% | 0.395 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -65.7 | -45.2 | 178.1 | -65.3 | 160.8 | 0 | 0 | 0 | 110.8 | V27 S107 I108 G109 F113 L114 A115 | V27-I111 HydrophobicContact CG1-CD1 4.44Å; S107-I111 WeakPolarHBondContact O-CD1 3.42Å; S107-I111 WeakPolarHBondContact O-CG1 3.48Å; S107-I111 PolarHBondContact O-N 2.9Å; I108-I111 PolarHBondContact O-N 3Å; G109-I111 PolarHBondContact O-N 3.26Å; I111-F113 VanDerWaalsContact C-N 3.35Å; I111-L114 PolarHBondContact O-N 2.89Å; I111-A115 WeakPolarHBondContact O-CB 3.35Å; I111-A115 PolarHBondContact O-N 3.48Å |
| 112 | A | 78.6 | Confident | 74.1 | Confident | 60 Ų | 60 | 88 Ų | 88 | 50% | 0.496 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -63.8 | -40.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | I108 G109 A115 Y116 | I108-A112 VanDerWaalsContact O-CB 3.3Å; I108-A112 WeakPolarHBondContact O-CB 3.23Å; I108-A112 PolarHBondContact O-N 2.93Å; G109-A112 PolarHBondContact O-N 2.88Å; A112-A115 PolarHBondContact O-N 2.73Å; A112-Y116 VanDerWaalsContact O-CB 3.24Å; A112-Y116 WeakPolarHBondContact O-CB 3.39Å; A112-Y116 PolarHBondContact O-N 2.86Å |
| 113 | F | 80.1 | Confident | 73.9 | Confident | 133 Ų | 133 | 89.5 Ų | 89.5 | 58% | 0.583 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -66.5 | -39.2 | 175.6 | -177.2 | -99.5 | 0 | 0 | 0 | 112.1 | G109 V110 I111 Y116 T117 | G109-F113 WeakPolarHBondContact O-CB 3.29Å; G109-F113 PolarHBondContact O-N 3.35Å; V110-F113 PolarHBondContact O-N 3.47Å; I111-F113 VanDerWaalsContact C-N 3.35Å; F113-Y116 PolarHBondContact O-N 3.29Å; F113-T117 VanDerWaalsContact O-CB 3.3Å; F113-T117 WeakPolarHBondContact O-CB 3.2Å; F113-T117 PolarHBondContact O-N 3.41Å; F113-T117 PolarHBondContact O-OG1 2.71Å |
| 114 | L | 79.5 | Confident | 73.7 | Confident | 101 Ų | 101 | 90.7 Ų | 90.7 | 53% | 0.529 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -65.3 | -47.3 | 174.4 | -126.1 | 70.6 | 0 | 0 | 0 | 110.9 | V110 I111 Y116 T117 L118 | V110-L114 WeakPolarHBondContact O-CB 3.37Å; V110-L114 PolarHBondContact O-N 2.96Å; I111-L114 PolarHBondContact O-N 2.89Å; L114-Y116 VanDerWaalsContact C-N 3.34Å; L114-Y116 PolarHBondContact O-N 2.89Å; L114-T117 PolarHBondContact O-N 2.91Å; L114-L118 WeakPolarHBondContact O-CB 3.41Å; L114-L118 WeakPolarHBondContact O-CG 3.32Å; L114-L118 PolarHBondContact O-N 3.15Å |
| 115 | A | 78.9 | Confident | 72.9 | Confident | 51 Ų | 51 | 93.1 Ų | 93.1 | 42% | 0.421 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -59.5 | -45.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | I111 A112 L118 S119 | I111-A115 WeakPolarHBondContact O-CB 3.35Å; I111-A115 PolarHBondContact O-N 3.48Å; A112-A115 PolarHBondContact O-N 2.73Å; A115-L118 PolarHBondContact O-N 2.91Å; A115-S119 VanDerWaalsContact O-CB 3.29Å; A115-S119 WeakPolarHBondContact O-CB 3.3Å; A115-S119 PolarHBondContact O-N 2.89Å; A115-S119 PolarHBondContact O-OG 3.26Å; A115-S119 VanDerWaalsContact O-OG 3.07Å |
| 116 | Y | 77.6 | Confident | 72.1 | Confident | 129 Ų | 129 | 92.5 Ų | 92.5 | 51% | 0.506 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -61.3 | -46.7 | 175.5 | 172.9 | -100.1 | 0 | 0 | 0 | 112.2 | A112 F113 L114 L118 S119 K120 | A112-Y116 VanDerWaalsContact O-CB 3.24Å; A112-Y116 WeakPolarHBondContact O-CB 3.39Å; A112-Y116 PolarHBondContact O-N 2.86Å; F113-Y116 PolarHBondContact O-N 3.29Å; L114-Y116 VanDerWaalsContact C-N 3.34Å; L114-Y116 PolarHBondContact O-N 2.89Å; Y116-L118 VanDerWaalsContact C-N 3.32Å; Y116-L118 PolarHBondContact O-N 2.92Å; Y116-S119 PolarHBondContact O-N 2.71Å; Y116-K120 HydrophobicContact CE1-CD 3.84Å; Y116-K120 WeakPolarHBondContact O-CB 3.41Å; Y116-K120 PolarHBondContact O-N 3.42Å; Y116-K120 PolarHBondContact OH-NZ 2.92Å |
| 117 | T | 76.1 | Confident | 71.1 | Confident | 49 Ų | 49 | 88.9 Ų | 88.9 | 30% | 0.301 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -63.2 | -41.7 | 179.7 | -57.4 | 0 | 0 | 0 | 0 | 110.6 | F113 L114 M121 | F113-T117 VanDerWaalsContact O-CB 3.3Å; F113-T117 WeakPolarHBondContact O-CB 3.2Å; F113-T117 PolarHBondContact O-N 3.41Å; F113-T117 PolarHBondContact O-OG1 2.71Å; L114-T117 PolarHBondContact O-N 2.91Å; T117-M121 HydrophobicContact CG2-SD 4.44Å; T117-M121 WeakPolarHBondContact O-CB 3.36Å; T117-M121 VanDerWaalsContact O-CG 3.25Å; T117-M121 WeakPolarHBondContact O-CG 3.46Å; T117-M121 PolarHBondContact O-N 3.35Å |
| 118 | L | 75 | Confident | 70 | Confident | 76 Ų | 76 | 93.8 Ų | 93.8 | 40% | 0.398 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -66.8 | -50.8 | 175.6 | -69.4 | 170.7 | 0 | 0 | 0 | 111 | L114 A115 Y116 K120 M121 W122 | L114-L118 WeakPolarHBondContact O-CB 3.41Å; L114-L118 WeakPolarHBondContact O-CG 3.32Å; L114-L118 PolarHBondContact O-N 3.15Å; A115-L118 PolarHBondContact O-N 2.91Å; Y116-L118 VanDerWaalsContact C-N 3.32Å; Y116-L118 PolarHBondContact O-N 2.92Å; L118-K120 VanDerWaalsContact C-N 3.28Å; L118-K120 PolarHBondContact O-N 3.1Å; L118-M121 CarbonylContact O-C 3.52Å; L118-M121 PolarHBondContact O-N 3.03Å; L118-M121 VanDerWaalsContact O-N 3.1Å; L118-W122 WeakPolarHBondContact O-CB 3.39Å; L118-W122 PolarHBondContact O-N 2.93Å |
| 119 | S | 75.8 | Confident | 68.5 | Low | 79 Ų | 79 | 91.9 Ų | 91.9 | 55% | 0.552 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -58.2 | -39.4 | 176.2 | -67.8 | 0 | 0 | 0 | 0 | 112.3 | A115 Y116 W122 L123 | A115-S119 VanDerWaalsContact O-CB 3.29Å; A115-S119 WeakPolarHBondContact O-CB 3.3Å; A115-S119 PolarHBondContact O-N 2.89Å; A115-S119 PolarHBondContact O-OG 3.26Å; A115-S119 VanDerWaalsContact O-OG 3.07Å; Y116-S119 PolarHBondContact O-N 2.71Å; S119-W122 PolarHBondContact O-N 2.86Å; S119-L123 VanDerWaalsContact O-CB 3.29Å; S119-L123 WeakPolarHBondContact O-CB 3.48Å; S119-L123 PolarHBondContact O-N 3.03Å |
| 120 | K | 72.3 | Confident | 66.9 | Low | 108 Ų | 108 | 95.9 Ų | 95.9 | 47% | 0.47 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -67.9 | -36.8 | 176.4 | -170.7 | 176.4 | -170.6 | 172.3 | 0 | 112.1 | Y116 L118 K124 | Y116-K120 HydrophobicContact CE1-CD 3.84Å; Y116-K120 WeakPolarHBondContact O-CB 3.41Å; Y116-K120 PolarHBondContact O-N 3.42Å; Y116-K120 PolarHBondContact OH-NZ 2.92Å; L118-K120 VanDerWaalsContact C-N 3.28Å; L118-K120 PolarHBondContact O-N 3.1Å; K120-K124 PolarHBondContact O-N 2.87Å |
| 121 | M | 68.2 | Low | 65.1 | Low | 85 Ų | 85 | 102.8 Ų | 102.8 | 42% | 0.419 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -70.5 | -37.3 | 172.7 | -75.6 | -177 | 62.8 | 0 | 0 | 112.2 | T117 L118 K124 T125 | T117-M121 HydrophobicContact CG2-SD 4.44Å; T117-M121 WeakPolarHBondContact O-CB 3.36Å; T117-M121 VanDerWaalsContact O-CG 3.25Å; T117-M121 WeakPolarHBondContact O-CG 3.46Å; T117-M121 PolarHBondContact O-N 3.35Å; L118-M121 CarbonylContact O-C 3.52Å; L118-M121 PolarHBondContact O-N 3.03Å; L118-M121 VanDerWaalsContact O-N 3.1Å; M121-K124 PolarHBondContact O-N 2.81Å; M121-T125 PolarHBondContact O-N 3.33Å; M121-T125 PolarHBondContact O-OG1 3.42Å |
| 122 | W | 64.6 | Low | 63.4 | Low | 90 Ų | 90 | 104 Ų | 104 | 34% | 0.341 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -72.6 | -42.5 | -179.6 | -79.3 | 50.1 | 0 | 0 | 0 | 111.7 | T13 V16 L118 S119 K124 T125 D126 | T13-W122 HydrophobicContact CG2-CH2 4.23Å; T13-W122 HydrophobicContact CG2-CZ3 3.9Å; V16-W122 HydrophobicContact CB-CH2 4.23Å; V16-W122 HydrophobicContact CB-CZ2 4.18Å; V16-W122 HydrophobicContact CG2-CH2 3.69Å; V16-W122 HydrophobicContact CG2-CZ2 3.24Å; L118-W122 WeakPolarHBondContact O-CB 3.39Å; L118-W122 PolarHBondContact O-N 2.93Å; S119-W122 PolarHBondContact O-N 2.86Å; W122-K124 PolarHBondContact O-N 3.38Å; W122-T125 WeakPolarHBondContact O-CA 3.49Å; W122-T125 WeakPolarHBondContact O-CB 3.06Å; W122-T125 PolarHBondContact O-N 3.28Å; W122-D126 PolarHBondContact O-N 2.89Å; W122-D126 VanDerWaalsContact O-N 3.11Å |
| 123 | L | 60.1 | Low | 61.8 | Low | 133 Ų | 133 | 110.6 Ų | 110.6 | 70% | 0.696 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -60.2 | -32.9 | 174.9 | -171.1 | 65.7 | 0 | 0 | 0 | 112.1 | S119 T125 | S119-L123 VanDerWaalsContact O-CB 3.29Å; S119-L123 WeakPolarHBondContact O-CB 3.48Å; S119-L123 PolarHBondContact O-N 3.03Å; L123-T125 VanDerWaalsContact C-N 3.35Å |
| 124 | K | 56.7 | Low | 60.3 | Low | 145 Ų | 145 | 112.1 Ų | 112.1 | 63% | 0.63 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -75.4 | -20.6 | 172 | -80.4 | -178.3 | 163.8 | -171 | 0 | 113.9 | K120 M121 W122 T127 | K120-K124 PolarHBondContact O-N 2.87Å; M121-K124 PolarHBondContact O-N 2.81Å; W122-K124 PolarHBondContact O-N 3.38Å; K124-T127 PolarHBondContact O-OG1 3.45Å |
| 125 | T | 53.6 | Low | 58.8 | Low | 90 Ų | 90 | 110.3 Ų | 110.3 | 55% | 0.552 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -85.3 | -37.9 | -177.1 | -59.3 | 0 | 0 | 0 | 0 | 111.1 | M121 W122 L123 T127 N128 | M121-T125 PolarHBondContact O-N 3.33Å; M121-T125 PolarHBondContact O-OG1 3.42Å; W122-T125 WeakPolarHBondContact O-CA 3.49Å; W122-T125 WeakPolarHBondContact O-CB 3.06Å; W122-T125 PolarHBondContact O-N 3.28Å; L123-T125 VanDerWaalsContact C-N 3.35Å; T125-T127 VanDerWaalsContact C-N 3.29Å; T125-T127 PolarHBondContact O-N 3.46Å; T125-N128 PolarHBondContact O-N 3.01Å |
| 126 | D | 54.4 | Low | 57.5 | Low | 123 Ų | 123 | 116.1 Ų | 116.1 | 66% | 0.658 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -72.1 | -20.8 | -179 | -70.9 | -28.5 | 0 | 0 | 0 | 113.3 | W122 N128 | W122-D126 PolarHBondContact O-N 2.89Å; W122-D126 VanDerWaalsContact O-N 3.11Å; D126-N128 VanDerWaalsContact C-N 3.3Å; D126-N128 PolarHBondContact O-N 3.05Å |
| 127 | T | 52.2 | Low | 56 | Low | 105 Ų | 105 | 117.5 Ų | 117.5 | 64% | 0.644 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.5 | -12.5 | 174.1 | 59.7 | 0 | 0 | 0 | 0 | 113.9 | K124 T125 | K124-T127 PolarHBondContact O-OG1 3.45Å; T125-T127 VanDerWaalsContact C-N 3.29Å; T125-T127 PolarHBondContact O-N 3.46Å |
| 128 | N | 48.5 | Very low | 54.8 | Low | 127 Ų | 127 | 120.1 Ų | 120.1 | 68% | 0.679 | 62% | 0.623 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.6 | 13.6 | -175.4 | -68.1 | 3.3 | 0 | 0 | 0 | 112.7 | T125 D126 V130 | T125-N128 PolarHBondContact O-N 3.01Å; D126-N128 VanDerWaalsContact C-N 3.3Å; D126-N128 PolarHBondContact O-N 3.05Å; N128-V130 PolarHBondContact O-N 3.29Å; N128-V130 VanDerWaalsContact O-N 3.1Å |
| 129 | G | 45.4 | Very low | 53.8 | Low | 69 Ų | 69 | 122 Ų | 122 | 71% | 0.711 | 64% | 0.638 | S | S | * | * | trans | -75.5 | 15.4 | -176.6 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 130 | V | 48.6 | Very low | 52.6 | Low | 122 Ų | 122 | 123 Ų | 123 | 74% | 0.739 | 65% | 0.645 | S | S | * | * | S | Bend | trans | -123.7 | 114 | 177.7 | -176.2 | 0 | 0 | 0 | 0 | 108.2 | N128 | N128-V130 PolarHBondContact O-N 3.29Å; N128-V130 VanDerWaalsContact O-N 3.1Å |
| 131 | R | 41.9 | Very low | 51.5 | Low | 207 Ų | 207 | 123.6 Ų | 123.6 | 78% | 0.781 | 65% | 0.652 | S | S | * | * | S | Bend | trans | 86.4 | 124.1 | 161.1 | -86.9 | 172.2 | 61.3 | -172.7 | -1.2 | 119.4 | ||
| 132 | D | 43.9 | Very low | 50.7 | Low | 103 Ų | 103 | 127.2 Ų | 127.2 | 55% | 0.551 | 67% | 0.666 | S | S | * | * | trans | 90.5 | 82.8 | 138.5 | -52.3 | -19.2 | 0 | 0 | 0 | 117.4 | H134 | D132-H134 PolarHBondContact O-N 3.4Š| ||
| 133 | E | 45 | Very low | 50 | Low | 197 Ų | 197 | 132.9 Ų | 132.9 | 92% | 0.921 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | 26.9 | 4.4 | 125.9 | -60.4 | -69.5 | 139.7 | 0 | 0 | 122.2 | |||
| 134 | H | 47.8 | Very low | 49.4 | Very low | 166 Ų | 166 | 133.7 Ų | 133.7 | 77% | 0.769 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -125.4 | -2.7 | 177.1 | -106.2 | -89.9 | 0 | 0 | 0 | 113.4 | D132 L136 | D132-H134 PolarHBondContact O-N 3.4Å; H134-L136 VanDerWaalsContact C-N 3.35Å; H134-L136 PolarHBondContact O-N 2.69Å |
| 135 | A | 49.3 | Very low | 48.9 | Very low | 63 Ų | 63 | 130.4 Ų | 130.4 | 52% | 0.521 | 70% | 0.7 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -79.7 | -6.6 | -173.8 | 0 | 0 | 0 | 0 | 0 | 115.3 | W137 T139 | A135-W137 VanDerWaalsContact C-N 3.31Å; A135-W137 PolarHBondContact O-N 2.88Å; A135-T139 PolarHBondContact O-OG1 3.45Å |
| 136 | L | 50.6 | Low | 48.5 | Very low | 173 Ų | 173 | 137.2 Ų | 137.2 | 91% | 0.906 | 72% | 0.715 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.2 | -15.7 | 179.2 | -78.6 | 173.7 | 0 | 0 | 0 | 114 | H134 | H134-L136 VanDerWaalsContact C-N 3.35Å; H134-L136 PolarHBondContact O-N 2.69Å |
| 137 | W | 46.1 | Very low | 48.1 | Very low | 157 Ų | 157 | 141.3 Ų | 141.3 | 60% | 0.595 | 73% | 0.73 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.5 | -24.6 | -177.1 | -166 | 69.1 | 0 | 0 | 0 | 114.2 | A135 L160 | A135-W137 VanDerWaalsContact C-N 3.31Å; A135-W137 PolarHBondContact O-N 2.88Å; W137-L160 HydrophobicContact CH2-CD2 4.3Å |
| 138 | L | 50.2 | Low | 47.9 | Very low | 105 Ų | 105 | 141.2 Ų | 141.2 | 55% | 0.55 | 73% | 0.734 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -90.8 | -18.9 | -176.4 | -86.2 | 139.9 | 0 | 0 | 0 | 114.4 | S140 F142 | L138-S140 VanDerWaalsContact C-N 3.34Å; L138-S140 PolarHBondContact O-N 3.08Å; L138-F142 HydrophobicContact CD2-CE2 4.34Å |
| 139 | T | 54.1 | Low | 47.7 | Very low | 116 Ų | 116 | 137.6 Ų | 137.6 | 71% | 0.712 | 73% | 0.726 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.5 | -10.4 | -172.1 | -40.1 | 0 | 0 | 0 | 0 | 113.3 | A135 | A135-T139 PolarHBondContact O-OG1 3.45Š|
| 140 | S | 50.5 | Low | 47.9 | Very low | 99 Ų | 99 | 139.5 Ų | 139.5 | 69% | 0.692 | 73% | 0.729 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.2 | -14.8 | 178.3 | 60.8 | 0 | 0 | 0 | 0 | 114.5 | L138 | L138-S140 VanDerWaalsContact C-N 3.34Å; L138-S140 PolarHBondContact O-N 3.08Å |
| 141 | L | 50.4 | Low | 48.1 | Very low | 120 Ų | 120 | 143 Ų | 143 | 63% | 0.628 | 73% | 0.73 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.8 | -11.6 | -167.6 | -105 | 162.3 | 0 | 0 | 0 | 116 | ||
| 142 | F | 50.6 | Low | 48.5 | Very low | 161 Ų | 161 | 140 Ų | 140 | 71% | 0.706 | 72% | 0.723 | S | S | * | * | trans | -121.9 | 13.9 | -168.6 | -74.8 | -80.1 | 0 | 0 | 0 | 116.2 | L138 N144 | L138-F142 HydrophobicContact CD2-CE2 4.34Å; F142-N144 PolarHBondContact O-N 2.83Å | ||
| 143 | R | 50.7 | Low | 49 | Very low | 210 Ų | 210 | 137.8 Ų | 137.8 | 79% | 0.792 | 73% | 0.725 | S | S | * | * | S | Bend | trans | -83.2 | 42.5 | 170.2 | -154.3 | -178.6 | 82.4 | 179.9 | 5 | 111.7 | ||
| 144 | N | 46.7 | Very low | 49.4 | Very low | 150 Ų | 150 | 132.6 Ų | 132.6 | 80% | 0.802 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -143.5 | 107.8 | 175.1 | -110.1 | 10.7 | 0 | 0 | 0 | 108.6 | F142 | F142-N144 PolarHBondContact O-N 2.83Š|
| 145 | G | 47 | Very low | 50 | Low | 76 Ų | 76 | 130.3 Ų | 130.3 | 78% | 0.784 | 70% | 0.703 | S | S | * | * | S | Bend | trans | 84 | 118.2 | 150.5 | 0 | 0 | 0 | 0 | 0 | 118 | ||
| 146 | R | 44.7 | Very low | 51.1 | Low | 232 Ų | 232 | 131.5 Ų | 131.5 | 88% | 0.875 | 70% | 0.701 | S | S | * | * | trans | 78 | 98.7 | 143.4 | -97.4 | 172.7 | 171.3 | -169.8 | -3.1 | 118 | S148 | R146-S148 PolarHBondContact O-N 3.33Š| ||
| 147 | E | 45.9 | Very low | 52.2 | Low | 210 Ų | 210 | 127.5 Ų | 127.5 | 98% | 0.981 | 68% | 0.68 | S | S | * | * | S | Bend | trans | -54.9 | 82.1 | 142.1 | -56.3 | 172.4 | -172.4 | 0 | 0 | 109.3 | ||
| 148 | S | 48.4 | Very low | 53.7 | Low | 102 Ų | 102 | 125.1 Ų | 125.1 | 71% | 0.713 | 68% | 0.679 | S | S | * | * | trans | -163.6 | 108.6 | 167 | -175.9 | 0 | 0 | 0 | 0 | 110.4 | R146 | R146-S148 PolarHBondContact O-N 3.33Š| ||
| 149 | G | 44.4 | Very low | 54.8 | Low | 51 Ų | 51 | 125.9 Ų | 125.9 | 53% | 0.526 | 68% | 0.68 | S | S | . | * | trans | 97 | 82.2 | 157.5 | 0 | 0 | 0 | 0 | 0 | 116 | Y151 | G149-Y151 PolarHBondContact O-N 2.84Š| ||
| 150 | S | 49.2 | Very low | 55.8 | Low | 110 Ų | 110 | 124.2 Ų | 124.2 | 77% | 0.769 | 67% | 0.666 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.3 | 39.9 | 172.3 | 59.4 | 0 | 0 | 0 | 0 | 115.3 | ||
| 151 | Y | 53 | Low | 57.3 | Low | 194 Ų | 194 | 125.6 Ų | 125.6 | 76% | 0.761 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -131.6 | -8.5 | 178.3 | -68.1 | -79.7 | 0 | 0 | 0 | 114.4 | G149 | G149-Y151 PolarHBondContact O-N 2.84Š|
| 152 | F | 50.9 | Low | 58.8 | Low | 145 Ų | 145 | 127.9 Ų | 127.9 | 64% | 0.636 | 66% | 0.66 | S | S | * | * | S | Bend | trans | -96.2 | -12.3 | -175.1 | -84.6 | -82.6 | 0 | 0 | 0 | 115.8 | ||
| 153 | G | 54 | Low | 60.2 | Low | 56 Ų | 56 | 123.7 Ų | 123.7 | 58% | 0.577 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -65.6 | -42.3 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | L155 | G153-L155 PolarHBondContact O-N 3.29Å |
| 154 | S | 53.2 | Low | 61.8 | Low | 89 Ų | 89 | 121.5 Ų | 121.5 | 62% | 0.622 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -76.4 | -21.3 | -174.9 | -177.8 | 0 | 0 | 0 | 0 | 114.3 | ||
| 155 | L | 60.5 | Low | 63.8 | Low | 118 Ų | 118 | 120.5 Ų | 120.5 | 62% | 0.618 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -78.4 | -27.4 | -179.9 | -72.8 | 172.4 | 0 | 0 | 0 | 112 | G153 | G153-L155 PolarHBondContact O-N 3.29Å |
| 156 | N | 71.4 | Confident | 65.4 | Low | 87 Ų | 87 | 119.9 Ų | 119.9 | 47% | 0.465 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -81 | -29.3 | -175.9 | -146.7 | 14.4 | 0 | 0 | 0 | 112.4 | N158 Q159 L160 | N156-N158 VanDerWaalsContact C-N 3.34Å; N156-N158 PolarHBondContact O-N 3.04Å; N156-Q159 PolarHBondContact O-N 2.79Å; N156-Q159 VanDerWaalsContact O-N 3.15Å; N156-L160 WeakPolarHBondContact O-CB 3.1Å; N156-L160 PolarHBondContact O-N 3.47Å |
| 157 | D | 73.7 | Confident | 67.3 | Low | 90 Ų | 90 | 113.6 Ų | 113.6 | 48% | 0.481 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -62.9 | -38.6 | -178.5 | -66.8 | -26.2 | 0 | 0 | 0 | 112.7 | Q159 L160 K161 | D157-Q159 VanDerWaalsContact C-N 3.35Å; D157-L160 PolarHBondContact O-N 3.2Å; D157-K161 WeakPolarHBondContact O-CB 3.13Å; D157-K161 VanDerWaalsContact O-CG 3.29Å; D157-K161 WeakPolarHBondContact O-CG 3.41Å; D157-K161 PolarHBondContact O-N 3.33Å |
| 158 | N | 77.9 | Confident | 69.3 | Low | 106 Ų | 106 | 108.5 Ų | 108.5 | 57% | 0.567 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -68.5 | -35.7 | 176.8 | -67.1 | -26.5 | 0 | 0 | 0 | 111.7 | N156 R162 | N156-N158 VanDerWaalsContact C-N 3.34Å; N156-N158 PolarHBondContact O-N 3.04Å; N158-R162 WeakPolarHBondContact O-CB 3.29Å; N158-R162 PolarHBondContact O-N 3.44Å |
| 159 | Q | 73.1 | Confident | 71 | Confident | 121 Ų | 121 | 110 Ų | 110 | 57% | 0.565 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -71.2 | -38.9 | 174.6 | -65.9 | -163.6 | -3.5 | 0 | 0 | 111.5 | N156 D157 R162 L163 | N156-Q159 PolarHBondContact O-N 2.79Å; N156-Q159 VanDerWaalsContact O-N 3.15Å; D157-Q159 VanDerWaalsContact C-N 3.35Å; Q159-R162 PolarHBondContact O-N 2.85Å; Q159-L163 WeakPolarHBondContact O-CB 3.44Å; Q159-L163 PolarHBondContact O-N 3.44Å |
| 160 | L | 75.9 | Confident | 72.7 | Confident | 82 Ų | 82 | 110.7 Ų | 110.7 | 43% | 0.429 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -65 | -41.6 | 174.8 | -126.5 | 82.4 | 0 | 0 | 0 | 111.6 | W137 N156 D157 L163 R164 | W137-L160 HydrophobicContact CH2-CD2 4.3Å; N156-L160 WeakPolarHBondContact O-CB 3.1Å; N156-L160 PolarHBondContact O-N 3.47Å; D157-L160 PolarHBondContact O-N 3.2Å; L160-L163 PolarHBondContact O-N 3.26Å; L160-R164 VanDerWaalsContact O-CB 3.27Å; L160-R164 WeakPolarHBondContact O-CB 3.25Å; L160-R164 PolarHBondContact O-N 3.02Å |
| 161 | K | 82.6 | Confident | 74.3 | Confident | 127 Ų | 127 | 111.3 Ų | 111.3 | 55% | 0.552 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -61.2 | -47.8 | 174.2 | -79.7 | 179.4 | -178.7 | -177.5 | 0 | 111 | D157 L163 R164 E165 | D157-K161 WeakPolarHBondContact O-CB 3.13Å; D157-K161 VanDerWaalsContact O-CG 3.29Å; D157-K161 WeakPolarHBondContact O-CG 3.41Å; D157-K161 PolarHBondContact O-N 3.33Å; K161-L163 VanDerWaalsContact C-N 3.33Å; K161-L163 PolarHBondContact O-N 3.05Å; K161-R164 PolarHBondContact O-N 3.31Å; K161-E165 WeakPolarHBondContact O-CB 3.32Å; K161-E165 WeakPolarHBondContact O-CG 3.2Å; K161-E165 PolarHBondContact O-N 3.1Å |
| 162 | R | 81.8 | Confident | 75.9 | Confident | 169 Ų | 169 | 108.3 Ų | 108.3 | 64% | 0.638 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -61.4 | -42.4 | 176.5 | -170.3 | 176.8 | 179.6 | -179 | 0.8 | 111.8 | N158 Q159 R164 E165 Q166 | N158-R162 WeakPolarHBondContact O-CB 3.29Å; N158-R162 PolarHBondContact O-N 3.44Å; Q159-R162 PolarHBondContact O-N 2.85Å; R162-R164 VanDerWaalsContact C-N 3.32Å; R162-R164 PolarHBondContact O-N 3.17Å; R162-E165 PolarHBondContact O-N 3.22Å; R162-Q166 WeakPolarHBondContact O-CB 3.24Å; R162-Q166 VanDerWaalsContact O-CG 3.23Å; R162-Q166 WeakPolarHBondContact O-CG 3.37Å; R162-Q166 PolarHBondContact O-N 2.95Å |
| 163 | L | 80 | Confident | 77.4 | Confident | 73 Ų | 73 | 103.8 Ų | 103.8 | 38% | 0.382 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -63.7 | -40.1 | 176.4 | -166.9 | 77.6 | 0 | 0 | 0 | 111.3 | Q159 L160 K161 Q166 L167 | Q159-L163 WeakPolarHBondContact O-CB 3.44Å; Q159-L163 PolarHBondContact O-N 3.44Å; L160-L163 PolarHBondContact O-N 3.26Å; K161-L163 VanDerWaalsContact C-N 3.33Å; K161-L163 PolarHBondContact O-N 3.05Å; L163-Q166 PolarHBondContact O-N 3.21Å; L163-L167 WeakPolarHBondContact O-CB 3.46Å; L163-L167 WeakPolarHBondContact O-CG 3.3Å; L163-L167 PolarHBondContact O-N 3.43Å |
| 164 | R | 84 | Confident | 78.5 | Confident | 164 Ų | 164 | 106 Ų | 106 | 62% | 0.619 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -68.2 | -43.5 | 177.9 | -172.3 | -176.9 | -176.3 | 109.9 | 3.7 | 112 | L160 K161 R162 Q166 L167 L168 | L160-R164 VanDerWaalsContact O-CB 3.27Å; L160-R164 WeakPolarHBondContact O-CB 3.25Å; L160-R164 PolarHBondContact O-N 3.02Å; K161-R164 PolarHBondContact O-N 3.31Å; R162-R164 VanDerWaalsContact C-N 3.32Å; R162-R164 PolarHBondContact O-N 3.17Å; R164-Q166 VanDerWaalsContact C-N 3.33Å; R164-L167 PolarHBondContact O-N 3.31Å; R164-L168 WeakPolarHBondContact O-CB 3.2Å; R164-L168 PolarHBondContact O-N 3.25Å |
| 165 | E | 87.5 | Confident | 80 | Confident | 129 Ų | 129 | 108 Ų | 108 | 60% | 0.603 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -60.3 | -45.4 | 173.6 | -76.4 | 167.7 | -169.8 | 0 | 0 | 110.4 | K161 R162 L167 L168 E169 | K161-E165 WeakPolarHBondContact O-CB 3.32Å; K161-E165 WeakPolarHBondContact O-CG 3.2Å; K161-E165 PolarHBondContact O-N 3.1Å; R162-E165 PolarHBondContact O-N 3.22Å; E165-L167 VanDerWaalsContact C-N 3.35Å; E165-L167 PolarHBondContact O-N 2.78Å; E165-L168 PolarHBondContact O-N 3.49Å; E165-E169 WeakPolarHBondContact O-CB 3.33Å; E165-E169 PolarHBondContact O-N 2.79Å |
| 166 | Q | 81.4 | Confident | 80.9 | Confident | 63 Ų | 63 | 109.9 Ų | 109.9 | 29% | 0.294 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.5 | -39 | 175.5 | -73.7 | -176.4 | -69.5 | 0 | 0 | 112.3 | R162 L163 R164 L168 E169 T170 | R162-Q166 WeakPolarHBondContact O-CB 3.24Å; R162-Q166 VanDerWaalsContact O-CG 3.23Å; R162-Q166 WeakPolarHBondContact O-CG 3.37Å; R162-Q166 PolarHBondContact O-N 2.95Å; L163-Q166 PolarHBondContact O-N 3.21Å; R164-Q166 VanDerWaalsContact C-N 3.33Å; Q166-L168 VanDerWaalsContact C-N 3.34Å; Q166-E169 PolarHBondContact O-N 3.34Å; Q166-T170 VanDerWaalsContact O-CG2 3.3Å; Q166-T170 WeakPolarHBondContact O-CG2 3.36Å; Q166-T170 PolarHBondContact O-N 3.48Å; Q166-T170 PolarHBondContact O-OG1 3.1Å |
| 167 | L | 84.3 | Confident | 81.1 | Confident | 100 Ų | 100 | 107.1 Ų | 107.1 | 52% | 0.524 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65 | -38.9 | 174.9 | -79.5 | 170.9 | 0 | 0 | 0 | 111.9 | L163 R164 E165 T170 E171 | L163-L167 WeakPolarHBondContact O-CB 3.46Å; L163-L167 WeakPolarHBondContact O-CG 3.3Å; L163-L167 PolarHBondContact O-N 3.43Å; R164-L167 PolarHBondContact O-N 3.31Å; E165-L167 VanDerWaalsContact C-N 3.35Å; E165-L167 PolarHBondContact O-N 2.78Å; L167-T170 VanDerWaalsContact CA-OG1 3.32Å; L167-T170 WeakPolarHBondContact CA-OG1 3.29Å; L167-T170 PolarHBondContact O-N 2.77Å; L167-T170 PolarHBondContact O-OG1 3.11Å; L167-E171 WeakPolarHBondContact O-CB 3.33Å; L167-E171 PolarHBondContact O-N 2.86Å |
| 168 | L | 88.1 | Confident | 81.2 | Confident | 102 Ų | 102 | 107.7 Ų | 107.7 | 53% | 0.534 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -69 | -41.5 | 177.1 | -161.4 | 157.9 | 0 | 0 | 0 | 111.1 | R164 E165 Q166 T170 E171 E172 | R164-L168 WeakPolarHBondContact O-CB 3.2Å; R164-L168 PolarHBondContact O-N 3.25Å; E165-L168 PolarHBondContact O-N 3.49Å; Q166-L168 VanDerWaalsContact C-N 3.34Å; L168-T170 VanDerWaalsContact C-N 3.3Å; L168-T170 PolarHBondContact O-N 2.83Å; L168-E171 WeakPolarHBondContact O-CB 3.3Å; L168-E171 PolarHBondContact O-N 3.25Å; L168-E171 VanDerWaalsContact O-N 3.15Å; L168-E172 PolarHBondContact O-N 3.37Å |
| 169 | E | 83.6 | Confident | 81.3 | Confident | 134 Ų | 134 | 108.8 Ų | 108.8 | 63% | 0.626 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -60.7 | -40.1 | 172.6 | -172.9 | -179.7 | -177.9 | 0 | 0 | 111.2 | E165 Q166 E172 A173 | E165-E169 WeakPolarHBondContact O-CB 3.33Å; E165-E169 PolarHBondContact O-N 2.79Å; Q166-E169 PolarHBondContact O-N 3.34Å; E169-E172 PolarHBondContact O-N 3.18Å; E169-A173 WeakPolarHBondContact O-CB 3.38Å; E169-A173 PolarHBondContact O-N 3.47Å |
| 170 | T | 80.7 | Confident | 81.1 | Confident | 66 Ų | 66 | 104.5 Ų | 104.5 | 41% | 0.405 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -70 | -32.4 | 174.5 | 57.5 | 0 | 0 | 0 | 0 | 113.2 | Q166 L167 L168 M174 | Q166-T170 VanDerWaalsContact O-CG2 3.3Å; Q166-T170 WeakPolarHBondContact O-CG2 3.36Å; Q166-T170 PolarHBondContact O-N 3.48Å; Q166-T170 PolarHBondContact O-OG1 3.1Å; L167-T170 VanDerWaalsContact CA-OG1 3.32Å; L167-T170 WeakPolarHBondContact CA-OG1 3.29Å; L167-T170 PolarHBondContact O-N 2.77Å; L167-T170 PolarHBondContact O-OG1 3.11Å; L168-T170 VanDerWaalsContact C-N 3.3Å; L168-T170 PolarHBondContact O-N 2.83Å; T170-M174 VanDerWaalsContact O-CB 3.27Å; T170-M174 WeakPolarHBondContact O-CB 3.39Å; T170-M174 PolarHBondContact O-N 3.3Å |
| 171 | E | 82.7 | Confident | 80.4 | Confident | 123 Ų | 123 | 103.7 Ų | 103.7 | 58% | 0.575 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -65.7 | -46.1 | 174.3 | -180 | 176.1 | -161.2 | 0 | 0 | 110.5 | L167 L168 M174 Q175 | L167-E171 WeakPolarHBondContact O-CB 3.33Å; L167-E171 PolarHBondContact O-N 2.86Å; L168-E171 WeakPolarHBondContact O-CB 3.3Å; L168-E171 PolarHBondContact O-N 3.25Å; L168-E171 VanDerWaalsContact O-N 3.15Å; E171-M174 PolarHBondContact O-N 2.85Å; E171-Q175 WeakPolarHBondContact O-CB 3.37Å; E171-Q175 PolarHBondContact O-N 3.4Å |
| 172 | E | 86.1 | Confident | 79.7 | Confident | 131 Ų | 131 | 105.6 Ų | 105.6 | 61% | 0.612 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -63.2 | -44.1 | 175.5 | -172.9 | 178.9 | 177.2 | 0 | 0 | 111.6 | L168 E169 M174 Q175 K176 | L168-E172 PolarHBondContact O-N 3.37Å; E169-E172 PolarHBondContact O-N 3.18Å; E172-M174 VanDerWaalsContact C-N 3.33Å; E172-M174 PolarHBondContact O-N 3.47Å; E172-Q175 PolarHBondContact O-N 2.76Å; E172-K176 WeakPolarHBondContact O-CB 3.38Å; E172-K176 PolarHBondContact O-N 3.43Å |
| 173 | A | 83.9 | Confident | 78.7 | Confident | 50 Ų | 50 | 101.7 Ų | 101.7 | 41% | 0.413 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.7 | -41.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | E169 K176 I177 | E169-A173 WeakPolarHBondContact O-CB 3.38Å; E169-A173 PolarHBondContact O-N 3.47Å; A173-K176 PolarHBondContact O-N 2.73Å; A173-I177 VanDerWaalsContact O-CG1 3.27Å; A173-I177 WeakPolarHBondContact O-CG1 3.43Å; A173-I177 PolarHBondContact O-N 2.82Å |
| 174 | M | 76.1 | Confident | 77.6 | Confident | 102 Ų | 102 | 102.8 Ų | 102.8 | 50% | 0.502 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -65.7 | -41.5 | 176.1 | -172.1 | 176.9 | 72 | 0 | 0 | 111.4 | T170 E171 E172 K176 I177 L178 | T170-M174 VanDerWaalsContact O-CB 3.27Å; T170-M174 WeakPolarHBondContact O-CB 3.39Å; T170-M174 PolarHBondContact O-N 3.3Å; E171-M174 PolarHBondContact O-N 2.85Å; E172-M174 VanDerWaalsContact C-N 3.33Å; E172-M174 PolarHBondContact O-N 3.47Å; M174-K176 VanDerWaalsContact C-N 3.32Å; M174-K176 PolarHBondContact O-N 2.81Å; M174-I177 PolarHBondContact O-N 3.07Å; M174-L178 HydrophobicContact CG-CD1 4.33Å; M174-L178 WeakPolarHBondContact O-CG 3.35Å; M174-L178 PolarHBondContact O-N 3.46Å |
| 175 | Q | 83.9 | Confident | 76.2 | Confident | 130 Ų | 130 | 101.1 Ų | 101.1 | 61% | 0.607 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -62 | -41.2 | 176.2 | -172.1 | 171.9 | 0.8 | 0 | 0 | 111.4 | E171 E172 L178 E179 | E171-Q175 WeakPolarHBondContact O-CB 3.37Å; E171-Q175 PolarHBondContact O-N 3.4Å; E172-Q175 PolarHBondContact O-N 2.76Å; Q175-L178 PolarHBondContact O-N 3.41Å; Q175-E179 WeakPolarHBondContact O-CB 3.24Å; Q175-E179 PolarHBondContact O-N 3.44Å |
| 176 | K | 81 | Confident | 74.6 | Confident | 158 Ų | 158 | 101.7 Ų | 101.7 | 69% | 0.687 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -64.4 | -38.9 | 175.2 | -170.6 | 176.8 | -178.2 | 179.6 | 0 | 112.8 | E172 A173 M174 E179 G180 | E172-K176 WeakPolarHBondContact O-CB 3.38Å; E172-K176 PolarHBondContact O-N 3.43Å; A173-K176 PolarHBondContact O-N 2.73Å; M174-K176 VanDerWaalsContact C-N 3.32Å; M174-K176 PolarHBondContact O-N 2.81Å; K176-E179 PolarHBondContact O-N 3.45Å; K176-G180 PolarHBondContact O-N 3.38Å |
| 177 | I | 74.4 | Confident | 73.5 | Confident | 29 Ų | 29 | 101 Ų | 101 | 15% | 0.149 | 53% | 0.534 | C | S | . | . | H | α-helix | trans | -66.3 | -40.5 | 174.8 | -66.7 | 163.1 | 0 | 0 | 0 | 110.5 | A173 M174 G180 L181 F195 | A173-I177 VanDerWaalsContact O-CG1 3.27Å; A173-I177 WeakPolarHBondContact O-CG1 3.43Å; A173-I177 PolarHBondContact O-N 2.82Å; M174-I177 PolarHBondContact O-N 3.07Å; I177-G180 PolarHBondContact O-N 3.07Å; I177-L181 HydrophobicContact CG2-CD1 3.93Å; I177-L181 HydrophobicContact CG2-CG 4.44Å; I177-L181 WeakPolarHBondContact O-CB 3.28Å; I177-L181 WeakPolarHBondContact O-CG 3.48Å; I177-L181 PolarHBondContact O-N 3.13Å; I177-F195 HydrophobicContact CG2-CD2 4.35Å |
| 178 | L | 75.7 | Confident | 72.3 | Confident | 102 Ų | 102 | 100.3 Ų | 100.3 | 53% | 0.534 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -65.4 | -41.1 | 176.7 | -71.3 | 169.2 | 0 | 0 | 0 | 111.8 | M174 Q175 L181 E182 | M174-L178 HydrophobicContact CG-CD1 4.33Å; M174-L178 WeakPolarHBondContact O-CG 3.35Å; M174-L178 PolarHBondContact O-N 3.46Å; Q175-L178 PolarHBondContact O-N 3.41Å; L178-L181 PolarHBondContact O-N 2.81Å; L178-E182 WeakPolarHBondContact O-CB 3.47Å; L178-E182 PolarHBondContact O-N 3.4Å |
| 179 | E | 79.9 | Confident | 71.2 | Confident | 130 Ų | 130 | 101.6 Ų | 101.6 | 61% | 0.607 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -64.9 | -39 | 174.4 | -171.4 | 175.4 | -167.7 | 0 | 0 | 111.7 | Q175 K176 E182 S183 | Q175-E179 WeakPolarHBondContact O-CB 3.24Å; Q175-E179 PolarHBondContact O-N 3.44Å; K176-E179 PolarHBondContact O-N 3.45Å; E179-E182 PolarHBondContact O-N 3.24Å; E179-S183 WeakPolarHBondContact O-CB 3.36Å; E179-S183 PolarHBondContact O-N 3.26Å; E179-S183 PolarHBondContact O-OG 2.91Å |
| 180 | G | 70.3 | Confident | 70.3 | Confident | 30 Ų | 30 | 99 Ų | 99 | 31% | 0.309 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -63.9 | -40.2 | 172.3 | 0 | 0 | 0 | 0 | 0 | 113 | K176 I177 S183 D184 | K176-G180 PolarHBondContact O-N 3.38Å; I177-G180 PolarHBondContact O-N 3.07Å; G180-S183 WeakPolarHBondContact CA-OG 3.31Å; G180-S183 PolarHBondContact O-OG 3.34Å; G180-D184 WeakPolarHBondContact O-CB 3.5Å; G180-D184 PolarHBondContact O-N 3.26Å |
| 181 | L | 61 | Low | 69.5 | Low | 65 Ų | 65 | 96.8 Ų | 96.8 | 34% | 0.34 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -71.2 | -33.7 | 175.9 | -74.9 | 166.5 | 0 | 0 | 0 | 112.7 | I177 L178 A191 | I177-L181 HydrophobicContact CG2-CD1 3.93Å; I177-L181 HydrophobicContact CG2-CG 4.44Å; I177-L181 WeakPolarHBondContact O-CB 3.28Å; I177-L181 WeakPolarHBondContact O-CG 3.48Å; I177-L181 PolarHBondContact O-N 3.13Å; L178-L181 PolarHBondContact O-N 2.81Å; L181-A191 HydrophobicContact CD2-CB 3.5Å; L181-A191 VanDerWaalsContact CD2-CB 3.5Å; L181-A191 HydrophobicContact CG-CB 4.04Å |
| 182 | E | 67 | Low | 68.9 | Low | 168 Ų | 168 | 99.4 Ų | 99.4 | 79% | 0.785 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -71.4 | -35.5 | 176.1 | -174.1 | 170 | -171.9 | 0 | 0 | 111.7 | L178 E179 | L178-E182 WeakPolarHBondContact O-CB 3.47Å; L178-E182 PolarHBondContact O-N 3.4Å; E179-E182 PolarHBondContact O-N 3.24Å |
| 183 | S | 62.1 | Low | 68.3 | Low | 86 Ų | 86 | 98 Ų | 98 | 60% | 0.601 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -83.7 | -36.3 | 178.6 | 53 | 0 | 0 | 0 | 0 | 114.2 | E179 G180 | E179-S183 WeakPolarHBondContact O-CB 3.36Å; E179-S183 PolarHBondContact O-N 3.26Å; E179-S183 PolarHBondContact O-OG 2.91Å; G180-S183 WeakPolarHBondContact CA-OG 3.31Å; G180-S183 PolarHBondContact O-OG 3.34Å |
| 184 | D | 56 | Low | 68 | Low | 97 Ų | 97 | 101 Ų | 101 | 52% | 0.519 | 53% | 0.527 | S | S | . | . | trans | -112.3 | 61.2 | -174.9 | -87.6 | -16.7 | 0 | 0 | 0 | 113.2 | G180 V186 S187 | G180-D184 WeakPolarHBondContact O-CB 3.5Å; G180-D184 PolarHBondContact O-N 3.26Å; D184-V186 PolarHBondContact O-N 3.49Å; D184-S187 PolarHBondContact O-N 2.84Å | ||
| 185 | N | 53.9 | Low | 67.9 | Low | 129 Ų | 129 | 100.7 Ų | 100.7 | 69% | 0.69 | 52% | 0.523 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.8 | 10.6 | 169 | -141 | -22.7 | 0 | 0 | 0 | 114.1 | ||
| 186 | V | 54.7 | Low | 67.6 | Low | 141 Ų | 141 | 100.3 Ų | 100.3 | 86% | 0.855 | 52% | 0.521 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -116.3 | -15.5 | 179.4 | -177.2 | 0 | 0 | 0 | 0 | 112.7 | D184 | D184-V186 PolarHBondContact O-N 3.49Š|
| 187 | S | 58.1 | Low | 67.6 | Low | 49 Ų | 49 | 99.8 Ų | 99.8 | 34% | 0.343 | 52% | 0.521 | S | S | . | . | trans | -113.9 | 40.8 | -176.6 | -163.5 | 0 | 0 | 0 | 0 | 113.4 | D184 N189 T190 | D184-S187 PolarHBondContact O-N 2.84Å; S187-N189 PolarHBondContact O-N 3.35Å; S187-T190 PolarHBondContact O-N 2.84Å; S187-T190 PolarHBondContact OG-OG1 3.45Å | ||
| 188 | N | 59.3 | Low | 67.7 | Low | 85 Ų | 85 | 100.5 Ų | 100.5 | 46% | 0.455 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -54.8 | -19.4 | -173.3 | -72.8 | -31 | 0 | 0 | 0 | 115.8 | R192 | N188-R192 VanDerWaalsContact O-CB 3.32Å; N188-R192 WeakPolarHBondContact O-CB 3.34Å |
| 189 | N | 64.5 | Low | 67.8 | Low | 129 Ų | 129 | 100 Ų | 100 | 69% | 0.69 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -87.7 | -33.8 | -175.7 | -57.5 | -18.9 | 0 | 0 | 0 | 112.3 | S187 N193 | S187-N189 PolarHBondContact O-N 3.35Å; N189-N193 PolarHBondContact O-N 3.32Å; N189-N193 PolarHBondContact O-ND2 3.31Å |
| 190 | T | 65.9 | Low | 67.8 | Low | 78 Ų | 78 | 96.4 Ų | 96.4 | 48% | 0.479 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -78.2 | -47.8 | -175.4 | -40.5 | 0 | 0 | 0 | 0 | 110.6 | S187 R192 N193 E194 | S187-T190 PolarHBondContact O-N 2.84Å; S187-T190 PolarHBondContact OG-OG1 3.45Å; T190-R192 VanDerWaalsContact C-N 3.26Å; T190-R192 PolarHBondContact O-N 3.42Å; T190-N193 PolarHBondContact O-N 2.87Å; T190-N193 VanDerWaalsContact O-N 3.09Å; T190-E194 PolarHBondContact O-N 3.28Å |
| 191 | A | 63.4 | Low | 68.3 | Low | 20 Ų | 20 | 98.3 Ų | 98.3 | 17% | 0.165 | 53% | 0.53 | C | S | . | . | H | α-helix | trans | -62.4 | -33.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | L181 N193 F195 | L181-A191 HydrophobicContact CD2-CB 3.5Å; L181-A191 VanDerWaalsContact CD2-CB 3.5Å; L181-A191 HydrophobicContact CG-CB 4.04Å; A191-N193 VanDerWaalsContact C-N 3.35Å; A191-F195 VanDerWaalsContact O-CB 3.31Å; A191-F195 WeakPolarHBondContact O-CB 3.18Å; A191-F195 PolarHBondContact O-N 2.93Å |
| 192 | R | 69.6 | Low | 68.8 | Low | 179 Ų | 179 | 99 Ų | 99 | 68% | 0.675 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -67 | -35.6 | 175.8 | -172.9 | 178.2 | 171.8 | 120.2 | 0.3 | 112.4 | N188 T190 Q196 | N188-R192 VanDerWaalsContact O-CB 3.32Å; N188-R192 WeakPolarHBondContact O-CB 3.34Å; T190-R192 VanDerWaalsContact C-N 3.26Å; T190-R192 PolarHBondContact O-N 3.42Å; R192-Q196 VanDerWaalsContact O-CB 3.3Å; R192-Q196 WeakPolarHBondContact O-CB 3.18Å; R192-Q196 PolarHBondContact O-N 2.9Å |
| 193 | N | 73.4 | Confident | 69.4 | Low | 101 Ų | 101 | 97.3 Ų | 97.3 | 54% | 0.54 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -70 | -44.1 | 177.1 | -71.1 | -23.3 | 0 | 0 | 0 | 111.3 | N189 T190 A191 F195 Q196 E197 | N189-N193 PolarHBondContact O-N 3.32Å; N189-N193 PolarHBondContact O-ND2 3.31Å; T190-N193 PolarHBondContact O-N 2.87Å; T190-N193 VanDerWaalsContact O-N 3.09Å; A191-N193 VanDerWaalsContact C-N 3.35Å; N193-F195 VanDerWaalsContact C-N 3.33Å; N193-F195 PolarHBondContact O-N 3Å; N193-Q196 PolarHBondContact O-N 3.5Å; N193-E197 WeakPolarHBondContact O-CB 3.3Å; N193-E197 PolarHBondContact O-N 3.27Å |
| 194 | E | 76.9 | Confident | 70.2 | Confident | 114 Ų | 114 | 102.6 Ų | 102.6 | 53% | 0.533 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -61.9 | -42.3 | 175.4 | -67.7 | -178.3 | 178.2 | 0 | 0 | 111.4 | T190 Q196 E197 A198 | T190-E194 PolarHBondContact O-N 3.28Å; E194-Q196 PolarHBondContact O-N 3.24Å; E194-E197 PolarHBondContact O-N 3Å; E194-A198 WeakPolarHBondContact O-CB 3.26Å; E194-A198 PolarHBondContact O-N 2.93Å |
| 195 | F | 74.1 | Confident | 70.9 | Confident | 95 Ų | 95 | 101.2 Ų | 101.2 | 42% | 0.417 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -62.3 | -42.9 | 174.6 | -175.7 | -99 | 0 | 0 | 0 | 112 | I177 A191 N193 E197 A198 L199 | I177-F195 HydrophobicContact CG2-CD2 4.35Å; A191-F195 VanDerWaalsContact O-CB 3.31Å; A191-F195 WeakPolarHBondContact O-CB 3.18Å; A191-F195 PolarHBondContact O-N 2.93Å; N193-F195 VanDerWaalsContact C-N 3.33Å; N193-F195 PolarHBondContact O-N 3Å; F195-E197 VanDerWaalsContact C-N 3.33Å; F195-E197 PolarHBondContact O-N 3.45Å; F195-A198 PolarHBondContact O-N 3Å; F195-L199 HydrophobicContact CD1-CD1 4.46Å; F195-L199 HydrophobicContact CE1-CD1 3.7Å; F195-L199 HydrophobicContact CZ-CD1 4.11Å; F195-L199 WeakPolarHBondContact O-CB 3.21Å; F195-L199 PolarHBondContact O-N 3.5Å |
| 196 | Q | 78.1 | Confident | 71.9 | Confident | 122 Ų | 122 | 98.8 Ų | 98.8 | 57% | 0.57 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -66.8 | -36.3 | 178.9 | -172.1 | 172.9 | -1.1 | 0 | 0 | 111.9 | R192 N193 E194 L199 A200 | R192-Q196 VanDerWaalsContact O-CB 3.3Å; R192-Q196 WeakPolarHBondContact O-CB 3.18Å; R192-Q196 PolarHBondContact O-N 2.9Å; N193-Q196 PolarHBondContact O-N 3.5Å; E194-Q196 PolarHBondContact O-N 3.24Å; Q196-L199 PolarHBondContact O-N 2.89Å; Q196-A200 VanDerWaalsContact O-CB 3.31Å; Q196-A200 WeakPolarHBondContact O-CB 3.29Å; Q196-A200 PolarHBondContact O-N 3.32Å |
| 197 | E | 80.9 | Confident | 72.9 | Confident | 147 Ų | 147 | 96.7 Ų | 96.7 | 69% | 0.687 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -67.6 | -43 | 174.6 | -172 | 169.4 | -171.3 | 0 | 0 | 111.7 | N193 E194 F195 L199 A200 S201 | N193-E197 WeakPolarHBondContact O-CB 3.3Å; N193-E197 PolarHBondContact O-N 3.27Å; E194-E197 PolarHBondContact O-N 3Å; F195-E197 VanDerWaalsContact C-N 3.33Å; F195-E197 PolarHBondContact O-N 3.45Å; E197-L199 VanDerWaalsContact C-N 3.34Å; E197-L199 PolarHBondContact O-N 3.3Å; E197-A200 PolarHBondContact O-N 3.03Å; E197-S201 PolarHBondContact O-N 3.3Å; E197-S201 PolarHBondContact O-OG 3.43Å |
| 198 | A | 77.2 | Confident | 73.6 | Confident | 43 Ų | 43 | 100.1 Ų | 100.1 | 36% | 0.355 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63 | -38.8 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | E194 F195 S201 L202 | E194-A198 WeakPolarHBondContact O-CB 3.26Å; E194-A198 PolarHBondContact O-N 2.93Å; F195-A198 PolarHBondContact O-N 3Å; A198-S201 WeakPolarHBondContact CA-OG 3.23Å; A198-S201 PolarHBondContact O-N 3.16Å; A198-S201 PolarHBondContact O-OG 3.02Å; A198-L202 WeakPolarHBondContact O-CB 3.42Å; A198-L202 PolarHBondContact O-N 3.2Å |
| 199 | L | 78.2 | Confident | 74 | Confident | 91 Ų | 91 | 98.6 Ų | 98.6 | 48% | 0.476 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -70.2 | -37.8 | 176.8 | -150.4 | 164.2 | 0 | 0 | 0 | 111 | F195 Q196 E197 L202 K203 | F195-L199 HydrophobicContact CD1-CD1 4.46Å; F195-L199 HydrophobicContact CE1-CD1 3.7Å; F195-L199 HydrophobicContact CZ-CD1 4.11Å; F195-L199 WeakPolarHBondContact O-CB 3.21Å; F195-L199 PolarHBondContact O-N 3.5Å; Q196-L199 PolarHBondContact O-N 2.89Å; E197-L199 VanDerWaalsContact C-N 3.34Å; E197-L199 PolarHBondContact O-N 3.3Å; L199-L202 PolarHBondContact O-N 3.26Å; L199-K203 WeakPolarHBondContact O-CB 3.18Å; L199-K203 PolarHBondContact O-N 3.06Å |
| 200 | A | 80.4 | Confident | 74 | Confident | 55 Ų | 55 | 94.7 Ų | 94.7 | 46% | 0.455 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -66.8 | -38.3 | 175 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q196 E197 R204 | Q196-A200 VanDerWaalsContact O-CB 3.31Å; Q196-A200 WeakPolarHBondContact O-CB 3.29Å; Q196-A200 PolarHBondContact O-N 3.32Å; E197-A200 PolarHBondContact O-N 3.03Å; A200-R204 PolarHBondContact O-N 3.07Å |
| 201 | S | 79.1 | Confident | 73.7 | Confident | 71 Ų | 71 | 92.4 Ų | 92.4 | 50% | 0.497 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -68.8 | -40.8 | 175.8 | 71.1 | 0 | 0 | 0 | 0 | 111.4 | E197 A198 R204 L205 | E197-S201 PolarHBondContact O-N 3.3Å; E197-S201 PolarHBondContact O-OG 3.43Å; A198-S201 WeakPolarHBondContact CA-OG 3.23Å; A198-S201 PolarHBondContact O-N 3.16Å; A198-S201 PolarHBondContact O-OG 3.02Å; S201-R204 PolarHBondContact O-N 2.98Å; S201-L205 WeakPolarHBondContact O-CB 3.37Å; S201-L205 PolarHBondContact O-N 3.41Å |
| 202 | L | 71.7 | Confident | 73.7 | Confident | 79 Ų | 79 | 98.2 Ų | 98.2 | 41% | 0.414 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -59.6 | -48.7 | 173.5 | -172.9 | 72.3 | 0 | 0 | 0 | 110.9 | A198 L199 R204 L205 T206 | A198-L202 WeakPolarHBondContact O-CB 3.42Å; A198-L202 PolarHBondContact O-N 3.2Å; L199-L202 PolarHBondContact O-N 3.26Å; L202-R204 VanDerWaalsContact C-N 3.32Å; L202-R204 PolarHBondContact O-N 3.28Å; L202-L205 PolarHBondContact O-N 2.88Å; L202-L205 VanDerWaalsContact O-N 3.12Å; L202-T206 PolarHBondContact O-N 2.96Å; L202-T206 PolarHBondContact O-OG1 3Å |
| 203 | K | 80.2 | Confident | 73 | Confident | 133 Ų | 133 | 95.5 Ų | 95.5 | 58% | 0.578 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -59.3 | -43.9 | 178.3 | -172.6 | 176.1 | -179.2 | -179.5 | 0 | 111.7 | L199 L205 T206 D207 | L199-K203 WeakPolarHBondContact O-CB 3.18Å; L199-K203 PolarHBondContact O-N 3.06Å; K203-L205 VanDerWaalsContact C-N 3.33Å; K203-L205 PolarHBondContact O-N 3.03Å; K203-T206 PolarHBondContact O-N 3.41Å; K203-D207 WeakPolarHBondContact O-CB 3.42Å; K203-D207 VanDerWaalsContact O-CG 3.25Å; K203-D207 PolarHBondContact O-N 2.82Å |
| 204 | R | 79.5 | Confident | 72 | Confident | 197 Ų | 197 | 95.8 Ų | 95.8 | 74% | 0.743 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -61.7 | -39.6 | 175.3 | -84.4 | -172.8 | 160.3 | 156.7 | -2.3 | 112.7 | A200 S201 L202 L208 | A200-R204 PolarHBondContact O-N 3.07Å; S201-R204 PolarHBondContact O-N 2.98Å; L202-R204 VanDerWaalsContact C-N 3.32Å; L202-R204 PolarHBondContact O-N 3.28Å; R204-L208 WeakPolarHBondContact O-CB 3.06Å; R204-L208 PolarHBondContact O-N 3.21Å |
| 205 | L | 70.5 | Confident | 70.6 | Confident | 68 Ų | 68 | 94.1 Ų | 94.1 | 36% | 0.356 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -71.9 | -39.1 | 178.9 | -171 | 66.1 | 0 | 0 | 0 | 111.7 | S201 L202 K203 L208 T209 | S201-L205 WeakPolarHBondContact O-CB 3.37Å; S201-L205 PolarHBondContact O-N 3.41Å; L202-L205 PolarHBondContact O-N 2.88Å; L202-L205 VanDerWaalsContact O-N 3.12Å; K203-L205 VanDerWaalsContact C-N 3.33Å; K203-L205 PolarHBondContact O-N 3.03Å; L205-L208 PolarHBondContact O-N 2.92Å; L205-T209 VanDerWaalsContact O-CB 3.32Å; L205-T209 WeakPolarHBondContact O-CB 3.2Å; L205-T209 PolarHBondContact O-N 2.66Å; L205-T209 PolarHBondContact O-OG1 2.8Å |
| 206 | T | 73.4 | Confident | 69.3 | Low | 77 Ų | 77 | 96.6 Ų | 96.6 | 47% | 0.472 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.1 | -42.8 | 173.3 | -55.2 | 0 | 0 | 0 | 0 | 110.9 | L202 K203 T209 A210 | L202-T206 PolarHBondContact O-N 2.96Å; L202-T206 PolarHBondContact O-OG1 3Å; K203-T206 PolarHBondContact O-N 3.41Å; T206-T209 PolarHBondContact O-N 2.85Å; T206-A210 WeakPolarHBondContact O-CB 3.33Å; T206-A210 PolarHBondContact O-N 3.49Å |
| 207 | D | 75.6 | Confident | 67.9 | Low | 97 Ų | 97 | 99.9 Ų | 99.9 | 52% | 0.519 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -65.8 | -38.5 | 176.4 | -72.4 | -17.2 | 0 | 0 | 0 | 111.5 | K203 G211 | K203-D207 WeakPolarHBondContact O-CB 3.42Å; K203-D207 VanDerWaalsContact O-CG 3.25Å; K203-D207 PolarHBondContact O-N 2.82Å; D207-G211 WeakPolarHBondContact O-CA 3.22Å; D207-G211 PolarHBondContact O-N 3.46Å |
| 208 | L | 73.5 | Confident | 66.3 | Low | 121 Ų | 121 | 99.4 Ų | 99.4 | 63% | 0.634 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -65.6 | -38.9 | 172.2 | -99.6 | 154.3 | 0 | 0 | 0 | 112.4 | R204 L205 K212 | R204-L208 WeakPolarHBondContact O-CB 3.06Å; R204-L208 PolarHBondContact O-N 3.21Å; L205-L208 PolarHBondContact O-N 2.92Å; L208-K212 WeakPolarHBondContact O-CB 3.12Å; L208-K212 PolarHBondContact O-N 3.36Å |
| 209 | T | 67.8 | Low | 65 | Low | 53 Ų | 53 | 105.3 Ų | 105.3 | 33% | 0.325 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -74.2 | -43.8 | -179.8 | -56.8 | 0 | 0 | 0 | 0 | 110.9 | L205 T206 K212 L213 | L205-T209 VanDerWaalsContact O-CB 3.32Å; L205-T209 WeakPolarHBondContact O-CB 3.2Å; L205-T209 PolarHBondContact O-N 2.66Å; L205-T209 PolarHBondContact O-OG1 2.8Å; T206-T209 PolarHBondContact O-N 2.85Å; T209-K212 PolarHBondContact O-N 2.81Å; T209-L213 HydrophobicContact CG2-CD1 4.09Å; T209-L213 VanDerWaalsContact O-CB 3.31Å; T209-L213 WeakPolarHBondContact O-CB 3.08Å; T209-L213 WeakPolarHBondContact O-CG 3.36Å; T209-L213 PolarHBondContact O-N 3.49Å |
| 210 | A | 64.3 | Low | 63.2 | Low | 47 Ų | 47 | 106.3 Ų | 106.3 | 39% | 0.388 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -63.8 | -43.6 | 174 | 0 | 0 | 0 | 0 | 0 | 110.9 | T206 L213 L214 | T206-A210 WeakPolarHBondContact O-CB 3.33Å; T206-A210 PolarHBondContact O-N 3.49Å; A210-L213 PolarHBondContact O-N 2.83Å; A210-L214 WeakPolarHBondContact O-CB 3.37Å; A210-L214 PolarHBondContact O-N 3.29Å |
| 211 | G | 60.2 | Low | 61.1 | Low | 31 Ų | 31 | 114.1 Ų | 114.1 | 32% | 0.32 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -63.9 | -43.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | D207 L214 C215 | D207-G211 WeakPolarHBondContact O-CA 3.22Å; D207-G211 PolarHBondContact O-N 3.46Å; G211-L214 PolarHBondContact O-N 3.36Å; G211-C215 PolarHBondContact O-N 3.2Å; G211-C215 PolarHBondContact O-SG 3.41Å |
| 212 | K | 64 | Low | 59.3 | Low | 142 Ų | 142 | 116.1 Ų | 116.1 | 62% | 0.617 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -70.5 | -32.8 | 178.2 | -166.6 | 174.1 | -176.9 | -177.5 | 0 | 112.7 | L208 T209 H216 | L208-K212 WeakPolarHBondContact O-CB 3.12Å; L208-K212 PolarHBondContact O-N 3.36Å; T209-K212 PolarHBondContact O-N 2.81Å; K212-H216 PolarHBondContact O-N 3.38Å |
| 213 | L | 53.8 | Low | 57.7 | Low | 121 Ų | 121 | 121 Ų | 121 | 63% | 0.634 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -69.7 | -36.1 | 170.6 | -73.9 | 170.1 | 0 | 0 | 0 | 111.7 | T209 A210 F217 | T209-L213 HydrophobicContact CG2-CD1 4.09Å; T209-L213 VanDerWaalsContact O-CB 3.31Å; T209-L213 WeakPolarHBondContact O-CB 3.08Å; T209-L213 WeakPolarHBondContact O-CG 3.36Å; T209-L213 PolarHBondContact O-N 3.49Å; A210-L213 PolarHBondContact O-N 2.83Å; L213-F217 PolarHBondContact O-N 3.44Å |
| 214 | L | 52.7 | Low | 55.8 | Low | 108 Ų | 108 | 119.3 Ų | 119.3 | 57% | 0.565 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -68.1 | -44.8 | 174.4 | -125.4 | 99.6 | 0 | 0 | 0 | 111.5 | A210 G211 H216 F217 E218 | A210-L214 WeakPolarHBondContact O-CB 3.37Å; A210-L214 PolarHBondContact O-N 3.29Å; G211-L214 PolarHBondContact O-N 3.36Å; L214-H216 VanDerWaalsContact C-N 3.26Å; L214-H216 PolarHBondContact O-N 2.86Å; L214-F217 PolarHBondContact O-N 3.27Å; L214-E218 VanDerWaalsContact O-CB 3.31Å; L214-E218 WeakPolarHBondContact O-CB 3.34Å; L214-E218 PolarHBondContact O-N 2.74Å |
| 215 | C | 47.3 | Very low | 53.5 | Low | 79 Ų | 79 | 114.9 Ų | 114.9 | 53% | 0.534 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -61.3 | -34.6 | 178.4 | -67.1 | 0 | 0 | 0 | 0 | 112.2 | G211 F217 E219 | G211-C215 PolarHBondContact O-N 3.2Å; G211-C215 PolarHBondContact O-SG 3.41Å; C215-F217 VanDerWaalsContact C-N 3.33Å; C215-E219 WeakPolarHBondContact O-CB 3.21Å; C215-E219 PolarHBondContact O-N 2.78Å |
| 216 | H | 47.6 | Very low | 52.2 | Low | 147 Ų | 147 | 119.7 Ų | 119.7 | 68% | 0.681 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -78.1 | -17 | 176.4 | -155.8 | -67.8 | 0 | 0 | 0 | 113.5 | K212 L214 | K212-H216 PolarHBondContact O-N 3.38Å; L214-H216 VanDerWaalsContact C-N 3.26Å; L214-H216 PolarHBondContact O-N 2.86Å |
| 217 | F | 47.8 | Very low | 50.7 | Low | 190 Ų | 190 | 124.8 Ų | 124.8 | 83% | 0.833 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -92.7 | -26.3 | 174.9 | -143.8 | -92 | 0 | 0 | 0 | 112.5 | L213 L214 C215 | L213-F217 PolarHBondContact O-N 3.44Å; L214-F217 PolarHBondContact O-N 3.27Å; C215-F217 VanDerWaalsContact C-N 3.33Å |
| 218 | E | 48.2 | Very low | 49.8 | Very low | 138 Ų | 138 | 124.9 Ų | 124.9 | 65% | 0.645 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -88.2 | -22.4 | -178.6 | -162.6 | 167.5 | -178.7 | 0 | 0 | 113.1 | L214 S220 | L214-E218 VanDerWaalsContact O-CB 3.31Å; L214-E218 WeakPolarHBondContact O-CB 3.34Å; L214-E218 PolarHBondContact O-N 2.74Å; E218-S220 PolarHBondContact O-N 2.67Å; E218-S220 VanDerWaalsContact O-N 3.14Å |
| 219 | E | 49.2 | Very low | 49.1 | Very low | 167 Ų | 167 | 123.1 Ų | 123.1 | 78% | 0.78 | 65% | 0.653 | S | S | * | * | S | Bend | trans | -79.2 | 12.8 | 178.3 | -165.1 | 152.4 | -168.6 | 0 | 0 | 114.5 | C215 | C215-E219 WeakPolarHBondContact O-CB 3.21Å; C215-E219 PolarHBondContact O-N 2.78Å |
| 220 | S | 40.9 | Very low | 49.5 | Very low | 112 Ų | 112 | 126.5 Ų | 126.5 | 78% | 0.783 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -106.8 | 43.9 | 165.2 | -66.1 | 0 | 0 | 0 | 0 | 112.2 | E218 | E218-S220 PolarHBondContact O-N 2.67Å; E218-S220 VanDerWaalsContact O-N 3.14Å |
| 221 | R | 36.8 | Very low | 49.9 | Very low | 218 Ų | 218 | 129.4 Ų | 129.4 | 82% | 0.823 | 67% | 0.673 | S | S | * | * | trans | -152.4 | 132.3 | 160.2 | -122.7 | -174.8 | -173.1 | 172.8 | 2.9 | 104.8 | ||||
| 222 | P | 40.2 | Very low | 50.7 | Low | 114 Ų | 114 | 132.9 Ų | 132.9 | 74% | 0.74 | 69% | 0.685 | S | S | * | * | -148.2 | 154.3 | 63.7 | 35.3 | -14.2 | 0 | 0 | 0 | 112.4 | |||||
| 223 | Q | 37.9 | Very low | 51.3 | Low | 181 Ų | 181 | 131.7 Ų | 131.7 | 85% | 0.846 | 68% | 0.684 | S | S | * | * | 163 | 164.7 | 96.8 | -103.3 | -133.3 | 4.7 | 0 | 0 | 109.4 | |||||
| 224 | P | 40.4 | Very low | 52.5 | Low | 97 Ų | 97 | 131.1 Ų | 131.1 | 63% | 0.63 | 68% | 0.681 | S | S | * | * | trans | -99.6 | 170 | -143.4 | 39.3 | -34.8 | 0 | 0 | 0 | 114.5 | ||||
| 225 | S | 31.6 | Very low | 53.8 | Low | 105 Ų | 105 | 131.6 Ų | 131.6 | 73% | 0.734 | 68% | 0.68 | S | S | * | * | trans | 59.2 | 92.9 | 162.3 | 63.4 | 0 | 0 | 0 | 0 | 117 | ||||
| 226 | L | 44.3 | Very low | 55.6 | Low | 169 Ų | 169 | 133 Ų | 133 | 89% | 0.885 | 68% | 0.683 | S | S | * | * | trans | -160.4 | 108.3 | 131.8 | -124.3 | 77.3 | 0 | 0 | 0 | 104.7 | P228 | L226-P228 VanDerWaalsContact O-CD 3.24Å; L226-P228 WeakPolarHBondContact O-CD 3.48Å | ||
| 227 | E | 41.8 | Very low | 57 | Low | 184 Ų | 184 | 131.1 Ų | 131.1 | 86% | 0.86 | 68% | 0.677 | S | S | * | * | trans | -55 | 120.2 | 168.7 | -90.2 | -169.4 | 123.8 | 0 | 0 | 107.6 | N229 | E227-N229 PolarHBondContact O-N 3.47Å; E227-N229 VanDerWaalsContact O-N 3.1Å | ||
| 228 | P | 55.8 | Low | 58.6 | Low | 98 Ų | 98 | 126.6 Ų | 126.6 | 64% | 0.636 | 66% | 0.658 | S | S | * | * | trans | -66.3 | 112.4 | 161.7 | 27.8 | -28.6 | 0 | 0 | 0 | 106 | L226 I230 | L226-P228 VanDerWaalsContact O-CD 3.24Å; L226-P228 WeakPolarHBondContact O-CD 3.48Å; P228-I230 PolarHBondContact O-N 3.22Å | ||
| 229 | N | 58.5 | Low | 60.2 | Low | 85 Ų | 85 | 123.9 Ų | 123.9 | 46% | 0.455 | 65% | 0.648 | S | S | . | * | trans | -55.4 | 134.2 | -178.7 | -147 | 15.1 | 0 | 0 | 0 | 108.4 | E227 E231 D232 L233 | E227-N229 PolarHBondContact O-N 3.47Å; E227-N229 VanDerWaalsContact O-N 3.1Å; N229-E231 WeakPolarHBondContact CB-OE2 3.36Å; N229-E231 PolarHBondContact ND2-OE2 2.78Å; N229-E231 PolarHBondContact O-N 3.34Å; N229-E231 PolarHBondContact OD1-OE2 2.77Å; N229-D232 PolarHBondContact O-N 3.16Å; N229-L233 PolarHBondContact O-N 3.46Å | ||
| 230 | I | 75.3 | Confident | 61.6 | Low | 124 Ų | 124 | 119.3 Ų | 119.3 | 64% | 0.636 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -57.1 | -27.4 | -174.6 | -64.3 | 169.3 | 0 | 0 | 0 | 110.8 | P228 L233 L234 | P228-I230 PolarHBondContact O-N 3.22Å; I230-L233 PolarHBondContact O-N 3.26Å; I230-L234 HydrophobicContact CG2-CD1 4.15Å; I230-L234 HydrophobicContact CG2-CG 4.45Å; I230-L234 WeakPolarHBondContact O-CB 3.3Å; I230-L234 WeakPolarHBondContact O-CG 3.45Å; I230-L234 PolarHBondContact O-N 2.85Å |
| 231 | E | 73.3 | Confident | 63.2 | Low | 108 Ų | 108 | 117.2 Ų | 117.2 | 51% | 0.505 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -67.2 | -39.6 | 176.8 | -58.2 | 77.7 | -178 | 0 | 0 | 112 | N229 L233 L234 H235 | N229-E231 WeakPolarHBondContact CB-OE2 3.36Å; N229-E231 PolarHBondContact ND2-OE2 2.78Å; N229-E231 PolarHBondContact O-N 3.34Å; N229-E231 PolarHBondContact OD1-OE2 2.77Å; E231-L233 VanDerWaalsContact C-N 3.34Å; E231-L234 PolarHBondContact O-N 3.43Å; E231-H235 VanDerWaalsContact O-CB 3.23Å; E231-H235 WeakPolarHBondContact O-CB 2.7Å; E231-H235 PolarHBondContact O-N 3.36Å |
| 232 | D | 77.6 | Confident | 65.2 | Low | 104 Ų | 104 | 112 Ų | 112 | 56% | 0.556 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -68.9 | -39.4 | 176.4 | -67.6 | -23.2 | 0 | 0 | 0 | 109.9 | N229 H235 D236 | N229-D232 PolarHBondContact O-N 3.16Å; D232-H235 PolarHBondContact O-N 3.41Å; D232-D236 PolarHBondContact O-N 3.24Å |
| 233 | L | 75.5 | Confident | 66.9 | Low | 117 Ų | 117 | 116.6 Ų | 116.6 | 61% | 0.613 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -67.6 | -38.6 | 175.9 | -139.7 | 81.7 | 0 | 0 | 0 | 112.1 | N229 I230 E231 L237 | N229-L233 PolarHBondContact O-N 3.46Å; I230-L233 PolarHBondContact O-N 3.26Å; E231-L233 VanDerWaalsContact C-N 3.34Å; L233-L237 WeakPolarHBondContact O-CB 3.39Å; L233-L237 PolarHBondContact O-N 2.88Å; L233-L237 VanDerWaalsContact O-N 3.08Å |
| 234 | L | 79.6 | Confident | 68.1 | Low | 109 Ų | 109 | 115.3 Ų | 115.3 | 57% | 0.571 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -68.2 | -37.2 | 173.6 | -82 | 172.9 | 0 | 0 | 0 | 111.7 | I230 E231 L237 E238 | I230-L234 HydrophobicContact CG2-CD1 4.15Å; I230-L234 HydrophobicContact CG2-CG 4.45Å; I230-L234 WeakPolarHBondContact O-CB 3.3Å; I230-L234 WeakPolarHBondContact O-CG 3.45Å; I230-L234 PolarHBondContact O-N 2.85Å; E231-L234 PolarHBondContact O-N 3.43Å; L234-L237 WeakPolarHBondContact O-CB 3.14Å; L234-L237 PolarHBondContact O-N 3.23Å; L234-E238 WeakPolarHBondContact O-CB 3.19Å; L234-E238 PolarHBondContact O-N 2.96Å |
| 235 | H | 81 | Confident | 68.8 | Low | 117 Ų | 117 | 113.9 Ų | 113.9 | 54% | 0.542 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -71.6 | -40.3 | -179.9 | -161.9 | 24.9 | 0 | 0 | 0 | 111.5 | E231 D232 L237 E238 N239 | E231-H235 VanDerWaalsContact O-CB 3.23Å; E231-H235 WeakPolarHBondContact O-CB 2.7Å; E231-H235 PolarHBondContact O-N 3.36Å; D232-H235 PolarHBondContact O-N 3.41Å; H235-L237 VanDerWaalsContact C-N 3.3Å; H235-L237 PolarHBondContact O-N 3.34Å; H235-E238 IonicContact ND1-OE2 3.82Å; H235-E238 PolarHBondContact O-N 3.1Å; H235-N239 VanDerWaalsContact O-CB 3.29Å; H235-N239 WeakPolarHBondContact O-CB 3.48Å; H235-N239 PolarHBondContact O-N 2.81Å |
| 236 | D | 83.6 | Confident | 70 | Confident | 110 Ų | 110 | 115.5 Ų | 115.5 | 59% | 0.588 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -61.6 | -39.8 | 170.3 | -92.5 | -4.3 | 0 | 0 | 0 | 111.3 | D232 N239 V240 | D232-D236 PolarHBondContact O-N 3.24Å; D236-N239 PolarHBondContact O-N 3.28Å; D236-V240 WeakPolarHBondContact O-CB 2.92Å; D236-V240 WeakPolarHBondContact O-CG2 3.31Å; D236-V240 PolarHBondContact O-N 3.34Å |
| 237 | L | 78.4 | Confident | 70.2 | Confident | 106 Ų | 106 | 109.6 Ų | 109.6 | 56% | 0.555 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -64.7 | -43.7 | 175.4 | -150.8 | 102.9 | 0 | 0 | 0 | 111.5 | L233 L234 H235 N239 V240 L241 | L233-L237 WeakPolarHBondContact O-CB 3.39Å; L233-L237 PolarHBondContact O-N 2.88Å; L233-L237 VanDerWaalsContact O-N 3.08Å; L234-L237 WeakPolarHBondContact O-CB 3.14Å; L234-L237 PolarHBondContact O-N 3.23Å; H235-L237 VanDerWaalsContact C-N 3.3Å; H235-L237 PolarHBondContact O-N 3.34Å; L237-N239 VanDerWaalsContact C-N 3.34Å; L237-V240 PolarHBondContact O-N 3.4Å; L237-L241 HydrophobicContact CD2-CD1 3.85Å; L237-L241 HydrophobicContact CG-CD1 3.93Å; L237-L241 WeakPolarHBondContact O-CD1 3.4Å; L237-L241 PolarHBondContact O-N 3.44Å |
| 238 | E | 81.4 | Confident | 70.5 | Confident | 95 Ų | 95 | 109.5 Ų | 109.5 | 44% | 0.444 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -61.6 | -42.6 | 175.6 | -175.1 | 175.2 | -158.6 | 0 | 0 | 111 | L234 H235 V240 L241 D242 | L234-E238 WeakPolarHBondContact O-CB 3.19Å; L234-E238 PolarHBondContact O-N 2.96Å; H235-E238 IonicContact ND1-OE2 3.82Å; H235-E238 PolarHBondContact O-N 3.1Å; E238-V240 VanDerWaalsContact C-N 3.32Å; E238-V240 PolarHBondContact O-N 2.7Å; E238-L241 PolarHBondContact O-N 3.37Å; E238-D242 VanDerWaalsContact O-CB 3.32Å; E238-D242 WeakPolarHBondContact O-CB 3.38Å; E238-D242 PolarHBondContact O-N 3.19Å |
| 239 | N | 81.2 | Confident | 70.1 | Confident | 81 Ų | 81 | 114 Ų | 114 | 43% | 0.433 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -66.6 | -35.1 | 178.3 | -153.4 | 8.7 | 0 | 0 | 0 | 111.7 | H235 D236 L237 R243 | H235-N239 VanDerWaalsContact O-CB 3.29Å; H235-N239 WeakPolarHBondContact O-CB 3.48Å; H235-N239 PolarHBondContact O-N 2.81Å; D236-N239 PolarHBondContact O-N 3.28Å; L237-N239 VanDerWaalsContact C-N 3.34Å; N239-R243 WeakPolarHBondContact O-CB 3.27Å; N239-R243 VanDerWaalsContact O-CG 3.3Å; N239-R243 WeakPolarHBondContact O-CG 3.25Å; N239-R243 PolarHBondContact O-N 3.18Å |
| 240 | V | 79.2 | Confident | 69.4 | Low | 72 Ų | 72 | 114.7 Ų | 114.7 | 44% | 0.436 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -68.3 | -44.4 | 171.4 | 170.4 | 0 | 0 | 0 | 0 | 110.7 | D236 L237 E238 D242 R243 F244 | D236-V240 WeakPolarHBondContact O-CB 2.92Å; D236-V240 WeakPolarHBondContact O-CG2 3.31Å; D236-V240 PolarHBondContact O-N 3.34Å; L237-V240 PolarHBondContact O-N 3.4Å; E238-V240 VanDerWaalsContact C-N 3.32Å; E238-V240 PolarHBondContact O-N 2.7Å; V240-D242 VanDerWaalsContact C-N 3.34Å; V240-D242 PolarHBondContact O-N 3.33Å; V240-R243 WeakPolarHBondContact O-CB 2.81Å; V240-R243 PolarHBondContact O-N 2.87Å; V240-F244 HydrophobicContact CG1-CD2 3.7Å; V240-F244 HydrophobicContact CG1-CE2 3.71Å; V240-F244 WeakPolarHBondContact O-CD2 3.39Å; V240-F244 PolarHBondContact O-N 3.27Å |
| 241 | L | 73.1 | Confident | 67.8 | Low | 68 Ų | 68 | 114.1 Ų | 114.1 | 36% | 0.356 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -65.3 | -35.5 | 176.7 | -92.8 | 92.8 | 0 | 0 | 0 | 113 | L237 E238 F244 G245 L246 | L237-L241 HydrophobicContact CD2-CD1 3.85Å; L237-L241 HydrophobicContact CG-CD1 3.93Å; L237-L241 WeakPolarHBondContact O-CD1 3.4Å; L237-L241 PolarHBondContact O-N 3.44Å; E238-L241 PolarHBondContact O-N 3.37Å; L241-F244 CarbonylContact O-C 3.59Å; L241-F244 PolarHBondContact O-N 3.06Å; L241-G245 PolarHBondContact O-N 2.61Å; L241-L246 PolarHBondContact O-N 2.8Å |
| 242 | D | 79.6 | Confident | 66.3 | Low | 108 Ų | 108 | 120.8 Ų | 120.8 | 58% | 0.578 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -67.2 | -43.1 | 175 | -162.5 | 54.3 | 0 | 0 | 0 | 110.6 | E238 V240 F244 G245 | E238-D242 VanDerWaalsContact O-CB 3.32Å; E238-D242 WeakPolarHBondContact O-CB 3.38Å; E238-D242 PolarHBondContact O-N 3.19Å; V240-D242 VanDerWaalsContact C-N 3.34Å; V240-D242 PolarHBondContact O-N 3.33Å; D242-F244 VanDerWaalsContact C-N 3.25Å; D242-F244 PolarHBondContact O-N 3.17Å; D242-G245 PolarHBondContact O-N 2.91Å |
| 243 | R | 76.3 | Confident | 64.6 | Low | 210 Ų | 210 | 125.7 Ų | 125.7 | 79% | 0.792 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -60 | -32.1 | 171.2 | -81.5 | 177.6 | 171.8 | -125.3 | 0 | 113.7 | N239 V240 G245 | N239-R243 WeakPolarHBondContact O-CB 3.27Å; N239-R243 VanDerWaalsContact O-CG 3.3Å; N239-R243 WeakPolarHBondContact O-CG 3.25Å; N239-R243 PolarHBondContact O-N 3.18Å; V240-R243 WeakPolarHBondContact O-CB 2.81Å; V240-R243 PolarHBondContact O-N 2.87Å; R243-G245 VanDerWaalsContact C-N 3.33Å |
| 244 | F | 62.5 | Low | 62.8 | Low | 154 Ų | 154 | 124.6 Ų | 124.6 | 68% | 0.675 | 65% | 0.651 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.8 | 4.6 | 177.2 | -76.8 | -68.4 | 0 | 0 | 0 | 113.6 | V240 L241 D242 L246 | V240-F244 HydrophobicContact CG1-CD2 3.7Å; V240-F244 HydrophobicContact CG1-CE2 3.71Å; V240-F244 WeakPolarHBondContact O-CD2 3.39Å; V240-F244 PolarHBondContact O-N 3.27Å; L241-F244 CarbonylContact O-C 3.59Å; L241-F244 PolarHBondContact O-N 3.06Å; D242-F244 VanDerWaalsContact C-N 3.25Å; D242-F244 PolarHBondContact O-N 3.17Å; F244-L246 HydrophobicContact CB-CD1 4.28Å; F244-L246 PolarHBondContact O-N 3.45Å |
| 245 | G | 54.9 | Low | 61.2 | Low | 67 Ų | 67 | 125.2 Ų | 125.2 | 69% | 0.691 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 63.2 | 24.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | L241 D242 R243 | L241-G245 PolarHBondContact O-N 2.61Å; D242-G245 PolarHBondContact O-N 2.91Å; R243-G245 VanDerWaalsContact C-N 3.33Å |
| 246 | L | 57.1 | Low | 59.6 | Low | 140 Ų | 140 | 129.2 Ų | 129.2 | 73% | 0.733 | 68% | 0.681 | S | S | * | * | trans | -111 | 10.6 | -171.1 | -79.2 | 170.1 | 0 | 0 | 0 | 113.7 | L241 F244 | L241-L246 PolarHBondContact O-N 2.8Å; F244-L246 HydrophobicContact CB-CD1 4.28Å; F244-L246 PolarHBondContact O-N 3.45Å | ||
| 247 | S | 47.6 | Very low | 57.7 | Low | 45 Ų | 45 | 133.7 Ų | 133.7 | 32% | 0.315 | 70% | 0.695 | S | S | . | * | S | Bend | trans | -121.2 | 125.4 | 176.1 | -161.3 | 0 | 0 | 0 | 0 | 109.6 | ||
| 248 | K | 49.6 | Very low | 56.3 | Low | 182 Ų | 182 | 133.1 Ų | 133.1 | 79% | 0.791 | 71% | 0.705 | S | S | * | * | S | Bend | trans | 96.5 | 7.4 | 162.1 | -99.5 | 169.4 | -177.7 | 160 | 0 | 124 | ||
| 249 | E | 46.3 | Very low | 54.2 | Low | 192 Ų | 192 | 135.5 Ų | 135.5 | 90% | 0.897 | 72% | 0.722 | S | S | * | * | S | Bend | trans | -100.9 | 94.5 | 165.2 | -114.2 | 88.7 | -142.2 | 0 | 0 | 112 | ||
| 250 | A | 44 | Very low | 52.4 | Low | 99 Ų | 99 | 141.8 Ų | 141.8 | 82% | 0.818 | 75% | 0.745 | S | S | * | * | S | Bend | trans | 173.9 | 4.6 | 152.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||
| 251 | S | 42.1 | Very low | 50.6 | Low | 112 Ų | 112 | 145.2 Ų | 145.2 | 78% | 0.783 | 76% | 0.761 | S | S | * | * | S | Bend | trans | -139.8 | 67.2 | -179.4 | -64.7 | 0 | 0 | 0 | 0 | 111.9 | ||
| 252 | R | 41.3 | Very low | 49.2 | Very low | 249 Ų | 249 | 146.2 Ų | 146.2 | 94% | 0.94 | 77% | 0.774 | S | S | * | * | trans | 170.4 | 88.3 | 150.4 | -95.3 | 161.1 | 177.1 | -154.8 | -0.9 | 111.3 | ||||
| 253 | Q | 42 | Very low | 47.2 | Very low | 206 Ų | 206 | 151.8 Ų | 151.8 | 96% | 0.963 | 79% | 0.787 | S | S | * | * | trans | -137.8 | 102 | 144.3 | -99.2 | -170 | 20.9 | 0 | 0 | 108.5 | ||||
| 254 | A | 38.8 | Very low | 45.8 | Very low | 94 Ų | 94 | 147.7 Ų | 147.7 | 78% | 0.777 | 79% | 0.789 | S | S | * | * | trans | -135.9 | 163.4 | 154.6 | 0 | 0 | 0 | 0 | 0 | 104.6 | ||||
| 255 | P | 45.6 | Very low | 44.8 | Very low | 123 Ų | 123 | 147.5 Ų | 147.5 | 80% | 0.799 | 80% | 0.795 | S | S | * | * | cis | -134.3 | 148 | -3.9 | 35.9 | -18.4 | 0 | 0 | 0 | 113 | ||||
| 256 | E | 46.5 | Very low | 44.4 | Very low | 200 Ų | 200 | 152.9 Ų | 152.9 | 94% | 0.935 | 80% | 0.8 | S | S | * | * | trans | -151.4 | 147.2 | 155.8 | -145.8 | 173.7 | 168 | 0 | 0 | 113.5 | ||||
| 257 | K | 44 | Very low | 44 | Very low | 205 Ų | 205 | 154 Ų | 154 | 89% | 0.891 | 81% | 0.805 | S | S | * | * | trans | -92.9 | 129.7 | -160.5 | -56.9 | 164.9 | 175.2 | 176.1 | 0 | 110.5 | ||||
| 258 | A | 48.1 | Very low | 43.8 | Very low | 93 Ų | 93 | 157.4 Ų | 157.4 | 77% | 0.769 | 82% | 0.824 | S | S | * | * | trans | -178.4 | 101.5 | 150.4 | 0 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 259 | N | 38.3 | Very low | 43.6 | Very low | 146 Ų | 146 | 156.6 Ų | 156.6 | 78% | 0.781 | 82% | 0.823 | S | S | * | * | 51.7 | 89.5 | 83 | -154.5 | -1.1 | 0 | 0 | 0 | 111.9 | |||||
| 260 | F | 44 | Very low | 43.6 | Very low | 212 Ų | 212 | 154.7 Ų | 154.7 | 93% | 0.93 | 82% | 0.819 | S | S | * | * | trans | -157.7 | 92.9 | 146.2 | -111 | -76.1 | 0 | 0 | 0 | 109.1 | ||||
| 261 | D | 40.9 | Very low | 44 | Very low | 144 Ų | 144 | 154.3 Ų | 154.3 | 77% | 0.77 | 82% | 0.815 | S | S | * | * | trans | -70.3 | 162.7 | 162.9 | -164 | -0 | 0 | 0 | 0 | 109.8 | ||||
| 262 | S | 42.7 | Very low | 44.2 | Very low | 90 Ų | 90 | 153.5 Ų | 153.5 | 63% | 0.629 | 81% | 0.808 | S | S | * | * | trans | 94.9 | 122.2 | 161.7 | -140.9 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 263 | R | 38.7 | Very low | 44.3 | Very low | 224 Ų | 224 | 150 Ų | 150 | 85% | 0.845 | 81% | 0.807 | S | S | * | * | trans | 80.2 | 107.6 | 138.9 | -95 | 175.8 | 178 | -168.8 | -0.4 | 118.2 | ||||
| 264 | C | 47.3 | Very low | 44.6 | Very low | 125 Ų | 125 | 145.6 Ų | 145.6 | 85% | 0.845 | 79% | 0.794 | S | S | * | * | -172.3 | 121.6 | 84.6 | -94.9 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 265 | D | 41.9 | Very low | 44.9 | Very low | 150 Ų | 150 | 151.4 Ų | 151.4 | 80% | 0.802 | 80% | 0.796 | S | S | * | * | trans | -76.8 | 158.5 | 169.7 | -112.2 | -24.1 | 0 | 0 | 0 | 111.6 | ||||
| 266 | K | 45.9 | Very low | 44.9 | Very low | 180 Ų | 180 | 152.9 Ų | 152.9 | 78% | 0.783 | 80% | 0.796 | S | S | * | * | trans | 78.7 | 121.1 | 157.1 | -68.8 | 171.2 | -179.5 | -173.2 | 0 | 119.1 | ||||
| 267 | I | 47.9 | Very low | 45.2 | Very low | 163 Ų | 163 | 151.4 Ų | 151.4 | 84% | 0.836 | 79% | 0.789 | S | S | * | * | 169.9 | 92.5 | 120 | -77.2 | 149 | 0 | 0 | 0 | 104.6 | |||||
| 268 | T | 43.9 | Very low | 45.5 | Very low | 117 Ų | 117 | 150.2 Ų | 150.2 | 72% | 0.718 | 78% | 0.779 | S | S | * | * | 67.2 | 108.4 | 88.5 | -54.9 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 269 | E | 45.9 | Very low | 45.3 | Very low | 164 Ų | 164 | 152.4 Ų | 152.4 | 77% | 0.766 | 78% | 0.777 | S | S | * | * | trans | 29.4 | 116.4 | 138.5 | -51.8 | -75.6 | 133.8 | 0 | 0 | 118 | ||||
| 270 | D | 45.3 | Very low | 45.9 | Very low | 152 Ų | 152 | 153.3 Ų | 153.3 | 81% | 0.813 | 78% | 0.777 | S | S | * | * | 170.9 | 114.6 | 118.9 | -83.8 | -27.6 | 0 | 0 | 0 | 111.8 | |||||
| 271 | A | 52.7 | Low | 46.4 | Very low | 91 Ų | 91 | 146 Ų | 146 | 75% | 0.752 | 75% | 0.753 | S | S | * | * | trans | 10.9 | 168 | 140.8 | 0 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 272 | P | 46.8 | Very low | 46.8 | Very low | 96 Ų | 96 | 145.5 Ų | 145.5 | 62% | 0.623 | 75% | 0.749 | S | S | * | * | cis | -137.8 | 158.1 | -28 | 30.2 | -9.7 | 0 | 0 | 0 | 114.8 | T274 | P272-T274 PolarHBondContact O-N 3.1Å; P272-T274 PolarHBondContact O-OG1 3.31Å | ||
| 273 | L | 42.4 | Very low | 47 | Very low | 175 Ų | 175 | 149.1 Ų | 149.1 | 92% | 0.916 | 76% | 0.761 | S | S | * | * | trans | 11.5 | 91.6 | 136.2 | -70.8 | 158.9 | 0 | 0 | 0 | 117.1 | ||||
| 274 | T | 48.7 | Very low | 47.4 | Very low | 113 Ų | 113 | 143 Ų | 143 | 69% | 0.693 | 75% | 0.752 | S | S | * | * | trans | -154.9 | 1 | 163 | 31.7 | 0 | 0 | 0 | 0 | 116.6 | P272 | P272-T274 PolarHBondContact O-N 3.1Å; P272-T274 PolarHBondContact O-OG1 3.31Å | ||
| 275 | R | 45.8 | Very low | 47.4 | Very low | 216 Ų | 216 | 143.1 Ų | 143.1 | 82% | 0.815 | 75% | 0.749 | S | S | * | * | S | Bend | trans | -107.7 | -12.2 | -172.4 | -102.3 | -178.9 | 170.2 | 172.5 | -2.4 | 117.7 | ||
| 276 | L | 44.8 | Very low | 47.4 | Very low | 155 Ų | 155 | 141.1 Ų | 141.1 | 81% | 0.812 | 75% | 0.747 | S | S | * | * | S | Bend | trans | -99.5 | -2.7 | -179.3 | -70.2 | -178.3 | 0 | 0 | 0 | 115.3 | ||
| 277 | Q | 53.2 | Low | 47.2 | Very low | 169 Ų | 169 | 141.9 Ų | 141.9 | 79% | 0.79 | 75% | 0.753 | S | S | * | * | S | Bend | trans | -89.1 | -6.4 | 173.9 | -140.5 | 174.8 | 8.7 | 0 | 0 | 113.4 | ||
| 278 | R | 50.1 | Low | 47.1 | Very low | 179 Ų | 179 | 145.9 Ų | 145.9 | 68% | 0.675 | 76% | 0.758 | S | S | * | * | S | Bend | trans | -95.9 | -2.1 | -175.6 | -159.7 | 175.8 | -91.4 | 138.9 | -8.1 | 114.1 | ||
| 279 | L | 44.8 | Very low | 47 | Very low | 140 Ų | 140 | 145.5 Ų | 145.5 | 73% | 0.733 | 76% | 0.757 | S | S | * | * | S | Bend | trans | -106.4 | -1.1 | 174.5 | -68.2 | 175.7 | 0 | 0 | 0 | 113.4 | ||
| 280 | Q | 50.5 | Low | 47.1 | Very low | 164 Ų | 164 | 143.9 Ų | 143.9 | 77% | 0.766 | 76% | 0.759 | S | S | * | * | S | Bend | trans | -102 | -7.8 | 178.7 | -145.8 | 176.2 | 0.2 | 0 | 0 | 113.1 | ||
| 281 | S | 54.9 | Low | 47.1 | Very low | 60 Ų | 60 | 144.7 Ų | 144.7 | 42% | 0.42 | 76% | 0.758 | S | S | . | * | S | Bend | trans | -94.9 | -12.1 | 179.6 | 50.8 | 0 | 0 | 0 | 0 | 115 | ||
| 282 | D | 48.1 | Very low | 47.2 | Very low | 132 Ų | 132 | 147.7 Ų | 147.7 | 71% | 0.706 | 76% | 0.76 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.7 | 6.1 | -173.3 | -72.1 | -8.3 | 0 | 0 | 0 | 114.2 | ||
| 283 | L | 47.9 | Very low | 47.4 | Very low | 167 Ų | 167 | 149.7 Ų | 149.7 | 87% | 0.874 | 77% | 0.766 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -118.1 | 10.3 | 179 | -109.7 | 132.9 | 0 | 0 | 0 | 114.1 | ||
| 284 | S | 47.6 | Very low | 47.9 | Very low | 94 Ų | 94 | 145.7 Ų | 145.7 | 66% | 0.657 | 75% | 0.753 | S | S | * | * | S | Bend | trans | -121.4 | 20.1 | -177.2 | 59.6 | 0 | 0 | 0 | 0 | 114.7 | ||
| 285 | V | 46.8 | Very low | 48.1 | Very low | 129 Ų | 129 | 149.4 Ų | 149.4 | 78% | 0.782 | 76% | 0.759 | S | S | * | * | trans | -124.7 | 98 | 179.2 | -179.2 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 286 | S | 41.1 | Very low | 48.4 | Very low | 108 Ų | 108 | 148.2 Ų | 148.2 | 76% | 0.755 | 76% | 0.76 | S | S | * | * | S | Bend | trans | 159.4 | 78.2 | 144.4 | 178.7 | 0 | 0 | 0 | 0 | 109.5 | ||
| 287 | E | 41.6 | Very low | 48.9 | Very low | 195 Ų | 195 | 147.4 Ų | 147.4 | 91% | 0.911 | 76% | 0.755 | S | S | * | * | trans | -173.9 | 95.3 | 147.5 | -106.3 | 167.6 | -179.5 | 0 | 0 | 107.6 | ||||
| 288 | R | 45.4 | Very low | 49.1 | Very low | 247 Ų | 247 | 149.5 Ų | 149.5 | 93% | 0.932 | 78% | 0.779 | S | S | * | * | trans | -131.5 | 145.5 | 156.1 | -85.9 | -160.2 | -155.8 | 172.1 | 8.8 | 111.2 | ||||
| 289 | P | 43 | Very low | 49 | Very low | 110 Ų | 110 | 148 Ų | 148 | 71% | 0.714 | 78% | 0.784 | S | S | * | * | trans | -102.9 | 160.9 | -167.4 | 40.6 | -32.3 | 0 | 0 | 0 | 112.1 | ||||
| 290 | T | 48.4 | Very low | 49.2 | Very low | 129 Ų | 129 | 148.4 Ų | 148.4 | 79% | 0.791 | 79% | 0.786 | S | S | * | * | trans | 175.4 | 116.2 | 142 | 23.9 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 291 | E | 45.6 | Very low | 49.2 | Very low | 170 Ų | 170 | 147.6 Ų | 147.6 | 79% | 0.794 | 79% | 0.787 | S | S | * | * | 68.5 | 115.3 | 106.5 | -73 | -151.1 | 133.7 | 0 | 0 | 115.7 | |||||
| 292 | L | 54.1 | Low | 48.8 | Very low | 154 Ų | 154 | 152.7 Ų | 152.7 | 81% | 0.806 | 81% | 0.809 | S | S | * | * | 155.9 | 99.5 | 124.4 | -83.3 | 157.2 | 0 | 0 | 0 | 107.9 | |||||
| 293 | N | 50.2 | Low | 48.9 | Very low | 137 Ų | 137 | 154 Ų | 154 | 73% | 0.733 | 82% | 0.816 | S | S | * | * | 85.2 | 124.4 | 84.1 | -158.2 | -0.8 | 0 | 0 | 0 | 113.1 | |||||
| 294 | S | 53.9 | Low | 49 | Very low | 92 Ų | 92 | 153.1 Ų | 153.1 | 64% | 0.643 | 81% | 0.812 | S | S | * | * | trans | 90.5 | 128.1 | 143.1 | 68.9 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 295 | K | 53 | Low | 49.1 | Very low | 190 Ų | 190 | 157.4 Ų | 157.4 | 83% | 0.826 | 82% | 0.823 | S | S | * | * | trans | 79 | 105.1 | 152 | -76.1 | 165.4 | 171.9 | 175.2 | 0 | 116.5 | ||||
| 296 | K | 51.1 | Low | 49.2 | Very low | 191 Ų | 191 | 159.5 Ų | 159.5 | 83% | 0.83 | 83% | 0.826 | S | S | * | * | 53.3 | 115.2 | 61.7 | -156 | -168.3 | -177.8 | -179.1 | 0 | 111.6 | |||||
| 297 | I | 56.6 | Low | 49.9 | Very low | 139 Ų | 139 | 163.8 Ų | 163.8 | 71% | 0.713 | 83% | 0.832 | S | S | * | * | 165.1 | 123.7 | 119.5 | -80.4 | 158.4 | 0 | 0 | 0 | 108.6 | |||||
| 298 | V | 56 | Low | 50.7 | Low | 212 Ų | 212 | 161 Ų | 161 | 100% | 1.285 | 82% | 0.824 | S | S | * | * | trans | 72.5 | 0 | 165.4 | -177.2 | 0 | 0 | 0 | 0 | 117.2 |
Retrieved 298 of 298 residues in 266.3 ms
(Link to these results)