| 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 | 45.2 | Very low | 46.5 | Very low | 191 Ų | 191 | 89.9 Ų | 89.9 | 94% | 0.941 | 52% | 0.516 | S | S | * | . | 0 | -31.7 | 0 | -61.4 | -61.7 | -97.2 | 0 | 0 | 113.8 | G3 V4 | M1-G3 PolarHBondContact O-N 3.35Å; M1-G3 VanDerWaalsContact O-N 3.14Å; M1-V4 PolarHBondContact O-N 3Å; M1-V4 HydrophobicContact SD-CG2 4.45Å | |||
| 2 | A | 43.6 | Very low | 46.8 | Very low | 82 Ų | 82 | 90.9 Ų | 90.9 | 68% | 0.678 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -54.4 | -30 | 170.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | V4 K6 | A2-V4 VanDerWaalsContact C-N 3.33Å; A2-V4 PolarHBondContact O-N 3.02Å; A2-K6 PolarHBondContact O-N 2.64Å |
| 3 | G | 44.9 | Very low | 46.9 | Very low | 41 Ų | 41 | 86.8 Ų | 86.8 | 42% | 0.423 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -71.9 | -19 | 174.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | M1 K7 | M1-G3 PolarHBondContact O-N 3.35Å; M1-G3 VanDerWaalsContact O-N 3.14Å; G3-K7 VanDerWaalsContact O-CG 3.28Å; G3-K7 WeakPolarHBondContact O-CG 3.26Å; G3-K7 PolarHBondContact O-N 2.94Å |
| 4 | V | 48.4 | Very low | 46.7 | Very low | 81 Ų | 81 | 88.7 Ų | 88.7 | 49% | 0.491 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -78.1 | -45 | 175.5 | 178.5 | 0 | 0 | 0 | 0 | 109.3 | M1 A2 K6 K7 T8 | M1-V4 PolarHBondContact O-N 3Å; M1-V4 HydrophobicContact SD-CG2 4.45Å; A2-V4 VanDerWaalsContact C-N 3.33Å; A2-V4 PolarHBondContact O-N 3.02Å; V4-K6 PolarHBondContact O-N 3.19Å; V4-K7 CarbonylContact O-C 3.58Å; V4-K7 WeakPolarHBondContact O-CA 3.48Å; V4-K7 WeakPolarHBondContact O-CB 3.23Å; V4-K7 PolarHBondContact O-N 3.4Å; V4-T8 HydrophobicContact CG1-CG2 4.14Å; V4-T8 WeakPolarHBondContact O-CG2 3.42Å; V4-T8 PolarHBondContact O-N 3.14Å; V4-T8 PolarHBondContact O-OG1 3.36Å |
| 5 | L | 46.8 | Very low | 46.7 | Very low | 41 Ų | 41 | 85.5 Ų | 85.5 | 22% | 0.215 | 51% | 0.508 | C | S | . | . | H | α-helix | trans | -57.3 | -45.4 | 172.8 | -90 | 165.7 | 0 | 0 | 0 | 112.5 | K7 T8 T9 W61 | L5-K7 PolarHBondContact O-N 3.35Å; L5-T8 PolarHBondContact O-N 2.99Å; L5-T8 VanDerWaalsContact O-N 3.16Å; L5-T8 PolarHBondContact O-OG1 3.02Å; L5-T9 HydrophobicContact CD2-CG2 4.22Å; L5-T9 PolarHBondContact O-N 3.16Å; L5-T9 PolarHBondContact O-OG1 2.92Å; L5-W61 HydrophobicContact CD1-CB 3.54Å; L5-W61 HydrophobicContact CD1-CD2 4.19Å; L5-W61 HydrophobicContact CD1-CE3 3.6Å; L5-W61 HydrophobicContact CD1-CG 4.23Å |
| 6 | K | 47.2 | Very low | 47.1 | Very low | 145 Ų | 145 | 85.1 Ų | 85.1 | 63% | 0.63 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -57.1 | -33.2 | 173.6 | -82.4 | -168.3 | 172.7 | -167.9 | 0 | 113.4 | A2 V4 | A2-K6 PolarHBondContact O-N 2.64Å; V4-K6 PolarHBondContact O-N 3.19Å |
| 7 | K | 50.6 | Low | 47.5 | Very low | 177 Ų | 177 | 81.7 Ų | 81.7 | 77% | 0.77 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -80.4 | -30.4 | 178.2 | -73.5 | 176.2 | 179.9 | -170.2 | 0 | 112.8 | G3 V4 L5 | G3-K7 VanDerWaalsContact O-CG 3.28Å; G3-K7 WeakPolarHBondContact O-CG 3.26Å; G3-K7 PolarHBondContact O-N 2.94Å; V4-K7 CarbonylContact O-C 3.58Å; V4-K7 WeakPolarHBondContact O-CA 3.48Å; V4-K7 WeakPolarHBondContact O-CB 3.23Å; V4-K7 PolarHBondContact O-N 3.4Å; L5-K7 PolarHBondContact O-N 3.35Å |
| 8 | T | 42.5 | Very low | 48.2 | Very low | 102 Ų | 102 | 86.6 Ų | 86.6 | 63% | 0.626 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -95.5 | -25.6 | -174.4 | 59 | 0 | 0 | 0 | 0 | 114.2 | V4 L5 G10 | V4-T8 HydrophobicContact CG1-CG2 4.14Å; V4-T8 WeakPolarHBondContact O-CG2 3.42Å; V4-T8 PolarHBondContact O-N 3.14Å; V4-T8 PolarHBondContact O-OG1 3.36Å; L5-T8 PolarHBondContact O-N 2.99Å; L5-T8 VanDerWaalsContact O-N 3.16Å; L5-T8 PolarHBondContact O-OG1 3.02Å; T8-G10 PolarHBondContact O-N 3.48Å |
| 9 | T | 48.1 | Very low | 48.8 | Very low | 48 Ų | 48 | 84.9 Ų | 84.9 | 29% | 0.294 | 50% | 0.501 | S | S | . | . | S | Bend | trans | -81.6 | -2.9 | 174.8 | 51.9 | 0 | 0 | 0 | 0 | 113.2 | L5 L11 M55 | L5-T9 HydrophobicContact CD2-CG2 4.22Å; L5-T9 PolarHBondContact O-N 3.16Å; L5-T9 PolarHBondContact O-OG1 2.92Å; T9-L11 PolarHBondContact O-N 3.37Å; T9-L11 VanDerWaalsContact O-N 3.09Å; T9-M55 HydrophobicContact CG2-CE 3.32Å; T9-M55 HydrophobicContact CG2-SD 3.99Å |
| 10 | G | 46.7 | Very low | 49.6 | Very low | 37 Ų | 37 | 83.4 Ų | 83.4 | 38% | 0.381 | 49% | 0.494 | S | S | . | . | trans | 63.4 | 11.4 | -173.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | T8 V12 | T8-G10 PolarHBondContact O-N 3.48Å; G10-V12 PolarHBondContact O-N 3.03Å; G10-V12 VanDerWaalsContact O-O 3.13Å | ||
| 11 | L | 47.1 | Very low | 50.4 | Low | 44 Ų | 44 | 88.2 Ų | 88.2 | 23% | 0.23 | 51% | 0.511 | C | S | . | . | trans | -71.9 | 43.5 | 168.7 | -69.4 | 172.2 | 0 | 0 | 0 | 110.7 | T9 E48 M55 | T9-L11 PolarHBondContact O-N 3.37Å; T9-L11 VanDerWaalsContact O-N 3.09Å; L11-E48 HydrophobicContact CD2-CB 3.78Å; L11-E48 HydrophobicContact CD2-CG 3.63Å; L11-M55 HydrophobicContact CD1-SD 4.23Å | ||
| 12 | V | 50.7 | Low | 51.6 | Low | 102 Ų | 102 | 85.8 Ų | 85.8 | 62% | 0.618 | 50% | 0.497 | S | S | * | . | S | Bend | trans | -79 | 106.4 | 143.7 | -175.9 | 0 | 0 | 0 | 0 | 101.2 | G10 L14 | G10-V12 PolarHBondContact O-N 3.03Å; G10-V12 VanDerWaalsContact O-O 3.13Å; V12-L14 VanDerWaalsContact C-N 3.31Å; V12-L14 WeakPolarHBondContact O-CA 3.49Å; V12-L14 PolarHBondContact O-N 3.49Å |
| 13 | G | 47.7 | Very low | 52.9 | Low | 38 Ų | 38 | 85 Ų | 85 | 39% | 0.392 | 48% | 0.48 | S | S | . | . | trans | -42.5 | 106.1 | 173.3 | 0 | 0 | 0 | 0 | 0 | 107.1 | A15 | G13-A15 PolarHBondContact O-N 3.29Š| ||
| 14 | L | 44 | Very low | 54.3 | Low | 113 Ų | 113 | 89.1 Ų | 89.1 | 59% | 0.592 | 50% | 0.499 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.1 | 85.7 | -154.1 | -137 | 150 | 0 | 0 | 0 | 104.5 | V12 | V12-L14 VanDerWaalsContact C-N 3.31Å; V12-L14 WeakPolarHBondContact O-CA 3.49Å; V12-L14 PolarHBondContact O-N 3.49Å |
| 15 | A | 47.7 | Very low | 56 | Low | 41 Ų | 41 | 88.4 Ų | 88.4 | 34% | 0.339 | 49% | 0.492 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 53 | 84.8 | -164.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | G13 L33 | G13-A15 PolarHBondContact O-N 3.29Å; A15-L33 HydrophobicContact CB-CB 4.32Å; A15-L33 HydrophobicContact CB-CG 4.1Å; A15-L33 WeakPolarHBondContact CB-O 3.02Å; A15-L33 WeakPolarHBondContact O-CD2 3.35Å; A15-L33 WeakPolarHBondContact O-CG 3.44Å |
| 16 | V | 52.1 | Low | 57.5 | Low | 79 Ų | 79 | 90.5 Ų | 90.5 | 48% | 0.479 | 51% | 0.506 | S | S | . | . | trans | -102.5 | 125.9 | 146 | -179.8 | 0 | 0 | 0 | 0 | 104 | N18 | V16-N18 PolarHBondContact O-N 3.16Š| ||
| 17 | C | 54.5 | Low | 59.1 | Low | 27 Ų | 27 | 90.7 Ų | 90.7 | 18% | 0.182 | 51% | 0.507 | C | S | . | . | trans | -43.2 | 128.2 | 167.7 | 171.6 | 0 | 0 | 0 | 0 | 107.8 | T19 P20 L29 L33 | C17-T19 PolarHBondContact O-N 3.35Å; C17-T19 PolarHBondContact SG-N 3.32Å; C17-T19 VanDerWaalsContact SG-N 3.35Å; C17-T19 PolarHBondContact SG-O 3.26Å; C17-P20 HydrophobicContact CB-CB 4.35Å; C17-P20 VanDerWaalsContact O-CD 3.31Å; C17-P20 WeakPolarHBondContact O-CD 3.41Å; C17-L29 HydrophobicContact CB-CD1 3.75Å; C17-L33 HydrophobicContact CB-CD1 3.98Å | ||
| 18 | N | 60.2 | Low | 60.6 | Low | 170 Ų | 170 | 87.6 Ų | 87.6 | 91% | 0.909 | 49% | 0.494 | S | S | * | . | S | Bend | trans | -57.3 | -19.9 | -179.8 | -71.8 | -40.6 | 0 | 0 | 0 | 111.5 | V16 | V16-N18 PolarHBondContact O-N 3.16Š|
| 19 | T | 60 | Low | 62.2 | Low | 54 Ų | 54 | 83.5 Ų | 83.5 | 33% | 0.331 | 47% | 0.468 | S | S | . | . | trans | -140.8 | 69.9 | -176.7 | 45.1 | 0 | 0 | 0 | 0 | 111 | C17 H21 E22 | C17-T19 PolarHBondContact O-N 3.35Å; C17-T19 PolarHBondContact SG-N 3.32Å; C17-T19 VanDerWaalsContact SG-N 3.35Å; C17-T19 PolarHBondContact SG-O 3.26Å; T19-H21 PolarHBondContact O-N 3.18Å; T19-E22 VanDerWaalsContact CB-OE2 3.23Å; T19-E22 WeakPolarHBondContact CB-OE2 3.31Å; T19-E22 HydrophobicContact CG2-CG 4.41Å; T19-E22 WeakPolarHBondContact CG2-OE1 3.48Å; T19-E22 WeakPolarHBondContact O-CB 3.41Å; T19-E22 PolarHBondContact O-N 2.92Å; T19-E22 PolarHBondContact OG1-OE2 3.37Å | ||
| 20 | P | 64.6 | Low | 63.6 | Low | 54 Ų | 54 | 83.5 Ų | 83.5 | 35% | 0.351 | 47% | 0.465 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.2 | -13 | -175 | 30.2 | -34.1 | 0 | 0 | 0 | 113.1 | C17 | C17-P20 HydrophobicContact CB-CB 4.35Å; C17-P20 VanDerWaalsContact O-CD 3.31Å; C17-P20 WeakPolarHBondContact O-CD 3.41Å |
| 21 | H | 66.7 | Low | 65.1 | Low | 185 Ų | 185 | 88 Ų | 88 | 86% | 0.856 | 48% | 0.48 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.2 | -8.4 | 176.4 | -56.3 | 108.6 | 0 | 0 | 0 | 113.9 | T19 | T19-H21 PolarHBondContact O-N 3.18Š|
| 22 | E | 69.5 | Low | 66.5 | Low | 140 Ų | 140 | 90.9 Ų | 90.9 | 65% | 0.654 | 49% | 0.492 | S | S | * | . | S | Bend | trans | -82.9 | -26.7 | -178.5 | -75.4 | 176.6 | 176.4 | 0 | 0 | 112.9 | T19 P24 | T19-E22 VanDerWaalsContact CB-OE2 3.23Å; T19-E22 WeakPolarHBondContact CB-OE2 3.31Å; T19-E22 HydrophobicContact CG2-CG 4.41Å; T19-E22 WeakPolarHBondContact CG2-OE1 3.48Å; T19-E22 WeakPolarHBondContact O-CB 3.41Å; T19-E22 PolarHBondContact O-N 2.92Å; T19-E22 PolarHBondContact OG1-OE2 3.37Å; E22-P24 WeakPolarHBondContact O-CD 3.39Å |
| 23 | E | 71.1 | Confident | 67.5 | Low | 67 Ų | 67 | 86.5 Ų | 86.5 | 31% | 0.313 | 47% | 0.466 | S | S | . | . | trans | -105.3 | 108.1 | 178.4 | -74.6 | -69.4 | 176.1 | 0 | 0 | 110.5 | D25 | E23-D25 PolarHBondContact O-N 2.8Š| ||
| 24 | P | 74.6 | Confident | 68.4 | Low | 127 Ų | 127 | 93.5 Ų | 93.5 | 83% | 0.825 | 49% | 0.488 | S | S | * | . | trans | -76.1 | -10.7 | 178.3 | 30.9 | -34.9 | 0 | 0 | 0 | 113.1 | E22 | E22-P24 WeakPolarHBondContact O-CD 3.39Š| ||
| 25 | D | 83.5 | Confident | 69.4 | Low | 66 Ų | 66 | 89.6 Ų | 89.6 | 35% | 0.353 | 48% | 0.475 | S | S | . | . | trans | -96.6 | 114.1 | -178.4 | -171.4 | 0.2 | 0 | 0 | 0 | 111.4 | E23 K27 K28 L29 | E23-D25 PolarHBondContact O-N 2.8Å; D25-K27 VanDerWaalsContact C-N 3.3Å; D25-K27 PolarHBondContact O-N 2.74Å; D25-K27 PolarHBondContact OD1-N 2.72Å; D25-K28 HydrophobicContact CB-CB 4.35Å; D25-K28 HydrophobicContact CB-CD 4.13Å; D25-K28 HydrophobicContact CB-CG 4.22Å; D25-K28 PolarHBondContact O-N 3.05Å; D25-K28 WeakPolarHBondContact OD2-CE 3.46Å; D25-L29 PolarHBondContact O-N 3.49Å; D25-L29 VanDerWaalsContact O-N 3.16Å | ||
| 26 | V | 79.4 | Confident | 70.7 | Confident | 84 Ų | 84 | 89.9 Ų | 89.9 | 51% | 0.509 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -54.9 | -43 | -179.2 | 178.6 | 0 | 0 | 0 | 0 | 111.6 | L29 E30 L38 | V26-L29 WeakPolarHBondContact O-CB 2.84Å; V26-L29 PolarHBondContact O-N 2.95Å; V26-E30 WeakPolarHBondContact O-CG 3.28Å; V26-E30 PolarHBondContact O-N 3.41Å; V26-L38 HydrophobicContact CB-CD1 4.32Å; V26-L38 HydrophobicContact CG1-CD1 3.45Å; V26-L38 VanDerWaalsContact CG1-CD1 3.45Å |
| 27 | K | 80.8 | Confident | 72 | Confident | 149 Ų | 149 | 91.7 Ų | 91.7 | 65% | 0.648 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -69.4 | -40.1 | -175 | -69.6 | -174.8 | 176.2 | -174.7 | 0 | 112.8 | D25 L29 E30 D31 | D25-K27 VanDerWaalsContact C-N 3.3Å; D25-K27 PolarHBondContact O-N 2.74Å; D25-K27 PolarHBondContact OD1-N 2.72Å; K27-L29 VanDerWaalsContact C-N 3.28Å; K27-L29 PolarHBondContact O-N 3.14Å; K27-E30 PolarHBondContact O-N 3.17Å; K27-D31 PolarHBondContact O-N 3Å |
| 28 | K | 80.5 | Confident | 73.1 | Confident | 112 Ų | 112 | 92 Ų | 92 | 49% | 0.487 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -67.1 | -35.6 | 176.7 | -67.1 | -177.8 | -172.6 | 175 | 0 | 111.4 | D25 D31 Q32 | D25-K28 HydrophobicContact CB-CB 4.35Å; D25-K28 HydrophobicContact CB-CD 4.13Å; D25-K28 HydrophobicContact CB-CG 4.22Å; D25-K28 PolarHBondContact O-N 3.05Å; D25-K28 WeakPolarHBondContact OD2-CE 3.46Å; K28-D31 PolarHBondContact O-N 2.83Å; K28-Q32 WeakPolarHBondContact O-CB 3.17Å; K28-Q32 VanDerWaalsContact O-CG 3.26Å; K28-Q32 WeakPolarHBondContact O-CG 2.94Å; K28-Q32 PolarHBondContact O-N 2.91Å |
| 29 | L | 77.4 | Confident | 74.1 | Confident | 17 Ų | 17 | 90.1 Ų | 90.1 | 9% | 0.089 | 47% | 0.471 | C | S | . | . | H | α-helix | trans | -65.7 | -41.8 | 176.6 | -171.6 | 65.7 | 0 | 0 | 0 | 111.1 | C17 D25 V26 K27 Q32 L33 L38 | C17-L29 HydrophobicContact CB-CD1 3.75Å; D25-L29 PolarHBondContact O-N 3.49Å; D25-L29 VanDerWaalsContact O-N 3.16Å; V26-L29 WeakPolarHBondContact O-CB 2.84Å; V26-L29 PolarHBondContact O-N 2.95Å; K27-L29 VanDerWaalsContact C-N 3.28Å; K27-L29 PolarHBondContact O-N 3.14Å; L29-Q32 PolarHBondContact O-N 3.34Å; L29-L33 HydrophobicContact CD1-CD1 3.91Å; L29-L33 HydrophobicContact CG-CD1 4.05Å; L29-L33 WeakPolarHBondContact O-CB 3.47Å; L29-L33 WeakPolarHBondContact O-CD1 3.4Å; L29-L33 PolarHBondContact O-N 3.16Å; L29-L38 HydrophobicContact CD2-CD1 4.1Å; L29-L38 HydrophobicContact CD2-CD2 4.02Å |
| 30 | E | 76.9 | Confident | 75 | Confident | 48 Ų | 48 | 93 Ų | 93 | 22% | 0.224 | 48% | 0.481 | C | S | . | . | H | α-helix | trans | -62.4 | -46.2 | 174 | -70.5 | 175.2 | 155.7 | 0 | 0 | 112.3 | V26 K27 Q32 L33 Q34 L38 | V26-E30 WeakPolarHBondContact O-CG 3.28Å; V26-E30 PolarHBondContact O-N 3.41Å; K27-E30 PolarHBondContact O-N 3.17Å; E30-Q32 VanDerWaalsContact C-N 3.27Å; E30-Q32 PolarHBondContact O-N 3.48Å; E30-L33 PolarHBondContact O-N 2.91Å; E30-L33 VanDerWaalsContact O-N 3.16Å; E30-Q34 PolarHBondContact O-N 3.09Å; E30-Q34 VanDerWaalsContact O-N 3.14Å; E30-L38 HydrophobicContact CG-CB 4.34Å; E30-L38 HydrophobicContact CG-CD1 3.67Å; E30-L38 HydrophobicContact CG-CG 3.81Å; E30-L38 PolarHBondContact OE1-N 3.26Å |
| 31 | D | 78.4 | Confident | 75.8 | Confident | 131 Ų | 131 | 91.4 Ų | 91.4 | 70% | 0.701 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -60.5 | -37.6 | 176.5 | -73.6 | -24.7 | 0 | 0 | 0 | 112 | K27 K28 | K27-D31 PolarHBondContact O-N 3Å; K28-D31 PolarHBondContact O-N 2.83Å |
| 32 | Q | 75.4 | Confident | 76.5 | Confident | 105 Ų | 105 | 87.3 Ų | 87.3 | 49% | 0.491 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -71.4 | -36.3 | 175.8 | -77.7 | 177.5 | -2.8 | 0 | 0 | 112.7 | K28 L29 E30 Q34 | K28-Q32 WeakPolarHBondContact O-CB 3.17Å; K28-Q32 VanDerWaalsContact O-CG 3.26Å; K28-Q32 WeakPolarHBondContact O-CG 2.94Å; K28-Q32 PolarHBondContact O-N 2.91Å; L29-Q32 PolarHBondContact O-N 3.34Å; E30-Q32 VanDerWaalsContact C-N 3.27Å; E30-Q32 PolarHBondContact O-N 3.48Å; Q32-Q34 VanDerWaalsContact C-N 3.33Å |
| 33 | L | 72.4 | Confident | 77.2 | Confident | 10 Ų | 10 | 85 Ų | 85 | 5% | 0.052 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -72.8 | -24.9 | -178.7 | -106.5 | 82.8 | 0 | 0 | 0 | 112.7 | A15 C17 L29 E30 G35 V41 | A15-L33 HydrophobicContact CB-CB 4.32Å; A15-L33 HydrophobicContact CB-CG 4.1Å; A15-L33 WeakPolarHBondContact CB-O 3.02Å; A15-L33 WeakPolarHBondContact O-CD2 3.35Å; A15-L33 WeakPolarHBondContact O-CG 3.44Å; C17-L33 HydrophobicContact CB-CD1 3.98Å; L29-L33 HydrophobicContact CD1-CD1 3.91Å; L29-L33 HydrophobicContact CG-CD1 4.05Å; L29-L33 WeakPolarHBondContact O-CB 3.47Å; L29-L33 WeakPolarHBondContact O-CD1 3.4Å; L29-L33 PolarHBondContact O-N 3.16Å; E30-L33 PolarHBondContact O-N 2.91Å; E30-L33 VanDerWaalsContact O-N 3.16Å; L33-G35 PolarHBondContact O-N 3.24Å; L33-V41 HydrophobicContact CD2-CB 4.11Å; L33-V41 HydrophobicContact CD2-CG1 3.43Å; L33-V41 VanDerWaalsContact CD2-CG1 3.43Å; L33-V41 HydrophobicContact CD2-CG2 3.67Å |
| 34 | Q | 67.4 | Low | 77.7 | Confident | 185 Ų | 185 | 85.7 Ų | 85.7 | 86% | 0.864 | 45% | 0.448 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50 | 25.5 | -175 | -57.8 | -172.6 | -24.3 | 0 | 0 | 113.1 | E30 Q32 | E30-Q34 PolarHBondContact O-N 3.09Å; E30-Q34 VanDerWaalsContact O-N 3.14Å; Q32-Q34 VanDerWaalsContact C-N 3.33Å |
| 35 | G | 65.3 | Low | 78 | Confident | 31 Ų | 31 | 81.9 Ų | 81.9 | 32% | 0.32 | 43% | 0.427 | S | S | . | . | S | Bend | trans | -114.7 | 13.2 | -167.6 | 0 | 0 | 0 | 0 | 0 | 114 | L33 | L33-G35 PolarHBondContact O-N 3.24Š|
| 36 | G | 74.8 | Confident | 78.2 | Confident | 47 Ų | 47 | 84 Ų | 84 | 49% | 0.485 | 44% | 0.435 | S | S | . | . | S | Bend | trans | 84.9 | -146.2 | -173 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||
| 37 | Q | 78.6 | Confident | 78.5 | Confident | 116 Ų | 116 | 85.5 Ų | 85.5 | 54% | 0.542 | 44% | 0.436 | S | S | . | . | trans | -77.7 | 149.9 | 177.7 | -66.7 | -177.8 | -7.7 | 0 | 0 | 111.2 | E39 E40 V41 | Q37-E39 PolarHBondContact O-N 2.99Å; Q37-E40 PolarHBondContact O-N 3.32Å; Q37-E40 VanDerWaalsContact O-N 3.11Å; Q37-V41 PolarHBondContact O-N 3.11Å | ||
| 38 | L | 77.1 | Confident | 78.6 | Confident | 35 Ų | 35 | 80.5 Ų | 80.5 | 18% | 0.183 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -58.8 | -31.6 | 179.4 | -98 | 152.7 | 0 | 0 | 0 | 113.7 | V26 L29 E30 V41 I42 | V26-L38 HydrophobicContact CB-CD1 4.32Å; V26-L38 HydrophobicContact CG1-CD1 3.45Å; V26-L38 VanDerWaalsContact CG1-CD1 3.45Å; L29-L38 HydrophobicContact CD2-CD1 4.1Å; L29-L38 HydrophobicContact CD2-CD2 4.02Å; E30-L38 HydrophobicContact CG-CB 4.34Å; E30-L38 HydrophobicContact CG-CD1 3.67Å; E30-L38 HydrophobicContact CG-CG 3.81Å; E30-L38 PolarHBondContact OE1-N 3.26Å; L38-V41 WeakPolarHBondContact O-CB 3.5Å; L38-V41 PolarHBondContact O-N 3.22Å; L38-I42 VanDerWaalsContact O-CG1 3.3Å; L38-I42 WeakPolarHBondContact O-CG1 3.42Å; L38-I42 PolarHBondContact O-N 3.36Å |
| 39 | E | 82 | Confident | 78.8 | Confident | 129 Ų | 129 | 79.6 Ų | 79.6 | 60% | 0.603 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -62.5 | -41.7 | 176.3 | -67.4 | 83.2 | 173 | 0 | 0 | 112.1 | Q37 V41 I42 L43 | Q37-E39 PolarHBondContact O-N 2.99Å; E39-V41 VanDerWaalsContact C-N 3.33Å; E39-I42 PolarHBondContact O-N 3.3Å; E39-L43 WeakPolarHBondContact O-CB 3.39Å; E39-L43 PolarHBondContact O-N 2.9Å |
| 40 | E | 79.7 | Confident | 79.3 | Confident | 116 Ų | 116 | 82.2 Ų | 82.2 | 54% | 0.542 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -67 | -38.7 | 177.7 | -64.2 | -177.3 | 173.5 | 0 | 0 | 110.7 | Q37 L43 Q44 | Q37-E40 PolarHBondContact O-N 3.32Å; Q37-E40 VanDerWaalsContact O-N 3.11Å; E40-L43 PolarHBondContact O-N 3.38Å; E40-Q44 WeakPolarHBondContact O-CB 3.44Å; E40-Q44 PolarHBondContact O-N 2.87Å |
| 41 | V | 80.1 | Confident | 79.7 | Confident | 20 Ų | 20 | 83 Ų | 83 | 12% | 0.121 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -63.4 | -44.9 | 176.1 | 174.9 | 0 | 0 | 0 | 0 | 111.3 | L33 Q37 L38 E39 L43 Q44 A45 | L33-V41 HydrophobicContact CD2-CB 4.11Å; L33-V41 HydrophobicContact CD2-CG1 3.43Å; L33-V41 VanDerWaalsContact CD2-CG1 3.43Å; L33-V41 HydrophobicContact CD2-CG2 3.67Å; Q37-V41 PolarHBondContact O-N 3.11Å; L38-V41 WeakPolarHBondContact O-CB 3.5Å; L38-V41 PolarHBondContact O-N 3.22Å; E39-V41 VanDerWaalsContact C-N 3.33Å; V41-L43 VanDerWaalsContact C-N 3.34Å; V41-Q44 PolarHBondContact O-N 3.24Å; V41-A45 WeakPolarHBondContact O-CB 3.47Å; V41-A45 PolarHBondContact O-N 3.14Å |
| 42 | I | 82.4 | Confident | 79.9 | Confident | 99 Ų | 99 | 79.1 Ų | 79.1 | 51% | 0.508 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -62.3 | -45.7 | 178 | -68.8 | 164.4 | 0 | 0 | 0 | 109.9 | L38 E39 Q44 A45 E46 | L38-I42 VanDerWaalsContact O-CG1 3.3Å; L38-I42 WeakPolarHBondContact O-CG1 3.42Å; L38-I42 PolarHBondContact O-N 3.36Å; E39-I42 PolarHBondContact O-N 3.3Å; I42-Q44 VanDerWaalsContact C-N 3.34Å; I42-Q44 PolarHBondContact O-N 3.04Å; I42-A45 WeakPolarHBondContact O-CB 3.3Å; I42-A45 PolarHBondContact O-N 2.84Å; I42-E46 PolarHBondContact O-N 3.45Å |
| 43 | L | 84.1 | Confident | 80.4 | Confident | 91 Ų | 91 | 81.2 Ų | 81.2 | 48% | 0.476 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -62 | -42.3 | 178.3 | -176.1 | 64.9 | 0 | 0 | 0 | 111.7 | E39 E40 V41 A45 E46 H47 | E39-L43 WeakPolarHBondContact O-CB 3.39Å; E39-L43 PolarHBondContact O-N 2.9Å; E40-L43 PolarHBondContact O-N 3.38Å; V41-L43 VanDerWaalsContact C-N 3.34Å; L43-A45 PolarHBondContact O-N 3.35Å; L43-E46 PolarHBondContact O-N 3.43Å; L43-H47 PolarHBondContact O-CD2 2.84Å; L43-H47 PolarHBondContact O-N 2.94Å |
| 44 | Q | 80.6 | Confident | 81 | Confident | 81 Ų | 81 | 85.9 Ų | 85.9 | 38% | 0.379 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -61.9 | -43.2 | 174.9 | -178.7 | 173.9 | -21.4 | 0 | 0 | 111.5 | E40 V41 I42 E46 H47 E48 | E40-Q44 WeakPolarHBondContact O-CB 3.44Å; E40-Q44 PolarHBondContact O-N 2.87Å; V41-Q44 PolarHBondContact O-N 3.24Å; I42-Q44 VanDerWaalsContact C-N 3.34Å; I42-Q44 PolarHBondContact O-N 3.04Å; Q44-E46 VanDerWaalsContact C-N 3.29Å; Q44-E46 PolarHBondContact O-N 2.95Å; Q44-H47 PolarHBondContact O-N 3.5Å; Q44-H47 VanDerWaalsContact O-N 3.14Å; Q44-E48 HydrophobicContact CG-CG 4.37Å; Q44-E48 PolarHBondContact NE2-OE1 3.36Å; Q44-E48 WeakPolarHBondContact O-CG 3.48Å; Q44-E48 PolarHBondContact O-N 3.2Å |
| 45 | A | 82.2 | Confident | 81.7 | Confident | 48 Ų | 48 | 78.4 Ų | 78.4 | 40% | 0.397 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -60.4 | -38.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | V41 I42 L43 L49 | V41-A45 WeakPolarHBondContact O-CB 3.47Å; V41-A45 PolarHBondContact O-N 3.14Å; I42-A45 WeakPolarHBondContact O-CB 3.3Å; I42-A45 PolarHBondContact O-N 2.84Å; L43-A45 PolarHBondContact O-N 3.35Å; A45-L49 WeakPolarHBondContact O-CB 3.39Å; A45-L49 PolarHBondContact O-N 3.06Å |
| 46 | E | 85.9 | Confident | 82.3 | Confident | 110 Ų | 110 | 86.5 Ų | 86.5 | 51% | 0.514 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -66.5 | -42.1 | 173.6 | -70 | -172.6 | 166.4 | 0 | 0 | 112.5 | I42 L43 Q44 L49 N50 | I42-E46 PolarHBondContact O-N 3.45Å; L43-E46 PolarHBondContact O-N 3.43Å; Q44-E46 VanDerWaalsContact C-N 3.29Å; Q44-E46 PolarHBondContact O-N 2.95Å; E46-L49 PolarHBondContact O-N 3.18Å; E46-N50 WeakPolarHBondContact O-CB 3.32Å; E46-N50 PolarHBondContact O-N 3.03Å; E46-N50 PolarHBondContact O-ND2 3.31Å |
| 47 | H | 85.7 | Confident | 82.7 | Confident | 116 Ų | 116 | 91.5 Ų | 91.5 | 54% | 0.537 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -63 | -42.8 | 175.4 | -72.6 | -46.5 | 0 | 0 | 0 | 111.8 | L43 Q44 N50 L51 | L43-H47 PolarHBondContact O-CD2 2.84Å; L43-H47 PolarHBondContact O-N 2.94Å; Q44-H47 PolarHBondContact O-N 3.5Å; Q44-H47 VanDerWaalsContact O-N 3.14Å; H47-N50 PolarHBondContact O-N 2.89Å; H47-L51 WeakPolarHBondContact O-CB 3.33Å; H47-L51 PolarHBondContact O-N 2.86Å |
| 48 | E | 83.6 | Confident | 82.8 | Confident | 44 Ų | 44 | 93 Ų | 93 | 21% | 0.206 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -63.6 | -43 | 175.8 | -74.8 | -174.8 | -164.8 | 0 | 0 | 112.1 | L11 Q44 N50 L51 A52 | L11-E48 HydrophobicContact CD2-CB 3.78Å; L11-E48 HydrophobicContact CD2-CG 3.63Å; Q44-E48 HydrophobicContact CG-CG 4.37Å; Q44-E48 PolarHBondContact NE2-OE1 3.36Å; Q44-E48 WeakPolarHBondContact O-CG 3.48Å; Q44-E48 PolarHBondContact O-N 3.2Å; E48-N50 VanDerWaalsContact C-N 3.33Å; E48-N50 PolarHBondContact O-N 3.2Å; E48-L51 PolarHBondContact O-N 3.12Å; E48-A52 WeakPolarHBondContact O-CB 3.42Å; E48-A52 PolarHBondContact O-N 3.29Å |
| 49 | L | 84.4 | Confident | 82.9 | Confident | 92 Ų | 92 | 96 Ų | 96 | 48% | 0.482 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -59.6 | -46 | 175.7 | -173.6 | 87.1 | 0 | 0 | 0 | 111.1 | A45 E46 L51 A52 R53 | A45-L49 WeakPolarHBondContact O-CB 3.39Å; A45-L49 PolarHBondContact O-N 3.06Å; E46-L49 PolarHBondContact O-N 3.18Å; L49-L51 VanDerWaalsContact C-N 3.35Å; L49-A52 PolarHBondContact O-N 3.43Å; L49-R53 WeakPolarHBondContact O-CG 3.29Å; L49-R53 PolarHBondContact O-N 3.13Å; L49-R53 VanDerWaalsContact O-N 3.13Å |
| 50 | N | 88.1 | Confident | 82.3 | Confident | 73 Ų | 73 | 94.3 Ų | 94.3 | 39% | 0.39 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -66.3 | -38.2 | 178.2 | -76.4 | -40.1 | 0 | 0 | 0 | 111.9 | E46 H47 E48 R53 K54 | E46-N50 WeakPolarHBondContact O-CB 3.32Å; E46-N50 PolarHBondContact O-N 3.03Å; E46-N50 PolarHBondContact O-ND2 3.31Å; H47-N50 PolarHBondContact O-N 2.89Å; E48-N50 VanDerWaalsContact C-N 3.33Å; E48-N50 PolarHBondContact O-N 3.2Å; N50-R53 PolarHBondContact O-N 3.42Å; N50-K54 WeakPolarHBondContact O-CG 3.26Å; N50-K54 PolarHBondContact O-N 3.23Å; N50-K54 VanDerWaalsContact O-N 3.13Å |
| 51 | L | 84.7 | Confident | 82.2 | Confident | 63 Ų | 63 | 95.5 Ų | 95.5 | 33% | 0.33 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -63.1 | -47.8 | 174.7 | -177.3 | 65.2 | 0 | 0 | 0 | 110.9 | H47 E48 L49 R53 K54 M55 W58 | H47-L51 WeakPolarHBondContact O-CB 3.33Å; H47-L51 PolarHBondContact O-N 2.86Å; E48-L51 PolarHBondContact O-N 3.12Å; L49-L51 VanDerWaalsContact C-N 3.35Å; L51-R53 VanDerWaalsContact C-N 3.26Å; L51-R53 PolarHBondContact O-N 2.84Å; L51-K54 PolarHBondContact O-N 2.8Å; L51-K54 VanDerWaalsContact O-N 3.09Å; L51-M55 HydrophobicContact CD1-CE 3.88Å; L51-M55 HydrophobicContact CD1-CG 4.38Å; L51-M55 HydrophobicContact CD2-CE 3.66Å; L51-M55 HydrophobicContact CG-CE 3.62Å; L51-M55 HydrophobicContact CG-CG 4.26Å; L51-M55 HydrophobicContact CG-SD 4.25Å; L51-M55 VanDerWaalsContact O-CG 3.29Å; L51-M55 WeakPolarHBondContact O-CG 3.39Å; L51-M55 PolarHBondContact O-N 3.09Å; L51-W58 HydrophobicContact CD1-CZ3 4.43Å |
| 52 | A | 83.4 | Confident | 82 | Confident | 50 Ų | 50 | 99.6 Ų | 99.6 | 41% | 0.413 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -58.9 | -37.8 | 179 | 0 | 0 | 0 | 0 | 0 | 112.3 | E48 L49 R56 | E48-A52 WeakPolarHBondContact O-CB 3.42Å; E48-A52 PolarHBondContact O-N 3.29Å; L49-A52 PolarHBondContact O-N 3.43Å; A52-R56 PolarHBondContact O-N 3.13Å |
| 53 | R | 86.2 | Confident | 81.9 | Confident | 150 Ų | 150 | 100.4 Ų | 100.4 | 57% | 0.566 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -62.4 | -48.5 | 173.2 | -72 | 172.1 | 177.1 | 174.1 | -2.1 | 111.6 | L49 N50 L51 R56 | L49-R53 WeakPolarHBondContact O-CG 3.29Å; L49-R53 PolarHBondContact O-N 3.13Å; L49-R53 VanDerWaalsContact O-N 3.13Å; N50-R53 PolarHBondContact O-N 3.42Å; L51-R53 VanDerWaalsContact C-N 3.26Å; L51-R53 PolarHBondContact O-N 2.84Å; R53-R56 WeakPolarHBondContact O-CB 3.44Å; R53-R56 PolarHBondContact O-N 3.45Å |
| 54 | K | 85.1 | Confident | 81.6 | Confident | 108 Ų | 108 | 103.2 Ų | 103.2 | 47% | 0.47 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -65.4 | -38.7 | 178.2 | -69.8 | 177.8 | -179.8 | -179.2 | 0 | 112.7 | N50 L51 R56 E57 W58 | N50-K54 WeakPolarHBondContact O-CG 3.26Å; N50-K54 PolarHBondContact O-N 3.23Å; N50-K54 VanDerWaalsContact O-N 3.13Å; L51-K54 PolarHBondContact O-N 2.8Å; L51-K54 VanDerWaalsContact O-N 3.09Å; K54-R56 PolarHBondContact O-N 3.01Å; K54-E57 WeakPolarHBondContact O-CB 3.43Å; K54-E57 PolarHBondContact O-N 3.42Å; K54-W58 HydrophobicContact CB-CD2 4.28Å; K54-W58 HydrophobicContact CB-CE3 4.29Å; K54-W58 HydrophobicContact CB-CH2 4.11Å; K54-W58 HydrophobicContact CB-CZ2 4.06Å; K54-W58 HydrophobicContact CB-CZ3 4.21Å; K54-W58 HydrophobicContact CD-CH2 4.1Å; K54-W58 HydrophobicContact CD-CZ2 4.09Å; K54-W58 HydrophobicContact CG-CZ2 4.48Å; K54-W58 PolarHBondContact O-N 3.07Å |
| 55 | M | 81.1 | Confident | 81.3 | Confident | 27 Ų | 27 | 106.2 Ų | 106.2 | 13% | 0.133 | 52% | 0.515 | C | S | . | . | H | α-helix | trans | -59.4 | -30.7 | 176.3 | -73.1 | -171.1 | 170.5 | 0 | 0 | 112.3 | T9 L11 L51 E57 K59 L60 W61 | T9-M55 HydrophobicContact CG2-CE 3.32Å; T9-M55 HydrophobicContact CG2-SD 3.99Å; L11-M55 HydrophobicContact CD1-SD 4.23Å; L51-M55 HydrophobicContact CD1-CE 3.88Å; L51-M55 HydrophobicContact CD1-CG 4.38Å; L51-M55 HydrophobicContact CD2-CE 3.66Å; L51-M55 HydrophobicContact CG-CE 3.62Å; L51-M55 HydrophobicContact CG-CG 4.26Å; L51-M55 HydrophobicContact CG-SD 4.25Å; L51-M55 VanDerWaalsContact O-CG 3.29Å; L51-M55 WeakPolarHBondContact O-CG 3.39Å; L51-M55 PolarHBondContact O-N 3.09Å; M55-E57 VanDerWaalsContact C-N 3.32Å; M55-K59 PolarHBondContact O-N 3.25Å; M55-K59 VanDerWaalsContact O-N 3.12Å; M55-L60 HydrophobicContact CB-CD1 4.41Å; M55-L60 HydrophobicContact CE-CD1 4.28Å; M55-L60 HydrophobicContact CG-CD1 3.82Å; M55-L60 HydrophobicContact SD-CD1 4.47Å; M55-W61 VanDerWaalsContact O-CZ3 3.26Å; M55-W61 WeakPolarHBondContact O-CZ3 3.07Å |
| 56 | R | 77.8 | Confident | 81.1 | Confident | 202 Ų | 202 | 111.7 Ų | 111.7 | 76% | 0.762 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -64.1 | -39 | 174.5 | -171.5 | 179.7 | 175.9 | -176.7 | -1.3 | 112.4 | A52 R53 K54 | A52-R56 PolarHBondContact O-N 3.13Å; R53-R56 WeakPolarHBondContact O-CB 3.44Å; R53-R56 PolarHBondContact O-N 3.45Å; K54-R56 PolarHBondContact O-N 3.01Å |
| 57 | E | 83.4 | Confident | 80.6 | Confident | 152 Ų | 152 | 115 Ų | 115 | 71% | 0.71 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -75.2 | -41.7 | 179.1 | -64.3 | 172.9 | 179.6 | 0 | 0 | 111.2 | K54 M55 K59 | K54-E57 WeakPolarHBondContact O-CB 3.43Å; K54-E57 PolarHBondContact O-N 3.42Å; M55-E57 VanDerWaalsContact C-N 3.32Å; E57-K59 VanDerWaalsContact C-N 3.31Å; E57-K59 PolarHBondContact O-N 3.22Å |
| 58 | W | 82 | Confident | 80.4 | Confident | 147 Ų | 147 | 112.7 Ų | 112.7 | 56% | 0.557 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -74 | -18.3 | -177.2 | -63.2 | -19.3 | 0 | 0 | 0 | 114.4 | L51 K54 L60 | L51-W58 HydrophobicContact CD1-CZ3 4.43Å; K54-W58 HydrophobicContact CB-CD2 4.28Å; K54-W58 HydrophobicContact CB-CE3 4.29Å; K54-W58 HydrophobicContact CB-CH2 4.11Å; K54-W58 HydrophobicContact CB-CZ2 4.06Å; K54-W58 HydrophobicContact CB-CZ3 4.21Å; K54-W58 HydrophobicContact CD-CH2 4.1Å; K54-W58 HydrophobicContact CD-CZ2 4.09Å; K54-W58 HydrophobicContact CG-CZ2 4.48Å; K54-W58 PolarHBondContact O-N 3.07Å; W58-L60 HydrophobicContact CB-CD1 4.48Å; W58-L60 HydrophobicContact CB-CD2 4.26Å; W58-L60 HydrophobicContact CB-CG 3.91Å; W58-L60 HydrophobicContact CE3-CD1 4.09Å; W58-L60 PolarHBondContact O-N 3.13Å; W58-L60 VanDerWaalsContact O-N 3.13Å |
| 59 | K | 78.4 | Confident | 80.4 | Confident | 99 Ų | 99 | 114.9 Ų | 114.9 | 43% | 0.43 | 56% | 0.562 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 44.3 | 46.8 | -179.5 | -56.4 | -174.2 | -170.3 | 169.1 | 0 | 113.4 | M55 E57 W61 E62 | M55-K59 PolarHBondContact O-N 3.25Å; M55-K59 VanDerWaalsContact O-N 3.12Å; E57-K59 VanDerWaalsContact C-N 3.31Å; E57-K59 PolarHBondContact O-N 3.22Å; K59-W61 HydrophobicContact CB-CZ2 4.03Å; K59-W61 HydrophobicContact CG-CZ2 3.96Å; K59-W61 PolarHBondContact O-N 3.42Å; K59-E62 HydrophobicContact CB-CG 4.1Å; K59-E62 WeakPolarHBondContact CD-OE1 3.47Å; K59-E62 IonicContact NZ-OE1 3.74Å; K59-E62 WeakPolarHBondContact O-CB 3.43Å; K59-E62 PolarHBondContact O-N 2.95Å |
| 60 | L | 68.8 | Low | 80 | Confident | 93 Ų | 93 | 115.3 Ų | 115.3 | 49% | 0.487 | 58% | 0.578 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -58.3 | -11.4 | -175.1 | -66.3 | 162.2 | 0 | 0 | 0 | 115 | M55 W58 E62 | M55-L60 HydrophobicContact CB-CD1 4.41Å; M55-L60 HydrophobicContact CE-CD1 4.28Å; M55-L60 HydrophobicContact CG-CD1 3.82Å; M55-L60 HydrophobicContact SD-CD1 4.47Å; W58-L60 HydrophobicContact CB-CD1 4.48Å; W58-L60 HydrophobicContact CB-CD2 4.26Å; W58-L60 HydrophobicContact CB-CG 3.91Å; W58-L60 HydrophobicContact CE3-CD1 4.09Å; W58-L60 PolarHBondContact O-N 3.13Å; W58-L60 VanDerWaalsContact O-N 3.13Å; L60-E62 VanDerWaalsContact C-N 3.29Å |
| 61 | W | 77.3 | Confident | 79.5 | Confident | 141 Ų | 141 | 118 Ų | 118 | 53% | 0.534 | 59% | 0.592 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -79.5 | -8.1 | 173.2 | 47.5 | 87.4 | 0 | 0 | 0 | 113.9 | L5 M55 K59 | L5-W61 HydrophobicContact CD1-CB 3.54Å; L5-W61 HydrophobicContact CD1-CD2 4.19Å; L5-W61 HydrophobicContact CD1-CE3 3.6Å; L5-W61 HydrophobicContact CD1-CG 4.23Å; M55-W61 VanDerWaalsContact O-CZ3 3.26Å; M55-W61 WeakPolarHBondContact O-CZ3 3.07Å; K59-W61 HydrophobicContact CB-CZ2 4.03Å; K59-W61 HydrophobicContact CG-CZ2 3.96Å; K59-W61 PolarHBondContact O-N 3.42Å |
| 62 | E | 77.3 | Confident | 79.4 | Confident | 106 Ų | 106 | 120.7 Ų | 120.7 | 50% | 0.495 | 60% | 0.603 | S | S | . | * | S | Bend | trans | -71.2 | 146.1 | 174.1 | -69.1 | 179.3 | 173.8 | 0 | 0 | 109.6 | K59 L60 | K59-E62 HydrophobicContact CB-CG 4.1Å; K59-E62 WeakPolarHBondContact CD-OE1 3.47Å; K59-E62 IonicContact NZ-OE1 3.74Å; K59-E62 WeakPolarHBondContact O-CB 3.43Å; K59-E62 PolarHBondContact O-N 2.95Å; L60-E62 VanDerWaalsContact C-N 3.29Å |
| 63 | P | 79.4 | Confident | 79.3 | Confident | 116 Ų | 116 | 128 Ų | 128 | 75% | 0.753 | 62% | 0.621 | S | S | * | * | P | Polyproline II helix | trans | -54.4 | 155.9 | 174.3 | -23.7 | 33.8 | 0 | 0 | 0 | 111.6 | V65 | P63-V65 PolarHBondContact O-N 3.01Š|
| 64 | L | 77.4 | Confident | 78.9 | Confident | 149 Ų | 149 | 128.1 Ų | 128.1 | 78% | 0.78 | 63% | 0.625 | S | S | * | * | P | Polyproline II helix | trans | -48.2 | 127.5 | 174.3 | -74.3 | 156.8 | 0 | 0 | 0 | 109.9 | E66 | L64-E66 PolarHBondContact O-N 3.22Š|
| 65 | V | 75.8 | Confident | 78.4 | Confident | 144 Ų | 144 | 133.7 Ų | 133.7 | 87% | 0.873 | 64% | 0.643 | S | S | * | * | S | Bend | trans | -64 | -35.7 | -179.8 | -178.7 | 0 | 0 | 0 | 0 | 110.3 | P63 | P63-V65 PolarHBondContact O-N 3.01Š|
| 66 | E | 76.4 | Confident | 78.5 | Confident | 164 Ų | 164 | 137.1 Ų | 137.1 | 77% | 0.766 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -142 | 141.6 | 174.9 | -64.5 | -174.8 | 165.2 | 0 | 0 | 110.8 | L64 | L64-E66 PolarHBondContact O-N 3.22Š|
| 67 | E | 76.2 | Confident | 77.9 | Confident | 178 Ų | 178 | 138 Ų | 138 | 83% | 0.832 | 69% | 0.685 | S | S | * | * | P | Polyproline II helix | trans | -72.2 | 138.2 | 171.5 | -67.2 | -173.7 | 173.3 | 0 | 0 | 109.9 | ||
| 68 | P | 81.6 | Confident | 77.7 | Confident | 69 Ų | 69 | 137.3 Ų | 137.3 | 45% | 0.448 | 68% | 0.684 | S | S | . | * | P | Polyproline II helix | trans | -65.1 | 145.5 | -179.9 | 27.1 | -33.8 | 0 | 0 | 0 | 111.1 | ||
| 69 | P | 83.6 | Confident | 77.4 | Confident | 90 Ų | 90 | 136.7 Ų | 136.7 | 58% | 0.584 | 69% | 0.69 | S | S | * | * | P | Polyproline II helix | trans | -55.7 | 143.7 | 171.8 | -23.3 | 32.6 | 0 | 0 | 0 | 111.7 | D71 Q72 | P69-D71 PolarHBondContact O-N 3Å; P69-Q72 HydrophobicContact CB-CB 4.44Å; P69-Q72 VanDerWaalsContact O-CB 3.25Å; P69-Q72 WeakPolarHBondContact O-CB 3.25Å; P69-Q72 PolarHBondContact O-N 3.41Å |
| 70 | A | 75.9 | Confident | 77.4 | Confident | 100 Ų | 100 | 138.8 Ų | 138.8 | 83% | 0.826 | 71% | 0.705 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.3 | -24.7 | -170.8 | 0 | 0 | 0 | 0 | 0 | 115 | ||
| 71 | D | 76.9 | Confident | 77.9 | Confident | 129 Ų | 129 | 141.5 Ų | 141.5 | 69% | 0.69 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.1 | -4 | -178.7 | -64.2 | -41.2 | 0 | 0 | 0 | 113.9 | P69 W73 | P69-D71 PolarHBondContact O-N 3Å; D71-W73 VanDerWaalsContact C-N 3.28Å; D71-W73 PolarHBondContact O-N 3Å |
| 72 | Q | 82.9 | Confident | 77.9 | Confident | 120 Ų | 120 | 141.6 Ų | 141.6 | 56% | 0.561 | 73% | 0.729 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.7 | -29.6 | -171.9 | -173.5 | 69 | 28 | 0 | 0 | 113.8 | P69 | P69-Q72 HydrophobicContact CB-CB 4.44Å; P69-Q72 VanDerWaalsContact O-CB 3.25Å; P69-Q72 WeakPolarHBondContact O-CB 3.25Å; P69-Q72 PolarHBondContact O-N 3.41Å |
| 73 | W | 81.9 | Confident | 78 | Confident | 204 Ų | 204 | 143.9 Ų | 143.9 | 77% | 0.773 | 75% | 0.745 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -120.8 | 19.1 | -171.6 | -58 | 112.4 | 0 | 0 | 0 | 114 | D71 | D71-W73 VanDerWaalsContact C-N 3.28Å; D71-W73 PolarHBondContact O-N 3Å |
| 74 | K | 77.9 | Confident | 77.9 | Confident | 152 Ų | 152 | 145.9 Ų | 145.9 | 66% | 0.661 | 74% | 0.744 | S | S | * | * | trans | -86.2 | 119.2 | -178.6 | -150.8 | -179.3 | -176.2 | -175.8 | 0 | 111 | ||||
| 75 | W | 73.6 | Confident | 77.9 | Confident | 225 Ų | 225 | 145.7 Ų | 145.7 | 85% | 0.852 | 74% | 0.741 | S | S | * | * | trans | -148.8 | 139.2 | 176.9 | -171.5 | -96.2 | 0 | 0 | 0 | 111.9 | ||||
| 76 | P | 84.2 | Confident | 78.1 | Confident | 99 Ų | 99 | 145.8 Ų | 145.8 | 64% | 0.643 | 73% | 0.73 | S | S | * | * | cis | -72 | 167.9 | -14.5 | -2.4 | 19.8 | 0 | 0 | 0 | 112 | ||||
| 77 | I | 66.1 | Low | 78.3 | Confident | 220 Ų | 220 | 144.2 Ų | 144.2 | 100% | 1.128 | 73% | 0.727 | S | S | * | * | trans | -70.7 | 0 | 173.3 | -57.9 | 168 | 0 | 0 | 0 | 110.2 |
Retrieved 77 of 77 residues in 22.8 ms
(Link to these results)