| 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 | 65.2 | Low | 80.8 | Confident | 198 Ų | 198 | 117.1 Ų | 117.1 | 98% | 0.975 | 60% | 0.6 | S | S | * | * | 0 | 119 | 0 | -95.3 | 170.5 | 179.8 | 0 | 0 | 108.7 | E5 | M1-E5 WeakPolarHBondContact CA-OE2 3.26Š| |||
| 2 | T | 84.4 | Confident | 80.5 | Confident | 71 Ų | 71 | 113.6 Ų | 113.6 | 44% | 0.436 | 59% | 0.593 | S | S | . | * | trans | -89 | 153.8 | 170.1 | 62.3 | 0 | 0 | 0 | 0 | 109.5 | Q4 E5 E6 | T2-Q4 PolarHBondContact O-N 2.98Å; T2-E5 PolarHBondContact N-OE2 2.94Å; T2-E5 WeakPolarHBondContact O-CB 3.08Å; T2-E5 PolarHBondContact O-N 3.13Å; T2-E5 PolarHBondContact OG1-N 3.4Å; T2-E6 PolarHBondContact O-N 3.48Å | ||
| 3 | L | 84.8 | Confident | 80.7 | Confident | 144 Ų | 144 | 109.5 Ų | 109.5 | 75% | 0.754 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -54.4 | -25.8 | 173.2 | -72.4 | 170.5 | 0 | 0 | 0 | 112.5 | L7 | L3-L7 WeakPolarHBondContact O-CB 3.45Å; L3-L7 PolarHBondContact O-N 3.31Å; L3-L7 VanDerWaalsContact O-N 3.14Å |
| 4 | Q | 82.9 | Confident | 80.8 | Confident | 163 Ų | 163 | 109.9 Ų | 109.9 | 76% | 0.762 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -68.3 | -40 | 174.7 | -71.8 | 178.3 | -22.4 | 0 | 0 | 112.5 | T2 L7 L8 | T2-Q4 PolarHBondContact O-N 2.98Å; Q4-L7 PolarHBondContact O-N 3.36Å; Q4-L8 WeakPolarHBondContact O-CB 3.13Å; Q4-L8 PolarHBondContact O-N 3.48Å |
| 5 | E | 85.1 | Confident | 80.8 | Confident | 104 Ų | 104 | 111 Ų | 111 | 49% | 0.486 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -67.4 | -42.3 | 177.2 | -70.6 | 169.4 | 155.5 | 0 | 0 | 111.4 | M1 T2 L7 L8 D9 | M1-E5 WeakPolarHBondContact CA-OE2 3.26Å; T2-E5 PolarHBondContact N-OE2 2.94Å; T2-E5 WeakPolarHBondContact O-CB 3.08Å; T2-E5 PolarHBondContact O-N 3.13Å; T2-E5 PolarHBondContact OG1-N 3.4Å; E5-L7 VanDerWaalsContact C-N 3.32Å; E5-L7 PolarHBondContact O-N 2.93Å; E5-L8 PolarHBondContact O-N 2.88Å; E5-D9 PolarHBondContact O-N 3.5Å |
| 6 | E | 83.4 | Confident | 80.9 | Confident | 100 Ų | 100 | 108.4 Ų | 108.4 | 47% | 0.467 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -62.8 | -38.9 | 176.3 | -69.8 | -178.5 | -171 | 0 | 0 | 112.3 | T2 S10 | T2-E6 PolarHBondContact O-N 3.48Å; E6-S10 VanDerWaalsContact O-CB 3.27Å; E6-S10 WeakPolarHBondContact O-CB 3.27Å; E6-S10 PolarHBondContact O-N 2.85Å; E6-S10 PolarHBondContact O-OG 3.49Å |
| 7 | L | 84.2 | Confident | 81 | Confident | 108 Ų | 108 | 109.4 Ų | 109.4 | 57% | 0.565 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -66.3 | -40.7 | 176 | -175.1 | 65.1 | 0 | 0 | 0 | 111.3 | L3 Q4 E5 S10 Q11 | L3-L7 WeakPolarHBondContact O-CB 3.45Å; L3-L7 PolarHBondContact O-N 3.31Å; L3-L7 VanDerWaalsContact O-N 3.14Å; Q4-L7 PolarHBondContact O-N 3.36Å; E5-L7 VanDerWaalsContact C-N 3.32Å; E5-L7 PolarHBondContact O-N 2.93Å; L7-S10 PolarHBondContact O-N 3.45Å; L7-Q11 WeakPolarHBondContact O-CB 3.45Å; L7-Q11 WeakPolarHBondContact O-CG 3.43Å; L7-Q11 PolarHBondContact O-N 3.16Å |
| 8 | L | 84.7 | Confident | 81.2 | Confident | 117 Ų | 117 | 106.1 Ų | 106.1 | 61% | 0.613 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -66.5 | -45.5 | 179.1 | -169.6 | 67.1 | 0 | 0 | 0 | 111.3 | Q4 E5 S10 Q11 S12 | Q4-L8 WeakPolarHBondContact O-CB 3.13Å; Q4-L8 PolarHBondContact O-N 3.48Å; E5-L8 PolarHBondContact O-N 2.88Å; L8-S10 VanDerWaalsContact C-N 3.33Å; L8-S10 PolarHBondContact O-N 2.91Å; L8-Q11 WeakPolarHBondContact O-CB 3.42Å; L8-Q11 PolarHBondContact O-N 3.37Å; L8-Q11 VanDerWaalsContact O-N 3.11Å; L8-S12 PolarHBondContact O-N 3.37Å; L8-S12 PolarHBondContact O-OG 3.41Å |
| 9 | D | 81.6 | Confident | 81.5 | Confident | 115 Ų | 115 | 108.9 Ų | 108.9 | 62% | 0.615 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -61.5 | -42.6 | 176.8 | -168.5 | 58.4 | 0 | 0 | 0 | 111.6 | E5 Q11 S12 N13 | E5-D9 PolarHBondContact O-N 3.5Å; D9-Q11 VanDerWaalsContact C-N 3.3Å; D9-Q11 PolarHBondContact O-N 2.91Å; D9-S12 WeakPolarHBondContact CA-OG 3.43Å; D9-S12 PolarHBondContact O-N 2.86Å; D9-S12 PolarHBondContact O-OG 2.84Å; D9-N13 PolarHBondContact O-N 3.39Å; D9-N13 VanDerWaalsContact O-N 3.12Å |
| 10 | S | 77.3 | Confident | 81.6 | Confident | 60 Ų | 60 | 110 Ų | 110 | 42% | 0.42 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -62.4 | -35.1 | 174 | -62.4 | 0 | 0 | 0 | 0 | 112.7 | E6 L7 L8 N13 | E6-S10 VanDerWaalsContact O-CB 3.27Å; E6-S10 WeakPolarHBondContact O-CB 3.27Å; E6-S10 PolarHBondContact O-N 2.85Å; E6-S10 PolarHBondContact O-OG 3.49Å; L7-S10 PolarHBondContact O-N 3.45Å; L8-S10 VanDerWaalsContact C-N 3.33Å; L8-S10 PolarHBondContact O-N 2.91Å; S10-N13 PolarHBondContact O-N 2.82Å |
| 11 | Q | 74.9 | Confident | 81.7 | Confident | 108 Ų | 108 | 107.5 Ų | 107.5 | 51% | 0.505 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -72.5 | -30.8 | 176 | -80.2 | -173.9 | -15.7 | 0 | 0 | 113.1 | L7 L8 D9 N13 K17 | L7-Q11 WeakPolarHBondContact O-CB 3.45Å; L7-Q11 WeakPolarHBondContact O-CG 3.43Å; L7-Q11 PolarHBondContact O-N 3.16Å; L8-Q11 WeakPolarHBondContact O-CB 3.42Å; L8-Q11 PolarHBondContact O-N 3.37Å; L8-Q11 VanDerWaalsContact O-N 3.11Å; D9-Q11 VanDerWaalsContact C-N 3.3Å; D9-Q11 PolarHBondContact O-N 2.91Å; Q11-N13 VanDerWaalsContact C-N 3.31Å; Q11-K17 WeakPolarHBondContact O-CE 3.29Å; Q11-K17 PolarHBondContact O-NZ 2.87Å |
| 12 | S | 77.2 | Confident | 82.6 | Confident | 75 Ų | 75 | 103 Ų | 103 | 52% | 0.524 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -77.9 | -15.3 | 173.9 | 44.8 | 0 | 0 | 0 | 0 | 113.6 | L8 D9 V14 | L8-S12 PolarHBondContact O-N 3.37Å; L8-S12 PolarHBondContact O-OG 3.41Å; D9-S12 WeakPolarHBondContact CA-OG 3.43Å; D9-S12 PolarHBondContact O-N 2.86Å; D9-S12 PolarHBondContact O-OG 2.84Å; S12-V14 PolarHBondContact O-N 2.86Å |
| 13 | N | 83.5 | Confident | 82.7 | Confident | 61 Ų | 61 | 101.3 Ų | 101.3 | 33% | 0.326 | 53% | 0.532 | S | S | . | . | trans | -69.1 | 99.1 | 179.5 | -168.5 | -41.3 | 0 | 0 | 0 | 111.3 | D9 S10 Q11 E15 L16 K17 | D9-N13 PolarHBondContact O-N 3.39Å; D9-N13 VanDerWaalsContact O-N 3.12Å; S10-N13 PolarHBondContact O-N 2.82Å; Q11-N13 VanDerWaalsContact C-N 3.31Å; N13-E15 VanDerWaalsContact C-N 3.28Å; N13-E15 PolarHBondContact O-N 3.47Å; N13-E15 WeakPolarHBondContact OD1-CB 3.38Å; N13-E15 PolarHBondContact OD1-N 3.14Å; N13-E15 VanDerWaalsContact OD1-N 3.13Å; N13-L16 HydrophobicContact CB-CB 4.02Å; N13-L16 HydrophobicContact CB-CD1 3.81Å; N13-L16 HydrophobicContact CB-CG 3.96Å; N13-L16 VanDerWaalsContact CG-CG 3.48Å; N13-L16 PolarHBondContact O-N 3.42Å; N13-L16 PolarHBondContact OD1-N 3.45Å; N13-K17 PolarHBondContact O-N 2.94Å; N13-K17 VanDerWaalsContact O-N 3.08Å | ||
| 14 | V | 81.7 | Confident | 82.5 | Confident | 115 Ų | 115 | 101.6 Ų | 101.6 | 70% | 0.697 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -61.1 | -37.1 | -179.4 | 178.6 | 0 | 0 | 0 | 0 | 111.6 | S12 K17 A18 | S12-V14 PolarHBondContact O-N 2.86Å; V14-K17 PolarHBondContact O-N 3.23Å; V14-A18 WeakPolarHBondContact O-CB 3.47Å; V14-A18 PolarHBondContact O-N 2.82Å |
| 15 | E | 81.8 | Confident | 82.4 | Confident | 126 Ų | 126 | 99.4 Ų | 99.4 | 59% | 0.589 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -65.5 | -43.5 | 178.5 | -167.1 | -170 | 150 | 0 | 0 | 111 | N13 K17 A18 R19 | N13-E15 VanDerWaalsContact C-N 3.28Å; N13-E15 PolarHBondContact O-N 3.47Å; N13-E15 WeakPolarHBondContact OD1-CB 3.38Å; N13-E15 PolarHBondContact OD1-N 3.14Å; N13-E15 VanDerWaalsContact OD1-N 3.13Å; E15-K17 PolarHBondContact O-N 3.41Å; E15-A18 PolarHBondContact O-N 3.39Å; E15-R19 WeakPolarHBondContact O-CB 3.28Å; E15-R19 VanDerWaalsContact O-CG 3.27Å; E15-R19 WeakPolarHBondContact O-CG 3.08Å; E15-R19 PolarHBondContact O-N 3.43Å |
| 16 | L | 81.3 | Confident | 82.3 | Confident | 69 Ų | 69 | 99.9 Ų | 99.9 | 36% | 0.361 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62 | -43.6 | 175.2 | -71.3 | -179.4 | 0 | 0 | 0 | 111.5 | N13 A18 R19 L20 | N13-L16 HydrophobicContact CB-CB 4.02Å; N13-L16 HydrophobicContact CB-CD1 3.81Å; N13-L16 HydrophobicContact CB-CG 3.96Å; N13-L16 VanDerWaalsContact CG-CG 3.48Å; N13-L16 PolarHBondContact O-N 3.42Å; N13-L16 PolarHBondContact OD1-N 3.45Å; L16-A18 PolarHBondContact O-N 3.07Å; L16-R19 PolarHBondContact O-N 3.12Å; L16-L20 WeakPolarHBondContact O-CB 3.38Å; L16-L20 VanDerWaalsContact O-CG 3.26Å; L16-L20 WeakPolarHBondContact O-CG 3.42Å; L16-L20 PolarHBondContact O-N 3.37Å |
| 17 | K | 83.4 | Confident | 82.2 | Confident | 126 Ų | 126 | 100.4 Ų | 100.4 | 55% | 0.548 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -59.4 | -46.7 | 175.3 | -82.4 | -179.8 | 168.6 | 159.9 | 0 | 112 | Q11 N13 V14 E15 R19 L20 S21 | Q11-K17 WeakPolarHBondContact O-CE 3.29Å; Q11-K17 PolarHBondContact O-NZ 2.87Å; N13-K17 PolarHBondContact O-N 2.94Å; N13-K17 VanDerWaalsContact O-N 3.08Å; V14-K17 PolarHBondContact O-N 3.23Å; E15-K17 PolarHBondContact O-N 3.41Å; K17-R19 PolarHBondContact O-N 3.19Å; K17-L20 PolarHBondContact O-N 3.08Å; K17-S21 WeakPolarHBondContact O-CB 3.36Å; K17-S21 PolarHBondContact O-N 3.28Å; K17-S21 PolarHBondContact O-OG 2.88Å |
| 18 | A | 83.8 | Confident | 81.8 | Confident | 50 Ų | 50 | 103 Ų | 103 | 41% | 0.413 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -62.7 | -42.9 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112 | V14 E15 L16 S21 Q22 | V14-A18 WeakPolarHBondContact O-CB 3.47Å; V14-A18 PolarHBondContact O-N 2.82Å; E15-A18 PolarHBondContact O-N 3.39Å; L16-A18 PolarHBondContact O-N 3.07Å; A18-S21 WeakPolarHBondContact CA-OG 3.5Å; A18-S21 PolarHBondContact O-N 2.94Å; A18-S21 PolarHBondContact O-OG 3.22Å; A18-Q22 VanDerWaalsContact O-CB 3.29Å; A18-Q22 WeakPolarHBondContact O-CB 3.36Å; A18-Q22 PolarHBondContact O-N 2.81Å |
| 19 | R | 86.7 | Confident | 81.3 | Confident | 160 Ų | 160 | 104 Ų | 104 | 60% | 0.604 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -66.4 | -41.4 | 177.3 | -71.4 | 177.4 | 66 | -179.9 | -1.1 | 112.2 | E15 L16 K17 Q22 G23 | E15-R19 WeakPolarHBondContact O-CB 3.28Å; E15-R19 VanDerWaalsContact O-CG 3.27Å; E15-R19 WeakPolarHBondContact O-CG 3.08Å; E15-R19 PolarHBondContact O-N 3.43Å; L16-R19 PolarHBondContact O-N 3.12Å; K17-R19 PolarHBondContact O-N 3.19Å; R19-Q22 PolarHBondContact O-N 3.01Å; R19-G23 PolarHBondContact O-N 2.79Å |
| 20 | L | 83.8 | Confident | 80.8 | Confident | 129 Ų | 129 | 103.6 Ų | 103.6 | 68% | 0.675 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -66.1 | -42.5 | 175.8 | -73.2 | 173.3 | 0 | 0 | 0 | 111.5 | L16 K17 G23 Y24 | L16-L20 WeakPolarHBondContact O-CB 3.38Å; L16-L20 VanDerWaalsContact O-CG 3.26Å; L16-L20 WeakPolarHBondContact O-CG 3.42Å; L16-L20 PolarHBondContact O-N 3.37Å; K17-L20 PolarHBondContact O-N 3.08Å; L20-G23 PolarHBondContact O-N 3.35Å; L20-Y24 VanDerWaalsContact O-CB 3.28Å; L20-Y24 WeakPolarHBondContact O-CB 3.26Å; L20-Y24 PolarHBondContact O-N 3.16Å |
| 21 | S | 83.6 | Confident | 80.2 | Confident | 59 Ų | 59 | 110.7 Ų | 110.7 | 41% | 0.413 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -64.6 | -42 | 176.4 | 60.2 | 0 | 0 | 0 | 0 | 111.6 | K17 A18 Y24 Q25 | K17-S21 WeakPolarHBondContact O-CB 3.36Å; K17-S21 PolarHBondContact O-N 3.28Å; K17-S21 PolarHBondContact O-OG 2.88Å; A18-S21 WeakPolarHBondContact CA-OG 3.5Å; A18-S21 PolarHBondContact O-N 2.94Å; A18-S21 PolarHBondContact O-OG 3.22Å; S21-Y24 PolarHBondContact O-N 2.94Å; S21-Q25 WeakPolarHBondContact O-CB 3.35Å; S21-Q25 VanDerWaalsContact O-CG 3.26Å; S21-Q25 WeakPolarHBondContact O-CG 3.46Å; S21-Q25 PolarHBondContact O-N 3.46Å |
| 22 | Q | 85.8 | Confident | 79.8 | Confident | 104 Ų | 104 | 113.5 Ų | 113.5 | 49% | 0.486 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -63.1 | -45.5 | 175.8 | -176.3 | -179.1 | 6 | 0 | 0 | 111.2 | A18 R19 Q25 Q26 | A18-Q22 VanDerWaalsContact O-CB 3.29Å; A18-Q22 WeakPolarHBondContact O-CB 3.36Å; A18-Q22 PolarHBondContact O-N 2.81Å; R19-Q22 PolarHBondContact O-N 3.01Å; Q22-Q25 PolarHBondContact O-N 3.23Å; Q22-Q26 WeakPolarHBondContact O-CB 3.47Å; Q22-Q26 VanDerWaalsContact O-CG 3.28Å; Q22-Q26 WeakPolarHBondContact O-CG 3.28Å; Q22-Q26 PolarHBondContact O-N 3.37Å |
| 23 | G | 85.2 | Confident | 79.3 | Confident | 34 Ų | 34 | 113.7 Ų | 113.7 | 35% | 0.351 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -63.7 | -41 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | R19 L20 Q26 F27 | R19-G23 PolarHBondContact O-N 2.79Å; L20-G23 PolarHBondContact O-N 3.35Å; G23-Q26 PolarHBondContact O-N 3.04Å; G23-F27 VanDerWaalsContact O-CB 3.29Å; G23-F27 WeakPolarHBondContact O-CB 3.29Å; G23-F27 PolarHBondContact O-N 2.99Å |
| 24 | Y | 80.3 | Confident | 78.6 | Confident | 151 Ų | 151 | 113.7 Ų | 113.7 | 59% | 0.592 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -62.3 | -49.7 | 174.2 | -174.3 | -93.3 | 0 | 0 | 0 | 110.6 | L20 S21 Q26 F27 W28 | L20-Y24 VanDerWaalsContact O-CB 3.28Å; L20-Y24 WeakPolarHBondContact O-CB 3.26Å; L20-Y24 PolarHBondContact O-N 3.16Å; S21-Y24 PolarHBondContact O-N 2.94Å; Y24-Q26 PolarHBondContact O-N 3.44Å; Y24-F27 PolarHBondContact O-N 3.49Å; Y24-W28 AromaticContact CD1-CD1 3.44Å; Y24-W28 VanDerWaalsContact CD1-CD1 3.44Å; Y24-W28 AromaticContact CD1-NE1 3.87Å; Y24-W28 AromaticContact CD2-CD1 3.69Å; Y24-W28 AromaticContact CD2-NE1 3.33Å; Y24-W28 VanDerWaalsContact CD2-NE1 3.33Å; Y24-W28 AromaticContact CE1-CD1 3.27Å; Y24-W28 HydrophobicContact CE1-CG 4.3Å; Y24-W28 AromaticContact CE1-NE1 3.47Å; Y24-W28 AromaticContact CE2-CD1 3.57Å; Y24-W28 AromaticContact CE2-CE2 3.92Å; Y24-W28 HydrophobicContact CE2-CZ2 4.44Å; Y24-W28 AromaticContact CE2-NE1 2.89Å; Y24-W28 AromaticContact CG-CD1 3.63Å; Y24-W28 AromaticContact CG-NE1 3.8Å; Y24-W28 AromaticContact CZ-CD1 3.34Å; Y24-W28 AromaticContact CZ-CE2 3.85Å; Y24-W28 AromaticContact CZ-NE1 2.95Å; Y24-W28 PolarHBondContact O-N 3.11Å; Y24-W28 PolarHBondContact OH-NE1 2.97Å |
| 25 | Q | 81.7 | Confident | 77.8 | Confident | 116 Ų | 116 | 115.9 Ų | 115.9 | 54% | 0.542 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -57.7 | -47.2 | 175.5 | -74.9 | 174 | -43 | 0 | 0 | 111.4 | S21 Q22 F27 W28 L29 | S21-Q25 WeakPolarHBondContact O-CB 3.35Å; S21-Q25 VanDerWaalsContact O-CG 3.26Å; S21-Q25 WeakPolarHBondContact O-CG 3.46Å; S21-Q25 PolarHBondContact O-N 3.46Å; Q22-Q25 PolarHBondContact O-N 3.23Å; Q25-F27 PolarHBondContact O-N 2.8Å; Q25-W28 PolarHBondContact O-N 3.31Å; Q25-L29 HydrophobicContact CB-CD1 4.39Å; Q25-L29 WeakPolarHBondContact O-CB 3.35Å; Q25-L29 WeakPolarHBondContact O-CD1 3.46Å; Q25-L29 WeakPolarHBondContact O-CG 3.43Å; Q25-L29 PolarHBondContact O-N 3.08Å |
| 26 | Q | 82 | Confident | 77.1 | Confident | 115 Ų | 115 | 113 Ų | 113 | 54% | 0.537 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -60.7 | -43.2 | 177.2 | -76.2 | 177.7 | -23.2 | 0 | 0 | 112.3 | Q22 G23 Y24 L29 Q30 | Q22-Q26 WeakPolarHBondContact O-CB 3.47Å; Q22-Q26 VanDerWaalsContact O-CG 3.28Å; Q22-Q26 WeakPolarHBondContact O-CG 3.28Å; Q22-Q26 PolarHBondContact O-N 3.37Å; G23-Q26 PolarHBondContact O-N 3.04Å; Y24-Q26 PolarHBondContact O-N 3.44Å; Q26-L29 PolarHBondContact O-N 2.95Å; Q26-Q30 WeakPolarHBondContact O-CG 3.5Å; Q26-Q30 PolarHBondContact O-N 2.78Å; Q26-Q30 VanDerWaalsContact O-N 3.14Å |
| 27 | F | 81.2 | Confident | 76.3 | Confident | 110 Ų | 110 | 114.9 Ų | 114.9 | 48% | 0.482 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -63.6 | -43.9 | 178.4 | 179.5 | -97.2 | 0 | 0 | 0 | 112.2 | G23 Y24 Q25 Q30 | G23-F27 VanDerWaalsContact O-CB 3.29Å; G23-F27 WeakPolarHBondContact O-CB 3.29Å; G23-F27 PolarHBondContact O-N 2.99Å; Y24-F27 PolarHBondContact O-N 3.49Å; Q25-F27 PolarHBondContact O-N 2.8Å; F27-Q30 WeakPolarHBondContact O-CB 3.27Å |
| 28 | W | 75.6 | Confident | 75.3 | Confident | 164 Ų | 164 | 112.1 Ų | 112.1 | 62% | 0.621 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -79.5 | -23.3 | 178.8 | -68 | 106.3 | 0 | 0 | 0 | 113.9 | Y24 Q25 Q30 | Y24-W28 AromaticContact CD1-CD1 3.44Å; Y24-W28 VanDerWaalsContact CD1-CD1 3.44Å; Y24-W28 AromaticContact CD1-NE1 3.87Å; Y24-W28 AromaticContact CD2-CD1 3.69Å; Y24-W28 AromaticContact CD2-NE1 3.33Å; Y24-W28 VanDerWaalsContact CD2-NE1 3.33Å; Y24-W28 AromaticContact CE1-CD1 3.27Å; Y24-W28 HydrophobicContact CE1-CG 4.3Å; Y24-W28 AromaticContact CE1-NE1 3.47Å; Y24-W28 AromaticContact CE2-CD1 3.57Å; Y24-W28 AromaticContact CE2-CE2 3.92Å; Y24-W28 HydrophobicContact CE2-CZ2 4.44Å; Y24-W28 AromaticContact CE2-NE1 2.89Å; Y24-W28 AromaticContact CG-CD1 3.63Å; Y24-W28 AromaticContact CG-NE1 3.8Å; Y24-W28 AromaticContact CZ-CD1 3.34Å; Y24-W28 AromaticContact CZ-CE2 3.85Å; Y24-W28 AromaticContact CZ-NE1 2.95Å; Y24-W28 PolarHBondContact O-N 3.11Å; Y24-W28 PolarHBondContact OH-NE1 2.97Å; Q25-W28 PolarHBondContact O-N 3.31Å; W28-Q30 VanDerWaalsContact C-N 3.31Å |
| 29 | L | 75.6 | Confident | 73.9 | Confident | 137 Ų | 137 | 113.6 Ų | 113.6 | 72% | 0.717 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -82.4 | -6.3 | 173.6 | -69.6 | 171.5 | 0 | 0 | 0 | 113 | Q25 Q26 K31 | Q25-L29 HydrophobicContact CB-CD1 4.39Å; Q25-L29 WeakPolarHBondContact O-CB 3.35Å; Q25-L29 WeakPolarHBondContact O-CD1 3.46Å; Q25-L29 WeakPolarHBondContact O-CG 3.43Å; Q25-L29 PolarHBondContact O-N 3.08Å; Q26-L29 PolarHBondContact O-N 2.95Å; L29-K31 PolarHBondContact O-N 2.83Å |
| 30 | Q | 69.9 | Low | 72.6 | Confident | 107 Ų | 107 | 113.8 Ų | 113.8 | 50% | 0.5 | 57% | 0.566 | S | S | . | * | trans | -62.5 | 106.6 | 168.4 | -81.3 | 173 | -10.6 | 0 | 0 | 108.7 | Q26 F27 W28 E32 | Q26-Q30 WeakPolarHBondContact O-CG 3.5Å; Q26-Q30 PolarHBondContact O-N 2.78Å; Q26-Q30 VanDerWaalsContact O-N 3.14Å; F27-Q30 WeakPolarHBondContact O-CB 3.27Å; W28-Q30 VanDerWaalsContact C-N 3.31Å; Q30-E32 PolarHBondContact O-N 2.68Å | ||
| 31 | K | 65.7 | Low | 71.4 | Confident | 208 Ų | 208 | 114.3 Ų | 114.3 | 90% | 0.904 | 56% | 0.563 | S | S | * | * | S | Bend | trans | -55.7 | -23.7 | 179.8 | -82.6 | -167.3 | 173.6 | -175.3 | 0 | 113.4 | L29 | L29-K31 PolarHBondContact O-N 2.83Š|
| 32 | E | 67 | Low | 70 | Confident | 168 Ų | 168 | 120.3 Ų | 120.3 | 79% | 0.785 | 58% | 0.576 | S | S | * | * | trans | -140.3 | 115.2 | -179.9 | -67.6 | 179.7 | 108.7 | 0 | 0 | 108.7 | Q30 P34 | Q30-E32 PolarHBondContact O-N 2.68Å; E32-P34 WeakPolarHBondContact O-CD 3.45Å | ||
| 33 | V | 66.7 | Low | 68.6 | Low | 79 Ų | 79 | 120.2 Ų | 120.2 | 48% | 0.479 | 59% | 0.587 | S | S | . | * | trans | -67.7 | 120 | 160.6 | 176.8 | 0 | 0 | 0 | 0 | 105.6 | E35 L37 V38 | V33-E35 PolarHBondContact O-N 2.91Å; V33-E35 VanDerWaalsContact O-N 3.16Å; V33-L37 HydrophobicContact CG1-CB 4.17Å; V33-L37 HydrophobicContact CG1-CD1 4.16Å; V33-V38 HydrophobicContact CG1-CG2 4.11Å | ||
| 34 | P | 67.8 | Low | 67.5 | Low | 61 Ų | 61 | 125.6 Ų | 125.6 | 40% | 0.396 | 60% | 0.603 | S | S | . | * | trans | -51.2 | 127.2 | -179.5 | -26.1 | 31.7 | 0 | 0 | 0 | 110.3 | E32 S36 L37 | E32-P34 WeakPolarHBondContact O-CD 3.45Å; P34-S36 WeakPolarHBondContact CB-OG 3.45Å; P34-S36 PolarHBondContact O-N 3.4Å; P34-L37 HydrophobicContact CB-CG 4.31Å; P34-L37 HydrophobicContact CG-CD1 4.29Å; P34-L37 HydrophobicContact CG-CG 4.5Å; P34-L37 WeakPolarHBondContact O-CB 2.92Å; P34-L37 PolarHBondContact O-N 3.47Å | ||
| 35 | E | 65.3 | Low | 66.6 | Low | 161 Ų | 161 | 124.7 Ų | 124.7 | 75% | 0.752 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -51.7 | -29.5 | 178.2 | -80.4 | -172.5 | 156.1 | 0 | 0 | 111.9 | V33 L37 V38 T39 | V33-E35 PolarHBondContact O-N 2.91Å; V33-E35 VanDerWaalsContact O-N 3.16Å; E35-L37 VanDerWaalsContact C-N 3.26Å; E35-L37 PolarHBondContact O-N 3.14Å; E35-V38 PolarHBondContact O-N 3Å; E35-V38 VanDerWaalsContact O-N 3.08Å; E35-T39 WeakPolarHBondContact O-CB 3.36Å; E35-T39 WeakPolarHBondContact O-CG2 3.34Å; E35-T39 PolarHBondContact O-N 3.28Å; E35-T39 PolarHBondContact O-OG1 2.93Å |
| 36 | S | 66.7 | Low | 65.6 | Low | 66 Ų | 66 | 127.2 Ų | 127.2 | 46% | 0.462 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -56.8 | -34 | 173.6 | 64 | 0 | 0 | 0 | 0 | 113.5 | P34 T39 K40 | P34-S36 WeakPolarHBondContact CB-OG 3.45Å; P34-S36 PolarHBondContact O-N 3.4Å; S36-T39 WeakPolarHBondContact CA-OG1 3.49Å; S36-K40 WeakPolarHBondContact O-CB 3.06Å; S36-K40 PolarHBondContact O-N 3.04Å |
| 37 | L | 64.6 | Low | 64.7 | Low | 108 Ų | 108 | 128.2 Ų | 128.2 | 57% | 0.565 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -72.8 | -34.5 | 175.7 | -61.4 | -177.9 | 0 | 0 | 0 | 111.8 | V33 P34 E35 | V33-L37 HydrophobicContact CG1-CB 4.17Å; V33-L37 HydrophobicContact CG1-CD1 4.16Å; P34-L37 HydrophobicContact CB-CG 4.31Å; P34-L37 HydrophobicContact CG-CD1 4.29Å; P34-L37 HydrophobicContact CG-CG 4.5Å; P34-L37 WeakPolarHBondContact O-CB 2.92Å; P34-L37 PolarHBondContact O-N 3.47Å; E35-L37 VanDerWaalsContact C-N 3.26Å; E35-L37 PolarHBondContact O-N 3.14Å |
| 38 | V | 62.6 | Low | 63.9 | Low | 67 Ų | 67 | 125.3 Ų | 125.3 | 41% | 0.406 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -81 | -28.1 | -178.5 | -143.3 | 0 | 0 | 0 | 0 | 111.9 | V33 E35 | V33-V38 HydrophobicContact CG1-CG2 4.11Å; E35-V38 PolarHBondContact O-N 3Å; E35-V38 VanDerWaalsContact O-N 3.08Å |
| 39 | T | 54.9 | Low | 63.7 | Low | 81 Ų | 81 | 125.6 Ų | 125.6 | 50% | 0.497 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -96.8 | -32.4 | -176.3 | 54.2 | 0 | 0 | 0 | 0 | 113.3 | E35 S36 K41 R42 | E35-T39 WeakPolarHBondContact O-CB 3.36Å; E35-T39 WeakPolarHBondContact O-CG2 3.34Å; E35-T39 PolarHBondContact O-N 3.28Å; E35-T39 PolarHBondContact O-OG1 2.93Å; S36-T39 WeakPolarHBondContact CA-OG1 3.49Å; T39-K41 VanDerWaalsContact C-N 3.28Å; T39-K41 PolarHBondContact O-N 3.41Å; T39-R42 PolarHBondContact O-N 3.27Å |
| 40 | K | 58.8 | Low | 63.4 | Low | 165 Ų | 165 | 129.9 Ų | 129.9 | 72% | 0.717 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.6 | -15.3 | -175.5 | -169.6 | 165.3 | 178 | 173 | 0 | 114.6 | S36 | S36-K40 WeakPolarHBondContact O-CB 3.06Å; S36-K40 PolarHBondContact O-N 3.04Å |
| 41 | K | 59.1 | Low | 63.6 | Low | 140 Ų | 140 | 126.9 Ų | 126.9 | 61% | 0.609 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.8 | -14.9 | 177.1 | -80.1 | -81.2 | -176.4 | 175.8 | 0 | 114.3 | T39 S43 Q44 | T39-K41 VanDerWaalsContact C-N 3.28Å; T39-K41 PolarHBondContact O-N 3.41Å; K41-S43 VanDerWaalsContact C-N 3.27Å; K41-S43 PolarHBondContact O-N 3.32Å; K41-Q44 PolarHBondContact O-N 3.38Å |
| 42 | R | 54.8 | Low | 64.2 | Low | 185 Ų | 185 | 119.4 Ų | 119.4 | 70% | 0.698 | 60% | 0.6 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70 | -21.8 | 178 | -83 | -178.1 | 174.4 | 170.3 | 0.5 | 113.5 | T39 | T39-R42 PolarHBondContact O-N 3.27Š|
| 43 | S | 56.4 | Low | 64.7 | Low | 102 Ų | 102 | 115.8 Ų | 115.8 | 71% | 0.713 | 59% | 0.585 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83 | -18.2 | 175.4 | 58.1 | 0 | 0 | 0 | 0 | 114.3 | K41 | K41-S43 VanDerWaalsContact C-N 3.27Å; K41-S43 PolarHBondContact O-N 3.32Å |
| 44 | Q | 61 | Low | 65.4 | Low | 147 Ų | 147 | 117.5 Ų | 117.5 | 69% | 0.687 | 59% | 0.591 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.3 | -22.1 | 179.2 | -73 | -142.2 | 19.6 | 0 | 0 | 113.7 | K41 Q46 | K41-Q44 PolarHBondContact O-N 3.38Å; Q44-Q46 PolarHBondContact O-N 3.5Å |
| 45 | L | 60.5 | Low | 66 | Low | 131 Ų | 131 | 120.6 Ų | 120.6 | 69% | 0.686 | 60% | 0.604 | S | S | * | * | S | Bend | trans | -91.5 | 103.3 | 171 | -60 | 177.9 | 0 | 0 | 0 | 106.5 | V47 | L45-V47 PolarHBondContact O-N 2.76Š|
| 46 | Q | 62.7 | Low | 66.8 | Low | 170 Ų | 170 | 120.3 Ų | 120.3 | 79% | 0.794 | 60% | 0.596 | S | S | * | * | trans | -48.4 | 117.3 | 167.8 | -71.4 | 179.6 | 12.5 | 0 | 0 | 107 | Q44 V48 | Q44-Q46 PolarHBondContact O-N 3.5Å; Q46-V48 WeakPolarHBondContact O-CG2 3.44Å; Q46-V48 PolarHBondContact O-N 2.96Å | ||
| 47 | V | 61.4 | Low | 67.7 | Low | 135 Ų | 135 | 120.1 Ų | 120.1 | 82% | 0.818 | 59% | 0.591 | S | S | * | * | trans | -67.1 | 90 | 173.7 | 178.2 | 0 | 0 | 0 | 0 | 105.8 | L45 R49 | L45-V47 PolarHBondContact O-N 2.76Å; V47-R49 PolarHBondContact O-N 3.18Å | ||
| 48 | V | 64.9 | Low | 68.5 | Low | 49 Ų | 49 | 118.8 Ų | 118.8 | 30% | 0.297 | 59% | 0.588 | S | S | . | * | trans | -62.7 | 116.3 | 175.2 | 179.1 | 0 | 0 | 0 | 0 | 105.6 | Q46 D52 L53 | Q46-V48 WeakPolarHBondContact O-CG2 3.44Å; Q46-V48 PolarHBondContact O-N 2.96Å; V48-D52 VanDerWaalsContact CG1-C 3.4Å; V48-D52 HydrophobicContact CG1-CB 3.39Å; V48-L53 HydrophobicContact CG1-CB 3.82Å | ||
| 49 | R | 70.7 | Confident | 69.4 | Low | 171 Ų | 171 | 118.7 Ų | 118.7 | 65% | 0.645 | 59% | 0.59 | S | S | * | * | trans | -56.8 | 146.3 | 175.2 | -61.8 | -178.4 | -61.8 | -93.4 | -10.3 | 107.4 | V47 G51 D52 L53 | V47-R49 PolarHBondContact O-N 3.18Å; R49-G51 CarbonylContact O-C 3.59Å; R49-G51 PolarHBondContact O-N 3.41Å; R49-D52 WeakPolarHBondContact CB-OD2 3.33Å; R49-D52 IonicContact CZ-OD1 3.66Å; R49-D52 IonicContact CZ-OD2 3.16Å; R49-D52 PolarHBondContact N-OD2 3.44Å; R49-D52 IonicContact NE-OD1 3.73Å; R49-D52 IonicContact NE-OD2 3.3Å; R49-D52 PolarHBondContact NE-OD2 2.85Å; R49-D52 IonicContact NH1-OD2 3.9Å; R49-D52 VanDerWaalsContact NH2-CG 3.32Å; R49-D52 IonicContact NH2-OD1 2.88Å; R49-D52 PolarHBondContact NH2-OD1 3.46Å; R49-D52 IonicContact NH2-OD2 2.98Å; R49-D52 PolarHBondContact NH2-OD2 3.5Å; R49-D52 WeakPolarHBondContact O-CA 3.38Å; R49-D52 WeakPolarHBondContact O-CB 3.43Å; R49-D52 PolarHBondContact O-N 3.17Å; R49-L53 PolarHBondContact O-N 3.39Å; R49-L53 VanDerWaalsContact O-N 3.14Å | ||
| 50 | R | 70.9 | Confident | 71 | Confident | 226 Ų | 226 | 119.1 Ų | 119.1 | 85% | 0.853 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -47.8 | -35.2 | -176.4 | -173.8 | 179 | 173.7 | -167.7 | -1.8 | 113.4 | L53 L54 | R50-L53 PolarHBondContact O-N 3.14Å; R50-L54 PolarHBondContact O-N 3.39Å |
| 51 | G | 72.8 | Confident | 72.4 | Confident | 45 Ų | 45 | 117 Ų | 117 | 46% | 0.464 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -69.4 | -37.8 | 174.2 | 0 | 0 | 0 | 0 | 0 | 114.8 | R49 L53 L54 L55 | R49-G51 CarbonylContact O-C 3.59Å; R49-G51 PolarHBondContact O-N 3.41Å; G51-L53 PolarHBondContact O-N 2.77Å; G51-L54 PolarHBondContact O-N 2.88Å; G51-L55 PolarHBondContact O-N 3.36Å |
| 52 | D | 79.2 | Confident | 73.7 | Confident | 50 Ų | 50 | 115.3 Ų | 115.3 | 27% | 0.267 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -68.3 | -28.2 | 176.7 | -55.3 | -22.7 | 0 | 0 | 0 | 110.9 | V48 R49 R56 | V48-D52 VanDerWaalsContact CG1-C 3.4Å; V48-D52 HydrophobicContact CG1-CB 3.39Å; R49-D52 WeakPolarHBondContact CB-OD2 3.33Å; R49-D52 IonicContact CZ-OD1 3.66Å; R49-D52 IonicContact CZ-OD2 3.16Å; R49-D52 PolarHBondContact N-OD2 3.44Å; R49-D52 IonicContact NE-OD1 3.73Å; R49-D52 IonicContact NE-OD2 3.3Å; R49-D52 PolarHBondContact NE-OD2 2.85Å; R49-D52 IonicContact NH1-OD2 3.9Å; R49-D52 VanDerWaalsContact NH2-CG 3.32Å; R49-D52 IonicContact NH2-OD1 2.88Å; R49-D52 PolarHBondContact NH2-OD1 3.46Å; R49-D52 IonicContact NH2-OD2 2.98Å; R49-D52 PolarHBondContact NH2-OD2 3.5Å; R49-D52 WeakPolarHBondContact O-CA 3.38Å; R49-D52 WeakPolarHBondContact O-CB 3.43Å; R49-D52 PolarHBondContact O-N 3.17Å; D52-R56 PolarHBondContact O-N 2.88Å |
| 53 | L | 78 | Confident | 75.3 | Confident | 92 Ų | 92 | 110.1 Ų | 110.1 | 48% | 0.482 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -70.2 | -43.2 | 178.1 | -176.3 | 63.1 | 0 | 0 | 0 | 110.9 | V48 R49 R50 G51 L55 R56 V57 | V48-L53 HydrophobicContact CG1-CB 3.82Å; R49-L53 PolarHBondContact O-N 3.39Å; R49-L53 VanDerWaalsContact O-N 3.14Å; R50-L53 PolarHBondContact O-N 3.14Å; G51-L53 PolarHBondContact O-N 2.77Å; L53-L55 VanDerWaalsContact C-N 3.33Å; L53-L55 PolarHBondContact O-N 2.93Å; L53-R56 WeakPolarHBondContact O-CB 3.32Å; L53-R56 PolarHBondContact O-N 3.35Å; L53-V57 HydrophobicContact CD1-CG2 4.46Å; L53-V57 HydrophobicContact CG-CG2 4.43Å; L53-V57 WeakPolarHBondContact O-CG2 3.46Å; L53-V57 PolarHBondContact O-N 3.15Å |
| 54 | L | 79.9 | Confident | 76.6 | Confident | 115 Ų | 115 | 109.7 Ų | 109.7 | 60% | 0.602 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -57.8 | -46.7 | 174.6 | -77.6 | 170.6 | 0 | 0 | 0 | 111 | R50 G51 R56 V57 T58 | R50-L54 PolarHBondContact O-N 3.39Å; G51-L54 PolarHBondContact O-N 2.88Å; L54-R56 VanDerWaalsContact C-N 3.3Å; L54-R56 PolarHBondContact O-N 2.98Å; L54-V57 PolarHBondContact O-N 3.33Å; L54-T58 PolarHBondContact O-N 2.91Å; L54-T58 PolarHBondContact O-OG1 3.08Å; L54-T58 VanDerWaalsContact O-OG1 3.12Å |
| 55 | L | 80.2 | Confident | 77.8 | Confident | 126 Ų | 126 | 104.1 Ų | 104.1 | 66% | 0.66 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -59.5 | -40.6 | 176.5 | -68.1 | 174.8 | 0 | 0 | 0 | 112.1 | G51 L53 S59 | G51-L55 PolarHBondContact O-N 3.36Å; L53-L55 VanDerWaalsContact C-N 3.33Å; L53-L55 PolarHBondContact O-N 2.93Å; L55-S59 WeakPolarHBondContact O-CB 3.45Å; L55-S59 PolarHBondContact O-N 3.18Å |
| 56 | R | 83.5 | Confident | 79 | Confident | 156 Ų | 156 | 106.1 Ų | 106.1 | 59% | 0.589 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -64.4 | -44.6 | 174.6 | -102.8 | 175.1 | 167 | -106.7 | 0.2 | 112.5 | D52 L53 L54 S59 I60 | D52-R56 PolarHBondContact O-N 2.88Å; L53-R56 WeakPolarHBondContact O-CB 3.32Å; L53-R56 PolarHBondContact O-N 3.35Å; L54-R56 VanDerWaalsContact C-N 3.3Å; L54-R56 PolarHBondContact O-N 2.98Å; R56-S59 PolarHBondContact O-N 3.45Å; R56-I60 WeakPolarHBondContact O-CD1 3.46Å; R56-I60 VanDerWaalsContact O-CG1 3.25Å; R56-I60 WeakPolarHBondContact O-CG1 3.25Å; R56-I60 PolarHBondContact O-N 3.36Å |
| 57 | V | 84 | Confident | 80.1 | Confident | 61 Ų | 61 | 103.8 Ų | 103.8 | 37% | 0.37 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -62.4 | -49.8 | 179 | 170.6 | 0 | 0 | 0 | 0 | 110.2 | L53 L54 S59 I60 E61 | L53-V57 HydrophobicContact CD1-CG2 4.46Å; L53-V57 HydrophobicContact CG-CG2 4.43Å; L53-V57 WeakPolarHBondContact O-CG2 3.46Å; L53-V57 PolarHBondContact O-N 3.15Å; L54-V57 PolarHBondContact O-N 3.33Å; V57-S59 VanDerWaalsContact C-N 3.3Å; V57-S59 PolarHBondContact O-N 3Å; V57-I60 WeakPolarHBondContact O-CB 3.47Å; V57-I60 PolarHBondContact O-N 3.06Å; V57-I60 VanDerWaalsContact O-N 3.08Å; V57-E61 HydrophobicContact CG1-CG 4.41Å; V57-E61 WeakPolarHBondContact O-CG 3.42Å; V57-E61 PolarHBondContact O-N 2.88Å |
| 58 | T | 82.3 | Confident | 81.3 | Confident | 81 Ų | 81 | 100.2 Ų | 100.2 | 50% | 0.497 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.7 | -38.4 | 177.5 | -58 | 0 | 0 | 0 | 0 | 112.3 | L54 E61 N62 | L54-T58 PolarHBondContact O-N 2.91Å; L54-T58 PolarHBondContact O-OG1 3.08Å; L54-T58 VanDerWaalsContact O-OG1 3.12Å; T58-E61 PolarHBondContact O-N 3.35Å; T58-N62 WeakPolarHBondContact O-CB 3.34Å; T58-N62 PolarHBondContact O-N 2.94Å |
| 59 | S | 82 | Confident | 81.9 | Confident | 64 Ų | 64 | 107.3 Ų | 107.3 | 45% | 0.448 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63.6 | -41.9 | 174.6 | 179.7 | 0 | 0 | 0 | 0 | 112 | L55 R56 V57 N62 N63 | L55-S59 WeakPolarHBondContact O-CB 3.45Å; L55-S59 PolarHBondContact O-N 3.18Å; R56-S59 PolarHBondContact O-N 3.45Å; V57-S59 VanDerWaalsContact C-N 3.3Å; V57-S59 PolarHBondContact O-N 3Å; S59-N62 PolarHBondContact O-N 3.12Å; S59-N63 VanDerWaalsContact O-CG 3.23Å; S59-N63 PolarHBondContact O-N 3.23Å; S59-N63 PolarHBondContact O-ND2 2.92Å |
| 60 | I | 88.4 | Confident | 82.4 | Confident | 91 Ų | 91 | 103.8 Ų | 103.8 | 47% | 0.467 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -64.3 | -46.5 | 176.2 | -69.1 | 163.6 | 0 | 0 | 0 | 110.6 | R56 V57 N62 N63 I64 | R56-I60 WeakPolarHBondContact O-CD1 3.46Å; R56-I60 VanDerWaalsContact O-CG1 3.25Å; R56-I60 WeakPolarHBondContact O-CG1 3.25Å; R56-I60 PolarHBondContact O-N 3.36Å; V57-I60 WeakPolarHBondContact O-CB 3.47Å; V57-I60 PolarHBondContact O-N 3.06Å; V57-I60 VanDerWaalsContact O-N 3.08Å; I60-N62 VanDerWaalsContact C-N 3.32Å; I60-N62 PolarHBondContact O-N 3.32Å; I60-N63 PolarHBondContact O-N 2.98Å; I60-N63 VanDerWaalsContact O-N 3.15Å; I60-I64 HydrophobicContact CG2-CD1 3.74Å; I60-I64 HydrophobicContact CG2-CG1 4.32Å; I60-I64 WeakPolarHBondContact O-CG1 3.49Å; I60-I64 PolarHBondContact O-N 3.3Å |
| 61 | E | 87.5 | Confident | 82.7 | Confident | 120 Ų | 120 | 100.5 Ų | 100.5 | 56% | 0.561 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -57.8 | -43.8 | 177.5 | -71.6 | 173.9 | 152.3 | 0 | 0 | 111.8 | V57 T58 I64 G65 | V57-E61 HydrophobicContact CG1-CG 4.41Å; V57-E61 WeakPolarHBondContact O-CG 3.42Å; V57-E61 PolarHBondContact O-N 2.88Å; T58-E61 PolarHBondContact O-N 3.35Å; E61-I64 PolarHBondContact O-N 2.91Å; E61-G65 PolarHBondContact O-N 2.88Å |
| 62 | N | 86 | Confident | 82.4 | Confident | 104 Ų | 104 | 104 Ų | 104 | 56% | 0.556 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -63 | -44.3 | 176.1 | -167.3 | -40.1 | 0 | 0 | 0 | 111.4 | T58 S59 I60 I64 G65 R66 | T58-N62 WeakPolarHBondContact O-CB 3.34Å; T58-N62 PolarHBondContact O-N 2.94Å; S59-N62 PolarHBondContact O-N 3.12Å; I60-N62 VanDerWaalsContact C-N 3.32Å; I60-N62 PolarHBondContact O-N 3.32Å; N62-I64 PolarHBondContact O-N 3.48Å; N62-G65 PolarHBondContact O-N 3.11Å; N62-R66 WeakPolarHBondContact O-CG 3.33Å; N62-R66 PolarHBondContact O-N 3.31Å |
| 63 | N | 88.8 | Confident | 81.7 | Confident | 76 Ų | 76 | 104.8 Ų | 104.8 | 41% | 0.406 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -61.9 | -43.3 | 177.2 | -71.9 | -25.4 | 0 | 0 | 0 | 112.1 | S59 I60 G65 R66 L67 | S59-N63 VanDerWaalsContact O-CG 3.23Å; S59-N63 PolarHBondContact O-N 3.23Å; S59-N63 PolarHBondContact O-ND2 2.92Å; I60-N63 PolarHBondContact O-N 2.98Å; I60-N63 VanDerWaalsContact O-N 3.15Å; N63-G65 VanDerWaalsContact C-N 3.34Å; N63-G65 PolarHBondContact O-N 2.99Å; N63-R66 PolarHBondContact O-N 3.23Å; N63-L67 WeakPolarHBondContact O-CG 3.21Å; N63-L67 PolarHBondContact O-N 3.49Å |
| 64 | I | 84.5 | Confident | 80.9 | Confident | 93 Ų | 93 | 108.8 Ų | 108.8 | 48% | 0.477 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -59.4 | -47.5 | 174.3 | -66.4 | 166.5 | 0 | 0 | 0 | 109.7 | I60 E61 N62 R66 L67 V68 | I60-I64 HydrophobicContact CG2-CD1 3.74Å; I60-I64 HydrophobicContact CG2-CG1 4.32Å; I60-I64 WeakPolarHBondContact O-CG1 3.49Å; I60-I64 PolarHBondContact O-N 3.3Å; E61-I64 PolarHBondContact O-N 2.91Å; N62-I64 PolarHBondContact O-N 3.48Å; I64-R66 VanDerWaalsContact C-N 3.29Å; I64-R66 PolarHBondContact O-N 2.93Å; I64-L67 PolarHBondContact O-N 3.21Å; I64-L67 VanDerWaalsContact O-N 3.11Å; I64-V68 HydrophobicContact CG2-CG2 4.01Å; I64-V68 WeakPolarHBondContact O-CB 3.27Å; I64-V68 VanDerWaalsContact O-CG2 3.27Å; I64-V68 WeakPolarHBondContact O-CG2 3.41Å; I64-V68 PolarHBondContact O-N 2.94Å |
| 65 | G | 85.5 | Confident | 79.8 | Confident | 30 Ų | 30 | 109 Ų | 109 | 31% | 0.309 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -57 | -40.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | E61 N62 N63 V68 R69 | E61-G65 PolarHBondContact O-N 2.88Å; N62-G65 PolarHBondContact O-N 3.11Å; N63-G65 VanDerWaalsContact C-N 3.34Å; N63-G65 PolarHBondContact O-N 2.99Å; G65-V68 PolarHBondContact O-N 3.47Å; G65-R69 VanDerWaalsContact O-CB 3.27Å; G65-R69 WeakPolarHBondContact O-CB 3.27Å; G65-R69 WeakPolarHBondContact O-CG 3.37Å; G65-R69 PolarHBondContact O-N 3.23Å |
| 66 | R | 85.6 | Confident | 78.6 | Confident | 173 Ų | 173 | 108.4 Ų | 108.4 | 65% | 0.653 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -68.3 | -33.6 | 176.4 | -69.8 | -179.5 | 70.6 | -158.8 | 1.9 | 113.4 | N62 N63 I64 P70 | N62-R66 WeakPolarHBondContact O-CG 3.33Å; N62-R66 PolarHBondContact O-N 3.31Å; N63-R66 PolarHBondContact O-N 3.23Å; I64-R66 VanDerWaalsContact C-N 3.29Å; I64-R66 PolarHBondContact O-N 2.93Å; R66-P70 WeakPolarHBondContact O-CD 3.46Å |
| 67 | L | 86.2 | Confident | 77.7 | Confident | 122 Ų | 122 | 106.6 Ų | 106.6 | 64% | 0.639 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -75.3 | -35.1 | 176.8 | -70.5 | 170.6 | 0 | 0 | 0 | 112.1 | N63 I64 H71 | N63-L67 WeakPolarHBondContact O-CG 3.21Å; N63-L67 PolarHBondContact O-N 3.49Å; I64-L67 PolarHBondContact O-N 3.21Å; I64-L67 VanDerWaalsContact O-N 3.11Å; L67-H71 PolarHBondContact O-CD2 3.01Å |
| 68 | V | 85.5 | Confident | 76.4 | Confident | 59 Ų | 59 | 109.1 Ų | 109.1 | 36% | 0.358 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -84.1 | -32.4 | -176.4 | 173.3 | 0 | 0 | 0 | 0 | 111.7 | I64 G65 H71 L72 | I64-V68 HydrophobicContact CG2-CG2 4.01Å; I64-V68 WeakPolarHBondContact O-CB 3.27Å; I64-V68 VanDerWaalsContact O-CG2 3.27Å; I64-V68 WeakPolarHBondContact O-CG2 3.41Å; I64-V68 PolarHBondContact O-N 2.94Å; G65-V68 PolarHBondContact O-N 3.47Å; V68-H71 WeakPolarHBondContact O-CA 3.14Å; V68-H71 PolarHBondContact O-N 3.39Å; V68-L72 HydrophobicContact CG1-CD1 3.37Å; V68-L72 HydrophobicContact CG1-CD2 4.34Å; V68-L72 HydrophobicContact CG1-CG 3.52Å; V68-L72 PolarHBondContact O-N 2.9Å |
| 69 | R | 79.3 | Confident | 74.8 | Confident | 199 Ų | 199 | 120.2 Ų | 120.2 | 75% | 0.751 | 64% | 0.642 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -50.9 | -45.3 | -179.7 | -93.1 | 179.9 | -171.2 | -128 | 4.6 | 114.7 | G65 H71 | G65-R69 VanDerWaalsContact O-CB 3.27Å; G65-R69 WeakPolarHBondContact O-CB 3.27Å; G65-R69 WeakPolarHBondContact O-CG 3.37Å; G65-R69 PolarHBondContact O-N 3.23Å; R69-H71 PolarHBondContact O-N 3.02Å |
| 70 | P | 79.9 | Confident | 74.4 | Confident | 96 Ų | 96 | 123.1 Ų | 123.1 | 62% | 0.623 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.6 | -13.7 | 177.5 | -22.1 | 34.1 | 0 | 0 | 0 | 114.5 | R66 | R66-P70 WeakPolarHBondContact O-CD 3.46Š|
| 71 | H | 77.8 | Confident | 73.7 | Confident | 158 Ų | 158 | 124.7 Ų | 124.7 | 73% | 0.731 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107.7 | -22.5 | -176 | -55.2 | -25.7 | 0 | 0 | 0 | 112.7 | L67 V68 R69 G73 | L67-H71 PolarHBondContact O-CD2 3.01Å; V68-H71 WeakPolarHBondContact O-CA 3.14Å; V68-H71 PolarHBondContact O-N 3.39Å; R69-H71 PolarHBondContact O-N 3.02Å; H71-G73 PolarHBondContact O-N 3.46Å |
| 72 | L | 67.3 | Low | 72.9 | Confident | 117 Ų | 117 | 125 Ų | 125 | 61% | 0.613 | 67% | 0.667 | S | S | * | * | S | Bend | trans | -82.6 | 86.4 | 164.4 | -65.4 | 177.1 | 0 | 0 | 0 | 107.5 | V68 E74 | V68-L72 HydrophobicContact CG1-CD1 3.37Å; V68-L72 HydrophobicContact CG1-CD2 4.34Å; V68-L72 HydrophobicContact CG1-CG 3.52Å; V68-L72 PolarHBondContact O-N 2.9Å; L72-E74 PolarHBondContact O-N 3.23Å |
| 73 | G | 62.8 | Low | 72.1 | Confident | 67 Ų | 67 | 126.2 Ų | 126.2 | 69% | 0.691 | 67% | 0.674 | S | S | * | * | trans | -42.7 | 137.4 | 169.2 | 0 | 0 | 0 | 0 | 0 | 110.2 | H71 | H71-G73 PolarHBondContact O-N 3.46Š| ||
| 74 | E | 62.1 | Low | 71.1 | Confident | 177 Ų | 177 | 129.4 Ų | 129.4 | 83% | 0.827 | 69% | 0.69 | S | S | * | * | trans | -44.6 | 128.5 | -167.8 | -62.3 | -159.7 | 133.3 | 0 | 0 | 110.9 | L72 S76 | L72-E74 PolarHBondContact O-N 3.23Å; E74-S76 PolarHBondContact O-N 2.85Å | ||
| 75 | P | 57.7 | Low | 70.2 | Confident | 120 Ų | 120 | 131.8 Ų | 131.8 | 78% | 0.779 | 71% | 0.705 | S | S | * | * | trans | -58.7 | 112.6 | 168.7 | 24.7 | -29.2 | 0 | 0 | 0 | 105.1 | S77 | P75-S77 PolarHBondContact O-N 2.72Š| ||
| 76 | S | 55.1 | Low | 69.1 | Low | 113 Ų | 113 | 139.1 Ų | 139.1 | 79% | 0.79 | 73% | 0.733 | S | S | * | * | trans | -60.8 | 93.9 | 175.9 | -59.6 | 0 | 0 | 0 | 0 | 106.2 | E74 S78 | E74-S76 PolarHBondContact O-N 2.85Å; S76-S78 PolarHBondContact O-N 3.38Å | ||
| 77 | S | 63.6 | Low | 67.9 | Low | 117 Ų | 117 | 136.5 Ų | 136.5 | 82% | 0.818 | 74% | 0.739 | S | S | * | * | trans | -72.2 | 88.4 | 173.3 | -172.8 | 0 | 0 | 0 | 0 | 105.6 | P75 R79 | P75-S77 PolarHBondContact O-N 2.72Å; S77-R79 PolarHBondContact O-N 3.14Å; S77-R79 VanDerWaalsContact O-N 3.14Å | ||
| 78 | S | 56 | Low | 66.3 | Low | 114 Ų | 114 | 137.7 Ų | 137.7 | 80% | 0.797 | 75% | 0.747 | S | S | * | * | trans | -58.5 | 118.1 | 165.9 | -72.9 | 0 | 0 | 0 | 0 | 108.2 | S76 | S76-S78 PolarHBondContact O-N 3.38Š| ||
| 79 | R | 48.9 | Very low | 64.6 | Low | 315 Ų | 315 | 144.8 Ų | 144.8 | 100% | 1.189 | 78% | 0.783 | S | S | * | * | trans | -28.6 | 0 | 172.3 | -156 | 178.6 | -167.5 | -177 | 2.6 | 116.7 | S77 | S77-R79 PolarHBondContact O-N 3.14Å; S77-R79 VanDerWaalsContact O-N 3.14Å |
Retrieved 79 of 79 residues in 139.8 ms
(Link to these results)