| 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 | 45.8 | Very low | 54.5 | Low | 246 Ų | 246 | 126.4 Ų | 126.4 | 100% | 1.212 | 69% | 0.689 | S | S | * | * | 0 | 117.9 | 0 | -94.3 | 175.7 | 170.3 | 0 | 0 | 107.8 | |||||
| 2 | E | 47 | Very low | 55.7 | Low | 163 Ų | 163 | 122.2 Ų | 122.2 | 76% | 0.762 | 68% | 0.676 | S | S | * | * | trans | -63 | 126.1 | 171.2 | -174 | 176.1 | 174.5 | 0 | 0 | 109.7 | T4 | E2-T4 HydrophobicContact CG-CG2 4Å; E2-T4 PolarHBondContact OE1-OG1 3Å | ||
| 3 | Q | 47.7 | Very low | 57 | Low | 198 Ų | 198 | 120.4 Ų | 120.4 | 93% | 0.925 | 66% | 0.664 | S | S | * | * | trans | -123.1 | 82.2 | 158.7 | -85 | -170.1 | -12.7 | 0 | 0 | 107.1 | ||||
| 4 | T | 50.3 | Low | 57.8 | Low | 105 Ų | 105 | 116 Ų | 116 | 64% | 0.644 | 65% | 0.651 | S | S | * | * | trans | -83.5 | 134.5 | 163.5 | 40.7 | 0 | 0 | 0 | 0 | 108.8 | E2 | E2-T4 HydrophobicContact CG-CG2 4Å; E2-T4 PolarHBondContact OE1-OG1 3Å | ||
| 5 | K | 49.7 | Very low | 58.8 | Low | 141 Ų | 141 | 113.2 Ų | 113.2 | 61% | 0.613 | 64% | 0.642 | S | S | * | * | trans | 97.9 | 126.3 | 166.5 | -140.9 | 169 | -174.3 | -178.9 | 0 | 116.6 | A7 H8 | K5-A7 HydrophobicContact CG-CB 4.12Å; K5-H8 WeakPolarHBondContact CE-CD2 3.35Å; K5-H8 PolarHBondContact NZ-CD2 3.22Å; K5-H8 PolarHBondContact NZ-NE2 3.39Å | ||
| 6 | P | 54.3 | Low | 59.6 | Low | 103 Ų | 103 | 108.3 Ų | 108.3 | 67% | 0.669 | 63% | 0.625 | S | S | * | * | -134.6 | 70.1 | 98.6 | 39.1 | -28 | 0 | 0 | 0 | 113.9 | H8 | P6-H8 PolarHBondContact O-N 3.06Š| |||
| 7 | A | 58.5 | Low | 60.4 | Low | 67 Ų | 67 | 110.4 Ų | 110.4 | 55% | 0.554 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -68.2 | -12.2 | 170.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | K5 | K5-A7 HydrophobicContact CG-CB 4.12Å |
| 8 | H | 56.6 | Low | 60.8 | Low | 136 Ų | 136 | 110.1 Ų | 110.1 | 63% | 0.63 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -79.2 | -26.6 | 179.2 | -90.2 | -65 | 0 | 0 | 0 | 113.9 | K5 P6 | K5-H8 WeakPolarHBondContact CE-CD2 3.35Å; K5-H8 PolarHBondContact NZ-CD2 3.22Å; K5-H8 PolarHBondContact NZ-NE2 3.39Å; P6-H8 PolarHBondContact O-N 3.06Å |
| 9 | A | 61.4 | Low | 61.1 | Low | 53 Ų | 53 | 106.6 Ų | 106.6 | 44% | 0.438 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -68.8 | -42.9 | -177.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | A11 S12 L13 | A9-A11 PolarHBondContact O-N 3.4Å; A9-S12 PolarHBondContact O-N 3.29Å; A9-S12 PolarHBondContact O-OG 3.36Å; A9-L13 PolarHBondContact O-N 3.36Å; A9-L13 VanDerWaalsContact O-N 3.12Å |
| 10 | D | 63.5 | Low | 61.4 | Low | 115 Ų | 115 | 111.1 Ų | 111.1 | 62% | 0.615 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -67.3 | -38.2 | -175.6 | -67.5 | -28.3 | 0 | 0 | 0 | 113.2 | S12 L13 A14 | D10-S12 PolarHBondContact O-N 2.83Å; D10-L13 PolarHBondContact O-N 2.75Å; D10-A14 WeakPolarHBondContact O-CB 3.46Å; D10-A14 PolarHBondContact O-N 2.76Å |
| 11 | A | 64.6 | Low | 61.6 | Low | 63 Ų | 63 | 111.5 Ų | 111.5 | 52% | 0.521 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -64.7 | -39.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | A9 A14 S15 | A9-A11 PolarHBondContact O-N 3.4Å; A11-A14 PolarHBondContact O-N 3.09Å; A11-S15 WeakPolarHBondContact O-CB 3.44Å; A11-S15 PolarHBondContact O-N 3.03Å |
| 12 | S | 68.8 | Low | 62.5 | Low | 76 Ų | 76 | 105.2 Ų | 105.2 | 53% | 0.531 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -65.5 | -41.4 | 176.6 | 79.2 | 0 | 0 | 0 | 0 | 111.7 | A9 D10 S15 G16 | A9-S12 PolarHBondContact O-N 3.29Å; A9-S12 PolarHBondContact O-OG 3.36Å; D10-S12 PolarHBondContact O-N 2.83Å; S12-S15 PolarHBondContact O-N 3.2Å; S12-S15 PolarHBondContact O-OG 3.38Å; S12-G16 PolarHBondContact O-N 3.49Å |
| 13 | L | 72.4 | Confident | 63.5 | Low | 99 Ų | 99 | 106.4 Ų | 106.4 | 52% | 0.518 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -66.8 | -40.8 | 178 | -170.5 | 71.1 | 0 | 0 | 0 | 111.6 | A9 D10 G16 K17 | A9-L13 PolarHBondContact O-N 3.36Å; A9-L13 VanDerWaalsContact O-N 3.12Å; D10-L13 PolarHBondContact O-N 2.75Å; L13-G16 PolarHBondContact O-N 3.29Å; L13-K17 WeakPolarHBondContact O-CG 3.42Å; L13-K17 PolarHBondContact O-N 3.46Å |
| 14 | A | 68.9 | Low | 64.6 | Low | 59 Ų | 59 | 103.4 Ų | 103.4 | 49% | 0.488 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -62.9 | -45 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | D10 A11 G16 K17 L18 | D10-A14 WeakPolarHBondContact O-CB 3.46Å; D10-A14 PolarHBondContact O-N 2.76Å; A11-A14 PolarHBondContact O-N 3.09Å; A14-G16 VanDerWaalsContact C-N 3.32Å; A14-G16 PolarHBondContact O-N 2.98Å; A14-K17 PolarHBondContact O-N 3.47Å; A14-L18 WeakPolarHBondContact O-CB 3.11Å; A14-L18 PolarHBondContact O-N 3.28Å |
| 15 | S | 72 | Confident | 65.5 | Low | 74 Ų | 74 | 103.8 Ų | 103.8 | 52% | 0.517 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -61.8 | -39.6 | 176 | 76.8 | 0 | 0 | 0 | 0 | 112.2 | A11 S12 L18 A19 | A11-S15 WeakPolarHBondContact O-CB 3.44Å; A11-S15 PolarHBondContact O-N 3.03Å; S12-S15 PolarHBondContact O-N 3.2Å; S12-S15 PolarHBondContact O-OG 3.38Å; S15-L18 PolarHBondContact O-N 2.94Å; S15-A19 WeakPolarHBondContact O-CB 3.48Å; S15-A19 PolarHBondContact O-N 2.9Å |
| 16 | G | 71.8 | Confident | 66.5 | Low | 35 Ų | 35 | 98.4 Ų | 98.4 | 36% | 0.361 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -66.6 | -40.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113 | S12 L13 A14 R20 | S12-G16 PolarHBondContact O-N 3.49Å; L13-G16 PolarHBondContact O-N 3.29Å; A14-G16 VanDerWaalsContact C-N 3.32Å; A14-G16 PolarHBondContact O-N 2.98Å; G16-R20 VanDerWaalsContact O-CB 3.31Å; G16-R20 WeakPolarHBondContact O-CB 3.46Å; G16-R20 PolarHBondContact O-N 3.48Å |
| 17 | K | 73.8 | Confident | 67.3 | Low | 144 Ų | 144 | 100.9 Ų | 100.9 | 63% | 0.626 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -64.5 | -43.8 | 173.6 | -75.8 | -179 | -179.1 | 179.2 | 0 | 111.4 | L13 A14 R20 F21 | L13-K17 WeakPolarHBondContact O-CG 3.42Å; L13-K17 PolarHBondContact O-N 3.46Å; A14-K17 PolarHBondContact O-N 3.47Å; K17-R20 PolarHBondContact O-N 3.49Å; K17-F21 WeakPolarHBondContact O-CB 3.2Å; K17-F21 PolarHBondContact O-N 3.48Å |
| 18 | L | 67.9 | Low | 67.9 | Low | 105 Ų | 105 | 101.6 Ų | 101.6 | 55% | 0.55 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -63.1 | -46 | 177.4 | -164.2 | 74.9 | 0 | 0 | 0 | 111.3 | A14 S15 R20 F21 H22 | A14-L18 WeakPolarHBondContact O-CB 3.11Å; A14-L18 PolarHBondContact O-N 3.28Å; S15-L18 PolarHBondContact O-N 2.94Å; L18-R20 VanDerWaalsContact C-N 3.31Å; L18-R20 PolarHBondContact O-N 3.14Å; L18-F21 WeakPolarHBondContact O-CB 3.49Å; L18-F21 PolarHBondContact O-N 3.49Å; L18-H22 PolarHBondContact O-CD2 3.32Å; L18-H22 VanDerWaalsContact O-CD2 3.29Å; L18-H22 PolarHBondContact O-N 3.32Å |
| 19 | A | 66.7 | Low | 68.6 | Low | 43 Ų | 43 | 98.8 Ų | 98.8 | 36% | 0.355 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.2 | -34.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | S15 R23 | S15-A19 WeakPolarHBondContact O-CB 3.48Å; S15-A19 PolarHBondContact O-N 2.9Å; A19-R23 WeakPolarHBondContact O-CB 3.41Å; A19-R23 PolarHBondContact O-N 3.17Å |
| 20 | R | 67.4 | Low | 69.3 | Low | 196 Ų | 196 | 104 Ų | 104 | 74% | 0.74 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -69.8 | -38.5 | 174.4 | -157 | -177 | -68.3 | -169.5 | -1.7 | 111 | G16 K17 L18 R23 F24 | G16-R20 VanDerWaalsContact O-CB 3.31Å; G16-R20 WeakPolarHBondContact O-CB 3.46Å; G16-R20 PolarHBondContact O-N 3.48Å; K17-R20 PolarHBondContact O-N 3.49Å; L18-R20 VanDerWaalsContact C-N 3.31Å; L18-R20 PolarHBondContact O-N 3.14Å; R20-R23 PolarHBondContact O-N 3.34Å; R20-F24 WeakPolarHBondContact O-CB 3.41Å; R20-F24 PolarHBondContact O-N 3.19Å |
| 21 | F | 64.1 | Low | 69.8 | Low | 121 Ų | 121 | 102.6 Ų | 102.6 | 53% | 0.531 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -65.5 | -44.7 | 174.9 | -168.6 | -104.1 | 0 | 0 | 0 | 112.2 | K17 L18 F24 R25 | K17-F21 WeakPolarHBondContact O-CB 3.2Å; K17-F21 PolarHBondContact O-N 3.48Å; L18-F21 WeakPolarHBondContact O-CB 3.49Å; L18-F21 PolarHBondContact O-N 3.49Å; F21-F24 PolarHBondContact O-N 2.97Å; F21-R25 HydrophobicContact CD1-CG 4.48Å; F21-R25 HydrophobicContact CE1-CG 4.31Å; F21-R25 WeakPolarHBondContact O-CG 3.41Å; F21-R25 PolarHBondContact O-N 2.88Å |
| 22 | H | 64.8 | Low | 70.1 | Confident | 113 Ų | 113 | 101.2 Ų | 101.2 | 52% | 0.523 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -63.2 | -42.3 | 174.3 | -83.7 | -81.4 | 0 | 0 | 0 | 112.6 | L18 F24 R25 G26 | L18-H22 PolarHBondContact O-CD2 3.32Å; L18-H22 VanDerWaalsContact O-CD2 3.29Å; L18-H22 PolarHBondContact O-N 3.32Å; H22-F24 PolarHBondContact O-N 3.48Å; H22-R25 PolarHBondContact O-N 3.2Å; H22-G26 PolarHBondContact O-N 3.49Å |
| 23 | R | 67.9 | Low | 70.2 | Confident | 188 Ų | 188 | 100.8 Ų | 100.8 | 71% | 0.709 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -62.1 | -41.4 | 174.2 | -90.9 | -174 | -79.8 | -156.6 | -4.7 | 112.5 | A19 R20 G26 Y27 | A19-R23 WeakPolarHBondContact O-CB 3.41Å; A19-R23 PolarHBondContact O-N 3.17Å; R20-R23 PolarHBondContact O-N 3.34Å; R23-G26 PolarHBondContact O-N 2.9Å; R23-Y27 WeakPolarHBondContact O-CB 3.45Å; R23-Y27 PolarHBondContact O-N 3.48Å |
| 24 | F | 71.3 | Confident | 70.1 | Confident | 136 Ų | 136 | 98 Ų | 98 | 60% | 0.596 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -65 | -41.8 | 177.5 | -170 | -98.2 | 0 | 0 | 0 | 112.1 | R20 F21 H22 Y27 L28 | R20-F24 WeakPolarHBondContact O-CB 3.41Å; R20-F24 PolarHBondContact O-N 3.19Å; F21-F24 PolarHBondContact O-N 2.97Å; H22-F24 PolarHBondContact O-N 3.48Å; F24-Y27 PolarHBondContact O-N 2.99Å; F24-L28 WeakPolarHBondContact O-CB 3.38Å; F24-L28 PolarHBondContact O-N 2.81Å |
| 25 | R | 69.8 | Low | 70.1 | Confident | 113 Ų | 113 | 99.3 Ų | 99.3 | 43% | 0.426 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -58.9 | -49.7 | 173.1 | -72.6 | -178.8 | 85.7 | 170.5 | 7.1 | 111.1 | F21 H22 Y27 L28 Y29 | F21-R25 HydrophobicContact CD1-CG 4.48Å; F21-R25 HydrophobicContact CE1-CG 4.31Å; F21-R25 WeakPolarHBondContact O-CG 3.41Å; F21-R25 PolarHBondContact O-N 2.88Å; H22-R25 PolarHBondContact O-N 3.2Å; R25-Y27 PolarHBondContact O-N 2.84Å; R25-L28 PolarHBondContact O-N 3.1Å; R25-Y29 VanDerWaalsContact C-CD2 3.5Å; R25-Y29 HydrophobicContact CB-CD2 4.4Å; R25-Y29 HydrophobicContact CB-CE2 3.91Å; R25-Y29 WeakPolarHBondContact O-CD2 3.17Å; R25-Y29 PolarHBondContact O-N 3.28Å |
| 26 | G | 69.1 | Low | 69.8 | Low | 28 Ų | 28 | 97.8 Ų | 97.8 | 29% | 0.289 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -54.8 | -49.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | H22 R23 L28 Y29 F30 | H22-G26 PolarHBondContact O-N 3.49Å; R23-G26 PolarHBondContact O-N 2.9Å; G26-L28 PolarHBondContact O-N 3.41Å; G26-Y29 PolarHBondContact O-N 3.46Å; G26-F30 VanDerWaalsContact O-CD2 3.27Å; G26-F30 WeakPolarHBondContact O-CD2 3.22Å; G26-F30 PolarHBondContact O-N 3.49Å |
| 27 | Y | 71.5 | Confident | 69.5 | Low | 154 Ų | 154 | 100 Ų | 100 | 60% | 0.604 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -60.5 | -44.1 | 178.9 | -175 | -93.2 | 0 | 0 | 0 | 112.8 | R23 F24 R25 Y29 F30 Q31 | R23-Y27 WeakPolarHBondContact O-CB 3.45Å; R23-Y27 PolarHBondContact O-N 3.48Å; F24-Y27 PolarHBondContact O-N 2.99Å; R25-Y27 PolarHBondContact O-N 2.84Å; Y27-Y29 VanDerWaalsContact C-N 3.33Å; Y27-Y29 PolarHBondContact O-N 3.19Å; Y27-F30 PolarHBondContact O-N 3.42Å; Y27-Q31 WeakPolarHBondContact O-CB 3.39Å; Y27-Q31 PolarHBondContact O-N 3.28Å |
| 28 | L | 72.6 | Confident | 68.7 | Low | 83 Ų | 83 | 97.3 Ų | 97.3 | 44% | 0.435 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -62 | -40.6 | 177.7 | -173.3 | 72 | 0 | 0 | 0 | 111.8 | F24 R25 G26 Q31 L32 | F24-L28 WeakPolarHBondContact O-CB 3.38Å; F24-L28 PolarHBondContact O-N 2.81Å; R25-L28 PolarHBondContact O-N 3.1Å; G26-L28 PolarHBondContact O-N 3.41Å; L28-Q31 PolarHBondContact O-N 3.07Å; L28-L32 HydrophobicContact CG-CD1 4.26Å; L28-L32 PolarHBondContact O-N 2.61Å; L28-L32 VanDerWaalsContact O-N 3.09Å |
| 29 | Y | 70.8 | Confident | 68.3 | Low | 76 Ų | 76 | 93.1 Ų | 93.1 | 30% | 0.298 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -63.7 | -47.2 | 175.5 | -66.8 | -54.7 | 0 | 0 | 0 | 111.9 | R25 G26 Y27 Q31 L32 I33 I132 | R25-Y29 VanDerWaalsContact C-CD2 3.5Å; R25-Y29 HydrophobicContact CB-CD2 4.4Å; R25-Y29 HydrophobicContact CB-CE2 3.91Å; R25-Y29 WeakPolarHBondContact O-CD2 3.17Å; R25-Y29 PolarHBondContact O-N 3.28Å; G26-Y29 PolarHBondContact O-N 3.46Å; Y27-Y29 VanDerWaalsContact C-N 3.33Å; Y27-Y29 PolarHBondContact O-N 3.19Å; Y29-Q31 VanDerWaalsContact C-N 3.33Å; Y29-Q31 PolarHBondContact O-N 2.99Å; Y29-L32 PolarHBondContact O-N 2.86Å; Y29-I33 WeakPolarHBondContact O-CG1 3.25Å; Y29-I33 PolarHBondContact O-N 3.21Å; Y29-I33 VanDerWaalsContact O-N 3.11Å; Y29-I132 HydrophobicContact CD1-CD1 3.9Å; Y29-I132 HydrophobicContact CD1-CG1 4.13Å; Y29-I132 HydrophobicContact CD1-CG2 3.6Å; Y29-I132 HydrophobicContact CE1-CD1 4.04Å; Y29-I132 HydrophobicContact CE1-CG1 4.02Å; Y29-I132 HydrophobicContact CE1-CG2 4.06Å; Y29-I132 HydrophobicContact CG-CG2 4.46Å |
| 30 | F | 74.6 | Confident | 67.9 | Low | 164 Ų | 164 | 102.8 Ų | 102.8 | 72% | 0.719 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -61.5 | -40.8 | 177.7 | -88.7 | -74.9 | 0 | 0 | 0 | 112.3 | G26 Y27 I33 G34 | G26-F30 VanDerWaalsContact O-CD2 3.27Å; G26-F30 WeakPolarHBondContact O-CD2 3.22Å; G26-F30 PolarHBondContact O-N 3.49Å; Y27-F30 PolarHBondContact O-N 3.42Å; F30-I33 PolarHBondContact O-N 2.92Å; F30-G34 PolarHBondContact O-N 3.38Å |
| 31 | Q | 75.5 | Confident | 67.3 | Low | 85 Ų | 85 | 94 Ų | 94 | 40% | 0.397 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -65.1 | -44.8 | 178.6 | -172.4 | -179.9 | -17.4 | 0 | 0 | 111.9 | Y27 L28 Y29 I33 G34 E35 | Y27-Q31 WeakPolarHBondContact O-CB 3.39Å; Y27-Q31 PolarHBondContact O-N 3.28Å; L28-Q31 PolarHBondContact O-N 3.07Å; Y29-Q31 VanDerWaalsContact C-N 3.33Å; Y29-Q31 PolarHBondContact O-N 2.99Å; Q31-I33 PolarHBondContact O-N 3.11Å; Q31-G34 PolarHBondContact O-N 3.49Å; Q31-E35 PolarHBondContact NE2-OE1 2.88Å; Q31-E35 WeakPolarHBondContact O-CG 3.35Å; Q31-E35 PolarHBondContact O-N 2.96Å |
| 32 | L | 71 | Confident | 66.8 | Low | 33 Ų | 33 | 95.3 Ų | 95.3 | 17% | 0.173 | 46% | 0.462 | C | S | . | . | H | α-helix | trans | -61 | -43.1 | 177.6 | -81.6 | 161.6 | 0 | 0 | 0 | 112.2 | L28 Y29 E35 F36 I132 | L28-L32 HydrophobicContact CG-CD1 4.26Å; L28-L32 PolarHBondContact O-N 2.61Å; L28-L32 VanDerWaalsContact O-N 3.09Å; Y29-L32 PolarHBondContact O-N 2.86Å; L32-E35 PolarHBondContact O-N 2.9Å; L32-F36 WeakPolarHBondContact O-CB 3.22Å; L32-F36 PolarHBondContact O-N 3.18Å; L32-I132 HydrophobicContact CD1-CD1 3.78Å |
| 33 | I | 70.7 | Confident | 66.4 | Low | 67 Ų | 67 | 96.1 Ų | 96.1 | 34% | 0.344 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -65.8 | -41.1 | 177.5 | -65.8 | 167.2 | 0 | 0 | 0 | 110.8 | Y29 F30 Q31 F36 A37 I133 | Y29-I33 WeakPolarHBondContact O-CG1 3.25Å; Y29-I33 PolarHBondContact O-N 3.21Å; Y29-I33 VanDerWaalsContact O-N 3.11Å; F30-I33 PolarHBondContact O-N 2.92Å; Q31-I33 PolarHBondContact O-N 3.11Å; I33-F36 PolarHBondContact O-N 3.05Å; I33-A37 WeakPolarHBondContact O-CB 3.45Å; I33-A37 PolarHBondContact O-N 3.48Å; I33-I133 HydrophobicContact CG1-CG1 4.25Å |
| 34 | G | 69.6 | Low | 66.4 | Low | 40 Ų | 40 | 89.2 Ų | 89.2 | 41% | 0.412 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -63.1 | -44 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113 | F30 Q31 F36 A37 A38 | F30-G34 PolarHBondContact O-N 3.38Å; Q31-G34 PolarHBondContact O-N 3.49Å; G34-F36 VanDerWaalsContact C-N 3.31Å; G34-F36 PolarHBondContact O-N 3.4Å; G34-A37 PolarHBondContact O-N 3.31Å; G34-A38 WeakPolarHBondContact O-CB 3.39Å; G34-A38 PolarHBondContact O-N 3.39Å |
| 35 | E | 68.7 | Low | 66.6 | Low | 88 Ų | 88 | 84 Ų | 84 | 41% | 0.411 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -62.1 | -38.4 | 174.7 | -75.3 | 179.8 | -160 | 0 | 0 | 111.8 | Q31 L32 S39 K125 | Q31-E35 PolarHBondContact NE2-OE1 2.88Å; Q31-E35 WeakPolarHBondContact O-CG 3.35Å; Q31-E35 PolarHBondContact O-N 2.96Å; L32-E35 PolarHBondContact O-N 2.9Å; E35-S39 PolarHBondContact O-N 2.97Å; E35-K125 IonicContact OE2-NZ 3.92Å |
| 36 | F | 65.6 | Low | 67.3 | Low | 42 Ų | 42 | 81.2 Ų | 81.2 | 18% | 0.184 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -66.7 | -47.2 | 175.5 | -177.7 | -97.4 | 0 | 0 | 0 | 112.1 | L32 I33 G34 A38 S39 Y45 C129 L130 I133 | L32-F36 WeakPolarHBondContact O-CB 3.22Å; L32-F36 PolarHBondContact O-N 3.18Å; I33-F36 PolarHBondContact O-N 3.05Å; G34-F36 VanDerWaalsContact C-N 3.31Å; G34-F36 PolarHBondContact O-N 3.4Å; F36-A38 VanDerWaalsContact C-N 3.29Å; F36-A38 PolarHBondContact O-N 2.96Å; F36-S39 WeakPolarHBondContact O-CB 3.31Å; F36-S39 PolarHBondContact O-N 3.3Å; F36-S39 VanDerWaalsContact O-N 3.17Å; F36-S39 PolarHBondContact O-OG 3.37Å; F36-Y45 HydrophobicContact CE1-CE2 4.29Å; F36-Y45 AromaticContact CE2-CE2 3.71Å; F36-Y45 HydrophobicContact CE2-CE2 3.71Å; F36-Y45 AromaticContact CE2-CZ 3.88Å; F36-Y45 WeakPolarHBondContact CE2-OH 3.27Å; F36-Y45 HydrophobicContact CZ-CD2 4.17Å; F36-Y45 AromaticContact CZ-CE2 3.33Å; F36-Y45 HydrophobicContact CZ-CE2 3.33Å; F36-Y45 AromaticContact CZ-CZ 3.73Å; F36-C129 HydrophobicContact CB-CB 4.26Å; F36-C129 WeakPolarHBondContact CB-SG 3.49Å; F36-C129 HydrophobicContact CD2-CB 4.23Å; F36-C129 HydrophobicContact CG-CB 4.39Å; F36-L130 HydrophobicContact CE2-CD2 4.2Å; F36-L130 HydrophobicContact CE2-CG 4.28Å; F36-L130 HydrophobicContact CZ-CD2 3.78Å; F36-L130 HydrophobicContact CZ-CG 4.36Å; F36-I133 HydrophobicContact CD1-CD1 4.41Å |
| 37 | A | 65.4 | Low | 68.3 | Low | 81 Ų | 81 | 81.5 Ų | 81.5 | 67% | 0.669 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -63.1 | -34.9 | 178 | 0 | 0 | 0 | 0 | 0 | 112.8 | I33 G34 S39 | I33-A37 WeakPolarHBondContact O-CB 3.45Å; I33-A37 PolarHBondContact O-N 3.48Å; G34-A37 PolarHBondContact O-N 3.31Å; A37-S39 VanDerWaalsContact C-N 3.27Å; A37-S39 PolarHBondContact O-N 3.29Å |
| 38 | A | 57.5 | Low | 69.1 | Low | 87 Ų | 87 | 75 Ų | 75 | 72% | 0.719 | 41% | 0.407 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.6 | -13.3 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | G34 F36 | G34-A38 WeakPolarHBondContact O-CB 3.39Å; G34-A38 PolarHBondContact O-N 3.39Å; F36-A38 VanDerWaalsContact C-N 3.29Å; F36-A38 PolarHBondContact O-N 2.96Å |
| 39 | S | 60.2 | Low | 70 | Confident | 18 Ų | 18 | 75.6 Ų | 75.6 | 13% | 0.126 | 41% | 0.409 | C | S | . | . | S | Bend | trans | -74.6 | 148.2 | -176.8 | 72.5 | 0 | 0 | 0 | 0 | 112.5 | E35 F36 A37 L41 Y122 | E35-S39 PolarHBondContact O-N 2.97Å; F36-S39 WeakPolarHBondContact O-CB 3.31Å; F36-S39 PolarHBondContact O-N 3.3Å; F36-S39 VanDerWaalsContact O-N 3.17Å; F36-S39 PolarHBondContact O-OG 3.37Å; A37-S39 VanDerWaalsContact C-N 3.27Å; A37-S39 PolarHBondContact O-N 3.29Å; S39-L41 PolarHBondContact O-N 2.98Å; S39-L41 WeakPolarHBondContact OG-CB 3.46Å; S39-L41 WeakPolarHBondContact OG-CD1 3.48Å; S39-Y122 VanDerWaalsContact CB-OH 3.27Å; S39-Y122 WeakPolarHBondContact CB-OH 3.36Å |
| 40 | R | 57.7 | Low | 71 | Confident | 245 Ų | 245 | 75.1 Ų | 75.1 | 93% | 0.925 | 41% | 0.414 | S | S | * | . | G | 310 helix | trans | -64 | 10.6 | 173.6 | -76.1 | -163.4 | -176.7 | -174.1 | 2.6 | 114.2 | H42 | R40-H42 PolarHBondContact O-N 2.94Š|
| 41 | L | 55.3 | Low | 72 | Confident | 11 Ų | 11 | 67.3 Ų | 67.3 | 6% | 0.058 | 38% | 0.38 | C | S | . | . | G | 310 helix | trans | -69 | -12 | 179.1 | -85.5 | 134.3 | 0 | 0 | 0 | 114.2 | S39 V43 S44 Y45 L109 Y122 | S39-L41 PolarHBondContact O-N 2.98Å; S39-L41 WeakPolarHBondContact OG-CB 3.46Å; S39-L41 WeakPolarHBondContact OG-CD1 3.48Å; L41-V43 VanDerWaalsContact C-N 3.27Å; L41-V43 PolarHBondContact O-N 3.35Å; L41-S44 WeakPolarHBondContact O-CA 3.45Å; L41-S44 WeakPolarHBondContact O-CB 3.41Å; L41-S44 PolarHBondContact O-N 3.36Å; L41-Y45 HydrophobicContact CB-CD2 3.88Å; L41-Y45 HydrophobicContact CB-CE2 3.4Å; L41-Y45 HydrophobicContact CD2-CD2 4.47Å; L41-Y45 HydrophobicContact CD2-CE1 4.42Å; L41-Y45 HydrophobicContact CD2-CE2 3.54Å; L41-Y45 VanDerWaalsContact CD2-CZ 3.47Å; L41-Y45 VanDerWaalsContact CD2-OH 3.25Å; L41-Y45 WeakPolarHBondContact CD2-OH 3.4Å; L41-Y45 HydrophobicContact CG-CE2 4.02Å; L41-Y45 WeakPolarHBondContact O-CD2 3.33Å; L41-Y45 PolarHBondContact O-N 3.42Å; L41-L109 HydrophobicContact CD2-CD1 3.51Å; L41-Y122 HydrophobicContact CD1-CE1 3.98Å; L41-Y122 WeakPolarHBondContact CD1-OH 3.5Å |
| 42 | H | 53.6 | Low | 72.8 | Confident | 150 Ų | 150 | 65.8 Ų | 65.8 | 69% | 0.694 | 38% | 0.376 | S | S | * | . | G | 310 helix | trans | -55.9 | -37.4 | -177.4 | -163.2 | -82.8 | 0 | 0 | 0 | 113.8 | R40 S44 | R40-H42 PolarHBondContact O-N 2.94Å; H42-S44 VanDerWaalsContact C-N 3.28Å; H42-S44 PolarHBondContact O-N 3.12Å |
| 43 | V | 56.8 | Low | 73.9 | Confident | 130 Ų | 130 | 66.8 Ų | 66.8 | 79% | 0.788 | 39% | 0.389 | S | S | * | . | G | 310 helix | trans | -70.4 | -27.4 | 177.2 | -178.4 | 0 | 0 | 0 | 0 | 111.6 | L41 | L41-V43 VanDerWaalsContact C-N 3.27Å; L41-V43 PolarHBondContact O-N 3.35Å |
| 44 | S | 67 | Low | 75.1 | Confident | 43 Ų | 43 | 65.2 Ų | 65.2 | 30% | 0.301 | 38% | 0.381 | S | S | . | . | G | 310 helix | trans | -80.5 | -12.9 | -177.5 | -62.8 | 0 | 0 | 0 | 0 | 114.1 | L41 H42 | L41-S44 WeakPolarHBondContact O-CA 3.45Å; L41-S44 WeakPolarHBondContact O-CB 3.41Å; L41-S44 PolarHBondContact O-N 3.36Å; H42-S44 VanDerWaalsContact C-N 3.28Å; H42-S44 PolarHBondContact O-N 3.12Å |
| 45 | Y | 76.1 | Confident | 76.2 | Confident | 26 Ų | 26 | 63.4 Ų | 63.4 | 10% | 0.102 | 36% | 0.362 | C | S | . | . | G | 310 helix | trans | -104.4 | 15.5 | -172.9 | -69.4 | -54.4 | 0 | 0 | 0 | 115.1 | F36 L41 N47 A48 I49 D105 | F36-Y45 HydrophobicContact CE1-CE2 4.29Å; F36-Y45 AromaticContact CE2-CE2 3.71Å; F36-Y45 HydrophobicContact CE2-CE2 3.71Å; F36-Y45 AromaticContact CE2-CZ 3.88Å; F36-Y45 WeakPolarHBondContact CE2-OH 3.27Å; F36-Y45 HydrophobicContact CZ-CD2 4.17Å; F36-Y45 AromaticContact CZ-CE2 3.33Å; F36-Y45 HydrophobicContact CZ-CE2 3.33Å; F36-Y45 AromaticContact CZ-CZ 3.73Å; L41-Y45 HydrophobicContact CB-CD2 3.88Å; L41-Y45 HydrophobicContact CB-CE2 3.4Å; L41-Y45 HydrophobicContact CD2-CD2 4.47Å; L41-Y45 HydrophobicContact CD2-CE1 4.42Å; L41-Y45 HydrophobicContact CD2-CE2 3.54Å; L41-Y45 VanDerWaalsContact CD2-CZ 3.47Å; L41-Y45 VanDerWaalsContact CD2-OH 3.25Å; L41-Y45 WeakPolarHBondContact CD2-OH 3.4Å; L41-Y45 HydrophobicContact CG-CE2 4.02Å; L41-Y45 WeakPolarHBondContact O-CD2 3.33Å; L41-Y45 PolarHBondContact O-N 3.42Å; Y45-N47 VanDerWaalsContact C-N 3.29Å; Y45-N47 PolarHBondContact O-N 3.27Å; Y45-A48 HydrophobicContact CD1-CB 4.33Å; Y45-A48 PolarHBondContact O-N 3.16Å; Y45-I49 WeakPolarHBondContact O-CG1 3.35Å; Y45-I49 PolarHBondContact O-N 2.89Å; Y45-D105 WeakPolarHBondContact CA-OD2 3.42Å; Y45-D105 HydrophobicContact CD1-CB 4.06Å |
| 46 | A | 83.6 | Confident | 77.4 | Confident | 54 Ų | 54 | 63 Ų | 63 | 45% | 0.446 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -57.7 | -39.1 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | V50 D105 | A46-V50 WeakPolarHBondContact O-CG2 3.35Å; A46-V50 PolarHBondContact O-N 3.47Å; A46-V50 VanDerWaalsContact O-N 3.16Å; A46-D105 PolarHBondContact N-OD2 3.23Å |
| 47 | N | 89.6 | Confident | 78.7 | Confident | 34 Ų | 34 | 63.9 Ų | 63.9 | 18% | 0.182 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -73.6 | -38.3 | 177.2 | -63.2 | -49.4 | 0 | 0 | 0 | 111.6 | Y45 I49 V50 G51 H101 T104 D105 R108 | Y45-N47 VanDerWaalsContact C-N 3.29Å; Y45-N47 PolarHBondContact O-N 3.27Å; N47-I49 VanDerWaalsContact C-N 3.25Å; N47-I49 PolarHBondContact O-N 3.34Å; N47-V50 CarbonylContact O-C 3.36Å; N47-V50 WeakPolarHBondContact O-CA 3.41Å; N47-V50 WeakPolarHBondContact O-CB 3.41Å; N47-V50 PolarHBondContact O-N 3.34Å; N47-V50 VanDerWaalsContact O-N 3.09Å; N47-G51 PolarHBondContact O-N 2.86Å; N47-H101 HydrophobicContact CB-CB 4.27Å; N47-H101 WeakPolarHBondContact CB-O 3.36Å; N47-H101 WeakPolarHBondContact O-CB 3.26Å; N47-T104 WeakPolarHBondContact CB-OG1 3.48Å; N47-T104 PolarHBondContact ND2-OG1 2.86Å; N47-T104 VanDerWaalsContact ND2-OG1 3.16Å; N47-D105 VanDerWaalsContact CA-OD2 3.31Å; N47-D105 WeakPolarHBondContact CA-OD2 3.08Å; N47-D105 WeakPolarHBondContact CB-OD1 3.36Å; N47-D105 WeakPolarHBondContact CB-OD2 3.37Å; N47-D105 PolarHBondContact N-OD2 2.82Å; N47-D105 PolarHBondContact ND2-OD1 3.34Å; N47-R108 PolarHBondContact ND2-NH1 2.94Å; N47-R108 PolarHBondContact ND2-NH2 3.2Å; N47-R108 VanDerWaalsContact ND2-NH2 3.1Å |
| 48 | A | 89.9 | Confident | 79.9 | Confident | 19 Ų | 19 | 60.6 Ų | 60.6 | 16% | 0.157 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -60 | -40.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 110.6 | Y45 G51 V52 D105 | Y45-A48 HydrophobicContact CD1-CB 4.33Å; Y45-A48 PolarHBondContact O-N 3.16Å; A48-G51 PolarHBondContact O-N 3.39Å; A48-V52 WeakPolarHBondContact O-CG2 3.32Å; A48-V52 PolarHBondContact O-N 3.03Å; A48-D105 HydrophobicContact CB-CB 4.26Å; A48-D105 PolarHBondContact N-OD2 3.09Å |
| 49 | I | 90.6 | Very high | 81.5 | Confident | 95 Ų | 95 | 57.9 Ų | 57.9 | 49% | 0.487 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -60.7 | -46.1 | 173.1 | -65.4 | 166.4 | 0 | 0 | 0 | 110.8 | Y45 N47 G51 V52 A53 | Y45-I49 WeakPolarHBondContact O-CG1 3.35Å; Y45-I49 PolarHBondContact O-N 2.89Å; N47-I49 VanDerWaalsContact C-N 3.25Å; N47-I49 PolarHBondContact O-N 3.34Å; I49-G51 VanDerWaalsContact C-N 3.34Å; I49-G51 PolarHBondContact O-N 2.93Å; I49-V52 PolarHBondContact O-N 3.24Å; I49-A53 WeakPolarHBondContact O-CB 3.49Å; I49-A53 PolarHBondContact O-N 2.88Å |
| 50 | V | 92.9 | Very high | 83 | Confident | 66 Ų | 66 | 61.6 Ų | 61.6 | 40% | 0.4 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -59.8 | -43.8 | 175 | 170.4 | 0 | 0 | 0 | 0 | 111.3 | A46 N47 V52 A53 I54 | A46-V50 WeakPolarHBondContact O-CG2 3.35Å; A46-V50 PolarHBondContact O-N 3.47Å; A46-V50 VanDerWaalsContact O-N 3.16Å; N47-V50 CarbonylContact O-C 3.36Å; N47-V50 WeakPolarHBondContact O-CA 3.41Å; N47-V50 WeakPolarHBondContact O-CB 3.41Å; N47-V50 PolarHBondContact O-N 3.34Å; N47-V50 VanDerWaalsContact O-N 3.09Å; V50-V52 PolarHBondContact O-N 3.47Å; V50-A53 PolarHBondContact O-N 3.38Å; V50-I54 HydrophobicContact CG1-CD1 3.81Å; V50-I54 HydrophobicContact CG1-CG1 4.37Å; V50-I54 VanDerWaalsContact O-CG1 3.27Å; V50-I54 WeakPolarHBondContact O-CG1 3.49Å; V50-I54 PolarHBondContact O-N 3.47Å |
| 51 | G | 94.3 | Very high | 84.5 | Confident | 0 Ų | 0 | 56 Ų | 56 | 0% | 0 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -61.9 | -44.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | N47 A48 I49 I54 A55 A98 | N47-G51 PolarHBondContact O-N 2.86Å; A48-G51 PolarHBondContact O-N 3.39Å; I49-G51 VanDerWaalsContact C-N 3.34Å; I49-G51 PolarHBondContact O-N 2.93Å; G51-I54 PolarHBondContact O-N 3.38Å; G51-A55 WeakPolarHBondContact O-CB 3.32Å; G51-A55 PolarHBondContact O-N 2.96Å; G51-A98 WeakPolarHBondContact O-CB 3.47Å |
| 52 | V | 93.4 | Very high | 86.1 | Confident | 52 Ų | 52 | 55.6 Ų | 55.6 | 32% | 0.315 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -62.8 | -42.9 | 174 | 174 | 0 | 0 | 0 | 0 | 111 | A48 I49 V50 I54 A55 L56 I102 F159 | A48-V52 WeakPolarHBondContact O-CG2 3.32Å; A48-V52 PolarHBondContact O-N 3.03Å; I49-V52 PolarHBondContact O-N 3.24Å; V50-V52 PolarHBondContact O-N 3.47Å; V52-I54 PolarHBondContact O-N 2.7Å; V52-A55 PolarHBondContact O-N 3.3Å; V52-L56 HydrophobicContact CG1-CD1 4.08Å; V52-L56 HydrophobicContact CG1-CG 4.42Å; V52-L56 WeakPolarHBondContact O-CG 3.5Å; V52-L56 PolarHBondContact O-N 3Å; V52-I102 HydrophobicContact CG2-CD1 4.4Å; V52-F159 HydrophobicContact CG2-CE1 4.3Å |
| 53 | A | 94.1 | Very high | 87.7 | Confident | 55 Ų | 55 | 54.4 Ų | 54.4 | 46% | 0.455 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -61.8 | -42.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | I49 V50 L56 A57 | I49-A53 WeakPolarHBondContact O-CB 3.49Å; I49-A53 PolarHBondContact O-N 2.88Å; V50-A53 PolarHBondContact O-N 3.38Å; A53-L56 PolarHBondContact O-N 2.95Å; A53-A57 WeakPolarHBondContact O-CB 3.48Å; A53-A57 PolarHBondContact O-N 2.94Å |
| 54 | I | 94.6 | Very high | 89.1 | Confident | 34 Ų | 34 | 49.8 Ų | 49.8 | 17% | 0.174 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -61.2 | -46.7 | 174 | -67.6 | 165.4 | 0 | 0 | 0 | 110.2 | V50 G51 V52 L56 A57 V58 V94 L97 A98 | V50-I54 HydrophobicContact CG1-CD1 3.81Å; V50-I54 HydrophobicContact CG1-CG1 4.37Å; V50-I54 VanDerWaalsContact O-CG1 3.27Å; V50-I54 WeakPolarHBondContact O-CG1 3.49Å; V50-I54 PolarHBondContact O-N 3.47Å; G51-I54 PolarHBondContact O-N 3.38Å; V52-I54 PolarHBondContact O-N 2.7Å; I54-L56 VanDerWaalsContact C-N 3.31Å; I54-L56 PolarHBondContact O-N 2.83Å; I54-A57 PolarHBondContact O-N 3.37Å; I54-V58 HydrophobicContact CG2-CG2 4.41Å; I54-V58 WeakPolarHBondContact O-CG2 3.33Å; I54-V58 PolarHBondContact O-N 3Å; I54-V94 HydrophobicContact CG2-CG1 3.66Å; I54-L97 HydrophobicContact CD1-CD2 4.31Å; I54-L97 HydrophobicContact CD1-CG 4.38Å; I54-A98 HydrophobicContact CB-CB 4.12Å; I54-A98 HydrophobicContact CG2-CB 3.97Å |
| 55 | A | 93.8 | Very high | 89.9 | Confident | 1 Ų | 1 | 54 Ų | 54 | 1% | 0.008 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -60.5 | -40.4 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | G51 V52 Q59 A98 W155 V158 | G51-A55 WeakPolarHBondContact O-CB 3.32Å; G51-A55 PolarHBondContact O-N 2.96Å; V52-A55 PolarHBondContact O-N 3.3Å; A55-Q59 PolarHBondContact O-N 3.27Å; A55-A98 HydrophobicContact CB-CB 4.1Å; A55-W155 HydrophobicContact CB-CB 4.32Å; A55-V158 HydrophobicContact CB-CB 4.26Å; A55-V158 HydrophobicContact CB-CG1 4.21Å; A55-V158 HydrophobicContact CB-CG2 4.13Å |
| 56 | L | 93.4 | Very high | 90.5 | Very high | 80 Ų | 80 | 60.7 Ų | 60.7 | 42% | 0.419 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -69.4 | -40.5 | 174.9 | -68.3 | 174.7 | 0 | 0 | 0 | 112.1 | V52 A53 I54 V58 Q59 V60 W155 | V52-L56 HydrophobicContact CG1-CD1 4.08Å; V52-L56 HydrophobicContact CG1-CG 4.42Å; V52-L56 WeakPolarHBondContact O-CG 3.5Å; V52-L56 PolarHBondContact O-N 3Å; A53-L56 PolarHBondContact O-N 2.95Å; I54-L56 VanDerWaalsContact C-N 3.31Å; I54-L56 PolarHBondContact O-N 2.83Å; L56-V58 VanDerWaalsContact C-N 3.34Å; L56-V58 PolarHBondContact O-N 3.36Å; L56-Q59 WeakPolarHBondContact O-CB 3.32Å; L56-Q59 PolarHBondContact O-N 3.04Å; L56-Q59 VanDerWaalsContact O-N 3.14Å; L56-V60 WeakPolarHBondContact O-CG2 3.44Å; L56-V60 PolarHBondContact O-N 3.44Å; L56-W155 HydrophobicContact CD2-CE3 4.09Å |
| 57 | A | 92.4 | Very high | 90.6 | Very high | 60 Ų | 60 | 60 Ų | 60 | 50% | 0.496 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -62.5 | -41.6 | 176 | 0 | 0 | 0 | 0 | 0 | 111.8 | A53 I54 Q59 V60 F61 | A53-A57 WeakPolarHBondContact O-CB 3.48Å; A53-A57 PolarHBondContact O-N 2.94Å; I54-A57 PolarHBondContact O-N 3.37Å; A57-Q59 VanDerWaalsContact C-N 3.31Å; A57-Q59 PolarHBondContact O-N 3.44Å; A57-V60 PolarHBondContact O-N 2.55Å; A57-F61 WeakPolarHBondContact O-CB 3.49Å; A57-F61 PolarHBondContact O-N 3.25Å |
| 58 | V | 91.6 | Very high | 90.5 | Very high | 12 Ų | 12 | 62 Ų | 62 | 7% | 0.073 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -60.6 | -43.1 | 172.1 | 170.2 | 0 | 0 | 0 | 0 | 110.4 | I54 L56 V60 F61 L62 V94 | I54-V58 HydrophobicContact CG2-CG2 4.41Å; I54-V58 WeakPolarHBondContact O-CG2 3.33Å; I54-V58 PolarHBondContact O-N 3Å; L56-V58 VanDerWaalsContact C-N 3.34Å; L56-V58 PolarHBondContact O-N 3.36Å; V58-V60 PolarHBondContact O-N 3.37Å; V58-F61 PolarHBondContact O-N 3.38Å; V58-L62 HydrophobicContact CG1-CD1 3.53Å; V58-L62 HydrophobicContact CG1-CG 4.3Å; V58-L62 WeakPolarHBondContact O-CB 2.89Å; V58-L62 WeakPolarHBondContact O-CD1 3.48Å; V58-L62 WeakPolarHBondContact O-CG 3.31Å; V58-L62 PolarHBondContact O-N 3.28Å; V58-V94 HydrophobicContact CG2-CB 3.89Å; V58-V94 HydrophobicContact CG2-CG1 3.36Å |
| 59 | Q | 91.5 | Very high | 90.3 | Very high | 31 Ų | 31 | 68.1 Ų | 68.1 | 15% | 0.145 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -61 | -45.3 | 176.8 | 177.9 | 56.6 | 23 | 0 | 0 | 112.2 | A55 L56 A57 F61 L62 Q63 W155 | A55-Q59 PolarHBondContact O-N 3.27Å; L56-Q59 WeakPolarHBondContact O-CB 3.32Å; L56-Q59 PolarHBondContact O-N 3.04Å; L56-Q59 VanDerWaalsContact O-N 3.14Å; A57-Q59 VanDerWaalsContact C-N 3.31Å; A57-Q59 PolarHBondContact O-N 3.44Å; Q59-F61 VanDerWaalsContact C-N 3.34Å; Q59-F61 PolarHBondContact O-N 3.45Å; Q59-L62 CarbonylContact O-C 3.52Å; Q59-L62 PolarHBondContact O-N 2.96Å; Q59-Q63 WeakPolarHBondContact O-CG 3.42Å; Q59-Q63 PolarHBondContact O-N 3.49Å; Q59-Q63 VanDerWaalsContact O-N 3.17Å; Q59-W155 HydrophobicContact CB-CB 4.28Å; Q59-W155 HydrophobicContact CB-CG 3.99Å; Q59-W155 HydrophobicContact CG-CD2 4.19Å; Q59-W155 HydrophobicContact CG-CG 4.04Å; Q59-W155 VanDerWaalsContact OE1-NE1 3.12Å |
| 60 | V | 91.4 | Very high | 90.2 | Very high | 95 Ų | 95 | 69.2 Ų | 69.2 | 58% | 0.576 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -61.8 | -43.2 | 177.2 | 172.2 | 0 | 0 | 0 | 0 | 110.9 | L56 A57 V58 L62 Q63 | L56-V60 WeakPolarHBondContact O-CG2 3.44Å; L56-V60 PolarHBondContact O-N 3.44Å; A57-V60 PolarHBondContact O-N 2.55Å; V58-V60 PolarHBondContact O-N 3.37Å; V60-L62 VanDerWaalsContact C-N 3.26Å; V60-L62 PolarHBondContact O-N 2.91Å; V60-Q63 WeakPolarHBondContact O-CB 3.42Å; V60-Q63 PolarHBondContact O-N 3.24Å |
| 61 | F | 89.8 | Confident | 89.9 | Confident | 127 Ų | 127 | 66.2 Ų | 66.2 | 56% | 0.557 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -60 | -37.2 | 175.6 | 177.2 | -103.9 | 0 | 0 | 0 | 112.5 | A57 V58 Q59 Q63 V67 | A57-F61 WeakPolarHBondContact O-CB 3.49Å; A57-F61 PolarHBondContact O-N 3.25Å; V58-F61 PolarHBondContact O-N 3.38Å; Q59-F61 VanDerWaalsContact C-N 3.34Å; Q59-F61 PolarHBondContact O-N 3.45Å; F61-Q63 VanDerWaalsContact C-N 3.32Å; F61-Q63 PolarHBondContact O-N 3.05Å; F61-V67 HydrophobicContact CD1-CG1 4.47Å; F61-V67 HydrophobicContact CE1-CG1 3.89Å; F61-V67 HydrophobicContact CZ-CG1 4.22Å |
| 62 | L | 88.3 | Confident | 89.5 | Confident | 3 Ų | 3 | 70.6 Ų | 70.6 | 2% | 0.016 | 37% | 0.372 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -83.1 | -1.2 | -179.7 | -67.4 | 166 | 0 | 0 | 0 | 114.4 | V58 Q59 V60 G64 V67 Q68 L71 V91 I152 | V58-L62 HydrophobicContact CG1-CD1 3.53Å; V58-L62 HydrophobicContact CG1-CG 4.3Å; V58-L62 WeakPolarHBondContact O-CB 2.89Å; V58-L62 WeakPolarHBondContact O-CD1 3.48Å; V58-L62 WeakPolarHBondContact O-CG 3.31Å; V58-L62 PolarHBondContact O-N 3.28Å; Q59-L62 CarbonylContact O-C 3.52Å; Q59-L62 PolarHBondContact O-N 2.96Å; V60-L62 VanDerWaalsContact C-N 3.26Å; V60-L62 PolarHBondContact O-N 2.91Å; L62-G64 PolarHBondContact O-N 3.31Å; L62-V67 HydrophobicContact CD2-CG1 4.3Å; L62-Q68 VanDerWaalsContact O-CG 3.22Å; L62-Q68 WeakPolarHBondContact O-CG 3.38Å; L62-Q68 PolarHBondContact O-NE2 3.32Å; L62-L71 HydrophobicContact CD2-CD1 3.46Å; L62-L71 VanDerWaalsContact CD2-CD1 3.46Å; L62-V91 HydrophobicContact CD2-CG1 4.33Å; L62-I152 HydrophobicContact CD1-CG2 3.27Å; L62-I152 HydrophobicContact CD2-CG2 3.65Å; L62-I152 HydrophobicContact CG-CG2 4.09Å |
| 63 | Q | 87.2 | Confident | 89.2 | Confident | 126 Ų | 126 | 71.6 Ų | 71.6 | 59% | 0.589 | 37% | 0.373 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.1 | -16.6 | 176.6 | -80.1 | 177.7 | -32.8 | 0 | 0 | 113 | Q59 V60 F61 D65 | Q59-Q63 WeakPolarHBondContact O-CG 3.42Å; Q59-Q63 PolarHBondContact O-N 3.49Å; Q59-Q63 VanDerWaalsContact O-N 3.17Å; V60-Q63 WeakPolarHBondContact O-CB 3.42Å; V60-Q63 PolarHBondContact O-N 3.24Å; F61-Q63 VanDerWaalsContact C-N 3.32Å; F61-Q63 PolarHBondContact O-N 3.05Å; Q63-D65 PolarHBondContact O-N 2.88Å |
| 64 | G | 86.1 | Confident | 88.8 | Confident | 32 Ų | 32 | 74.7 Ų | 74.7 | 33% | 0.33 | 38% | 0.378 | S | S | . | . | trans | -72.1 | 120.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | L62 E66 V67 Q68 | L62-G64 PolarHBondContact O-N 3.31Å; G64-E66 VanDerWaalsContact C-N 3.25Å; G64-E66 PolarHBondContact O-N 3.46Å; G64-V67 WeakPolarHBondContact O-CB 3.39Å; G64-V67 PolarHBondContact O-N 3.15Å; G64-Q68 PolarHBondContact O-N 3.25Å; G64-Q68 VanDerWaalsContact O-N 3.09Å | ||
| 65 | D | 84 | Confident | 88.2 | Confident | 132 Ų | 132 | 78.6 Ų | 78.6 | 71% | 0.706 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -55.8 | -40.5 | 177.9 | -67.2 | -30.7 | 0 | 0 | 0 | 111.8 | Q63 V67 Q68 E69 | Q63-D65 PolarHBondContact O-N 2.88Å; D65-V67 VanDerWaalsContact C-N 3.3Å; D65-V67 PolarHBondContact O-N 3.43Å; D65-Q68 PolarHBondContact O-N 2.96Å; D65-E69 WeakPolarHBondContact O-CB 3.46Å; D65-E69 PolarHBondContact O-N 2.48Å |
| 66 | E | 88 | Confident | 87.7 | Confident | 166 Ų | 166 | 89.3 Ų | 89.3 | 78% | 0.776 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -61.1 | -37.5 | 176.7 | -63.1 | -177.2 | 177.1 | 0 | 0 | 112.6 | G64 Y70 | G64-E66 VanDerWaalsContact C-N 3.25Å; G64-E66 PolarHBondContact O-N 3.46Å; E66-Y70 WeakPolarHBondContact O-CB 3.42Å; E66-Y70 PolarHBondContact O-N 2.92Å |
| 67 | V | 86.4 | Confident | 87.3 | Confident | 41 Ų | 41 | 93 Ų | 93 | 25% | 0.248 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -70.1 | -41.1 | 178.3 | -179.7 | 0 | 0 | 0 | 0 | 109.8 | F61 L62 G64 D65 L71 | F61-V67 HydrophobicContact CD1-CG1 4.47Å; F61-V67 HydrophobicContact CE1-CG1 3.89Å; F61-V67 HydrophobicContact CZ-CG1 4.22Å; L62-V67 HydrophobicContact CD2-CG1 4.3Å; G64-V67 WeakPolarHBondContact O-CB 3.39Å; G64-V67 PolarHBondContact O-N 3.15Å; D65-V67 VanDerWaalsContact C-N 3.3Å; D65-V67 PolarHBondContact O-N 3.43Å; V67-L71 HydrophobicContact CG1-CD1 3.93Å; V67-L71 HydrophobicContact CG1-CG 4.46Å; V67-L71 WeakPolarHBondContact O-CB 3.35Å; V67-L71 WeakPolarHBondContact O-CG 3.43Å; V67-L71 PolarHBondContact O-N 3.35Å |
| 68 | Q | 86.8 | Confident | 87 | Confident | 74 Ų | 74 | 91.5 Ų | 91.5 | 35% | 0.346 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -66.9 | -45.6 | 176.9 | -65.9 | -164.6 | -8.3 | 0 | 0 | 111.8 | L62 G64 D65 Y70 L71 F72 | L62-Q68 VanDerWaalsContact O-CG 3.22Å; L62-Q68 WeakPolarHBondContact O-CG 3.38Å; L62-Q68 PolarHBondContact O-NE2 3.32Å; G64-Q68 PolarHBondContact O-N 3.25Å; G64-Q68 VanDerWaalsContact O-N 3.09Å; D65-Q68 PolarHBondContact O-N 2.96Å; Q68-Y70 VanDerWaalsContact C-N 3.34Å; Q68-Y70 PolarHBondContact O-N 3.31Å; Q68-L71 PolarHBondContact O-N 3.48Å; Q68-F72 HydrophobicContact CB-CD2 4.29Å; Q68-F72 WeakPolarHBondContact O-CB 3.34Å; Q68-F72 VanDerWaalsContact O-CD2 3.25Å; Q68-F72 WeakPolarHBondContact O-CD2 3.46Å; Q68-F72 PolarHBondContact O-N 3.11Å |
| 69 | E | 86.8 | Confident | 86.7 | Confident | 149 Ų | 149 | 97.9 Ų | 97.9 | 70% | 0.696 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -61.4 | -44.7 | 177.1 | -173.7 | 175.6 | -174.5 | 0 | 0 | 110.8 | D65 L71 F72 Q73 | D65-E69 WeakPolarHBondContact O-CB 3.46Å; D65-E69 PolarHBondContact O-N 2.48Å; E69-L71 PolarHBondContact O-N 3.46Å; E69-F72 PolarHBondContact O-N 3.44Å; E69-Q73 PolarHBondContact O-N 3.49Å |
| 70 | Y | 87 | Confident | 86.4 | Confident | 117 Ų | 117 | 104.4 Ų | 104.4 | 46% | 0.459 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -57.7 | -49.7 | 172.3 | -179.9 | -105.2 | 0 | 0 | 0 | 110.7 | E66 Q68 F72 R87 | E66-Y70 WeakPolarHBondContact O-CB 3.42Å; E66-Y70 PolarHBondContact O-N 2.92Å; Q68-Y70 VanDerWaalsContact C-N 3.34Å; Q68-Y70 PolarHBondContact O-N 3.31Å; Y70-F72 PolarHBondContact O-N 3.25Å; Y70-R87 VanDerWaalsContact CE1-CD 3.46Å; Y70-R87 PolarHBondContact O-NE 2.86Å; Y70-R87 PolarHBondContact O-NH1 3.12Å; Y70-R87 PolarHBondContact O-NH2 2.99Å |
| 71 | L | 87.5 | Confident | 86.2 | Confident | 4 Ų | 4 | 101.2 Ų | 101.2 | 2% | 0.021 | 48% | 0.481 | C | S | . | . | H | α-helix | trans | -65.2 | -42.1 | -177.9 | -72.6 | 169.7 | 0 | 0 | 0 | 113 | L62 V67 Q68 E69 R78 R87 V91 I152 | L62-L71 HydrophobicContact CD2-CD1 3.46Å; L62-L71 VanDerWaalsContact CD2-CD1 3.46Å; V67-L71 HydrophobicContact CG1-CD1 3.93Å; V67-L71 HydrophobicContact CG1-CG 4.46Å; V67-L71 WeakPolarHBondContact O-CB 3.35Å; V67-L71 WeakPolarHBondContact O-CG 3.43Å; V67-L71 PolarHBondContact O-N 3.35Å; Q68-L71 PolarHBondContact O-N 3.48Å; E69-L71 PolarHBondContact O-N 3.46Å; L71-R78 PolarHBondContact O-NH2 3.38Å; L71-R87 HydrophobicContact CD2-CB 4.29Å; L71-R87 HydrophobicContact CD2-CG 4.13Å; L71-V91 HydrophobicContact CD1-CG1 4.38Å; L71-V91 HydrophobicContact CD1-CG2 4.28Å; L71-V91 HydrophobicContact CD2-CB 4.39Å; L71-V91 HydrophobicContact CD2-CG2 3.72Å; L71-I152 HydrophobicContact CB-CD1 4.27Å; L71-I152 HydrophobicContact CD1-CD1 4.11Å |
| 72 | F | 86 | Confident | 86.2 | Confident | 91 Ų | 91 | 101.3 Ų | 101.3 | 40% | 0.399 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -89.8 | -1.4 | -173.7 | -71.1 | -60.8 | 0 | 0 | 0 | 115.4 | Q68 E69 Y70 E74 I152 | Q68-F72 HydrophobicContact CB-CD2 4.29Å; Q68-F72 WeakPolarHBondContact O-CB 3.34Å; Q68-F72 VanDerWaalsContact O-CD2 3.25Å; Q68-F72 WeakPolarHBondContact O-CD2 3.46Å; Q68-F72 PolarHBondContact O-N 3.11Å; E69-F72 PolarHBondContact O-N 3.44Å; Y70-F72 PolarHBondContact O-N 3.25Å; F72-E74 PolarHBondContact O-N 3.45Å; F72-I152 HydrophobicContact CD1-CD1 4.41Å; F72-I152 HydrophobicContact CD2-CD1 4.15Å; F72-I152 HydrophobicContact CE1-CD1 3.67Å; F72-I152 HydrophobicContact CE1-CG1 4.12Å; F72-I152 HydrophobicContact CE2-CD1 3.36Å; F72-I152 HydrophobicContact CZ-CD1 3.1Å; F72-I152 HydrophobicContact CZ-CG1 3.91Å |
| 73 | Q | 87.4 | Confident | 86.2 | Confident | 74 Ų | 74 | 108.5 Ų | 108.5 | 35% | 0.346 | 52% | 0.518 | S | S | . | . | trans | -51.1 | 136.3 | 173.8 | -146.4 | -168.6 | -0.3 | 0 | 0 | 111.2 | E69 Y77 R78 | E69-Q73 PolarHBondContact O-N 3.49Å; Q73-Y77 PolarHBondContact NE2-O 3.38Å; Q73-Y77 VanDerWaalsContact NE2-O 3.16Å; Q73-R78 PolarHBondContact O-NE 2.86Å; Q73-R78 PolarHBondContact O-NH2 2.94Å | ||
| 74 | E | 85.1 | Confident | 86.2 | Confident | 120 Ų | 120 | 102.8 Ų | 102.8 | 56% | 0.561 | 49% | 0.492 | S | S | * | . | trans | -61.4 | 148.3 | 179.8 | -56.3 | -177 | 167.4 | 0 | 0 | 112 | F72 R76 Y77 | F72-E74 PolarHBondContact O-N 3.45Å; E74-R76 PolarHBondContact O-N 2.97Å; E74-Y77 HydrophobicContact CB-CD2 3.98Å; E74-Y77 HydrophobicContact CB-CE2 4.4Å; E74-Y77 PolarHBondContact O-N 3.27Å | ||
| 75 | L | 81.9 | Confident | 86.3 | Confident | 116 Ų | 116 | 104.6 Ų | 104.6 | 61% | 0.607 | 49% | 0.494 | S | S | * | . | G | 310 helix | trans | -53.5 | -32.5 | -177 | -166.4 | 71 | 0 | 0 | 0 | 113.2 | Y77 R78 L85 | L75-Y77 VanDerWaalsContact C-N 3.26Å; L75-Y77 PolarHBondContact O-N 3.44Å; L75-R78 PolarHBondContact O-N 2.95Å; L75-L85 HydrophobicContact CD1-CD2 3.77Å |
| 76 | R | 82.5 | Confident | 86.6 | Confident | 225 Ų | 225 | 102.4 Ų | 102.4 | 85% | 0.849 | 48% | 0.482 | S | S | * | . | G | 310 helix | trans | -66.4 | -25.8 | -179.1 | -64.9 | -177.1 | -177.1 | -175.3 | 2.3 | 113.8 | E74 | E74-R76 PolarHBondContact O-N 2.97Š|
| 77 | Y | 85 | Confident | 86.7 | Confident | 159 Ų | 159 | 95.1 Ų | 95.1 | 62% | 0.624 | 45% | 0.447 | S | S | * | . | G | 310 helix | trans | -101.2 | 1.9 | -179.2 | -57.2 | -70.3 | 0 | 0 | 0 | 112.6 | Q73 E74 L75 | Q73-Y77 PolarHBondContact NE2-O 3.38Å; Q73-Y77 VanDerWaalsContact NE2-O 3.16Å; E74-Y77 HydrophobicContact CB-CD2 3.98Å; E74-Y77 HydrophobicContact CB-CE2 4.4Å; E74-Y77 PolarHBondContact O-N 3.27Å; L75-Y77 VanDerWaalsContact C-N 3.26Å; L75-Y77 PolarHBondContact O-N 3.44Å |
| 78 | R | 86.3 | Confident | 86.8 | Confident | 27 Ų | 27 | 94.6 Ų | 94.6 | 10% | 0.102 | 44% | 0.443 | C | S | . | . | S | Bend | trans | -77.4 | 143 | 178.2 | -63.6 | -166 | -170.1 | 176.8 | -3.3 | 110.5 | L71 Q73 L75 S84 L85 E88 | L71-R78 PolarHBondContact O-NH2 3.38Å; Q73-R78 PolarHBondContact O-NE 2.86Å; Q73-R78 PolarHBondContact O-NH2 2.94Å; L75-R78 PolarHBondContact O-N 2.95Å; R78-S84 WeakPolarHBondContact CD-O 3.36Å; R78-L85 HydrophobicContact CB-CD2 4.28Å; R78-L85 PolarHBondContact NH1-O 3.42Å; R78-E88 IonicContact CZ-OE1 3.61Å; R78-E88 IonicContact NH1-OE1 3.7Å; R78-E88 IonicContact NH2-OE1 2.67Å; R78-E88 PolarHBondContact NH2-OE1 3.25Å |
| 79 | E | 85 | Confident | 86.9 | Confident | 147 Ų | 147 | 92.8 Ų | 92.8 | 69% | 0.687 | 44% | 0.444 | S | S | * | . | trans | -61.3 | 146.5 | 169.8 | -62 | 175.4 | 177.5 | 0 | 0 | 110.6 | G81 S84 | E79-G81 PolarHBondContact O-N 2.98Å; E79-S84 PolarHBondContact N-OG 3.03Å; E79-S84 WeakPolarHBondContact O-CB 3.32Å; E79-S84 PolarHBondContact O-OG 3.22Å; E79-S84 VanDerWaalsContact O-OG 3.04Å | ||
| 80 | N | 85.9 | Confident | 87.1 | Confident | 168 Ų | 168 | 89.8 Ų | 89.8 | 90% | 0.898 | 43% | 0.432 | S | S | * | . | S | Bend | trans | -73.2 | 40.5 | 179.8 | -70.5 | -34.5 | 0 | 0 | 0 | 113.5 | ||
| 81 | G | 87.8 | Confident | 87.2 | Confident | 28 Ų | 28 | 85.6 Ų | 85.6 | 29% | 0.289 | 42% | 0.418 | S | S | . | . | trans | -104.4 | 141.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | E79 F83 S84 L85 | E79-G81 PolarHBondContact O-N 2.98Å; G81-F83 PolarHBondContact O-N 3.37Å; G81-S84 PolarHBondContact O-N 2.95Å; G81-S84 VanDerWaalsContact O-N 3.12Å; G81-L85 WeakPolarHBondContact O-CG 3.49Å; G81-L85 PolarHBondContact O-N 2.8Å | ||
| 82 | L | 88.6 | Confident | 87.5 | Confident | 129 Ų | 129 | 86.3 Ų | 86.3 | 68% | 0.675 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -55.9 | -38.2 | 177.8 | -172.6 | 125.9 | 0 | 0 | 0 | 112.3 | N86 | L82-N86 WeakPolarHBondContact O-CB 3.36Å; L82-N86 PolarHBondContact O-N 3.33Å; L82-N86 PolarHBondContact O-ND2 3.45Å |
| 83 | F | 88.4 | Confident | 87.8 | Confident | 154 Ų | 154 | 86.4 Ų | 86.4 | 68% | 0.675 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -69.6 | -45.6 | 175.9 | -65.6 | -77.6 | 0 | 0 | 0 | 112.5 | G81 L85 N86 R87 I90 | G81-F83 PolarHBondContact O-N 3.37Å; F83-L85 VanDerWaalsContact C-N 3.29Å; F83-L85 PolarHBondContact O-N 2.94Å; F83-N86 CarbonylContact O-C 3.59Å; F83-N86 PolarHBondContact O-N 3.31Å; F83-R87 WeakPolarHBondContact O-CA 3.43Å; F83-R87 WeakPolarHBondContact O-CB 3.48Å; F83-R87 PolarHBondContact O-N 3.37Å; F83-I90 HydrophobicContact CD1-CD1 3.77Å |
| 84 | S | 88.1 | Confident | 88.1 | Confident | 6 Ų | 6 | 85.9 Ų | 85.9 | 4% | 0.042 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -58.2 | -42.1 | 177.3 | 172.1 | 0 | 0 | 0 | 0 | 111.5 | R78 E79 G81 N86 R87 | R78-S84 WeakPolarHBondContact CD-O 3.36Å; E79-S84 PolarHBondContact N-OG 3.03Å; E79-S84 WeakPolarHBondContact O-CB 3.32Å; E79-S84 PolarHBondContact O-OG 3.22Å; E79-S84 VanDerWaalsContact O-OG 3.04Å; G81-S84 PolarHBondContact O-N 2.95Å; G81-S84 VanDerWaalsContact O-N 3.12Å; S84-N86 PolarHBondContact O-N 2.88Å; S84-R87 WeakPolarHBondContact O-CD 3.22Å; S84-R87 WeakPolarHBondContact O-CG 3.42Å |
| 85 | L | 88.5 | Confident | 88.5 | Confident | 69 Ų | 69 | 80.2 Ų | 80.2 | 36% | 0.361 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -69.6 | -33.3 | 178.8 | -65.7 | 173.2 | 0 | 0 | 0 | 112.9 | L75 R78 G81 F83 | L75-L85 HydrophobicContact CD1-CD2 3.77Å; R78-L85 HydrophobicContact CB-CD2 4.28Å; R78-L85 PolarHBondContact NH1-O 3.42Å; G81-L85 WeakPolarHBondContact O-CG 3.49Å; G81-L85 PolarHBondContact O-N 2.8Å; F83-L85 VanDerWaalsContact C-N 3.29Å; F83-L85 PolarHBondContact O-N 2.94Å |
| 86 | N | 88.9 | Confident | 89 | Confident | 87 Ų | 87 | 77.7 Ų | 77.7 | 47% | 0.465 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -105.4 | 10.2 | -175.7 | -65.5 | -64.9 | 0 | 0 | 0 | 114.6 | L82 F83 S84 E88 G89 I90 | L82-N86 WeakPolarHBondContact O-CB 3.36Å; L82-N86 PolarHBondContact O-N 3.33Å; L82-N86 PolarHBondContact O-ND2 3.45Å; F83-N86 CarbonylContact O-C 3.59Å; F83-N86 PolarHBondContact O-N 3.31Å; S84-N86 PolarHBondContact O-N 2.88Å; N86-E88 VanDerWaalsContact C-N 3.31Å; N86-E88 PolarHBondContact O-N 3.47Å; N86-G89 WeakPolarHBondContact O-CA 3.27Å; N86-G89 PolarHBondContact O-N 3.02Å; N86-I90 WeakPolarHBondContact O-CG1 3.47Å; N86-I90 PolarHBondContact O-N 3.37Å |
| 87 | R | 89.8 | Confident | 89.6 | Confident | 12 Ų | 12 | 70.8 Ų | 70.8 | 5% | 0.045 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -56.7 | -39 | -174 | 63.8 | -172.9 | 175 | -157.1 | -0.8 | 114.4 | Y70 L71 F83 S84 G89 I90 V91 | Y70-R87 VanDerWaalsContact CE1-CD 3.46Å; Y70-R87 PolarHBondContact O-NE 2.86Å; Y70-R87 PolarHBondContact O-NH1 3.12Å; Y70-R87 PolarHBondContact O-NH2 2.99Å; L71-R87 HydrophobicContact CD2-CB 4.29Å; L71-R87 HydrophobicContact CD2-CG 4.13Å; F83-R87 WeakPolarHBondContact O-CA 3.43Å; F83-R87 WeakPolarHBondContact O-CB 3.48Å; F83-R87 PolarHBondContact O-N 3.37Å; S84-R87 WeakPolarHBondContact O-CD 3.22Å; S84-R87 WeakPolarHBondContact O-CG 3.42Å; R87-G89 VanDerWaalsContact C-N 3.33Å; R87-G89 PolarHBondContact O-N 3.31Å; R87-I90 PolarHBondContact O-N 3.48Å; R87-V91 PolarHBondContact O-N 3.16Å |
| 88 | E | 89.5 | Confident | 90.1 | Very high | 31 Ų | 31 | 63.2 Ų | 63.2 | 15% | 0.145 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -58.6 | -47.7 | 174.1 | -68.6 | -179.2 | -158.1 | 0 | 0 | 110.8 | R78 N86 I90 V91 S92 R151 | R78-E88 IonicContact CZ-OE1 3.61Å; R78-E88 IonicContact NH1-OE1 3.7Å; R78-E88 IonicContact NH2-OE1 2.67Å; R78-E88 PolarHBondContact NH2-OE1 3.25Å; N86-E88 VanDerWaalsContact C-N 3.31Å; N86-E88 PolarHBondContact O-N 3.47Å; E88-I90 PolarHBondContact O-N 2.95Å; E88-V91 PolarHBondContact O-N 3.35Å; E88-S92 WeakPolarHBondContact O-CB 3.4Å; E88-S92 PolarHBondContact O-N 3.01Å; E88-S92 PolarHBondContact O-OG 3.18Å; E88-R151 CarbonylContact C-O 3.41Å; E88-R151 WeakPolarHBondContact OE2-CB 3.41Å; E88-R151 WeakPolarHBondContact OE2-CD 3.38Å; E88-R151 WeakPolarHBondContact OE2-CG 3.31Å |
| 89 | G | 89.2 | Confident | 90.5 | Very high | 36 Ų | 36 | 63.6 Ų | 63.6 | 37% | 0.371 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -57.9 | -48.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | N86 R87 V91 S92 V93 | N86-G89 WeakPolarHBondContact O-CA 3.27Å; N86-G89 PolarHBondContact O-N 3.02Å; R87-G89 VanDerWaalsContact C-N 3.33Å; R87-G89 PolarHBondContact O-N 3.31Å; G89-V91 PolarHBondContact O-N 3.3Å; G89-S92 WeakPolarHBondContact CA-OG 3.41Å; G89-S92 PolarHBondContact O-N 2.76Å; G89-S92 PolarHBondContact O-OG 3.25Å; G89-V93 WeakPolarHBondContact O-CG2 3.45Å; G89-V93 PolarHBondContact O-N 3.5Å; G89-V93 VanDerWaalsContact O-N 3.14Å |
| 90 | I | 89.8 | Confident | 90.9 | Very high | 86 Ų | 86 | 62.5 Ų | 62.5 | 44% | 0.441 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -59.7 | -46.7 | -179.6 | -64 | 168.5 | 0 | 0 | 0 | 111.4 | F83 N86 R87 E88 S92 V93 | F83-I90 HydrophobicContact CD1-CD1 3.77Å; N86-I90 WeakPolarHBondContact O-CG1 3.47Å; N86-I90 PolarHBondContact O-N 3.37Å; R87-I90 PolarHBondContact O-N 3.48Å; E88-I90 PolarHBondContact O-N 2.95Å; I90-S92 VanDerWaalsContact C-N 3.33Å; I90-S92 PolarHBondContact O-N 3.04Å; I90-V93 WeakPolarHBondContact O-CB 3.34Å; I90-V93 PolarHBondContact O-N 3.5Å |
| 91 | V | 90.5 | Very high | 91.3 | Very high | 28 Ų | 28 | 56.3 Ų | 56.3 | 17% | 0.17 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -64.9 | -39.9 | 177.7 | 174.4 | 0 | 0 | 0 | 0 | 111 | L62 L71 R87 E88 G89 V93 V94 I152 | L62-V91 HydrophobicContact CD2-CG1 4.33Å; L71-V91 HydrophobicContact CD1-CG1 4.38Å; L71-V91 HydrophobicContact CD1-CG2 4.28Å; L71-V91 HydrophobicContact CD2-CB 4.39Å; L71-V91 HydrophobicContact CD2-CG2 3.72Å; R87-V91 PolarHBondContact O-N 3.16Å; E88-V91 PolarHBondContact O-N 3.35Å; G89-V91 PolarHBondContact O-N 3.3Å; V91-V93 PolarHBondContact O-N 3.18Å; V91-V94 PolarHBondContact O-N 3.09Å; V91-V94 VanDerWaalsContact O-N 3.17Å; V91-I152 HydrophobicContact CG1-CG2 3.89Å |
| 92 | S | 92.7 | Very high | 91.6 | Very high | 20 Ų | 20 | 55.7 Ų | 55.7 | 14% | 0.14 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -64.7 | -23.3 | 179.7 | 74.1 | 0 | 0 | 0 | 0 | 114.2 | E88 G89 I90 V94 G95 C96 I152 | E88-S92 WeakPolarHBondContact O-CB 3.4Å; E88-S92 PolarHBondContact O-N 3.01Å; E88-S92 PolarHBondContact O-OG 3.18Å; G89-S92 WeakPolarHBondContact CA-OG 3.41Å; G89-S92 PolarHBondContact O-N 2.76Å; G89-S92 PolarHBondContact O-OG 3.25Å; I90-S92 VanDerWaalsContact C-N 3.33Å; I90-S92 PolarHBondContact O-N 3.04Å; S92-V94 PolarHBondContact O-N 3.37Å; S92-G95 PolarHBondContact O-N 3.13Å; S92-G95 VanDerWaalsContact O-N 3.12Å; S92-C96 PolarHBondContact O-N 3.26Å; S92-C96 PolarHBondContact O-SG 3.18Å; S92-C96 VanDerWaalsContact O-SG 3.35Å; S92-I152 WeakPolarHBondContact CA-O 3.32Å |
| 93 | V | 92.9 | Very high | 91.8 | Very high | 92 Ų | 92 | 52 Ų | 52 | 56% | 0.558 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -56.8 | -37.5 | 174.3 | 171.3 | 0 | 0 | 0 | 0 | 111.2 | G89 I90 V91 C96 L97 | G89-V93 WeakPolarHBondContact O-CG2 3.45Å; G89-V93 PolarHBondContact O-N 3.5Å; G89-V93 VanDerWaalsContact O-N 3.14Å; I90-V93 WeakPolarHBondContact O-CB 3.34Å; I90-V93 PolarHBondContact O-N 3.5Å; V91-V93 PolarHBondContact O-N 3.18Å; V93-C96 WeakPolarHBondContact O-CB 3.44Å; V93-C96 PolarHBondContact O-N 3.17Å; V93-L97 PolarHBondContact O-N 2.94Å |
| 94 | V | 93.2 | Very high | 91.9 | Very high | 64 Ų | 64 | 46.4 Ų | 46.4 | 39% | 0.388 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -68.9 | -39.9 | 179 | -171.6 | 0 | 0 | 0 | 0 | 110.9 | I54 V58 V91 S92 L97 A98 | I54-V94 HydrophobicContact CG2-CG1 3.66Å; V58-V94 HydrophobicContact CG2-CB 3.89Å; V58-V94 HydrophobicContact CG2-CG1 3.36Å; V91-V94 PolarHBondContact O-N 3.09Å; V91-V94 VanDerWaalsContact O-N 3.17Å; S92-V94 PolarHBondContact O-N 3.37Å; V94-L97 WeakPolarHBondContact O-CB 3.15Å; V94-L97 PolarHBondContact O-N 3.18Å; V94-A98 PolarHBondContact O-N 3.41Å; V94-A98 VanDerWaalsContact O-N 3.13Å |
| 95 | G | 93.2 | Very high | 91.9 | Very high | 0 Ų | 0 | 46.2 Ų | 46.2 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -63.6 | -40 | 171.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | S92 L97 A98 I99 A153 | S92-G95 PolarHBondContact O-N 3.13Å; S92-G95 VanDerWaalsContact O-N 3.12Å; G95-L97 VanDerWaalsContact C-N 3.3Å; G95-L97 PolarHBondContact O-N 3.23Å; G95-A98 WeakPolarHBondContact O-CB 3.32Å; G95-A98 PolarHBondContact O-N 2.67Å; G95-I99 WeakPolarHBondContact O-CG1 3.41Å; G95-I99 PolarHBondContact O-N 3.12Å; G95-I99 VanDerWaalsContact O-N 3.1Å; G95-A153 WeakPolarHBondContact CA-O 3.33Å |
| 96 | C | 93.6 | Very high | 91.8 | Very high | 63 Ų | 63 | 43.5 Ų | 43.5 | 43% | 0.426 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -64 | -35 | 173.7 | -69.7 | 0 | 0 | 0 | 0 | 112.3 | S92 V93 A98 I99 F100 | S92-C96 PolarHBondContact O-N 3.26Å; S92-C96 PolarHBondContact O-SG 3.18Å; S92-C96 VanDerWaalsContact O-SG 3.35Å; V93-C96 WeakPolarHBondContact O-CB 3.44Å; V93-C96 PolarHBondContact O-N 3.17Å; C96-A98 VanDerWaalsContact C-N 3.33Å; C96-I99 WeakPolarHBondContact O-CB 3.36Å; C96-I99 PolarHBondContact O-N 3.27Å; C96-F100 PolarHBondContact O-N 3.38Å |
| 97 | L | 94.5 | Very high | 91.6 | Very high | 80 Ų | 80 | 41.2 Ų | 41.2 | 42% | 0.419 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -64.1 | -38.5 | 173.5 | -176.4 | 65.1 | 0 | 0 | 0 | 111.5 | I54 V93 V94 G95 F100 H101 | I54-L97 HydrophobicContact CD1-CD2 4.31Å; I54-L97 HydrophobicContact CD1-CG 4.38Å; V93-L97 PolarHBondContact O-N 2.94Å; V94-L97 WeakPolarHBondContact O-CB 3.15Å; V94-L97 PolarHBondContact O-N 3.18Å; G95-L97 VanDerWaalsContact C-N 3.3Å; G95-L97 PolarHBondContact O-N 3.23Å; L97-F100 HydrophobicContact CD1-CD1 4.36Å; L97-F100 WeakPolarHBondContact O-CB 3.49Å; L97-F100 PolarHBondContact O-N 3.2Å; L97-H101 PolarHBondContact O-CD2 3.25Å; L97-H101 VanDerWaalsContact O-CD2 3.28Å; L97-H101 PolarHBondContact O-N 2.85Å |
| 98 | A | 95.5 | Very high | 91.3 | Very high | 0 Ų | 0 | 46.9 Ų | 46.9 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -60.9 | -45.4 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112 | G51 I54 A55 V94 G95 C96 F100 H101 I102 V158 | G51-A98 WeakPolarHBondContact O-CB 3.47Å; I54-A98 HydrophobicContact CB-CB 4.12Å; I54-A98 HydrophobicContact CG2-CB 3.97Å; A55-A98 HydrophobicContact CB-CB 4.1Å; V94-A98 PolarHBondContact O-N 3.41Å; V94-A98 VanDerWaalsContact O-N 3.13Å; G95-A98 WeakPolarHBondContact O-CB 3.32Å; G95-A98 PolarHBondContact O-N 2.67Å; C96-A98 VanDerWaalsContact C-N 3.33Å; A98-F100 VanDerWaalsContact C-N 3.32Å; A98-F100 PolarHBondContact O-N 3.44Å; A98-H101 PolarHBondContact O-N 3.1Å; A98-I102 WeakPolarHBondContact O-CG1 3.27Å; A98-I102 PolarHBondContact O-N 2.61Å; A98-I102 VanDerWaalsContact O-N 3.11Å; A98-V158 HydrophobicContact CB-CG1 4.16Å; A98-V158 HydrophobicContact CB-CG2 4.21Å |
| 99 | I | 94.8 | Very high | 90.8 | Very high | 36 Ų | 36 | 45.6 Ų | 45.6 | 19% | 0.185 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -59.1 | -45.5 | 175.5 | -64.1 | 167.4 | 0 | 0 | 0 | 110.3 | G95 C96 H101 I102 A103 Y157 V158 I161 | G95-I99 WeakPolarHBondContact O-CG1 3.41Å; G95-I99 PolarHBondContact O-N 3.12Å; G95-I99 VanDerWaalsContact O-N 3.1Å; C96-I99 WeakPolarHBondContact O-CB 3.36Å; C96-I99 PolarHBondContact O-N 3.27Å; I99-H101 PolarHBondContact O-N 3.1Å; I99-I102 PolarHBondContact O-N 3.3Å; I99-A103 WeakPolarHBondContact O-CB 3.43Å; I99-A103 PolarHBondContact O-N 3.29Å; I99-Y157 HydrophobicContact CD1-CD1 4.2Å; I99-Y157 HydrophobicContact CD1-CE1 3.91Å; I99-V158 HydrophobicContact CG1-CB 4.28Å; I99-V158 HydrophobicContact CG1-CG1 3.96Å; I99-V158 HydrophobicContact CG1-CG2 4.13Å; I99-I161 HydrophobicContact CD1-CB 4.11Å; I99-I161 HydrophobicContact CD1-CG1 4.24Å; I99-I161 HydrophobicContact CD1-CG2 4.05Å; I99-I161 HydrophobicContact CG1-CG2 4.46Å; I99-I161 HydrophobicContact CG2-CG2 3.94Å |
| 100 | F | 94.3 | Very high | 90.4 | Very high | 123 Ų | 123 | 46.9 Ų | 46.9 | 54% | 0.539 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -57 | -50.2 | 177.7 | 172.1 | -99.8 | 0 | 0 | 0 | 111.7 | C96 L97 A98 I102 A103 T104 | C96-F100 PolarHBondContact O-N 3.38Å; L97-F100 HydrophobicContact CD1-CD1 4.36Å; L97-F100 WeakPolarHBondContact O-CB 3.49Å; L97-F100 PolarHBondContact O-N 3.2Å; A98-F100 VanDerWaalsContact C-N 3.32Å; A98-F100 PolarHBondContact O-N 3.44Å; F100-I102 PolarHBondContact O-N 3.27Å; F100-A103 WeakPolarHBondContact O-CB 3.08Å; F100-A103 PolarHBondContact O-N 2.9Å; F100-A103 VanDerWaalsContact O-N 3.12Å; F100-T104 HydrophobicContact CD1-CG2 4.21Å; F100-T104 HydrophobicContact CD2-CG2 4.36Å; F100-T104 HydrophobicContact CE1-CG2 3.76Å; F100-T104 HydrophobicContact CE2-CG2 3.93Å; F100-T104 HydrophobicContact CG-CG2 4.5Å; F100-T104 HydrophobicContact CZ-CG2 3.61Å; F100-T104 WeakPolarHBondContact O-CG2 3.39Å; F100-T104 PolarHBondContact O-N 3.09Å |
| 101 | H | 93.5 | Very high | 89.8 | Confident | 39 Ų | 39 | 48.5 Ų | 48.5 | 18% | 0.181 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -60.5 | -43.2 | 179.9 | -85.4 | -67.6 | 0 | 0 | 0 | 112.8 | N47 L97 A98 I99 A103 T104 | N47-H101 HydrophobicContact CB-CB 4.27Å; N47-H101 WeakPolarHBondContact CB-O 3.36Å; N47-H101 WeakPolarHBondContact O-CB 3.26Å; L97-H101 PolarHBondContact O-CD2 3.25Å; L97-H101 VanDerWaalsContact O-CD2 3.28Å; L97-H101 PolarHBondContact O-N 2.85Å; A98-H101 PolarHBondContact O-N 3.1Å; I99-H101 PolarHBondContact O-N 3.1Å; H101-A103 VanDerWaalsContact C-N 3.33Å; H101-A103 PolarHBondContact O-N 3.33Å; H101-T104 PolarHBondContact O-N 3.11Å; H101-T104 PolarHBondContact O-OG1 3.46Å |
| 102 | I | 93.8 | Very high | 88.8 | Confident | 14 Ų | 14 | 47.5 Ų | 47.5 | 7% | 0.072 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -60.7 | -44.9 | 174.2 | -65.8 | 168.1 | 0 | 0 | 0 | 110.5 | V52 A98 I99 F100 T104 D105 V106 V158 A162 F166 | V52-I102 HydrophobicContact CG2-CD1 4.4Å; A98-I102 WeakPolarHBondContact O-CG1 3.27Å; A98-I102 PolarHBondContact O-N 2.61Å; A98-I102 VanDerWaalsContact O-N 3.11Å; I99-I102 PolarHBondContact O-N 3.3Å; F100-I102 PolarHBondContact O-N 3.27Å; I102-T104 VanDerWaalsContact C-N 3.33Å; I102-T104 PolarHBondContact O-N 3.17Å; I102-D105 PolarHBondContact O-N 3Å; I102-V106 PolarHBondContact O-N 3.38Å; I102-V158 HydrophobicContact CD1-CG1 3.7Å; I102-A162 HydrophobicContact CG2-CB 4.45Å; I102-F166 HydrophobicContact CG2-CE1 4.25Å; I102-F166 HydrophobicContact CG2-CZ 3.72Å |
| 103 | A | 92.6 | Very high | 87.5 | Confident | 53 Ų | 53 | 47.8 Ų | 47.8 | 44% | 0.438 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -62.8 | -37.1 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | I99 F100 H101 D105 V106 G107 | I99-A103 WeakPolarHBondContact O-CB 3.43Å; I99-A103 PolarHBondContact O-N 3.29Å; F100-A103 WeakPolarHBondContact O-CB 3.08Å; F100-A103 PolarHBondContact O-N 2.9Å; F100-A103 VanDerWaalsContact O-N 3.12Å; H101-A103 VanDerWaalsContact C-N 3.33Å; H101-A103 PolarHBondContact O-N 3.33Å; A103-D105 VanDerWaalsContact C-N 3.32Å; A103-D105 PolarHBondContact O-N 2.84Å; A103-V106 PolarHBondContact O-N 3.46Å; A103-G107 PolarHBondContact O-N 3.26Å |
| 104 | T | 90.8 | Very high | 86.4 | Confident | 36 Ų | 36 | 51.6 Ų | 51.6 | 22% | 0.221 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -60.9 | -38.3 | 179.9 | 59.8 | 0 | 0 | 0 | 0 | 113.1 | N47 F100 H101 I102 G107 R108 | N47-T104 WeakPolarHBondContact CB-OG1 3.48Å; N47-T104 PolarHBondContact ND2-OG1 2.86Å; N47-T104 VanDerWaalsContact ND2-OG1 3.16Å; F100-T104 HydrophobicContact CD1-CG2 4.21Å; F100-T104 HydrophobicContact CD2-CG2 4.36Å; F100-T104 HydrophobicContact CE1-CG2 3.76Å; F100-T104 HydrophobicContact CE2-CG2 3.93Å; F100-T104 HydrophobicContact CG-CG2 4.5Å; F100-T104 HydrophobicContact CZ-CG2 3.61Å; F100-T104 WeakPolarHBondContact O-CG2 3.39Å; F100-T104 PolarHBondContact O-N 3.09Å; H101-T104 PolarHBondContact O-N 3.11Å; H101-T104 PolarHBondContact O-OG1 3.46Å; I102-T104 VanDerWaalsContact C-N 3.33Å; I102-T104 PolarHBondContact O-N 3.17Å; T104-G107 PolarHBondContact O-N 2.91Å; T104-R108 WeakPolarHBondContact O-CG 3.39Å; T104-R108 PolarHBondContact O-N 3.45Å |
| 105 | D | 88 | Confident | 85 | Confident | 1 Ų | 1 | 56.4 Ų | 56.4 | 1% | 0.005 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -76.9 | -33.1 | 179.8 | -77.1 | -9.2 | 0 | 0 | 0 | 112.5 | Y45 A46 N47 A48 I102 A103 G107 R108 L109 | Y45-D105 WeakPolarHBondContact CA-OD2 3.42Å; Y45-D105 HydrophobicContact CD1-CB 4.06Å; A46-D105 PolarHBondContact N-OD2 3.23Å; N47-D105 VanDerWaalsContact CA-OD2 3.31Å; N47-D105 WeakPolarHBondContact CA-OD2 3.08Å; N47-D105 WeakPolarHBondContact CB-OD1 3.36Å; N47-D105 WeakPolarHBondContact CB-OD2 3.37Å; N47-D105 PolarHBondContact N-OD2 2.82Å; N47-D105 PolarHBondContact ND2-OD1 3.34Å; A48-D105 HydrophobicContact CB-CB 4.26Å; A48-D105 PolarHBondContact N-OD2 3.09Å; I102-D105 PolarHBondContact O-N 3Å; A103-D105 VanDerWaalsContact C-N 3.32Å; A103-D105 PolarHBondContact O-N 2.84Å; D105-G107 VanDerWaalsContact C-N 3.33Å; D105-R108 PolarHBondContact O-N 3Å; D105-R108 IonicContact OD1-CZ 3.44Å; D105-R108 IonicContact OD1-NE 3.44Å; D105-R108 IonicContact OD1-NH1 3.98Å; D105-R108 PolarHBondContact OD1-NH1 2.9Å; D105-L109 PolarHBondContact O-N 3.47Å |
| 106 | V | 86.2 | Confident | 83.4 | Confident | 13 Ų | 13 | 62.4 Ų | 62.4 | 8% | 0.079 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -65 | -40.3 | 168.8 | 176.6 | 0 | 0 | 0 | 0 | 111 | I102 A103 R108 L109 L110 L130 F166 | I102-V106 PolarHBondContact O-N 3.38Å; A103-V106 PolarHBondContact O-N 3.46Å; V106-R108 VanDerWaalsContact C-N 3.31Å; V106-R108 PolarHBondContact O-N 3.15Å; V106-L109 WeakPolarHBondContact O-CB 3.44Å; V106-L109 PolarHBondContact O-N 3.3Å; V106-L110 HydrophobicContact CG1-CD1 4.37Å; V106-L110 WeakPolarHBondContact O-CG 3.33Å; V106-L110 PolarHBondContact O-N 2.93Å; V106-L130 HydrophobicContact CG2-CD1 4.44Å; V106-F166 HydrophobicContact CB-CE1 4.38Å; V106-F166 HydrophobicContact CG2-CD1 4.17Å; V106-F166 HydrophobicContact CG2-CE1 3.44Å; V106-F166 VanDerWaalsContact CG2-CE1 3.44Å; V106-F166 HydrophobicContact CG2-CZ 3.95Å |
| 107 | G | 85.8 | Confident | 82 | Confident | 38 Ų | 38 | 68.2 Ų | 68.2 | 39% | 0.392 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -58.4 | -41.7 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | A103 T104 D105 L110 Y111 | A103-G107 PolarHBondContact O-N 3.26Å; T104-G107 PolarHBondContact O-N 2.91Å; D105-G107 VanDerWaalsContact C-N 3.33Å; G107-L110 PolarHBondContact O-N 2.9Å; G107-Y111 WeakPolarHBondContact O-CB 3.49Å; G107-Y111 PolarHBondContact O-N 3.3Å |
| 108 | R | 83 | Confident | 80.5 | Confident | 132 Ų | 132 | 68.4 Ų | 68.4 | 50% | 0.498 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -66.3 | -39.9 | 174.6 | -72.5 | 171.2 | -176 | 173.3 | -3.5 | 112.8 | N47 T104 D105 V106 L110 Y111 G112 | N47-R108 PolarHBondContact ND2-NH1 2.94Å; N47-R108 PolarHBondContact ND2-NH2 3.2Å; N47-R108 VanDerWaalsContact ND2-NH2 3.1Å; T104-R108 WeakPolarHBondContact O-CG 3.39Å; T104-R108 PolarHBondContact O-N 3.45Å; D105-R108 PolarHBondContact O-N 3Å; D105-R108 IonicContact OD1-CZ 3.44Å; D105-R108 IonicContact OD1-NE 3.44Å; D105-R108 IonicContact OD1-NH1 3.98Å; D105-R108 PolarHBondContact OD1-NH1 2.9Å; V106-R108 VanDerWaalsContact C-N 3.31Å; V106-R108 PolarHBondContact O-N 3.15Å; R108-L110 VanDerWaalsContact C-N 3.32Å; R108-L110 PolarHBondContact O-N 3.02Å; R108-Y111 PolarHBondContact O-N 3.5Å; R108-G112 PolarHBondContact O-N 3.25Å |
| 109 | L | 79.3 | Confident | 79.6 | Confident | 3 Ų | 3 | 73.8 Ų | 73.8 | 2% | 0.016 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -56.9 | -49 | 173.6 | 178 | 71.4 | 0 | 0 | 0 | 109.9 | L41 D105 V106 G112 C113 W118 I123 I127 | L41-L109 HydrophobicContact CD2-CD1 3.51Å; D105-L109 PolarHBondContact O-N 3.47Å; V106-L109 WeakPolarHBondContact O-CB 3.44Å; V106-L109 PolarHBondContact O-N 3.3Å; L109-G112 PolarHBondContact O-N 3.02Å; L109-C113 PolarHBondContact O-N 2.99Å; L109-C113 PolarHBondContact O-SG 3.25Å; L109-W118 HydrophobicContact CD1-CE3 4.17Å; L109-W118 HydrophobicContact CD1-CH2 4.48Å; L109-W118 HydrophobicContact CD1-CZ3 3.52Å; L109-W118 HydrophobicContact CG-CZ3 4.43Å; L109-W118 WeakPolarHBondContact O-CZ3 3.4Å; L109-I123 HydrophobicContact CD2-CG2 4.29Å; L109-I123 HydrophobicContact CG-CG2 4.33Å; L109-I127 HydrophobicContact CD2-CG1 4.13Å |
| 110 | L | 80.9 | Confident | 78.8 | Confident | 64 Ų | 64 | 75.3 Ų | 75.3 | 34% | 0.335 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -64.7 | -41.1 | 178.1 | -66.9 | 174.1 | 0 | 0 | 0 | 112.5 | V106 G107 R108 G112 C113 R114 I123 I127 V169 | V106-L110 HydrophobicContact CG1-CD1 4.37Å; V106-L110 WeakPolarHBondContact O-CG 3.33Å; V106-L110 PolarHBondContact O-N 2.93Å; G107-L110 PolarHBondContact O-N 2.9Å; R108-L110 VanDerWaalsContact C-N 3.32Å; R108-L110 PolarHBondContact O-N 3.02Å; L110-G112 VanDerWaalsContact C-N 3.33Å; L110-G112 PolarHBondContact O-N 3.09Å; L110-C113 VanDerWaalsContact CA-SG 3.51Å; L110-C113 WeakPolarHBondContact O-CB 3.43Å; L110-C113 PolarHBondContact O-N 2.84Å; L110-C113 PolarHBondContact O-SG 2.97Å; L110-R114 PolarHBondContact O-N 3.41Å; L110-I123 HydrophobicContact CD2-CG2 4.16Å; L110-I127 HydrophobicContact CD2-CD1 4.15Å; L110-V169 HydrophobicContact CD1-CG1 3.81Å; L110-V169 HydrophobicContact CD2-CG1 3.99Å; L110-V169 HydrophobicContact CG-CG1 4.44Å |
| 111 | Y | 76.6 | Confident | 78.3 | Confident | 120 Ų | 120 | 72.1 Ų | 72.1 | 47% | 0.471 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -65.5 | -35.7 | 175.7 | -174.4 | -95.1 | 0 | 0 | 0 | 112.4 | G107 R108 C113 R114 R115 | G107-Y111 WeakPolarHBondContact O-CB 3.49Å; G107-Y111 PolarHBondContact O-N 3.3Å; R108-Y111 PolarHBondContact O-N 3.5Å; Y111-C113 VanDerWaalsContact C-N 3.27Å; Y111-C113 PolarHBondContact O-N 2.82Å; Y111-R114 WeakPolarHBondContact O-CB 3.46Å; Y111-R114 PolarHBondContact O-N 3.49Å; Y111-R114 VanDerWaalsContact O-N 3.08Å; Y111-R115 HydrophobicContact CE1-CB 4.13Å; Y111-R115 PolarHBondContact O-N 3.35Å; Y111-R115 PolarHBondContact OH-NH1 3.19Å |
| 112 | G | 69.5 | Low | 77.8 | Confident | 6 Ų | 6 | 75.2 Ų | 75.2 | 6% | 0.062 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -56.2 | -40.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | R108 L109 L110 R114 R115 H116 | R108-G112 PolarHBondContact O-N 3.25Å; L109-G112 PolarHBondContact O-N 3.02Å; L110-G112 VanDerWaalsContact C-N 3.33Å; L110-G112 PolarHBondContact O-N 3.09Å; G112-R114 VanDerWaalsContact C-N 3.33Å; G112-R114 PolarHBondContact O-N 3Å; G112-R115 PolarHBondContact O-N 2.65Å; G112-H116 PolarHBondContact O-N 3.45Å |
| 113 | C | 66.1 | Low | 77.3 | Confident | 27 Ų | 27 | 74.7 Ų | 74.7 | 18% | 0.182 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -58 | -46.6 | 173.6 | -26.5 | 0 | 0 | 0 | 0 | 112 | L109 L110 Y111 R117 I123 | L109-C113 PolarHBondContact O-N 2.99Å; L109-C113 PolarHBondContact O-SG 3.25Å; L110-C113 VanDerWaalsContact CA-SG 3.51Å; L110-C113 WeakPolarHBondContact O-CB 3.43Å; L110-C113 PolarHBondContact O-N 2.84Å; L110-C113 PolarHBondContact O-SG 2.97Å; Y111-C113 VanDerWaalsContact C-N 3.27Å; Y111-C113 PolarHBondContact O-N 2.82Å; C113-R117 WeakPolarHBondContact O-CA 3.45Å; C113-R117 PolarHBondContact O-N 2.95Å; C113-R117 VanDerWaalsContact O-N 3.17Å; C113-I123 HydrophobicContact CB-CD1 3.48Å; C113-I123 VanDerWaalsContact CB-CD1 3.48Å; C113-I123 HydrophobicContact CB-CG1 4.39Å; C113-I123 WeakPolarHBondContact SG-CD1 3.47Å; C113-I123 WeakPolarHBondContact SG-CG1 3.29Å |
| 114 | R | 68.8 | Low | 77.1 | Confident | 172 Ų | 172 | 72.6 Ų | 72.6 | 65% | 0.649 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -63.6 | -46.7 | -178.7 | -176.1 | 179.2 | 177.2 | -175.4 | -2.2 | 111.2 | L110 Y111 G112 | L110-R114 PolarHBondContact O-N 3.41Å; Y111-R114 WeakPolarHBondContact O-CB 3.46Å; Y111-R114 PolarHBondContact O-N 3.49Å; Y111-R114 VanDerWaalsContact O-N 3.08Å; G112-R114 VanDerWaalsContact C-N 3.33Å; G112-R114 PolarHBondContact O-N 3Å |
| 115 | R | 65.2 | Low | 77 | Confident | 164 Ų | 164 | 76.1 Ų | 76.1 | 62% | 0.619 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -82.5 | -43.6 | -171.9 | -171.3 | 173.6 | -176.2 | 120.9 | -0.5 | 113.6 | Y111 G112 | Y111-R115 HydrophobicContact CE1-CB 4.13Å; Y111-R115 PolarHBondContact O-N 3.35Å; Y111-R115 PolarHBondContact OH-NH1 3.19Å; G112-R115 PolarHBondContact O-N 2.65Å |
| 116 | H | 59.8 | Low | 76.9 | Confident | 126 Ų | 126 | 76.5 Ų | 76.5 | 58% | 0.583 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -105.6 | 8.1 | -171.4 | -65.7 | -71 | 0 | 0 | 0 | 113.7 | G112 W118 | G112-H116 PolarHBondContact O-N 3.45Å; H116-W118 VanDerWaalsContact C-N 3.27Å; H116-W118 PolarHBondContact O-N 2.81Å |
| 117 | R | 63.8 | Low | 77.1 | Confident | 185 Ų | 185 | 75.9 Ų | 75.9 | 70% | 0.698 | 35% | 0.352 | S | S | * | . | trans | 51.9 | 43.5 | -179.2 | -57.5 | -162.6 | -176.2 | -164.8 | 0.8 | 113.2 | C113 N119 S194 | C113-R117 WeakPolarHBondContact O-CA 3.45Å; C113-R117 PolarHBondContact O-N 2.95Å; C113-R117 VanDerWaalsContact O-N 3.17Å; R117-N119 PolarHBondContact O-N 2.86Å; R117-S194 PolarHBondContact NH2-OG 3.35Å | ||
| 118 | W | 61.8 | Low | 77.3 | Confident | 85 Ų | 85 | 75.3 Ų | 75.3 | 32% | 0.322 | 34% | 0.343 | S | S | . | . | trans | -58.7 | 142.2 | 171.8 | -64.1 | -7.9 | 0 | 0 | 0 | 109.9 | L109 H116 V120 I123 | L109-W118 HydrophobicContact CD1-CE3 4.17Å; L109-W118 HydrophobicContact CD1-CH2 4.48Å; L109-W118 HydrophobicContact CD1-CZ3 3.52Å; L109-W118 HydrophobicContact CG-CZ3 4.43Å; L109-W118 WeakPolarHBondContact O-CZ3 3.4Å; H116-W118 VanDerWaalsContact C-N 3.27Å; H116-W118 PolarHBondContact O-N 2.81Å; W118-V120 PolarHBondContact O-N 2.74Å; W118-I123 HydrophobicContact CB-CD1 3.84Å; W118-I123 HydrophobicContact CB-CG1 4.48Å; W118-I123 HydrophobicContact CE3-CG1 4.26Å | ||
| 119 | N | 76.5 | Confident | 77.7 | Confident | 112 Ų | 112 | 69.1 Ų | 69.1 | 60% | 0.599 | 32% | 0.32 | S | S | * | . | trans | -61.2 | 121.8 | 178.3 | -176.7 | -17.3 | 0 | 0 | 0 | 109.2 | R117 A121 Y122 I123 | R117-N119 PolarHBondContact O-N 2.86Å; N119-A121 PolarHBondContact O-N 2.97Å; N119-A121 WeakPolarHBondContact OD1-CB 3.22Å; N119-A121 PolarHBondContact OD1-N 3.1Å; N119-Y122 WeakPolarHBondContact O-CA 3.47Å; N119-Y122 WeakPolarHBondContact O-CB 3.48Å; N119-Y122 PolarHBondContact O-N 3.16Å; N119-I123 WeakPolarHBondContact O-CD1 3.28Å; N119-I123 PolarHBondContact O-N 3.47Å | ||
| 120 | V | 79.7 | Confident | 78.2 | Confident | 69 Ų | 69 | 70.1 Ų | 70.1 | 42% | 0.418 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -49.4 | -36.5 | 177.8 | 174.2 | 0 | 0 | 0 | 0 | 112 | W118 Y122 I123 G124 L173 V177 | W118-V120 PolarHBondContact O-N 2.74Å; V120-Y122 VanDerWaalsContact C-N 3.29Å; V120-Y122 PolarHBondContact O-N 2.71Å; V120-I123 PolarHBondContact O-N 3.28Å; V120-G124 PolarHBondContact O-N 3.47Å; V120-L173 HydrophobicContact CG1-CD1 3.9Å; V120-L173 HydrophobicContact CG1-CD2 4.3Å; V120-L173 HydrophobicContact CG1-CG 4.22Å; V120-V177 HydrophobicContact CG1-CG2 3.84Å |
| 121 | A | 83.7 | Confident | 78.8 | Confident | 56 Ų | 56 | 68.5 Ų | 68.5 | 46% | 0.463 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -62.5 | -34.7 | 176 | 0 | 0 | 0 | 0 | 0 | 112.9 | N119 K125 | N119-A121 PolarHBondContact O-N 2.97Å; N119-A121 WeakPolarHBondContact OD1-CB 3.22Å; N119-A121 PolarHBondContact OD1-N 3.1Å; A121-K125 WeakPolarHBondContact O-CB 3.41Å; A121-K125 VanDerWaalsContact O-CG 3.28Å; A121-K125 WeakPolarHBondContact O-CG 3.41Å; A121-K125 PolarHBondContact O-N 3.33Å |
| 122 | Y | 82.3 | Confident | 79.6 | Confident | 103 Ų | 103 | 64.1 Ų | 64.1 | 40% | 0.404 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -67.2 | -43.5 | 177.2 | -176.2 | -101.4 | 0 | 0 | 0 | 111.8 | S39 L41 N119 V120 K125 G126 | S39-Y122 VanDerWaalsContact CB-OH 3.27Å; S39-Y122 WeakPolarHBondContact CB-OH 3.36Å; L41-Y122 HydrophobicContact CD1-CE1 3.98Å; L41-Y122 WeakPolarHBondContact CD1-OH 3.5Å; N119-Y122 WeakPolarHBondContact O-CA 3.47Å; N119-Y122 WeakPolarHBondContact O-CB 3.48Å; N119-Y122 PolarHBondContact O-N 3.16Å; V120-Y122 VanDerWaalsContact C-N 3.29Å; V120-Y122 PolarHBondContact O-N 2.71Å; Y122-K125 PolarHBondContact O-N 3.32Å; Y122-G126 PolarHBondContact O-N 2.9Å |
| 123 | I | 84.1 | Confident | 80.7 | Confident | 3 Ų | 3 | 66.2 Ų | 66.2 | 2% | 0.015 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -68.4 | -42.8 | 176 | -61.3 | 123.1 | 0 | 0 | 0 | 110.8 | L109 L110 C113 W118 N119 V120 K125 G126 I127 | L109-I123 HydrophobicContact CD2-CG2 4.29Å; L109-I123 HydrophobicContact CG-CG2 4.33Å; L110-I123 HydrophobicContact CD2-CG2 4.16Å; C113-I123 HydrophobicContact CB-CD1 3.48Å; C113-I123 VanDerWaalsContact CB-CD1 3.48Å; C113-I123 HydrophobicContact CB-CG1 4.39Å; C113-I123 WeakPolarHBondContact SG-CD1 3.47Å; C113-I123 WeakPolarHBondContact SG-CG1 3.29Å; W118-I123 HydrophobicContact CB-CD1 3.84Å; W118-I123 HydrophobicContact CB-CG1 4.48Å; W118-I123 HydrophobicContact CE3-CG1 4.26Å; N119-I123 WeakPolarHBondContact O-CD1 3.28Å; N119-I123 PolarHBondContact O-N 3.47Å; V120-I123 PolarHBondContact O-N 3.28Å; I123-K125 VanDerWaalsContact C-N 3.27Å; I123-K125 PolarHBondContact O-N 3.02Å; I123-G126 PolarHBondContact O-N 2.88Å; I123-G126 VanDerWaalsContact O-N 3.08Å; I123-I127 HydrophobicContact CG2-CD1 3.69Å; I123-I127 HydrophobicContact CG2-CG1 4.17Å; I123-I127 WeakPolarHBondContact O-CG1 3.31Å; I123-I127 PolarHBondContact O-N 3.27Å |
| 124 | G | 87.9 | Confident | 82 | Confident | 9 Ų | 9 | 65.5 Ų | 65.5 | 9% | 0.093 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -55.6 | -43.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | V120 A128 | V120-G124 PolarHBondContact O-N 3.47Å; G124-A128 WeakPolarHBondContact O-CB 3.45Å; G124-A128 PolarHBondContact O-N 3.35Å |
| 125 | K | 87.6 | Confident | 83.2 | Confident | 111 Ų | 111 | 59.4 Ų | 59.4 | 48% | 0.483 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -62.6 | -45.3 | 172.7 | -76.2 | 178.5 | 175.7 | -162.4 | 0 | 112.7 | E35 A121 Y122 I123 A128 C129 | E35-K125 IonicContact OE2-NZ 3.92Å; A121-K125 WeakPolarHBondContact O-CB 3.41Å; A121-K125 VanDerWaalsContact O-CG 3.28Å; A121-K125 WeakPolarHBondContact O-CG 3.41Å; A121-K125 PolarHBondContact O-N 3.33Å; Y122-K125 PolarHBondContact O-N 3.32Å; I123-K125 VanDerWaalsContact C-N 3.27Å; I123-K125 PolarHBondContact O-N 3.02Å; K125-A128 PolarHBondContact O-N 3.32Å; K125-C129 WeakPolarHBondContact O-CB 3.4Å; K125-C129 PolarHBondContact O-N 3.45Å |
| 126 | G | 86.4 | Confident | 84.6 | Confident | 8 Ų | 8 | 56.6 Ų | 56.6 | 8% | 0.082 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -59.9 | -47.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | Y122 I123 C129 L130 | Y122-G126 PolarHBondContact O-N 2.9Å; I123-G126 PolarHBondContact O-N 2.88Å; I123-G126 VanDerWaalsContact O-N 3.08Å; G126-C129 WeakPolarHBondContact O-CB 3.43Å; G126-C129 PolarHBondContact O-N 3.44Å; G126-L130 WeakPolarHBondContact O-CG 3.49Å; G126-L130 PolarHBondContact O-N 2.9Å |
| 127 | I | 89.9 | Confident | 86.2 | Confident | 1 Ų | 1 | 54.2 Ų | 54.2 | 1% | 0.005 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -65.2 | -43.2 | 176.7 | -62.9 | 173.4 | 0 | 0 | 0 | 110.7 | L109 L110 I123 C129 L130 I131 F166 V169 F170 | L109-I127 HydrophobicContact CD2-CG1 4.13Å; L110-I127 HydrophobicContact CD2-CD1 4.15Å; I123-I127 HydrophobicContact CG2-CD1 3.69Å; I123-I127 HydrophobicContact CG2-CG1 4.17Å; I123-I127 WeakPolarHBondContact O-CG1 3.31Å; I123-I127 PolarHBondContact O-N 3.27Å; I127-C129 VanDerWaalsContact C-N 3.28Å; I127-C129 PolarHBondContact O-N 3.3Å; I127-L130 WeakPolarHBondContact O-CB 3.12Å; I127-L130 PolarHBondContact O-N 3.41Å; I127-L130 VanDerWaalsContact O-N 3.15Å; I127-I131 HydrophobicContact CG2-CD1 4.03Å; I127-I131 HydrophobicContact CG2-CG1 4.42Å; I127-I131 WeakPolarHBondContact O-CG1 3.33Å; I127-I131 PolarHBondContact O-N 2.86Å; I127-F166 HydrophobicContact CG2-CB 4.4Å; I127-V169 HydrophobicContact CD1-CG1 3.69Å; I127-F170 HydrophobicContact CB-CD2 4.47Å; I127-F170 HydrophobicContact CG2-CB 3.92Å; I127-F170 HydrophobicContact CG2-CD2 4.2Å |
| 128 | A | 91.6 | Very high | 87.6 | Confident | 26 Ų | 26 | 45.7 Ų | 45.7 | 22% | 0.215 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -59.8 | -39.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112 | G124 K125 I131 I132 F170 | G124-A128 WeakPolarHBondContact O-CB 3.45Å; G124-A128 PolarHBondContact O-N 3.35Å; K125-A128 PolarHBondContact O-N 3.32Å; A128-I131 PolarHBondContact O-N 3.38Å; A128-I132 WeakPolarHBondContact O-CD1 3.41Å; A128-I132 VanDerWaalsContact O-CG1 3.28Å; A128-I132 WeakPolarHBondContact O-CG1 3.47Å; A128-I132 PolarHBondContact O-N 3.41Å; A128-F170 HydrophobicContact CB-CE2 4.12Å |
| 129 | C | 90.3 | Very high | 89.1 | Confident | 2 Ų | 2 | 44.8 Ų | 44.8 | 1% | 0.014 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -63.3 | -44.1 | 174.2 | -170.3 | 0 | 0 | 0 | 0 | 111.7 | F36 K125 G126 I127 I131 I132 I133 | F36-C129 HydrophobicContact CB-CB 4.26Å; F36-C129 WeakPolarHBondContact CB-SG 3.49Å; F36-C129 HydrophobicContact CD2-CB 4.23Å; F36-C129 HydrophobicContact CG-CB 4.39Å; K125-C129 WeakPolarHBondContact O-CB 3.4Å; K125-C129 PolarHBondContact O-N 3.45Å; G126-C129 WeakPolarHBondContact O-CB 3.43Å; G126-C129 PolarHBondContact O-N 3.44Å; I127-C129 VanDerWaalsContact C-N 3.28Å; I127-C129 PolarHBondContact O-N 3.3Å; C129-I131 PolarHBondContact O-N 3.14Å; C129-I132 PolarHBondContact O-N 2.69Å; C129-I133 VanDerWaalsContact O-CG1 3.32Å; C129-I133 WeakPolarHBondContact O-CG1 3.35Å; C129-I133 PolarHBondContact O-N 2.82Å |
| 130 | L | 90.8 | Very high | 89.8 | Confident | 24 Ų | 24 | 40.8 Ų | 40.8 | 13% | 0.126 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -61 | -43.6 | 175.1 | -70.4 | 173.6 | 0 | 0 | 0 | 111.8 | F36 V106 G126 I127 I132 I133 V134 F166 | F36-L130 HydrophobicContact CE2-CD2 4.2Å; F36-L130 HydrophobicContact CE2-CG 4.28Å; F36-L130 HydrophobicContact CZ-CD2 3.78Å; F36-L130 HydrophobicContact CZ-CG 4.36Å; V106-L130 HydrophobicContact CG2-CD1 4.44Å; G126-L130 WeakPolarHBondContact O-CG 3.49Å; G126-L130 PolarHBondContact O-N 2.9Å; I127-L130 WeakPolarHBondContact O-CB 3.12Å; I127-L130 PolarHBondContact O-N 3.41Å; I127-L130 VanDerWaalsContact O-N 3.15Å; L130-I132 VanDerWaalsContact C-N 3.31Å; L130-I132 PolarHBondContact O-N 2.9Å; L130-I133 PolarHBondContact O-N 3.35Å; L130-V134 WeakPolarHBondContact O-CB 3.47Å; L130-V134 VanDerWaalsContact O-CG2 3.29Å; L130-V134 WeakPolarHBondContact O-CG2 3.44Å; L130-V134 PolarHBondContact O-N 3.4Å; L130-F166 HydrophobicContact CB-CD2 3.85Å; L130-F166 HydrophobicContact CB-CE2 3.96Å; L130-F166 HydrophobicContact CD1-CE2 4.44Å |
| 131 | I | 93.6 | Very high | 90.4 | Very high | 30 Ų | 30 | 37.8 Ų | 37.8 | 15% | 0.154 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -57 | -47 | 175.1 | -69.4 | 168 | 0 | 0 | 0 | 110.2 | I127 A128 C129 T135 L163 F166 F170 | I127-I131 HydrophobicContact CG2-CD1 4.03Å; I127-I131 HydrophobicContact CG2-CG1 4.42Å; I127-I131 WeakPolarHBondContact O-CG1 3.33Å; I127-I131 PolarHBondContact O-N 2.86Å; A128-I131 PolarHBondContact O-N 3.38Å; C129-I131 PolarHBondContact O-N 3.14Å; I131-T135 WeakPolarHBondContact O-CB 3.49Å; I131-T135 PolarHBondContact O-N 2.87Å; I131-T135 PolarHBondContact O-OG1 3.4Å; I131-L163 HydrophobicContact CG2-CD1 3.94Å; I131-F166 HydrophobicContact CD1-CB 4.37Å; I131-F166 HydrophobicContact CG1-CB 3.65Å; I131-F170 HydrophobicContact CD1-CB 3.78Å; I131-F170 HydrophobicContact CD1-CG 4.09Å |
| 132 | I | 93.2 | Very high | 90.8 | Very high | 27 Ų | 27 | 39 Ų | 39 | 14% | 0.138 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -60.7 | -50.2 | 178.7 | -70.2 | 159.6 | 0 | 0 | 0 | 110.7 | Y29 L32 A128 C129 L130 V134 T135 M136 | Y29-I132 HydrophobicContact CD1-CD1 3.9Å; Y29-I132 HydrophobicContact CD1-CG1 4.13Å; Y29-I132 HydrophobicContact CD1-CG2 3.6Å; Y29-I132 HydrophobicContact CE1-CD1 4.04Å; Y29-I132 HydrophobicContact CE1-CG1 4.02Å; Y29-I132 HydrophobicContact CE1-CG2 4.06Å; Y29-I132 HydrophobicContact CG-CG2 4.46Å; L32-I132 HydrophobicContact CD1-CD1 3.78Å; A128-I132 WeakPolarHBondContact O-CD1 3.41Å; A128-I132 VanDerWaalsContact O-CG1 3.28Å; A128-I132 WeakPolarHBondContact O-CG1 3.47Å; A128-I132 PolarHBondContact O-N 3.41Å; C129-I132 PolarHBondContact O-N 2.69Å; L130-I132 VanDerWaalsContact C-N 3.31Å; L130-I132 PolarHBondContact O-N 2.9Å; I132-V134 PolarHBondContact O-N 2.95Å; I132-T135 PolarHBondContact O-N 2.84Å; I132-M136 WeakPolarHBondContact O-CG 3.25Å; I132-M136 PolarHBondContact O-N 3.3Å |
| 133 | I | 91.7 | Very high | 91.2 | Very high | 51 Ų | 51 | 38.7 Ų | 38.7 | 26% | 0.262 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -59.1 | -49.6 | -178.9 | -69.2 | 166.1 | 0 | 0 | 0 | 110.5 | I33 F36 C129 L130 T135 M136 L137 | I33-I133 HydrophobicContact CG1-CG1 4.25Å; F36-I133 HydrophobicContact CD1-CD1 4.41Å; C129-I133 VanDerWaalsContact O-CG1 3.32Å; C129-I133 WeakPolarHBondContact O-CG1 3.35Å; C129-I133 PolarHBondContact O-N 2.82Å; L130-I133 PolarHBondContact O-N 3.35Å; I133-T135 VanDerWaalsContact C-N 3.35Å; I133-T135 PolarHBondContact O-N 3.11Å; I133-M136 PolarHBondContact O-N 2.78Å; I133-L137 HydrophobicContact CG2-CD1 4.43Å; I133-L137 WeakPolarHBondContact O-CG 3.48Å; I133-L137 PolarHBondContact O-N 2.92Å |
| 134 | V | 93.3 | Very high | 91.4 | Very high | 12 Ų | 12 | 47.3 Ų | 47.3 | 7% | 0.073 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -69.7 | -33.9 | -178.6 | -176.7 | 0 | 0 | 0 | 0 | 111.5 | L130 I132 M136 L137 C138 F159 L163 F166 | L130-V134 WeakPolarHBondContact O-CB 3.47Å; L130-V134 VanDerWaalsContact O-CG2 3.29Å; L130-V134 WeakPolarHBondContact O-CG2 3.44Å; L130-V134 PolarHBondContact O-N 3.4Å; I132-V134 PolarHBondContact O-N 2.95Å; V134-M136 VanDerWaalsContact C-N 3.34Å; V134-M136 PolarHBondContact O-N 3.08Å; V134-L137 WeakPolarHBondContact O-CB 3.47Å; V134-L137 PolarHBondContact O-N 3.35Å; V134-C138 PolarHBondContact O-N 3.42Å; V134-C138 PolarHBondContact O-SG 3.37Å; V134-C138 VanDerWaalsContact O-SG 3.35Å; V134-F159 HydrophobicContact CG1-CB 4.01Å; V134-F159 WeakPolarHBondContact CG1-O 3.4Å; V134-L163 HydrophobicContact CG1-CB 3.78Å; V134-F166 HydrophobicContact CG2-CD2 4.27Å; V134-F166 HydrophobicContact CG2-CE2 3.91Å |
| 135 | T | 94.9 | Very high | 91.4 | Very high | 43 Ų | 43 | 50 Ų | 50 | 26% | 0.264 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -60.9 | -44.7 | 171.9 | -59.1 | 0 | 0 | 0 | 0 | 110.9 | I131 I132 I133 L137 C138 C139 L163 | I131-T135 WeakPolarHBondContact O-CB 3.49Å; I131-T135 PolarHBondContact O-N 2.87Å; I131-T135 PolarHBondContact O-OG1 3.4Å; I132-T135 PolarHBondContact O-N 2.84Å; I133-T135 VanDerWaalsContact C-N 3.35Å; I133-T135 PolarHBondContact O-N 3.11Å; T135-L137 VanDerWaalsContact C-N 3.31Å; T135-L137 PolarHBondContact O-N 3.38Å; T135-C138 PolarHBondContact O-N 3.49Å; T135-C139 WeakPolarHBondContact O-CB 3.35Å; T135-C139 PolarHBondContact O-N 3.37Å; T135-C139 PolarHBondContact O-SG 2.85Å; T135-L163 VanDerWaalsContact OG1-CD1 3.31Å; T135-L163 WeakPolarHBondContact OG1-CD1 3.32Å |
| 136 | M | 93.5 | Very high | 91.4 | Very high | 106 Ų | 106 | 47.5 Ų | 47.5 | 52% | 0.522 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -61.8 | -39.9 | 176.5 | -67.9 | -62.6 | 103.4 | 0 | 0 | 111.8 | I132 I133 V134 G140 | I132-M136 WeakPolarHBondContact O-CG 3.25Å; I132-M136 PolarHBondContact O-N 3.3Å; I133-M136 PolarHBondContact O-N 2.78Å; V134-M136 VanDerWaalsContact C-N 3.34Å; V134-M136 PolarHBondContact O-N 3.08Å; M136-G140 PolarHBondContact O-N 2.88Å |
| 137 | L | 92.9 | Very high | 91.5 | Very high | 75 Ų | 75 | 51.2 Ų | 51.2 | 39% | 0.393 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -61.9 | -50.9 | 174.1 | -69.4 | 172 | 0 | 0 | 0 | 111.3 | I133 V134 T135 C139 G140 L141 F159 | I133-L137 HydrophobicContact CG2-CD1 4.43Å; I133-L137 WeakPolarHBondContact O-CG 3.48Å; I133-L137 PolarHBondContact O-N 2.92Å; V134-L137 WeakPolarHBondContact O-CB 3.47Å; V134-L137 PolarHBondContact O-N 3.35Å; T135-L137 VanDerWaalsContact C-N 3.31Å; T135-L137 PolarHBondContact O-N 3.38Å; L137-C139 PolarHBondContact O-N 3.05Å; L137-G140 PolarHBondContact O-N 2.97Å; L137-G140 VanDerWaalsContact O-N 3.15Å; L137-L141 VanDerWaalsContact O-CG 3.32Å; L137-L141 WeakPolarHBondContact O-CG 3.31Å; L137-L141 PolarHBondContact O-N 2.89Å; L137-F159 HydrophobicContact CB-CD2 4.4Å; L137-F159 HydrophobicContact CD1-CD1 4.41Å; L137-F159 HydrophobicContact CD1-CD2 4.49Å; L137-F159 HydrophobicContact CD1-CE1 4.3Å; L137-F159 HydrophobicContact CD1-CE2 4.36Å; L137-F159 HydrophobicContact CD1-CZ 4.28Å |
| 138 | C | 93.5 | Very high | 91.5 | Very high | 7 Ų | 7 | 53.5 Ų | 53.5 | 5% | 0.047 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -59.7 | -45.7 | 178.2 | -68.2 | 0 | 0 | 0 | 0 | 112.1 | V134 T135 G140 L141 D142 | V134-C138 PolarHBondContact O-N 3.42Å; V134-C138 PolarHBondContact O-SG 3.37Å; V134-C138 VanDerWaalsContact O-SG 3.35Å; T135-C138 PolarHBondContact O-N 3.49Å; C138-G140 VanDerWaalsContact C-N 3.28Å; C138-G140 PolarHBondContact O-N 2.76Å; C138-L141 WeakPolarHBondContact O-CB 3.49Å; C138-L141 PolarHBondContact O-N 3.12Å; C138-L141 VanDerWaalsContact O-N 3.07Å; C138-D142 PolarHBondContact O-N 3.32Å |
| 139 | C | 93.7 | Very high | 91.4 | Very high | 65 Ų | 65 | 53.8 Ų | 53.8 | 44% | 0.439 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -61.4 | -36.9 | 175.9 | -68.6 | 0 | 0 | 0 | 0 | 112.4 | T135 L137 D142 S143 | T135-C139 WeakPolarHBondContact O-CB 3.35Å; T135-C139 PolarHBondContact O-N 3.37Å; T135-C139 PolarHBondContact O-SG 2.85Å; L137-C139 PolarHBondContact O-N 3.05Å; C139-D142 PolarHBondContact O-N 3.48Å; C139-S143 PolarHBondContact O-N 2.91Å; C139-S143 VanDerWaalsContact O-N 3.11Å |
| 140 | G | 92.1 | Very high | 91.2 | Very high | 28 Ų | 28 | 62.5 Ų | 62.5 | 29% | 0.289 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -60.1 | -46.2 | 171.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | M136 L137 C138 S143 Y144 | M136-G140 PolarHBondContact O-N 2.88Å; L137-G140 PolarHBondContact O-N 2.97Å; L137-G140 VanDerWaalsContact O-N 3.15Å; C138-G140 VanDerWaalsContact C-N 3.28Å; C138-G140 PolarHBondContact O-N 2.76Å; G140-S143 WeakPolarHBondContact O-CB 3.36Å; G140-S143 PolarHBondContact O-N 3.32Å; G140-S143 PolarHBondContact O-OG 2.91Å; G140-Y144 WeakPolarHBondContact O-CD2 3.03Å; G140-Y144 PolarHBondContact O-N 3.21Å |
| 141 | L | 91.3 | Very high | 91 | Very high | 7 Ų | 7 | 68 Ų | 68 | 4% | 0.037 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -67.2 | -36.6 | 178.8 | -61.6 | 173 | 0 | 0 | 0 | 113.4 | L137 C138 S143 Y144 L146 W155 Y156 F159 | L137-L141 VanDerWaalsContact O-CG 3.32Å; L137-L141 WeakPolarHBondContact O-CG 3.31Å; L137-L141 PolarHBondContact O-N 2.89Å; C138-L141 WeakPolarHBondContact O-CB 3.49Å; C138-L141 PolarHBondContact O-N 3.12Å; C138-L141 VanDerWaalsContact O-N 3.07Å; L141-S143 VanDerWaalsContact C-N 3.26Å; L141-S143 PolarHBondContact O-N 3.41Å; L141-Y144 WeakPolarHBondContact O-CB 3.34Å; L141-Y144 PolarHBondContact O-N 3.28Å; L141-Y144 VanDerWaalsContact O-N 3.1Å; L141-L146 HydrophobicContact CD2-CD1 4.12Å; L141-L146 PolarHBondContact O-N 2.83Å; L141-W155 HydrophobicContact CD2-CD2 4.13Å; L141-W155 HydrophobicContact CD2-CE3 4.06Å; L141-W155 HydrophobicContact CD2-CH2 3.16Å; L141-W155 HydrophobicContact CD2-CZ2 3.21Å; L141-W155 HydrophobicContact CD2-CZ3 3.6Å; L141-Y156 HydrophobicContact CB-CD1 3.38Å; L141-Y156 HydrophobicContact CB-CE1 3.51Å; L141-Y156 HydrophobicContact CB-CG 4.24Å; L141-Y156 HydrophobicContact CD1-CD1 3.79Å; L141-Y156 HydrophobicContact CD1-CE1 4.47Å; L141-Y156 HydrophobicContact CD1-CG 3.78Å; L141-Y156 HydrophobicContact CG-CD1 4.16Å; L141-F159 HydrophobicContact CD1-CD2 4.02Å |
| 142 | D | 91.4 | Very high | 90.6 | Very high | 81 Ų | 81 | 67 Ų | 67 | 43% | 0.433 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -60.4 | -38.6 | 172.6 | -72.8 | -31.4 | 0 | 0 | 0 | 111.4 | C138 C139 Y144 G145 Y156 | C138-D142 PolarHBondContact O-N 3.32Å; C139-D142 PolarHBondContact O-N 3.48Å; D142-Y144 PolarHBondContact O-N 3.41Å; D142-G145 PolarHBondContact O-N 3.39Å; D142-Y156 VanDerWaalsContact CG-OH 3.28Å; D142-Y156 WeakPolarHBondContact OD1-CE1 3.39Å; D142-Y156 PolarHBondContact OD1-OH 3.23Å |
| 143 | S | 91.4 | Very high | 90.5 | Very high | 96 Ų | 96 | 65.7 Ų | 65.7 | 67% | 0.671 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -66.5 | -21.6 | 176.9 | 77.1 | 0 | 0 | 0 | 0 | 113.5 | C139 G140 L141 G145 | C139-S143 PolarHBondContact O-N 2.91Å; C139-S143 VanDerWaalsContact O-N 3.11Å; G140-S143 WeakPolarHBondContact O-CB 3.36Å; G140-S143 PolarHBondContact O-N 3.32Å; G140-S143 PolarHBondContact O-OG 2.91Å; L141-S143 VanDerWaalsContact C-N 3.26Å; L141-S143 PolarHBondContact O-N 3.41Å; S143-G145 VanDerWaalsContact C-N 3.29Å |
| 144 | Y | 89.4 | Confident | 90.5 | Very high | 185 Ų | 185 | 64.5 Ų | 64.5 | 73% | 0.725 | 35% | 0.351 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.7 | 2 | 170.3 | -71.8 | -74.9 | 0 | 0 | 0 | 113.3 | G140 L141 D142 L146 | G140-Y144 WeakPolarHBondContact O-CD2 3.03Å; G140-Y144 PolarHBondContact O-N 3.21Å; L141-Y144 WeakPolarHBondContact O-CB 3.34Å; L141-Y144 PolarHBondContact O-N 3.28Å; L141-Y144 VanDerWaalsContact O-N 3.1Å; D142-Y144 PolarHBondContact O-N 3.41Å; Y144-L146 PolarHBondContact O-N 2.95Å |
| 145 | G | 87.5 | Confident | 90.4 | Very high | 65 Ų | 65 | 66.8 Ų | 66.8 | 67% | 0.67 | 36% | 0.359 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 71.6 | 15.6 | -178.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | D142 S143 | D142-G145 PolarHBondContact O-N 3.39Å; S143-G145 VanDerWaalsContact C-N 3.29Å |
| 146 | L | 86.6 | Confident | 90.4 | Very high | 59 Ų | 59 | 65.1 Ų | 65.1 | 31% | 0.309 | 35% | 0.348 | S | S | . | . | trans | -78.9 | 151.1 | 175.5 | -64.5 | 174.8 | 0 | 0 | 0 | 110.1 | L141 Y144 W155 Y156 | L141-L146 HydrophobicContact CD2-CD1 4.12Å; L141-L146 PolarHBondContact O-N 2.83Å; Y144-L146 PolarHBondContact O-N 2.95Å; L146-W155 HydrophobicContact CD1-CZ2 4.03Å; L146-Y156 HydrophobicContact CB-CD1 3.78Å; L146-Y156 HydrophobicContact CB-CE1 4.27Å; L146-Y156 VanDerWaalsContact O-CE1 3.31Å; L146-Y156 WeakPolarHBondContact O-CE1 3.45Å | ||
| 147 | S | 88.4 | Confident | 90.4 | Very high | 85 Ų | 85 | 62.1 Ų | 62.1 | 59% | 0.594 | 33% | 0.331 | S | S | * | . | trans | -132.3 | 138.6 | 179 | -70.7 | 0 | 0 | 0 | 0 | 111.2 | S149 Y154 | S147-S149 PolarHBondContact O-N 2.85Å; S147-Y154 PolarHBondContact N-OH 3.38Å; S147-Y154 WeakPolarHBondContact O-CE1 3.45Å; S147-Y154 PolarHBondContact O-OH 2.77Å | ||
| 148 | P | 90.9 | Very high | 90.5 | Very high | 49 Ų | 49 | 58.6 Ų | 58.6 | 32% | 0.318 | 31% | 0.312 | S | S | . | . | trans | -60.6 | 128.2 | -178.4 | 23.3 | -28.9 | 0 | 0 | 0 | 110.1 | Y156 Y157 W160 | P148-Y156 HydrophobicContact CB-CD2 3.57Å; P148-Y156 HydrophobicContact CB-CE2 3.68Å; P148-Y156 VanDerWaalsContact CD-CE2 3.47Å; P148-Y156 HydrophobicContact CG-CD2 4.13Å; P148-Y156 HydrophobicContact CG-CE2 3.72Å; P148-Y157 HydrophobicContact CB-CD2 4.34Å; P148-W160 HydrophobicContact CB-CB 4.19Å; P148-W160 HydrophobicContact CB-CD2 4.06Å; P148-W160 HydrophobicContact CB-CE3 4.24Å; P148-W160 HydrophobicContact CB-CG 4.03Å; P148-W160 HydrophobicContact CG-CD2 4.17Å; P148-W160 HydrophobicContact CG-CG 4.17Å | ||
| 149 | S | 89.2 | Confident | 90.6 | Very high | 32 Ų | 32 | 58.9 Ų | 58.9 | 22% | 0.224 | 31% | 0.313 | C | S | . | . | trans | -127.6 | 111.4 | 180 | -178.1 | 0 | 0 | 0 | 0 | 110 | S147 R151 A153 | S147-S149 PolarHBondContact O-N 2.85Å; S149-R151 PolarHBondContact O-N 3.31Å; S149-A153 PolarHBondContact O-N 2.98Å; S149-A153 VanDerWaalsContact O-N 3.11Å | ||
| 150 | R | 86 | Confident | 90.6 | Very high | 186 Ų | 186 | 60.9 Ų | 60.9 | 70% | 0.702 | 31% | 0.311 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.9 | -20 | 175.8 | 67.8 | 178.5 | 179.4 | -166.8 | -5.1 | 113.8 | I152 Y157 | R150-I152 VanDerWaalsContact C-N 3.31Å; R150-I152 PolarHBondContact O-N 3.36Å; R150-Y157 HydrophobicContact CB-CD2 4.31Å; R150-Y157 HydrophobicContact CB-CE2 3.65Å |
| 151 | R | 87 | Confident | 90.8 | Very high | 140 Ų | 140 | 61 Ų | 61 | 53% | 0.528 | 31% | 0.305 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.4 | -35.5 | -175.4 | -68.3 | -176.8 | -173 | -175.3 | 5 | 112.1 | E88 S149 | E88-R151 CarbonylContact C-O 3.41Å; E88-R151 WeakPolarHBondContact OE2-CB 3.41Å; E88-R151 WeakPolarHBondContact OE2-CD 3.38Å; E88-R151 WeakPolarHBondContact OE2-CG 3.31Å; S149-R151 PolarHBondContact O-N 3.31Å |
| 152 | I | 85.1 | Confident | 91 | Very high | 7 Ų | 7 | 61 Ų | 61 | 4% | 0.036 | 31% | 0.307 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -113.3 | -22.4 | -177 | -55.3 | -171.2 | 0 | 0 | 0 | 111.5 | L62 L71 F72 V91 S92 R150 Y154 | L62-I152 HydrophobicContact CD1-CG2 3.27Å; L62-I152 HydrophobicContact CD2-CG2 3.65Å; L62-I152 HydrophobicContact CG-CG2 4.09Å; L71-I152 HydrophobicContact CB-CD1 4.27Å; L71-I152 HydrophobicContact CD1-CD1 4.11Å; F72-I152 HydrophobicContact CD1-CD1 4.41Å; F72-I152 HydrophobicContact CD2-CD1 4.15Å; F72-I152 HydrophobicContact CE1-CD1 3.67Å; F72-I152 HydrophobicContact CE1-CG1 4.12Å; F72-I152 HydrophobicContact CE2-CD1 3.36Å; F72-I152 HydrophobicContact CZ-CD1 3.1Å; F72-I152 HydrophobicContact CZ-CG1 3.91Å; V91-I152 HydrophobicContact CG1-CG2 3.89Å; S92-I152 WeakPolarHBondContact CA-O 3.32Å; R150-I152 VanDerWaalsContact C-N 3.31Å; R150-I152 PolarHBondContact O-N 3.36Å; I152-Y154 VanDerWaalsContact C-N 3.26Å; I152-Y154 PolarHBondContact O-N 2.9Å |
| 153 | A | 90.7 | Very high | 91.2 | Very high | 1 Ų | 1 | 58.7 Ų | 58.7 | 1% | 0.008 | 29% | 0.294 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 55.2 | 39.4 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | G95 S149 Y157 | G95-A153 WeakPolarHBondContact CA-O 3.33Å; S149-A153 PolarHBondContact O-N 2.98Å; S149-A153 VanDerWaalsContact O-N 3.11Å; A153-Y157 HydrophobicContact CB-CD1 3.57Å; A153-Y157 HydrophobicContact CB-CE1 3.95Å; A153-Y157 HydrophobicContact CB-CG 4.49Å |
| 154 | Y | 90.6 | Very high | 91.4 | Very high | 25 Ų | 25 | 58 Ų | 58 | 10% | 0.098 | 28% | 0.282 | C | S | . | . | trans | -64.7 | 171.2 | 174.3 | 77 | -59.4 | 0 | 0 | 0 | 113 | S147 I152 Y156 Y157 V158 | S147-Y154 PolarHBondContact N-OH 3.38Å; S147-Y154 WeakPolarHBondContact O-CE1 3.45Å; S147-Y154 PolarHBondContact O-OH 2.77Å; I152-Y154 VanDerWaalsContact C-N 3.26Å; I152-Y154 PolarHBondContact O-N 2.9Å; Y154-Y156 VanDerWaalsContact C-N 3.31Å; Y154-Y156 PolarHBondContact O-N 3.32Å; Y154-Y156 VanDerWaalsContact O-N 3.1Å; Y154-Y156 WeakPolarHBondContact OH-CB 3.22Å; Y154-Y157 WeakPolarHBondContact O-CA 3.49Å; Y154-Y157 WeakPolarHBondContact O-CB 3.28Å; Y154-Y157 PolarHBondContact O-N 3.37Å; Y154-V158 PolarHBondContact O-N 3.4Å; Y154-V158 VanDerWaalsContact O-N 3.09Å | ||
| 155 | W | 92 | Very high | 91.6 | Very high | 60 Ų | 60 | 51.7 Ų | 51.7 | 23% | 0.227 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -43.8 | -44.4 | -176.3 | 69.3 | -46.7 | 0 | 0 | 0 | 115.9 | A55 L56 Q59 L141 L146 Y157 V158 F159 | A55-W155 HydrophobicContact CB-CB 4.32Å; L56-W155 HydrophobicContact CD2-CE3 4.09Å; Q59-W155 HydrophobicContact CB-CB 4.28Å; Q59-W155 HydrophobicContact CB-CG 3.99Å; Q59-W155 HydrophobicContact CG-CD2 4.19Å; Q59-W155 HydrophobicContact CG-CG 4.04Å; Q59-W155 VanDerWaalsContact OE1-NE1 3.12Å; L141-W155 HydrophobicContact CD2-CD2 4.13Å; L141-W155 HydrophobicContact CD2-CE3 4.06Å; L141-W155 HydrophobicContact CD2-CH2 3.16Å; L141-W155 HydrophobicContact CD2-CZ2 3.21Å; L141-W155 HydrophobicContact CD2-CZ3 3.6Å; L146-W155 HydrophobicContact CD1-CZ2 4.03Å; W155-Y157 PolarHBondContact O-N 3.35Å; W155-V158 PolarHBondContact O-N 2.92Å; W155-F159 HydrophobicContact CB-CE2 4.29Å; W155-F159 AromaticContact CE3-CE2 3.88Å; W155-F159 HydrophobicContact CE3-CE2 3.88Å; W155-F159 VanDerWaalsContact O-CD2 3.26Å; W155-F159 WeakPolarHBondContact O-CD2 3.4Å; W155-F159 WeakPolarHBondContact O-CG 3.17Å; W155-F159 PolarHBondContact O-N 3.39Å |
| 156 | Y | 94.2 | Very high | 91.9 | Very high | 8 Ų | 8 | 49.1 Ų | 49.1 | 3% | 0.031 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -54.2 | -56.5 | 174.2 | -170.6 | 133.8 | 0 | 0 | 0 | 109.3 | L141 D142 L146 P148 Y154 V158 F159 W160 | L141-Y156 HydrophobicContact CB-CD1 3.38Å; L141-Y156 HydrophobicContact CB-CE1 3.51Å; L141-Y156 HydrophobicContact CB-CG 4.24Å; L141-Y156 HydrophobicContact CD1-CD1 3.79Å; L141-Y156 HydrophobicContact CD1-CE1 4.47Å; L141-Y156 HydrophobicContact CD1-CG 3.78Å; L141-Y156 HydrophobicContact CG-CD1 4.16Å; D142-Y156 VanDerWaalsContact CG-OH 3.28Å; D142-Y156 WeakPolarHBondContact OD1-CE1 3.39Å; D142-Y156 PolarHBondContact OD1-OH 3.23Å; L146-Y156 HydrophobicContact CB-CD1 3.78Å; L146-Y156 HydrophobicContact CB-CE1 4.27Å; L146-Y156 VanDerWaalsContact O-CE1 3.31Å; L146-Y156 WeakPolarHBondContact O-CE1 3.45Å; P148-Y156 HydrophobicContact CB-CD2 3.57Å; P148-Y156 HydrophobicContact CB-CE2 3.68Å; P148-Y156 VanDerWaalsContact CD-CE2 3.47Å; P148-Y156 HydrophobicContact CG-CD2 4.13Å; P148-Y156 HydrophobicContact CG-CE2 3.72Å; Y154-Y156 VanDerWaalsContact C-N 3.31Å; Y154-Y156 PolarHBondContact O-N 3.32Å; Y154-Y156 VanDerWaalsContact O-N 3.1Å; Y154-Y156 WeakPolarHBondContact OH-CB 3.22Å; Y156-V158 PolarHBondContact O-N 2.98Å; Y156-F159 PolarHBondContact O-N 3.22Å; Y156-F159 VanDerWaalsContact O-N 3.09Å; Y156-W160 HydrophobicContact CD2-CB 3.96Å; Y156-W160 HydrophobicContact CE2-CB 3.88Å; Y156-W160 HydrophobicContact CE2-CG 4.21Å; Y156-W160 WeakPolarHBondContact O-CB 3.35Å; Y156-W160 PolarHBondContact O-N 2.87Å |
| 157 | Y | 94.5 | Very high | 92.4 | Very high | 44 Ų | 44 | 48.7 Ų | 48.7 | 17% | 0.173 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -57.4 | -40.3 | -176.4 | 179.1 | -99.6 | 0 | 0 | 0 | 111.7 | I99 P148 R150 A153 Y154 W155 W160 I161 | I99-Y157 HydrophobicContact CD1-CD1 4.2Å; I99-Y157 HydrophobicContact CD1-CE1 3.91Å; P148-Y157 HydrophobicContact CB-CD2 4.34Å; R150-Y157 HydrophobicContact CB-CD2 4.31Å; R150-Y157 HydrophobicContact CB-CE2 3.65Å; A153-Y157 HydrophobicContact CB-CD1 3.57Å; A153-Y157 HydrophobicContact CB-CE1 3.95Å; A153-Y157 HydrophobicContact CB-CG 4.49Å; Y154-Y157 WeakPolarHBondContact O-CA 3.49Å; Y154-Y157 WeakPolarHBondContact O-CB 3.28Å; Y154-Y157 PolarHBondContact O-N 3.37Å; W155-Y157 PolarHBondContact O-N 3.35Å; Y157-W160 HydrophobicContact CD2-CE3 4.21Å; Y157-W160 HydrophobicContact CE2-CE3 4.17Å; Y157-W160 HydrophobicContact CE2-CZ3 4.22Å; Y157-W160 PolarHBondContact O-N 3.06Å; Y157-I161 HydrophobicContact CD1-CG1 4.17Å; Y157-I161 HydrophobicContact CD2-CG1 4.25Å; Y157-I161 HydrophobicContact CE1-CD1 4.48Å; Y157-I161 HydrophobicContact CE1-CG1 3.74Å; Y157-I161 HydrophobicContact CE2-CD1 3.92Å; Y157-I161 HydrophobicContact CE2-CG1 3.79Å; Y157-I161 HydrophobicContact CG-CG1 4.43Å; Y157-I161 WeakPolarHBondContact O-CG1 3.45Å; Y157-I161 PolarHBondContact O-N 3.49Å |
| 158 | V | 95 | Very high | 92.6 | Very high | 0 Ų | 0 | 48.4 Ų | 48.4 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -59.4 | -49 | 175.4 | 177.4 | 0 | 0 | 0 | 0 | 111.3 | A55 A98 I99 I102 Y154 W155 Y156 I161 A162 | A55-V158 HydrophobicContact CB-CB 4.26Å; A55-V158 HydrophobicContact CB-CG1 4.21Å; A55-V158 HydrophobicContact CB-CG2 4.13Å; A98-V158 HydrophobicContact CB-CG1 4.16Å; A98-V158 HydrophobicContact CB-CG2 4.21Å; I99-V158 HydrophobicContact CG1-CB 4.28Å; I99-V158 HydrophobicContact CG1-CG1 3.96Å; I99-V158 HydrophobicContact CG1-CG2 4.13Å; I102-V158 HydrophobicContact CD1-CG1 3.7Å; Y154-V158 PolarHBondContact O-N 3.4Å; Y154-V158 VanDerWaalsContact O-N 3.09Å; W155-V158 PolarHBondContact O-N 2.92Å; Y156-V158 PolarHBondContact O-N 2.98Å; V158-I161 PolarHBondContact O-N 3.37Å; V158-A162 WeakPolarHBondContact O-CB 3.39Å; V158-A162 PolarHBondContact O-N 2.92Å |
| 159 | F | 94.8 | Very high | 92.6 | Very high | 14 Ų | 14 | 47.8 Ų | 47.8 | 6% | 0.061 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -65.9 | -38.8 | 177.7 | -63.7 | -36.4 | 0 | 0 | 0 | 112.5 | V52 V134 L137 L141 W155 Y156 A162 L163 | V52-F159 HydrophobicContact CG2-CE1 4.3Å; V134-F159 HydrophobicContact CG1-CB 4.01Å; V134-F159 WeakPolarHBondContact CG1-O 3.4Å; L137-F159 HydrophobicContact CB-CD2 4.4Å; L137-F159 HydrophobicContact CD1-CD1 4.41Å; L137-F159 HydrophobicContact CD1-CD2 4.49Å; L137-F159 HydrophobicContact CD1-CE1 4.3Å; L137-F159 HydrophobicContact CD1-CE2 4.36Å; L137-F159 HydrophobicContact CD1-CZ 4.28Å; L141-F159 HydrophobicContact CD1-CD2 4.02Å; W155-F159 HydrophobicContact CB-CE2 4.29Å; W155-F159 AromaticContact CE3-CE2 3.88Å; W155-F159 HydrophobicContact CE3-CE2 3.88Å; W155-F159 VanDerWaalsContact O-CD2 3.26Å; W155-F159 WeakPolarHBondContact O-CD2 3.4Å; W155-F159 WeakPolarHBondContact O-CG 3.17Å; W155-F159 PolarHBondContact O-N 3.39Å; Y156-F159 PolarHBondContact O-N 3.22Å; Y156-F159 VanDerWaalsContact O-N 3.09Å; F159-A162 PolarHBondContact O-N 3.42Å; F159-L163 WeakPolarHBondContact O-CB 3.3Å; F159-L163 PolarHBondContact O-N 2.96Å |
| 160 | W | 95.2 | Very high | 92.7 | Very high | 106 Ų | 106 | 48.9 Ų | 48.9 | 40% | 0.402 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -63.7 | -43.6 | 177.3 | -175.8 | 76.1 | 0 | 0 | 0 | 112.2 | P148 Y156 Y157 L163 L164 | P148-W160 HydrophobicContact CB-CB 4.19Å; P148-W160 HydrophobicContact CB-CD2 4.06Å; P148-W160 HydrophobicContact CB-CE3 4.24Å; P148-W160 HydrophobicContact CB-CG 4.03Å; P148-W160 HydrophobicContact CG-CD2 4.17Å; P148-W160 HydrophobicContact CG-CG 4.17Å; Y156-W160 HydrophobicContact CD2-CB 3.96Å; Y156-W160 HydrophobicContact CE2-CB 3.88Å; Y156-W160 HydrophobicContact CE2-CG 4.21Å; Y156-W160 WeakPolarHBondContact O-CB 3.35Å; Y156-W160 PolarHBondContact O-N 2.87Å; Y157-W160 HydrophobicContact CD2-CE3 4.21Å; Y157-W160 HydrophobicContact CE2-CE3 4.17Å; Y157-W160 HydrophobicContact CE2-CZ3 4.22Å; Y157-W160 PolarHBondContact O-N 3.06Å; W160-L163 WeakPolarHBondContact O-CB 3.31Å; W160-L163 PolarHBondContact O-N 3.44Å; W160-L164 PolarHBondContact O-N 3.08Å |
| 161 | I | 95.4 | Very high | 93.1 | Very high | 31 Ų | 31 | 44.7 Ų | 44.7 | 16% | 0.159 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -67.3 | -38.8 | 174.5 | -67 | -63.3 | 0 | 0 | 0 | 111.4 | I99 Y157 V158 L163 L164 S165 | I99-I161 HydrophobicContact CD1-CB 4.11Å; I99-I161 HydrophobicContact CD1-CG1 4.24Å; I99-I161 HydrophobicContact CD1-CG2 4.05Å; I99-I161 HydrophobicContact CG1-CG2 4.46Å; I99-I161 HydrophobicContact CG2-CG2 3.94Å; Y157-I161 HydrophobicContact CD1-CG1 4.17Å; Y157-I161 HydrophobicContact CD2-CG1 4.25Å; Y157-I161 HydrophobicContact CE1-CD1 4.48Å; Y157-I161 HydrophobicContact CE1-CG1 3.74Å; Y157-I161 HydrophobicContact CE2-CD1 3.92Å; Y157-I161 HydrophobicContact CE2-CG1 3.79Å; Y157-I161 HydrophobicContact CG-CG1 4.43Å; Y157-I161 WeakPolarHBondContact O-CG1 3.45Å; Y157-I161 PolarHBondContact O-N 3.49Å; V158-I161 PolarHBondContact O-N 3.37Å; I161-L163 VanDerWaalsContact C-N 3.34Å; I161-L164 PolarHBondContact O-N 2.96Å; I161-S165 WeakPolarHBondContact O-CB 3.38Å; I161-S165 PolarHBondContact O-N 3.44Å; I161-S165 PolarHBondContact O-OG 3.13Å |
| 162 | A | 95.2 | Very high | 93.1 | Very high | 8 Ų | 8 | 42.9 Ų | 42.9 | 7% | 0.066 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -60.9 | -44.3 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | I102 V158 F159 S165 F166 | I102-A162 HydrophobicContact CG2-CB 4.45Å; V158-A162 WeakPolarHBondContact O-CB 3.39Å; V158-A162 PolarHBondContact O-N 2.92Å; F159-A162 PolarHBondContact O-N 3.42Å; A162-S165 PolarHBondContact O-N 2.98Å; A162-F166 HydrophobicContact CB-CE2 4.06Å; A162-F166 HydrophobicContact CB-CZ 3.99Å; A162-F166 WeakPolarHBondContact O-CB 3.43Å; A162-F166 VanDerWaalsContact O-CD1 3.31Å; A162-F166 WeakPolarHBondContact O-CD1 3.27Å; A162-F166 WeakPolarHBondContact O-CD2 3.01Å; A162-F166 WeakPolarHBondContact O-CG 3.05Å; A162-F166 PolarHBondContact O-N 3.41Å |
| 163 | L | 96.1 | Very high | 93.3 | Very high | 31 Ų | 31 | 44.1 Ų | 44.1 | 16% | 0.162 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -58.9 | -48.9 | 176.4 | 179 | 58.8 | 0 | 0 | 0 | 112 | I131 V134 T135 F159 W160 I161 S165 F166 T167 | I131-L163 HydrophobicContact CG2-CD1 3.94Å; V134-L163 HydrophobicContact CG1-CB 3.78Å; T135-L163 VanDerWaalsContact OG1-CD1 3.31Å; T135-L163 WeakPolarHBondContact OG1-CD1 3.32Å; F159-L163 WeakPolarHBondContact O-CB 3.3Å; F159-L163 PolarHBondContact O-N 2.96Å; W160-L163 WeakPolarHBondContact O-CB 3.31Å; W160-L163 PolarHBondContact O-N 3.44Å; I161-L163 VanDerWaalsContact C-N 3.34Å; L163-S165 VanDerWaalsContact C-N 3.34Å; L163-S165 PolarHBondContact O-N 2.88Å; L163-F166 PolarHBondContact O-N 3.29Å; L163-T167 WeakPolarHBondContact O-CB 3.44Å; L163-T167 PolarHBondContact O-N 3.47Å; L163-T167 PolarHBondContact O-OG1 3Å |
| 164 | L | 94.8 | Very high | 93.2 | Very high | 83 Ų | 83 | 47.5 Ų | 47.5 | 44% | 0.435 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -58.7 | -49 | 177.6 | -177.6 | 60.9 | 0 | 0 | 0 | 110.4 | W160 I161 F166 T167 D168 | W160-L164 PolarHBondContact O-N 3.08Å; I161-L164 PolarHBondContact O-N 2.96Å; L164-F166 PolarHBondContact O-N 3.36Å; L164-T167 WeakPolarHBondContact O-CB 3.31Å; L164-T167 PolarHBondContact O-N 3.37Å; L164-D168 PolarHBondContact O-N 3.49Å |
| 165 | S | 94.5 | Very high | 93.1 | Very high | 51 Ų | 51 | 50.7 Ų | 50.7 | 36% | 0.357 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -62.6 | -42.1 | -179.2 | -56.1 | 0 | 0 | 0 | 0 | 112.6 | I161 A162 L163 T167 D168 V169 | I161-S165 WeakPolarHBondContact O-CB 3.38Å; I161-S165 PolarHBondContact O-N 3.44Å; I161-S165 PolarHBondContact O-OG 3.13Å; A162-S165 PolarHBondContact O-N 2.98Å; L163-S165 VanDerWaalsContact C-N 3.34Å; L163-S165 PolarHBondContact O-N 2.88Å; S165-T167 VanDerWaalsContact C-N 3.34Å; S165-D168 PolarHBondContact O-N 3.07Å; S165-V169 VanDerWaalsContact O-CG2 3.3Å; S165-V169 WeakPolarHBondContact O-CG2 3.38Å; S165-V169 PolarHBondContact O-N 3.27Å |
| 166 | F | 94.3 | Very high | 92.7 | Very high | 12 Ų | 12 | 49.5 Ų | 49.5 | 5% | 0.053 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -67.7 | -37.9 | 178.3 | -60.9 | -14.8 | 0 | 0 | 0 | 111.5 | I102 V106 I127 L130 I131 V134 A162 L163 L164 V169 F170 | I102-F166 HydrophobicContact CG2-CE1 4.25Å; I102-F166 HydrophobicContact CG2-CZ 3.72Å; V106-F166 HydrophobicContact CB-CE1 4.38Å; V106-F166 HydrophobicContact CG2-CD1 4.17Å; V106-F166 HydrophobicContact CG2-CE1 3.44Å; V106-F166 VanDerWaalsContact CG2-CE1 3.44Å; V106-F166 HydrophobicContact CG2-CZ 3.95Å; I127-F166 HydrophobicContact CG2-CB 4.4Å; L130-F166 HydrophobicContact CB-CD2 3.85Å; L130-F166 HydrophobicContact CB-CE2 3.96Å; L130-F166 HydrophobicContact CD1-CE2 4.44Å; I131-F166 HydrophobicContact CD1-CB 4.37Å; I131-F166 HydrophobicContact CG1-CB 3.65Å; V134-F166 HydrophobicContact CG2-CD2 4.27Å; V134-F166 HydrophobicContact CG2-CE2 3.91Å; A162-F166 HydrophobicContact CB-CE2 4.06Å; A162-F166 HydrophobicContact CB-CZ 3.99Å; A162-F166 WeakPolarHBondContact O-CB 3.43Å; A162-F166 VanDerWaalsContact O-CD1 3.31Å; A162-F166 WeakPolarHBondContact O-CD1 3.27Å; A162-F166 WeakPolarHBondContact O-CD2 3.01Å; A162-F166 WeakPolarHBondContact O-CG 3.05Å; A162-F166 PolarHBondContact O-N 3.41Å; L163-F166 PolarHBondContact O-N 3.29Å; L164-F166 PolarHBondContact O-N 3.36Å; F166-V169 PolarHBondContact O-N 2.86Å; F166-F170 VanDerWaalsContact O-CB 3.31Å; F166-F170 WeakPolarHBondContact O-CB 3.38Å; F166-F170 PolarHBondContact O-N 2.94Å |
| 167 | T | 95.5 | Very high | 92.3 | Very high | 49 Ų | 49 | 51.6 Ų | 51.6 | 30% | 0.301 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -62.2 | -45.7 | 174.3 | -56.4 | 0 | 0 | 0 | 0 | 110.5 | L163 L164 S165 F170 L171 | L163-T167 WeakPolarHBondContact O-CB 3.44Å; L163-T167 PolarHBondContact O-N 3.47Å; L163-T167 PolarHBondContact O-OG1 3Å; L164-T167 WeakPolarHBondContact O-CB 3.31Å; L164-T167 PolarHBondContact O-N 3.37Å; S165-T167 VanDerWaalsContact C-N 3.34Å; T167-F170 PolarHBondContact O-N 3.35Å; T167-L171 HydrophobicContact CG2-CD1 4.13Å; T167-L171 HydrophobicContact CG2-CG 4.45Å; T167-L171 VanDerWaalsContact O-CG 3.31Å; T167-L171 WeakPolarHBondContact O-CG 3.29Å; T167-L171 PolarHBondContact O-N 3.3Å |
| 168 | D | 92.8 | Very high | 92 | Very high | 79 Ų | 79 | 53.8 Ų | 53.8 | 42% | 0.422 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -61.5 | -47.2 | 177.8 | -70.1 | -21.8 | 0 | 0 | 0 | 111.9 | L164 S165 F170 L171 L172 | L164-D168 PolarHBondContact O-N 3.49Å; S165-D168 PolarHBondContact O-N 3.07Å; D168-F170 VanDerWaalsContact C-N 3.3Å; D168-F170 PolarHBondContact O-N 3.06Å; D168-L171 PolarHBondContact O-N 3.11Å; D168-L172 WeakPolarHBondContact O-CB 3.47Å; D168-L172 VanDerWaalsContact O-CG 3.3Å; D168-L172 WeakPolarHBondContact O-CG 3.45Å; D168-L172 PolarHBondContact O-N 3.36Å |
| 169 | V | 91.5 | Very high | 91.5 | Very high | 36 Ų | 36 | 55.4 Ų | 55.4 | 22% | 0.218 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -60.7 | -41.4 | 176.2 | 173.9 | 0 | 0 | 0 | 0 | 111 | L110 I127 S165 F166 L172 L173 | L110-V169 HydrophobicContact CD1-CG1 3.81Å; L110-V169 HydrophobicContact CD2-CG1 3.99Å; L110-V169 HydrophobicContact CG-CG1 4.44Å; I127-V169 HydrophobicContact CD1-CG1 3.69Å; S165-V169 VanDerWaalsContact O-CG2 3.3Å; S165-V169 WeakPolarHBondContact O-CG2 3.38Å; S165-V169 PolarHBondContact O-N 3.27Å; F166-V169 PolarHBondContact O-N 2.86Å; V169-L172 PolarHBondContact O-N 3.49Å; V169-L173 WeakPolarHBondContact O-CB 3.3Å; V169-L173 PolarHBondContact O-N 2.96Å |
| 170 | F | 92.3 | Very high | 90.8 | Very high | 56 Ų | 56 | 57.7 Ų | 57.7 | 25% | 0.246 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -64.6 | -43.7 | 177.7 | -174.5 | -97 | 0 | 0 | 0 | 112 | I127 A128 I131 F166 T167 D168 L173 M174 | I127-F170 HydrophobicContact CB-CD2 4.47Å; I127-F170 HydrophobicContact CG2-CB 3.92Å; I127-F170 HydrophobicContact CG2-CD2 4.2Å; A128-F170 HydrophobicContact CB-CE2 4.12Å; I131-F170 HydrophobicContact CD1-CB 3.78Å; I131-F170 HydrophobicContact CD1-CG 4.09Å; F166-F170 VanDerWaalsContact O-CB 3.31Å; F166-F170 WeakPolarHBondContact O-CB 3.38Å; F166-F170 PolarHBondContact O-N 2.94Å; T167-F170 PolarHBondContact O-N 3.35Å; D168-F170 VanDerWaalsContact C-N 3.3Å; D168-F170 PolarHBondContact O-N 3.06Å; F170-L173 WeakPolarHBondContact O-CB 3.41Å; F170-L173 PolarHBondContact O-N 2.92Å; F170-M174 HydrophobicContact CD1-CG 4.26Å; F170-M174 HydrophobicContact CD2-CE 4.46Å; F170-M174 HydrophobicContact CE1-CE 4.21Å; F170-M174 HydrophobicContact CE1-CG 3.96Å; F170-M174 HydrophobicContact CE1-SD 4.42Å; F170-M174 HydrophobicContact CE2-CE 3.84Å; F170-M174 HydrophobicContact CZ-CE 3.69Å; F170-M174 HydrophobicContact CZ-CG 4.39Å; F170-M174 HydrophobicContact CZ-SD 4.33Å; F170-M174 WeakPolarHBondContact O-CG 3.44Å; F170-M174 PolarHBondContact O-N 2.81Å |
| 171 | L | 92.8 | Very high | 90.3 | Very high | 97 Ų | 97 | 58.1 Ų | 58.1 | 51% | 0.508 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -63 | -44.6 | 176.2 | -71.9 | 173.3 | 0 | 0 | 0 | 111.4 | T167 D168 L173 M174 V175 | T167-L171 HydrophobicContact CG2-CD1 4.13Å; T167-L171 HydrophobicContact CG2-CG 4.45Å; T167-L171 VanDerWaalsContact O-CG 3.31Å; T167-L171 WeakPolarHBondContact O-CG 3.29Å; T167-L171 PolarHBondContact O-N 3.3Å; D168-L171 PolarHBondContact O-N 3.11Å; L171-L173 VanDerWaalsContact C-N 3.31Å; L171-L173 PolarHBondContact O-N 3.46Å; L171-M174 WeakPolarHBondContact O-CB 3.2Å; L171-M174 PolarHBondContact O-N 3.28Å; L171-M174 VanDerWaalsContact O-N 3.17Å; L171-V175 WeakPolarHBondContact O-CG2 3.4Å; L171-V175 PolarHBondContact O-N 3.2Å |
| 172 | L | 88.8 | Confident | 89.8 | Confident | 103 Ų | 103 | 62.8 Ų | 62.8 | 54% | 0.539 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -59.5 | -42.8 | 174.7 | -72.7 | 171.2 | 0 | 0 | 0 | 111.3 | D168 V169 M174 V175 T176 | D168-L172 WeakPolarHBondContact O-CB 3.47Å; D168-L172 VanDerWaalsContact O-CG 3.3Å; D168-L172 WeakPolarHBondContact O-CG 3.45Å; D168-L172 PolarHBondContact O-N 3.36Å; V169-L172 PolarHBondContact O-N 3.49Å; L172-M174 VanDerWaalsContact C-N 3.33Å; L172-M174 PolarHBondContact O-N 2.81Å; L172-V175 PolarHBondContact O-N 3.43Å; L172-T176 PolarHBondContact O-N 2.82Å; L172-T176 PolarHBondContact O-OG1 3.17Å |
| 173 | L | 87.8 | Confident | 88.9 | Confident | 32 Ų | 32 | 65 Ų | 65 | 17% | 0.168 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -59.5 | -43.7 | 175.3 | -171.4 | 67.7 | 0 | 0 | 0 | 111.6 | V120 V169 F170 L171 T176 V177 | V120-L173 HydrophobicContact CG1-CD1 3.9Å; V120-L173 HydrophobicContact CG1-CD2 4.3Å; V120-L173 HydrophobicContact CG1-CG 4.22Å; V169-L173 WeakPolarHBondContact O-CB 3.3Å; V169-L173 PolarHBondContact O-N 2.96Å; F170-L173 WeakPolarHBondContact O-CB 3.41Å; F170-L173 PolarHBondContact O-N 2.92Å; L171-L173 VanDerWaalsContact C-N 3.31Å; L171-L173 PolarHBondContact O-N 3.46Å; L173-T176 PolarHBondContact O-N 2.88Å; L173-V177 WeakPolarHBondContact O-CG2 3.3Å; L173-V177 PolarHBondContact O-N 3.28Å |
| 174 | M | 89.6 | Confident | 88.1 | Confident | 73 Ų | 73 | 71.5 Ų | 71.5 | 36% | 0.36 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -62.4 | -45.3 | 176.2 | -68.3 | -61.7 | 118.7 | 0 | 0 | 111.7 | F170 L171 L172 T176 V177 I178 | F170-M174 HydrophobicContact CD1-CG 4.26Å; F170-M174 HydrophobicContact CD2-CE 4.46Å; F170-M174 HydrophobicContact CE1-CE 4.21Å; F170-M174 HydrophobicContact CE1-CG 3.96Å; F170-M174 HydrophobicContact CE1-SD 4.42Å; F170-M174 HydrophobicContact CE2-CE 3.84Å; F170-M174 HydrophobicContact CZ-CE 3.69Å; F170-M174 HydrophobicContact CZ-CG 4.39Å; F170-M174 HydrophobicContact CZ-SD 4.33Å; F170-M174 WeakPolarHBondContact O-CG 3.44Å; F170-M174 PolarHBondContact O-N 2.81Å; L171-M174 WeakPolarHBondContact O-CB 3.2Å; L171-M174 PolarHBondContact O-N 3.28Å; L171-M174 VanDerWaalsContact O-N 3.17Å; L172-M174 VanDerWaalsContact C-N 3.33Å; L172-M174 PolarHBondContact O-N 2.81Å; M174-T176 VanDerWaalsContact C-N 3.31Å; M174-T176 PolarHBondContact O-N 2.97Å; M174-V177 PolarHBondContact O-N 2.97Å; M174-I178 WeakPolarHBondContact O-CB 3.33Å; M174-I178 VanDerWaalsContact O-CG1 3.28Å; M174-I178 WeakPolarHBondContact O-CG1 3.39Å; M174-I178 PolarHBondContact O-N 3.28Å |
| 175 | V | 88.6 | Confident | 87.5 | Confident | 92 Ų | 92 | 77.8 Ų | 77.8 | 56% | 0.558 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -59.2 | -44.5 | 176.3 | 171.4 | 0 | 0 | 0 | 0 | 110.7 | L171 L172 I178 A179 | L171-V175 WeakPolarHBondContact O-CG2 3.4Å; L171-V175 PolarHBondContact O-N 3.2Å; L172-V175 PolarHBondContact O-N 3.43Å; V175-I178 PolarHBondContact O-N 3.05Å; V175-A179 WeakPolarHBondContact O-CB 3.37Å; V175-A179 PolarHBondContact O-N 3.28Å |
| 176 | T | 83.6 | Confident | 86.9 | Confident | 35 Ų | 35 | 80.8 Ų | 80.8 | 22% | 0.215 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -62.1 | -44.5 | 176.8 | -56.5 | 0 | 0 | 0 | 0 | 111.8 | L172 L173 M174 A179 F180 | L172-T176 PolarHBondContact O-N 2.82Å; L172-T176 PolarHBondContact O-OG1 3.17Å; L173-T176 PolarHBondContact O-N 2.88Å; M174-T176 VanDerWaalsContact C-N 3.31Å; M174-T176 PolarHBondContact O-N 2.97Å; T176-A179 PolarHBondContact O-N 2.93Å; T176-F180 HydrophobicContact CG2-CD2 3.75Å; T176-F180 HydrophobicContact CG2-CE2 3.38Å; T176-F180 HydrophobicContact CG2-CZ 4.3Å; T176-F180 WeakPolarHBondContact O-CD2 3.4Å; T176-F180 PolarHBondContact O-N 3.35Å |
| 177 | V | 85.5 | Confident | 85.6 | Confident | 51 Ų | 51 | 82.4 Ų | 82.4 | 31% | 0.309 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -62.3 | -44.9 | 176.5 | 170.3 | 0 | 0 | 0 | 0 | 111.2 | V120 L173 M174 A179 F180 L181 | V120-V177 HydrophobicContact CG1-CG2 3.84Å; L173-V177 WeakPolarHBondContact O-CG2 3.3Å; L173-V177 PolarHBondContact O-N 3.28Å; M174-V177 PolarHBondContact O-N 2.97Å; V177-A179 PolarHBondContact O-N 3.43Å; V177-F180 WeakPolarHBondContact O-CB 3.38Å; V177-F180 PolarHBondContact O-N 3.42Å; V177-L181 HydrophobicContact CG1-CD1 4.28Å; V177-L181 HydrophobicContact CG1-CG 4.48Å; V177-L181 WeakPolarHBondContact O-CG 3.48Å; V177-L181 PolarHBondContact O-N 3.43Å |
| 178 | I | 87.5 | Confident | 83.7 | Confident | 90 Ų | 90 | 84.6 Ų | 84.6 | 46% | 0.462 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -60.8 | -46.2 | 177.1 | -69.4 | 166.1 | 0 | 0 | 0 | 110.5 | M174 V175 F180 L181 F182 | M174-I178 WeakPolarHBondContact O-CB 3.33Å; M174-I178 VanDerWaalsContact O-CG1 3.28Å; M174-I178 WeakPolarHBondContact O-CG1 3.39Å; M174-I178 PolarHBondContact O-N 3.28Å; V175-I178 PolarHBondContact O-N 3.05Å; I178-F180 VanDerWaalsContact C-N 3.29Å; I178-F180 PolarHBondContact O-N 2.96Å; I178-L181 WeakPolarHBondContact O-CB 3.31Å; I178-L181 PolarHBondContact O-N 3.35Å; I178-L181 VanDerWaalsContact O-N 3.12Å; I178-F182 HydrophobicContact CG2-CD2 3.72Å; I178-F182 HydrophobicContact CG2-CE2 3.62Å; I178-F182 VanDerWaalsContact O-CD2 3.31Å; I178-F182 WeakPolarHBondContact O-CD2 3.41Å; I178-F182 PolarHBondContact O-N 3.14Å |
| 179 | A | 84.1 | Confident | 81.8 | Confident | 35 Ų | 35 | 86.8 Ų | 86.8 | 29% | 0.289 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -58.8 | -41 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | V175 T176 V177 F182 Y183 L200 | V175-A179 WeakPolarHBondContact O-CB 3.37Å; V175-A179 PolarHBondContact O-N 3.28Å; T176-A179 PolarHBondContact O-N 2.93Å; V177-A179 PolarHBondContact O-N 3.43Å; A179-F182 PolarHBondContact O-N 3.05Å; A179-Y183 WeakPolarHBondContact O-CB 3.47Å; A179-Y183 PolarHBondContact O-N 2.92Å; A179-L200 HydrophobicContact CB-CD2 3.94Å |
| 180 | F | 80 | Confident | 79.9 | Confident | 61 Ų | 61 | 88.7 Ų | 88.7 | 27% | 0.268 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -64.1 | -40.4 | 173.8 | -79.1 | -52.8 | 0 | 0 | 0 | 113.2 | T176 V177 I178 F182 Y183 Y184 Y197 L200 | T176-F180 HydrophobicContact CG2-CD2 3.75Å; T176-F180 HydrophobicContact CG2-CE2 3.38Å; T176-F180 HydrophobicContact CG2-CZ 4.3Å; T176-F180 WeakPolarHBondContact O-CD2 3.4Å; T176-F180 PolarHBondContact O-N 3.35Å; V177-F180 WeakPolarHBondContact O-CB 3.38Å; V177-F180 PolarHBondContact O-N 3.42Å; I178-F180 VanDerWaalsContact C-N 3.29Å; I178-F180 PolarHBondContact O-N 2.96Å; F180-F182 VanDerWaalsContact C-N 3.34Å; F180-Y183 PolarHBondContact O-N 3.39Å; F180-Y184 WeakPolarHBondContact O-CB 3.14Å; F180-Y184 PolarHBondContact O-N 3.48Å; F180-Y197 AromaticContact CE1-CD1 3.59Å; F180-Y197 HydrophobicContact CE1-CD1 3.59Å; F180-Y197 AromaticContact CE1-CE1 3.94Å; F180-Y197 HydrophobicContact CE1-CE1 3.94Å; F180-Y197 AromaticContact CZ-CD1 3.91Å; F180-Y197 HydrophobicContact CZ-CD1 3.91Å; F180-Y197 HydrophobicContact CZ-CE1 4.42Å; F180-L200 HydrophobicContact CD1-CD1 3.75Å; F180-L200 HydrophobicContact CD2-CD1 4.44Å; F180-L200 HydrophobicContact CE1-CD1 3.15Å; F180-L200 HydrophobicContact CE2-CD1 3.97Å; F180-L200 HydrophobicContact CG-CD1 4.35Å; F180-L200 HydrophobicContact CZ-CD1 3.28Å |
| 181 | L | 85.3 | Confident | 77.9 | Confident | 115 Ų | 115 | 94.3 Ų | 94.3 | 60% | 0.602 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -62.9 | -41.9 | 176.1 | -69.1 | 173.7 | 0 | 0 | 0 | 111.5 | V177 I178 R185 | V177-L181 HydrophobicContact CG1-CD1 4.28Å; V177-L181 HydrophobicContact CG1-CG 4.48Å; V177-L181 WeakPolarHBondContact O-CG 3.48Å; V177-L181 PolarHBondContact O-N 3.43Å; I178-L181 WeakPolarHBondContact O-CB 3.31Å; I178-L181 PolarHBondContact O-N 3.35Å; I178-L181 VanDerWaalsContact O-N 3.12Å; L181-R185 WeakPolarHBondContact O-CB 3.38Å; L181-R185 PolarHBondContact O-N 3.27Å |
| 182 | F | 84.2 | Confident | 75.8 | Confident | 129 Ų | 129 | 94 Ų | 94 | 57% | 0.566 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -63.1 | -44.5 | 173.7 | -85.5 | -73.2 | 0 | 0 | 0 | 112 | I178 A179 F180 R185 N186 | I178-F182 HydrophobicContact CG2-CD2 3.72Å; I178-F182 HydrophobicContact CG2-CE2 3.62Å; I178-F182 VanDerWaalsContact O-CD2 3.31Å; I178-F182 WeakPolarHBondContact O-CD2 3.41Å; I178-F182 PolarHBondContact O-N 3.14Å; A179-F182 PolarHBondContact O-N 3.05Å; F180-F182 VanDerWaalsContact C-N 3.34Å; F182-R185 PolarHBondContact O-N 3.48Å; F182-N186 WeakPolarHBondContact O-CB 3.41Å; F182-N186 PolarHBondContact O-N 3.2Å; F182-N186 PolarHBondContact O-ND2 3.26Å |
| 183 | Y | 77.7 | Confident | 74 | Confident | 55 Ų | 55 | 97.1 Ų | 97.1 | 22% | 0.216 | 48% | 0.482 | C | S | . | . | H | α-helix | trans | -59.3 | -48.7 | 177.9 | -178.5 | -92.7 | 0 | 0 | 0 | 111.8 | A179 F180 N186 L188 T190 M192 Y199 | A179-Y183 WeakPolarHBondContact O-CB 3.47Å; A179-Y183 PolarHBondContact O-N 2.92Å; F180-Y183 PolarHBondContact O-N 3.39Å; Y183-N186 PolarHBondContact O-N 2.79Å; Y183-L188 HydrophobicContact CD2-CB 4.38Å; Y183-L188 HydrophobicContact CD2-CD1 4.27Å; Y183-L188 HydrophobicContact CE1-CB 4.39Å; Y183-L188 HydrophobicContact CE2-CB 3.89Å; Y183-L188 HydrophobicContact CE2-CD1 4.22Å; Y183-L188 PolarHBondContact OH-O 3.46Å; Y183-T190 PolarHBondContact OH-OG1 3.44Å; Y183-M192 PolarHBondContact OH-SD 2.98Å; Y183-Y199 HydrophobicContact CD2-CE2 4.35Å; Y183-Y199 AromaticContact CD2-CZ 3.88Å; Y183-Y199 WeakPolarHBondContact CD2-OH 3.39Å; Y183-Y199 HydrophobicContact CE2-CE1 4.28Å; Y183-Y199 AromaticContact CE2-CZ 3.97Å; Y183-Y199 VanDerWaalsContact CG-OH 3.32Å |
| 184 | Y | 78.1 | Confident | 72.4 | Confident | 168 Ų | 168 | 97.6 Ų | 97.6 | 66% | 0.659 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -66 | -40.5 | 178.4 | -168.2 | -92.7 | 0 | 0 | 0 | 112.2 | F180 N186 G187 H189 | F180-Y184 WeakPolarHBondContact O-CB 3.14Å; F180-Y184 PolarHBondContact O-N 3.48Å; Y184-N186 VanDerWaalsContact C-N 3.34Å; Y184-N186 PolarHBondContact O-N 3.1Å; Y184-G187 PolarHBondContact O-N 3.44Å; Y184-H189 AromaticContact CE2-CE1 3.85Å; Y184-H189 AromaticContact CZ-CE1 3.85Å |
| 185 | R | 83.2 | Confident | 70.4 | Confident | 215 Ų | 215 | 98.8 Ų | 98.8 | 81% | 0.811 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -65.9 | -34.7 | 179.3 | 179.8 | 165.1 | 177.9 | 136 | -0.9 | 113.1 | L181 F182 G187 | L181-R185 WeakPolarHBondContact O-CB 3.38Å; L181-R185 PolarHBondContact O-N 3.27Å; F182-R185 PolarHBondContact O-N 3.48Å; R185-G187 PolarHBondContact O-N 3.43Å |
| 186 | N | 82.1 | Confident | 68.5 | Low | 114 Ų | 114 | 97.8 Ų | 97.8 | 61% | 0.61 | 48% | 0.484 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.8 | 7.8 | 179.3 | -72.5 | -30.3 | 0 | 0 | 0 | 113.5 | F182 Y183 Y184 L188 | F182-N186 WeakPolarHBondContact O-CB 3.41Å; F182-N186 PolarHBondContact O-N 3.2Å; F182-N186 PolarHBondContact O-ND2 3.26Å; Y183-N186 PolarHBondContact O-N 2.79Å; Y184-N186 VanDerWaalsContact C-N 3.34Å; Y184-N186 PolarHBondContact O-N 3.1Å; N186-L188 HydrophobicContact CB-CD1 4.45Å; N186-L188 PolarHBondContact O-N 2.94Å; N186-L188 VanDerWaalsContact O-N 3.15Å |
| 187 | G | 66.2 | Low | 67.1 | Low | 45 Ų | 45 | 102 Ų | 102 | 46% | 0.464 | 50% | 0.497 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 67 | 19.8 | 169.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | Y184 R185 H189 | Y184-G187 PolarHBondContact O-N 3.44Å; R185-G187 PolarHBondContact O-N 3.43Å; G187-H189 PolarHBondContact O-N 3.24Å |
| 188 | L | 56.6 | Low | 65.5 | Low | 96 Ų | 96 | 106 Ų | 106 | 50% | 0.503 | 51% | 0.507 | S | S | . | . | trans | -71.9 | 58.6 | 167 | -76.3 | 145.9 | 0 | 0 | 0 | 109.1 | Y183 N186 T190 | Y183-L188 HydrophobicContact CD2-CB 4.38Å; Y183-L188 HydrophobicContact CD2-CD1 4.27Å; Y183-L188 HydrophobicContact CE1-CB 4.39Å; Y183-L188 HydrophobicContact CE2-CB 3.89Å; Y183-L188 HydrophobicContact CE2-CD1 4.22Å; Y183-L188 PolarHBondContact OH-O 3.46Å; N186-L188 HydrophobicContact CB-CD1 4.45Å; N186-L188 PolarHBondContact O-N 2.94Å; N186-L188 VanDerWaalsContact O-N 3.15Å; L188-T190 PolarHBondContact O-N 2.92Å | ||
| 189 | H | 51.8 | Low | 63.8 | Low | 124 Ų | 124 | 105.7 Ų | 105.7 | 57% | 0.574 | 50% | 0.501 | S | S | * | . | trans | -76.7 | 44 | 169.9 | -66.4 | -80.6 | 0 | 0 | 0 | 110.2 | Y184 G187 N191 | Y184-H189 AromaticContact CE2-CE1 3.85Å; Y184-H189 AromaticContact CZ-CE1 3.85Å; G187-H189 PolarHBondContact O-N 3.24Å; H189-N191 PolarHBondContact O-N 3.49Å | ||
| 190 | T | 51.5 | Low | 62.4 | Low | 76 Ų | 76 | 106.5 Ų | 106.5 | 47% | 0.466 | 50% | 0.5 | S | S | . | . | trans | -58 | 136.4 | 159.1 | 43.5 | 0 | 0 | 0 | 0 | 106.1 | Y183 L188 M192 | Y183-T190 PolarHBondContact OH-OG1 3.44Å; L188-T190 PolarHBondContact O-N 2.92Å; T190-M192 PolarHBondContact O-N 3.4Å; T190-M192 WeakPolarHBondContact OG1-CE 3.23Å; T190-M192 WeakPolarHBondContact OG1-CG 3.46Å | ||
| 191 | N | 51 | Low | 61.1 | Low | 175 Ų | 175 | 111.5 Ų | 111.5 | 94% | 0.936 | 52% | 0.518 | S | S | * | . | trans | -61.2 | 59.2 | 173.1 | -83 | -49.6 | 0 | 0 | 0 | 110.2 | H189 R193 | H189-N191 PolarHBondContact O-N 3.49Å; N191-R193 PolarHBondContact O-N 3.31Å | ||
| 192 | M | 49.8 | Very low | 59.8 | Low | 91 Ų | 91 | 109.6 Ų | 109.6 | 45% | 0.448 | 51% | 0.508 | S | S | . | . | trans | -83.9 | 109.7 | -176.1 | -91.1 | -164 | -166 | 0 | 0 | 105.4 | Y183 T190 D196 | Y183-M192 PolarHBondContact OH-SD 2.98Å; T190-M192 PolarHBondContact O-N 3.4Å; T190-M192 WeakPolarHBondContact OG1-CE 3.23Å; T190-M192 WeakPolarHBondContact OG1-CG 3.46Å; M192-D196 VanDerWaalsContact C-OD2 3.3Å; M192-D196 WeakPolarHBondContact CA-OD2 3.34Å; M192-D196 HydrophobicContact CB-CB 3.69Å; M192-D196 VanDerWaalsContact CB-OD2 3.24Å; M192-D196 WeakPolarHBondContact CB-OD2 3.37Å; M192-D196 HydrophobicContact CG-CB 3.51Å; M192-D196 VanDerWaalsContact CG-OD2 3.23Å; M192-D196 WeakPolarHBondContact CG-OD2 3.23Å; M192-D196 HydrophobicContact SD-CB 3.39Å; M192-D196 WeakPolarHBondContact SD-CB 3.34Å | ||
| 193 | R | 50.1 | Low | 58.8 | Low | 168 Ų | 168 | 104.8 Ų | 104.8 | 63% | 0.634 | 50% | 0.495 | S | S | * | . | trans | -57.5 | 158.2 | 173.6 | -168.4 | 167.9 | 169.5 | 152 | -1.2 | 106 | N191 E195 D196 | N191-R193 PolarHBondContact O-N 3.31Å; R193-E195 HydrophobicContact CB-CB 4.41Å; R193-E195 HydrophobicContact CG-CB 4.43Å; R193-E195 HydrophobicContact CG-CG 4.36Å; R193-E195 IonicContact CZ-OE1 2.95Å; R193-E195 VanDerWaalsContact NE-CD 3.33Å; R193-E195 IonicContact NE-OE1 2.82Å; R193-E195 PolarHBondContact NE-OE1 3.44Å; R193-E195 IonicContact NE-OE2 3.44Å; R193-E195 PolarHBondContact NE-OE2 2.83Å; R193-E195 IonicContact NH2-OE1 3.66Å; R193-E195 PolarHBondContact NH2-OE1 3.46Å; R193-E195 PolarHBondContact O-N 3.26Å; R193-D196 PolarHBondContact N-OD2 3.17Å; R193-D196 PolarHBondContact O-N 3.39Å | ||
| 194 | S | 53.2 | Low | 58.6 | Low | 42 Ų | 42 | 105.7 Ų | 105.7 | 29% | 0.294 | 50% | 0.504 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -54.2 | -6.4 | 172.2 | 57 | 0 | 0 | 0 | 0 | 114.9 | R117 Y197 | R117-S194 PolarHBondContact NH2-OG 3.35Å; S194-Y197 VanDerWaalsContact CA-CE2 3.4Å; S194-Y197 WeakPolarHBondContact O-CD2 3.34Å |
| 195 | E | 48.5 | Very low | 58.7 | Low | 98 Ų | 98 | 100.7 Ų | 100.7 | 46% | 0.458 | 49% | 0.488 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77 | -25.8 | 172.8 | -71.6 | 159.9 | -151.6 | 0 | 0 | 111.8 | R193 Y197 Y198 | R193-E195 HydrophobicContact CB-CB 4.41Å; R193-E195 HydrophobicContact CG-CB 4.43Å; R193-E195 HydrophobicContact CG-CG 4.36Å; R193-E195 IonicContact CZ-OE1 2.95Å; R193-E195 VanDerWaalsContact NE-CD 3.33Å; R193-E195 IonicContact NE-OE1 2.82Å; R193-E195 PolarHBondContact NE-OE1 3.44Å; R193-E195 IonicContact NE-OE2 3.44Å; R193-E195 PolarHBondContact NE-OE2 2.83Å; R193-E195 IonicContact NH2-OE1 3.66Å; R193-E195 PolarHBondContact NH2-OE1 3.46Å; R193-E195 PolarHBondContact O-N 3.26Å; E195-Y197 VanDerWaalsContact C-N 3.3Å; E195-Y197 PolarHBondContact O-N 2.91Å; E195-Y198 WeakPolarHBondContact O-CD2 3.47Å; E195-Y198 WeakPolarHBondContact O-CE2 3.13Å |
| 196 | D | 49.3 | Very low | 58.6 | Low | 70 Ų | 70 | 98 Ų | 98 | 37% | 0.374 | 48% | 0.478 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.4 | -4.3 | -176.5 | -57.8 | -57.1 | 0 | 0 | 0 | 114.2 | M192 R193 Y198 Y199 | M192-D196 VanDerWaalsContact C-OD2 3.3Å; M192-D196 WeakPolarHBondContact CA-OD2 3.34Å; M192-D196 HydrophobicContact CB-CB 3.69Å; M192-D196 VanDerWaalsContact CB-OD2 3.24Å; M192-D196 WeakPolarHBondContact CB-OD2 3.37Å; M192-D196 HydrophobicContact CG-CB 3.51Å; M192-D196 VanDerWaalsContact CG-OD2 3.23Å; M192-D196 WeakPolarHBondContact CG-OD2 3.23Å; M192-D196 HydrophobicContact SD-CB 3.39Å; M192-D196 WeakPolarHBondContact SD-CB 3.34Å; R193-D196 PolarHBondContact N-OD2 3.17Å; R193-D196 PolarHBondContact O-N 3.39Å; D196-Y198 PolarHBondContact O-N 3.45Å; D196-Y199 VanDerWaalsContact O-CD1 3.23Å; D196-Y199 WeakPolarHBondContact O-CD1 3.26Å; D196-Y199 PolarHBondContact O-N 3.14Å |
| 197 | Y | 54.2 | Low | 58.5 | Low | 124 Ų | 124 | 95.7 Ų | 95.7 | 49% | 0.486 | 46% | 0.464 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.2 | -6.7 | 174.7 | -64.5 | -55.5 | 0 | 0 | 0 | 114 | F180 S194 E195 Y199 | F180-Y197 AromaticContact CE1-CD1 3.59Å; F180-Y197 HydrophobicContact CE1-CD1 3.59Å; F180-Y197 AromaticContact CE1-CE1 3.94Å; F180-Y197 HydrophobicContact CE1-CE1 3.94Å; F180-Y197 AromaticContact CZ-CD1 3.91Å; F180-Y197 HydrophobicContact CZ-CD1 3.91Å; F180-Y197 HydrophobicContact CZ-CE1 4.42Å; S194-Y197 VanDerWaalsContact CA-CE2 3.4Å; S194-Y197 WeakPolarHBondContact O-CD2 3.34Å; E195-Y197 VanDerWaalsContact C-N 3.3Å; E195-Y197 PolarHBondContact O-N 2.91Å; Y197-Y199 PolarHBondContact O-N 2.89Å |
| 198 | Y | 52.3 | Low | 59.3 | Low | 135 Ų | 135 | 93.7 Ų | 93.7 | 53% | 0.529 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -56 | -31.7 | 173.3 | -68.7 | -61.6 | 0 | 0 | 0 | 112.6 | E195 D196 L200 Y201 D202 | E195-Y198 WeakPolarHBondContact O-CD2 3.47Å; E195-Y198 WeakPolarHBondContact O-CE2 3.13Å; D196-Y198 PolarHBondContact O-N 3.45Å; Y198-L200 VanDerWaalsContact C-N 3.25Å; Y198-L200 PolarHBondContact O-N 3.49Å; Y198-Y201 CarbonylContact O-C 3.46Å; Y198-Y201 WeakPolarHBondContact O-CA 3.33Å; Y198-Y201 PolarHBondContact O-N 3.48Å; Y198-D202 WeakPolarHBondContact O-CB 3.36Å; Y198-D202 PolarHBondContact O-N 2.91Å |
| 199 | Y | 51 | Low | 60.7 | Low | 83 Ų | 83 | 90.5 Ų | 90.5 | 33% | 0.325 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -56.2 | -32.5 | -173.4 | 76.3 | -93.6 | 0 | 0 | 0 | 115.1 | Y183 D196 Y197 | Y183-Y199 HydrophobicContact CD2-CE2 4.35Å; Y183-Y199 AromaticContact CD2-CZ 3.88Å; Y183-Y199 WeakPolarHBondContact CD2-OH 3.39Å; Y183-Y199 HydrophobicContact CE2-CE1 4.28Å; Y183-Y199 AromaticContact CE2-CZ 3.97Å; Y183-Y199 VanDerWaalsContact CG-OH 3.32Å; D196-Y199 VanDerWaalsContact O-CD1 3.23Å; D196-Y199 WeakPolarHBondContact O-CD1 3.26Å; D196-Y199 PolarHBondContact O-N 3.14Å; Y197-Y199 PolarHBondContact O-N 2.89Å |
| 200 | L | 53.7 | Low | 62.3 | Low | 52 Ų | 52 | 90.4 Ų | 90.4 | 27% | 0.272 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -71 | -34.1 | 175.9 | -85.3 | 149.2 | 0 | 0 | 0 | 112.4 | A179 F180 Y198 | A179-L200 HydrophobicContact CB-CD2 3.94Å; F180-L200 HydrophobicContact CD1-CD1 3.75Å; F180-L200 HydrophobicContact CD2-CD1 4.44Å; F180-L200 HydrophobicContact CE1-CD1 3.15Å; F180-L200 HydrophobicContact CE2-CD1 3.97Å; F180-L200 HydrophobicContact CG-CD1 4.35Å; F180-L200 HydrophobicContact CZ-CD1 3.28Å; Y198-L200 VanDerWaalsContact C-N 3.25Å; Y198-L200 PolarHBondContact O-N 3.49Å |
| 201 | Y | 54.2 | Low | 63.9 | Low | 166 Ų | 166 | 89.1 Ų | 89.1 | 65% | 0.651 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -87.7 | -17.5 | 176.4 | -68 | -79 | 0 | 0 | 0 | 112.6 | Y198 G203 | Y198-Y201 CarbonylContact O-C 3.46Å; Y198-Y201 WeakPolarHBondContact O-CA 3.33Å; Y198-Y201 PolarHBondContact O-N 3.48Å; Y201-G203 PolarHBondContact O-N 2.85Å |
| 202 | D | 57.2 | Low | 65.4 | Low | 75 Ų | 75 | 82.4 Ų | 82.4 | 40% | 0.401 | 39% | 0.394 | S | S | . | . | trans | -83.1 | 12.9 | 176.7 | -156 | 18.7 | 0 | 0 | 0 | 112.1 | Y198 N204 Q207 | Y198-D202 WeakPolarHBondContact O-CB 3.36Å; Y198-D202 PolarHBondContact O-N 2.91Å; D202-N204 PolarHBondContact O-N 3.26Å; D202-Q207 PolarHBondContact OD1-NE2 3.43Å | ||
| 203 | G | 64.3 | Low | 67.1 | Low | 28 Ų | 28 | 79.7 Ų | 79.7 | 29% | 0.289 | 39% | 0.389 | S | S | . | . | trans | -55.4 | 119.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 109.3 | Y201 L205 W206 Q207 | Y201-G203 PolarHBondContact O-N 2.85Å; G203-L205 PolarHBondContact O-N 2.98Å; G203-W206 PolarHBondContact O-N 3.05Å; G203-Q207 PolarHBondContact O-N 2.95Å | ||
| 204 | N | 72.4 | Confident | 68.9 | Low | 75 Ų | 75 | 77.6 Ų | 77.6 | 40% | 0.401 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -50.1 | -29.6 | -173 | -55.7 | 25.8 | 0 | 0 | 0 | 112.8 | D202 A208 | D202-N204 PolarHBondContact O-N 3.26Å; N204-A208 WeakPolarHBondContact O-CB 3.36Å; N204-A208 PolarHBondContact O-N 2.84Å |
| 205 | L | 81.2 | Confident | 70.5 | Confident | 62 Ų | 62 | 79.1 Ų | 79.1 | 33% | 0.325 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -69 | -43 | 176.9 | -177.4 | 60.6 | 0 | 0 | 0 | 113.2 | G203 A208 I209 S254 A257 | G203-L205 PolarHBondContact O-N 2.98Å; L205-A208 WeakPolarHBondContact O-CB 3.5Å; L205-A208 PolarHBondContact O-N 2.89Å; L205-I209 HydrophobicContact CD1-CD1 4.01Å; L205-I209 HydrophobicContact CD1-CG1 4.24Å; L205-I209 HydrophobicContact CG-CD1 3.96Å; L205-I209 VanDerWaalsContact O-CG1 3.27Å; L205-I209 WeakPolarHBondContact O-CG1 3.5Å; L205-I209 PolarHBondContact O-N 3.36Å; L205-S254 WeakPolarHBondContact CD1-O 3.35Å; L205-A257 HydrophobicContact CD1-CB 3.92Å |
| 206 | W | 79.6 | Confident | 72.4 | Confident | 159 Ų | 159 | 76.8 Ų | 76.8 | 60% | 0.602 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -65.5 | -43 | 178.6 | -83.2 | 116.2 | 0 | 0 | 0 | 111.4 | G203 I209 N210 | G203-W206 PolarHBondContact O-N 3.05Å; W206-I209 PolarHBondContact O-N 3.25Å; W206-N210 WeakPolarHBondContact O-CB 3.39Å; W206-N210 VanDerWaalsContact O-CG 3.24Å; W206-N210 PolarHBondContact O-N 3.35Å; W206-N210 PolarHBondContact O-ND2 3.43Å |
| 207 | Q | 81 | Confident | 74.3 | Confident | 66 Ų | 66 | 79.1 Ų | 79.1 | 31% | 0.308 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -62.7 | -45.9 | 174 | -64.1 | -157.2 | -19.3 | 0 | 0 | 111.7 | D202 G203 I209 N210 A211 W261 | D202-Q207 PolarHBondContact OD1-NE2 3.43Å; G203-Q207 PolarHBondContact O-N 2.95Å; Q207-I209 VanDerWaalsContact C-N 3.33Å; Q207-I209 PolarHBondContact O-N 3.35Å; Q207-N210 PolarHBondContact O-N 2.87Å; Q207-N210 VanDerWaalsContact O-N 3.14Å; Q207-A211 WeakPolarHBondContact O-CB 3.28Å; Q207-A211 PolarHBondContact O-N 2.89Å; Q207-W261 HydrophobicContact CB-CH2 4.02Å; Q207-W261 HydrophobicContact CB-CZ2 3.88Å; Q207-W261 HydrophobicContact CB-CZ3 4.45Å |
| 208 | A | 83.4 | Confident | 76.1 | Confident | 3 Ų | 3 | 77.8 Ų | 77.8 | 3% | 0.025 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -55.8 | -45.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | N204 L205 A257 W261 | N204-A208 WeakPolarHBondContact O-CB 3.36Å; N204-A208 PolarHBondContact O-N 2.84Å; L205-A208 WeakPolarHBondContact O-CB 3.5Å; L205-A208 PolarHBondContact O-N 2.89Å; A208-A257 HydrophobicContact CB-CB 4.29Å; A208-A257 WeakPolarHBondContact CB-O 3.3Å; A208-W261 HydrophobicContact CB-CB 3.41Å; A208-W261 VanDerWaalsContact CB-CB 3.41Å; A208-W261 HydrophobicContact CB-CD2 4.32Å; A208-W261 HydrophobicContact CB-CG 3.85Å |
| 209 | I | 86.1 | Confident | 77.9 | Confident | 28 Ų | 28 | 73 Ų | 73 | 14% | 0.144 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -65.5 | -45.7 | 176.8 | -68.3 | 167.4 | 0 | 0 | 0 | 110 | L205 W206 Q207 A211 S212 G213 Y216 A257 | L205-I209 HydrophobicContact CD1-CD1 4.01Å; L205-I209 HydrophobicContact CD1-CG1 4.24Å; L205-I209 HydrophobicContact CG-CD1 3.96Å; L205-I209 VanDerWaalsContact O-CG1 3.27Å; L205-I209 WeakPolarHBondContact O-CG1 3.5Å; L205-I209 PolarHBondContact O-N 3.36Å; W206-I209 PolarHBondContact O-N 3.25Å; Q207-I209 VanDerWaalsContact C-N 3.33Å; Q207-I209 PolarHBondContact O-N 3.35Å; I209-A211 VanDerWaalsContact C-N 3.31Å; I209-A211 PolarHBondContact O-N 3.25Å; I209-S212 CarbonylContact O-C 3.54Å; I209-S212 PolarHBondContact O-N 3.48Å; I209-G213 WeakPolarHBondContact O-CA 3.11Å; I209-G213 PolarHBondContact O-N 3.41Å; I209-Y216 HydrophobicContact CD1-CE1 4.2Å; I209-Y216 HydrophobicContact CD1-CE2 4.44Å; I209-Y216 HydrophobicContact CG1-CD1 4.34Å; I209-Y216 HydrophobicContact CG1-CD2 4.23Å; I209-Y216 HydrophobicContact CG1-CE1 4.22Å; I209-Y216 HydrophobicContact CG1-CE2 4.12Å; I209-Y216 HydrophobicContact CG1-CG 4.34Å; I209-Y216 HydrophobicContact CG2-CD1 3.78Å; I209-Y216 HydrophobicContact CG2-CE1 4.12Å; I209-Y216 HydrophobicContact CG2-CG 4.2Å; I209-A257 HydrophobicContact CG1-CB 3.88Å |
| 210 | N | 83.6 | Confident | 79.8 | Confident | 122 Ų | 122 | 69.9 Ų | 69.9 | 65% | 0.652 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -65.5 | -32.6 | -178.3 | -74 | -18.8 | 0 | 0 | 0 | 113.3 | W206 Q207 S212 | W206-N210 WeakPolarHBondContact O-CB 3.39Å; W206-N210 VanDerWaalsContact O-CG 3.24Å; W206-N210 PolarHBondContact O-N 3.35Å; W206-N210 PolarHBondContact O-ND2 3.43Å; Q207-N210 PolarHBondContact O-N 2.87Å; Q207-N210 VanDerWaalsContact O-N 3.14Å; N210-S212 VanDerWaalsContact C-N 3.28Å; N210-S212 PolarHBondContact O-N 2.88Å |
| 211 | A | 85.1 | Confident | 81.5 | Confident | 50 Ų | 50 | 71.2 Ų | 71.2 | 41% | 0.413 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -60.1 | -38.9 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | Q207 I209 W261 L264 | Q207-A211 WeakPolarHBondContact O-CB 3.28Å; Q207-A211 PolarHBondContact O-N 2.89Å; I209-A211 VanDerWaalsContact C-N 3.31Å; I209-A211 PolarHBondContact O-N 3.25Å; A211-W261 HydrophobicContact CB-CE3 3.37Å; A211-W261 HydrophobicContact CB-CZ3 3.28Å; A211-L264 HydrophobicContact CB-CD1 3.72Å |
| 212 | S | 83.3 | Confident | 83.3 | Confident | 34 Ų | 34 | 67.4 Ų | 67.4 | 24% | 0.238 | 37% | 0.37 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -129.7 | 42.1 | -174 | -65.6 | 0 | 0 | 0 | 0 | 110.7 | I209 N210 L214 S215 Y216 | I209-S212 CarbonylContact O-C 3.54Å; I209-S212 PolarHBondContact O-N 3.48Å; N210-S212 VanDerWaalsContact C-N 3.28Å; N210-S212 PolarHBondContact O-N 2.88Å; S212-L214 VanDerWaalsContact C-N 3.26Å; S212-L214 PolarHBondContact O-N 3.02Å; S212-S215 PolarHBondContact O-N 2.88Å; S212-Y216 PolarHBondContact O-N 3.49Å |
| 213 | G | 85.6 | Confident | 84.8 | Confident | 34 Ų | 34 | 67.4 Ų | 67.4 | 35% | 0.351 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -55.5 | -38.9 | -170.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | I209 F217 | I209-G213 WeakPolarHBondContact O-CA 3.11Å; I209-G213 PolarHBondContact O-N 3.41Å; G213-F217 VanDerWaalsContact O-CB 3.23Å; G213-F217 WeakPolarHBondContact O-CB 3.31Å; G213-F217 PolarHBondContact O-N 3.24Å |
| 214 | L | 88.3 | Confident | 85.9 | Confident | 124 Ų | 124 | 69.5 Ų | 69.5 | 65% | 0.649 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -66.9 | -47.1 | 176.4 | -179.6 | 61.6 | 0 | 0 | 0 | 112.3 | S212 F217 L218 | S212-L214 VanDerWaalsContact C-N 3.26Å; S212-L214 PolarHBondContact O-N 3.02Å; L214-F217 PolarHBondContact O-N 2.94Å; L214-L218 HydrophobicContact CD1-CD1 4.3Å; L214-L218 HydrophobicContact CD1-CG 4.29Å; L214-L218 HydrophobicContact CG-CD1 4.24Å; L214-L218 WeakPolarHBondContact O-CG 3.42Å; L214-L218 PolarHBondContact O-N 3.47Å |
| 215 | S | 86.7 | Confident | 86.6 | Confident | 73 Ų | 73 | 67.3 Ų | 67.3 | 51% | 0.51 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -63.8 | -42.8 | 179.7 | -55.4 | 0 | 0 | 0 | 0 | 111.2 | S212 L218 L219 | S212-S215 PolarHBondContact O-N 2.88Å; S215-L218 PolarHBondContact O-N 3.05Å; S215-L219 VanDerWaalsContact O-CB 3.31Å; S215-L219 WeakPolarHBondContact O-CB 3.48Å; S215-L219 PolarHBondContact O-N 2.95Å |
| 216 | Y | 88.1 | Confident | 86.9 | Confident | 49 Ų | 49 | 68.4 Ų | 68.4 | 19% | 0.192 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -61.2 | -46 | 174.6 | -176.5 | -98.6 | 0 | 0 | 0 | 111.2 | I209 S212 L218 L219 C220 A257 | I209-Y216 HydrophobicContact CD1-CE1 4.2Å; I209-Y216 HydrophobicContact CD1-CE2 4.44Å; I209-Y216 HydrophobicContact CG1-CD1 4.34Å; I209-Y216 HydrophobicContact CG1-CD2 4.23Å; I209-Y216 HydrophobicContact CG1-CE1 4.22Å; I209-Y216 HydrophobicContact CG1-CE2 4.12Å; I209-Y216 HydrophobicContact CG1-CG 4.34Å; I209-Y216 HydrophobicContact CG2-CD1 3.78Å; I209-Y216 HydrophobicContact CG2-CE1 4.12Å; I209-Y216 HydrophobicContact CG2-CG 4.2Å; S212-Y216 PolarHBondContact O-N 3.49Å; Y216-L218 PolarHBondContact O-N 3.29Å; Y216-L219 PolarHBondContact O-N 2.92Å; Y216-C220 VanDerWaalsContact CE1-SG 3.58Å; Y216-C220 WeakPolarHBondContact O-CB 3.34Å; Y216-C220 PolarHBondContact O-N 3.33Å; Y216-C220 PolarHBondContact O-SG 2.97Å; Y216-A257 HydrophobicContact CD2-CB 3.9Å; Y216-A257 HydrophobicContact CE2-CB 3.92Å |
| 217 | F | 89.9 | Confident | 87.2 | Confident | 120 Ų | 120 | 63.2 Ų | 63.2 | 53% | 0.526 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -59.6 | -46.8 | 176.3 | 172 | -102 | 0 | 0 | 0 | 112.9 | G213 L214 C220 N221 | G213-F217 VanDerWaalsContact O-CB 3.23Å; G213-F217 WeakPolarHBondContact O-CB 3.31Å; G213-F217 PolarHBondContact O-N 3.24Å; L214-F217 PolarHBondContact O-N 2.94Å; F217-C220 PolarHBondContact O-N 2.94Å; F217-N221 WeakPolarHBondContact CD1-ND2 3.05Å; F217-N221 WeakPolarHBondContact CE1-ND2 3.4Å; F217-N221 VanDerWaalsContact CE2-ND2 3.27Å; F217-N221 WeakPolarHBondContact CE2-ND2 3.27Å; F217-N221 WeakPolarHBondContact CZ-ND2 3.42Å; F217-N221 PolarHBondContact O-N 3.38Å; F217-N221 PolarHBondContact O-ND2 2.94Å |
| 218 | L | 90.8 | Very high | 87.3 | Confident | 95 Ų | 95 | 67 Ų | 67 | 50% | 0.497 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -64.2 | -44.1 | 177.7 | -71.3 | 175.6 | 0 | 0 | 0 | 111.5 | L214 S215 Y216 C220 N221 V222 | L214-L218 HydrophobicContact CD1-CD1 4.3Å; L214-L218 HydrophobicContact CD1-CG 4.29Å; L214-L218 HydrophobicContact CG-CD1 4.24Å; L214-L218 WeakPolarHBondContact O-CG 3.42Å; L214-L218 PolarHBondContact O-N 3.47Å; S215-L218 PolarHBondContact O-N 3.05Å; Y216-L218 PolarHBondContact O-N 3.29Å; L218-C220 VanDerWaalsContact C-N 3.34Å; L218-C220 PolarHBondContact O-N 2.91Å; L218-N221 PolarHBondContact O-N 3.17Å; L218-V222 WeakPolarHBondContact O-CG2 3.24Å; L218-V222 PolarHBondContact O-N 3.35Å |
| 219 | L | 89.9 | Confident | 87.3 | Confident | 35 Ų | 35 | 74.4 Ų | 74.4 | 18% | 0.183 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -58.3 | -47.5 | 175.5 | -178.8 | 68 | 0 | 0 | 0 | 111.3 | S215 Y216 N221 V222 F223 F256 | S215-L219 VanDerWaalsContact O-CB 3.31Å; S215-L219 WeakPolarHBondContact O-CB 3.48Å; S215-L219 PolarHBondContact O-N 2.95Å; Y216-L219 PolarHBondContact O-N 2.92Å; L219-N221 VanDerWaalsContact C-N 3.35Å; L219-N221 PolarHBondContact O-N 3.39Å; L219-V222 PolarHBondContact O-N 3.31Å; L219-F223 HydrophobicContact CD1-CD1 4.13Å; L219-F223 HydrophobicContact CD1-CD2 4.35Å; L219-F223 HydrophobicContact CD1-CE1 3.67Å; L219-F223 HydrophobicContact CD1-CE2 3.9Å; L219-F223 HydrophobicContact CD1-CG 4.47Å; L219-F223 HydrophobicContact CD1-CZ 3.55Å; L219-F223 HydrophobicContact CD2-CE2 4.29Å; L219-F223 HydrophobicContact CG-CD2 4.23Å; L219-F223 HydrophobicContact CG-CE2 4.02Å; L219-F223 HydrophobicContact CG-CZ 4.2Å; L219-F223 WeakPolarHBondContact O-CB 3.38Å; L219-F223 PolarHBondContact O-N 3.36Å; L219-F256 HydrophobicContact CD2-CB 4.34Å; L219-F256 HydrophobicContact CD2-CD1 3.22Å; L219-F256 HydrophobicContact CD2-CD2 4.31Å; L219-F256 HydrophobicContact CD2-CE1 3.48Å; L219-F256 VanDerWaalsContact CD2-CE1 3.48Å; L219-F256 HydrophobicContact CD2-CE2 4.5Å; L219-F256 HydrophobicContact CD2-CG 3.69Å; L219-F256 HydrophobicContact CD2-CZ 4.12Å |
| 220 | C | 91.9 | Very high | 87.1 | Confident | 17 Ų | 17 | 77.3 Ų | 77.3 | 12% | 0.115 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -57.5 | -46.9 | 176.6 | -78.2 | 0 | 0 | 0 | 0 | 111.4 | Y216 F217 L218 F223 T224 Y249 | Y216-C220 VanDerWaalsContact CE1-SG 3.58Å; Y216-C220 WeakPolarHBondContact O-CB 3.34Å; Y216-C220 PolarHBondContact O-N 3.33Å; Y216-C220 PolarHBondContact O-SG 2.97Å; F217-C220 PolarHBondContact O-N 2.94Å; L218-C220 VanDerWaalsContact C-N 3.34Å; L218-C220 PolarHBondContact O-N 2.91Å; C220-F223 PolarHBondContact O-N 3.14Å; C220-T224 WeakPolarHBondContact O-CB 3.47Å; C220-T224 PolarHBondContact O-N 2.98Å; C220-T224 PolarHBondContact O-OG1 3.27Å; C220-Y249 WeakPolarHBondContact CA-OH 3.32Å; C220-Y249 VanDerWaalsContact CB-OH 3.26Å; C220-Y249 WeakPolarHBondContact CB-OH 3.3Å; C220-Y249 PolarHBondContact O-OH 3.12Å; C220-Y249 PolarHBondContact SG-OH 3.35Å |
| 221 | N | 89.8 | Confident | 86.7 | Confident | 81 Ų | 81 | 73 Ų | 73 | 43% | 0.433 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -63.3 | -42.2 | 178.1 | -77.3 | -52.7 | 0 | 0 | 0 | 113 | F217 L218 L219 T224 G225 | F217-N221 WeakPolarHBondContact CD1-ND2 3.05Å; F217-N221 WeakPolarHBondContact CE1-ND2 3.4Å; F217-N221 VanDerWaalsContact CE2-ND2 3.27Å; F217-N221 WeakPolarHBondContact CE2-ND2 3.27Å; F217-N221 WeakPolarHBondContact CZ-ND2 3.42Å; F217-N221 PolarHBondContact O-N 3.38Å; F217-N221 PolarHBondContact O-ND2 2.94Å; L218-N221 PolarHBondContact O-N 3.17Å; L219-N221 VanDerWaalsContact C-N 3.35Å; L219-N221 PolarHBondContact O-N 3.39Å; N221-T224 PolarHBondContact O-N 2.92Å; N221-G225 PolarHBondContact O-N 2.67Å |
| 222 | V | 90.9 | Very high | 85.7 | Confident | 86 Ų | 86 | 75.6 Ų | 75.6 | 52% | 0.521 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -61.5 | -49.7 | 176.1 | 170.4 | 0 | 0 | 0 | 0 | 110 | L218 L219 T224 G225 I226 | L218-V222 WeakPolarHBondContact O-CG2 3.24Å; L218-V222 PolarHBondContact O-N 3.35Å; L219-V222 PolarHBondContact O-N 3.31Å; V222-T224 PolarHBondContact O-N 2.8Å; V222-G225 CarbonylContact O-C 3.48Å; V222-G225 WeakPolarHBondContact O-CA 3.48Å; V222-G225 PolarHBondContact O-N 3.01Å; V222-G225 VanDerWaalsContact O-N 3.14Å; V222-I226 HydrophobicContact CG1-CD1 3.93Å; V222-I226 HydrophobicContact CG1-CG1 4.5Å; V222-I226 WeakPolarHBondContact O-CG1 3.4Å; V222-I226 PolarHBondContact O-N 2.87Å |
| 223 | F | 88.3 | Confident | 84.6 | Confident | 75 Ų | 75 | 77.9 Ų | 77.9 | 33% | 0.329 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -64.6 | -40.1 | 179.2 | -78.2 | 2.9 | 0 | 0 | 0 | 112.7 | L219 C220 G225 I226 V227 Y249 T253 | L219-F223 HydrophobicContact CD1-CD1 4.13Å; L219-F223 HydrophobicContact CD1-CD2 4.35Å; L219-F223 HydrophobicContact CD1-CE1 3.67Å; L219-F223 HydrophobicContact CD1-CE2 3.9Å; L219-F223 HydrophobicContact CD1-CG 4.47Å; L219-F223 HydrophobicContact CD1-CZ 3.55Å; L219-F223 HydrophobicContact CD2-CE2 4.29Å; L219-F223 HydrophobicContact CG-CD2 4.23Å; L219-F223 HydrophobicContact CG-CE2 4.02Å; L219-F223 HydrophobicContact CG-CZ 4.2Å; L219-F223 WeakPolarHBondContact O-CB 3.38Å; L219-F223 PolarHBondContact O-N 3.36Å; C220-F223 PolarHBondContact O-N 3.14Å; F223-G225 VanDerWaalsContact C-N 3.29Å; F223-G225 PolarHBondContact O-N 3.26Å; F223-I226 HydrophobicContact CD1-CD1 4.22Å; F223-I226 PolarHBondContact O-N 2.98Å; F223-V227 WeakPolarHBondContact O-CG2 3.08Å; F223-V227 PolarHBondContact O-N 2.9Å; F223-Y249 HydrophobicContact CB-CD2 4.04Å; F223-Y249 HydrophobicContact CB-CE2 3.54Å; F223-Y249 HydrophobicContact CD2-CD2 4.37Å; F223-Y249 HydrophobicContact CD2-CE2 4.17Å; F223-Y249 HydrophobicContact CG-CE2 4.4Å; F223-T253 HydrophobicContact CD2-CG2 3.84Å; F223-T253 HydrophobicContact CE2-CG2 4.3Å |
| 224 | T | 88 | Confident | 83.4 | Confident | 72 Ų | 72 | 81.7 Ų | 81.7 | 44% | 0.442 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -62.8 | -38.6 | 172.9 | -57.7 | 0 | 0 | 0 | 0 | 111 | C220 N221 V222 K228 Y249 | C220-T224 WeakPolarHBondContact O-CB 3.47Å; C220-T224 PolarHBondContact O-N 2.98Å; C220-T224 PolarHBondContact O-OG1 3.27Å; N221-T224 PolarHBondContact O-N 2.92Å; V222-T224 PolarHBondContact O-N 2.8Å; T224-K228 WeakPolarHBondContact O-CB 3.19Å; T224-K228 PolarHBondContact O-N 3.46Å; T224-Y249 PolarHBondContact OG1-OH 2.92Å |
| 225 | G | 87.4 | Confident | 82.2 | Confident | 28 Ų | 28 | 85.2 Ų | 85.2 | 29% | 0.289 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -59.6 | -48.4 | 171.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | N221 V222 F223 K228 M229 | N221-G225 PolarHBondContact O-N 2.67Å; V222-G225 CarbonylContact O-C 3.48Å; V222-G225 WeakPolarHBondContact O-CA 3.48Å; V222-G225 PolarHBondContact O-N 3.01Å; V222-G225 VanDerWaalsContact O-N 3.14Å; F223-G225 VanDerWaalsContact C-N 3.29Å; F223-G225 PolarHBondContact O-N 3.26Å; G225-K228 PolarHBondContact O-N 3.1Å; G225-M229 VanDerWaalsContact O-CG 3.29Å; G225-M229 WeakPolarHBondContact O-CG 3.46Å; G225-M229 PolarHBondContact O-N 2.86Å |
| 226 | I | 87.1 | Confident | 81.2 | Confident | 86 Ų | 86 | 92.3 Ų | 92.3 | 44% | 0.441 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.4 | -53.1 | 177.3 | -68.3 | 168.2 | 0 | 0 | 0 | 110.5 | V222 F223 K228 M229 S230 | V222-I226 HydrophobicContact CG1-CD1 3.93Å; V222-I226 HydrophobicContact CG1-CG1 4.5Å; V222-I226 WeakPolarHBondContact O-CG1 3.4Å; V222-I226 PolarHBondContact O-N 2.87Å; F223-I226 HydrophobicContact CD1-CD1 4.22Å; F223-I226 PolarHBondContact O-N 2.98Å; I226-K228 VanDerWaalsContact C-N 3.26Å; I226-K228 PolarHBondContact O-N 3.37Å; I226-M229 PolarHBondContact O-N 3.45Å; I226-S230 WeakPolarHBondContact O-CB 2.77Å; I226-S230 PolarHBondContact O-N 3.23Å; I226-S230 PolarHBondContact O-OG 2.9Å; I226-S230 VanDerWaalsContact O-OG 3.05Å |
| 227 | V | 85.2 | Confident | 80.5 | Confident | 49 Ų | 49 | 93 Ų | 93 | 30% | 0.297 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -55.6 | -45.4 | 179.3 | 169.8 | 0 | 0 | 0 | 0 | 110.1 | F223 M229 S230 T231 V245 | F223-V227 WeakPolarHBondContact O-CG2 3.08Å; F223-V227 PolarHBondContact O-N 2.9Å; V227-M229 VanDerWaalsContact C-N 3.34Å; V227-M229 PolarHBondContact O-N 3.37Å; V227-S230 PolarHBondContact O-N 3.47Å; V227-T231 HydrophobicContact CG1-CG2 4.34Å; V227-T231 WeakPolarHBondContact O-CB 3.42Å; V227-T231 WeakPolarHBondContact O-CG2 3.31Å; V227-T231 PolarHBondContact O-N 2.91Å; V227-T231 PolarHBondContact O-OG1 3.48Å; V227-V245 HydrophobicContact CG1-CG1 3.67Å; V227-V245 HydrophobicContact CG2-CG1 4.46Å |
| 228 | K | 83.1 | Confident | 80.3 | Confident | 147 Ų | 147 | 89.6 Ų | 89.6 | 64% | 0.639 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -63.5 | -36.2 | 178.3 | -174.4 | -179.2 | 178.8 | -170.5 | 0 | 113.3 | T224 G225 I226 T231 | T224-K228 WeakPolarHBondContact O-CB 3.19Å; T224-K228 PolarHBondContact O-N 3.46Å; G225-K228 PolarHBondContact O-N 3.1Å; I226-K228 VanDerWaalsContact C-N 3.26Å; I226-K228 PolarHBondContact O-N 3.37Å; K228-T231 CarbonylContact O-C 3.58Å |
| 229 | M | 83.6 | Confident | 80.2 | Confident | 157 Ų | 157 | 90 Ų | 90 | 77% | 0.773 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -73.4 | -38.3 | 175.5 | -71.2 | 177.3 | -178.7 | 0 | 0 | 111.8 | G225 I226 V227 T231 | G225-M229 VanDerWaalsContact O-CG 3.29Å; G225-M229 WeakPolarHBondContact O-CG 3.46Å; G225-M229 PolarHBondContact O-N 2.86Å; I226-M229 PolarHBondContact O-N 3.45Å; V227-M229 VanDerWaalsContact C-N 3.34Å; V227-M229 PolarHBondContact O-N 3.37Å; M229-T231 VanDerWaalsContact C-N 3.33Å |
| 230 | S | 83 | Confident | 80.3 | Confident | 89 Ų | 89 | 95 Ų | 95 | 62% | 0.622 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -69.6 | -31.2 | 175.7 | -58 | 0 | 0 | 0 | 0 | 112.2 | I226 V227 S232 | I226-S230 WeakPolarHBondContact O-CB 2.77Å; I226-S230 PolarHBondContact O-N 3.23Å; I226-S230 PolarHBondContact O-OG 2.9Å; I226-S230 VanDerWaalsContact O-OG 3.05Å; V227-S230 PolarHBondContact O-N 3.47Å; S230-S232 VanDerWaalsContact C-N 3.35Å; S230-S232 PolarHBondContact O-N 3.29Å |
| 231 | T | 75 | Confident | 80.1 | Confident | 31 Ų | 31 | 97.2 Ų | 97.2 | 19% | 0.19 | 52% | 0.524 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -96.1 | 54.1 | 174.4 | 62.9 | 0 | 0 | 0 | 0 | 111.1 | V227 K228 M229 T233 M237 | V227-T231 HydrophobicContact CG1-CG2 4.34Å; V227-T231 WeakPolarHBondContact O-CB 3.42Å; V227-T231 WeakPolarHBondContact O-CG2 3.31Å; V227-T231 PolarHBondContact O-N 2.91Å; V227-T231 PolarHBondContact O-OG1 3.48Å; K228-T231 CarbonylContact O-C 3.58Å; M229-T231 VanDerWaalsContact C-N 3.33Å; T231-T233 PolarHBondContact O-N 3.41Å; T231-M237 HydrophobicContact CG2-CE 3.63Å |
| 232 | S | 64.7 | Low | 80 | Confident | 105 Ų | 105 | 95.4 Ų | 95.4 | 73% | 0.734 | 52% | 0.518 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.2 | -4 | 171.2 | 56.9 | 0 | 0 | 0 | 0 | 113.9 | S230 | S230-S232 VanDerWaalsContact C-N 3.35Å; S230-S232 PolarHBondContact O-N 3.29Å |
| 233 | T | 59.5 | Low | 80 | Confident | 82 Ų | 82 | 96.5 Ų | 96.5 | 50% | 0.503 | 52% | 0.52 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -119.6 | 42.4 | -171.2 | 47.9 | 0 | 0 | 0 | 0 | 113.4 | T231 E235 R236 | T231-T233 PolarHBondContact O-N 3.41Å; T233-E235 PolarHBondContact O-N 2.91Å; T233-R236 PolarHBondContact O-N 2.93Å |
| 234 | V | 59.5 | Low | 80.1 | Confident | 115 Ų | 115 | 95.4 Ų | 95.4 | 70% | 0.697 | 52% | 0.524 | S | S | * | . | G | 310 helix | trans | -51.1 | -29.5 | 178.8 | 166 | 0 | 0 | 0 | 0 | 113.8 | R236 | V234-R236 PolarHBondContact O-N 3.12Å; V234-R236 VanDerWaalsContact O-N 3.13Å |
| 235 | E | 62.7 | Low | 80.1 | Confident | 197 Ų | 197 | 94.2 Ų | 94.2 | 92% | 0.921 | 52% | 0.517 | S | S | * | . | G | 310 helix | trans | -65.6 | -14.4 | 177.7 | -67.4 | -175.2 | 172.8 | 0 | 0 | 114.3 | T233 | T233-E235 PolarHBondContact O-N 2.91Š|
| 236 | R | 66.6 | Low | 80.1 | Confident | 223 Ų | 223 | 98 Ų | 98 | 84% | 0.842 | 53% | 0.529 | S | S | * | . | G | 310 helix | trans | -118.9 | -4.1 | -173.8 | -60.3 | -171.3 | -161.1 | -168.5 | 5.2 | 115.2 | T233 V234 S238 | T233-R236 PolarHBondContact O-N 2.93Å; V234-R236 PolarHBondContact O-N 3.12Å; V234-R236 VanDerWaalsContact O-N 3.13Å; R236-S238 PolarHBondContact O-N 2.91Å |
| 237 | M | 74.5 | Confident | 80.3 | Confident | 63 Ų | 63 | 100.5 Ų | 100.5 | 31% | 0.31 | 54% | 0.537 | S | S | . | . | trans | -79.1 | 125.6 | -177.4 | -168.8 | 172.9 | -77.7 | 0 | 0 | 110.1 | T231 T241 | T231-M237 HydrophobicContact CG2-CE 3.63Å; M237-T241 HydrophobicContact CE-CG2 3.95Å; M237-T241 HydrophobicContact CG-CG2 3.77Å; M237-T241 HydrophobicContact SD-CG2 3.77Å | ||
| 238 | S | 85.6 | Confident | 80.5 | Confident | 49 Ų | 49 | 101.9 Ų | 101.9 | 34% | 0.343 | 55% | 0.549 | S | S | . | . | trans | -61.8 | 152.9 | 171.9 | 78.1 | 0 | 0 | 0 | 0 | 111.1 | R236 Q240 T241 S242 | R236-S238 PolarHBondContact O-N 2.91Å; S238-Q240 PolarHBondContact O-N 3.3Å; S238-Q240 PolarHBondContact OG-OE1 2.93Å; S238-T241 PolarHBondContact O-N 3.38Å; S238-T241 PolarHBondContact OG-N 3.44Å; S238-T241 VanDerWaalsContact OG-N 3.1Å; S238-T241 PolarHBondContact OG-OG1 3.44Å; S238-S242 PolarHBondContact O-N 2.82Å; S238-S242 PolarHBondContact O-OG 2.83Å; S238-S242 VanDerWaalsContact O-OG 3.14Å | ||
| 239 | V | 88.6 | Confident | 80.7 | Confident | 104 Ų | 104 | 97.7 Ų | 97.7 | 63% | 0.63 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -56.5 | -38.9 | 175.5 | 176.3 | 0 | 0 | 0 | 0 | 110.5 | S242 L243 | V239-S242 WeakPolarHBondContact O-CB 3.19Å; V239-S242 PolarHBondContact O-N 2.98Å; V239-L243 HydrophobicContact CG1-CD1 4.15Å; V239-L243 HydrophobicContact CG1-CG 4.45Å; V239-L243 WeakPolarHBondContact O-CG 3.06Å; V239-L243 PolarHBondContact O-N 3.31Å |
| 240 | Q | 90.9 | Very high | 81 | Confident | 138 Ų | 138 | 92.2 Ų | 92.2 | 65% | 0.645 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -62.6 | -45.9 | 179.4 | -62.1 | 83.9 | -10.9 | 0 | 0 | 111.7 | S238 S242 L243 A244 | S238-Q240 PolarHBondContact O-N 3.3Å; S238-Q240 PolarHBondContact OG-OE1 2.93Å; Q240-S242 VanDerWaalsContact C-N 3.32Å; Q240-S242 PolarHBondContact O-N 3.36Å; Q240-L243 PolarHBondContact O-N 3.05Å; Q240-A244 WeakPolarHBondContact O-CB 3.47Å; Q240-A244 PolarHBondContact O-N 2.85Å |
| 241 | T | 87.3 | Confident | 81.4 | Confident | 64 Ų | 64 | 92.2 Ų | 92.2 | 39% | 0.393 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.2 | -39.5 | 176.7 | -48.8 | 0 | 0 | 0 | 0 | 111.1 | M237 S238 A244 V245 | M237-T241 HydrophobicContact CE-CG2 3.95Å; M237-T241 HydrophobicContact CG-CG2 3.77Å; M237-T241 HydrophobicContact SD-CG2 3.77Å; S238-T241 PolarHBondContact O-N 3.38Å; S238-T241 PolarHBondContact OG-N 3.44Å; S238-T241 VanDerWaalsContact OG-N 3.1Å; S238-T241 PolarHBondContact OG-OG1 3.44Å; T241-A244 PolarHBondContact O-N 2.7Å; T241-V245 WeakPolarHBondContact O-CG2 3.41Å; T241-V245 PolarHBondContact O-N 2.57Å |
| 242 | S | 88 | Confident | 82.1 | Confident | 44 Ų | 44 | 93.2 Ų | 93.2 | 31% | 0.308 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.5 | -45 | 177.7 | -58 | 0 | 0 | 0 | 0 | 111.6 | S238 V239 Q240 A244 V245 I246 | S238-S242 PolarHBondContact O-N 2.82Å; S238-S242 PolarHBondContact O-OG 2.83Å; S238-S242 VanDerWaalsContact O-OG 3.14Å; V239-S242 WeakPolarHBondContact O-CB 3.19Å; V239-S242 PolarHBondContact O-N 2.98Å; Q240-S242 VanDerWaalsContact C-N 3.32Å; Q240-S242 PolarHBondContact O-N 3.36Å; S242-A244 VanDerWaalsContact C-N 3.34Å; S242-A244 PolarHBondContact O-N 2.88Å; S242-V245 PolarHBondContact O-N 2.73Å; S242-I246 VanDerWaalsContact O-CG1 3.31Å; S242-I246 WeakPolarHBondContact O-CG1 3.48Å; S242-I246 PolarHBondContact O-N 3.33Å |
| 243 | L | 90.2 | Very high | 83.3 | Confident | 108 Ų | 108 | 88.3 Ų | 88.3 | 57% | 0.565 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -62.5 | -40.2 | 175 | -70.7 | 173.6 | 0 | 0 | 0 | 111.9 | V239 Q240 I246 F247 | V239-L243 HydrophobicContact CG1-CD1 4.15Å; V239-L243 HydrophobicContact CG1-CG 4.45Å; V239-L243 WeakPolarHBondContact O-CG 3.06Å; V239-L243 PolarHBondContact O-N 3.31Å; Q240-L243 PolarHBondContact O-N 3.05Å; L243-I246 PolarHBondContact O-N 2.84Å; L243-F247 VanDerWaalsContact O-CB 3.3Å; L243-F247 WeakPolarHBondContact O-CB 3.23Å; L243-F247 PolarHBondContact O-N 2.94Å |
| 244 | A | 90.4 | Very high | 84.6 | Confident | 52 Ų | 52 | 86 Ų | 86 | 43% | 0.43 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -63.5 | -43.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q240 T241 S242 F247 C248 | Q240-A244 WeakPolarHBondContact O-CB 3.47Å; Q240-A244 PolarHBondContact O-N 2.85Å; T241-A244 PolarHBondContact O-N 2.7Å; S242-A244 VanDerWaalsContact C-N 3.34Å; S242-A244 PolarHBondContact O-N 2.88Å; A244-F247 PolarHBondContact O-N 3.38Å; A244-C248 WeakPolarHBondContact O-CB 3.41Å; A244-C248 PolarHBondContact O-N 3.39Å; A244-C248 PolarHBondContact O-SG 2.87Å; A244-C248 VanDerWaalsContact O-SG 3.33Å |
| 245 | V | 88.1 | Confident | 85.9 | Confident | 48 Ų | 48 | 85.5 Ų | 85.5 | 29% | 0.291 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -61.4 | -46.7 | 176.2 | 171.8 | 0 | 0 | 0 | 0 | 110.8 | V227 T241 S242 F247 C248 Y249 | V227-V245 HydrophobicContact CG1-CG1 3.67Å; V227-V245 HydrophobicContact CG2-CG1 4.46Å; T241-V245 WeakPolarHBondContact O-CG2 3.41Å; T241-V245 PolarHBondContact O-N 2.57Å; S242-V245 PolarHBondContact O-N 2.73Å; V245-F247 PolarHBondContact O-N 3.36Å; V245-C248 PolarHBondContact O-N 3.03Å; V245-Y249 VanDerWaalsContact O-CB 3.23Å; V245-Y249 WeakPolarHBondContact O-CB 3.46Å; V245-Y249 PolarHBondContact O-N 3.33Å |
| 246 | I | 88.8 | Confident | 87 | Confident | 106 Ų | 106 | 80 Ų | 80 | 54% | 0.544 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -61.9 | -43.9 | 177.9 | -68 | 167.3 | 0 | 0 | 0 | 110.8 | S242 L243 Y249 A250 | S242-I246 VanDerWaalsContact O-CG1 3.31Å; S242-I246 WeakPolarHBondContact O-CG1 3.48Å; S242-I246 PolarHBondContact O-N 3.33Å; L243-I246 PolarHBondContact O-N 2.84Å; I246-Y249 PolarHBondContact O-N 2.95Å; I246-A250 WeakPolarHBondContact O-CB 3.33Å; I246-A250 PolarHBondContact O-N 2.86Å |
| 247 | F | 90.7 | Very high | 88 | Confident | 139 Ų | 139 | 69.5 Ų | 69.5 | 61% | 0.61 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -63.4 | -48.9 | 178.8 | -177.4 | -94.4 | 0 | 0 | 0 | 112.1 | L243 A244 V245 Y249 A250 L251 | L243-F247 VanDerWaalsContact O-CB 3.3Å; L243-F247 WeakPolarHBondContact O-CB 3.23Å; L243-F247 PolarHBondContact O-N 2.94Å; A244-F247 PolarHBondContact O-N 3.38Å; V245-F247 PolarHBondContact O-N 3.36Å; F247-Y249 VanDerWaalsContact C-N 3.31Å; F247-Y249 PolarHBondContact O-N 3.02Å; F247-A250 PolarHBondContact O-N 3.44Å; F247-L251 HydrophobicContact CE1-CD2 4.45Å; F247-L251 WeakPolarHBondContact O-CB 3.43Å; F247-L251 PolarHBondContact O-N 3.08Å |
| 248 | C | 89.6 | Confident | 88.4 | Confident | 79 Ų | 79 | 73.2 Ų | 73.2 | 53% | 0.534 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -60.4 | -42.1 | 177.2 | -72.7 | 0 | 0 | 0 | 0 | 111.7 | A244 V245 L251 A252 | A244-C248 WeakPolarHBondContact O-CB 3.41Å; A244-C248 PolarHBondContact O-N 3.39Å; A244-C248 PolarHBondContact O-SG 2.87Å; A244-C248 VanDerWaalsContact O-SG 3.33Å; V245-C248 PolarHBondContact O-N 3.03Å; C248-L251 PolarHBondContact O-N 2.94Å; C248-A252 VanDerWaalsContact O-CB 3.3Å; C248-A252 WeakPolarHBondContact O-CB 3.24Å; C248-A252 PolarHBondContact O-N 3.18Å |
| 249 | Y | 87.7 | Confident | 88.4 | Confident | 59 Ų | 59 | 74.1 Ų | 74.1 | 23% | 0.231 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -61.8 | -48.3 | 175.3 | 164.3 | -99.3 | 0 | 0 | 0 | 112.3 | C220 F223 T224 V245 I246 F247 L251 A252 T253 | C220-Y249 WeakPolarHBondContact CA-OH 3.32Å; C220-Y249 VanDerWaalsContact CB-OH 3.26Å; C220-Y249 WeakPolarHBondContact CB-OH 3.3Å; C220-Y249 PolarHBondContact O-OH 3.12Å; C220-Y249 PolarHBondContact SG-OH 3.35Å; F223-Y249 HydrophobicContact CB-CD2 4.04Å; F223-Y249 HydrophobicContact CB-CE2 3.54Å; F223-Y249 HydrophobicContact CD2-CD2 4.37Å; F223-Y249 HydrophobicContact CD2-CE2 4.17Å; F223-Y249 HydrophobicContact CG-CE2 4.4Å; T224-Y249 PolarHBondContact OG1-OH 2.92Å; V245-Y249 VanDerWaalsContact O-CB 3.23Å; V245-Y249 WeakPolarHBondContact O-CB 3.46Å; V245-Y249 PolarHBondContact O-N 3.33Å; I246-Y249 PolarHBondContact O-N 2.95Å; F247-Y249 VanDerWaalsContact C-N 3.31Å; F247-Y249 PolarHBondContact O-N 3.02Å; Y249-L251 VanDerWaalsContact C-N 3.32Å; Y249-L251 PolarHBondContact O-N 3.32Å; Y249-A252 PolarHBondContact O-N 3.4Å; Y249-T253 HydrophobicContact CD2-CG2 4.06Å; Y249-T253 HydrophobicContact CE2-CG2 3.68Å; Y249-T253 WeakPolarHBondContact O-CG2 2.96Å; Y249-T253 PolarHBondContact O-N 3.37Å; Y249-T253 PolarHBondContact O-OG1 3.31Å |
| 250 | A | 89.8 | Confident | 87.9 | Confident | 42 Ų | 42 | 73.3 Ų | 73.3 | 35% | 0.347 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -62.6 | -40.5 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | I246 F247 T253 S254 | I246-A250 WeakPolarHBondContact O-CB 3.33Å; I246-A250 PolarHBondContact O-N 2.86Å; F247-A250 PolarHBondContact O-N 3.44Å; A250-T253 PolarHBondContact O-OG1 2.98Å; A250-T253 VanDerWaalsContact O-OG1 3.1Å; A250-S254 VanDerWaalsContact O-CB 3.24Å; A250-S254 WeakPolarHBondContact O-CB 3.45Å; A250-S254 PolarHBondContact O-N 2.92Å; A250-S254 PolarHBondContact O-OG 3.28Å |
| 251 | L | 90.7 | Very high | 87.1 | Confident | 88 Ų | 88 | 69.1 Ų | 69.1 | 46% | 0.461 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -64.9 | -49 | 176 | -175.1 | 65.9 | 0 | 0 | 0 | 111.6 | F247 C248 Y249 T253 S254 L255 | F247-L251 HydrophobicContact CE1-CD2 4.45Å; F247-L251 WeakPolarHBondContact O-CB 3.43Å; F247-L251 PolarHBondContact O-N 3.08Å; C248-L251 PolarHBondContact O-N 2.94Å; Y249-L251 VanDerWaalsContact C-N 3.32Å; Y249-L251 PolarHBondContact O-N 3.32Å; L251-T253 PolarHBondContact O-N 2.98Å; L251-S254 PolarHBondContact O-N 3.42Å; L251-L255 HydrophobicContact CD1-CD1 4.45Å; L251-L255 HydrophobicContact CG-CD1 4.14Å; L251-L255 WeakPolarHBondContact O-CG 3.45Å; L251-L255 PolarHBondContact O-N 3.46Å |
| 252 | A | 89.6 | Confident | 86.3 | Confident | 52 Ų | 52 | 68 Ų | 68 | 43% | 0.43 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -61.4 | -45.8 | -178.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | C248 Y249 L255 F256 | C248-A252 VanDerWaalsContact O-CB 3.3Å; C248-A252 WeakPolarHBondContact O-CB 3.24Å; C248-A252 PolarHBondContact O-N 3.18Å; Y249-A252 PolarHBondContact O-N 3.4Å; A252-L255 PolarHBondContact O-N 3.46Å; A252-F256 WeakPolarHBondContact O-CB 3.39Å; A252-F256 PolarHBondContact O-N 3.22Å |
| 253 | T | 89.4 | Confident | 85.2 | Confident | 2 Ų | 2 | 72 Ų | 72 | 1% | 0.012 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -66.1 | -37.4 | 177 | 52.4 | 0 | 0 | 0 | 0 | 111.9 | F223 Y249 A250 L251 F256 A257 | F223-T253 HydrophobicContact CD2-CG2 3.84Å; F223-T253 HydrophobicContact CE2-CG2 4.3Å; Y249-T253 HydrophobicContact CD2-CG2 4.06Å; Y249-T253 HydrophobicContact CE2-CG2 3.68Å; Y249-T253 WeakPolarHBondContact O-CG2 2.96Å; Y249-T253 PolarHBondContact O-N 3.37Å; Y249-T253 PolarHBondContact O-OG1 3.31Å; A250-T253 PolarHBondContact O-OG1 2.98Å; A250-T253 VanDerWaalsContact O-OG1 3.1Å; L251-T253 PolarHBondContact O-N 2.98Å; T253-F256 PolarHBondContact O-N 3.29Å; T253-A257 PolarHBondContact O-N 3.01Å |
| 254 | S | 88.3 | Confident | 83.8 | Confident | 34 Ų | 34 | 70.4 Ų | 70.4 | 24% | 0.238 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -66.2 | -41 | 176.1 | -60.5 | 0 | 0 | 0 | 0 | 112.7 | L205 A250 L251 A257 R258 | L205-S254 WeakPolarHBondContact CD1-O 3.35Å; A250-S254 VanDerWaalsContact O-CB 3.24Å; A250-S254 WeakPolarHBondContact O-CB 3.45Å; A250-S254 PolarHBondContact O-N 2.92Å; A250-S254 PolarHBondContact O-OG 3.28Å; L251-S254 PolarHBondContact O-N 3.42Å; S254-A257 PolarHBondContact O-N 2.94Å; S254-R258 WeakPolarHBondContact O-CB 3.23Å; S254-R258 PolarHBondContact O-N 2.72Å |
| 255 | L | 87.3 | Confident | 82.6 | Confident | 104 Ų | 104 | 74 Ų | 74 | 55% | 0.545 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -65.4 | -39.6 | 174.9 | -70.8 | 172.9 | 0 | 0 | 0 | 111.7 | L251 A252 R258 S259 | L251-L255 HydrophobicContact CD1-CD1 4.45Å; L251-L255 HydrophobicContact CG-CD1 4.14Å; L251-L255 WeakPolarHBondContact O-CG 3.45Å; L251-L255 PolarHBondContact O-N 3.46Å; A252-L255 PolarHBondContact O-N 3.46Å; L255-R258 PolarHBondContact O-N 3.21Å; L255-S259 PolarHBondContact O-N 2.92Å |
| 256 | F | 85.9 | Confident | 81.4 | Confident | 81 Ų | 81 | 75.9 Ų | 75.9 | 36% | 0.355 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -63.3 | -46.9 | 174.5 | 179 | -90.7 | 0 | 0 | 0 | 112 | L219 A252 T253 R258 S259 Q260 | L219-F256 HydrophobicContact CD2-CB 4.34Å; L219-F256 HydrophobicContact CD2-CD1 3.22Å; L219-F256 HydrophobicContact CD2-CD2 4.31Å; L219-F256 HydrophobicContact CD2-CE1 3.48Å; L219-F256 VanDerWaalsContact CD2-CE1 3.48Å; L219-F256 HydrophobicContact CD2-CE2 4.5Å; L219-F256 HydrophobicContact CD2-CG 3.69Å; L219-F256 HydrophobicContact CD2-CZ 4.12Å; A252-F256 WeakPolarHBondContact O-CB 3.39Å; A252-F256 PolarHBondContact O-N 3.22Å; T253-F256 PolarHBondContact O-N 3.29Å; F256-R258 VanDerWaalsContact C-N 3.27Å; F256-R258 PolarHBondContact O-N 3.42Å; F256-S259 PolarHBondContact O-N 3Å; F256-S259 PolarHBondContact O-OG 3.37Å; F256-Q260 HydrophobicContact CD1-CG 4.14Å; F256-Q260 HydrophobicContact CE1-CG 3.61Å; F256-Q260 HydrophobicContact CE2-CG 4.27Å; F256-Q260 HydrophobicContact CZ-CG 3.69Å; F256-Q260 WeakPolarHBondContact O-CG 3.37Å; F256-Q260 PolarHBondContact O-N 3.19Å; F256-Q260 VanDerWaalsContact O-N 3.08Å |
| 257 | A | 86.4 | Confident | 80 | Confident | 4 Ų | 4 | 79.3 Ų | 79.3 | 3% | 0.033 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -56.2 | -47.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | L205 A208 I209 Y216 T253 S254 S259 Q260 W261 | L205-A257 HydrophobicContact CD1-CB 3.92Å; A208-A257 HydrophobicContact CB-CB 4.29Å; A208-A257 WeakPolarHBondContact CB-O 3.3Å; I209-A257 HydrophobicContact CG1-CB 3.88Å; Y216-A257 HydrophobicContact CD2-CB 3.9Å; Y216-A257 HydrophobicContact CE2-CB 3.92Å; T253-A257 PolarHBondContact O-N 3.01Å; S254-A257 PolarHBondContact O-N 2.94Å; A257-S259 PolarHBondContact O-N 3.16Å; A257-Q260 PolarHBondContact O-N 3.18Å; A257-W261 PolarHBondContact O-N 3.2Å; A257-W261 VanDerWaalsContact O-N 3.12Å |
| 258 | R | 83.1 | Confident | 79.5 | Confident | 140 Ų | 140 | 76.3 Ų | 76.3 | 53% | 0.528 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -60.9 | -39.6 | 177.8 | -173.3 | 178.8 | 177.4 | 97 | 3.6 | 113.2 | S254 L255 F256 W261 G262 | S254-R258 WeakPolarHBondContact O-CB 3.23Å; S254-R258 PolarHBondContact O-N 2.72Å; L255-R258 PolarHBondContact O-N 3.21Å; F256-R258 VanDerWaalsContact C-N 3.27Å; F256-R258 PolarHBondContact O-N 3.42Å; R258-W261 PolarHBondContact O-N 3.32Å; R258-G262 PolarHBondContact O-N 3.15Å |
| 259 | S | 84.6 | Confident | 79 | Confident | 68 Ų | 68 | 76.2 Ų | 76.2 | 48% | 0.476 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -69.2 | -36.2 | -180 | 72.1 | 0 | 0 | 0 | 0 | 112.5 | L255 F256 A257 | L255-S259 PolarHBondContact O-N 2.92Å; F256-S259 PolarHBondContact O-N 3Å; F256-S259 PolarHBondContact O-OG 3.37Å; A257-S259 PolarHBondContact O-N 3.16Å |
| 260 | Q | 79.3 | Confident | 78.5 | Confident | 87 Ų | 87 | 77.1 Ų | 77.1 | 41% | 0.407 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -65.3 | -40.3 | 174.3 | -68 | -62.2 | -72 | 0 | 0 | 111.8 | F256 A257 H263 L264 | F256-Q260 HydrophobicContact CD1-CG 4.14Å; F256-Q260 HydrophobicContact CE1-CG 3.61Å; F256-Q260 HydrophobicContact CE2-CG 4.27Å; F256-Q260 HydrophobicContact CZ-CG 3.69Å; F256-Q260 WeakPolarHBondContact O-CG 3.37Å; F256-Q260 PolarHBondContact O-N 3.19Å; F256-Q260 VanDerWaalsContact O-N 3.08Å; A257-Q260 PolarHBondContact O-N 3.18Å; Q260-H263 WeakPolarHBondContact O-CB 3.48Å; Q260-H263 PolarHBondContact O-N 2.6Å; Q260-L264 PolarHBondContact O-N 3.31Å |
| 261 | W | 74.3 | Confident | 77.8 | Confident | 51 Ų | 51 | 79.2 Ų | 79.2 | 19% | 0.193 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -64 | -41 | 178 | -177.4 | -98.3 | 0 | 0 | 0 | 113.2 | Q207 A208 A211 A257 R258 H263 L264 E265 | Q207-W261 HydrophobicContact CB-CH2 4.02Å; Q207-W261 HydrophobicContact CB-CZ2 3.88Å; Q207-W261 HydrophobicContact CB-CZ3 4.45Å; A208-W261 HydrophobicContact CB-CB 3.41Å; A208-W261 VanDerWaalsContact CB-CB 3.41Å; A208-W261 HydrophobicContact CB-CD2 4.32Å; A208-W261 HydrophobicContact CB-CG 3.85Å; A211-W261 HydrophobicContact CB-CE3 3.37Å; A211-W261 HydrophobicContact CB-CZ3 3.28Å; A257-W261 PolarHBondContact O-N 3.2Å; A257-W261 VanDerWaalsContact O-N 3.12Å; R258-W261 PolarHBondContact O-N 3.32Å; W261-H263 PolarHBondContact O-N 3.01Å; W261-H263 VanDerWaalsContact O-N 3.16Å; W261-L264 HydrophobicContact CE3-CD1 4.2Å; W261-L264 PolarHBondContact O-N 3.42Å; W261-E265 HydrophobicContact CZ2-CG 4.46Å; W261-E265 VanDerWaalsContact NE1-CD 3.32Å; W261-E265 PolarHBondContact NE1-OE1 2.77Å; W261-E265 PolarHBondContact O-N 3.41Å |
| 262 | G | 71 | Confident | 77 | Confident | 41 Ų | 41 | 78.6 Ų | 78.6 | 42% | 0.423 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -59.7 | -26.4 | 175 | 0 | 0 | 0 | 0 | 0 | 113.7 | R258 | R258-G262 PolarHBondContact O-N 3.15Å |
| 263 | H | 63.3 | Low | 76.2 | Confident | 127 Ų | 127 | 80.4 Ų | 80.4 | 59% | 0.588 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -79.1 | -31.3 | 172.6 | -170 | -66.4 | 0 | 0 | 0 | 112.4 | Q260 W261 A266 | Q260-H263 WeakPolarHBondContact O-CB 3.48Å; Q260-H263 PolarHBondContact O-N 2.6Å; W261-H263 PolarHBondContact O-N 3.01Å; W261-H263 VanDerWaalsContact O-N 3.16Å; H263-A266 PolarHBondContact O-N 3.42Å |
| 264 | L | 62.4 | Low | 75.2 | Confident | 75 Ų | 75 | 86 Ų | 86 | 39% | 0.393 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -73.6 | -33.4 | 177.4 | -71 | 168.8 | 0 | 0 | 0 | 112.4 | A211 Q260 W261 A266 | A211-L264 HydrophobicContact CB-CD1 3.72Å; Q260-L264 PolarHBondContact O-N 3.31Å; W261-L264 HydrophobicContact CE3-CD1 4.2Å; W261-L264 PolarHBondContact O-N 3.42Å; L264-A266 PolarHBondContact O-N 3.41Å |
| 265 | E | 64.2 | Low | 74.2 | Confident | 128 Ų | 128 | 90 Ų | 90 | 60% | 0.598 | 47% | 0.474 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.3 | -19.2 | 172.5 | -72.6 | -178.3 | 168.7 | 0 | 0 | 113.3 | W261 | W261-E265 HydrophobicContact CZ2-CG 4.46Å; W261-E265 VanDerWaalsContact NE1-CD 3.32Å; W261-E265 PolarHBondContact NE1-OE1 2.77Å; W261-E265 PolarHBondContact O-N 3.41Å |
| 266 | A | 63.7 | Low | 73.1 | Confident | 86 Ų | 86 | 88.8 Ų | 88.8 | 71% | 0.711 | 47% | 0.468 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.7 | -9.3 | -176.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | H263 L264 | H263-A266 PolarHBondContact O-N 3.42Å; L264-A266 PolarHBondContact O-N 3.41Å |
| 267 | I | 59.2 | Low | 72 | Confident | 178 Ų | 178 | 89.5 Ų | 89.5 | 91% | 0.913 | 48% | 0.478 | S | S | * | . | trans | -99.2 | 0 | 176.3 | -61 | 172.2 | 0 | 0 | 0 | 109 |
Retrieved 267 of 267 residues in 328.5 ms
(Link to these results)