| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 56.5 | Low | 73.6 | Confident | 217 Ų | 217 | 104.5 Ų | 104.5 | 100% | 1.069 | 59% | 0.593 | S | S | * | * | 0 | -50.6 | 0 | -66.3 | -70.8 | -104.1 | 0 | 0 | 112.7 | G3 F4 | M1-G3 PolarHBondContact O-N 3.28Å; M1-F4 PolarHBondContact O-N 3.16Å | |||
| 2 | A | 67.1 | Low | 73.7 | Confident | 77 Ų | 77 | 102.4 Ų | 102.4 | 64% | 0.636 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -58 | -39.4 | -175.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | F4 V5 V6 | A2-F4 VanDerWaalsContact C-N 3.3Å; A2-F4 PolarHBondContact O-N 2.69Å; A2-V5 PolarHBondContact O-N 2.87Å; A2-V6 WeakPolarHBondContact O-CG2 3.37Å; A2-V6 PolarHBondContact O-N 3.01Å; A2-V6 VanDerWaalsContact O-N 3.17Å |
| 3 | G | 65.4 | Low | 73.6 | Confident | 57 Ų | 57 | 104.8 Ų | 104.8 | 59% | 0.588 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -64.8 | -27.6 | -178.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | M1 K7 | M1-G3 PolarHBondContact O-N 3.28Å; G3-K7 PolarHBondContact O-N 2.97Å; G3-K7 VanDerWaalsContact O-N 3.14Å |
| 4 | F | 79.7 | Confident | 73.1 | Confident | 134 Ų | 134 | 105 Ų | 105 | 59% | 0.588 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -73.7 | -40.1 | 177.3 | -175.6 | -99 | 0 | 0 | 0 | 111.6 | M1 A2 K7 Q8 | M1-F4 PolarHBondContact O-N 3.16Å; A2-F4 VanDerWaalsContact C-N 3.3Å; A2-F4 PolarHBondContact O-N 2.69Å; F4-K7 PolarHBondContact O-N 3.49Å; F4-Q8 HydrophobicContact CE1-CG 4.2Å; F4-Q8 HydrophobicContact CZ-CG 4.36Å; F4-Q8 PolarHBondContact O-N 3.48Å |
| 5 | V | 78.3 | Confident | 73 | Confident | 87 Ų | 87 | 104.8 Ų | 104.8 | 53% | 0.527 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -63.1 | -44.5 | 175.9 | -177.8 | 0 | 0 | 0 | 0 | 110.5 | A2 K7 Q8 V9 | A2-V5 PolarHBondContact O-N 2.87Å; V5-K7 VanDerWaalsContact C-N 3.33Å; V5-K7 PolarHBondContact O-N 3.29Å; V5-Q8 PolarHBondContact O-N 2.84Å; V5-V9 WeakPolarHBondContact O-CG2 3.17Å; V5-V9 PolarHBondContact O-N 2.92Å |
| 6 | V | 78 | Confident | 73 | Confident | 93 Ų | 93 | 107.8 Ų | 107.8 | 56% | 0.564 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -62.2 | -40.5 | 176.7 | 176.2 | 0 | 0 | 0 | 0 | 111.4 | A2 V9 L10 | A2-V6 WeakPolarHBondContact O-CG2 3.37Å; A2-V6 PolarHBondContact O-N 3.01Å; A2-V6 VanDerWaalsContact O-N 3.17Å; V6-V9 PolarHBondContact O-N 3.15Å; V6-L10 WeakPolarHBondContact O-CB 3.35Å; V6-L10 PolarHBondContact O-N 2.67Å |
| 7 | K | 78.3 | Confident | 72.5 | Confident | 163 Ų | 163 | 110.1 Ų | 110.1 | 71% | 0.709 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -64.6 | -40.1 | 178.2 | -173.2 | 168.9 | -176.6 | 172.7 | 0 | 112.7 | G3 F4 V5 G11 | G3-K7 PolarHBondContact O-N 2.97Å; G3-K7 VanDerWaalsContact O-N 3.14Å; F4-K7 PolarHBondContact O-N 3.49Å; V5-K7 VanDerWaalsContact C-N 3.33Å; V5-K7 PolarHBondContact O-N 3.29Å; K7-G11 PolarHBondContact O-N 3.46Å |
| 8 | Q | 78.2 | Confident | 72.2 | Confident | 115 Ų | 115 | 113.2 Ų | 113.2 | 54% | 0.537 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -66.5 | -48.5 | 176.2 | -77.8 | -173.2 | -39.6 | 0 | 0 | 111.5 | F4 V5 L10 G11 S12 | F4-Q8 HydrophobicContact CE1-CG 4.2Å; F4-Q8 HydrophobicContact CZ-CG 4.36Å; F4-Q8 PolarHBondContact O-N 3.48Å; V5-Q8 PolarHBondContact O-N 2.84Å; Q8-L10 PolarHBondContact O-N 3.34Å; Q8-G11 PolarHBondContact O-N 3.41Å; Q8-S12 PolarHBondContact O-N 2.98Å; Q8-S12 PolarHBondContact O-OG 3.47Å; Q8-S12 VanDerWaalsContact O-OG 3.08Å |
| 9 | V | 81.8 | Confident | 71.8 | Confident | 77 Ų | 77 | 109.2 Ų | 109.2 | 47% | 0.467 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -64 | -41.9 | -180 | 177.2 | 0 | 0 | 0 | 0 | 111.7 | V5 V6 K13 | V5-V9 WeakPolarHBondContact O-CG2 3.17Å; V5-V9 PolarHBondContact O-N 2.92Å; V6-V9 PolarHBondContact O-N 3.15Å; V9-K13 HydrophobicContact CG1-CD 4.37Å; V9-K13 WeakPolarHBondContact O-CG 3.44Å; V9-K13 PolarHBondContact O-N 3.41Å; V9-K13 VanDerWaalsContact O-N 3.12Å |
| 10 | L | 73.2 | Confident | 71.4 | Confident | 97 Ų | 97 | 105.2 Ų | 105.2 | 51% | 0.508 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -72.4 | -35.9 | 179.7 | -168.6 | 63.1 | 0 | 0 | 0 | 112.1 | V6 Q8 K13 L14 | V6-L10 WeakPolarHBondContact O-CB 3.35Å; V6-L10 PolarHBondContact O-N 2.67Å; Q8-L10 PolarHBondContact O-N 3.34Å; L10-K13 PolarHBondContact O-N 3.39Å; L10-L14 HydrophobicContact CG-CD1 4.18Å; L10-L14 WeakPolarHBondContact O-CB 3.46Å; L10-L14 WeakPolarHBondContact O-CG 3.49Å; L10-L14 PolarHBondContact O-N 3.15Å |
| 11 | G | 73.3 | Confident | 70.9 | Confident | 32 Ų | 32 | 105.5 Ų | 105.5 | 33% | 0.33 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -63.3 | -43.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | K7 Q8 T15 | K7-G11 PolarHBondContact O-N 3.46Å; Q8-G11 PolarHBondContact O-N 3.41Å; G11-T15 WeakPolarHBondContact O-CB 3.46Å; G11-T15 PolarHBondContact O-N 3.42Å; G11-T15 PolarHBondContact O-OG1 2.86Å |
| 12 | S | 74.5 | Confident | 71.3 | Confident | 80 Ų | 80 | 101 Ų | 101 | 56% | 0.559 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -63 | -47.6 | 175.1 | -59.1 | 0 | 0 | 0 | 0 | 111.7 | Q8 L14 T15 E16 | Q8-S12 PolarHBondContact O-N 2.98Å; Q8-S12 PolarHBondContact O-OG 3.47Å; Q8-S12 VanDerWaalsContact O-OG 3.08Å; S12-L14 PolarHBondContact O-N 3.41Å; S12-T15 PolarHBondContact O-N 2.78Å; S12-E16 WeakPolarHBondContact O-CB 3.25Å; S12-E16 PolarHBondContact O-N 3.28Å |
| 13 | K | 72.3 | Confident | 71.1 | Confident | 134 Ų | 134 | 105.6 Ų | 105.6 | 58% | 0.583 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -63.5 | -39 | 179.3 | -72.2 | -175.5 | -177.5 | -139.9 | 0 | 113.3 | V9 L10 M17 | V9-K13 HydrophobicContact CG1-CD 4.37Å; V9-K13 WeakPolarHBondContact O-CG 3.44Å; V9-K13 PolarHBondContact O-N 3.41Å; V9-K13 VanDerWaalsContact O-N 3.12Å; L10-K13 PolarHBondContact O-N 3.39Å; K13-M17 WeakPolarHBondContact O-CB 3.31Å; K13-M17 PolarHBondContact O-N 2.83Å |
| 14 | L | 66.3 | Low | 70.4 | Confident | 107 Ų | 107 | 109.8 Ų | 109.8 | 56% | 0.56 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -69.1 | -36.7 | 176.6 | -83 | 168.9 | 0 | 0 | 0 | 112.4 | L10 S12 K18 | L10-L14 HydrophobicContact CG-CD1 4.18Å; L10-L14 WeakPolarHBondContact O-CB 3.46Å; L10-L14 WeakPolarHBondContact O-CG 3.49Å; L10-L14 PolarHBondContact O-N 3.15Å; S12-L14 PolarHBondContact O-N 3.41Å; L14-K18 WeakPolarHBondContact O-CB 3.33Å; L14-K18 PolarHBondContact O-N 3.44Å |
| 15 | T | 71.8 | Confident | 69.3 | Low | 102 Ų | 102 | 108.6 Ų | 108.6 | 63% | 0.626 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -68 | -40.4 | 177 | -51.6 | 0 | 0 | 0 | 0 | 110.7 | G11 S12 K18 G19 | G11-T15 WeakPolarHBondContact O-CB 3.46Å; G11-T15 PolarHBondContact O-N 3.42Å; G11-T15 PolarHBondContact O-OG1 2.86Å; S12-T15 PolarHBondContact O-N 2.78Å; T15-K18 PolarHBondContact O-N 3.47Å; T15-G19 PolarHBondContact O-N 2.98Å |
| 16 | E | 72.4 | Confident | 67.7 | Low | 153 Ų | 153 | 107.3 Ų | 107.3 | 72% | 0.715 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -69 | -42.7 | 177.3 | -158.6 | 168 | -145.5 | 0 | 0 | 112 | S12 K18 G19 G20 | S12-E16 WeakPolarHBondContact O-CB 3.25Å; S12-E16 PolarHBondContact O-N 3.28Å; E16-K18 PolarHBondContact O-N 3.11Å; E16-G19 PolarHBondContact O-N 2.95Å; E16-G20 PolarHBondContact O-N 2.99Å |
| 17 | M | 65.8 | Low | 66.1 | Low | 147 Ų | 147 | 109.6 Ų | 109.6 | 72% | 0.724 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -64.1 | -38.3 | 171.3 | -92.5 | -174.7 | 85.2 | 0 | 0 | 112.6 | K13 G20 L21 | K13-M17 WeakPolarHBondContact O-CB 3.31Å; K13-M17 PolarHBondContact O-N 2.83Å; M17-G20 PolarHBondContact O-N 3.32Å; M17-L21 VanDerWaalsContact O-CB 3.3Å; M17-L21 WeakPolarHBondContact O-CB 3.33Å; M17-L21 PolarHBondContact O-N 2.89Å |
| 18 | K | 66.5 | Low | 64.2 | Low | 165 Ų | 165 | 108.6 Ų | 108.6 | 72% | 0.717 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -68.6 | -40.8 | 178.1 | -173.3 | 170.1 | 178.9 | -178.7 | 0 | 111.5 | L14 T15 E16 D22 | L14-K18 WeakPolarHBondContact O-CB 3.33Å; L14-K18 PolarHBondContact O-N 3.44Å; T15-K18 PolarHBondContact O-N 3.47Å; E16-K18 PolarHBondContact O-N 3.11Å; K18-D22 WeakPolarHBondContact O-CB 3.36Å; K18-D22 PolarHBondContact O-N 2.8Å; K18-D22 VanDerWaalsContact O-N 3.07Å |
| 19 | G | 63.8 | Low | 62.3 | Low | 37 Ų | 37 | 108.7 Ų | 108.7 | 38% | 0.381 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -67.9 | -33.6 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | T15 E16 K23 | T15-G19 PolarHBondContact O-N 2.98Å; E16-G19 PolarHBondContact O-N 2.95Å; G19-K23 PolarHBondContact O-N 2.96Å |
| 20 | G | 65.5 | Low | 60.1 | Low | 30 Ų | 30 | 108.3 Ų | 108.3 | 31% | 0.309 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -72.6 | -37.8 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | E16 M17 K23 L24 | E16-G20 PolarHBondContact O-N 2.99Å; M17-G20 PolarHBondContact O-N 3.32Å; G20-K23 PolarHBondContact O-N 3.44Å; G20-L24 WeakPolarHBondContact O-CB 3.49Å; G20-L24 WeakPolarHBondContact O-CG 3.32Å; G20-L24 PolarHBondContact O-N 3.04Å |
| 21 | L | 61.1 | Low | 58.3 | Low | 111 Ų | 111 | 110.6 Ų | 110.6 | 58% | 0.581 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -67.4 | -44.1 | 175.9 | -174.4 | 63.3 | 0 | 0 | 0 | 110.9 | M17 K23 L24 T25 | M17-L21 VanDerWaalsContact O-CB 3.3Å; M17-L21 WeakPolarHBondContact O-CB 3.33Å; M17-L21 PolarHBondContact O-N 2.89Å; L21-K23 VanDerWaalsContact C-N 3.26Å; L21-K23 PolarHBondContact O-N 2.86Å; L21-L24 PolarHBondContact O-N 3.44Å; L21-T25 HydrophobicContact CD1-CG2 4.33Å; L21-T25 PolarHBondContact O-N 2.93Å; L21-T25 PolarHBondContact O-OG1 3.31Å |
| 22 | D | 63.7 | Low | 56.4 | Low | 123 Ų | 123 | 112.9 Ų | 112.9 | 66% | 0.658 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -58.9 | -37.9 | 176.1 | -164.2 | 49.7 | 0 | 0 | 0 | 112.1 | K18 G26 | K18-D22 WeakPolarHBondContact O-CB 3.36Å; K18-D22 PolarHBondContact O-N 2.8Å; K18-D22 VanDerWaalsContact O-N 3.07Å; D22-G26 PolarHBondContact O-N 3.36Å |
| 23 | K | 62.8 | Low | 54.5 | Low | 173 Ų | 173 | 117.9 Ų | 117.9 | 75% | 0.752 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -72.1 | -26.6 | 173 | -80 | 175.7 | 176.5 | -74.6 | 0 | 114.5 | G19 G20 L21 | G19-K23 PolarHBondContact O-N 2.96Å; G20-K23 PolarHBondContact O-N 3.44Å; L21-K23 VanDerWaalsContact C-N 3.26Å; L21-K23 PolarHBondContact O-N 2.86Å |
| 24 | L | 52.1 | Low | 52.6 | Low | 146 Ų | 146 | 115 Ų | 115 | 76% | 0.764 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -89.3 | -26.6 | 179.7 | -81.9 | 165.3 | 0 | 0 | 0 | 113.1 | G20 L21 | G20-L24 WeakPolarHBondContact O-CB 3.49Å; G20-L24 WeakPolarHBondContact O-CG 3.32Å; G20-L24 PolarHBondContact O-N 3.04Å; L21-L24 PolarHBondContact O-N 3.44Å |
| 25 | T | 55.4 | Low | 51.4 | Low | 109 Ų | 109 | 119 Ų | 119 | 67% | 0.669 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -90.3 | -4.9 | 173.4 | 41.2 | 0 | 0 | 0 | 0 | 113.7 | L21 | L21-T25 HydrophobicContact CD1-CG2 4.33Å; L21-T25 PolarHBondContact O-N 2.93Å; L21-T25 PolarHBondContact O-OG1 3.31Å |
| 26 | G | 44.8 | Very low | 50.2 | Low | 59 Ų | 59 | 120.3 Ų | 120.3 | 61% | 0.608 | 68% | 0.676 | S | S | * | * | S | Bend | trans | -113.9 | 28.6 | -171.5 | 0 | 0 | 0 | 0 | 0 | 115.3 | D22 | D22-G26 PolarHBondContact O-N 3.36Š|
| 27 | D | 44.9 | Very low | 49.1 | Very low | 142 Ų | 142 | 116.6 Ų | 116.6 | 76% | 0.759 | 68% | 0.679 | S | S | * | * | S | Bend | trans | -157.6 | 122.2 | 167.4 | -161.9 | 23.5 | 0 | 0 | 0 | 113.1 | ||
| 28 | N | 38.4 | Very low | 48.1 | Very low | 141 Ų | 141 | 113.6 Ų | 113.6 | 75% | 0.754 | 66% | 0.663 | S | S | * | * | trans | 87.4 | 126.9 | 154.5 | -149.1 | 28.5 | 0 | 0 | 0 | 120.2 | ||||
| 29 | S | 38 | Very low | 47.2 | Very low | 117 Ų | 117 | 111.4 Ų | 111.4 | 82% | 0.818 | 66% | 0.659 | S | S | * | * | trans | 86.9 | 111.4 | 175.5 | -31.6 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 30 | G | 35.6 | Very low | 47 | Very low | 69 Ų | 69 | 114 Ų | 114 | 71% | 0.711 | 67% | 0.67 | S | S | * | * | cis | 155.7 | 148.2 | 15.7 | 0 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 31 | D | 35.8 | Very low | 46.5 | Very low | 146 Ų | 146 | 120.2 Ų | 120.2 | 78% | 0.781 | 69% | 0.69 | S | S | * | * | trans | 60.2 | 103.5 | 151.1 | -121.9 | 10.3 | 0 | 0 | 0 | 116.9 | ||||
| 32 | S | 33.4 | Very low | 46.3 | Very low | 79 Ų | 79 | 119.2 Ų | 119.2 | 55% | 0.552 | 69% | 0.689 | S | S | * | * | 52.7 | 124.6 | 67.1 | 118 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 33 | K | 33.9 | Very low | 46 | Very low | 186 Ų | 186 | 116.1 Ų | 116.1 | 81% | 0.809 | 67% | 0.674 | S | S | * | * | trans | 78.2 | 101.1 | 172.7 | -51.1 | -71.8 | -171.1 | 173.3 | 0 | 115.6 | ||||
| 34 | T | 33.5 | Very low | 45.7 | Very low | 74 Ų | 74 | 114.1 Ų | 114.1 | 45% | 0.454 | 67% | 0.667 | S | S | . | * | -170 | 63.8 | 124 | 27.2 | 0 | 0 | 0 | 0 | 110.8 | T36 E38 | T34-T36 PolarHBondContact O-N 2.85Å; T34-E38 WeakPolarHBondContact CB-OE1 3.48Å; T34-E38 HydrophobicContact CG2-CG 4.03Å; T34-E38 VanDerWaalsContact OG1-CD 3.27Å; T34-E38 WeakPolarHBondContact OG1-CG 3.3Å; T34-E38 PolarHBondContact OG1-OE1 3.5Å | |||
| 35 | E | 40.4 | Very low | 46.1 | Very low | 189 Ų | 189 | 109.8 Ų | 109.8 | 88% | 0.883 | 65% | 0.653 | S | S | * | * | S | Bend | trans | -59.8 | 116.8 | 133.9 | -172 | -177.9 | -164.3 | 0 | 0 | 105.4 | ||
| 36 | T | 47 | Very low | 46.4 | Very low | 131 Ų | 131 | 112.7 Ų | 112.7 | 80% | 0.804 | 65% | 0.652 | S | S | * | * | S | Bend | trans | 88 | 98.4 | 175.6 | -26.4 | 0 | 0 | 0 | 0 | 116.3 | T34 | T34-T36 PolarHBondContact O-N 2.85Š|
| 37 | G | 48.8 | Very low | 47.2 | Very low | 74 Ų | 74 | 114 Ų | 114 | 76% | 0.763 | 64% | 0.644 | S | S | * | * | trans | 102.7 | 23.8 | 154.7 | 0 | 0 | 0 | 0 | 0 | 117.9 | D39 | G37-D39 PolarHBondContact O-N 3.3Š| ||
| 38 | E | 45.2 | Very low | 48.2 | Very low | 84 Ų | 84 | 112.1 Ų | 112.1 | 39% | 0.393 | 63% | 0.631 | S | S | . | * | trans | -58.2 | 124.1 | 178.1 | -64.7 | -174.7 | 165.2 | 0 | 0 | 111.8 | T34 V43 | T34-E38 WeakPolarHBondContact CB-OE1 3.48Å; T34-E38 HydrophobicContact CG2-CG 4.03Å; T34-E38 VanDerWaalsContact OG1-CD 3.27Å; T34-E38 WeakPolarHBondContact OG1-CG 3.3Å; T34-E38 PolarHBondContact OG1-OE1 3.5Å; E38-V43 HydrophobicContact CB-CG2 3.76Å | ||
| 39 | D | 47.2 | Very low | 49.8 | Very low | 120 Ų | 120 | 107.9 Ų | 107.9 | 64% | 0.642 | 62% | 0.615 | S | S | * | * | trans | -45.9 | 131.1 | 175.2 | -77.2 | -47 | 0 | 0 | 0 | 110.4 | G37 E41 V42 | G37-D39 PolarHBondContact O-N 3.3Å; D39-E41 PolarHBondContact O-N 2.69Å; D39-V42 PolarHBondContact O-N 3.39Å | ||
| 40 | P | 59.5 | Low | 51.2 | Low | 92 Ų | 92 | 106.2 Ų | 106.2 | 60% | 0.597 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -58.1 | -18.5 | -172 | 22.8 | -34.1 | 0 | 0 | 0 | 113.7 | Q44 | P40-Q44 VanDerWaalsContact O-CG 3.24Å; P40-Q44 WeakPolarHBondContact O-CG 3.26Å; P40-Q44 PolarHBondContact O-N 2.98Å |
| 41 | E | 56.1 | Low | 52.7 | Low | 159 Ų | 159 | 107.6 Ų | 107.6 | 74% | 0.743 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -75.7 | -34.3 | 176.4 | -60 | -168.8 | 170.4 | 0 | 0 | 113.3 | D39 Q44 A45 | D39-E41 PolarHBondContact O-N 2.69Å; E41-Q44 PolarHBondContact O-N 3.31Å; E41-A45 PolarHBondContact O-N 3.29Å |
| 42 | V | 55.2 | Low | 54.6 | Low | 91 Ų | 91 | 107.9 Ų | 107.9 | 55% | 0.552 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -76.3 | -37.7 | -180 | -178.7 | 0 | 0 | 0 | 0 | 110.9 | D39 Q44 A45 R46 | D39-V42 PolarHBondContact O-N 3.39Å; V42-Q44 VanDerWaalsContact C-N 3.31Å; V42-Q44 PolarHBondContact O-N 2.97Å; V42-A45 PolarHBondContact O-N 3.4Å; V42-R46 PolarHBondContact O-N 3.43Å |
| 43 | V | 57.5 | Low | 56.6 | Low | 57 Ų | 57 | 113 Ų | 113 | 35% | 0.345 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -62.1 | -41.6 | 172.3 | -178.6 | 0 | 0 | 0 | 0 | 110.2 | E38 R46 L47 | E38-V43 HydrophobicContact CB-CG2 3.76Å; V43-R46 PolarHBondContact O-N 2.83Å; V43-L47 HydrophobicContact CG1-CD1 4.04Å; V43-L47 WeakPolarHBondContact O-CB 3.38Å; V43-L47 VanDerWaalsContact O-CG 3.23Å; V43-L47 WeakPolarHBondContact O-CG 2.75Å; V43-L47 PolarHBondContact O-N 3.14Å |
| 44 | Q | 57.1 | Low | 58.6 | Low | 131 Ų | 131 | 109.1 Ų | 109.1 | 61% | 0.612 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -63.5 | -41.1 | 174 | -76.7 | 178.2 | 22.9 | 0 | 0 | 112.5 | P40 E41 V42 R46 L47 E48 | P40-Q44 VanDerWaalsContact O-CG 3.24Å; P40-Q44 WeakPolarHBondContact O-CG 3.26Å; P40-Q44 PolarHBondContact O-N 2.98Å; E41-Q44 PolarHBondContact O-N 3.31Å; V42-Q44 VanDerWaalsContact C-N 3.31Å; V42-Q44 PolarHBondContact O-N 2.97Å; Q44-R46 PolarHBondContact O-N 3.49Å; Q44-L47 PolarHBondContact O-N 3.45Å; Q44-E48 WeakPolarHBondContact O-CB 3.25Å; Q44-E48 PolarHBondContact O-N 3.22Å |
| 45 | A | 61.4 | Low | 60.7 | Low | 56 Ų | 56 | 110.9 Ų | 110.9 | 46% | 0.463 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -65.6 | -38.8 | 179 | 0 | 0 | 0 | 0 | 0 | 113 | E41 V42 E48 A49 | E41-A45 PolarHBondContact O-N 3.29Å; V42-A45 PolarHBondContact O-N 3.4Å; A45-E48 PolarHBondContact O-N 2.71Å; A45-A49 PolarHBondContact O-N 2.81Å; A45-A49 VanDerWaalsContact O-N 3.07Å |
| 46 | R | 61.3 | Low | 62.8 | Low | 170 Ų | 170 | 108.7 Ų | 108.7 | 64% | 0.642 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -65.8 | -44 | 174 | -174.7 | 172.5 | 175.7 | 166.6 | -1.5 | 111.3 | V42 V43 Q44 A49 E50 | V42-R46 PolarHBondContact O-N 3.43Å; V43-R46 PolarHBondContact O-N 2.83Å; Q44-R46 PolarHBondContact O-N 3.49Å; R46-A49 PolarHBondContact O-N 3.17Å; R46-E50 IonicContact NE-OE1 3.29Å; R46-E50 PolarHBondContact O-N 3.32Å; R46-E50 VanDerWaalsContact O-N 3.12Å |
| 47 | L | 61.8 | Low | 64.6 | Low | 86 Ų | 86 | 108.7 Ų | 108.7 | 45% | 0.45 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -64.7 | -39.1 | 176.3 | -69.1 | 173.7 | 0 | 0 | 0 | 112 | V43 Q44 E50 Q51 | V43-L47 HydrophobicContact CG1-CD1 4.04Å; V43-L47 WeakPolarHBondContact O-CB 3.38Å; V43-L47 VanDerWaalsContact O-CG 3.23Å; V43-L47 WeakPolarHBondContact O-CG 2.75Å; V43-L47 PolarHBondContact O-N 3.14Å; Q44-L47 PolarHBondContact O-N 3.45Å; L47-E50 PolarHBondContact O-N 3.42Å; L47-Q51 VanDerWaalsContact O-CB 3.26Å; L47-Q51 WeakPolarHBondContact O-CB 3.24Å; L47-Q51 WeakPolarHBondContact O-CG 3.47Å; L47-Q51 PolarHBondContact O-N 3.26Å |
| 48 | E | 65.3 | Low | 66.3 | Low | 102 Ų | 102 | 112.4 Ų | 112.4 | 48% | 0.477 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -65.7 | -40.8 | 177.1 | -165 | -162.9 | 147.3 | 0 | 0 | 111.4 | Q44 A45 E50 Q51 R52 | Q44-E48 WeakPolarHBondContact O-CB 3.25Å; Q44-E48 PolarHBondContact O-N 3.22Å; A45-E48 PolarHBondContact O-N 2.71Å; E48-E50 PolarHBondContact O-N 3.3Å; E48-Q51 PolarHBondContact O-N 2.77Å; E48-R52 WeakPolarHBondContact O-CB 3.14Å; E48-R52 VanDerWaalsContact O-CG 3.31Å; E48-R52 WeakPolarHBondContact O-CG 3.2Å; E48-R52 PolarHBondContact O-N 3.28Å; E48-R52 IonicContact OE1-CZ 3.99Å; E48-R52 IonicContact OE1-NH1 3.81Å; E48-R52 PolarHBondContact OE1-NH1 3.14Å |
| 49 | A | 72 | Confident | 68.2 | Low | 52 Ų | 52 | 114.6 Ų | 114.6 | 43% | 0.43 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -65.4 | -39.3 | 178 | 0 | 0 | 0 | 0 | 0 | 112.4 | A45 R46 R53 | A45-A49 PolarHBondContact O-N 2.81Å; A45-A49 VanDerWaalsContact O-N 3.07Å; R46-A49 PolarHBondContact O-N 3.17Å; A49-R53 WeakPolarHBondContact O-CG 3.31Å; A49-R53 PolarHBondContact O-N 3.06Å |
| 50 | E | 67.6 | Low | 70.1 | Confident | 83 Ų | 83 | 114 Ų | 114 | 39% | 0.388 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -69.9 | -43 | 173.5 | -72.6 | 179.3 | -161.3 | 0 | 0 | 111.5 | R46 L47 E48 R52 R53 Q54 | R46-E50 IonicContact NE-OE1 3.29Å; R46-E50 PolarHBondContact O-N 3.32Å; R46-E50 VanDerWaalsContact O-N 3.12Å; L47-E50 PolarHBondContact O-N 3.42Å; E48-E50 PolarHBondContact O-N 3.3Å; E50-R52 PolarHBondContact O-N 3.3Å; E50-R53 WeakPolarHBondContact O-CB 3.27Å; E50-R53 PolarHBondContact O-N 2.89Å; E50-R53 VanDerWaalsContact O-N 3.12Å; E50-Q54 WeakPolarHBondContact O-CG 3.47Å; E50-Q54 PolarHBondContact O-N 3.48Å |
| 51 | Q | 67.4 | Low | 71.4 | Confident | 98 Ų | 98 | 114.2 Ų | 114.2 | 46% | 0.458 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -59.2 | -43.9 | 175.1 | -77.2 | 177.3 | 23.6 | 0 | 0 | 111.4 | L47 E48 R53 Q54 E55 | L47-Q51 VanDerWaalsContact O-CB 3.26Å; L47-Q51 WeakPolarHBondContact O-CB 3.24Å; L47-Q51 WeakPolarHBondContact O-CG 3.47Å; L47-Q51 PolarHBondContact O-N 3.26Å; E48-Q51 PolarHBondContact O-N 2.77Å; Q51-R53 VanDerWaalsContact C-N 3.26Å; Q51-R53 PolarHBondContact O-N 3.31Å; Q51-Q54 CarbonylContact O-C 3.57Å; Q51-Q54 PolarHBondContact O-N 3.07Å; Q51-Q54 VanDerWaalsContact O-N 3.14Å; Q51-E55 VanDerWaalsContact O-CB 3.26Å; Q51-E55 WeakPolarHBondContact O-CB 3.48Å; Q51-E55 VanDerWaalsContact O-CG 3.24Å; Q51-E55 WeakPolarHBondContact O-CG 3.48Å; Q51-E55 PolarHBondContact O-N 3.47Å |
| 52 | R | 74.3 | Confident | 73 | Confident | 152 Ų | 152 | 112.6 Ų | 112.6 | 57% | 0.574 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -62 | -32.5 | 176.4 | -74.1 | -179.6 | 112.3 | 156.2 | 2.5 | 112.9 | E48 E50 K56 | E48-R52 WeakPolarHBondContact O-CB 3.14Å; E48-R52 VanDerWaalsContact O-CG 3.31Å; E48-R52 WeakPolarHBondContact O-CG 3.2Å; E48-R52 PolarHBondContact O-N 3.28Å; E48-R52 IonicContact OE1-CZ 3.99Å; E48-R52 IonicContact OE1-NH1 3.81Å; E48-R52 PolarHBondContact OE1-NH1 3.14Å; E50-R52 PolarHBondContact O-N 3.3Å; R52-K56 WeakPolarHBondContact O-CB 3.23Å; R52-K56 VanDerWaalsContact O-CG 3.23Å; R52-K56 WeakPolarHBondContact O-CG 3.47Å; R52-K56 PolarHBondContact O-N 3.44Å |
| 53 | R | 76.3 | Confident | 74.7 | Confident | 185 Ų | 185 | 113.4 Ų | 113.4 | 70% | 0.698 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -72.8 | -45.8 | 173.1 | -69.2 | 177.7 | -174.4 | -109.5 | 4.3 | 111 | A49 E50 Q51 K56 H57 | A49-R53 WeakPolarHBondContact O-CG 3.31Å; A49-R53 PolarHBondContact O-N 3.06Å; E50-R53 WeakPolarHBondContact O-CB 3.27Å; E50-R53 PolarHBondContact O-N 2.89Å; E50-R53 VanDerWaalsContact O-N 3.12Å; Q51-R53 VanDerWaalsContact C-N 3.26Å; Q51-R53 PolarHBondContact O-N 3.31Å; R53-K56 PolarHBondContact O-N 3.12Å; R53-H57 PolarHBondContact O-CD2 2.86Å; R53-H57 PolarHBondContact O-N 3.4Å |
| 54 | Q | 75.9 | Confident | 76.4 | Confident | 106 Ų | 106 | 117.4 Ų | 117.4 | 50% | 0.495 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -65.2 | -38.1 | 178.6 | -69.5 | -178.1 | 27.4 | 0 | 0 | 112.4 | E50 Q51 H57 R58 | E50-Q54 WeakPolarHBondContact O-CG 3.47Å; E50-Q54 PolarHBondContact O-N 3.48Å; Q51-Q54 CarbonylContact O-C 3.57Å; Q51-Q54 PolarHBondContact O-N 3.07Å; Q51-Q54 VanDerWaalsContact O-N 3.14Å; Q54-H57 PolarHBondContact O-N 3.07Å; Q54-R58 WeakPolarHBondContact O-CB 3.36Å; Q54-R58 PolarHBondContact O-N 3.12Å |
| 55 | E | 78.1 | Confident | 78 | Confident | 110 Ų | 110 | 114.7 Ų | 114.7 | 51% | 0.514 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -66.6 | -43.8 | 175.7 | -76.6 | 176 | -174.9 | 0 | 0 | 111.5 | Q51 H57 R58 K59 | Q51-E55 VanDerWaalsContact O-CB 3.26Å; Q51-E55 WeakPolarHBondContact O-CB 3.48Å; Q51-E55 VanDerWaalsContact O-CG 3.24Å; Q51-E55 WeakPolarHBondContact O-CG 3.48Å; Q51-E55 PolarHBondContact O-N 3.47Å; E55-H57 VanDerWaalsContact C-N 3.34Å; E55-H57 PolarHBondContact O-N 3.36Å; E55-R58 PolarHBondContact O-N 3.5Å; E55-K59 WeakPolarHBondContact O-CB 3.47Å; E55-K59 PolarHBondContact O-N 3.45Å |
| 56 | K | 82.8 | Confident | 79.5 | Confident | 144 Ų | 144 | 118.2 Ų | 118.2 | 63% | 0.626 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -58 | -47.9 | 171.8 | -78.8 | 176.5 | -178.3 | -178.3 | 0 | 111 | R52 R53 K59 M60 | R52-K56 WeakPolarHBondContact O-CB 3.23Å; R52-K56 VanDerWaalsContact O-CG 3.23Å; R52-K56 WeakPolarHBondContact O-CG 3.47Å; R52-K56 PolarHBondContact O-N 3.44Å; R53-K56 PolarHBondContact O-N 3.12Å; K56-K59 PolarHBondContact O-N 3.34Å; K56-M60 HydrophobicContact CB-CE 4.42Å; K56-M60 WeakPolarHBondContact O-CB 3.44Å; K56-M60 WeakPolarHBondContact O-CE 3.24Å; K56-M60 WeakPolarHBondContact O-CG 3.47Å; K56-M60 PolarHBondContact O-N 3.22Å |
| 57 | H | 85.9 | Confident | 81 | Confident | 131 Ų | 131 | 115.3 Ų | 115.3 | 61% | 0.606 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61.9 | -43.7 | 176.7 | -94.9 | -83.7 | 0 | 0 | 0 | 112.3 | R53 Q54 E55 K59 M60 E61 | R53-H57 PolarHBondContact O-CD2 2.86Å; R53-H57 PolarHBondContact O-N 3.4Å; Q54-H57 PolarHBondContact O-N 3.07Å; E55-H57 VanDerWaalsContact C-N 3.34Å; E55-H57 PolarHBondContact O-N 3.36Å; H57-K59 PolarHBondContact O-N 2.99Å; H57-M60 PolarHBondContact O-N 3.5Å; H57-E61 WeakPolarHBondContact O-CB 3.26Å; H57-E61 PolarHBondContact O-N 3.32Å |
| 58 | R | 84.1 | Confident | 82.5 | Confident | 152 Ų | 152 | 116.5 Ų | 116.5 | 57% | 0.574 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -61.9 | -44.9 | 178.6 | -170.8 | -176.7 | -52.9 | -160.1 | 3.4 | 111.5 | Q54 E55 E61 Q62 | Q54-R58 WeakPolarHBondContact O-CB 3.36Å; Q54-R58 PolarHBondContact O-N 3.12Å; E55-R58 PolarHBondContact O-N 3.5Å; R58-E61 PolarHBondContact O-N 2.81Å; R58-Q62 VanDerWaalsContact O-CG 3.27Å; R58-Q62 WeakPolarHBondContact O-CG 3.17Å; R58-Q62 PolarHBondContact O-N 3.04Å |
| 59 | K | 86.3 | Confident | 83.8 | Confident | 129 Ų | 129 | 117 Ų | 117 | 56% | 0.561 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -63.7 | -44.6 | 176.5 | -174.3 | 178.6 | 177.8 | -178.7 | 0 | 111.5 | E55 K56 H57 Q62 E63 | E55-K59 WeakPolarHBondContact O-CB 3.47Å; E55-K59 PolarHBondContact O-N 3.45Å; K56-K59 PolarHBondContact O-N 3.34Å; H57-K59 PolarHBondContact O-N 2.99Å; K59-Q62 WeakPolarHBondContact O-CB 3.47Å; K59-Q62 PolarHBondContact O-N 3.49Å; K59-E63 WeakPolarHBondContact CE-OE1 3.26Å; K59-E63 PolarHBondContact O-N 3.28Å |
| 60 | M | 86.3 | Confident | 84.9 | Confident | 108 Ų | 108 | 118.5 Ų | 118.5 | 53% | 0.532 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -65.8 | -38.3 | 177.9 | -73.1 | -172.9 | -67.6 | 0 | 0 | 112.5 | K56 H57 Q62 E63 R64 | K56-M60 HydrophobicContact CB-CE 4.42Å; K56-M60 WeakPolarHBondContact O-CB 3.44Å; K56-M60 WeakPolarHBondContact O-CE 3.24Å; K56-M60 WeakPolarHBondContact O-CG 3.47Å; K56-M60 PolarHBondContact O-N 3.22Å; H57-M60 PolarHBondContact O-N 3.5Å; M60-Q62 VanDerWaalsContact C-N 3.34Å; M60-E63 PolarHBondContact O-N 3.12Å; M60-R64 VanDerWaalsContact O-CB 3.31Å; M60-R64 WeakPolarHBondContact O-CB 3.31Å; M60-R64 PolarHBondContact O-N 2.8Å |
| 61 | E | 87.4 | Confident | 86.2 | Confident | 96 Ų | 96 | 118.7 Ų | 118.7 | 45% | 0.449 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -70.5 | -31.6 | 176.4 | -163.5 | 61.5 | -131.2 | 0 | 0 | 111.7 | H57 R58 R64 E65 | H57-E61 WeakPolarHBondContact O-CB 3.26Å; H57-E61 PolarHBondContact O-N 3.32Å; R58-E61 PolarHBondContact O-N 2.81Å; E61-R64 WeakPolarHBondContact O-CB 3.4Å; E61-R64 PolarHBondContact O-N 3.01Å; E61-R64 WeakPolarHBondContact OE1-CD 3.47Å; E61-E65 WeakPolarHBondContact O-CB 3.49Å; E61-E65 PolarHBondContact O-N 3.45Å |
| 62 | Q | 89.3 | Confident | 87.5 | Confident | 126 Ų | 126 | 117.2 Ų | 117.2 | 59% | 0.589 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -64.6 | -46.6 | 171.2 | -76.4 | 173.9 | -8 | 0 | 0 | 112.2 | R58 K59 M60 R64 E65 K66 | R58-Q62 VanDerWaalsContact O-CG 3.27Å; R58-Q62 WeakPolarHBondContact O-CG 3.17Å; R58-Q62 PolarHBondContact O-N 3.04Å; K59-Q62 WeakPolarHBondContact O-CB 3.47Å; K59-Q62 PolarHBondContact O-N 3.49Å; M60-Q62 VanDerWaalsContact C-N 3.34Å; Q62-R64 VanDerWaalsContact C-N 3.25Å; Q62-R64 PolarHBondContact O-N 3.06Å; Q62-E65 PolarHBondContact O-N 2.57Å; Q62-K66 WeakPolarHBondContact O-CB 3.45Å; Q62-K66 PolarHBondContact O-N 2.9Å |
| 63 | E | 91.3 | Very high | 88.5 | Confident | 107 Ų | 107 | 114.9 Ų | 114.9 | 50% | 0.5 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.5 | -38.5 | 174.4 | -71.9 | 174.3 | -167.3 | 0 | 0 | 110.9 | K59 M60 K66 M67 | K59-E63 WeakPolarHBondContact CE-OE1 3.26Å; K59-E63 PolarHBondContact O-N 3.28Å; M60-E63 PolarHBondContact O-N 3.12Å; E63-K66 PolarHBondContact O-N 2.91Å; E63-M67 WeakPolarHBondContact O-CG 3.44Å; E63-M67 PolarHBondContact O-N 3.47Å |
| 64 | R | 92 | Very high | 89.4 | Confident | 141 Ų | 141 | 113.2 Ų | 113.2 | 53% | 0.532 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.2 | -46.8 | 175.4 | -168.9 | 177.1 | -172.6 | 151.3 | 2.7 | 112.2 | M60 E61 Q62 K66 M67 R68 | M60-R64 VanDerWaalsContact O-CB 3.31Å; M60-R64 WeakPolarHBondContact O-CB 3.31Å; M60-R64 PolarHBondContact O-N 2.8Å; E61-R64 WeakPolarHBondContact O-CB 3.4Å; E61-R64 PolarHBondContact O-N 3.01Å; E61-R64 WeakPolarHBondContact OE1-CD 3.47Å; Q62-R64 VanDerWaalsContact C-N 3.25Å; Q62-R64 PolarHBondContact O-N 3.06Å; R64-K66 VanDerWaalsContact C-N 3.34Å; R64-M67 PolarHBondContact O-N 2.75Å; R64-R68 VanDerWaalsContact NE-NH2 3.11Å; R64-R68 VanDerWaalsContact O-CG 3.24Å; R64-R68 WeakPolarHBondContact O-CG 3.17Å; R64-R68 PolarHBondContact O-N 2.84Å |
| 65 | E | 90.5 | Very high | 90.3 | Very high | 75 Ų | 75 | 115 Ų | 115 | 35% | 0.35 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -69.7 | -32.4 | 177.9 | -169.8 | 60.7 | -151.9 | 0 | 0 | 111.7 | E61 Q62 R68 K69 R72 | E61-E65 WeakPolarHBondContact O-CB 3.49Å; E61-E65 PolarHBondContact O-N 3.45Å; Q62-E65 PolarHBondContact O-N 2.57Å; E65-R68 WeakPolarHBondContact O-CB 3.37Å; E65-R68 PolarHBondContact O-N 3.08Å; E65-R68 WeakPolarHBondContact OE2-CD 3.23Å; E65-R68 IonicContact OE2-NE 2.67Å; E65-K69 WeakPolarHBondContact O-CB 3.41Å; E65-K69 PolarHBondContact O-N 3.36Å; E65-R72 IonicContact OE1-NH1 2.69Å |
| 66 | K | 93.7 | Very high | 91 | Very high | 130 Ų | 130 | 116.9 Ų | 116.9 | 57% | 0.565 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -59.9 | -51.1 | 170.8 | -174.3 | 176.2 | -173.9 | -80.2 | 0 | 110.9 | Q62 E63 R64 R68 K69 E70 | Q62-K66 WeakPolarHBondContact O-CB 3.45Å; Q62-K66 PolarHBondContact O-N 2.9Å; E63-K66 PolarHBondContact O-N 2.91Å; R64-K66 VanDerWaalsContact C-N 3.34Å; K66-R68 VanDerWaalsContact C-N 3.32Å; K66-R68 PolarHBondContact O-N 3.44Å; K66-K69 PolarHBondContact O-N 2.96Å; K66-K69 VanDerWaalsContact O-N 3.15Å; K66-E70 IonicContact NZ-OE1 3.64Å; K66-E70 PolarHBondContact NZ-OE1 3.01Å; K66-E70 WeakPolarHBondContact O-CG 3.47Å; K66-E70 PolarHBondContact O-N 2.92Å |
| 67 | M | 93.5 | Very high | 91.3 | Very high | 108 Ų | 108 | 114.4 Ų | 114.4 | 53% | 0.532 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -59.5 | -41.6 | 174.5 | -72.5 | -71.3 | -64.1 | 0 | 0 | 111.9 | E63 R64 K69 E70 I71 | E63-M67 WeakPolarHBondContact O-CG 3.44Å; E63-M67 PolarHBondContact O-N 3.47Å; R64-M67 PolarHBondContact O-N 2.75Å; M67-K69 VanDerWaalsContact C-N 3.33Å; M67-K69 PolarHBondContact O-N 3.05Å; M67-E70 PolarHBondContact O-N 2.87Å; M67-I71 VanDerWaalsContact O-CG1 3.25Å; M67-I71 WeakPolarHBondContact O-CG1 3.49Å; M67-I71 PolarHBondContact O-N 3.48Å |
| 68 | R | 91.8 | Very high | 91.4 | Very high | 112 Ų | 112 | 116.2 Ų | 116.2 | 42% | 0.423 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.2 | -42.1 | 175.1 | -72.3 | 170.2 | -174.5 | -82.5 | 11.1 | 111.5 | R64 E65 K66 R72 | R64-R68 VanDerWaalsContact NE-NH2 3.11Å; R64-R68 VanDerWaalsContact O-CG 3.24Å; R64-R68 WeakPolarHBondContact O-CG 3.17Å; R64-R68 PolarHBondContact O-N 2.84Å; E65-R68 WeakPolarHBondContact O-CB 3.37Å; E65-R68 PolarHBondContact O-N 3.08Å; E65-R68 WeakPolarHBondContact OE2-CD 3.23Å; E65-R68 IonicContact OE2-NE 2.67Å; K66-R68 VanDerWaalsContact C-N 3.32Å; K66-R68 PolarHBondContact O-N 3.44Å; R68-R72 VanDerWaalsContact O-CB 3.26Å; R68-R72 WeakPolarHBondContact O-CB 3.24Å; R68-R72 PolarHBondContact O-N 3.02Å |
| 69 | K | 94.1 | Very high | 91.5 | Very high | 113 Ų | 113 | 114.8 Ų | 114.8 | 49% | 0.491 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -68 | -42.9 | 177.7 | -164.5 | -176.9 | -172.2 | -99.5 | 0 | 111.6 | E65 K66 M67 I71 R72 E73 | E65-K69 WeakPolarHBondContact O-CB 3.41Å; E65-K69 PolarHBondContact O-N 3.36Å; K66-K69 PolarHBondContact O-N 2.96Å; K66-K69 VanDerWaalsContact O-N 3.15Å; M67-K69 VanDerWaalsContact C-N 3.33Å; M67-K69 PolarHBondContact O-N 3.05Å; K69-I71 PolarHBondContact O-N 3.48Å; K69-R72 WeakPolarHBondContact O-CA 3.36Å; K69-R72 VanDerWaalsContact O-CB 3.3Å; K69-R72 WeakPolarHBondContact O-CB 3.46Å; K69-R72 PolarHBondContact O-N 2.71Å; K69-R72 VanDerWaalsContact O-N 3.11Å; K69-E73 VanDerWaalsContact CE-OE1 3.31Å; K69-E73 WeakPolarHBondContact CE-OE1 3.44Å; K69-E73 WeakPolarHBondContact CG-OE1 3.3Å; K69-E73 IonicContact NZ-OE1 2.59Å; K69-E73 PolarHBondContact NZ-OE1 2.86Å; K69-E73 WeakPolarHBondContact O-CB 3.42Å; K69-E73 WeakPolarHBondContact O-CG 3.45Å; K69-E73 PolarHBondContact O-N 3.26Å |
| 70 | E | 94.9 | Very high | 91.3 | Very high | 82 Ų | 82 | 117.7 Ų | 117.7 | 38% | 0.383 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -61.3 | -42.9 | 175.8 | -73.6 | 173.2 | -169.7 | 0 | 0 | 111.6 | K66 M67 R72 K74 | K66-E70 IonicContact NZ-OE1 3.64Å; K66-E70 PolarHBondContact NZ-OE1 3.01Å; K66-E70 WeakPolarHBondContact O-CG 3.47Å; K66-E70 PolarHBondContact O-N 2.92Å; M67-E70 PolarHBondContact O-N 2.87Å; E70-R72 VanDerWaalsContact C-N 3.32Å; E70-K74 WeakPolarHBondContact O-CB 3.38Å; E70-K74 PolarHBondContact O-N 2.95Å |
| 71 | I | 95.1 | Very high | 90.6 | Very high | 88 Ų | 88 | 119.1 Ų | 119.1 | 45% | 0.451 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -63.4 | -42.2 | 173.6 | -67.4 | 166.6 | 0 | 0 | 0 | 110.3 | M67 K69 K74 Y75 | M67-I71 VanDerWaalsContact O-CG1 3.25Å; M67-I71 WeakPolarHBondContact O-CG1 3.49Å; M67-I71 PolarHBondContact O-N 3.48Å; K69-I71 PolarHBondContact O-N 3.48Å; I71-K74 PolarHBondContact O-N 3.31Å; I71-Y75 HydrophobicContact CG2-CD2 4.14Å; I71-Y75 HydrophobicContact CG2-CE2 4.44Å; I71-Y75 WeakPolarHBondContact O-CD2 3.43Å; I71-Y75 PolarHBondContact O-N 3.44Å |
| 72 | R | 94 | Very high | 89.5 | Confident | 66 Ų | 66 | 119.3 Ų | 119.3 | 25% | 0.249 | 56% | 0.555 | C | S | . | * | H | α-helix | trans | -59.8 | -48.9 | 179.3 | -173.2 | 178.3 | -81.5 | 109.4 | -3.3 | 111.6 | E65 R68 K69 E70 Y75 N76 I77 K79 | E65-R72 IonicContact OE1-NH1 2.69Å; R68-R72 VanDerWaalsContact O-CB 3.26Å; R68-R72 WeakPolarHBondContact O-CB 3.24Å; R68-R72 PolarHBondContact O-N 3.02Å; K69-R72 WeakPolarHBondContact O-CA 3.36Å; K69-R72 VanDerWaalsContact O-CB 3.3Å; K69-R72 WeakPolarHBondContact O-CB 3.46Å; K69-R72 PolarHBondContact O-N 2.71Å; K69-R72 VanDerWaalsContact O-N 3.11Å; E70-R72 VanDerWaalsContact C-N 3.32Å; R72-Y75 PolarHBondContact O-N 3.49Å; R72-N76 WeakPolarHBondContact O-CA 3.18Å; R72-N76 PolarHBondContact O-N 3.09Å; R72-I77 VanDerWaalsContact CD-O 3.25Å; R72-I77 WeakPolarHBondContact CD-O 3.14Å; R72-I77 HydrophobicContact CG-CB 4.19Å; R72-I77 WeakPolarHBondContact CG-O 3.47Å; R72-I77 PolarHBondContact O-N 2.99Å; R72-K79 VanDerWaalsContact NE-CA 3.34Å |
| 73 | E | 94.2 | Very high | 88.2 | Confident | 104 Ų | 104 | 119.8 Ų | 119.8 | 49% | 0.486 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -67.5 | -40.8 | 178.5 | -70.4 | 171.5 | -173.5 | 0 | 0 | 111.5 | K69 Y75 N76 | K69-E73 VanDerWaalsContact CE-OE1 3.31Å; K69-E73 WeakPolarHBondContact CE-OE1 3.44Å; K69-E73 WeakPolarHBondContact CG-OE1 3.3Å; K69-E73 IonicContact NZ-OE1 2.59Å; K69-E73 PolarHBondContact NZ-OE1 2.86Å; K69-E73 WeakPolarHBondContact O-CB 3.42Å; K69-E73 WeakPolarHBondContact O-CG 3.45Å; K69-E73 PolarHBondContact O-N 3.26Å; E73-Y75 PolarHBondContact O-N 2.88Å; E73-Y75 VanDerWaalsContact O-N 3.16Å; E73-N76 PolarHBondContact O-N 3.43Å; E73-N76 PolarHBondContact O-OD1 2.87Å |
| 74 | K | 96.6 | Very high | 86.7 | Confident | 150 Ų | 150 | 120.4 Ų | 120.4 | 65% | 0.652 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -57.5 | -32 | 178.5 | -177.8 | 176.9 | -179.9 | -174.4 | 0 | 113.4 | E70 I71 | E70-K74 WeakPolarHBondContact O-CB 3.38Å; E70-K74 PolarHBondContact O-N 2.95Å; I71-K74 PolarHBondContact O-N 3.31Å |
| 75 | Y | 94.8 | Very high | 85 | Confident | 143 Ų | 143 | 120.3 Ų | 120.3 | 56% | 0.561 | 58% | 0.584 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115.9 | 10.2 | -177 | -64 | -73.2 | 0 | 0 | 0 | 113.7 | I71 R72 E73 I77 | I71-Y75 HydrophobicContact CG2-CD2 4.14Å; I71-Y75 HydrophobicContact CG2-CE2 4.44Å; I71-Y75 WeakPolarHBondContact O-CD2 3.43Å; I71-Y75 PolarHBondContact O-N 3.44Å; R72-Y75 PolarHBondContact O-N 3.49Å; E73-Y75 PolarHBondContact O-N 2.88Å; E73-Y75 VanDerWaalsContact O-N 3.16Å; Y75-I77 PolarHBondContact O-N 3.38Å; Y75-I77 VanDerWaalsContact O-N 3.15Å |
| 76 | N | 91.6 | Very high | 83.4 | Confident | 149 Ų | 149 | 121.3 Ų | 121.3 | 80% | 0.797 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 49.1 | 38.2 | -176 | -61.8 | -41.2 | 0 | 0 | 0 | 113.4 | R72 E73 | R72-N76 WeakPolarHBondContact O-CA 3.18Å; R72-N76 PolarHBondContact O-N 3.09Å; E73-N76 PolarHBondContact O-N 3.43Å; E73-N76 PolarHBondContact O-OD1 2.87Å |
| 77 | I | 90 | Very high | 81.7 | Confident | 93 Ų | 93 | 121.8 Ų | 121.8 | 48% | 0.477 | 61% | 0.61 | S | S | . | * | trans | -78.9 | 125.2 | 178.7 | -63.7 | 168.2 | 0 | 0 | 0 | 107.2 | R72 Y75 K79 | R72-I77 VanDerWaalsContact CD-O 3.25Å; R72-I77 WeakPolarHBondContact CD-O 3.14Å; R72-I77 HydrophobicContact CG-CB 4.19Å; R72-I77 WeakPolarHBondContact CG-O 3.47Å; R72-I77 PolarHBondContact O-N 2.99Å; Y75-I77 PolarHBondContact O-N 3.38Å; Y75-I77 VanDerWaalsContact O-N 3.15Å; I77-K79 PolarHBondContact O-N 3.01Å | ||
| 78 | E | 87.5 | Confident | 80.1 | Confident | 169 Ų | 169 | 123.7 Ų | 123.7 | 79% | 0.79 | 62% | 0.62 | S | S | * | * | trans | -70.3 | 137.1 | 174.5 | -67.2 | -178.9 | 172.3 | 0 | 0 | 110 | K80 | E78-K80 PolarHBondContact O-N 3.07Š| ||
| 79 | K | 86.4 | Confident | 78.5 | Confident | 121 Ų | 121 | 124.7 Ų | 124.7 | 53% | 0.526 | 63% | 0.634 | S | S | . | * | trans | -66 | 105.8 | 166.6 | -175.5 | 173 | 178 | -177.3 | 0 | 106.1 | R72 I77 E81 | R72-K79 VanDerWaalsContact NE-CA 3.34Å; I77-K79 PolarHBondContact O-N 3.01Å; K79-E81 PolarHBondContact O-N 3.33Å | ||
| 80 | K | 81.1 | Confident | 76.9 | Confident | 190 Ų | 190 | 121.3 Ų | 121.3 | 83% | 0.826 | 62% | 0.624 | S | S | * | * | trans | -61.2 | 108 | 168.6 | -64.2 | -176.3 | -179.7 | -176.5 | 0 | 106.6 | E78 | E78-K80 PolarHBondContact O-N 3.07Š| ||
| 81 | E | 72.4 | Confident | 75.5 | Confident | 139 Ų | 139 | 122.6 Ų | 122.6 | 65% | 0.65 | 64% | 0.642 | S | S | * | * | trans | -49.8 | 142.7 | 164.5 | -73.1 | -60.1 | 142.6 | 0 | 0 | 107.6 | K79 L83 | K79-E81 PolarHBondContact O-N 3.33Å; E81-L83 PolarHBondContact O-N 2.86Å | ||
| 82 | A | 65.3 | Low | 74 | Confident | 100 Ų | 100 | 122.1 Ų | 122.1 | 83% | 0.826 | 66% | 0.659 | S | S | * | * | trans | -70.6 | 60.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 83 | L | 60.5 | Low | 72.4 | Confident | 135 Ų | 135 | 127 Ų | 127 | 71% | 0.707 | 68% | 0.678 | S | S | * | * | trans | -54 | 135.9 | 152.8 | -68.1 | 170.9 | 0 | 0 | 0 | 105.6 | E81 L85 | E81-L83 PolarHBondContact O-N 2.86Å; L83-L85 PolarHBondContact O-N 2.81Å | ||
| 84 | P | 60.8 | Low | 71 | Confident | 121 Ų | 121 | 130.7 Ų | 130.7 | 79% | 0.786 | 70% | 0.699 | S | S | * | * | trans | -50.6 | 111.1 | 172.6 | -19.8 | 29.4 | 0 | 0 | 0 | 106.2 | ||||
| 85 | L | 57.1 | Low | 69.2 | Low | 139 Ų | 139 | 127.1 Ų | 127.1 | 73% | 0.728 | 70% | 0.704 | S | S | * | * | trans | -54.7 | 131.5 | 173.5 | -76.2 | 167.2 | 0 | 0 | 0 | 104.9 | L83 T87 | L83-L85 PolarHBondContact O-N 2.81Å; L85-T87 PolarHBondContact O-N 3.01Å | ||
| 86 | P | 55.5 | Low | 67.4 | Low | 96 Ų | 96 | 124.2 Ų | 124.2 | 62% | 0.623 | 70% | 0.701 | S | S | * | * | trans | -50.5 | 128.9 | 173.1 | 22.5 | -31.3 | 0 | 0 | 0 | 105.3 | M88 | P86-M88 PolarHBondContact O-N 3.43Š| ||
| 87 | T | 59.3 | Low | 65.3 | Low | 139 Ų | 139 | 119.5 Ų | 119.5 | 85% | 0.853 | 68% | 0.68 | S | S | * | * | trans | -54.5 | 81.9 | -176.2 | 49.1 | 0 | 0 | 0 | 0 | 108.2 | L85 D89 | L85-T87 PolarHBondContact O-N 3.01Å; T87-D89 PolarHBondContact O-N 3.01Å | ||
| 88 | M | 58 | Low | 63.6 | Low | 148 Ų | 148 | 121.3 Ų | 121.3 | 73% | 0.729 | 69% | 0.686 | S | S | * | * | trans | -63.6 | 114.2 | 174.7 | -85.8 | -81.6 | 113.2 | 0 | 0 | 102.7 | P86 S90 | P86-M88 PolarHBondContact O-N 3.43Å; M88-S90 VanDerWaalsContact C-N 3.27Å; M88-S90 WeakPolarHBondContact O-CB 3.44Å; M88-S90 PolarHBondContact O-N 2.85Å; M88-S90 PolarHBondContact O-OG 2.98Å | ||
| 89 | D | 58.7 | Low | 62 | Low | 134 Ų | 134 | 121.5 Ų | 121.5 | 72% | 0.717 | 69% | 0.687 | S | S | * | * | trans | -44.6 | 96.3 | -179 | 175.3 | 11.4 | 0 | 0 | 0 | 108.9 | T87 S91 | T87-D89 PolarHBondContact O-N 3.01Å; D89-S91 VanDerWaalsContact C-N 3.34Å; D89-S91 WeakPolarHBondContact OD1-CB 3.16Å; D89-S91 PolarHBondContact OD1-N 3.06Å; D89-S91 PolarHBondContact OD1-OG 3.41Å | ||
| 90 | S | 61.1 | Low | 60.3 | Low | 42 Ų | 42 | 120.2 Ų | 120.2 | 29% | 0.294 | 68% | 0.681 | S | S | . | * | trans | -111.2 | 29.1 | 178.1 | 34.9 | 0 | 0 | 0 | 0 | 108.1 | M88 G92 R93 S97 | M88-S90 VanDerWaalsContact C-N 3.27Å; M88-S90 WeakPolarHBondContact O-CB 3.44Å; M88-S90 PolarHBondContact O-N 2.85Å; M88-S90 PolarHBondContact O-OG 2.98Å; S90-G92 PolarHBondContact O-N 3.1Å; S90-R93 PolarHBondContact O-N 2.63Å; S90-S97 WeakPolarHBondContact O-CB 3.46Å; S90-S97 PolarHBondContact O-OG 2.62Å; S90-S97 VanDerWaalsContact O-OG 3.1Å; S90-S97 WeakPolarHBondContact OG-CB 3.08Å | ||
| 91 | S | 64.6 | Low | 59.2 | Low | 109 Ų | 109 | 115.5 Ų | 115.5 | 76% | 0.762 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.6 | -15.3 | 172.8 | -55.5 | 0 | 0 | 0 | 0 | 112.6 | D89 | D89-S91 VanDerWaalsContact C-N 3.34Å; D89-S91 WeakPolarHBondContact OD1-CB 3.16Å; D89-S91 PolarHBondContact OD1-N 3.06Å; D89-S91 PolarHBondContact OD1-OG 3.41Å |
| 92 | G | 63.9 | Low | 58.7 | Low | 78 Ų | 78 | 113.1 Ų | 113.1 | 80% | 0.804 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96 | -4.2 | 172.5 | 0 | 0 | 0 | 0 | 0 | 116.1 | S90 | S90-G92 PolarHBondContact O-N 3.1Š|
| 93 | R | 62.1 | Low | 58.5 | Low | 169 Ų | 169 | 115.2 Ų | 115.2 | 64% | 0.638 | 67% | 0.666 | S | S | * | * | trans | -100 | 101.4 | -175.7 | -126.4 | -173.1 | -163.4 | -169.9 | 5.5 | 110.3 | S90 G95 T96 S97 | S90-R93 PolarHBondContact O-N 2.63Å; R93-G95 PolarHBondContact O-N 2.59Å; R93-T96 WeakPolarHBondContact CD-OG1 3.32Å; R93-S97 PolarHBondContact O-OG 2.84Å | ||
| 94 | I | 63.4 | Low | 58.3 | Low | 181 Ų | 181 | 111.4 Ų | 111.4 | 93% | 0.928 | 64% | 0.644 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.2 | 109.8 | 170.3 | -58 | 175.2 | 0 | 0 | 0 | 107.7 | ||
| 95 | G | 59.1 | Low | 58.2 | Low | 74 Ų | 74 | 110.7 Ų | 110.7 | 76% | 0.763 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 107.2 | 2.3 | 165.1 | 0 | 0 | 0 | 0 | 0 | 118.6 | R93 | R93-G95 PolarHBondContact O-N 2.59Š|
| 96 | T | 56.3 | Low | 58.5 | Low | 82 Ų | 82 | 106.5 Ų | 106.5 | 50% | 0.503 | 62% | 0.619 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -139 | 0.5 | 175.6 | 74 | 0 | 0 | 0 | 0 | 116.6 | R93 | R93-T96 WeakPolarHBondContact CD-OG1 3.32Š|
| 97 | S | 49.4 | Very low | 58.8 | Low | 50 Ų | 50 | 108 Ų | 108 | 35% | 0.35 | 61% | 0.612 | S | S | . | * | S | Bend | trans | -90.4 | -13.3 | -172.2 | 46.4 | 0 | 0 | 0 | 0 | 115 | S90 R93 | S90-S97 WeakPolarHBondContact O-CB 3.46Å; S90-S97 PolarHBondContact O-OG 2.62Å; S90-S97 VanDerWaalsContact O-OG 3.1Å; S90-S97 WeakPolarHBondContact OG-CB 3.08Å; R93-S97 PolarHBondContact O-OG 2.84Å |
| 98 | Q | 53.7 | Low | 58.6 | Low | 131 Ų | 131 | 104.8 Ų | 104.8 | 61% | 0.612 | 59% | 0.587 | S | S | * | * | trans | -100.7 | 94.9 | 169.1 | -63.8 | -178.7 | -81.7 | 0 | 0 | 108 | K100 E104 | Q98-K100 PolarHBondContact O-N 2.56Å; Q98-E104 PolarHBondContact NE2-OE1 2.94Å | ||
| 99 | H | 53.2 | Low | 58.8 | Low | 173 Ų | 173 | 100.1 Ų | 100.1 | 80% | 0.801 | 57% | 0.572 | S | S | * | * | trans | -59.5 | 93.8 | 151.5 | -76.7 | -85.2 | 0 | 0 | 0 | 105.9 | T101 | H99-T101 PolarHBondContact O-N 3.34Å; H99-T101 VanDerWaalsContact O-N 3.09Å | ||
| 100 | K | 51 | Low | 59.1 | Low | 94 Ų | 94 | 100.4 Ų | 100.4 | 41% | 0.409 | 57% | 0.569 | S | S | . | * | trans | -52 | 117 | -179.5 | -66.6 | 171.7 | -178.6 | 177.1 | 0 | 107.8 | Q98 E104 L105 E108 | Q98-K100 PolarHBondContact O-N 2.56Å; K100-E104 HydrophobicContact CB-CB 4.44Å; K100-L105 HydrophobicContact CB-CD1 4.46Å; K100-L105 HydrophobicContact CD-CD1 4.37Å; K100-E108 WeakPolarHBondContact CD-OE2 3.34Å; K100-E108 WeakPolarHBondContact CE-OE1 3.09Å; K100-E108 WeakPolarHBondContact CE-OE2 3.16Å; K100-E108 IonicContact NZ-OE1 3.95Å; K100-E108 PolarHBondContact NZ-OE1 3.2Å; K100-E108 IonicContact NZ-OE2 2.62Å; K100-E108 PolarHBondContact NZ-OE2 3.21Å | ||
| 101 | T | 57.5 | Low | 59.1 | Low | 91 Ų | 91 | 103.8 Ų | 103.8 | 56% | 0.558 | 58% | 0.581 | S | S | * | * | trans | -63.1 | 151.1 | 169.6 | 52.4 | 0 | 0 | 0 | 0 | 107.7 | H99 E103 E104 L105 | H99-T101 PolarHBondContact O-N 3.34Å; H99-T101 VanDerWaalsContact O-N 3.09Å; T101-E103 PolarHBondContact O-N 3.15Å; T101-E104 PolarHBondContact O-N 3.38Å; T101-L105 PolarHBondContact O-N 3.26Å; T101-L105 VanDerWaalsContact O-N 3.15Å | ||
| 102 | A | 61.7 | Low | 59.1 | Low | 90 Ų | 90 | 103.6 Ų | 103.6 | 74% | 0.744 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -53.8 | -25.2 | -175.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | A106 | A102-A106 PolarHBondContact O-N 2.99Å |
| 103 | E | 62 | Low | 59.5 | Low | 144 Ų | 144 | 105 Ų | 105 | 67% | 0.673 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -73.1 | -36.5 | 174.4 | -170 | 179.7 | 170.5 | 0 | 0 | 113.4 | T101 L105 A106 R107 | T101-E103 PolarHBondContact O-N 3.15Å; E103-L105 VanDerWaalsContact C-N 3.35Å; E103-A106 PolarHBondContact O-N 3.21Å; E103-R107 PolarHBondContact O-N 3.32Å |
| 104 | E | 55.5 | Low | 60.2 | Low | 54 Ų | 54 | 100.6 Ų | 100.6 | 25% | 0.252 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -73.9 | -30.3 | 175.9 | -157.4 | 174.6 | -156.2 | 0 | 0 | 111.2 | Q98 K100 T101 A106 R107 E108 | Q98-E104 PolarHBondContact NE2-OE1 2.94Å; K100-E104 HydrophobicContact CB-CB 4.44Å; T101-E104 PolarHBondContact O-N 3.38Å; E104-A106 VanDerWaalsContact C-N 3.27Å; E104-A106 PolarHBondContact O-N 2.85Å; E104-R107 PolarHBondContact O-N 3.23Å; E104-E108 PolarHBondContact O-N 2.8Å |
| 105 | L | 59.9 | Low | 60.8 | Low | 106 Ų | 106 | 96.1 Ų | 96.1 | 56% | 0.555 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -62.2 | -34.7 | 170.9 | -154.5 | 85.6 | 0 | 0 | 0 | 112 | K100 T101 E103 A109 | K100-L105 HydrophobicContact CB-CD1 4.46Å; K100-L105 HydrophobicContact CD-CD1 4.37Å; T101-L105 PolarHBondContact O-N 3.26Å; T101-L105 VanDerWaalsContact O-N 3.15Å; E103-L105 VanDerWaalsContact C-N 3.35Å; L105-A109 PolarHBondContact O-N 3.25Å |
| 106 | A | 63.3 | Low | 61.7 | Low | 52 Ų | 52 | 97.3 Ų | 97.3 | 43% | 0.43 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -71.9 | -37.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | A102 E103 E104 A109 E110 | A102-A106 PolarHBondContact O-N 2.99Å; E103-A106 PolarHBondContact O-N 3.21Å; E104-A106 VanDerWaalsContact C-N 3.27Å; E104-A106 PolarHBondContact O-N 2.85Å; A106-A109 WeakPolarHBondContact O-CB 3.37Å; A106-A109 PolarHBondContact O-N 3.42Å; A106-E110 PolarHBondContact O-N 3.07Å |
| 107 | R | 61.6 | Low | 62.8 | Low | 128 Ų | 128 | 97.3 Ų | 97.3 | 48% | 0.483 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -66.6 | -38.6 | 176.8 | -165.4 | -178.6 | -65 | 132.7 | 3.2 | 112.4 | E103 E104 A109 E110 E111 | E103-R107 PolarHBondContact O-N 3.32Å; E104-R107 PolarHBondContact O-N 3.23Å; R107-A109 VanDerWaalsContact C-N 3.33Å; R107-E110 PolarHBondContact O-N 3.25Å; R107-E111 PolarHBondContact O-N 3.45Å |
| 108 | E | 54.3 | Low | 64.3 | Low | 71 Ų | 71 | 101.9 Ų | 101.9 | 33% | 0.332 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -67.1 | -33.5 | 171.8 | -81.3 | -174 | 167.4 | 0 | 0 | 112.7 | K100 E104 E110 E111 D112 | K100-E108 WeakPolarHBondContact CD-OE2 3.34Å; K100-E108 WeakPolarHBondContact CE-OE1 3.09Å; K100-E108 WeakPolarHBondContact CE-OE2 3.16Å; K100-E108 IonicContact NZ-OE1 3.95Å; K100-E108 PolarHBondContact NZ-OE1 3.2Å; K100-E108 IonicContact NZ-OE2 2.62Å; K100-E108 PolarHBondContact NZ-OE2 3.21Å; E104-E108 PolarHBondContact O-N 2.8Å; E108-E110 VanDerWaalsContact C-N 3.29Å; E108-E110 PolarHBondContact O-N 3.03Å; E108-E111 PolarHBondContact O-N 2.99Å; E108-D112 WeakPolarHBondContact O-CB 3.4Å; E108-D112 PolarHBondContact O-N 3.27Å |
| 109 | A | 61.9 | Low | 65.6 | Low | 50 Ų | 50 | 102.7 Ų | 102.7 | 41% | 0.413 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -62.7 | -37.7 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | L105 A106 R107 D113 | L105-A109 PolarHBondContact O-N 3.25Å; A106-A109 WeakPolarHBondContact O-CB 3.37Å; A106-A109 PolarHBondContact O-N 3.42Å; R107-A109 VanDerWaalsContact C-N 3.33Å; A109-D113 PolarHBondContact O-N 3.29Å |
| 110 | E | 65.4 | Low | 67 | Low | 139 Ų | 139 | 98.7 Ų | 98.7 | 65% | 0.65 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -68.4 | -37.3 | 173.4 | -68.8 | 177 | -171.5 | 0 | 0 | 112.6 | A106 R107 E108 D113 S114 | A106-E110 PolarHBondContact O-N 3.07Å; R107-E110 PolarHBondContact O-N 3.25Å; E108-E110 VanDerWaalsContact C-N 3.29Å; E108-E110 PolarHBondContact O-N 3.03Å; E110-D113 PolarHBondContact O-N 2.91Å; E110-S114 PolarHBondContact O-N 3.44Å |
| 111 | E | 62.2 | Low | 68.5 | Low | 114 Ų | 114 | 95.6 Ų | 95.6 | 53% | 0.533 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -67.8 | -40.5 | 174.1 | -72.6 | 179.1 | -167.4 | 0 | 0 | 111.8 | R107 E108 D113 S114 I115 | R107-E111 PolarHBondContact O-N 3.45Å; E108-E111 PolarHBondContact O-N 2.99Å; E111-D113 VanDerWaalsContact C-N 3.34Å; E111-D113 PolarHBondContact O-N 3.22Å; E111-S114 WeakPolarHBondContact O-CB 3.43Å; E111-S114 PolarHBondContact O-N 3.43Å; E111-I115 WeakPolarHBondContact O-CG1 3.23Å; E111-I115 PolarHBondContact O-N 2.85Å |
| 112 | D | 63.5 | Low | 69.7 | Low | 104 Ų | 104 | 98.6 Ų | 98.6 | 56% | 0.556 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -62.8 | -39.6 | 174.2 | -82.5 | -14.1 | 0 | 0 | 0 | 111.1 | E108 S114 I115 L116 | E108-D112 WeakPolarHBondContact O-CB 3.4Å; E108-D112 PolarHBondContact O-N 3.27Å; D112-S114 VanDerWaalsContact C-N 3.34Å; D112-S114 PolarHBondContact O-N 3.38Å; D112-I115 PolarHBondContact O-N 3.41Å; D112-L116 VanDerWaalsContact O-CB 3.23Å; D112-L116 WeakPolarHBondContact O-CB 3.31Å; D112-L116 PolarHBondContact O-N 3.5Å |
| 113 | D | 72.4 | Confident | 70.7 | Confident | 107 Ų | 107 | 100.1 Ų | 100.1 | 57% | 0.572 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -64.4 | -37.3 | 173.4 | -82.3 | -16.5 | 0 | 0 | 0 | 112.2 | A109 E110 E111 L116 S117 | A109-D113 PolarHBondContact O-N 3.29Å; E110-D113 PolarHBondContact O-N 2.91Å; E111-D113 VanDerWaalsContact C-N 3.34Å; E111-D113 PolarHBondContact O-N 3.22Å; D113-L116 PolarHBondContact O-N 3.19Å; D113-S117 VanDerWaalsContact O-CB 3.31Å; D113-S117 WeakPolarHBondContact O-CB 3.36Å; D113-S117 PolarHBondContact O-N 3.06Å |
| 114 | S | 76.3 | Confident | 71.9 | Confident | 78 Ų | 78 | 97.6 Ų | 97.6 | 55% | 0.545 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.9 | -44.5 | 174 | -175.6 | 0 | 0 | 0 | 0 | 111.8 | E110 E111 D112 S117 Q118 | E110-S114 PolarHBondContact O-N 3.44Å; E111-S114 WeakPolarHBondContact O-CB 3.43Å; E111-S114 PolarHBondContact O-N 3.43Å; D112-S114 VanDerWaalsContact C-N 3.34Å; D112-S114 PolarHBondContact O-N 3.38Å; S114-S117 PolarHBondContact O-N 3.5Å; S114-Q118 PolarHBondContact O-N 3.46Å |
| 115 | I | 77.3 | Confident | 73.4 | Confident | 87 Ų | 87 | 102.2 Ų | 102.2 | 45% | 0.446 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -62.8 | -44.7 | 174.3 | -67.4 | 169.5 | 0 | 0 | 0 | 110 | E111 D112 S117 Q118 F119 | E111-I115 WeakPolarHBondContact O-CG1 3.23Å; E111-I115 PolarHBondContact O-N 2.85Å; D112-I115 PolarHBondContact O-N 3.41Å; I115-S117 VanDerWaalsContact C-N 3.34Å; I115-S117 PolarHBondContact O-N 2.79Å; I115-Q118 PolarHBondContact O-N 3.34Å; I115-F119 HydrophobicContact CG2-CD2 3.86Å; I115-F119 HydrophobicContact CG2-CE2 4Å; I115-F119 WeakPolarHBondContact O-CD2 3.46Å; I115-F119 PolarHBondContact O-N 2.91Å |
| 116 | L | 77.2 | Confident | 74.5 | Confident | 99 Ų | 99 | 99.2 Ų | 99.2 | 52% | 0.518 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61 | -42.5 | 178.3 | -171.1 | 69.8 | 0 | 0 | 0 | 111.5 | D112 D113 F119 N120 | D112-L116 VanDerWaalsContact O-CB 3.23Å; D112-L116 WeakPolarHBondContact O-CB 3.31Å; D112-L116 PolarHBondContact O-N 3.5Å; D113-L116 PolarHBondContact O-N 3.19Å; L116-F119 WeakPolarHBondContact O-CB 3.36Å; L116-F119 PolarHBondContact O-N 2.99Å; L116-N120 PolarHBondContact O-N 3.29Å; L116-N120 PolarHBondContact O-ND2 3.3Å |
| 117 | S | 79.6 | Confident | 75.7 | Confident | 81 Ų | 81 | 101.4 Ų | 101.4 | 57% | 0.566 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -62.1 | -44 | 174.6 | -177.4 | 0 | 0 | 0 | 0 | 112.1 | D113 S114 I115 F119 N120 G121 | D113-S117 VanDerWaalsContact O-CB 3.31Å; D113-S117 WeakPolarHBondContact O-CB 3.36Å; D113-S117 PolarHBondContact O-N 3.06Å; S114-S117 PolarHBondContact O-N 3.5Å; I115-S117 VanDerWaalsContact C-N 3.34Å; I115-S117 PolarHBondContact O-N 2.79Å; S117-F119 VanDerWaalsContact C-N 3.33Å; S117-F119 PolarHBondContact O-N 3.34Å; S117-N120 PolarHBondContact O-N 2.93Å; S117-G121 PolarHBondContact O-N 3.05Å |
| 118 | Q | 80.5 | Confident | 76.8 | Confident | 147 Ų | 147 | 99 Ų | 99 | 69% | 0.687 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -62 | -40.7 | 175.1 | -177.4 | 176.6 | -25.6 | 0 | 0 | 112.1 | S114 I115 G121 F122 | S114-Q118 PolarHBondContact O-N 3.46Å; I115-Q118 PolarHBondContact O-N 3.34Å; Q118-G121 PolarHBondContact O-N 2.97Å; Q118-F122 PolarHBondContact O-N 3.14Å |
| 119 | F | 81.2 | Confident | 78.2 | Confident | 147 Ų | 147 | 98.4 Ų | 98.4 | 65% | 0.645 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -62.7 | -44.8 | 175 | -98.8 | -92.8 | 0 | 0 | 0 | 112.1 | I115 L116 S117 G121 F122 F123 | I115-F119 HydrophobicContact CG2-CD2 3.86Å; I115-F119 HydrophobicContact CG2-CE2 4Å; I115-F119 WeakPolarHBondContact O-CD2 3.46Å; I115-F119 PolarHBondContact O-N 2.91Å; L116-F119 WeakPolarHBondContact O-CB 3.36Å; L116-F119 PolarHBondContact O-N 2.99Å; S117-F119 VanDerWaalsContact C-N 3.33Å; S117-F119 PolarHBondContact O-N 3.34Å; F119-G121 VanDerWaalsContact C-N 3.34Å; F119-G121 PolarHBondContact O-N 3.19Å; F119-F122 PolarHBondContact O-N 3.46Å; F119-F123 PolarHBondContact O-N 3.39Å |
| 120 | N | 83.1 | Confident | 79.4 | Confident | 89 Ų | 89 | 100.8 Ų | 100.8 | 48% | 0.476 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -60.2 | -44.2 | 175.7 | -72.6 | -22.1 | 0 | 0 | 0 | 111.4 | L116 S117 F122 F123 D124 | L116-N120 PolarHBondContact O-N 3.29Å; L116-N120 PolarHBondContact O-ND2 3.3Å; S117-N120 PolarHBondContact O-N 2.93Å; N120-F122 VanDerWaalsContact C-N 3.29Å; N120-F122 PolarHBondContact O-N 3.44Å; N120-F123 WeakPolarHBondContact O-CB 3.5Å; N120-F123 PolarHBondContact O-N 2.95Å; N120-F123 VanDerWaalsContact O-N 3.14Å; N120-D124 PolarHBondContact O-N 2.98Å |
| 121 | G | 81.7 | Confident | 80.3 | Confident | 30 Ų | 30 | 97.7 Ų | 97.7 | 31% | 0.309 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -63.6 | -31.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 114 | S117 Q118 F119 K125 | S117-G121 PolarHBondContact O-N 3.05Å; Q118-G121 PolarHBondContact O-N 2.97Å; F119-G121 VanDerWaalsContact C-N 3.34Å; F119-G121 PolarHBondContact O-N 3.19Å; G121-K125 WeakPolarHBondContact O-CD 3.47Å; G121-K125 VanDerWaalsContact O-CG 3.28Å; G121-K125 WeakPolarHBondContact O-CG 3.28Å; G121-K125 PolarHBondContact O-N 3.41Å |
| 122 | F | 83.3 | Confident | 81.3 | Confident | 154 Ų | 154 | 96.9 Ų | 96.9 | 68% | 0.675 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -71.1 | -39 | 173.5 | -154.2 | -90.6 | 0 | 0 | 0 | 111.5 | Q118 F119 N120 K125 A126 | Q118-F122 PolarHBondContact O-N 3.14Å; F119-F122 PolarHBondContact O-N 3.46Å; N120-F122 VanDerWaalsContact C-N 3.29Å; N120-F122 PolarHBondContact O-N 3.44Å; F122-K125 PolarHBondContact O-N 2.71Å; F122-A126 WeakPolarHBondContact O-CB 3.48Å; F122-A126 PolarHBondContact O-N 2.91Å |
| 123 | F | 83.7 | Confident | 82.2 | Confident | 121 Ų | 121 | 98.9 Ų | 98.9 | 53% | 0.531 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -66.8 | -41 | 178.6 | -168 | -121.3 | 0 | 0 | 0 | 112.4 | F119 N120 A126 K127 | F119-F123 PolarHBondContact O-N 3.39Å; N120-F123 WeakPolarHBondContact O-CB 3.5Å; N120-F123 PolarHBondContact O-N 2.95Å; N120-F123 VanDerWaalsContact O-N 3.14Å; F123-A126 PolarHBondContact O-N 3.42Å; F123-K127 HydrophobicContact CD1-CD 4.21Å; F123-K127 HydrophobicContact CE1-CD 4.16Å; F123-K127 WeakPolarHBondContact O-CG 3.32Å; F123-K127 PolarHBondContact O-N 3.01Å |
| 124 | D | 87.2 | Confident | 82.8 | Confident | 91 Ų | 91 | 95.5 Ų | 95.5 | 49% | 0.487 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -65.9 | -41 | 175.8 | -72 | -27.7 | 0 | 0 | 0 | 111.9 | N120 A126 K127 T128 | N120-D124 PolarHBondContact O-N 2.98Å; D124-A126 VanDerWaalsContact C-N 3.3Å; D124-A126 PolarHBondContact O-N 3.25Å; D124-K127 PolarHBondContact O-N 3.14Å; D124-T128 WeakPolarHBondContact O-CG2 3.41Å; D124-T128 PolarHBondContact O-N 3.44Å; D124-T128 PolarHBondContact O-OG1 2.95Å |
| 125 | K | 85.5 | Confident | 83 | Confident | 151 Ų | 151 | 95.2 Ų | 95.2 | 66% | 0.657 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -61 | -38.5 | 172.4 | -72.9 | 171.1 | -173.7 | 173.9 | 0 | 112.5 | G121 F122 T128 A129 | G121-K125 WeakPolarHBondContact O-CD 3.47Å; G121-K125 VanDerWaalsContact O-CG 3.28Å; G121-K125 WeakPolarHBondContact O-CG 3.28Å; G121-K125 PolarHBondContact O-N 3.41Å; F122-K125 PolarHBondContact O-N 2.71Å; K125-T128 WeakPolarHBondContact CA-OG1 3.49Å; K125-T128 PolarHBondContact O-OG1 2.91Å; K125-A129 VanDerWaalsContact O-CB 3.25Å; K125-A129 WeakPolarHBondContact O-CB 3.28Å; K125-A129 PolarHBondContact O-N 3.28Å |
| 126 | A | 83.2 | Confident | 83.1 | Confident | 44 Ų | 44 | 94.4 Ų | 94.4 | 36% | 0.364 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -67.7 | -43.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | F122 F123 D124 A129 V130 | F122-A126 WeakPolarHBondContact O-CB 3.48Å; F122-A126 PolarHBondContact O-N 2.91Å; F123-A126 PolarHBondContact O-N 3.42Å; D124-A126 VanDerWaalsContact C-N 3.3Å; D124-A126 PolarHBondContact O-N 3.25Å; A126-A129 PolarHBondContact O-N 2.97Å; A126-V130 WeakPolarHBondContact O-CB 3.43Å; A126-V130 VanDerWaalsContact O-CG2 3.28Å; A126-V130 WeakPolarHBondContact O-CG2 3.49Å; A126-V130 PolarHBondContact O-N 2.97Å |
| 127 | K | 88.3 | Confident | 83.1 | Confident | 98 Ų | 98 | 92.3 Ų | 92.3 | 43% | 0.426 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.4 | -45.1 | 175.6 | -77.3 | 175.2 | 174.6 | 165.9 | 0 | 112.4 | F123 D124 V130 T131 | F123-K127 HydrophobicContact CD1-CD 4.21Å; F123-K127 HydrophobicContact CE1-CD 4.16Å; F123-K127 WeakPolarHBondContact O-CG 3.32Å; F123-K127 PolarHBondContact O-N 3.01Å; D124-K127 PolarHBondContact O-N 3.14Å; K127-V130 PolarHBondContact O-N 3.28Å; K127-T131 VanDerWaalsContact O-CB 3.32Å; K127-T131 WeakPolarHBondContact O-CB 3.22Å; K127-T131 PolarHBondContact O-N 2.85Å; K127-T131 PolarHBondContact O-OG1 2.85Å |
| 128 | T | 85.8 | Confident | 82.9 | Confident | 78 Ų | 78 | 95.4 Ų | 95.4 | 48% | 0.479 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.1 | -45.4 | 177.8 | 54.2 | 0 | 0 | 0 | 0 | 110.7 | D124 K125 V130 T131 D132 | D124-T128 WeakPolarHBondContact O-CG2 3.41Å; D124-T128 PolarHBondContact O-N 3.44Å; D124-T128 PolarHBondContact O-OG1 2.95Å; K125-T128 WeakPolarHBondContact CA-OG1 3.49Å; K125-T128 PolarHBondContact O-OG1 2.91Å; T128-V130 VanDerWaalsContact C-N 3.35Å; T128-V130 PolarHBondContact O-N 3.4Å; T128-T131 PolarHBondContact O-N 3.46Å; T128-T131 VanDerWaalsContact O-N 3.13Å; T128-D132 WeakPolarHBondContact O-CB 3.26Å; T128-D132 PolarHBondContact O-N 3.24Å |
| 129 | A | 84.2 | Confident | 82.5 | Confident | 57 Ų | 57 | 95.1 Ų | 95.1 | 47% | 0.471 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -58.7 | -42.5 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | K125 A126 F133 | K125-A129 VanDerWaalsContact O-CB 3.25Å; K125-A129 WeakPolarHBondContact O-CB 3.28Å; K125-A129 PolarHBondContact O-N 3.28Å; A126-A129 PolarHBondContact O-N 2.97Å; A129-F133 VanDerWaalsContact O-CB 3.31Å; A129-F133 WeakPolarHBondContact O-CB 3.38Å; A129-F133 PolarHBondContact O-N 3.21Å |
| 130 | V | 85.5 | Confident | 82 | Confident | 101 Ų | 101 | 97.4 Ų | 97.4 | 61% | 0.612 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -67.5 | -40.1 | 176.4 | 172.2 | 0 | 0 | 0 | 0 | 111.2 | A126 K127 T128 F133 A134 | A126-V130 WeakPolarHBondContact O-CB 3.43Å; A126-V130 VanDerWaalsContact O-CG2 3.28Å; A126-V130 WeakPolarHBondContact O-CG2 3.49Å; A126-V130 PolarHBondContact O-N 2.97Å; K127-V130 PolarHBondContact O-N 3.28Å; T128-V130 VanDerWaalsContact C-N 3.35Å; T128-V130 PolarHBondContact O-N 3.4Å; V130-F133 PolarHBondContact O-N 3.49Å; V130-A134 VanDerWaalsContact O-CB 3.26Å; V130-A134 WeakPolarHBondContact O-CB 3.31Å; V130-A134 PolarHBondContact O-N 2.79Å |
| 131 | T | 84.4 | Confident | 80.8 | Confident | 73 Ų | 73 | 97.3 Ų | 97.3 | 45% | 0.448 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -67 | -42.9 | 178.3 | -56.2 | 0 | 0 | 0 | 0 | 111.4 | K127 T128 A134 N135 | K127-T131 VanDerWaalsContact O-CB 3.32Å; K127-T131 WeakPolarHBondContact O-CB 3.22Å; K127-T131 PolarHBondContact O-N 2.85Å; K127-T131 PolarHBondContact O-OG1 2.85Å; T128-T131 PolarHBondContact O-N 3.46Å; T128-T131 VanDerWaalsContact O-N 3.13Å; T131-A134 PolarHBondContact O-N 3.13Å; T131-N135 WeakPolarHBondContact O-CB 3.39Å; T131-N135 VanDerWaalsContact O-CG 3.24Å; T131-N135 PolarHBondContact O-N 2.93Å; T131-N135 PolarHBondContact O-ND2 3.31Å |
| 132 | D | 83.3 | Confident | 80 | Confident | 97 Ų | 97 | 101.2 Ų | 101.2 | 52% | 0.519 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -64.7 | -42.2 | 176.8 | -69.4 | -18.5 | 0 | 0 | 0 | 111.2 | T128 N135 T136 | T128-D132 WeakPolarHBondContact O-CB 3.26Å; T128-D132 PolarHBondContact O-N 3.24Å; D132-N135 PolarHBondContact O-N 3.35Å; D132-T136 WeakPolarHBondContact O-CB 3.25Å; D132-T136 PolarHBondContact O-N 2.84Å; D132-T136 PolarHBondContact O-OG1 2.88Å |
| 133 | F | 83.6 | Confident | 79 | Confident | 146 Ų | 146 | 102 Ų | 102 | 64% | 0.64 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -62.9 | -47.3 | 173.1 | -177.5 | -102.1 | 0 | 0 | 0 | 111.4 | A129 V130 N135 T136 V137 | A129-F133 VanDerWaalsContact O-CB 3.31Å; A129-F133 WeakPolarHBondContact O-CB 3.38Å; A129-F133 PolarHBondContact O-N 3.21Å; V130-F133 PolarHBondContact O-N 3.49Å; F133-N135 VanDerWaalsContact C-N 3.33Å; F133-N135 PolarHBondContact O-N 3.48Å; F133-T136 PolarHBondContact O-N 2.96Å; F133-V137 HydrophobicContact CD1-CG2 4.1Å; F133-V137 HydrophobicContact CD2-CG2 4.36Å; F133-V137 HydrophobicContact CE1-CG2 3.71Å; F133-V137 HydrophobicContact CE2-CG2 3.99Å; F133-V137 HydrophobicContact CG-CG2 4.42Å; F133-V137 HydrophobicContact CZ-CG2 3.65Å; F133-V137 WeakPolarHBondContact O-CB 3.37Å; F133-V137 VanDerWaalsContact O-CG2 3.29Å; F133-V137 WeakPolarHBondContact O-CG2 3.2Å; F133-V137 PolarHBondContact O-N 3.49Å |
| 134 | A | 83.5 | Confident | 77.5 | Confident | 36 Ų | 36 | 104.4 Ų | 104.4 | 30% | 0.298 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -61.1 | -40.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | V130 T131 K138 | V130-A134 VanDerWaalsContact O-CB 3.26Å; V130-A134 WeakPolarHBondContact O-CB 3.31Å; V130-A134 PolarHBondContact O-N 2.79Å; T131-A134 PolarHBondContact O-N 3.13Å; A134-K138 WeakPolarHBondContact O-CB 3.5Å; A134-K138 VanDerWaalsContact O-CG 3.22Å; A134-K138 WeakPolarHBondContact O-CG 3.29Å; A134-K138 PolarHBondContact O-N 2.94Å |
| 135 | N | 80.6 | Confident | 75.4 | Confident | 72 Ų | 72 | 112.7 Ų | 112.7 | 39% | 0.385 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -69.1 | -39.8 | 176.2 | -72.3 | -28.3 | 0 | 0 | 0 | 112 | T131 D132 F133 K138 N139 | T131-N135 WeakPolarHBondContact O-CB 3.39Å; T131-N135 VanDerWaalsContact O-CG 3.24Å; T131-N135 PolarHBondContact O-N 2.93Å; T131-N135 PolarHBondContact O-ND2 3.31Å; D132-N135 PolarHBondContact O-N 3.35Å; F133-N135 VanDerWaalsContact C-N 3.33Å; F133-N135 PolarHBondContact O-N 3.48Å; N135-K138 PolarHBondContact O-N 3.44Å; N135-N139 WeakPolarHBondContact O-CB 3.45Å; N135-N139 VanDerWaalsContact O-CG 3.25Å; N135-N139 PolarHBondContact O-N 2.91Å; N135-N139 PolarHBondContact O-ND2 3.45Å |
| 136 | T | 79.2 | Confident | 74.9 | Confident | 71 Ų | 71 | 110.8 Ų | 110.8 | 44% | 0.436 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -61.8 | -48.2 | 174.5 | -56.5 | 0 | 0 | 0 | 0 | 110.3 | D132 F133 K138 N139 Y140 | D132-T136 WeakPolarHBondContact O-CB 3.25Å; D132-T136 PolarHBondContact O-N 2.84Å; D132-T136 PolarHBondContact O-OG1 2.88Å; F133-T136 PolarHBondContact O-N 2.96Å; T136-K138 PolarHBondContact O-N 3.38Å; T136-N139 PolarHBondContact O-N 3.42Å; T136-Y140 HydrophobicContact CG2-CD2 3.83Å; T136-Y140 HydrophobicContact CG2-CE2 3.95Å; T136-Y140 WeakPolarHBondContact O-CD2 3.46Å; T136-Y140 PolarHBondContact O-N 2.84Å |
| 137 | V | 78.9 | Confident | 74.5 | Confident | 54 Ų | 54 | 114.3 Ų | 114.3 | 33% | 0.327 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -62 | -42.3 | 177.7 | 172 | 0 | 0 | 0 | 0 | 111.3 | F133 N139 Y140 L141 | F133-V137 HydrophobicContact CD1-CG2 4.1Å; F133-V137 HydrophobicContact CD2-CG2 4.36Å; F133-V137 HydrophobicContact CE1-CG2 3.71Å; F133-V137 HydrophobicContact CE2-CG2 3.99Å; F133-V137 HydrophobicContact CG-CG2 4.42Å; F133-V137 HydrophobicContact CZ-CG2 3.65Å; F133-V137 WeakPolarHBondContact O-CB 3.37Å; F133-V137 VanDerWaalsContact O-CG2 3.29Å; F133-V137 WeakPolarHBondContact O-CG2 3.2Å; F133-V137 PolarHBondContact O-N 3.49Å; V137-N139 VanDerWaalsContact C-N 3.32Å; V137-N139 PolarHBondContact O-N 3.25Å; V137-Y140 PolarHBondContact O-N 3.18Å; V137-L141 HydrophobicContact CG1-CD1 3.57Å; V137-L141 WeakPolarHBondContact O-CB 3.35Å; V137-L141 WeakPolarHBondContact O-CD1 3.4Å; V137-L141 PolarHBondContact O-N 2.95Å |
| 138 | K | 74.1 | Confident | 73.7 | Confident | 146 Ų | 146 | 115.2 Ų | 115.2 | 64% | 0.635 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -60.4 | -39.7 | 174.4 | -77.1 | 172.4 | -175.5 | 176.9 | 0 | 112.7 | A134 N135 T136 L141 | A134-K138 WeakPolarHBondContact O-CB 3.5Å; A134-K138 VanDerWaalsContact O-CG 3.22Å; A134-K138 WeakPolarHBondContact O-CG 3.29Å; A134-K138 PolarHBondContact O-N 2.94Å; N135-K138 PolarHBondContact O-N 3.44Å; T136-K138 PolarHBondContact O-N 3.38Å; K138-L141 PolarHBondContact O-N 2.88Å |
| 139 | N | 72.1 | Confident | 73 | Confident | 142 Ų | 142 | 117.4 Ų | 117.4 | 76% | 0.759 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -73.8 | -27.6 | 178.3 | -70.2 | -13.2 | 0 | 0 | 0 | 112.9 | N135 T136 V137 | N135-N139 WeakPolarHBondContact O-CB 3.45Å; N135-N139 VanDerWaalsContact O-CG 3.25Å; N135-N139 PolarHBondContact O-N 2.91Å; N135-N139 PolarHBondContact O-ND2 3.45Å; T136-N139 PolarHBondContact O-N 3.42Å; V137-N139 VanDerWaalsContact C-N 3.32Å; V137-N139 PolarHBondContact O-N 3.25Å |
| 140 | Y | 70.4 | Confident | 72.3 | Confident | 195 Ų | 195 | 121.1 Ų | 121.1 | 77% | 0.765 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -85.3 | -18.7 | 174.7 | -88.5 | -89.9 | 0 | 0 | 0 | 113.4 | T136 V137 P142 | T136-Y140 HydrophobicContact CG2-CD2 3.83Å; T136-Y140 HydrophobicContact CG2-CE2 3.95Å; T136-Y140 WeakPolarHBondContact O-CD2 3.46Å; T136-Y140 PolarHBondContact O-N 2.84Å; V137-Y140 PolarHBondContact O-N 3.18Å; Y140-P142 WeakPolarHBondContact O-CD 3.33Å |
| 141 | L | 58.8 | Low | 71.4 | Confident | 87 Ų | 87 | 122.5 Ų | 122.5 | 46% | 0.455 | 61% | 0.614 | S | S | . | * | S | Bend | trans | -80.2 | 117.8 | 174 | -100.9 | 80.2 | 0 | 0 | 0 | 110.1 | V137 K138 F143 | V137-L141 HydrophobicContact CG1-CD1 3.57Å; V137-L141 WeakPolarHBondContact O-CB 3.35Å; V137-L141 WeakPolarHBondContact O-CD1 3.4Å; V137-L141 PolarHBondContact O-N 2.95Å; K138-L141 PolarHBondContact O-N 2.88Å; L141-F143 HydrophobicContact CB-CD2 4.17Å; L141-F143 HydrophobicContact CD2-CD2 3.88Å; L141-F143 HydrophobicContact CD2-CE2 3.99Å; L141-F143 HydrophobicContact CG-CD2 4.28Å; L141-F143 HydrophobicContact CG-CE2 4.47Å; L141-F143 PolarHBondContact O-N 3.49Å |
| 142 | P | 65.5 | Low | 70.5 | Confident | 111 Ų | 111 | 126 Ų | 126 | 72% | 0.721 | 63% | 0.626 | S | S | * | * | trans | -78.4 | 37.5 | -173.1 | 34.8 | -38.2 | 0 | 0 | 0 | 113.7 | Y140 | Y140-P142 WeakPolarHBondContact O-CD 3.33Š| ||
| 143 | F | 61.5 | Low | 69.5 | Low | 171 Ų | 171 | 128.2 Ų | 128.2 | 75% | 0.75 | 63% | 0.634 | S | S | * | * | trans | -94.2 | 3.9 | -178.9 | -71.6 | -69.6 | 0 | 0 | 0 | 114.7 | L141 K145 | L141-F143 HydrophobicContact CB-CD2 4.17Å; L141-F143 HydrophobicContact CD2-CD2 3.88Å; L141-F143 HydrophobicContact CD2-CE2 3.99Å; L141-F143 HydrophobicContact CG-CD2 4.28Å; L141-F143 HydrophobicContact CG-CE2 4.47Å; L141-F143 PolarHBondContact O-N 3.49Å; F143-K145 PolarHBondContact O-N 2.73Å | ||
| 144 | N | 52.6 | Low | 68.3 | Low | 172 Ų | 172 | 126.8 Ų | 126.8 | 92% | 0.92 | 63% | 0.633 | S | S | * | * | trans | -96.1 | 77.7 | 161.4 | -104.7 | -4.5 | 0 | 0 | 0 | 109.1 | ||||
| 145 | K | 43.2 | Very low | 67 | Low | 264 Ų | 264 | 135 Ų | 135 | 100% | 1.148 | 66% | 0.664 | S | S | * | * | trans | -97.2 | 0 | 150.8 | -78 | -165.2 | 178.5 | -176.2 | 0 | 108.3 | F143 | F143-K145 PolarHBondContact O-N 2.73Š|
Retrieved 145 of 145 residues in 167 ms
(Link to these results)