| 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 | 40.4 | Very low | 51.4 | Low | 234 Ų | 234 | 129.7 Ų | 129.7 | 100% | 1.153 | 65% | 0.653 | S | S | * | * | 0 | 98 | 0 | -71.4 | 159.7 | 86.7 | 0 | 0 | 107.8 | S3 | M1-S3 PolarHBondContact O-N 2.85Š| |||
| 2 | N | 40.3 | Very low | 52.1 | Low | 156 Ų | 156 | 130.5 Ų | 130.5 | 83% | 0.834 | 66% | 0.66 | S | S | * | * | trans | -97.5 | 83.1 | -167.7 | -62.7 | -14.9 | 0 | 0 | 0 | 110.2 | R4 | N2-R4 PolarHBondContact O-N 3.1Š| ||
| 3 | S | 47.7 | Very low | 52.6 | Low | 96 Ų | 96 | 127.5 Ų | 127.5 | 67% | 0.671 | 66% | 0.658 | S | S | * | * | G | 310 helix | trans | -77.4 | -4.4 | 176.5 | 52 | 0 | 0 | 0 | 0 | 114.1 | M1 G5 | M1-S3 PolarHBondContact O-N 2.85Å; S3-G5 PolarHBondContact O-N 2.72Å |
| 4 | R | 51.8 | Low | 53 | Low | 236 Ų | 236 | 122.2 Ų | 122.2 | 89% | 0.891 | 64% | 0.635 | S | S | * | * | G | 310 helix | trans | -76.6 | -15.4 | -172.3 | -74.5 | -171.7 | -93.2 | -156.9 | -3.8 | 115.1 | N2 | N2-R4 PolarHBondContact O-N 3.1Š|
| 5 | G | 52.4 | Low | 53.2 | Low | 50 Ų | 50 | 120.3 Ų | 120.3 | 52% | 0.515 | 63% | 0.633 | S | S | . | * | G | 310 helix | trans | -92.7 | -17.6 | -178.7 | 0 | 0 | 0 | 0 | 0 | 115.6 | S3 S8 | S3-G5 PolarHBondContact O-N 2.72Å; G5-S8 PolarHBondContact O-OG 2.95Å |
| 6 | L | 49.9 | Very low | 53.2 | Low | 94 Ų | 94 | 120.8 Ų | 120.8 | 49% | 0.492 | 64% | 0.642 | S | S | . | * | S | Bend | trans | -79.9 | -23.8 | -175 | -75.3 | 166.8 | 0 | 0 | 0 | 113.1 | S8 Q9 | L6-S8 VanDerWaalsContact C-N 3.27Å; L6-S8 PolarHBondContact O-N 3.41Å; L6-Q9 PolarHBondContact O-N 2.71Å |
| 7 | R | 51.2 | Low | 53.1 | Low | 204 Ų | 204 | 118.1 Ų | 118.1 | 77% | 0.77 | 64% | 0.641 | S | S | * | * | G | 310 helix | trans | -67.1 | -27.6 | -178.2 | -145.2 | -179.5 | -169.2 | -162.5 | 2.4 | 112.7 | Q9 L10 | R7-Q9 PolarHBondContact O-N 3.23Å; R7-L10 HydrophobicContact CG-CD1 4.4Å |
| 8 | S | 55 | Low | 52.9 | Low | 87 Ų | 87 | 113.8 Ų | 113.8 | 61% | 0.608 | 63% | 0.628 | S | S | * | * | G | 310 helix | trans | -78.8 | -4.9 | 177.6 | 70.4 | 0 | 0 | 0 | 0 | 114 | G5 L6 | G5-S8 PolarHBondContact O-OG 2.95Å; L6-S8 VanDerWaalsContact C-N 3.27Å; L6-S8 PolarHBondContact O-N 3.41Å |
| 9 | Q | 56.3 | Low | 52.7 | Low | 92 Ų | 92 | 116.7 Ų | 116.7 | 43% | 0.43 | 64% | 0.642 | S | S | . | * | G | 310 helix | trans | -101.7 | 0.1 | 179.2 | -61.3 | -70.3 | 82 | 0 | 0 | 112.3 | L6 R7 L51 | L6-Q9 PolarHBondContact O-N 2.71Å; R7-Q9 PolarHBondContact O-N 3.23Å; Q9-L51 HydrophobicContact CB-CD1 4.4Å |
| 10 | L | 60.6 | Low | 52.6 | Low | 44 Ų | 44 | 113.9 Ų | 113.9 | 23% | 0.23 | 63% | 0.63 | C | S | . | * | S | Bend | trans | -75.4 | 143.4 | 170.3 | -63.3 | 175.6 | 0 | 0 | 0 | 108.8 | R7 D12 L44 P45 L51 | R7-L10 HydrophobicContact CG-CD1 4.4Å; L10-D12 VanDerWaalsContact C-N 3.34Å; L10-D12 PolarHBondContact O-N 3.05Å; L10-L44 HydrophobicContact CD1-CD2 4.3Å; L10-P45 HydrophobicContact CD2-CG 4.12Å; L10-L51 HydrophobicContact CD2-CD1 4.03Å |
| 11 | K | 59.8 | Low | 52.6 | Low | 134 Ų | 134 | 114.2 Ų | 114.2 | 58% | 0.583 | 64% | 0.637 | S | S | * | * | trans | -68.1 | 96.5 | 171.6 | -74.6 | 179.1 | 172.4 | -176.1 | 0 | 107.6 | S13 L43 | K11-S13 PolarHBondContact O-N 3.3Å; K11-S13 VanDerWaalsContact O-N 3.07Å; K11-L43 VanDerWaalsContact O-CD2 3.31Å; K11-L43 WeakPolarHBondContact O-CD2 3.48Å | ||
| 12 | D | 59.7 | Low | 53.4 | Low | 139 Ų | 139 | 108.3 Ų | 108.3 | 74% | 0.743 | 61% | 0.607 | S | S | * | * | S | Bend | trans | -67.1 | -5.4 | 177 | -69.1 | -33.6 | 0 | 0 | 0 | 113 | L10 | L10-D12 VanDerWaalsContact C-N 3.34Å; L10-D12 PolarHBondContact O-N 3.05Å |
| 13 | S | 58.2 | Low | 54.3 | Low | 91 Ų | 91 | 103 Ų | 103 | 64% | 0.636 | 59% | 0.589 | S | S | * | * | trans | -140 | 130.8 | -179.4 | 43.9 | 0 | 0 | 0 | 0 | 111.1 | K11 | K11-S13 PolarHBondContact O-N 3.3Å; K11-S13 VanDerWaalsContact O-N 3.07Å | ||
| 14 | V | 59.1 | Low | 55 | Low | 54 Ų | 54 | 103.4 Ų | 103.4 | 33% | 0.327 | 60% | 0.598 | S | S | . | * | P | Polyproline II helix | trans | -84.3 | 127.4 | 166.3 | 174.5 | 0 | 0 | 0 | 0 | 106.6 | V16 V39 L43 | V14-V16 PolarHBondContact O-N 2.99Å; V14-V39 HydrophobicContact CG2-CG1 3.91Å; V14-L43 HydrophobicContact CG2-CD1 4.06Å; V14-L43 HydrophobicContact CG2-CD2 4.35Å; V14-L43 HydrophobicContact CG2-CG 3.99Å |
| 15 | P | 56.2 | Low | 55.8 | Low | 94 Ų | 94 | 102.4 Ų | 102.4 | 61% | 0.61 | 60% | 0.596 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 116.2 | 172.1 | 25.6 | -31.1 | 0 | 0 | 0 | 108.1 | A17 | P15-A17 PolarHBondContact O-N 3.32Š|
| 16 | V | 52.2 | Low | 56.4 | Low | 127 Ų | 127 | 102.5 Ų | 102.5 | 77% | 0.77 | 60% | 0.597 | S | S | * | * | P | Polyproline II helix | trans | -56.2 | 127.7 | 170.8 | 171.6 | 0 | 0 | 0 | 0 | 107.1 | V14 G18 | V14-V16 PolarHBondContact O-N 2.99Å; V16-G18 PolarHBondContact O-N 3.31Å |
| 17 | A | 52 | Low | 57.1 | Low | 76 Ų | 76 | 103.1 Ų | 103.1 | 63% | 0.628 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.1 | 27.1 | -173.1 | 0 | 0 | 0 | 0 | 0 | 115.6 | P15 | P15-A17 PolarHBondContact O-N 3.32Š|
| 18 | G | 50.1 | Low | 57.8 | Low | 40 Ų | 40 | 96 Ų | 96 | 41% | 0.412 | 58% | 0.58 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -109.8 | -5.7 | -173.3 | 0 | 0 | 0 | 0 | 0 | 116.4 | V16 | V16-G18 PolarHBondContact O-N 3.31Š|
| 19 | L | 48.7 | Very low | 58.2 | Low | 170 Ų | 170 | 95.6 Ų | 95.6 | 89% | 0.89 | 57% | 0.571 | S | S | * | * | trans | -118.9 | 13.6 | -170.9 | -67.2 | 173.8 | 0 | 0 | 0 | 115.3 | ||||
| 20 | C | 51.2 | Low | 58.6 | Low | 60 Ų | 60 | 93.6 Ų | 93.6 | 41% | 0.405 | 57% | 0.567 | S | S | . | * | S | Bend | trans | -67.3 | 146 | 166.7 | -86.8 | 0 | 0 | 0 | 0 | 110.2 | Q22 | C20-Q22 PolarHBondContact O-N 3.26Š|
| 21 | P | 52.1 | Low | 58.9 | Low | 121 Ų | 121 | 98.3 Ų | 98.3 | 79% | 0.786 | 59% | 0.592 | S | S | * | * | trans | -57.4 | 114.8 | 176.3 | 24.2 | -31.5 | 0 | 0 | 0 | 107.9 | G23 | P21-G23 PolarHBondContact O-N 2.99Š| ||
| 22 | Q | 56.5 | Low | 58.9 | Low | 110 Ų | 110 | 102.5 Ų | 102.5 | 51% | 0.514 | 60% | 0.604 | S | S | . | * | trans | -59 | 130.7 | 173.5 | -76.8 | 89 | 33.3 | 0 | 0 | 107.7 | C20 | C20-Q22 PolarHBondContact O-N 3.26Š| ||
| 23 | G | 59.9 | Low | 59 | Low | 44 Ų | 44 | 98.4 Ų | 98.4 | 45% | 0.454 | 59% | 0.586 | S | S | . | * | trans | -56.1 | 165.6 | 167.6 | 0 | 0 | 0 | 0 | 0 | 110 | P21 Y25 G26 | P21-G23 PolarHBondContact O-N 2.99Å; G23-Y25 PolarHBondContact O-N 2.64Å; G23-G26 PolarHBondContact O-N 2.85Å | ||
| 24 | A | 62.6 | Low | 59 | Low | 105 Ų | 105 | 95.7 Ų | 95.7 | 87% | 0.868 | 57% | 0.573 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -49.4 | -16.9 | -175.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||
| 25 | Y | 69 | Low | 59.1 | Low | 214 Ų | 214 | 96.3 Ų | 96.3 | 84% | 0.839 | 58% | 0.579 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.6 | 9.6 | 179.9 | -59.1 | -75.6 | 0 | 0 | 0 | 115.4 | G23 V27 | G23-Y25 PolarHBondContact O-N 2.64Å; Y25-V27 PolarHBondContact O-N 2.86Å; Y25-V27 VanDerWaalsContact O-N 3.1Å |
| 26 | G | 64.3 | Low | 59.4 | Low | 53 Ų | 53 | 99.5 Ų | 99.5 | 55% | 0.546 | 58% | 0.584 | S | S | . | * | S | Bend | trans | 74.2 | -2.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 115.3 | G23 | G23-G26 PolarHBondContact O-N 2.85Š|
| 27 | V | 65.3 | Low | 60 | Low | 106 Ų | 106 | 97.1 Ų | 97.1 | 64% | 0.642 | 57% | 0.57 | S | S | * | * | trans | -86.1 | 130.5 | 177.6 | -176.5 | 0 | 0 | 0 | 0 | 109.3 | Y25 D29 | Y25-V27 PolarHBondContact O-N 2.86Å; Y25-V27 VanDerWaalsContact O-N 3.1Å; V27-D29 PolarHBondContact O-N 3.32Å | ||
| 28 | Q | 64.6 | Low | 60.7 | Low | 55 Ų | 55 | 96.7 Ų | 96.7 | 26% | 0.257 | 56% | 0.562 | S | S | . | * | trans | -70.6 | 121.8 | 172.3 | -65 | -69.6 | 4.9 | 0 | 0 | 109 | S30 | Q28-S30 VanDerWaalsContact C-N 3.29Å; Q28-S30 PolarHBondContact O-N 3.39Å | ||
| 29 | D | 63.2 | Low | 61.5 | Low | 79 Ų | 79 | 98.7 Ų | 98.7 | 42% | 0.422 | 57% | 0.566 | S | S | . | * | trans | -77.5 | 82.8 | 174 | -169.3 | -22.8 | 0 | 0 | 0 | 109.4 | V27 L31 R32 S33 | V27-D29 PolarHBondContact O-N 3.32Å; D29-L31 PolarHBondContact O-N 3.48Å; D29-L31 PolarHBondContact OD1-N 3.31Å; D29-R32 HydrophobicContact CB-CB 4.26Å; D29-R32 PolarHBondContact O-N 3.15Å; D29-R32 PolarHBondContact OD1-N 3.3Å; D29-R32 WeakPolarHBondContact OD2-CD 3.25Å; D29-R32 VanDerWaalsContact OD2-CG 3.25Å; D29-R32 WeakPolarHBondContact OD2-CG 3.15Å; D29-R32 IonicContact OD2-NE 3.95Å; D29-S33 VanDerWaalsContact O-CB 3.25Å; D29-S33 WeakPolarHBondContact O-CB 3.31Å; D29-S33 PolarHBondContact O-N 2.72Å; D29-S33 PolarHBondContact O-OG 3.39Å | ||
| 30 | S | 65.4 | Low | 62.3 | Low | 49 Ų | 49 | 98.4 Ų | 98.4 | 34% | 0.343 | 56% | 0.557 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -61.2 | -26.5 | -178.2 | -57.1 | 0 | 0 | 0 | 0 | 113.3 | Q28 S33 G34 S35 F36 | Q28-S30 VanDerWaalsContact C-N 3.29Å; Q28-S30 PolarHBondContact O-N 3.39Å; S30-S33 VanDerWaalsContact CA-OG 3.31Å; S30-S33 WeakPolarHBondContact CA-OG 3.25Å; S30-G34 PolarHBondContact O-N 3.23Å; S30-S35 PolarHBondContact O-N 2.99Å; S30-F36 WeakPolarHBondContact O-CE2 3.44Å |
| 31 | L | 66.3 | Low | 63.1 | Low | 144 Ų | 144 | 101 Ų | 101 | 75% | 0.754 | 57% | 0.567 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.2 | -43 | 179.2 | -69.6 | 169.8 | 0 | 0 | 0 | 111 | D29 F36 | D29-L31 PolarHBondContact O-N 3.48Å; D29-L31 PolarHBondContact OD1-N 3.31Å; L31-F36 HydrophobicContact CD2-CE2 3.68Å; L31-F36 HydrophobicContact CD2-CZ 4.24Å; L31-F36 HydrophobicContact CG-CE2 4.26Å |
| 32 | R | 60.6 | Low | 63.9 | Low | 222 Ų | 222 | 97.9 Ų | 97.9 | 84% | 0.838 | 54% | 0.542 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.5 | -31.9 | 175.5 | -70.3 | -170.6 | 169.6 | -163.4 | -6.7 | 113.8 | D29 G34 | D29-R32 HydrophobicContact CB-CB 4.26Å; D29-R32 PolarHBondContact O-N 3.15Å; D29-R32 PolarHBondContact OD1-N 3.3Å; D29-R32 WeakPolarHBondContact OD2-CD 3.25Å; D29-R32 VanDerWaalsContact OD2-CG 3.25Å; D29-R32 WeakPolarHBondContact OD2-CG 3.15Å; D29-R32 IonicContact OD2-NE 3.95Å; R32-G34 VanDerWaalsContact C-N 3.29Å; R32-G34 PolarHBondContact O-N 3.46Å |
| 33 | S | 61 | Low | 64.6 | Low | 53 Ų | 53 | 95.7 Ų | 95.7 | 37% | 0.371 | 53% | 0.534 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.7 | -4.5 | -179.4 | 59.1 | 0 | 0 | 0 | 0 | 114.1 | D29 S30 S35 | D29-S33 VanDerWaalsContact O-CB 3.25Å; D29-S33 WeakPolarHBondContact O-CB 3.31Å; D29-S33 PolarHBondContact O-N 2.72Å; D29-S33 PolarHBondContact O-OG 3.39Å; S30-S33 VanDerWaalsContact CA-OG 3.31Å; S30-S33 WeakPolarHBondContact CA-OG 3.25Å; S33-S35 VanDerWaalsContact C-N 3.32Å; S33-S35 PolarHBondContact O-N 3.23Å |
| 34 | G | 60 | Low | 65.3 | Low | 34 Ų | 34 | 98.8 Ų | 98.8 | 35% | 0.351 | 54% | 0.54 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 72.3 | 19.8 | 173 | 0 | 0 | 0 | 0 | 0 | 114.6 | S30 R32 F36 T37 | S30-G34 PolarHBondContact O-N 3.23Å; R32-G34 VanDerWaalsContact C-N 3.29Å; R32-G34 PolarHBondContact O-N 3.46Å; G34-F36 PolarHBondContact O-N 3.25Å; G34-T37 PolarHBondContact O-N 2.85Å; G34-T37 PolarHBondContact O-OG1 3.48Å |
| 35 | S | 60.1 | Low | 65.9 | Low | 66 Ų | 66 | 95.9 Ų | 95.9 | 46% | 0.462 | 51% | 0.512 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.8 | 7.1 | -174.2 | -167.3 | 0 | 0 | 0 | 0 | 115.4 | S30 S33 | S30-S35 PolarHBondContact O-N 2.99Å; S33-S35 VanDerWaalsContact C-N 3.32Å; S33-S35 PolarHBondContact O-N 3.23Å |
| 36 | F | 62.3 | Low | 66.4 | Low | 161 Ų | 161 | 90.5 Ų | 90.5 | 71% | 0.706 | 51% | 0.506 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.5 | 2.9 | 176 | -60.4 | -77 | 0 | 0 | 0 | 113.3 | S30 L31 G34 | S30-F36 WeakPolarHBondContact O-CE2 3.44Å; L31-F36 HydrophobicContact CD2-CE2 3.68Å; L31-F36 HydrophobicContact CD2-CZ 4.24Å; L31-F36 HydrophobicContact CG-CE2 4.26Å; G34-F36 PolarHBondContact O-N 3.25Å |
| 37 | T | 64.1 | Low | 67.4 | Low | 78 Ų | 78 | 92.9 Ų | 92.9 | 48% | 0.479 | 50% | 0.502 | S | S | . | . | S | Bend | trans | -75 | 134.8 | 177.7 | 45.5 | 0 | 0 | 0 | 0 | 111.9 | G34 V39 E42 | G34-T37 PolarHBondContact O-N 2.85Å; G34-T37 PolarHBondContact O-OG1 3.48Å; T37-V39 PolarHBondContact O-N 3.07Å; T37-E42 PolarHBondContact OG1-OE1 2.91Å |
| 38 | S | 66.8 | Low | 68.2 | Low | 66 Ų | 66 | 93 Ų | 93 | 46% | 0.462 | 51% | 0.505 | S | S | . | . | trans | -64.3 | 129 | 173.5 | 174.8 | 0 | 0 | 0 | 0 | 110.2 | K40 N41 | S38-K40 PolarHBondContact O-N 2.77Å; S38-N41 WeakPolarHBondContact O-CB 3.42Å; S38-N41 PolarHBondContact O-N 3.42Å | ||
| 39 | V | 66.8 | Low | 69.2 | Low | 82 Ų | 82 | 94.8 Ų | 94.8 | 50% | 0.497 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -49.9 | -31.7 | 177.4 | 174.5 | 0 | 0 | 0 | 0 | 112.6 | V14 T37 N41 E42 L43 | V14-V39 HydrophobicContact CG2-CG1 3.91Å; T37-V39 PolarHBondContact O-N 3.07Å; V39-N41 PolarHBondContact O-N 3.19Å; V39-E42 PolarHBondContact O-N 3.35Å; V39-L43 HydrophobicContact CG1-CD1 3.6Å; V39-L43 WeakPolarHBondContact O-CD1 3.31Å; V39-L43 PolarHBondContact O-N 2.63Å |
| 40 | K | 66.9 | Low | 70.3 | Confident | 164 Ų | 164 | 93.6 Ų | 93.6 | 71% | 0.713 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -64.8 | -36.5 | 176.5 | -67.7 | -175.7 | 179.1 | 179.5 | 0 | 113.2 | S38 E42 L44 | S38-K40 PolarHBondContact O-N 2.77Å; K40-E42 PolarHBondContact O-N 2.92Å; K40-L44 PolarHBondContact O-N 3.34Å |
| 41 | N | 68.1 | Low | 71.3 | Confident | 115 Ų | 115 | 92.5 Ų | 92.5 | 62% | 0.615 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -72.6 | -20.7 | 177.3 | -75 | 21.5 | 0 | 0 | 0 | 112.1 | S38 V39 | S38-N41 WeakPolarHBondContact O-CB 3.42Å; S38-N41 PolarHBondContact O-N 3.42Å; V39-N41 PolarHBondContact O-N 3.19Å |
| 42 | E | 68.4 | Low | 72.3 | Confident | 55 Ų | 55 | 88.3 Ų | 88.3 | 26% | 0.257 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -83.4 | -31.9 | 177.2 | -63 | -169.8 | -169.2 | 0 | 0 | 112.8 | T37 V39 K40 | T37-E42 PolarHBondContact OG1-OE1 2.91Å; V39-E42 PolarHBondContact O-N 3.35Å; K40-E42 PolarHBondContact O-N 2.92Å |
| 43 | L | 71.1 | Confident | 73.6 | Confident | 64 Ų | 64 | 83.7 Ų | 83.7 | 34% | 0.335 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -85.7 | -37.1 | -175.2 | -81 | 154.7 | 0 | 0 | 0 | 113.3 | K11 V14 V39 | K11-L43 VanDerWaalsContact O-CD2 3.31Å; K11-L43 WeakPolarHBondContact O-CD2 3.48Å; V14-L43 HydrophobicContact CG2-CD1 4.06Å; V14-L43 HydrophobicContact CG2-CD2 4.35Å; V14-L43 HydrophobicContact CG2-CG 3.99Å; V39-L43 HydrophobicContact CG1-CD1 3.6Å; V39-L43 WeakPolarHBondContact O-CD1 3.31Å; V39-L43 PolarHBondContact O-N 2.63Å |
| 44 | L | 73.4 | Confident | 74.9 | Confident | 110 Ų | 110 | 87.8 Ų | 87.8 | 58% | 0.576 | 48% | 0.48 | S | S | * | . | S | Bend | trans | -122.1 | 134.2 | -171.7 | -60.8 | 177.6 | 0 | 0 | 0 | 111.4 | L10 K40 | L10-L44 HydrophobicContact CD1-CD2 4.3Å; K40-L44 PolarHBondContact O-N 3.34Å |
| 45 | P | 75.3 | Confident | 76.4 | Confident | 43 Ų | 43 | 88 Ų | 88 | 28% | 0.279 | 47% | 0.472 | S | S | . | . | trans | -64.7 | 139.3 | 171 | 28.6 | -34.7 | 0 | 0 | 0 | 109.5 | L10 H47 E50 L51 | L10-P45 HydrophobicContact CD2-CG 4.12Å; P45-H47 VanDerWaalsContact C-N 3.35Å; P45-E50 WeakPolarHBondContact CA-OE2 3.47Å; P45-E50 HydrophobicContact CB-CB 4.1Å; P45-L51 HydrophobicContact CB-CD1 4.47Å; P45-L51 HydrophobicContact CB-CD2 4.44Å; P45-L51 HydrophobicContact CB-CG 4Å; P45-L51 HydrophobicContact CG-CD1 3.9Å; P45-L51 HydrophobicContact CG-CG 3.99Å | ||
| 46 | S | 80.5 | Confident | 77.8 | Confident | 102 Ų | 102 | 89.9 Ų | 89.9 | 71% | 0.713 | 47% | 0.473 | S | S | * | . | S | Bend | trans | -73.7 | -32.9 | 177.8 | -61.7 | 0 | 0 | 0 | 0 | 111.1 | E50 | S46-E50 PolarHBondContact N-OE2 3.23Š|
| 47 | H | 84 | Confident | 79.2 | Confident | 103 Ų | 103 | 85.7 Ų | 85.7 | 48% | 0.477 | 46% | 0.455 | S | S | . | . | S | Bend | trans | -119.3 | 138.9 | -179.6 | -172.4 | -91.3 | 0 | 0 | 0 | 111.4 | P45 L49 E50 | P45-H47 VanDerWaalsContact C-N 3.35Å; H47-L49 WeakPolarHBondContact ND1-CB 3.43Å; H47-L49 PolarHBondContact ND1-N 3.19Å; H47-L49 PolarHBondContact O-N 3.12Å; H47-L49 VanDerWaalsContact O-N 3.12Å; H47-E50 HydrophobicContact CB-CB 4.17Å; H47-E50 PolarHBondContact N-OE2 3.42Å; H47-E50 WeakPolarHBondContact O-CB 3.16Å; H47-E50 PolarHBondContact O-N 3.43Å |
| 48 | P | 83.1 | Confident | 80.5 | Confident | 107 Ų | 107 | 86.6 Ų | 86.6 | 70% | 0.695 | 46% | 0.457 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.2 | -29.7 | -178 | 22 | -35.1 | 0 | 0 | 0 | 113.9 | ||
| 49 | L | 86.6 | Confident | 81.8 | Confident | 94 Ų | 94 | 86.4 Ų | 86.4 | 49% | 0.492 | 45% | 0.451 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.7 | -7.4 | 177.3 | -58.7 | -179.9 | 0 | 0 | 0 | 113.9 | H47 L51 S52 E53 | H47-L49 WeakPolarHBondContact ND1-CB 3.43Å; H47-L49 PolarHBondContact ND1-N 3.19Å; H47-L49 PolarHBondContact O-N 3.12Å; H47-L49 VanDerWaalsContact O-N 3.12Å; L49-L51 VanDerWaalsContact C-N 3.29Å; L49-L51 PolarHBondContact O-N 3.12Å; L49-S52 WeakPolarHBondContact O-CA 3.38Å; L49-S52 WeakPolarHBondContact O-CB 3.38Å; L49-S52 PolarHBondContact O-N 3.01Å; L49-E53 PolarHBondContact O-N 3.49Å |
| 50 | E | 86.3 | Confident | 83 | Confident | 53 Ų | 53 | 85.8 Ų | 85.8 | 25% | 0.248 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -57.2 | -42.8 | -174.1 | -168.9 | -173.3 | 149 | 0 | 0 | 112.2 | P45 S46 H47 S52 K54 | P45-E50 WeakPolarHBondContact CA-OE2 3.47Å; P45-E50 HydrophobicContact CB-CB 4.1Å; S46-E50 PolarHBondContact N-OE2 3.23Å; H47-E50 HydrophobicContact CB-CB 4.17Å; H47-E50 PolarHBondContact N-OE2 3.42Å; H47-E50 WeakPolarHBondContact O-CB 3.16Å; H47-E50 PolarHBondContact O-N 3.43Å; E50-S52 VanDerWaalsContact C-N 3.31Å; E50-S52 PolarHBondContact O-N 3.41Å; E50-K54 HydrophobicContact CG-CD 4.17Å; E50-K54 VanDerWaalsContact O-CB 3.28Å; E50-K54 WeakPolarHBondContact O-CB 3.46Å; E50-K54 VanDerWaalsContact O-CG 3.23Å; E50-K54 WeakPolarHBondContact O-CG 3.37Å; E50-K54 PolarHBondContact O-N 3.48Å; E50-K54 WeakPolarHBondContact OE1-CE 3.23Å; E50-K54 IonicContact OE1-NZ 3.87Å; E50-K54 PolarHBondContact OE1-NZ 3.47Å |
| 51 | L | 84.9 | Confident | 84.2 | Confident | 27 Ų | 27 | 79.1 Ų | 79.1 | 14% | 0.141 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -67.7 | -33 | 176.8 | -66.4 | 177.6 | 0 | 0 | 0 | 112.6 | Q9 L10 P45 L49 N55 | Q9-L51 HydrophobicContact CB-CD1 4.4Å; L10-L51 HydrophobicContact CD2-CD1 4.03Å; P45-L51 HydrophobicContact CB-CD1 4.47Å; P45-L51 HydrophobicContact CB-CD2 4.44Å; P45-L51 HydrophobicContact CB-CG 4Å; P45-L51 HydrophobicContact CG-CD1 3.9Å; P45-L51 HydrophobicContact CG-CG 3.99Å; L49-L51 VanDerWaalsContact C-N 3.29Å; L49-L51 PolarHBondContact O-N 3.12Å; L51-N55 WeakPolarHBondContact O-CB 3.28Å; L51-N55 PolarHBondContact O-N 3.2Å; L51-N55 PolarHBondContact O-ND2 3.11Å |
| 52 | S | 87.3 | Confident | 85.5 | Confident | 55 Ų | 55 | 80 Ų | 80 | 39% | 0.385 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -68.8 | -52.1 | 178.3 | -174.5 | 0 | 0 | 0 | 0 | 110.1 | L49 E50 K54 N55 F56 | L49-S52 WeakPolarHBondContact O-CA 3.38Å; L49-S52 WeakPolarHBondContact O-CB 3.38Å; L49-S52 PolarHBondContact O-N 3.01Å; E50-S52 VanDerWaalsContact C-N 3.31Å; E50-S52 PolarHBondContact O-N 3.41Å; S52-K54 PolarHBondContact O-N 2.93Å; S52-N55 CarbonylContact O-C 3.44Å; S52-N55 PolarHBondContact O-N 3.32Å; S52-N55 VanDerWaalsContact O-N 3.13Å; S52-F56 WeakPolarHBondContact O-CA 3.3Å; S52-F56 PolarHBondContact O-N 3.23Å |
| 53 | E | 88.7 | Confident | 86.8 | Confident | 125 Ų | 125 | 83 Ų | 83 | 58% | 0.584 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -59.5 | -47.3 | 178.7 | -68.4 | -57.3 | 137.4 | 0 | 0 | 111.3 | L49 N55 F56 | L49-E53 PolarHBondContact O-N 3.49Å; E53-N55 PolarHBondContact O-N 2.94Å; E53-N55 VanDerWaalsContact O-N 3.1Å; E53-F56 VanDerWaalsContact O-CB 3.31Å; E53-F56 WeakPolarHBondContact O-CB 3.3Å; E53-F56 PolarHBondContact O-N 3.44Å |
| 54 | K | 88.1 | Confident | 88 | Confident | 140 Ų | 140 | 84.3 Ų | 84.3 | 61% | 0.609 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -57.1 | -30 | 176.7 | -78.9 | 176.7 | 173.2 | 173.9 | 0 | 113.7 | E50 S52 | E50-K54 HydrophobicContact CG-CD 4.17Å; E50-K54 VanDerWaalsContact O-CB 3.28Å; E50-K54 WeakPolarHBondContact O-CB 3.46Å; E50-K54 VanDerWaalsContact O-CG 3.23Å; E50-K54 WeakPolarHBondContact O-CG 3.37Å; E50-K54 PolarHBondContact O-N 3.48Å; E50-K54 WeakPolarHBondContact OE1-CE 3.23Å; E50-K54 IonicContact OE1-NZ 3.87Å; E50-K54 PolarHBondContact OE1-NZ 3.47Å; S52-K54 PolarHBondContact O-N 2.93Å |
| 55 | N | 90.7 | Very high | 89.1 | Confident | 37 Ų | 37 | 80.7 Ų | 80.7 | 20% | 0.198 | 42% | 0.415 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -105.8 | 5.3 | -178.8 | -68.4 | -68.2 | 0 | 0 | 0 | 113.1 | L51 S52 E53 Q57 L58 N59 | L51-N55 WeakPolarHBondContact O-CB 3.28Å; L51-N55 PolarHBondContact O-N 3.2Å; L51-N55 PolarHBondContact O-ND2 3.11Å; S52-N55 CarbonylContact O-C 3.44Å; S52-N55 PolarHBondContact O-N 3.32Å; S52-N55 VanDerWaalsContact O-N 3.13Å; E53-N55 PolarHBondContact O-N 2.94Å; E53-N55 VanDerWaalsContact O-N 3.1Å; N55-Q57 PolarHBondContact O-N 2.96Å; N55-L58 PolarHBondContact O-N 2.97Å; N55-N59 WeakPolarHBondContact O-CB 3.49Å; N55-N59 PolarHBondContact O-N 2.95Å; N55-N59 PolarHBondContact O-ND2 3.13Å |
| 56 | F | 91.3 | Very high | 90.1 | Very high | 106 Ų | 106 | 81.6 Ų | 81.6 | 47% | 0.465 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -56.7 | -55.5 | -170.7 | 177.1 | -99.8 | 0 | 0 | 0 | 111.5 | S52 E53 L58 N59 Q60 | S52-F56 WeakPolarHBondContact O-CA 3.3Å; S52-F56 PolarHBondContact O-N 3.23Å; E53-F56 VanDerWaalsContact O-CB 3.31Å; E53-F56 WeakPolarHBondContact O-CB 3.3Å; E53-F56 PolarHBondContact O-N 3.44Å; F56-L58 PolarHBondContact O-N 3.49Å; F56-N59 PolarHBondContact O-N 3.1Å; F56-Q60 WeakPolarHBondContact O-CB 3.48Å; F56-Q60 PolarHBondContact O-N 3.33Å |
| 57 | Q | 90 | Very high | 91 | Very high | 74 Ų | 74 | 80.2 Ų | 80.2 | 35% | 0.346 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -60.4 | -44.8 | -179.7 | -169.4 | 62.6 | 48.5 | 0 | 0 | 112.5 | N55 N59 Q60 D61 | N55-Q57 PolarHBondContact O-N 2.96Å; Q57-N59 VanDerWaalsContact C-N 3.29Å; Q57-N59 PolarHBondContact O-N 2.82Å; Q57-Q60 PolarHBondContact O-N 3.17Å; Q57-D61 PolarHBondContact NE2-OD1 3.47Å; Q57-D61 WeakPolarHBondContact O-CB 3.48Å; Q57-D61 VanDerWaalsContact O-CG 3.3Å; Q57-D61 PolarHBondContact O-N 3.08Å |
| 58 | L | 92.2 | Very high | 91.6 | Very high | 97 Ų | 97 | 77.4 Ų | 77.4 | 51% | 0.508 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -63.3 | -37.7 | 179.8 | -69.1 | 176.8 | 0 | 0 | 0 | 111.9 | N55 F56 K62 | N55-L58 PolarHBondContact O-N 2.97Å; F56-L58 PolarHBondContact O-N 3.49Å; L58-K62 WeakPolarHBondContact O-CB 3.34Å; L58-K62 WeakPolarHBondContact O-CG 3.44Å; L58-K62 PolarHBondContact O-N 3.48Å |
| 59 | N | 93.4 | Very high | 92.3 | Very high | 62 Ų | 62 | 78.5 Ų | 78.5 | 33% | 0.332 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -71.5 | -40.6 | 177.7 | -69.9 | -22.6 | 0 | 0 | 0 | 111.1 | N55 F56 Q57 K62 M63 | N55-N59 WeakPolarHBondContact O-CB 3.49Å; N55-N59 PolarHBondContact O-N 2.95Å; N55-N59 PolarHBondContact O-ND2 3.13Å; F56-N59 PolarHBondContact O-N 3.1Å; Q57-N59 VanDerWaalsContact C-N 3.29Å; Q57-N59 PolarHBondContact O-N 2.82Å; N59-K62 PolarHBondContact O-N 3.13Å; N59-M63 WeakPolarHBondContact O-CG 3.28Å; N59-M63 PolarHBondContact O-N 3.33Å |
| 60 | Q | 92.8 | Very high | 92.8 | Very high | 69 Ų | 69 | 80 Ų | 80 | 32% | 0.322 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -61.2 | -48.8 | 174.6 | -169.4 | 172.4 | 36.8 | 0 | 0 | 111.4 | F56 Q57 K62 M63 N64 | F56-Q60 WeakPolarHBondContact O-CB 3.48Å; F56-Q60 PolarHBondContact O-N 3.33Å; Q57-Q60 PolarHBondContact O-N 3.17Å; Q60-K62 VanDerWaalsContact C-N 3.33Å; Q60-K62 PolarHBondContact O-N 2.91Å; Q60-M63 PolarHBondContact O-N 3.09Å; Q60-N64 WeakPolarHBondContact O-CB 3.43Å; Q60-N64 PolarHBondContact O-N 3.27Å; Q60-N64 PolarHBondContact O-OD1 2.9Å |
| 61 | D | 92.9 | Very high | 93.4 | Very high | 23 Ų | 23 | 83.7 Ų | 83.7 | 12% | 0.123 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -58.1 | -44.5 | 176.4 | -72.7 | -2.4 | 0 | 0 | 0 | 111.3 | Q57 M63 N64 F65 R107 | Q57-D61 PolarHBondContact NE2-OD1 3.47Å; Q57-D61 WeakPolarHBondContact O-CB 3.48Å; Q57-D61 VanDerWaalsContact O-CG 3.3Å; Q57-D61 PolarHBondContact O-N 3.08Å; D61-M63 PolarHBondContact O-N 3.17Å; D61-N64 PolarHBondContact O-N 3.02Å; D61-F65 HydrophobicContact CB-CD2 4.4Å; D61-F65 HydrophobicContact CB-CE2 4.31Å; D61-F65 WeakPolarHBondContact O-CB 2.99Å; D61-F65 WeakPolarHBondContact O-CD2 3.19Å; D61-F65 WeakPolarHBondContact O-CG 3.31Å; D61-F65 PolarHBondContact O-N 3.07Å; D61-R107 IonicContact OD2-NH2 2.63Å |
| 62 | K | 95.1 | Very high | 94 | Very high | 134 Ų | 134 | 87.7 Ų | 87.7 | 58% | 0.583 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -59.3 | -46.1 | 176.3 | -78.6 | 170.8 | -175 | 174.4 | 0 | 112.1 | L58 N59 Q60 S66 | L58-K62 WeakPolarHBondContact O-CB 3.34Å; L58-K62 WeakPolarHBondContact O-CG 3.44Å; L58-K62 PolarHBondContact O-N 3.48Å; N59-K62 PolarHBondContact O-N 3.13Å; Q60-K62 VanDerWaalsContact C-N 3.33Å; Q60-K62 PolarHBondContact O-N 2.91Å; K62-S66 WeakPolarHBondContact O-CB 3.35Å; K62-S66 PolarHBondContact O-N 2.93Å |
| 63 | M | 96 | Very high | 94.5 | Very high | 118 Ų | 118 | 86.4 Ų | 86.4 | 58% | 0.581 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -62.5 | -47.5 | 177.2 | -71.3 | -173.4 | -63.3 | 0 | 0 | 110.7 | N59 Q60 D61 F65 S66 T67 | N59-M63 WeakPolarHBondContact O-CG 3.28Å; N59-M63 PolarHBondContact O-N 3.33Å; Q60-M63 PolarHBondContact O-N 3.09Å; D61-M63 PolarHBondContact O-N 3.17Å; M63-F65 PolarHBondContact O-N 3.1Å; M63-S66 WeakPolarHBondContact O-CB 3.42Å; M63-S66 PolarHBondContact O-N 3.38Å; M63-T67 PolarHBondContact O-N 3.28Å; M63-T67 PolarHBondContact O-OG1 3.33Å; M63-T67 VanDerWaalsContact O-OG1 3.1Å |
| 64 | N | 95.1 | Very high | 94.9 | Very high | 92 Ų | 92 | 85.3 Ų | 85.3 | 49% | 0.492 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -59.8 | -47.2 | 179.7 | -69.9 | -7.8 | 0 | 0 | 0 | 111.8 | Q60 D61 S66 T67 L68 | Q60-N64 WeakPolarHBondContact O-CB 3.43Å; Q60-N64 PolarHBondContact O-N 3.27Å; Q60-N64 PolarHBondContact O-OD1 2.9Å; D61-N64 PolarHBondContact O-N 3.02Å; N64-S66 VanDerWaalsContact C-N 3.33Å; N64-S66 PolarHBondContact O-N 3.46Å; N64-T67 PolarHBondContact O-N 3.09Å; N64-L68 VanDerWaalsContact O-CB 3.25Å; N64-L68 WeakPolarHBondContact O-CB 3.35Å; N64-L68 PolarHBondContact O-N 3.22Å |
| 65 | F | 96.8 | Very high | 95.3 | Very high | 34 Ų | 34 | 84.8 Ų | 84.8 | 15% | 0.149 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -65.1 | -35.6 | 177.1 | -75.3 | -53.9 | 0 | 0 | 0 | 113.1 | D61 M63 R69 P77 L80 Q81 Y84 | D61-F65 HydrophobicContact CB-CD2 4.4Å; D61-F65 HydrophobicContact CB-CE2 4.31Å; D61-F65 WeakPolarHBondContact O-CB 2.99Å; D61-F65 WeakPolarHBondContact O-CD2 3.19Å; D61-F65 WeakPolarHBondContact O-CG 3.31Å; D61-F65 PolarHBondContact O-N 3.07Å; M63-F65 PolarHBondContact O-N 3.1Å; F65-R69 WeakPolarHBondContact O-CB 3.34Å; F65-R69 PolarHBondContact O-N 3.05Å; F65-P77 HydrophobicContact CB-CB 4.33Å; F65-P77 HydrophobicContact CD1-CB 3.69Å; F65-P77 HydrophobicContact CE1-CB 4.43Å; F65-P77 HydrophobicContact CG-CB 4.39Å; F65-L80 HydrophobicContact CE1-CB 4.15Å; F65-L80 HydrophobicContact CE1-CD2 3.8Å; F65-L80 HydrophobicContact CE1-CG 4.04Å; F65-Q81 HydrophobicContact CE1-CG 3.79Å; F65-Q81 HydrophobicContact CE2-CG 4.14Å; F65-Q81 HydrophobicContact CZ-CG 3.54Å; F65-Y84 HydrophobicContact CE1-CE2 4.25Å; F65-Y84 HydrophobicContact CE2-CE2 4.28Å; F65-Y84 AromaticContact CZ-CD2 3.88Å; F65-Y84 HydrophobicContact CZ-CD2 3.88Å; F65-Y84 AromaticContact CZ-CE2 3.49Å; F65-Y84 HydrophobicContact CZ-CE2 3.49Å; F65-Y84 VanDerWaalsContact CZ-CE2 3.49Å |
| 66 | S | 97.6 | Very high | 95.6 | Very high | 61 Ų | 61 | 83.4 Ų | 83.4 | 43% | 0.427 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -64.5 | -46.3 | 174.4 | -173.3 | 0 | 0 | 0 | 0 | 111 | K62 M63 N64 R69 N70 | K62-S66 WeakPolarHBondContact O-CB 3.35Å; K62-S66 PolarHBondContact O-N 2.93Å; M63-S66 WeakPolarHBondContact O-CB 3.42Å; M63-S66 PolarHBondContact O-N 3.38Å; N64-S66 VanDerWaalsContact C-N 3.33Å; N64-S66 PolarHBondContact O-N 3.46Å; S66-R69 PolarHBondContact O-N 3.21Å; S66-N70 PolarHBondContact O-N 2.91Å; S66-N70 PolarHBondContact O-ND2 3.4Å; S66-N70 PolarHBondContact O-OD1 3.3Å |
| 67 | T | 97.7 | Very high | 95.9 | Very high | 74 Ų | 74 | 78.6 Ų | 78.6 | 45% | 0.454 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -62 | -46.8 | 177.1 | -61.5 | 0 | 0 | 0 | 0 | 111.3 | M63 N64 R69 N70 I71 | M63-T67 PolarHBondContact O-N 3.28Å; M63-T67 PolarHBondContact O-OG1 3.33Å; M63-T67 VanDerWaalsContact O-OG1 3.1Å; N64-T67 PolarHBondContact O-N 3.09Å; T67-R69 VanDerWaalsContact C-N 3.32Å; T67-R69 PolarHBondContact O-N 2.97Å; T67-N70 WeakPolarHBondContact O-CB 3.44Å; T67-N70 PolarHBondContact O-N 2.87Å; T67-I71 HydrophobicContact CG2-CD1 3.7Å; T67-I71 HydrophobicContact CG2-CG1 4.46Å; T67-I71 WeakPolarHBondContact O-CG1 3.49Å; T67-I71 PolarHBondContact O-N 3.44Å |
| 68 | L | 97 | Very high | 96.2 | Very high | 44 Ų | 44 | 79 Ų | 79 | 23% | 0.23 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -63.4 | -38.3 | 179.9 | -168.7 | 127.2 | 0 | 0 | 0 | 111.8 | N64 N70 I71 Q72 A76 P77 | N64-L68 VanDerWaalsContact O-CB 3.25Å; N64-L68 WeakPolarHBondContact O-CB 3.35Å; N64-L68 PolarHBondContact O-N 3.22Å; L68-N70 VanDerWaalsContact C-N 3.35Å; L68-I71 PolarHBondContact O-N 2.9Å; L68-Q72 PolarHBondContact O-N 3.25Å; L68-A76 HydrophobicContact CD2-CB 3.39Å; L68-A76 HydrophobicContact CG-CB 4.2Å; L68-P77 HydrophobicContact CD2-CB 3.96Å; L68-P77 HydrophobicContact CD2-CG 4.44Å |
| 69 | R | 97.8 | Very high | 96.5 | Very high | 129 Ų | 129 | 80 Ų | 80 | 49% | 0.487 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -60.2 | -43.5 | 170 | -179 | -178.7 | -71.4 | 165.8 | -2.6 | 112.2 | F65 S66 T67 I71 G73 P77 | F65-R69 WeakPolarHBondContact O-CB 3.34Å; F65-R69 PolarHBondContact O-N 3.05Å; S66-R69 PolarHBondContact O-N 3.21Å; T67-R69 VanDerWaalsContact C-N 3.32Å; T67-R69 PolarHBondContact O-N 2.97Å; R69-I71 VanDerWaalsContact C-N 3.32Å; R69-G73 WeakPolarHBondContact CA-O 3.27Å; R69-G73 CarbonylContact O-C 3.51Å; R69-G73 WeakPolarHBondContact O-CA 3.26Å; R69-G73 PolarHBondContact O-N 3.37Å; R69-P77 HydrophobicContact CB-CG 4.12Å |
| 70 | N | 97.9 | Very high | 96.7 | Very high | 127 Ų | 127 | 78.8 Ų | 78.8 | 68% | 0.679 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -68 | -34.8 | -177.3 | -67.9 | -18.2 | 0 | 0 | 0 | 111.9 | S66 T67 L68 | S66-N70 PolarHBondContact O-N 2.91Å; S66-N70 PolarHBondContact O-ND2 3.4Å; S66-N70 PolarHBondContact O-OD1 3.3Å; T67-N70 WeakPolarHBondContact O-CB 3.44Å; T67-N70 PolarHBondContact O-N 2.87Å; L68-N70 VanDerWaalsContact C-N 3.35Å |
| 71 | I | 98.2 | Very high | 96.8 | Very high | 129 Ų | 129 | 78.9 Ų | 78.9 | 66% | 0.662 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -81.8 | -48.3 | -178.5 | -62.2 | 167.8 | 0 | 0 | 0 | 111.5 | T67 L68 R69 | T67-I71 HydrophobicContact CG2-CD1 3.7Å; T67-I71 HydrophobicContact CG2-CG1 4.46Å; T67-I71 WeakPolarHBondContact O-CG1 3.49Å; T67-I71 PolarHBondContact O-N 3.44Å; L68-I71 PolarHBondContact O-N 2.9Å; R69-I71 VanDerWaalsContact C-N 3.32Å |
| 72 | Q | 97.4 | Very high | 97 | Very high | 111 Ų | 111 | 83.7 Ų | 83.7 | 52% | 0.519 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -109.8 | -9.8 | -168.7 | -59.1 | 179 | 13.1 | 0 | 0 | 113.1 | L68 H75 A76 | L68-Q72 PolarHBondContact O-N 3.25Å; Q72-H75 PolarHBondContact O-CE1 3.26Å; Q72-H75 PolarHBondContact O-ND1 3.09Å; Q72-A76 HydrophobicContact CB-CB 3.57Å; Q72-A76 HydrophobicContact CG-CB 4.46Å; Q72-A76 VanDerWaalsContact OE1-CB 3.29Å |
| 73 | G | 97.6 | Very high | 97 | Very high | 28 Ų | 28 | 80.5 Ų | 80.5 | 29% | 0.289 | 41% | 0.409 | S | S | . | . | trans | 90.5 | -178.3 | -175.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | R69 H75 P77 | R69-G73 WeakPolarHBondContact CA-O 3.27Å; R69-G73 CarbonylContact O-C 3.51Å; R69-G73 WeakPolarHBondContact O-CA 3.26Å; R69-G73 PolarHBondContact O-N 3.37Å; G73-H75 VanDerWaalsContact C-N 3.33Å; G73-H75 PolarHBondContact O-N 2.99Å; G73-P77 WeakPolarHBondContact O-CD 3.49Å | ||
| 74 | L | 96.9 | Very high | 97 | Very high | 103 Ų | 103 | 76.5 Ų | 76.5 | 54% | 0.539 | 39% | 0.388 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70.9 | -22.5 | -169.4 | -173.7 | 140 | 0 | 0 | 0 | 114.6 | P77 L78 | L74-P77 VanDerWaalsContact O-CD 3.28Å; L74-P77 WeakPolarHBondContact O-CD 3.47Å; L74-P77 WeakPolarHBondContact O-CG 3.23Å; L74-L78 HydrophobicContact CD2-CD1 3.45Å; L74-L78 VanDerWaalsContact CD2-CD1 3.45Å; L74-L78 HydrophobicContact CD2-CG 4.17Å; L74-L78 HydrophobicContact CG-CD1 4.48Å; L74-L78 WeakPolarHBondContact O-CG 3.5Å |
| 75 | H | 97.6 | Very high | 96.9 | Very high | 129 Ų | 129 | 80.5 Ų | 80.5 | 60% | 0.597 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -69.4 | -34.6 | -179.6 | 70.9 | -86.4 | 0 | 0 | 0 | 112.7 | Q72 G73 L78 K79 | Q72-H75 PolarHBondContact O-CE1 3.26Å; Q72-H75 PolarHBondContact O-ND1 3.09Å; G73-H75 VanDerWaalsContact C-N 3.33Å; G73-H75 PolarHBondContact O-N 2.99Å; H75-L78 PolarHBondContact O-N 3.47Å; H75-K79 WeakPolarHBondContact O-CB 3.45Å; H75-K79 PolarHBondContact O-N 3.15Å |
| 76 | A | 97.3 | Very high | 96.7 | Very high | 8 Ų | 8 | 82 Ų | 82 | 7% | 0.066 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -64.4 | -51.3 | -176.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | L68 Q72 L78 K79 L80 | L68-A76 HydrophobicContact CD2-CB 3.39Å; L68-A76 HydrophobicContact CG-CB 4.2Å; Q72-A76 HydrophobicContact CB-CB 3.57Å; Q72-A76 HydrophobicContact CG-CB 4.46Å; Q72-A76 VanDerWaalsContact OE1-CB 3.29Å; A76-L78 VanDerWaalsContact C-N 3.3Å; A76-L78 PolarHBondContact O-N 3.45Å; A76-K79 PolarHBondContact O-N 2.94Å; A76-L80 PolarHBondContact O-N 3.26Å; A76-L80 VanDerWaalsContact O-N 3.1Å |
| 77 | P | 96.8 | Very high | 96.5 | Very high | 4 Ų | 4 | 80 Ų | 80 | 3% | 0.026 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -68.2 | -31 | 178.2 | 29.4 | -36.8 | 0 | 0 | 0 | 112 | F65 L68 R69 G73 L74 Q81 | F65-P77 HydrophobicContact CB-CB 4.33Å; F65-P77 HydrophobicContact CD1-CB 3.69Å; F65-P77 HydrophobicContact CE1-CB 4.43Å; F65-P77 HydrophobicContact CG-CB 4.39Å; L68-P77 HydrophobicContact CD2-CB 3.96Å; L68-P77 HydrophobicContact CD2-CG 4.44Å; R69-P77 HydrophobicContact CB-CG 4.12Å; G73-P77 WeakPolarHBondContact O-CD 3.49Å; L74-P77 VanDerWaalsContact O-CD 3.28Å; L74-P77 WeakPolarHBondContact O-CD 3.47Å; L74-P77 WeakPolarHBondContact O-CG 3.23Å; P77-Q81 WeakPolarHBondContact O-CB 3.46Å; P77-Q81 WeakPolarHBondContact O-CG 3.22Å; P77-Q81 PolarHBondContact O-N 2.9Å |
| 78 | L | 97.1 | Very high | 96.1 | Very high | 83 Ų | 83 | 84.9 Ų | 84.9 | 44% | 0.435 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -65.2 | -46.1 | 175 | -75.3 | -177.9 | 0 | 0 | 0 | 111.6 | L74 H75 A76 Q81 M82 | L74-L78 HydrophobicContact CD2-CD1 3.45Å; L74-L78 VanDerWaalsContact CD2-CD1 3.45Å; L74-L78 HydrophobicContact CD2-CG 4.17Å; L74-L78 HydrophobicContact CG-CD1 4.48Å; L74-L78 WeakPolarHBondContact O-CG 3.5Å; H75-L78 PolarHBondContact O-N 3.47Å; A76-L78 VanDerWaalsContact C-N 3.3Å; A76-L78 PolarHBondContact O-N 3.45Å; L78-Q81 PolarHBondContact O-N 3.05Å; L78-M82 WeakPolarHBondContact O-CG 3.27Å; L78-M82 PolarHBondContact O-N 3Å |
| 79 | K | 97.8 | Very high | 95.6 | Very high | 119 Ų | 119 | 90.3 Ų | 90.3 | 52% | 0.517 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -57.2 | -51.1 | 176 | -179.7 | 178.4 | 169.3 | -177 | 0 | 111 | H75 A76 Q81 M82 E83 | H75-K79 WeakPolarHBondContact O-CB 3.45Å; H75-K79 PolarHBondContact O-N 3.15Å; A76-K79 PolarHBondContact O-N 2.94Å; K79-Q81 VanDerWaalsContact C-N 3.33Å; K79-Q81 PolarHBondContact O-N 3.48Å; K79-M82 WeakPolarHBondContact O-CB 3.22Å; K79-M82 PolarHBondContact O-N 3Å; K79-M82 VanDerWaalsContact O-N 3.08Å; K79-E83 WeakPolarHBondContact CE-OE1 3.49Å; K79-E83 WeakPolarHBondContact CG-OE1 3.34Å; K79-E83 IonicContact NZ-OE1 3.78Å; K79-E83 WeakPolarHBondContact O-CG 3.45Å; K79-E83 PolarHBondContact O-N 3.22Å |
| 80 | L | 96.5 | Very high | 94.7 | Very high | 35 Ų | 35 | 87.8 Ų | 87.8 | 18% | 0.183 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -62.8 | -38.5 | 179.8 | -174.5 | 60.6 | 0 | 0 | 0 | 112.3 | F65 A76 M82 E83 Y84 | F65-L80 HydrophobicContact CE1-CB 4.15Å; F65-L80 HydrophobicContact CE1-CD2 3.8Å; F65-L80 HydrophobicContact CE1-CG 4.04Å; A76-L80 PolarHBondContact O-N 3.26Å; A76-L80 VanDerWaalsContact O-N 3.1Å; L80-M82 VanDerWaalsContact C-N 3.33Å; L80-M82 PolarHBondContact O-N 3.26Å; L80-E83 PolarHBondContact O-N 3.44Å; L80-Y84 HydrophobicContact CD1-CD1 4.36Å; L80-Y84 HydrophobicContact CD1-CE1 3.85Å; L80-Y84 HydrophobicContact CD2-CE2 4.4Å; L80-Y84 HydrophobicContact CG-CE1 4.19Å; L80-Y84 HydrophobicContact CG-CE2 4.05Å; L80-Y84 PolarHBondContact O-N 3.42Å |
| 81 | Q | 95.8 | Very high | 93.7 | Very high | 72 Ų | 72 | 91.2 Ų | 91.2 | 34% | 0.336 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -63.8 | -36.7 | 173.3 | -77.2 | 178.2 | 8.8 | 0 | 0 | 113 | F65 P77 L78 K79 R85 | F65-Q81 HydrophobicContact CE1-CG 3.79Å; F65-Q81 HydrophobicContact CE2-CG 4.14Å; F65-Q81 HydrophobicContact CZ-CG 3.54Å; P77-Q81 WeakPolarHBondContact O-CB 3.46Å; P77-Q81 WeakPolarHBondContact O-CG 3.22Å; P77-Q81 PolarHBondContact O-N 2.9Å; L78-Q81 PolarHBondContact O-N 3.05Å; K79-Q81 VanDerWaalsContact C-N 3.33Å; K79-Q81 PolarHBondContact O-N 3.48Å; Q81-R85 WeakPolarHBondContact O-CG 3.35Å; Q81-R85 PolarHBondContact O-N 3.31Å; Q81-R85 VanDerWaalsContact O-N 3.11Å |
| 82 | M | 96.8 | Very high | 93 | Very high | 123 Ų | 123 | 92.9 Ų | 92.9 | 61% | 0.606 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -66.3 | -43.6 | 173.9 | -69.6 | -172.8 | -62.4 | 0 | 0 | 111.1 | L78 K79 L80 R85 A86 | L78-M82 WeakPolarHBondContact O-CG 3.27Å; L78-M82 PolarHBondContact O-N 3Å; K79-M82 WeakPolarHBondContact O-CB 3.22Å; K79-M82 PolarHBondContact O-N 3Å; K79-M82 VanDerWaalsContact O-N 3.08Å; L80-M82 VanDerWaalsContact C-N 3.33Å; L80-M82 PolarHBondContact O-N 3.26Å; M82-R85 WeakPolarHBondContact O-CB 3.5Å; M82-R85 PolarHBondContact O-N 3.05Å; M82-R85 VanDerWaalsContact O-N 3.16Å; M82-A86 PolarHBondContact O-N 3.18Å |
| 83 | E | 95.9 | Very high | 92.5 | Very high | 68 Ų | 68 | 92 Ų | 92 | 32% | 0.318 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -61.3 | -44.5 | 176.4 | -70.5 | 173 | -171.6 | 0 | 0 | 111.5 | K79 L80 R85 A86 A87 L106 | K79-E83 WeakPolarHBondContact CE-OE1 3.49Å; K79-E83 WeakPolarHBondContact CG-OE1 3.34Å; K79-E83 IonicContact NZ-OE1 3.78Å; K79-E83 WeakPolarHBondContact O-CG 3.45Å; K79-E83 PolarHBondContact O-N 3.22Å; L80-E83 PolarHBondContact O-N 3.44Å; E83-R85 VanDerWaalsContact C-N 3.3Å; E83-R85 PolarHBondContact O-N 2.8Å; E83-A86 PolarHBondContact O-N 2.94Å; E83-A87 WeakPolarHBondContact O-CB 3.22Å; E83-A87 PolarHBondContact O-N 3.35Å; E83-L106 HydrophobicContact CB-CD1 3.96Å |
| 84 | Y | 94.8 | Very high | 91.8 | Very high | 33 Ų | 33 | 93.2 Ų | 93.2 | 13% | 0.129 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -57.7 | -41.3 | 172.6 | -72.4 | -18.8 | 0 | 0 | 0 | 112.8 | F65 L80 R88 L106 R107 | F65-Y84 HydrophobicContact CE1-CE2 4.25Å; F65-Y84 HydrophobicContact CE2-CE2 4.28Å; F65-Y84 AromaticContact CZ-CD2 3.88Å; F65-Y84 HydrophobicContact CZ-CD2 3.88Å; F65-Y84 AromaticContact CZ-CE2 3.49Å; F65-Y84 HydrophobicContact CZ-CE2 3.49Å; F65-Y84 VanDerWaalsContact CZ-CE2 3.49Å; L80-Y84 HydrophobicContact CD1-CD1 4.36Å; L80-Y84 HydrophobicContact CD1-CE1 3.85Å; L80-Y84 HydrophobicContact CD2-CE2 4.4Å; L80-Y84 HydrophobicContact CG-CE1 4.19Å; L80-Y84 HydrophobicContact CG-CE2 4.05Å; L80-Y84 PolarHBondContact O-N 3.42Å; Y84-R88 WeakPolarHBondContact O-CB 3.35Å; Y84-R88 VanDerWaalsContact O-CG 3.27Å; Y84-R88 WeakPolarHBondContact O-CG 3.45Å; Y84-R88 PolarHBondContact O-N 3.16Å; Y84-L106 HydrophobicContact CD1-CB 3.82Å; Y84-L106 HydrophobicContact CD1-CD1 4.05Å; Y84-L106 HydrophobicContact CE1-CB 3.45Å; Y84-L106 VanDerWaalsContact CE1-CB 3.45Å; Y84-L106 PolarHBondContact OH-O 3.05Å; Y84-R107 HydrophobicContact CE1-CG 3.76Å; Y84-R107 HydrophobicContact CE2-CG 4.49Å; Y84-R107 WeakPolarHBondContact OH-CG 3.38Å |
| 85 | R | 93.8 | Very high | 91.1 | Very high | 177 Ų | 177 | 91 Ų | 91 | 67% | 0.668 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -66.2 | -40.7 | 177.5 | -73.9 | 175.8 | -176.4 | -174.1 | 2.2 | 111.7 | Q81 M82 E83 Q89 | Q81-R85 WeakPolarHBondContact O-CG 3.35Å; Q81-R85 PolarHBondContact O-N 3.31Å; Q81-R85 VanDerWaalsContact O-N 3.11Å; M82-R85 WeakPolarHBondContact O-CB 3.5Å; M82-R85 PolarHBondContact O-N 3.05Å; M82-R85 VanDerWaalsContact O-N 3.16Å; E83-R85 VanDerWaalsContact C-N 3.3Å; E83-R85 PolarHBondContact O-N 2.8Å; R85-Q89 WeakPolarHBondContact O-CG 3.06Å |
| 86 | A | 93.2 | Very high | 90.5 | Very high | 64 Ų | 64 | 88.1 Ų | 88.1 | 53% | 0.529 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -65.5 | -46.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | M82 E83 R88 Q89 | M82-A86 PolarHBondContact O-N 3.18Å; E83-A86 PolarHBondContact O-N 2.94Å; A86-R88 VanDerWaalsContact C-N 3.27Å; A86-R88 PolarHBondContact O-N 3.11Å; A86-Q89 WeakPolarHBondContact O-CB 3.4Å; A86-Q89 PolarHBondContact O-N 2.97Å |
| 87 | A | 92.5 | Very high | 89.8 | Confident | 19 Ų | 19 | 91.4 Ų | 91.4 | 16% | 0.157 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -63.4 | -30.8 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113 | E83 Q89 A102 L103 L106 | E83-A87 WeakPolarHBondContact O-CB 3.22Å; E83-A87 PolarHBondContact O-N 3.35Å; A87-Q89 VanDerWaalsContact C-N 3.27Å; A87-Q89 PolarHBondContact O-N 2.96Å; A87-A102 HydrophobicContact CB-CB 4.29Å; A87-L103 HydrophobicContact CB-CB 4.23Å; A87-L106 HydrophobicContact CB-CD1 3.93Å |
| 88 | R | 89.9 | Confident | 89 | Confident | 177 Ų | 177 | 95.1 Ų | 95.1 | 67% | 0.668 | 46% | 0.464 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.7 | -20.3 | 174.1 | -77.7 | -180 | 110.2 | -177 | 1.9 | 113.9 | Y84 A86 I90 L103 | Y84-R88 WeakPolarHBondContact O-CB 3.35Å; Y84-R88 VanDerWaalsContact O-CG 3.27Å; Y84-R88 WeakPolarHBondContact O-CG 3.45Å; Y84-R88 PolarHBondContact O-N 3.16Å; A86-R88 VanDerWaalsContact C-N 3.27Å; A86-R88 PolarHBondContact O-N 3.11Å; R88-I90 VanDerWaalsContact C-N 3.27Å; R88-I90 PolarHBondContact O-N 3.46Å; R88-L103 HydrophobicContact CG-CD1 3.29Å; R88-L103 HydrophobicContact CG-CG 4.47Å |
| 89 | Q | 86.2 | Confident | 88.4 | Confident | 158 Ų | 158 | 95.4 Ų | 95.4 | 74% | 0.738 | 47% | 0.473 | S | S | * | . | trans | -83.5 | 71.1 | -178.5 | -70.3 | 176.9 | 0.6 | 0 | 0 | 110.8 | R85 A86 A87 | R85-Q89 WeakPolarHBondContact O-CG 3.06Å; A86-Q89 WeakPolarHBondContact O-CB 3.4Å; A86-Q89 PolarHBondContact O-N 2.97Å; A87-Q89 VanDerWaalsContact C-N 3.27Å; A87-Q89 PolarHBondContact O-N 2.96Å | ||
| 90 | I | 78 | Confident | 87.9 | Confident | 76 Ų | 76 | 92.5 Ų | 92.5 | 39% | 0.39 | 46% | 0.463 | S | S | . | . | trans | -90.2 | 118.3 | 175.6 | -61.6 | 167.6 | 0 | 0 | 0 | 108.9 | R88 R92 | R88-I90 VanDerWaalsContact C-N 3.27Å; R88-I90 PolarHBondContact O-N 3.46Å; I90-R92 VanDerWaalsContact C-N 3.31Å; I90-R92 HydrophobicContact CG2-CB 4.08Å; I90-R92 HydrophobicContact CG2-CG 3.45Å; I90-R92 VanDerWaalsContact CG2-CG 3.45Å; I90-R92 PolarHBondContact O-N 3.08Å | ||
| 91 | Q | 77.6 | Confident | 87.6 | Confident | 199 Ų | 199 | 95.9 Ų | 95.9 | 93% | 0.93 | 48% | 0.481 | S | S | * | . | trans | -91.8 | 53.8 | 177.8 | -64 | -175.7 | -4.7 | 0 | 0 | 111.8 | ||||
| 92 | R | 83.5 | Confident | 87.5 | Confident | 164 Ų | 164 | 95.5 Ų | 95.5 | 62% | 0.619 | 49% | 0.489 | S | S | * | . | trans | -85.5 | 152.9 | 171.3 | -70.2 | -85.7 | -179.2 | 158.3 | 0.8 | 109.6 | I90 | I90-R92 VanDerWaalsContact C-N 3.31Å; I90-R92 HydrophobicContact CG2-CB 4.08Å; I90-R92 HydrophobicContact CG2-CG 3.45Å; I90-R92 VanDerWaalsContact CG2-CG 3.45Å; I90-R92 PolarHBondContact O-N 3.08Å | ||
| 93 | L | 86.6 | Confident | 87.3 | Confident | 93 Ų | 93 | 89.8 Ų | 89.8 | 49% | 0.487 | 46% | 0.461 | S | S | . | . | trans | -64.7 | 147.3 | 170.3 | -65.1 | 171.1 | 0 | 0 | 0 | 109.6 | F95 L96 | L93-F95 HydrophobicContact CB-CD1 3.95Å; L93-F95 HydrophobicContact CB-CE1 3.53Å; L93-F95 HydrophobicContact CB-CE2 4.46Å; L93-F95 HydrophobicContact CB-CZ 3.83Å; L93-F95 HydrophobicContact CD1-CE1 3.69Å; L93-F95 HydrophobicContact CD1-CE2 4.36Å; L93-F95 HydrophobicContact CD1-CZ 3.39Å; L93-F95 HydrophobicContact CG-CE1 4.11Å; L93-F95 HydrophobicContact CG-CZ 4.21Å; L93-F95 PolarHBondContact O-N 3.32Å; L93-F95 VanDerWaalsContact O-N 3.09Å; L93-L96 HydrophobicContact CB-CD1 4.21Å; L93-L96 HydrophobicContact CB-CG 4.28Å; L93-L96 HydrophobicContact CD1-CD1 4.38Å; L93-L96 PolarHBondContact O-N 3.39Å | ||
| 94 | P | 83 | Confident | 87.1 | Confident | 53 Ų | 53 | 88.7 Ų | 88.7 | 34% | 0.344 | 46% | 0.458 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.3 | -16.4 | -170.9 | 26.2 | -35.4 | 0 | 0 | 0 | 114.6 | M134 V135 K138 | P94-M134 HydrophobicContact CB-CB 4.22Å; P94-M134 HydrophobicContact CG-CB 4.05Å; P94-V135 HydrophobicContact CG-CG2 3.86Å; P94-K138 HydrophobicContact CG-CB 4.26Å |
| 95 | F | 83 | Confident | 87.1 | Confident | 56 Ų | 56 | 90.7 Ų | 90.7 | 25% | 0.246 | 47% | 0.474 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -97.8 | -4 | 177.1 | 62.4 | -96.3 | 0 | 0 | 0 | 113.3 | L93 M128 P131 M134 V135 | L93-F95 HydrophobicContact CB-CD1 3.95Å; L93-F95 HydrophobicContact CB-CE1 3.53Å; L93-F95 HydrophobicContact CB-CE2 4.46Å; L93-F95 HydrophobicContact CB-CZ 3.83Å; L93-F95 HydrophobicContact CD1-CE1 3.69Å; L93-F95 HydrophobicContact CD1-CE2 4.36Å; L93-F95 HydrophobicContact CD1-CZ 3.39Å; L93-F95 HydrophobicContact CG-CE1 4.11Å; L93-F95 HydrophobicContact CG-CZ 4.21Å; L93-F95 PolarHBondContact O-N 3.32Å; L93-F95 VanDerWaalsContact O-N 3.09Å; F95-M128 VanDerWaalsContact CA-SD 3.6Å; F95-M128 HydrophobicContact CB-SD 4.09Å; F95-M128 VanDerWaalsContact O-CE 3.26Å; F95-M128 WeakPolarHBondContact O-CE 3.46Å; F95-P131 HydrophobicContact CB-CB 4.22Å; F95-P131 HydrophobicContact CB-CG 4.37Å; F95-P131 HydrophobicContact CD1-CB 3.81Å; F95-P131 HydrophobicContact CD2-CB 4.26Å; F95-P131 HydrophobicContact CD2-CG 4.37Å; F95-P131 HydrophobicContact CE1-CB 4.18Å; F95-P131 HydrophobicContact CG-CB 3.84Å; F95-P131 HydrophobicContact CG-CG 4.24Å; F95-M134 HydrophobicContact CB-SD 3.69Å; F95-V135 HydrophobicContact CD1-CG2 4.01Å; F95-V135 HydrophobicContact CE1-CG2 3.97Å |
| 96 | L | 84.9 | Confident | 87 | Confident | 70 Ų | 70 | 85.2 Ų | 85.2 | 37% | 0.366 | 46% | 0.457 | S | S | . | . | S | Bend | trans | -94 | 132.1 | 175.9 | -69.4 | 179.1 | 0 | 0 | 0 | 109.1 | L93 S98 | L93-L96 HydrophobicContact CB-CD1 4.21Å; L93-L96 HydrophobicContact CB-CG 4.28Å; L93-L96 HydrophobicContact CD1-CD1 4.38Å; L93-L96 PolarHBondContact O-N 3.39Å; L96-S98 PolarHBondContact O-N 3.45Å |
| 97 | P | 81.9 | Confident | 86.9 | Confident | 77 Ų | 77 | 86.2 Ų | 86.2 | 50% | 0.5 | 45% | 0.447 | S | S | . | . | trans | -61.7 | 129.1 | 175.8 | 27.2 | -34.1 | 0 | 0 | 0 | 109.5 | P122 | P97-P122 HydrophobicContact CB-CB 3.94Š| ||
| 98 | S | 80.8 | Confident | 86.8 | Confident | 82 Ų | 82 | 87 Ų | 87 | 57% | 0.573 | 46% | 0.457 | S | S | * | . | trans | -104.2 | 128.7 | 170.9 | 59.5 | 0 | 0 | 0 | 0 | 109.1 | L96 | L96-S98 PolarHBondContact O-N 3.45Š| ||
| 99 | S | 84.1 | Confident | 86.8 | Confident | 89 Ų | 89 | 81 Ų | 81 | 62% | 0.622 | 44% | 0.442 | S | S | * | . | trans | -91.7 | 149.3 | 164.4 | 56.8 | 0 | 0 | 0 | 0 | 109.7 | L101 | S99-L101 PolarHBondContact O-N 2.88Š| ||
| 100 | N | 87.4 | Confident | 87.1 | Confident | 58 Ų | 58 | 77.3 Ų | 77.3 | 31% | 0.31 | 43% | 0.428 | S | S | . | . | trans | -89.6 | 20.9 | 179.9 | -165.7 | 43.7 | 0 | 0 | 0 | 112.6 | A102 L103 D104 | N100-A102 PolarHBondContact O-N 3.46Å; N100-A102 VanDerWaalsContact O-N 3.15Å; N100-L103 WeakPolarHBondContact ND2-CD2 3.39Å; N100-L103 WeakPolarHBondContact O-CA 3.46Å; N100-L103 WeakPolarHBondContact O-CB 3.42Å; N100-L103 PolarHBondContact O-N 3.48Å; N100-L103 WeakPolarHBondContact OD1-CB 3.43Å; N100-L103 WeakPolarHBondContact OD1-CD1 3.39Å; N100-D104 WeakPolarHBondContact CB-OD2 3.45Å; N100-D104 PolarHBondContact ND2-OD1 3.33Å; N100-D104 PolarHBondContact O-N 3.45Å | ||
| 101 | L | 89.9 | Confident | 87.8 | Confident | 106 Ų | 106 | 82 Ų | 82 | 56% | 0.555 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -50.3 | -49 | -166.1 | -176.1 | 67.7 | 0 | 0 | 0 | 113.9 | S99 L103 D104 T105 | S99-L101 PolarHBondContact O-N 2.88Å; L101-L103 VanDerWaalsContact C-N 3.28Å; L101-L103 PolarHBondContact O-N 3.18Å; L101-D104 PolarHBondContact O-N 3.4Å; L101-T105 PolarHBondContact O-N 3.44Å; L101-T105 PolarHBondContact O-OG1 2.95Å |
| 102 | A | 92.9 | Very high | 88.4 | Confident | 63 Ų | 63 | 77 Ų | 77 | 52% | 0.521 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -62.5 | -36.9 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | A87 N100 L106 | A87-A102 HydrophobicContact CB-CB 4.29Å; N100-A102 PolarHBondContact O-N 3.46Å; N100-A102 VanDerWaalsContact O-N 3.15Å; A102-L106 VanDerWaalsContact O-CG 3.3Å; A102-L106 WeakPolarHBondContact O-CG 3.35Å; A102-L106 PolarHBondContact O-N 2.86Å |
| 103 | L | 92.7 | Very high | 88.8 | Confident | 3 Ų | 3 | 75.9 Ų | 75.9 | 2% | 0.016 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -73.4 | -41.4 | 176.7 | -173.6 | 171.9 | 0 | 0 | 0 | 110.2 | A87 R88 N100 L101 T105 L106 R107 | A87-L103 HydrophobicContact CB-CB 4.23Å; R88-L103 HydrophobicContact CG-CD1 3.29Å; R88-L103 HydrophobicContact CG-CG 4.47Å; N100-L103 WeakPolarHBondContact ND2-CD2 3.39Å; N100-L103 WeakPolarHBondContact O-CA 3.46Å; N100-L103 WeakPolarHBondContact O-CB 3.42Å; N100-L103 PolarHBondContact O-N 3.48Å; N100-L103 WeakPolarHBondContact OD1-CB 3.43Å; N100-L103 WeakPolarHBondContact OD1-CD1 3.39Å; L101-L103 VanDerWaalsContact C-N 3.28Å; L101-L103 PolarHBondContact O-N 3.18Å; L103-T105 VanDerWaalsContact C-N 3.34Å; L103-T105 PolarHBondContact O-N 3.32Å; L103-L106 PolarHBondContact O-N 3.02Å; L103-L106 VanDerWaalsContact O-N 3.15Å; L103-R107 HydrophobicContact CD2-CG 3.86Å; L103-R107 VanDerWaalsContact CD2-CZ 3.49Å; L103-R107 VanDerWaalsContact CD2-NE 3.3Å; L103-R107 PolarHBondContact O-N 3.37Å |
| 104 | D | 92.1 | Very high | 88.9 | Confident | 45 Ų | 45 | 72.7 Ų | 72.7 | 24% | 0.241 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -63.4 | -41 | -179 | -59.2 | -26.8 | 0 | 0 | 0 | 111.1 | N100 L101 L106 R107 G108 S109 | N100-D104 WeakPolarHBondContact CB-OD2 3.45Å; N100-D104 PolarHBondContact ND2-OD1 3.33Å; N100-D104 PolarHBondContact O-N 3.45Å; L101-D104 PolarHBondContact O-N 3.4Å; D104-L106 PolarHBondContact O-N 2.91Å; D104-R107 CarbonylContact O-C 3.5Å; D104-R107 PolarHBondContact O-N 3.19Å; D104-R107 VanDerWaalsContact O-N 3.14Å; D104-G108 PolarHBondContact O-N 3.35Å; D104-S109 PolarHBondContact O-N 3.04Å |
| 105 | T | 94.1 | Very high | 89.2 | Confident | 76 Ų | 76 | 78 Ų | 78 | 47% | 0.466 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -62 | -41.4 | 171.9 | -61.5 | 0 | 0 | 0 | 0 | 112.4 | L101 L103 R107 G108 D110 | L101-T105 PolarHBondContact O-N 3.44Å; L101-T105 PolarHBondContact O-OG1 2.95Å; L103-T105 VanDerWaalsContact C-N 3.34Å; L103-T105 PolarHBondContact O-N 3.32Å; T105-R107 PolarHBondContact O-N 3.1Å; T105-G108 PolarHBondContact O-N 2.83Å; T105-D110 WeakPolarHBondContact CA-OD2 3.48Å; T105-D110 WeakPolarHBondContact CB-OD2 3.48Å; T105-D110 PolarHBondContact OG1-OD2 2.92Å |
| 106 | L | 93.3 | Very high | 89.2 | Confident | 61 Ų | 61 | 81.2 Ų | 81.2 | 32% | 0.319 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -66.8 | -27.4 | 176.5 | -68.3 | 171 | 0 | 0 | 0 | 112.3 | E83 Y84 A87 A102 L103 D104 | E83-L106 HydrophobicContact CB-CD1 3.96Å; Y84-L106 HydrophobicContact CD1-CB 3.82Å; Y84-L106 HydrophobicContact CD1-CD1 4.05Å; Y84-L106 HydrophobicContact CE1-CB 3.45Å; Y84-L106 VanDerWaalsContact CE1-CB 3.45Å; Y84-L106 PolarHBondContact OH-O 3.05Å; A87-L106 HydrophobicContact CB-CD1 3.93Å; A102-L106 VanDerWaalsContact O-CG 3.3Å; A102-L106 WeakPolarHBondContact O-CG 3.35Å; A102-L106 PolarHBondContact O-N 2.86Å; L103-L106 PolarHBondContact O-N 3.02Å; L103-L106 VanDerWaalsContact O-N 3.15Å; D104-L106 PolarHBondContact O-N 2.91Å |
| 107 | R | 91.1 | Very high | 89.3 | Confident | 86 Ų | 86 | 83.1 Ų | 83.1 | 33% | 0.325 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -84.6 | -15.9 | 174.5 | -77.2 | -177.5 | 175.7 | 171.1 | -8.4 | 113.6 | D61 Y84 L103 D104 T105 S109 | D61-R107 IonicContact OD2-NH2 2.63Å; Y84-R107 HydrophobicContact CE1-CG 3.76Å; Y84-R107 HydrophobicContact CE2-CG 4.49Å; Y84-R107 WeakPolarHBondContact OH-CG 3.38Å; L103-R107 HydrophobicContact CD2-CG 3.86Å; L103-R107 VanDerWaalsContact CD2-CZ 3.49Å; L103-R107 VanDerWaalsContact CD2-NE 3.3Å; L103-R107 PolarHBondContact O-N 3.37Å; D104-R107 CarbonylContact O-C 3.5Å; D104-R107 PolarHBondContact O-N 3.19Å; D104-R107 VanDerWaalsContact O-N 3.14Å; T105-R107 PolarHBondContact O-N 3.1Å; R107-S109 VanDerWaalsContact C-N 3.25Å |
| 108 | G | 90.8 | Very high | 89.6 | Confident | 36 Ų | 36 | 85.2 Ų | 85.2 | 37% | 0.371 | 48% | 0.478 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 68.1 | 24.9 | -169.6 | 0 | 0 | 0 | 0 | 0 | 113 | D104 T105 | D104-G108 PolarHBondContact O-N 3.35Å; T105-G108 PolarHBondContact O-N 2.83Å |
| 109 | S | 89.9 | Confident | 90 | Very high | 49 Ų | 49 | 87.9 Ų | 87.9 | 34% | 0.343 | 49% | 0.485 | S | S | . | . | trans | -84 | -15.2 | 177.9 | -59.5 | 0 | 0 | 0 | 0 | 112.5 | D104 R107 E111 C112 | D104-S109 PolarHBondContact O-N 3.04Å; R107-S109 VanDerWaalsContact C-N 3.25Å; S109-E111 PolarHBondContact O-N 3.34Å; S109-C112 PolarHBondContact O-N 2.93Å; S109-C112 VanDerWaalsContact O-O 3.08Å | ||
| 110 | D | 91.3 | Very high | 89.8 | Confident | 82 Ų | 82 | 88 Ų | 88 | 44% | 0.439 | 49% | 0.485 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.2 | -14.7 | 178.3 | 55.1 | -21.6 | 0 | 0 | 0 | 114.2 | T105 | T105-D110 WeakPolarHBondContact CA-OD2 3.48Å; T105-D110 WeakPolarHBondContact CB-OD2 3.48Å; T105-D110 PolarHBondContact OG1-OD2 2.92Å |
| 111 | E | 92.4 | Very high | 89.6 | Confident | 173 Ų | 173 | 89.4 Ų | 89.4 | 81% | 0.808 | 49% | 0.493 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.7 | -13.4 | 175.3 | -59.1 | -173.6 | 169.6 | 0 | 0 | 113.4 | S109 | S109-E111 PolarHBondContact O-N 3.34Š|
| 112 | C | 90.4 | Very high | 89 | Confident | 96 Ų | 96 | 88.1 Ų | 88.1 | 65% | 0.649 | 49% | 0.491 | S | S | * | . | S | Bend | trans | -119.4 | 145.1 | -173.6 | -68 | 0 | 0 | 0 | 0 | 110.6 | S109 | S109-C112 PolarHBondContact O-N 2.93Å; S109-C112 VanDerWaalsContact O-O 3.08Å |
| 113 | I | 91.2 | Very high | 88.3 | Confident | 140 Ų | 140 | 88 Ų | 88 | 72% | 0.718 | 50% | 0.495 | S | S | * | . | trans | -104.1 | 125.6 | 174.6 | -168 | 167.6 | 0 | 0 | 0 | 110.3 | D117 | I113-D117 HydrophobicContact CG1-CB 3.99Š| ||
| 114 | G | 88.9 | Confident | 87.5 | Confident | 25 Ų | 25 | 95.2 Ų | 95.2 | 26% | 0.258 | 53% | 0.529 | S | S | . | . | trans | -98.9 | -179.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | E116 D117 | G114-E116 VanDerWaalsContact C-N 3.29Å; G114-D117 PolarHBondContact N-OD2 2.88Å | ||
| 115 | F | 89.3 | Confident | 86.8 | Confident | 165 Ų | 165 | 95.5 Ų | 95.5 | 72% | 0.724 | 53% | 0.534 | S | S | * | . | S | Bend | trans | -71.9 | -31.1 | 172.5 | -71 | -81.6 | 0 | 0 | 0 | 111.4 | D117 I118 L119 | F115-D117 VanDerWaalsContact C-N 3.29Å; F115-D117 PolarHBondContact O-N 3.2Å; F115-I118 PolarHBondContact O-N 3.15Å; F115-L119 WeakPolarHBondContact O-CB 3.42Å; F115-L119 WeakPolarHBondContact O-CG 3.41Å; F115-L119 PolarHBondContact O-N 3.3Å |
| 116 | E | 84.4 | Confident | 86 | Confident | 124 Ų | 124 | 101.2 Ų | 101.2 | 58% | 0.579 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -63.6 | -36.5 | -179.1 | -56.2 | 76.1 | -166.4 | 0 | 0 | 110.9 | G114 I118 L119 C120 | G114-E116 VanDerWaalsContact C-N 3.29Å; E116-I118 PolarHBondContact O-N 2.79Å; E116-L119 PolarHBondContact O-N 2.95Å; E116-C120 WeakPolarHBondContact O-CA 3.4Å; E116-C120 VanDerWaalsContact O-CB 3.23Å; E116-C120 WeakPolarHBondContact O-CB 3.25Å; E116-C120 PolarHBondContact O-N 3.15Å |
| 117 | D | 86 | Confident | 85 | Confident | 110 Ų | 110 | 104 Ų | 104 | 59% | 0.588 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -65.9 | -25.4 | 179.2 | -59.2 | -45.3 | 0 | 0 | 0 | 112.8 | I113 G114 F115 | I113-D117 HydrophobicContact CG1-CB 3.99Å; G114-D117 PolarHBondContact N-OD2 2.88Å; F115-D117 VanDerWaalsContact C-N 3.29Å; F115-D117 PolarHBondContact O-N 3.2Å |
| 118 | I | 89.1 | Confident | 84.2 | Confident | 120 Ų | 120 | 103.8 Ų | 103.8 | 62% | 0.615 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -94.3 | -38.9 | -178.8 | -56.3 | 171.4 | 0 | 0 | 0 | 110.8 | F115 E116 | F115-I118 PolarHBondContact O-N 3.15Å; E116-I118 PolarHBondContact O-N 2.79Å |
| 119 | L | 87.8 | Confident | 83.6 | Confident | 139 Ų | 139 | 103.9 Ų | 103.9 | 73% | 0.728 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -99.7 | -16.3 | -169.7 | -61.4 | 178.8 | 0 | 0 | 0 | 114.3 | F115 E116 | F115-L119 WeakPolarHBondContact O-CB 3.42Å; F115-L119 WeakPolarHBondContact O-CG 3.41Å; F115-L119 PolarHBondContact O-N 3.3Å; E116-L119 PolarHBondContact O-N 2.95Å |
| 120 | C | 80.8 | Confident | 83.5 | Confident | 91 Ų | 91 | 107.1 Ų | 107.1 | 62% | 0.615 | 59% | 0.59 | S | S | * | * | trans | -108.2 | 55.2 | -179.6 | -66.2 | 0 | 0 | 0 | 0 | 112.4 | E116 P122 | E116-C120 WeakPolarHBondContact O-CA 3.4Å; E116-C120 VanDerWaalsContact O-CB 3.23Å; E116-C120 WeakPolarHBondContact O-CB 3.25Å; E116-C120 PolarHBondContact O-N 3.15Å; C120-P122 VanDerWaalsContact O-CD 3.27Å; C120-P122 WeakPolarHBondContact O-CD 3.28Å; C120-P122 VanDerWaalsContact O-N 3.15Å | ||
| 121 | D | 82.8 | Confident | 83.3 | Confident | 88 Ų | 88 | 106 Ų | 106 | 47% | 0.471 | 59% | 0.587 | S | S | . | * | trans | -60.2 | 116.6 | 173.8 | 179.4 | 10.2 | 0 | 0 | 0 | 110.4 | G123 Q124 S125 | D121-G123 PolarHBondContact O-N 2.98Å; D121-G123 VanDerWaalsContact O-N 3.15Å; D121-G123 PolarHBondContact OD1-N 3.35Å; D121-Q124 HydrophobicContact CB-CB 4.49Å; D121-Q124 HydrophobicContact CB-CG 4.43Å; D121-Q124 PolarHBondContact O-N 3.14Å; D121-S125 PolarHBondContact O-N 2.94Å | ||
| 122 | P | 77.5 | Confident | 83.1 | Confident | 79 Ų | 79 | 103.9 Ų | 103.9 | 51% | 0.513 | 58% | 0.577 | S | S | . | * | G | 310 helix | trans | -61 | -23.9 | 178.6 | 24.8 | -34.7 | 0 | 0 | 0 | 112.9 | P97 C120 Q124 | P97-P122 HydrophobicContact CB-CB 3.94Å; C120-P122 VanDerWaalsContact O-CD 3.27Å; C120-P122 WeakPolarHBondContact O-CD 3.28Å; C120-P122 VanDerWaalsContact O-N 3.15Å; P122-Q124 VanDerWaalsContact C-N 3.27Å; P122-Q124 PolarHBondContact O-N 3.38Å |
| 123 | G | 77.8 | Confident | 83 | Confident | 60 Ų | 60 | 104.3 Ų | 104.3 | 62% | 0.619 | 57% | 0.571 | S | S | * | * | G | 310 helix | trans | -70.4 | -20.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | D121 | D121-G123 PolarHBondContact O-N 2.98Å; D121-G123 VanDerWaalsContact O-N 3.15Å; D121-G123 PolarHBondContact OD1-N 3.35Å |
| 124 | Q | 77.4 | Confident | 82.9 | Confident | 155 Ų | 155 | 99.2 Ų | 99.2 | 72% | 0.724 | 54% | 0.544 | S | S | * | . | G | 310 helix | trans | -111.6 | 13.4 | -179.6 | -58.8 | -59.8 | -40.7 | 0 | 0 | 112.6 | D121 P122 E126 | D121-Q124 HydrophobicContact CB-CB 4.49Å; D121-Q124 HydrophobicContact CB-CG 4.43Å; D121-Q124 PolarHBondContact O-N 3.14Å; P122-Q124 VanDerWaalsContact C-N 3.27Å; P122-Q124 PolarHBondContact O-N 3.38Å; Q124-E126 PolarHBondContact O-N 3.1Å |
| 125 | S | 76.3 | Confident | 82.9 | Confident | 50 Ų | 50 | 100.1 Ų | 100.1 | 35% | 0.35 | 55% | 0.545 | S | S | . | . | trans | -67.5 | 119.5 | -176.8 | -170.4 | 0 | 0 | 0 | 0 | 111.4 | D121 V127 M128 | D121-S125 PolarHBondContact O-N 2.94Å; S125-V127 PolarHBondContact O-N 3.34Å; S125-V127 VanDerWaalsContact O-N 3.09Å; S125-V127 PolarHBondContact OG-N 2.94Å; S125-M128 WeakPolarHBondContact O-CB 3.12Å; S125-M128 PolarHBondContact O-N 3.3Å | ||
| 126 | E | 76.8 | Confident | 83 | Confident | 196 Ų | 196 | 96 Ų | 96 | 92% | 0.916 | 53% | 0.527 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.4 | -18.1 | 172.9 | -58.2 | 178.4 | -166.7 | 0 | 0 | 112.9 | Q124 M128 | Q124-E126 PolarHBondContact O-N 3.1Å; E126-M128 PolarHBondContact O-N 3.36Å |
| 127 | V | 73.7 | Confident | 83.1 | Confident | 119 Ų | 119 | 98.5 Ų | 98.5 | 72% | 0.721 | 53% | 0.533 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.4 | -18.3 | 178.3 | -172.4 | 0 | 0 | 0 | 0 | 111.2 | S125 G129 M134 | S125-V127 PolarHBondContact O-N 3.34Å; S125-V127 VanDerWaalsContact O-N 3.09Å; S125-V127 PolarHBondContact OG-N 2.94Å; V127-G129 PolarHBondContact O-N 3.44Å; V127-M134 WeakPolarHBondContact O-CE 3.47Å |
| 128 | M | 73.3 | Confident | 83.1 | Confident | 82 Ų | 82 | 101 Ų | 101 | 40% | 0.404 | 54% | 0.538 | S | S | . | . | trans | -75 | 110 | 179.9 | -164.6 | 63.8 | 71.9 | 0 | 0 | 110.9 | F95 S125 E126 M134 | F95-M128 VanDerWaalsContact CA-SD 3.6Å; F95-M128 HydrophobicContact CB-SD 4.09Å; F95-M128 VanDerWaalsContact O-CE 3.26Å; F95-M128 WeakPolarHBondContact O-CE 3.46Å; S125-M128 WeakPolarHBondContact O-CB 3.12Å; S125-M128 PolarHBondContact O-N 3.3Å; E126-M128 PolarHBondContact O-N 3.36Å; M128-M134 HydrophobicContact SD-CE 4.18Å; M128-M134 HydrophobicContact SD-SD 3.98Å | ||
| 129 | G | 78.4 | Confident | 83.1 | Confident | 39 Ų | 39 | 101.2 Ų | 101.2 | 40% | 0.402 | 54% | 0.54 | S | S | . | . | trans | -109.7 | -171.2 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | V127 M134 | V127-G129 PolarHBondContact O-N 3.44Å; G129-M134 PolarHBondContact N-SD 2.99Å | ||
| 130 | E | 87.4 | Confident | 83.1 | Confident | 116 Ų | 116 | 97.5 Ų | 97.5 | 54% | 0.542 | 54% | 0.535 | S | S | . | . | trans | -59.6 | 129.9 | 173.9 | -171.6 | -174.2 | 167.9 | 0 | 0 | 110.6 | H132 M133 M134 | E130-H132 PolarHBondContact O-N 2.85Å; E130-H132 VanDerWaalsContact O-N 3.09Å; E130-M133 HydrophobicContact CB-CB 4.46Å; E130-M133 HydrophobicContact CB-CG 4.22Å; E130-M133 HydrophobicContact CB-SD 4.38Å; E130-M133 PolarHBondContact O-N 3.4Å; E130-M133 VanDerWaalsContact O-N 3.12Å; E130-M134 WeakPolarHBondContact O-CG 3.36Å; E130-M134 PolarHBondContact O-N 3.44Å; E130-M134 VanDerWaalsContact O-N 3.13Å | ||
| 131 | P | 87.5 | Confident | 83.4 | Confident | 58 Ų | 58 | 99.3 Ų | 99.3 | 38% | 0.377 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -53.2 | -36.1 | -175.7 | -30.9 | 36 | 0 | 0 | 0 | 114.7 | F95 V135 | F95-P131 HydrophobicContact CB-CB 4.22Å; F95-P131 HydrophobicContact CB-CG 4.37Å; F95-P131 HydrophobicContact CD1-CB 3.81Å; F95-P131 HydrophobicContact CD2-CB 4.26Å; F95-P131 HydrophobicContact CD2-CG 4.37Å; F95-P131 HydrophobicContact CE1-CB 4.18Å; F95-P131 HydrophobicContact CG-CB 3.84Å; F95-P131 HydrophobicContact CG-CG 4.24Å; P131-V135 VanDerWaalsContact O-CG2 3.28Å; P131-V135 WeakPolarHBondContact O-CG2 3.06Å; P131-V135 PolarHBondContact O-N 3.04Å |
| 132 | H | 88.7 | Confident | 83.1 | Confident | 129 Ų | 129 | 101.9 Ų | 101.9 | 60% | 0.597 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -65.7 | -51.4 | 179.5 | -75.7 | 63.8 | 0 | 0 | 0 | 111 | E130 M134 V135 E136 | E130-H132 PolarHBondContact O-N 2.85Å; E130-H132 VanDerWaalsContact O-N 3.09Å; H132-M134 VanDerWaalsContact C-N 3.31Å; H132-M134 PolarHBondContact O-N 3.34Å; H132-V135 PolarHBondContact O-N 2.83Å; H132-E136 WeakPolarHBondContact O-CG 3.3Å; H132-E136 PolarHBondContact O-N 3.33Å |
| 133 | M | 88.6 | Confident | 83.4 | Confident | 106 Ų | 106 | 103 Ų | 103 | 52% | 0.522 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -58.2 | -41.4 | 177.7 | -66.7 | -173.7 | 66.7 | 0 | 0 | 112.5 | E130 V135 E136 Y137 | E130-M133 HydrophobicContact CB-CB 4.46Å; E130-M133 HydrophobicContact CB-CG 4.22Å; E130-M133 HydrophobicContact CB-SD 4.38Å; E130-M133 PolarHBondContact O-N 3.4Å; E130-M133 VanDerWaalsContact O-N 3.12Å; M133-V135 VanDerWaalsContact C-N 3.34Å; M133-V135 PolarHBondContact O-N 2.91Å; M133-E136 PolarHBondContact O-N 2.86Å; M133-Y137 VanDerWaalsContact O-CB 3.3Å; M133-Y137 WeakPolarHBondContact O-CB 3.48Å; M133-Y137 PolarHBondContact O-N 3.29Å |
| 134 | M | 87.6 | Confident | 83.7 | Confident | 33 Ų | 33 | 105.3 Ų | 105.3 | 16% | 0.163 | 55% | 0.55 | C | S | . | . | H | α-helix | trans | -66.5 | -36.9 | -179.3 | -61.9 | -176.9 | 106.5 | 0 | 0 | 112.3 | P94 F95 V127 M128 G129 E130 H132 K138 | P94-M134 HydrophobicContact CB-CB 4.22Å; P94-M134 HydrophobicContact CG-CB 4.05Å; F95-M134 HydrophobicContact CB-SD 3.69Å; V127-M134 WeakPolarHBondContact O-CE 3.47Å; M128-M134 HydrophobicContact SD-CE 4.18Å; M128-M134 HydrophobicContact SD-SD 3.98Å; G129-M134 PolarHBondContact N-SD 2.99Å; E130-M134 WeakPolarHBondContact O-CG 3.36Å; E130-M134 PolarHBondContact O-N 3.44Å; E130-M134 VanDerWaalsContact O-N 3.13Å; H132-M134 VanDerWaalsContact C-N 3.31Å; H132-M134 PolarHBondContact O-N 3.34Å; M134-K138 WeakPolarHBondContact O-CB 3.44Å; M134-K138 PolarHBondContact O-N 3.49Å; M134-K138 VanDerWaalsContact O-N 3.08Å |
| 135 | V | 90.3 | Very high | 84 | Confident | 44 Ų | 44 | 102.5 Ų | 102.5 | 27% | 0.267 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -72.1 | -45.6 | 176.7 | 171.2 | 0 | 0 | 0 | 0 | 110.8 | P94 F95 P131 H132 M133 Y137 K138 L139 | P94-V135 HydrophobicContact CG-CG2 3.86Å; F95-V135 HydrophobicContact CD1-CG2 4.01Å; F95-V135 HydrophobicContact CE1-CG2 3.97Å; P131-V135 VanDerWaalsContact O-CG2 3.28Å; P131-V135 WeakPolarHBondContact O-CG2 3.06Å; P131-V135 PolarHBondContact O-N 3.04Å; H132-V135 PolarHBondContact O-N 2.83Å; M133-V135 VanDerWaalsContact C-N 3.34Å; M133-V135 PolarHBondContact O-N 2.91Å; V135-Y137 VanDerWaalsContact C-N 3.34Å; V135-Y137 PolarHBondContact O-N 3.23Å; V135-K138 PolarHBondContact O-N 3.18Å; V135-L139 HydrophobicContact CG1-CD1 3.72Å; V135-L139 HydrophobicContact CG1-CG 4.39Å; V135-L139 WeakPolarHBondContact O-CB 2.89Å; V135-L139 VanDerWaalsContact O-CG 3.3Å; V135-L139 WeakPolarHBondContact O-CG 3.47Å; V135-L139 PolarHBondContact O-N 2.89Å |
| 136 | E | 90.9 | Very high | 84.5 | Confident | 77 Ų | 77 | 105.6 Ų | 105.6 | 36% | 0.36 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -58.5 | -45.2 | 176.4 | -73 | 174.6 | -179.3 | 0 | 0 | 111.7 | H132 M133 K138 L139 G140 L141 L142 | H132-E136 WeakPolarHBondContact O-CG 3.3Å; H132-E136 PolarHBondContact O-N 3.33Å; M133-E136 PolarHBondContact O-N 2.86Å; E136-K138 PolarHBondContact O-N 3.18Å; E136-L139 CarbonylContact O-C 3.54Å; E136-L139 PolarHBondContact O-N 2.92Å; E136-G140 PolarHBondContact O-N 3.48Å; E136-L141 HydrophobicContact CB-CB 4.25Å; E136-L141 PolarHBondContact O-N 2.88Å; E136-L142 HydrophobicContact CB-CD1 3.82Å; E136-L142 HydrophobicContact CB-CG 4Å; E136-L142 WeakPolarHBondContact OE2-CD1 3.48Å |
| 137 | Y | 86.4 | Confident | 85 | Confident | 177 Ų | 177 | 99.9 Ų | 99.9 | 69% | 0.694 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -61.3 | -43.6 | 174.5 | -178.6 | -101.8 | 0 | 0 | 0 | 112.2 | M133 V135 L139 G140 | M133-Y137 VanDerWaalsContact O-CB 3.3Å; M133-Y137 WeakPolarHBondContact O-CB 3.48Å; M133-Y137 PolarHBondContact O-N 3.29Å; V135-Y137 VanDerWaalsContact C-N 3.34Å; V135-Y137 PolarHBondContact O-N 3.23Å; Y137-L139 PolarHBondContact O-N 2.92Å; Y137-G140 PolarHBondContact O-N 3.34Å; Y137-G140 VanDerWaalsContact O-N 3.11Å |
| 138 | K | 85.8 | Confident | 85.7 | Confident | 163 Ų | 163 | 98.7 Ų | 98.7 | 71% | 0.709 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -64.3 | -30.7 | 178 | -174.9 | 62 | 177.5 | -172.6 | 0 | 112.6 | P94 M134 V135 E136 | P94-K138 HydrophobicContact CG-CB 4.26Å; M134-K138 WeakPolarHBondContact O-CB 3.44Å; M134-K138 PolarHBondContact O-N 3.49Å; M134-K138 VanDerWaalsContact O-N 3.08Å; V135-K138 PolarHBondContact O-N 3.18Å; E136-K138 PolarHBondContact O-N 3.18Å |
| 139 | L | 89.3 | Confident | 86.6 | Confident | 124 Ų | 124 | 99.9 Ų | 99.9 | 65% | 0.649 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -86.2 | -7.1 | 176.9 | -67.2 | 171.3 | 0 | 0 | 0 | 113.2 | V135 E136 Y137 L141 | V135-L139 HydrophobicContact CG1-CD1 3.72Å; V135-L139 HydrophobicContact CG1-CG 4.39Å; V135-L139 WeakPolarHBondContact O-CB 2.89Å; V135-L139 VanDerWaalsContact O-CG 3.3Å; V135-L139 WeakPolarHBondContact O-CG 3.47Å; V135-L139 PolarHBondContact O-N 2.89Å; E136-L139 CarbonylContact O-C 3.54Å; E136-L139 PolarHBondContact O-N 2.92Å; Y137-L139 PolarHBondContact O-N 2.92Å; L139-L141 HydrophobicContact CB-CD1 4.19Å; L139-L141 HydrophobicContact CB-CG 4.11Å; L139-L141 HydrophobicContact CD1-CD1 4.39Å |
| 140 | G | 88.2 | Confident | 87.2 | Confident | 61 Ų | 61 | 104.5 Ų | 104.5 | 63% | 0.629 | 53% | 0.533 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 74.4 | 28.6 | -179.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | E136 Y137 | E136-G140 PolarHBondContact O-N 3.48Å; Y137-G140 PolarHBondContact O-N 3.34Å; Y137-G140 VanDerWaalsContact O-N 3.11Å |
| 141 | L | 87.4 | Confident | 87.2 | Confident | 129 Ų | 129 | 103.6 Ų | 103.6 | 68% | 0.675 | 53% | 0.532 | S | S | * | . | trans | -91.2 | -13.4 | 178.7 | -61.3 | 175 | 0 | 0 | 0 | 113.2 | E136 L139 | E136-L141 HydrophobicContact CB-CB 4.25Å; E136-L141 PolarHBondContact O-N 2.88Å; L139-L141 HydrophobicContact CB-CD1 4.19Å; L139-L141 HydrophobicContact CB-CG 4.11Å; L139-L141 HydrophobicContact CD1-CD1 4.39Å | ||
| 142 | L | 75.9 | Confident | 87.2 | Confident | 142 Ų | 142 | 107.7 Ų | 107.7 | 74% | 0.743 | 55% | 0.546 | S | S | * | . | trans | -119.3 | 0 | 175.7 | -75.9 | 174.1 | 0 | 0 | 0 | 111.3 | E136 | E136-L142 HydrophobicContact CB-CD1 3.82Å; E136-L142 HydrophobicContact CB-CG 4Å; E136-L142 WeakPolarHBondContact OE2-CD1 3.48Å |
Retrieved 142 of 142 residues in 104.5 ms
(Link to these results)