| 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 | I | 47.9 | Very low | 62.2 | Low | 229 Ų | 229 | 144.2 Ų | 144.2 | 100% | 1.174 | 76% | 0.761 | S | S | * | * | 0 | 79.3 | 0 | -57.2 | 165.2 | 0 | 0 | 0 | 107.5 | |||||
| 2 | S | 44.4 | Very low | 64.2 | Low | 122 Ų | 122 | 139.4 Ų | 139.4 | 85% | 0.853 | 77% | 0.772 | S | S | * | * | trans | -169.7 | 70.1 | 178.3 | -177.2 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 3 | S | 48.1 | Very low | 66.2 | Low | 112 Ų | 112 | 136.1 Ų | 136.1 | 78% | 0.783 | 75% | 0.753 | S | S | * | * | trans | -154.8 | 19.8 | 175.3 | 68.6 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 4 | L | 54 | Low | 67.8 | Low | 161 Ų | 161 | 133.5 Ų | 133.5 | 84% | 0.843 | 74% | 0.736 | S | S | * | * | trans | -125.5 | 23.3 | -170.2 | -70.1 | -178.8 | 0 | 0 | 0 | 117.1 | ||||
| 5 | V | 56.6 | Low | 69.2 | Low | 111 Ų | 111 | 130.1 Ų | 130.1 | 67% | 0.673 | 73% | 0.732 | S | S | * | * | trans | -142.6 | 80.9 | 171.4 | -169.6 | 0 | 0 | 0 | 0 | 111 | ||||
| 6 | N | 55.4 | Low | 70.5 | Confident | 146 Ų | 146 | 132.8 Ų | 132.8 | 78% | 0.781 | 73% | 0.734 | S | S | * | * | trans | -130.1 | 73.2 | 155.9 | -140.5 | 11.1 | 0 | 0 | 0 | 107.3 | ||||
| 7 | M | 66.2 | Low | 71.7 | Confident | 150 Ų | 150 | 131.1 Ų | 131.1 | 74% | 0.739 | 73% | 0.728 | S | S | * | * | trans | -89.9 | 96.6 | 174.9 | -67.2 | -172.4 | 83.4 | 0 | 0 | 108.3 | R9 | M7-R9 WeakPolarHBondContact O-CG 3.38Å; M7-R9 PolarHBondContact O-N 3.03Å | ||
| 8 | G | 61.6 | Low | 73 | Confident | 29 Ų | 29 | 133.7 Ų | 133.7 | 30% | 0.299 | 73% | 0.725 | S | S | . | * | trans | 35.3 | 60.5 | 149.3 | 0 | 0 | 0 | 0 | 0 | 118.1 | D13 | G8-D13 WeakPolarHBondContact CA-O 3.17Å; G8-D13 WeakPolarHBondContact CA-OD2 3.42Å; G8-D13 PolarHBondContact N-OD2 3.15Å; G8-D13 VanDerWaalsContact N-OD2 3.15Å | ||
| 9 | R | 77.1 | Confident | 74.2 | Confident | 186 Ų | 186 | 136.5 Ų | 136.5 | 70% | 0.702 | 73% | 0.732 | S | S | * | * | trans | -100.6 | -2.8 | 177.1 | -61.8 | -154.1 | 172 | 108.4 | -1.3 | 114.3 | M7 | M7-R9 WeakPolarHBondContact O-CG 3.38Å; M7-R9 PolarHBondContact O-N 3.03Å | ||
| 10 | H | 83.9 | Confident | 75.3 | Confident | 141 Ų | 141 | 134.8 Ų | 134.8 | 65% | 0.653 | 73% | 0.726 | S | S | * | * | S | Bend | trans | -137.3 | 154.6 | -171.5 | -59.1 | -65.4 | 0 | 0 | 0 | 112.4 | G12 D13 L14 | H10-G12 PolarHBondContact O-N 3.1Å; H10-D13 PolarHBondContact O-N 3.3Å; H10-D13 VanDerWaalsContact O-N 3.1Å; H10-L14 WeakPolarHBondContact O-CG 2.95Å |
| 11 | F | 89.2 | Confident | 76.3 | Confident | 199 Ų | 199 | 134.7 Ų | 134.7 | 87% | 0.873 | 72% | 0.724 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53.1 | 128.3 | 172.9 | -69.5 | -67.7 | 0 | 0 | 0 | 110.4 | L14 | F11-L14 HydrophobicContact CD1-CD1 3.69Å; F11-L14 HydrophobicContact CE1-CD1 4.05Å |
| 12 | G | 86.3 | Confident | 78.7 | Confident | 87 Ų | 87 | 129.4 Ų | 129.4 | 90% | 0.897 | 70% | 0.703 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 108.8 | -26.6 | -173.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | H10 | H10-G12 PolarHBondContact O-N 3.1Š|
| 13 | D | 89.3 | Confident | 81.2 | Confident | 96 Ų | 96 | 133.2 Ų | 133.2 | 51% | 0.513 | 70% | 0.7 | S | S | . | * | S | Bend | trans | -126.9 | 21 | 180 | -169 | 37.5 | 0 | 0 | 0 | 112.9 | G8 H10 | G8-D13 WeakPolarHBondContact CA-O 3.17Å; G8-D13 WeakPolarHBondContact CA-OD2 3.42Å; G8-D13 PolarHBondContact N-OD2 3.15Å; G8-D13 VanDerWaalsContact N-OD2 3.15Å; H10-D13 PolarHBondContact O-N 3.3Å; H10-D13 VanDerWaalsContact O-N 3.1Å |
| 14 | L | 88.6 | Confident | 83.5 | Confident | 100 Ų | 100 | 133.4 Ų | 133.4 | 52% | 0.524 | 70% | 0.701 | S | S | . | * | S | Bend | trans | -73.2 | -52.4 | -173.8 | -63.9 | 173.6 | 0 | 0 | 0 | 113.1 | H10 F11 | H10-L14 WeakPolarHBondContact O-CG 2.95Å; F11-L14 HydrophobicContact CD1-CD1 3.69Å; F11-L14 HydrophobicContact CE1-CD1 4.05Å |
| 15 | A | 88.8 | Confident | 85.6 | Confident | 82 Ų | 82 | 131.1 Ų | 131.1 | 68% | 0.678 | 69% | 0.689 | S | S | * | * | trans | -162.3 | 153.3 | -173.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | V17 | A15-V17 HydrophobicContact CB-CG2 4.31Å; A15-V17 PolarHBondContact O-N 3.48Å | ||
| 16 | K | 90.1 | Very high | 87.5 | Confident | 173 Ų | 173 | 128.4 Ų | 128.4 | 75% | 0.752 | 68% | 0.675 | S | S | * | * | trans | -91.6 | 98 | 171.8 | -172.2 | 175.2 | -177.1 | 175.6 | 0 | 109.8 | ||||
| 17 | V | 91.8 | Very high | 89.4 | Confident | 105 Ų | 105 | 126.4 Ų | 126.4 | 64% | 0.636 | 67% | 0.67 | S | S | * | * | trans | -107.2 | 139 | 175.3 | -175.9 | 0 | 0 | 0 | 0 | 109.2 | A15 V20 | A15-V17 HydrophobicContact CB-CG2 4.31Å; A15-V17 PolarHBondContact O-N 3.48Å; V17-V20 HydrophobicContact CG1-CB 4.16Å; V17-V20 HydrophobicContact CG1-CG2 3.62Å | ||
| 18 | R | 94.6 | Very high | 90.9 | Very high | 178 Ų | 178 | 128.8 Ų | 128.8 | 67% | 0.672 | 68% | 0.677 | S | S | * | * | trans | -130.2 | 139.7 | 178.9 | -68.9 | -179.5 | 161.5 | -176.2 | -8.6 | 110.1 | V20 | R18-V20 PolarHBondContact O-N 3.46Š| ||
| 19 | H | 96.8 | Very high | 92.5 | Very high | 187 Ų | 187 | 134.3 Ų | 134.3 | 87% | 0.866 | 69% | 0.694 | S | S | * | * | S | Bend | trans | 59.3 | 39.7 | 171.5 | -44 | 113.2 | 0 | 0 | 0 | 116.2 | ||
| 20 | V | 95.9 | Very high | 93.5 | Very high | 102 Ų | 102 | 130.5 Ų | 130.5 | 62% | 0.618 | 69% | 0.685 | S | S | * | * | trans | -108.2 | 119.8 | 171.4 | 178.8 | 0 | 0 | 0 | 0 | 108.8 | V17 R18 T22 | V17-V20 HydrophobicContact CG1-CB 4.16Å; V17-V20 HydrophobicContact CG1-CG2 3.62Å; R18-V20 PolarHBondContact O-N 3.46Å; V20-T22 HydrophobicContact CG1-CG2 4.18Å | ||
| 21 | I | 96.3 | Very high | 93.9 | Very high | 132 Ų | 132 | 132 Ų | 132 | 68% | 0.677 | 69% | 0.69 | S | S | * | * | trans | -106.7 | 126.4 | 177.2 | -56.7 | 167.4 | 0 | 0 | 0 | 108.2 | Y23 | I21-Y23 HydrophobicContact CG2-CE1 4.03Å; I21-Y23 HydrophobicContact CG2-CE2 3.94Å | ||
| 22 | T | 97.2 | Very high | 94.2 | Very high | 118 Ų | 118 | 127.1 Ų | 127.1 | 72% | 0.724 | 69% | 0.686 | S | S | * | * | trans | -122 | 133.1 | 179.2 | 55.5 | 0 | 0 | 0 | 0 | 110.2 | V20 | V20-T22 HydrophobicContact CG1-CG2 4.18Š| ||
| 23 | Y | 97.7 | Very high | 94.5 | Very high | 203 Ų | 203 | 131.4 Ų | 131.4 | 80% | 0.796 | 68% | 0.68 | S | S | * | * | trans | -106.2 | 147.3 | 176.4 | -55.4 | -79.3 | 0 | 0 | 0 | 110.3 | I21 | I21-Y23 HydrophobicContact CG2-CE1 4.03Å; I21-Y23 HydrophobicContact CG2-CE2 3.94Å | ||
| 24 | S | 96.3 | Very high | 94.6 | Very high | 116 Ų | 116 | 129.7 Ų | 129.7 | 81% | 0.811 | 68% | 0.679 | S | S | * | * | trans | -148 | 147.3 | 178.1 | -63.6 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 25 | L | 97.1 | Very high | 94.9 | Very high | 113 Ų | 113 | 129.8 Ų | 129.8 | 59% | 0.592 | 68% | 0.68 | S | S | * | * | trans | -103.2 | 152.5 | 174.8 | -68 | 171.2 | 0 | 0 | 0 | 109.8 | Q30 | L25-Q30 HydrophobicContact CB-CG 3.89Å; L25-Q30 PolarHBondContact O-NE2 2.79Å | ||
| 26 | S | 97.1 | Very high | 95.1 | Very high | 53 Ų | 53 | 132.4 Ų | 132.4 | 37% | 0.371 | 67% | 0.673 | S | S | . | * | trans | -60 | 139.8 | 174.8 | 176.9 | 0 | 0 | 0 | 0 | 110.5 | F28 E29 Q30 | S26-F28 PolarHBondContact O-N 3.25Å; S26-F28 VanDerWaalsContact O-N 3.15Å; S26-E29 WeakPolarHBondContact O-CB 3.49Å; S26-E29 PolarHBondContact O-N 3.41Å; S26-Q30 PolarHBondContact O-N 2.95Å | ||
| 27 | P | 96.5 | Very high | 95.2 | Very high | 104 Ų | 104 | 131.6 Ų | 131.6 | 68% | 0.675 | 67% | 0.67 | S | S | * | * | G | 310 helix | trans | -56.2 | -30.9 | 177.5 | -26.4 | 35.1 | 0 | 0 | 0 | 113.6 | E29 Q30 | P27-E29 PolarHBondContact O-N 3.36Å; P27-Q30 PolarHBondContact O-N 3.15Å |
| 28 | F | 96.6 | Very high | 95.3 | Very high | 201 Ų | 201 | 130 Ų | 130 | 88% | 0.882 | 66% | 0.664 | S | S | * | * | G | 310 helix | trans | -72.8 | -14.3 | 178.2 | -58.5 | -70.7 | 0 | 0 | 0 | 113.6 | S26 | S26-F28 PolarHBondContact O-N 3.25Å; S26-F28 VanDerWaalsContact O-N 3.15Å |
| 29 | E | 95.6 | Very high | 95.4 | Very high | 144 Ų | 144 | 127.9 Ų | 127.9 | 67% | 0.673 | 66% | 0.659 | S | S | * | * | G | 310 helix | trans | -97.4 | -8.9 | 175.3 | -61.8 | -176.7 | 153.2 | 0 | 0 | 112.2 | S26 P27 | S26-E29 WeakPolarHBondContact O-CB 3.49Å; S26-E29 PolarHBondContact O-N 3.41Å; P27-E29 PolarHBondContact O-N 3.36Å |
| 30 | Q | 97.1 | Very high | 95.3 | Very high | 106 Ų | 106 | 120.3 Ų | 120.3 | 50% | 0.495 | 63% | 0.632 | S | S | . | * | S | Bend | trans | -102.1 | 155.1 | -178.2 | -63.7 | -175.2 | 47.1 | 0 | 0 | 111.9 | L25 S26 P27 | L25-Q30 HydrophobicContact CB-CG 3.89Å; L25-Q30 PolarHBondContact O-NE2 2.79Å; S26-Q30 PolarHBondContact O-N 2.95Å; P27-Q30 PolarHBondContact O-N 3.15Å |
| 31 | K | 94.2 | Very high | 95.3 | Very high | 174 Ų | 174 | 119.5 Ų | 119.5 | 76% | 0.757 | 62% | 0.623 | S | S | * | * | trans | -85.3 | 125.3 | 168.8 | -66.1 | 178.3 | 179.3 | 178.4 | 0 | 109.1 | F33 A34 | K31-F33 PolarHBondContact O-N 3.25Å; K31-A34 HydrophobicContact CB-CB 4.25Å | ||
| 32 | A | 93.7 | Very high | 95.4 | Very high | 96 Ų | 96 | 116.4 Ų | 116.4 | 79% | 0.793 | 61% | 0.612 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.8 | -36.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113 | ||
| 33 | F | 92.3 | Very high | 95.4 | Very high | 177 Ų | 177 | 114.3 Ų | 114.3 | 78% | 0.776 | 60% | 0.596 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -122.4 | 64.2 | 178.7 | -57.9 | -71.7 | 0 | 0 | 0 | 111.8 | K31 | K31-F33 PolarHBondContact O-N 3.25Š|
| 34 | A | 92.7 | Very high | 95.4 | Very high | 59 Ų | 59 | 109.3 Ų | 109.3 | 49% | 0.488 | 59% | 0.587 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -68.8 | 140.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | K31 Y36 | K31-A34 HydrophobicContact CB-CB 4.25Å; A34-Y36 VanDerWaalsContact C-N 3.27Å; A34-Y36 PolarHBondContact O-N 2.8Å; A34-Y36 VanDerWaalsContact O-N 3.16Å |
| 35 | N | 94.4 | Very high | 95.4 | Very high | 103 Ų | 103 | 111.6 Ų | 111.6 | 55% | 0.551 | 58% | 0.578 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 55.4 | 33.1 | 169.2 | -58.1 | -54.8 | 0 | 0 | 0 | 115.7 | F37 S38 K39 G40 | N35-F37 PolarHBondContact O-N 3.16Å; N35-S38 WeakPolarHBondContact CB-OG 3.49Å; N35-S38 PolarHBondContact OD1-OG 3.12Å; N35-K39 HydrophobicContact CB-CB 3.86Å; N35-K39 HydrophobicContact CB-CG 3.83Å; N35-K39 WeakPolarHBondContact O-CA 3.25Å; N35-K39 PolarHBondContact O-N 3.49Å; N35-G40 PolarHBondContact O-N 3.21Å |
| 36 | Y | 92.2 | Very high | 95.5 | Very high | 137 Ų | 137 | 113.2 Ų | 113.2 | 54% | 0.537 | 58% | 0.576 | S | S | . | * | I | π-helix | trans | -54.6 | -52.4 | -175.9 | -176.6 | -98.4 | 0 | 0 | 0 | 113.1 | A34 G40 I41 | A34-Y36 VanDerWaalsContact C-N 3.27Å; A34-Y36 PolarHBondContact O-N 2.8Å; A34-Y36 VanDerWaalsContact O-N 3.16Å; Y36-G40 CarbonylContact O-C 3.52Å; Y36-G40 WeakPolarHBondContact O-CA 3.47Å; Y36-G40 PolarHBondContact O-N 3Å; Y36-I41 HydrophobicContact CE1-CD1 4.32Å; Y36-I41 HydrophobicContact CE1-CG1 4.45Å; Y36-I41 PolarHBondContact O-N 2.73Å |
| 37 | F | 94.3 | Very high | 95.5 | Very high | 156 Ų | 156 | 119 Ų | 119 | 68% | 0.684 | 59% | 0.589 | S | S | * | * | I | π-helix | trans | -79.7 | -40.9 | -179.5 | -61.5 | -78 | 0 | 0 | 0 | 113 | N35 I41 P42 | N35-F37 PolarHBondContact O-N 3.16Å; F37-I41 HydrophobicContact CD1-CD1 3.54Å; F37-I41 HydrophobicContact CE1-CD1 4.11Å; F37-I41 HydrophobicContact CG-CD1 4.46Å; F37-P42 VanDerWaalsContact O-CD 3.27Å; F37-P42 WeakPolarHBondContact O-CD 3.28Å |
| 38 | S | 93.8 | Very high | 95.5 | Very high | 72 Ų | 72 | 119 Ų | 119 | 50% | 0.503 | 58% | 0.579 | S | S | . | * | I | π-helix | trans | -76 | -29.5 | -173.7 | 58.7 | 0 | 0 | 0 | 0 | 113.8 | N35 | N35-S38 WeakPolarHBondContact CB-OG 3.49Å; N35-S38 PolarHBondContact OD1-OG 3.12Å |
| 39 | K | 95 | Very high | 95.6 | Very high | 133 Ų | 133 | 112 Ų | 112 | 58% | 0.578 | 55% | 0.552 | S | S | * | * | I | π-helix | trans | -127.9 | -36 | -177.9 | -61.2 | -66.4 | -178 | -177.8 | 0 | 113 | N35 N43 | N35-K39 HydrophobicContact CB-CB 3.86Å; N35-K39 HydrophobicContact CB-CG 3.83Å; N35-K39 WeakPolarHBondContact O-CA 3.25Å; N35-K39 PolarHBondContact O-N 3.49Å; K39-N43 VanDerWaalsContact O-CB 3.28Å; K39-N43 WeakPolarHBondContact O-CB 3.43Å; K39-N43 PolarHBondContact O-N 2.98Å; K39-N43 VanDerWaalsContact O-N 3.15Å; K39-N43 PolarHBondContact O-ND2 2.78Å |
| 40 | G | 95.4 | Very high | 95.6 | Very high | 28 Ų | 28 | 107.9 Ų | 107.9 | 29% | 0.289 | 54% | 0.544 | S | S | . | . | I | π-helix | trans | -61.4 | -62.6 | -179.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | N35 Y36 N43 V44 | N35-G40 PolarHBondContact O-N 3.21Å; Y36-G40 CarbonylContact O-C 3.52Å; Y36-G40 WeakPolarHBondContact O-CA 3.47Å; Y36-G40 PolarHBondContact O-N 3Å; G40-N43 PolarHBondContact O-N 3.4Å; G40-N43 VanDerWaalsContact O-N 3.14Å; G40-V44 WeakPolarHBondContact O-CG2 3.1Å; G40-V44 PolarHBondContact O-N 3.22Å |
| 41 | I | 96.4 | Very high | 95.6 | Very high | 84 Ų | 84 | 105.9 Ų | 105.9 | 43% | 0.431 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -58.1 | -48.5 | -178.2 | -63.2 | 174.2 | 0 | 0 | 0 | 112.4 | Y36 F37 N43 V44 W45 | Y36-I41 HydrophobicContact CE1-CD1 4.32Å; Y36-I41 HydrophobicContact CE1-CG1 4.45Å; Y36-I41 PolarHBondContact O-N 2.73Å; F37-I41 HydrophobicContact CD1-CD1 3.54Å; F37-I41 HydrophobicContact CE1-CD1 4.11Å; F37-I41 HydrophobicContact CG-CD1 4.46Å; I41-N43 VanDerWaalsContact C-N 3.28Å; I41-N43 PolarHBondContact O-N 3.25Å; I41-V44 PolarHBondContact O-N 3.17Å; I41-V44 VanDerWaalsContact O-N 3.14Å; I41-W45 PolarHBondContact O-N 3.31Å |
| 42 | P | 97.3 | Very high | 95.8 | Very high | 68 Ų | 68 | 101.6 Ų | 101.6 | 44% | 0.442 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -59.2 | -36.5 | 176.9 | -28.3 | 37.1 | 0 | 0 | 0 | 113.7 | F37 W45 R46 | F37-P42 VanDerWaalsContact O-CD 3.27Å; F37-P42 WeakPolarHBondContact O-CD 3.28Å; P42-W45 PolarHBondContact O-N 2.85Å; P42-R46 WeakPolarHBondContact O-CB 3.25Å; P42-R46 PolarHBondContact O-N 3.02Å |
| 43 | N | 96.9 | Very high | 95.9 | Very high | 73 Ų | 73 | 104.5 Ų | 104.5 | 39% | 0.39 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -71.6 | -36.7 | 176.2 | -83.7 | -58.4 | 0 | 0 | 0 | 112.7 | K39 G40 I41 W45 R46 R47 | K39-N43 VanDerWaalsContact O-CB 3.28Å; K39-N43 WeakPolarHBondContact O-CB 3.43Å; K39-N43 PolarHBondContact O-N 2.98Å; K39-N43 VanDerWaalsContact O-N 3.15Å; K39-N43 PolarHBondContact O-ND2 2.78Å; G40-N43 PolarHBondContact O-N 3.4Å; G40-N43 VanDerWaalsContact O-N 3.14Å; I41-N43 VanDerWaalsContact C-N 3.28Å; I41-N43 PolarHBondContact O-N 3.25Å; N43-W45 VanDerWaalsContact C-N 3.35Å; N43-R46 PolarHBondContact O-N 3.45Å; N43-R47 WeakPolarHBondContact O-CB 3.39Å; N43-R47 VanDerWaalsContact O-CG 3.25Å; N43-R47 WeakPolarHBondContact O-CG 3.33Å; N43-R47 PolarHBondContact O-N 3.23Å |
| 44 | V | 97.5 | Very high | 96.1 | Very high | 99 Ų | 99 | 104.1 Ų | 104.1 | 60% | 0.6 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -61.3 | -47.1 | 172.9 | 173.5 | 0 | 0 | 0 | 0 | 110 | G40 I41 R46 R47 F48 | G40-V44 WeakPolarHBondContact O-CG2 3.1Å; G40-V44 PolarHBondContact O-N 3.22Å; I41-V44 PolarHBondContact O-N 3.17Å; I41-V44 VanDerWaalsContact O-N 3.14Å; V44-R46 PolarHBondContact O-N 3.3Å; V44-R47 PolarHBondContact O-N 3.18Å; V44-F48 WeakPolarHBondContact O-CB 3.39Å; V44-F48 PolarHBondContact O-N 2.91Å |
| 45 | W | 97.8 | Very high | 96.3 | Very high | 164 Ų | 164 | 105.5 Ų | 105.5 | 62% | 0.621 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -58.4 | -48.6 | 176.4 | -178.4 | -113.3 | 0 | 0 | 0 | 112 | I41 P42 N43 R47 F48 T49 | I41-W45 PolarHBondContact O-N 3.31Å; P42-W45 PolarHBondContact O-N 2.85Å; N43-W45 VanDerWaalsContact C-N 3.35Å; W45-R47 VanDerWaalsContact C-N 3.29Å; W45-R47 PolarHBondContact O-N 3.15Å; W45-F48 HydrophobicContact CE3-CD1 4.02Å; W45-F48 HydrophobicContact CH2-CD1 4.39Å; W45-F48 HydrophobicContact CH2-CE1 4.41Å; W45-F48 AromaticContact CZ3-CD1 3.76Å; W45-F48 HydrophobicContact CZ3-CD1 3.76Å; W45-F48 AromaticContact CZ3-CE1 3.98Å; W45-F48 HydrophobicContact CZ3-CE1 3.98Å; W45-F48 WeakPolarHBondContact O-CB 3.44Å; W45-F48 PolarHBondContact O-N 3.25Å; W45-T49 HydrophobicContact CD2-CG2 3.95Å; W45-T49 HydrophobicContact CE3-CG2 4.47Å; W45-T49 HydrophobicContact CG-CG2 4.42Å; W45-T49 HydrophobicContact CH2-CG2 4.24Å; W45-T49 HydrophobicContact CZ2-CG2 3.68Å; W45-T49 WeakPolarHBondContact O-CG2 3.26Å; W45-T49 PolarHBondContact O-N 3.17Å; W45-T49 PolarHBondContact O-OG1 2.95Å |
| 46 | R | 97.7 | Very high | 96.5 | Very high | 146 Ų | 146 | 101.3 Ų | 101.3 | 55% | 0.551 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -57.5 | -39.3 | 175.9 | -171.5 | -168.9 | 64.4 | 73.9 | -1.8 | 112.7 | P42 N43 V44 T49 A50 | P42-R46 WeakPolarHBondContact O-CB 3.25Å; P42-R46 PolarHBondContact O-N 3.02Å; N43-R46 PolarHBondContact O-N 3.45Å; V44-R46 PolarHBondContact O-N 3.3Å; R46-T49 PolarHBondContact O-OG1 3.18Å; R46-A50 WeakPolarHBondContact O-CB 3.23Å; R46-A50 PolarHBondContact O-N 3.44Å |
| 47 | R | 97.2 | Very high | 96.8 | Very high | 174 Ų | 174 | 97.9 Ų | 97.9 | 66% | 0.657 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -70.4 | -40 | 177.5 | -73 | 176 | 71.9 | 178.5 | 3 | 111.9 | N43 V44 W45 S51 | N43-R47 WeakPolarHBondContact O-CB 3.39Å; N43-R47 VanDerWaalsContact O-CG 3.25Å; N43-R47 WeakPolarHBondContact O-CG 3.33Å; N43-R47 PolarHBondContact O-N 3.23Å; V44-R47 PolarHBondContact O-N 3.18Å; W45-R47 VanDerWaalsContact C-N 3.29Å; W45-R47 PolarHBondContact O-N 3.15Å; R47-S51 PolarHBondContact O-N 2.95Å; R47-S51 PolarHBondContact O-OG 3.5Å; R47-S51 VanDerWaalsContact O-OG 3.12Å |
| 48 | F | 98 | Very high | 96.9 | Very high | 106 Ų | 106 | 93.7 Ų | 93.7 | 47% | 0.465 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -62.2 | -53.8 | 176.5 | 173.5 | -99.6 | 0 | 0 | 0 | 110.9 | V44 W45 A50 S51 F52 | V44-F48 WeakPolarHBondContact O-CB 3.39Å; V44-F48 PolarHBondContact O-N 2.91Å; W45-F48 HydrophobicContact CE3-CD1 4.02Å; W45-F48 HydrophobicContact CH2-CD1 4.39Å; W45-F48 HydrophobicContact CH2-CE1 4.41Å; W45-F48 AromaticContact CZ3-CD1 3.76Å; W45-F48 HydrophobicContact CZ3-CD1 3.76Å; W45-F48 AromaticContact CZ3-CE1 3.98Å; W45-F48 HydrophobicContact CZ3-CE1 3.98Å; W45-F48 WeakPolarHBondContact O-CB 3.44Å; W45-F48 PolarHBondContact O-N 3.25Å; F48-A50 VanDerWaalsContact C-N 3.29Å; F48-A50 PolarHBondContact O-N 3.31Å; F48-S51 PolarHBondContact O-N 3.46Å; F48-F52 HydrophobicContact CE1-CB 4.39Å; F48-F52 AromaticContact CE1-CD2 3.79Å; F48-F52 HydrophobicContact CE1-CD2 3.79Å; F48-F52 HydrophobicContact CE1-CE2 4.43Å; F48-F52 HydrophobicContact CE1-CG 4.29Å; F48-F52 HydrophobicContact CE2-CD2 4.03Å; F48-F52 AromaticContact CZ-CD2 3.35Å; F48-F52 HydrophobicContact CZ-CD2 3.35Å; F48-F52 AromaticContact CZ-CE2 3.88Å; F48-F52 HydrophobicContact CZ-CE2 3.88Å; F48-F52 HydrophobicContact CZ-CG 4.25Å; F48-F52 WeakPolarHBondContact O-CB 3.15Å; F48-F52 PolarHBondContact O-N 2.93Å |
| 49 | T | 97.1 | Very high | 97.1 | Very high | 52 Ų | 52 | 96.5 Ų | 96.5 | 32% | 0.319 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -61.9 | -36.2 | -178.1 | 55.8 | 0 | 0 | 0 | 0 | 112.6 | W45 R46 S51 | W45-T49 HydrophobicContact CD2-CG2 3.95Å; W45-T49 HydrophobicContact CE3-CG2 4.47Å; W45-T49 HydrophobicContact CG-CG2 4.42Å; W45-T49 HydrophobicContact CH2-CG2 4.24Å; W45-T49 HydrophobicContact CZ2-CG2 3.68Å; W45-T49 WeakPolarHBondContact O-CG2 3.26Å; W45-T49 PolarHBondContact O-N 3.17Å; W45-T49 PolarHBondContact O-OG1 2.95Å; R46-T49 PolarHBondContact O-OG1 3.18Å; T49-S51 PolarHBondContact O-N 2.87Å |
| 50 | A | 97.4 | Very high | 97.3 | Very high | 59 Ų | 59 | 94.7 Ų | 94.7 | 49% | 0.488 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -64 | -23.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | R46 F48 | R46-A50 WeakPolarHBondContact O-CB 3.23Å; R46-A50 PolarHBondContact O-N 3.44Å; F48-A50 VanDerWaalsContact C-N 3.29Å; F48-A50 PolarHBondContact O-N 3.31Å |
| 51 | S | 96.6 | Very high | 97.4 | Very high | 63 Ų | 63 | 98.3 Ų | 98.3 | 44% | 0.441 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -106.5 | -23.6 | -177.9 | -50.1 | 0 | 0 | 0 | 0 | 112.7 | R47 F48 T49 F53 K54 V55 | R47-S51 PolarHBondContact O-N 2.95Å; R47-S51 PolarHBondContact O-OG 3.5Å; R47-S51 VanDerWaalsContact O-OG 3.12Å; F48-S51 PolarHBondContact O-N 3.46Å; T49-S51 PolarHBondContact O-N 2.87Å; S51-F53 PolarHBondContact O-N 3.14Å; S51-K54 WeakPolarHBondContact O-CB 3.49Å; S51-K54 PolarHBondContact O-N 2.95Å; S51-V55 PolarHBondContact O-N 3.14Å |
| 52 | F | 97.3 | Very high | 97.5 | Very high | 84 Ų | 84 | 98.7 Ų | 98.7 | 37% | 0.368 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -53 | -50.9 | -173 | -177.2 | -98.9 | 0 | 0 | 0 | 112.6 | F48 K54 V55 A56 | F48-F52 HydrophobicContact CE1-CB 4.39Å; F48-F52 AromaticContact CE1-CD2 3.79Å; F48-F52 HydrophobicContact CE1-CD2 3.79Å; F48-F52 HydrophobicContact CE1-CE2 4.43Å; F48-F52 HydrophobicContact CE1-CG 4.29Å; F48-F52 HydrophobicContact CE2-CD2 4.03Å; F48-F52 AromaticContact CZ-CD2 3.35Å; F48-F52 HydrophobicContact CZ-CD2 3.35Å; F48-F52 AromaticContact CZ-CE2 3.88Å; F48-F52 HydrophobicContact CZ-CE2 3.88Å; F48-F52 HydrophobicContact CZ-CG 4.25Å; F48-F52 WeakPolarHBondContact O-CB 3.15Å; F48-F52 PolarHBondContact O-N 2.93Å; F52-K54 PolarHBondContact O-N 3.28Å; F52-V55 PolarHBondContact O-N 3.15Å; F52-A56 HydrophobicContact CD1-CB 4.24Å; F52-A56 HydrophobicContact CD2-CB 4.04Å; F52-A56 HydrophobicContact CE1-CB 3.97Å; F52-A56 HydrophobicContact CE2-CB 3.78Å; F52-A56 HydrophobicContact CG-CB 4.27Å; F52-A56 HydrophobicContact CZ-CB 3.74Å; F52-A56 WeakPolarHBondContact O-CB 3.45Å; F52-A56 PolarHBondContact O-N 3.01Å |
| 53 | F | 96.1 | Very high | 97.6 | Very high | 158 Ų | 158 | 102.8 Ų | 102.8 | 69% | 0.693 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -72.1 | -11.5 | -178.5 | -66.3 | -72.4 | 0 | 0 | 0 | 114.7 | S51 P57 | S51-F53 PolarHBondContact O-N 3.14Å; F53-P57 VanDerWaalsContact O-CD 3.25Å; F53-P57 WeakPolarHBondContact O-CD 3.43Å; F53-P57 VanDerWaalsContact O-CG 3.26Å; F53-P57 WeakPolarHBondContact O-CG 3.33Å |
| 54 | K | 96.9 | Very high | 97.7 | Very high | 169 Ų | 169 | 104 Ų | 104 | 74% | 0.735 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -87 | -33.3 | 173.5 | -62.9 | 177.3 | -178.5 | 173.2 | 0 | 111.5 | S51 F52 | S51-K54 WeakPolarHBondContact O-CB 3.49Å; S51-K54 PolarHBondContact O-N 2.95Å; F52-K54 PolarHBondContact O-N 3.28Å |
| 55 | V | 97.7 | Very high | 97.7 | Very high | 88 Ų | 88 | 104.2 Ų | 104.2 | 53% | 0.533 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -100.9 | -42.1 | -172.6 | -178.4 | 0 | 0 | 0 | 0 | 112.3 | S51 F52 P58 M59 | S51-V55 PolarHBondContact O-N 3.14Å; F52-V55 PolarHBondContact O-N 3.15Å; V55-P58 WeakPolarHBondContact O-CD 3.27Å; V55-P58 WeakPolarHBondContact O-CG 3.45Å; V55-M59 HydrophobicContact CG1-CG 4.32Å; V55-M59 VanDerWaalsContact O-CG 3.23Å; V55-M59 WeakPolarHBondContact O-CG 3.4Å |
| 56 | A | 98 | Very high | 97.7 | Very high | 15 Ų | 15 | 103.6 Ų | 103.6 | 12% | 0.124 | 51% | 0.51 | C | S | . | . | H | α-helix | trans | -65.7 | -43.1 | -173.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | F52 M59 I60 | F52-A56 HydrophobicContact CD1-CB 4.24Å; F52-A56 HydrophobicContact CD2-CB 4.04Å; F52-A56 HydrophobicContact CE1-CB 3.97Å; F52-A56 HydrophobicContact CE2-CB 3.78Å; F52-A56 HydrophobicContact CG-CB 4.27Å; F52-A56 HydrophobicContact CZ-CB 3.74Å; F52-A56 WeakPolarHBondContact O-CB 3.45Å; F52-A56 PolarHBondContact O-N 3.01Å; A56-M59 PolarHBondContact O-N 2.96Å; A56-I60 HydrophobicContact CB-CD1 4.21Å; A56-I60 WeakPolarHBondContact O-CB 3.49Å; A56-I60 VanDerWaalsContact O-CG1 3.25Å; A56-I60 WeakPolarHBondContact O-CG1 3.35Å; A56-I60 PolarHBondContact O-N 3.4Å |
| 57 | P | 97.9 | Very high | 97.8 | Very high | 64 Ų | 64 | 99 Ų | 99 | 42% | 0.416 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -58.3 | -50.7 | -176.9 | -26 | 36.1 | 0 | 0 | 0 | 115.2 | F53 M59 I60 L61 | F53-P57 VanDerWaalsContact O-CD 3.25Å; F53-P57 WeakPolarHBondContact O-CD 3.43Å; F53-P57 VanDerWaalsContact O-CG 3.26Å; F53-P57 WeakPolarHBondContact O-CG 3.33Å; P57-M59 VanDerWaalsContact C-N 3.31Å; P57-M59 PolarHBondContact O-N 2.89Å; P57-I60 PolarHBondContact O-N 3.37Å; P57-L61 WeakPolarHBondContact O-CB 3.49Å; P57-L61 PolarHBondContact O-N 3.4Å |
| 58 | P | 97.8 | Very high | 97.8 | Very high | 69 Ų | 69 | 98.9 Ų | 98.9 | 45% | 0.448 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -65.7 | -33.9 | 178.1 | 25.3 | -34 | 0 | 0 | 0 | 112.6 | V55 T62 | V55-P58 WeakPolarHBondContact O-CD 3.27Å; V55-P58 WeakPolarHBondContact O-CG 3.45Å; P58-T62 WeakPolarHBondContact O-CB 3.25Å; P58-T62 PolarHBondContact O-N 3.04Å; P58-T62 PolarHBondContact O-OG1 3.38Å |
| 59 | M | 98.1 | Very high | 97.8 | Very high | 131 Ų | 131 | 95.2 Ų | 95.2 | 65% | 0.645 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -64.5 | -46.6 | 176.2 | -69.5 | -66.6 | -67.3 | 0 | 0 | 111.9 | V55 A56 P57 T62 Y63 | V55-M59 HydrophobicContact CG1-CG 4.32Å; V55-M59 VanDerWaalsContact O-CG 3.23Å; V55-M59 WeakPolarHBondContact O-CG 3.4Å; A56-M59 PolarHBondContact O-N 2.96Å; P57-M59 VanDerWaalsContact C-N 3.31Å; P57-M59 PolarHBondContact O-N 2.89Å; M59-T62 PolarHBondContact O-N 2.97Å; M59-Y63 PolarHBondContact O-N 2.88Å |
| 60 | I | 98.3 | Very high | 97.9 | Very high | 95 Ų | 95 | 96.2 Ų | 96.2 | 49% | 0.487 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.9 | -46.9 | 177.5 | -67.5 | 164.5 | 0 | 0 | 0 | 109.8 | A56 P57 T62 Y63 L64 | A56-I60 HydrophobicContact CB-CD1 4.21Å; A56-I60 WeakPolarHBondContact O-CB 3.49Å; A56-I60 VanDerWaalsContact O-CG1 3.25Å; A56-I60 WeakPolarHBondContact O-CG1 3.35Å; A56-I60 PolarHBondContact O-N 3.4Å; P57-I60 PolarHBondContact O-N 3.37Å; I60-T62 VanDerWaalsContact C-N 3.3Å; I60-T62 PolarHBondContact O-N 2.95Å; I60-Y63 WeakPolarHBondContact O-CB 3.36Å; I60-Y63 PolarHBondContact O-N 3.01Å; I60-Y63 VanDerWaalsContact O-N 3.17Å; I60-L64 HydrophobicContact CG2-CD1 4.13Å; I60-L64 HydrophobicContact CG2-CG 4.37Å; I60-L64 WeakPolarHBondContact O-CG 3.4Å; I60-L64 PolarHBondContact O-N 3.36Å |
| 61 | L | 98.4 | Very high | 97.9 | Very high | 103 Ų | 103 | 98.6 Ų | 98.6 | 54% | 0.539 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -58 | -44.7 | 179.1 | -178.7 | 61.9 | 0 | 0 | 0 | 111.7 | P57 Y63 L64 I65 | P57-L61 WeakPolarHBondContact O-CB 3.49Å; P57-L61 PolarHBondContact O-N 3.4Å; L61-Y63 VanDerWaalsContact C-N 3.33Å; L61-Y63 PolarHBondContact O-N 3.25Å; L61-L64 PolarHBondContact O-N 3.44Å; L61-I65 HydrophobicContact CD1-CD1 4.27Å; L61-I65 HydrophobicContact CG-CD1 4.04Å; L61-I65 WeakPolarHBondContact O-CG1 3.19Å; L61-I65 PolarHBondContact O-N 3.34Å |
| 62 | T | 98.4 | Very high | 97.9 | Very high | 93 Ų | 93 | 98.4 Ų | 98.4 | 57% | 0.571 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -61.2 | -43.5 | 177.9 | -57 | 0 | 0 | 0 | 0 | 111.3 | P58 M59 I60 L64 I65 Y66 | P58-T62 WeakPolarHBondContact O-CB 3.25Å; P58-T62 PolarHBondContact O-N 3.04Å; P58-T62 PolarHBondContact O-OG1 3.38Å; M59-T62 PolarHBondContact O-N 2.97Å; I60-T62 VanDerWaalsContact C-N 3.3Å; I60-T62 PolarHBondContact O-N 2.95Å; T62-L64 VanDerWaalsContact C-N 3.35Å; T62-L64 PolarHBondContact O-N 3.17Å; T62-I65 PolarHBondContact O-N 3.49Å; T62-Y66 WeakPolarHBondContact O-CB 3.39Å; T62-Y66 PolarHBondContact O-N 2.96Å |
| 63 | Y | 98.4 | Very high | 97.9 | Very high | 153 Ų | 153 | 99.6 Ų | 99.6 | 60% | 0.6 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -62.9 | -40.3 | 177.2 | 178.2 | -104.4 | 0 | 0 | 0 | 112.6 | M59 I60 L61 Y66 S67 | M59-Y63 PolarHBondContact O-N 2.88Å; I60-Y63 WeakPolarHBondContact O-CB 3.36Å; I60-Y63 PolarHBondContact O-N 3.01Å; I60-Y63 VanDerWaalsContact O-N 3.17Å; L61-Y63 VanDerWaalsContact C-N 3.33Å; L61-Y63 PolarHBondContact O-N 3.25Å; Y63-Y66 PolarHBondContact O-N 3.34Å; Y63-S67 WeakPolarHBondContact O-CB 3.49Å; Y63-S67 PolarHBondContact O-N 2.94Å |
| 64 | L | 98.6 | Very high | 98 | Very high | 100 Ų | 100 | 96.8 Ų | 96.8 | 52% | 0.524 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -63.3 | -46.2 | 176.2 | -67.2 | 175.5 | 0 | 0 | 0 | 111.6 | I60 L61 T62 Y66 S67 W68 | I60-L64 HydrophobicContact CG2-CD1 4.13Å; I60-L64 HydrophobicContact CG2-CG 4.37Å; I60-L64 WeakPolarHBondContact O-CG 3.4Å; I60-L64 PolarHBondContact O-N 3.36Å; L61-L64 PolarHBondContact O-N 3.44Å; T62-L64 VanDerWaalsContact C-N 3.35Å; T62-L64 PolarHBondContact O-N 3.17Å; L64-Y66 VanDerWaalsContact C-N 3.33Å; L64-Y66 PolarHBondContact O-N 3.43Å; L64-S67 PolarHBondContact O-N 3.46Å; L64-W68 WeakPolarHBondContact O-CB 3.46Å; L64-W68 PolarHBondContact O-N 3.49Å |
| 65 | I | 98.4 | Very high | 97.8 | Very high | 102 Ų | 102 | 94.1 Ų | 94.1 | 52% | 0.523 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -60.8 | -44.2 | 177.3 | -67 | 166.6 | 0 | 0 | 0 | 110.6 | L61 T62 W68 G69 | L61-I65 HydrophobicContact CD1-CD1 4.27Å; L61-I65 HydrophobicContact CG-CD1 4.04Å; L61-I65 WeakPolarHBondContact O-CG1 3.19Å; L61-I65 PolarHBondContact O-N 3.34Å; T62-I65 PolarHBondContact O-N 3.49Å; I65-W68 PolarHBondContact O-N 3.09Å; I65-G69 PolarHBondContact O-N 2.94Å |
| 66 | Y | 98.4 | Very high | 97.6 | Very high | 151 Ų | 151 | 93.1 Ų | 93.1 | 59% | 0.592 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -59.3 | -49.2 | 177 | 169.9 | -100.9 | 0 | 0 | 0 | 112.2 | T62 Y63 L64 G69 N70 | T62-Y66 WeakPolarHBondContact O-CB 3.39Å; T62-Y66 PolarHBondContact O-N 2.96Å; Y63-Y66 PolarHBondContact O-N 3.34Å; L64-Y66 VanDerWaalsContact C-N 3.33Å; L64-Y66 PolarHBondContact O-N 3.43Å; Y66-G69 PolarHBondContact O-N 3.38Å; Y66-N70 WeakPolarHBondContact CE1-ND2 3Å; Y66-N70 WeakPolarHBondContact CE2-ND2 3.22Å; Y66-N70 PolarHBondContact O-N 3.47Å; Y66-N70 VanDerWaalsContact O-N 3.09Å; Y66-N70 PolarHBondContact O-ND2 3.41Å; Y66-N70 PolarHBondContact OH-ND2 2.98Å |
| 67 | S | 98.3 | Very high | 97.4 | Very high | 50 Ų | 50 | 98.2 Ų | 98.2 | 35% | 0.35 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.1 | -45.9 | -179.9 | -175.1 | 0 | 0 | 0 | 0 | 111.8 | Y63 L64 N70 M71 | Y63-S67 WeakPolarHBondContact O-CB 3.49Å; Y63-S67 PolarHBondContact O-N 2.94Å; L64-S67 PolarHBondContact O-N 3.46Å; S67-N70 PolarHBondContact O-N 3.04Å; S67-M71 WeakPolarHBondContact O-CB 3.41Å; S67-M71 PolarHBondContact O-N 3.34Å |
| 68 | W | 98.3 | Very high | 97.2 | Very high | 172 Ų | 172 | 102.6 Ų | 102.6 | 65% | 0.652 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -60.9 | -48.7 | 176.4 | 173.1 | 79.3 | 0 | 0 | 0 | 111.8 | L64 I65 N70 M71 T72 | L64-W68 WeakPolarHBondContact O-CB 3.46Å; L64-W68 PolarHBondContact O-N 3.49Å; I65-W68 PolarHBondContact O-N 3.09Å; W68-N70 VanDerWaalsContact C-N 3.32Å; W68-N70 PolarHBondContact O-N 2.79Å; W68-M71 PolarHBondContact O-N 3.34Å; W68-M71 VanDerWaalsContact O-N 3.12Å; W68-T72 PolarHBondContact NE1-OG1 3.36Å; W68-T72 PolarHBondContact O-N 3.35Å; W68-T72 PolarHBondContact O-OG1 3.42Å |
| 69 | G | 98.2 | Very high | 96.8 | Very high | 28 Ų | 28 | 107.2 Ų | 107.2 | 29% | 0.289 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -58.5 | -43.4 | -178.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | I65 Y66 H73 | I65-G69 PolarHBondContact O-N 2.94Å; Y66-G69 PolarHBondContact O-N 3.38Å; G69-H73 WeakPolarHBondContact O-CB 3.45Å; G69-H73 PolarHBondContact O-N 2.86Å |
| 70 | N | 98 | Very high | 96.4 | Very high | 73 Ų | 73 | 104.7 Ų | 104.7 | 39% | 0.39 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -64.6 | -44 | 175.6 | -71.3 | -22.8 | 0 | 0 | 0 | 112.2 | Y66 S67 W68 H73 E74 | Y66-N70 WeakPolarHBondContact CE1-ND2 3Å; Y66-N70 WeakPolarHBondContact CE2-ND2 3.22Å; Y66-N70 PolarHBondContact O-N 3.47Å; Y66-N70 VanDerWaalsContact O-N 3.09Å; Y66-N70 PolarHBondContact O-ND2 3.41Å; Y66-N70 PolarHBondContact OH-ND2 2.98Å; S67-N70 PolarHBondContact O-N 3.04Å; W68-N70 VanDerWaalsContact C-N 3.32Å; W68-N70 PolarHBondContact O-N 2.79Å; N70-H73 PolarHBondContact O-N 2.93Å; N70-E74 WeakPolarHBondContact O-CG 3.48Å; N70-E74 PolarHBondContact O-N 3.41Å |
| 71 | M | 97.8 | Very high | 95.9 | Very high | 110 Ų | 110 | 105.4 Ų | 105.4 | 54% | 0.542 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -63.6 | -46.7 | 179.7 | -174 | 179.9 | -62.4 | 0 | 0 | 111.8 | S67 W68 E74 Q75 | S67-M71 WeakPolarHBondContact O-CB 3.41Å; S67-M71 PolarHBondContact O-N 3.34Å; W68-M71 PolarHBondContact O-N 3.34Å; W68-M71 VanDerWaalsContact O-N 3.12Å; M71-E74 PolarHBondContact O-N 3.38Å; M71-Q75 WeakPolarHBondContact O-CB 3.35Å; M71-Q75 VanDerWaalsContact O-CG 3.26Å; M71-Q75 WeakPolarHBondContact O-CG 3.26Å; M71-Q75 PolarHBondContact O-N 3.22Å |
| 72 | T | 97.3 | Very high | 95.5 | Very high | 58 Ų | 58 | 103.8 Ų | 103.8 | 36% | 0.356 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -66 | -39 | 178.2 | -60.3 | 0 | 0 | 0 | 0 | 111.5 | W68 Q75 G76 | W68-T72 PolarHBondContact NE1-OG1 3.36Å; W68-T72 PolarHBondContact O-N 3.35Å; W68-T72 PolarHBondContact O-OG1 3.42Å; T72-Q75 PolarHBondContact O-N 2.86Å; T72-G76 PolarHBondContact O-N 3.05Å |
| 73 | H | 97 | Very high | 94.9 | Very high | 110 Ų | 110 | 104.5 Ų | 104.5 | 51% | 0.509 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -62.2 | -45.2 | 175.9 | -177.6 | 63.4 | 0 | 0 | 0 | 112 | G69 N70 G76 K77 | G69-H73 WeakPolarHBondContact O-CB 3.45Å; G69-H73 PolarHBondContact O-N 2.86Å; N70-H73 PolarHBondContact O-N 2.93Å; H73-G76 PolarHBondContact O-N 2.93Å; H73-K77 PolarHBondContact CD2-NZ 3Å; H73-K77 VanDerWaalsContact CD2-NZ 3.34Å; H73-K77 WeakPolarHBondContact NE2-CE 3.44Å; H73-K77 PolarHBondContact NE2-NZ 3.03Å; H73-K77 PolarHBondContact O-N 3.5Å |
| 74 | E | 96.8 | Very high | 94.3 | Very high | 98 Ų | 98 | 103 Ų | 103 | 46% | 0.458 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -68.6 | -35 | 177 | -71.5 | -56 | 124.9 | 0 | 0 | 112.8 | N70 M71 K77 | N70-E74 WeakPolarHBondContact O-CG 3.48Å; N70-E74 PolarHBondContact O-N 3.41Å; M71-E74 PolarHBondContact O-N 3.38Å; E74-K77 PolarHBondContact O-N 3.24Å; E74-K77 IonicContact OE1-NZ 2.79Å; E74-K77 PolarHBondContact OE1-NZ 3.28Å |
| 75 | Q | 94.6 | Very high | 93.5 | Very high | 113 Ų | 113 | 101.7 Ų | 101.7 | 53% | 0.528 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -64.8 | -43 | 171.9 | -74.6 | 170.4 | -5.4 | 0 | 0 | 111.8 | M71 T72 K77 K78 | M71-Q75 WeakPolarHBondContact O-CB 3.35Å; M71-Q75 VanDerWaalsContact O-CG 3.26Å; M71-Q75 WeakPolarHBondContact O-CG 3.26Å; M71-Q75 PolarHBondContact O-N 3.22Å; T72-Q75 PolarHBondContact O-N 2.86Å; Q75-K77 PolarHBondContact O-N 2.88Å; Q75-K78 WeakPolarHBondContact O-CB 3.42Å; Q75-K78 PolarHBondContact O-N 3.12Å |
| 76 | G | 93.4 | Very high | 92.8 | Very high | 68 Ų | 68 | 104.5 Ų | 104.5 | 70% | 0.701 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -66.3 | -20.6 | 179.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | T72 H73 K78 | T72-G76 PolarHBondContact O-N 3.05Å; H73-G76 PolarHBondContact O-N 2.93Å; G76-K78 VanDerWaalsContact C-N 3.33Å |
| 77 | K | 94.1 | Very high | 91.5 | Very high | 122 Ų | 122 | 103.4 Ų | 103.4 | 53% | 0.53 | 55% | 0.552 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -76.7 | -20 | 171.8 | -72.1 | 175.9 | -173.9 | 162.4 | 0 | 113.3 | H73 E74 Q75 | H73-K77 PolarHBondContact CD2-NZ 3Å; H73-K77 VanDerWaalsContact CD2-NZ 3.34Å; H73-K77 WeakPolarHBondContact NE2-CE 3.44Å; H73-K77 PolarHBondContact NE2-NZ 3.03Å; H73-K77 PolarHBondContact O-N 3.5Å; E74-K77 PolarHBondContact O-N 3.24Å; E74-K77 IonicContact OE1-NZ 2.79Å; E74-K77 PolarHBondContact OE1-NZ 3.28Å; Q75-K77 PolarHBondContact O-N 2.88Å |
| 78 | K | 92.5 | Very high | 89.8 | Confident | 156 Ų | 156 | 113.7 Ų | 113.7 | 68% | 0.678 | 60% | 0.595 | S | S | * | * | S | Bend | trans | -77.8 | 134.4 | -178.4 | -63.4 | 179.8 | -175.9 | -176.9 | 0 | 109.2 | Q75 G76 | Q75-K78 WeakPolarHBondContact O-CB 3.42Å; Q75-K78 PolarHBondContact O-N 3.12Å; G76-K78 VanDerWaalsContact C-N 3.33Å |
| 79 | K | 90 | Very high | 89.4 | Confident | 166 Ų | 166 | 110.8 Ų | 110.8 | 72% | 0.722 | 59% | 0.592 | S | S | * | * | P | Polyproline II helix | trans | -62.7 | 135.4 | 173.2 | -63.9 | -173.3 | -179.7 | -174.2 | 0 | 109.6 | P81 Y84 | K79-P81 WeakPolarHBondContact O-CD 3.43Å; K79-Y84 HydrophobicContact CB-CE2 4.08Å; K79-Y84 HydrophobicContact CD-CE2 4.37Å |
| 80 | N | 90.1 | Very high | 88.9 | Confident | 78 Ų | 78 | 115.1 Ų | 115.1 | 42% | 0.417 | 61% | 0.608 | S | S | . | * | P | Polyproline II helix | trans | -84.4 | 117.2 | 172.9 | 177.9 | 23.9 | 0 | 0 | 0 | 109.4 | A82 D83 Y84 | N80-A82 PolarHBondContact O-N 2.81Å; N80-A82 PolarHBondContact OD1-N 3.4Å; N80-D83 WeakPolarHBondContact CB-OD2 3.4Å; N80-D83 PolarHBondContact ND2-OD1 3.15Å; N80-D83 PolarHBondContact O-N 3.36Å; N80-D83 VanDerWaalsContact O-N 3.15Å; N80-Y84 WeakPolarHBondContact O-CD2 3.42Å; N80-Y84 WeakPolarHBondContact O-CE2 3.46Å |
| 81 | P | 87.6 | Confident | 88.4 | Confident | 110 Ų | 110 | 117.4 Ų | 117.4 | 71% | 0.714 | 62% | 0.62 | S | S | * | * | G | 310 helix | trans | -60.1 | -27.4 | -179.9 | -24.1 | 34.8 | 0 | 0 | 0 | 113.7 | K79 D83 Y84 | K79-P81 WeakPolarHBondContact O-CD 3.43Å; P81-D83 PolarHBondContact O-N 3.35Å; P81-Y84 PolarHBondContact O-N 3.36Å |
| 82 | A | 88.8 | Confident | 87.9 | Confident | 68 Ų | 68 | 117.9 Ų | 117.9 | 56% | 0.562 | 63% | 0.625 | S | S | * | * | G | 310 helix | trans | -68.7 | -21.7 | 180 | 0 | 0 | 0 | 0 | 0 | 113.3 | N80 Y84 A85 | N80-A82 PolarHBondContact O-N 2.81Å; N80-A82 PolarHBondContact OD1-N 3.4Å; A82-Y84 PolarHBondContact O-N 3.18Å; A82-A85 PolarHBondContact O-N 3.44Å |
| 83 | D | 85.7 | Confident | 87.3 | Confident | 108 Ų | 108 | 121.6 Ų | 121.6 | 58% | 0.578 | 64% | 0.641 | S | S | * | * | G | 310 helix | trans | -73.3 | -19.2 | -180 | -62.1 | -9.5 | 0 | 0 | 0 | 112.1 | N80 P81 | N80-D83 WeakPolarHBondContact CB-OD2 3.4Å; N80-D83 PolarHBondContact ND2-OD1 3.15Å; N80-D83 PolarHBondContact O-N 3.36Å; N80-D83 VanDerWaalsContact O-N 3.15Å; P81-D83 PolarHBondContact O-N 3.35Å |
| 84 | Y | 85.6 | Confident | 86.7 | Confident | 122 Ų | 122 | 122.4 Ų | 122.4 | 48% | 0.478 | 65% | 0.65 | S | S | . | * | G | 310 helix | trans | -108 | 7.8 | -179.1 | -49.2 | -75 | 0 | 0 | 0 | 113 | K79 N80 P81 A82 N86 | K79-Y84 HydrophobicContact CB-CE2 4.08Å; K79-Y84 HydrophobicContact CD-CE2 4.37Å; N80-Y84 WeakPolarHBondContact O-CD2 3.42Å; N80-Y84 WeakPolarHBondContact O-CE2 3.46Å; P81-Y84 PolarHBondContact O-N 3.36Å; A82-Y84 PolarHBondContact O-N 3.18Å; Y84-N86 VanDerWaalsContact C-N 3.32Å; Y84-N86 PolarHBondContact O-N 3.5Å |
| 85 | A | 83.2 | Confident | 85.9 | Confident | 73 Ų | 73 | 124.1 Ų | 124.1 | 60% | 0.603 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74 | -21.1 | -173.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | A82 | A82-A85 PolarHBondContact O-N 3.44Š|
| 86 | N | 83.9 | Confident | 85.3 | Confident | 160 Ų | 160 | 125 Ų | 125 | 86% | 0.856 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -124.1 | 18.7 | -179.7 | -59.1 | -47.5 | 0 | 0 | 0 | 112.4 | Y84 | Y84-N86 VanDerWaalsContact C-N 3.32Å; Y84-N86 PolarHBondContact O-N 3.5Å |
| 87 | D | 71.1 | Confident | 84.6 | Confident | 128 Ų | 128 | 129.8 Ų | 129.8 | 68% | 0.684 | 67% | 0.672 | S | S | * | * | trans | -84.5 | 115.2 | 173.3 | -121.1 | -1.4 | 0 | 0 | 0 | 107.3 | ||||
| 88 | E | 62.6 | Low | 83.7 | Confident | 266 Ų | 266 | 130.5 Ų | 130.5 | 100% | 1.243 | 69% | 0.685 | S | S | * | * | trans | -84.8 | 0 | 171.3 | -76.5 | -166.6 | 162.5 | 0 | 0 | 112 |
Retrieved 88 of 88 residues in 41.2 ms
(Link to these results)