| 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 | 33.8 | Very low | 31.4 | Very low | 250 Ų | 250 | 171.3 Ų | 171.3 | 100% | 1.232 | 82% | 0.818 | S | S | * | * | 0 | 116.9 | 0 | -146.1 | 158.7 | -177.5 | 0 | 0 | 106.6 | |||||
| 2 | G | 35.3 | Very low | 31.1 | Very low | 75 Ų | 75 | 169.5 Ų | 169.5 | 77% | 0.773 | 81% | 0.808 | S | S | * | * | trans | 80.4 | 91.7 | 179.3 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 3 | D | 29.8 | Very low | 31 | Very low | 125 Ų | 125 | 165.9 Ų | 165.9 | 67% | 0.668 | 80% | 0.797 | S | S | * | * | 68.1 | 113.9 | 61.4 | -155.6 | 13.7 | 0 | 0 | 0 | 113.6 | |||||
| 4 | R | 33.8 | Very low | 30.9 | Very low | 235 Ų | 235 | 162.1 Ų | 162.1 | 89% | 0.887 | 80% | 0.796 | S | S | * | * | trans | -169.7 | 102.4 | 135.3 | -103.1 | 175.3 | -131.1 | -129.8 | 5.4 | 110.4 | ||||
| 5 | R | 31 | Very low | 31 | Very low | 197 Ų | 197 | 162.5 Ų | 162.5 | 74% | 0.743 | 80% | 0.803 | S | S | * | * | trans | -60 | 137.5 | 154.5 | -85.5 | 171.9 | -85.5 | -170.8 | -6.3 | 109.8 | ||||
| 6 | F | 32.1 | Very low | 31.1 | Very low | 183 Ų | 183 | 159.1 Ų | 159.1 | 80% | 0.803 | 80% | 0.8 | S | S | * | * | trans | -136.8 | 117.6 | 145.6 | -104.9 | -89.6 | 0 | 0 | 0 | 108 | ||||
| 7 | I | 30.9 | Very low | 31.4 | Very low | 137 Ų | 137 | 156.7 Ų | 156.7 | 70% | 0.703 | 80% | 0.802 | S | S | * | * | trans | -93.8 | 120.1 | 167.1 | -66.2 | 178.8 | 0 | 0 | 0 | 104.5 | F9 | I7-F9 HydrophobicContact CG2-CD2 4.47Š| ||
| 8 | D | 30 | Very low | 31.6 | Very low | 153 Ų | 153 | 157.2 Ų | 157.2 | 82% | 0.818 | 81% | 0.805 | S | S | * | * | trans | -119.8 | 124.3 | 162.6 | -99.5 | -29.5 | 0 | 0 | 0 | 108.9 | ||||
| 9 | F | 31.9 | Very low | 31.7 | Very low | 171 Ų | 171 | 161.3 Ų | 161.3 | 75% | 0.75 | 81% | 0.81 | S | S | * | * | trans | -110.6 | 112.8 | 173.1 | -122.6 | -84.3 | 0 | 0 | 0 | 106.4 | I7 | I7-F9 HydrophobicContact CG2-CD2 4.47Š| ||
| 10 | Q | 28.9 | Very low | 31.9 | Very low | 187 Ų | 187 | 159.5 Ų | 159.5 | 87% | 0.874 | 81% | 0.81 | S | S | * | * | trans | -142.5 | 134.6 | 158.3 | -85.6 | -58.6 | -75 | 0 | 0 | 111.6 | ||||
| 11 | F | 28.6 | Very low | 32 | Very low | 171 Ų | 171 | 163.8 Ų | 163.8 | 75% | 0.75 | 82% | 0.816 | S | S | * | * | trans | -68.2 | 152.6 | 175.6 | -114.2 | -114.7 | 0 | 0 | 0 | 112.1 | ||||
| 12 | Q | 26.7 | Very low | 32.2 | Very low | 150 Ų | 150 | 159.4 Ų | 159.4 | 70% | 0.701 | 80% | 0.797 | S | S | * | * | 147.5 | 117.1 | 120.8 | -157.5 | 89.9 | 19 | 0 | 0 | 112.1 | |||||
| 13 | D | 31 | Very low | 32.3 | Very low | 123 Ų | 123 | 158.9 Ų | 158.9 | 66% | 0.658 | 79% | 0.792 | S | S | * | * | trans | 25.6 | 131 | 148.1 | -53.2 | -39.9 | 0 | 0 | 0 | 121.6 | ||||
| 14 | S | 29 | Very low | 32.8 | Very low | 113 Ų | 113 | 160.3 Ų | 160.3 | 79% | 0.79 | 80% | 0.799 | S | S | * | * | 157 | 119.7 | 110.4 | -66.3 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 15 | N | 32.5 | Very low | 33.2 | Very low | 168 Ų | 168 | 153.4 Ų | 153.4 | 90% | 0.898 | 79% | 0.792 | S | S | * | * | trans | 29.2 | 109.9 | 150.8 | -78.6 | -17.8 | 0 | 0 | 0 | 120 | ||||
| 16 | S | 32.3 | Very low | 33.8 | Very low | 108 Ų | 108 | 150 Ų | 150 | 76% | 0.755 | 79% | 0.793 | S | S | * | * | trans | -148.5 | 129.1 | 133.4 | 58.5 | 0 | 0 | 0 | 0 | 111.5 | L18 | S16-L18 PolarHBondContact O-N 3.3Š| ||
| 17 | S | 36.8 | Very low | 34.6 | Very low | 118 Ų | 118 | 144.9 Ų | 144.9 | 83% | 0.825 | 79% | 0.785 | S | S | * | * | trans | -58.8 | 120.4 | 177.9 | 50.4 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 18 | L | 35.3 | Very low | 35.2 | Very low | 166 Ų | 166 | 144.6 Ų | 144.6 | 87% | 0.869 | 79% | 0.785 | S | S | * | * | trans | -126.1 | 118.1 | 155.8 | -99.3 | 99.1 | 0 | 0 | 0 | 110.6 | S16 | S16-L18 PolarHBondContact O-N 3.3Š| ||
| 19 | R | 32.8 | Very low | 36.4 | Very low | 235 Ų | 235 | 144.7 Ų | 144.7 | 89% | 0.887 | 79% | 0.785 | S | S | * | * | trans | -51.7 | 139.1 | 178.3 | -61.7 | 176.9 | -175.5 | -161 | 0.5 | 111.2 | R21 | R19-R21 PolarHBondContact O-N 3.02Š| ||
| 20 | P | 35.2 | Very low | 37.9 | Very low | 125 Ų | 125 | 140 Ų | 140 | 81% | 0.812 | 77% | 0.771 | S | S | * | * | trans | -68.3 | 129.5 | 166.3 | 20.5 | -15.6 | 0 | 0 | 0 | 108.6 | L22 | P20-L22 PolarHBondContact O-N 3.35Š| ||
| 21 | R | 34.9 | Very low | 40.2 | Very low | 249 Ų | 249 | 132.4 Ų | 132.4 | 94% | 0.94 | 74% | 0.738 | S | S | * | * | trans | -55 | 107.5 | 169.1 | -74.1 | -175.9 | 176.8 | -154.8 | -0.2 | 108 | R19 G23 | R19-R21 PolarHBondContact O-N 3.02Å; R21-G23 PolarHBondContact O-N 3.44Å | ||
| 22 | L | 37.5 | Very low | 42.5 | Very low | 159 Ų | 159 | 130.4 Ų | 130.4 | 83% | 0.832 | 73% | 0.734 | S | S | * | * | trans | -62.2 | 102.6 | 165.1 | -165.2 | 72.2 | 0 | 0 | 0 | 106 | P20 N24 | P20-L22 PolarHBondContact O-N 3.35Å; L22-N24 PolarHBondContact O-N 3.46Å; L22-N24 VanDerWaalsContact O-N 3.1Å | ||
| 23 | G | 37.4 | Very low | 45.1 | Very low | 64 Ų | 64 | 124.7 Ų | 124.7 | 66% | 0.66 | 71% | 0.709 | S | S | * | * | trans | -55 | 118.9 | 169.1 | 0 | 0 | 0 | 0 | 0 | 107.4 | R21 A25 | R21-G23 PolarHBondContact O-N 3.44Å; G23-A25 PolarHBondContact O-N 2.92Å | ||
| 24 | N | 40.3 | Very low | 47.6 | Very low | 155 Ų | 155 | 124.4 Ų | 124.4 | 83% | 0.829 | 71% | 0.708 | S | S | * | * | trans | -62.4 | 81.7 | 164.3 | -93.8 | -9.8 | 0 | 0 | 0 | 107.4 | L22 T26 | L22-N24 PolarHBondContact O-N 3.46Å; L22-N24 VanDerWaalsContact O-N 3.1Å; N24-T26 PolarHBondContact O-N 2.9Å | ||
| 25 | A | 43 | Very low | 50.1 | Low | 89 Ų | 89 | 122.2 Ų | 122.2 | 74% | 0.736 | 69% | 0.687 | S | S | * | * | trans | -69.8 | 92.7 | 153.1 | 0 | 0 | 0 | 0 | 0 | 105.1 | G23 A27 | G23-A25 PolarHBondContact O-N 2.92Å; A25-A27 PolarHBondContact O-N 3.25Å | ||
| 26 | T | 42.5 | Very low | 52.7 | Low | 125 Ų | 125 | 115.7 Ų | 115.7 | 77% | 0.767 | 66% | 0.655 | S | S | * | * | trans | -54.3 | 92.1 | 151.6 | 23.6 | 0 | 0 | 0 | 0 | 106 | N24 N28 | N24-T26 PolarHBondContact O-N 2.9Å; T26-N28 VanDerWaalsContact C-N 3.3Å; T26-N28 PolarHBondContact O-N 3.17Å | ||
| 27 | A | 48.8 | Very low | 55.5 | Low | 76 Ų | 76 | 113.9 Ų | 113.9 | 63% | 0.628 | 63% | 0.633 | S | S | * | * | trans | -56.8 | 104.5 | 165.2 | 0 | 0 | 0 | 0 | 0 | 105.1 | A25 N29 | A25-A27 PolarHBondContact O-N 3.25Å; A27-N29 PolarHBondContact O-N 2.98Å | ||
| 28 | N | 43.5 | Very low | 58.1 | Low | 132 Ų | 132 | 109.6 Ų | 109.6 | 71% | 0.706 | 60% | 0.6 | S | S | * | * | trans | -51.8 | 109.1 | 171.6 | -95.8 | -18.1 | 0 | 0 | 0 | 106.4 | T26 T30 | T26-N28 VanDerWaalsContact C-N 3.3Å; T26-N28 PolarHBondContact O-N 3.17Å; N28-T30 PolarHBondContact O-N 3.5Å | ||
| 29 | N | 55.9 | Low | 60.8 | Low | 154 Ų | 154 | 103.1 Ų | 103.1 | 82% | 0.824 | 56% | 0.564 | S | S | * | * | trans | -68.5 | 29 | -179.6 | -84 | -16.3 | 0 | 0 | 0 | 112.4 | A27 | A27-N29 PolarHBondContact O-N 2.98Š| ||
| 30 | T | 63.8 | Low | 63.7 | Low | 73 Ų | 73 | 96.5 Ų | 96.5 | 45% | 0.448 | 55% | 0.546 | S | S | . | . | trans | -96.5 | 113.2 | 178.7 | 57 | 0 | 0 | 0 | 0 | 108.8 | N28 I32 | N28-T30 PolarHBondContact O-N 3.5Å; T30-I32 HydrophobicContact CG2-CD1 4.48Å; T30-I32 PolarHBondContact O-N 2.84Å | ||
| 31 | C | 76.2 | Confident | 66.6 | Low | 27 Ų | 27 | 93.3 Ų | 93.3 | 18% | 0.182 | 52% | 0.522 | C | S | . | . | trans | -79.2 | 51.5 | 177.4 | -55.5 | 0 | 0 | 0 | 0 | 111.4 | C283 E286 K290 | C31-C283 WeakPolarHBondContact CA-SG 3.42Å; C31-C283 HydrophobicContact CB-CB 4.3Å; C31-C283 WeakPolarHBondContact CB-SG 3.13Å; C31-C283 WeakPolarHBondContact SG-CA 3.39Å; C31-C283 WeakPolarHBondContact SG-CB 3.08Å; C31-C283 CovalentContact SG-SG 2.04Å; C31-C283 PolarHBondContact SG-SG 2.97Å; C31-E286 HydrophobicContact CB-CG 4.45Å; C31-K290 PolarHBondContact O-NZ 2.79Å | ||
| 32 | I | 77.6 | Confident | 69.4 | Low | 129 Ų | 129 | 82 Ų | 82 | 66% | 0.662 | 48% | 0.48 | S | S | * | . | trans | -82.1 | 130.3 | 179 | -59.5 | 170 | 0 | 0 | 0 | 107.8 | T30 | T30-I32 HydrophobicContact CG2-CD1 4.48Å; T30-I32 PolarHBondContact O-N 2.84Å | ||
| 33 | V | 81.3 | Confident | 72.2 | Confident | 31 Ų | 31 | 74.4 Ų | 74.4 | 19% | 0.188 | 44% | 0.44 | C | S | . | . | trans | -128.3 | 130.6 | 173.2 | 179.6 | 0 | 0 | 0 | 0 | 105.9 | D35 R287 K290 I291 | V33-D35 PolarHBondContact O-N 2.91Å; V33-R287 HydrophobicContact CG2-CB 3.93Å; V33-R287 HydrophobicContact CG2-CG 3.54Å; V33-K290 HydrophobicContact CB-CD 4.35Å; V33-K290 HydrophobicContact CG2-CD 4.28Å; V33-I291 HydrophobicContact CG1-CD1 4.27Å; V33-I291 HydrophobicContact CG1-CG1 3.86Å | ||
| 34 | D | 82.1 | Confident | 75.1 | Confident | 117 Ų | 117 | 73.8 Ų | 73.8 | 63% | 0.626 | 43% | 0.429 | S | S | * | . | trans | -71.7 | 108.8 | 165.6 | 179.4 | 13.7 | 0 | 0 | 0 | 108.5 | S36 | D34-S36 VanDerWaalsContact CG-OG 3.31Å; D34-S36 WeakPolarHBondContact OD1-CB 3.49Å; D34-S36 PolarHBondContact OD1-N 3.26Å; D34-S36 PolarHBondContact OD1-OG 3.47Å; D34-S36 PolarHBondContact OD2-OG 3.27Å | ||
| 35 | D | 82.9 | Confident | 77.8 | Confident | 66 Ų | 66 | 67.8 Ų | 67.8 | 35% | 0.353 | 40% | 0.398 | S | S | . | . | trans | -98 | 10.6 | 179.6 | 71.1 | -23.8 | 0 | 0 | 0 | 112.3 | V33 F37 K38 | V33-D35 PolarHBondContact O-N 2.91Å; D35-F37 PolarHBondContact O-N 2.99Å; D35-F37 VanDerWaalsContact O-N 3.13Å; D35-K38 HydrophobicContact CB-CD 4.22Å; D35-K38 VanDerWaalsContact O-CB 3.3Å; D35-K38 WeakPolarHBondContact O-CB 3.49Å; D35-K38 VanDerWaalsContact O-CD 3.31Å; D35-K38 WeakPolarHBondContact O-CD 3.4Å; D35-K38 WeakPolarHBondContact O-CG 3.37Å; D35-K38 PolarHBondContact O-N 3.43Å; D35-K38 WeakPolarHBondContact OD2-CE 3.23Å; D35-K38 IonicContact OD2-NZ 2.72Å; D35-K38 PolarHBondContact OD2-NZ 3.14Å | ||
| 36 | S | 86.1 | Confident | 80.4 | Confident | 32 Ų | 32 | 64.2 Ų | 64.2 | 22% | 0.224 | 37% | 0.366 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -61.4 | -24.2 | -176.6 | 67.7 | 0 | 0 | 0 | 0 | 114 | D34 K38 Y39 | D34-S36 VanDerWaalsContact CG-OG 3.31Å; D34-S36 WeakPolarHBondContact OD1-CB 3.49Å; D34-S36 PolarHBondContact OD1-N 3.26Å; D34-S36 PolarHBondContact OD1-OG 3.47Å; D34-S36 PolarHBondContact OD2-OG 3.27Å; S36-K38 PolarHBondContact O-N 2.89Å; S36-Y39 WeakPolarHBondContact O-CD2 3.41Å; S36-Y39 PolarHBondContact O-N 3.48Å |
| 37 | F | 91.6 | Very high | 83 | Confident | 70 Ų | 70 | 59.9 Ų | 59.9 | 31% | 0.307 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -58.6 | -28.7 | 174.5 | 80.3 | -89.2 | 0 | 0 | 0 | 112.7 | D35 Y39 N40 L41 I291 P294 I295 | D35-F37 PolarHBondContact O-N 2.99Å; D35-F37 VanDerWaalsContact O-N 3.13Å; F37-Y39 PolarHBondContact O-N 3.05Å; F37-N40 PolarHBondContact O-N 3.06Å; F37-L41 HydrophobicContact CD2-CD2 4.36Å; F37-L41 HydrophobicContact CE2-CD2 4.08Å; F37-L41 WeakPolarHBondContact O-CB 3.3Å; F37-L41 PolarHBondContact O-N 3.19Å; F37-I291 HydrophobicContact CZ-CG2 4.33Å; F37-P294 HydrophobicContact CE2-CG 3.93Å; F37-P294 HydrophobicContact CZ-CG 3.65Å; F37-I295 HydrophobicContact CE2-CG1 4.29Å |
| 38 | K | 91.7 | Very high | 85.3 | Confident | 28 Ų | 28 | 59.7 Ų | 59.7 | 12% | 0.122 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -58.2 | -34.7 | -177.7 | 79.2 | -167.3 | 175.1 | -179.2 | 0 | 112 | D35 S36 N42 E190 P294 | D35-K38 HydrophobicContact CB-CD 4.22Å; D35-K38 VanDerWaalsContact O-CB 3.3Å; D35-K38 WeakPolarHBondContact O-CB 3.49Å; D35-K38 VanDerWaalsContact O-CD 3.31Å; D35-K38 WeakPolarHBondContact O-CD 3.4Å; D35-K38 WeakPolarHBondContact O-CG 3.37Å; D35-K38 PolarHBondContact O-N 3.43Å; D35-K38 WeakPolarHBondContact OD2-CE 3.23Å; D35-K38 IonicContact OD2-NZ 2.72Å; D35-K38 PolarHBondContact OD2-NZ 3.14Å; S36-K38 PolarHBondContact O-N 2.89Å; K38-N42 WeakPolarHBondContact O-CB 3.34Å; K38-N42 PolarHBondContact O-N 2.97Å; K38-N42 PolarHBondContact O-ND2 3.39Å; K38-N42 PolarHBondContact O-OD1 3.26Å; K38-E190 IonicContact NZ-OE2 3.99Å; K38-E190 PolarHBondContact NZ-OE2 2.95Å; K38-P294 HydrophobicContact CB-CB 3.66Å; K38-P294 HydrophobicContact CB-CG 3.94Å |
| 39 | Y | 91.7 | Very high | 87.8 | Confident | 30 Ų | 30 | 53.4 Ų | 53.4 | 12% | 0.118 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -65.5 | -49.6 | -177.8 | -68.4 | -65.1 | 0 | 0 | 0 | 111 | S36 F37 G43 Y98 N99 R102 E190 | S36-Y39 WeakPolarHBondContact O-CD2 3.41Å; S36-Y39 PolarHBondContact O-N 3.48Å; F37-Y39 PolarHBondContact O-N 3.05Å; Y39-G43 PolarHBondContact O-N 2.7Å; Y39-Y98 HydrophobicContact CE1-CE1 4.38Å; Y39-N99 WeakPolarHBondContact CB-O 3.3Å; Y39-N99 WeakPolarHBondContact O-CB 3.21Å; Y39-R102 HydrophobicContact CD1-CG 4.37Å; Y39-R102 HydrophobicContact CD2-CG 4.43Å; Y39-R102 HydrophobicContact CG-CG 4.23Å; Y39-E190 PolarHBondContact OH-OE2 3.42Å |
| 40 | N | 94.3 | Very high | 89.8 | Confident | 96 Ų | 96 | 48.9 Ų | 48.9 | 51% | 0.513 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -66.9 | -42.1 | 178.3 | -66.8 | -13.3 | 0 | 0 | 0 | 111.5 | F37 A44 | F37-N40 PolarHBondContact O-N 3.06Å; N40-A44 WeakPolarHBondContact O-CB 3.29Å; N40-A44 PolarHBondContact O-N 3.17Å |
| 41 | L | 95.3 | Very high | 91.4 | Very high | 57 Ų | 57 | 50 Ų | 50 | 30% | 0.298 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -60.4 | -54.7 | 177.7 | 176.3 | 64.4 | 0 | 0 | 0 | 111.6 | F37 G43 A44 V45 I295 | F37-L41 HydrophobicContact CD2-CD2 4.36Å; F37-L41 HydrophobicContact CE2-CD2 4.08Å; F37-L41 WeakPolarHBondContact O-CB 3.3Å; F37-L41 PolarHBondContact O-N 3.19Å; L41-G43 VanDerWaalsContact C-N 3.35Å; L41-G43 PolarHBondContact O-N 3.41Å; L41-A44 PolarHBondContact O-N 3.45Å; L41-V45 HydrophobicContact CD1-CG2 4.11Å; L41-V45 WeakPolarHBondContact O-CG2 3.48Å; L41-V45 PolarHBondContact O-N 3.21Å; L41-I295 HydrophobicContact CD2-CG1 3.86Å |
| 42 | N | 94.3 | Very high | 92.3 | Very high | 11 Ų | 11 | 52.6 Ų | 52.6 | 6% | 0.059 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -61.7 | -43.8 | -179.9 | -67.9 | -13.2 | 0 | 0 | 0 | 110.9 | K38 A44 V45 Y46 N99 C298 | K38-N42 WeakPolarHBondContact O-CB 3.34Å; K38-N42 PolarHBondContact O-N 2.97Å; K38-N42 PolarHBondContact O-ND2 3.39Å; K38-N42 PolarHBondContact O-OD1 3.26Å; N42-A44 PolarHBondContact O-N 3.31Å; N42-V45 PolarHBondContact O-N 3.06Å; N42-Y46 HydrophobicContact CB-CD2 4.29Å; N42-Y46 HydrophobicContact CB-CE2 3.97Å; N42-Y46 WeakPolarHBondContact O-CB 3.45Å; N42-Y46 WeakPolarHBondContact O-CD2 3.12Å; N42-Y46 PolarHBondContact O-N 3.41Å; N42-N99 HydrophobicContact CB-CB 4.49Å; N42-N99 VanDerWaalsContact CB-OD1 3.29Å; N42-N99 WeakPolarHBondContact CB-OD1 3.38Å; N42-N99 PolarHBondContact ND2-OD1 3.29Å; N42-C298 PolarHBondContact OD1-SG 3.42Å |
| 43 | G | 96.2 | Very high | 93.1 | Very high | 0 Ų | 0 | 46.5 Ų | 46.5 | 0% | 0 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -57.6 | -46.3 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y39 L41 S47 | Y39-G43 PolarHBondContact O-N 2.7Å; L41-G43 VanDerWaalsContact C-N 3.35Å; L41-G43 PolarHBondContact O-N 3.41Å; G43-S47 WeakPolarHBondContact O-CB 3.42Å; G43-S47 PolarHBondContact O-N 3.28Å; G43-S47 VanDerWaalsContact O-N 3.16Å; G43-S47 PolarHBondContact O-OG 3.46Å |
| 44 | A | 97.2 | Very high | 93.8 | Very high | 52 Ų | 52 | 47.7 Ų | 47.7 | 43% | 0.43 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -65.9 | -50.7 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | N40 L41 N42 S47 V48 | N40-A44 WeakPolarHBondContact O-CB 3.29Å; N40-A44 PolarHBondContact O-N 3.17Å; L41-A44 PolarHBondContact O-N 3.45Å; N42-A44 PolarHBondContact O-N 3.31Å; A44-S47 WeakPolarHBondContact O-CB 3.32Å; A44-S47 PolarHBondContact O-N 3.21Å; A44-V48 PolarHBondContact O-N 2.95Å |
| 45 | V | 97.2 | Very high | 94.4 | Very high | 28 Ų | 28 | 47 Ų | 47 | 17% | 0.17 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -64.9 | -44.9 | -178 | 175.1 | 0 | 0 | 0 | 0 | 111.2 | L41 N42 S47 V48 V49 C298 L302 | L41-V45 HydrophobicContact CD1-CG2 4.11Å; L41-V45 WeakPolarHBondContact O-CG2 3.48Å; L41-V45 PolarHBondContact O-N 3.21Å; N42-V45 PolarHBondContact O-N 3.06Å; V45-S47 PolarHBondContact O-N 3.43Å; V45-V48 PolarHBondContact O-N 2.82Å; V45-V48 VanDerWaalsContact O-N 3.12Å; V45-V49 HydrophobicContact CG1-CG2 4.05Å; V45-V49 WeakPolarHBondContact O-CG2 3.43Å; V45-V49 PolarHBondContact O-N 2.63Å; V45-C298 HydrophobicContact CB-CB 4.16Å; V45-C298 HydrophobicContact CG1-CB 3.88Å; V45-C298 HydrophobicContact CG2-CB 4.06Å; V45-L302 HydrophobicContact CG1-CD2 4.47Å; V45-L302 HydrophobicContact CG1-CG 4.49Å |
| 46 | Y | 97.3 | Very high | 94.7 | Very high | 14 Ų | 14 | 45.7 Ų | 45.7 | 6% | 0.055 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -62.8 | -32 | 177.8 | -66.4 | -11.9 | 0 | 0 | 0 | 112.3 | N42 F50 L92 K95 L297 T301 | N42-Y46 HydrophobicContact CB-CD2 4.29Å; N42-Y46 HydrophobicContact CB-CE2 3.97Å; N42-Y46 WeakPolarHBondContact O-CB 3.45Å; N42-Y46 WeakPolarHBondContact O-CD2 3.12Å; N42-Y46 PolarHBondContact O-N 3.41Å; Y46-F50 WeakPolarHBondContact O-CB 3.25Å; Y46-F50 PolarHBondContact O-N 3Å; Y46-L92 HydrophobicContact CD1-CD2 4.19Å; Y46-L92 HydrophobicContact CD2-CD2 4.27Å; Y46-L92 HydrophobicContact CG-CD2 3.93Å; Y46-K95 HydrophobicContact CD2-CB 3.94Å; Y46-K95 HydrophobicContact CE2-CB 4.16Å; Y46-L297 WeakPolarHBondContact OH-CD2 3.47Å; Y46-T301 HydrophobicContact CD1-CG2 4.45Å; Y46-T301 HydrophobicContact CE1-CG2 3.75Å |
| 47 | S | 97.8 | Very high | 95.1 | Very high | 34 Ų | 34 | 44.1 Ų | 44.1 | 24% | 0.238 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -64.7 | -43.6 | 173.7 | -58.8 | 0 | 0 | 0 | 0 | 111.7 | G43 A44 V45 F50 I51 I96 | G43-S47 WeakPolarHBondContact O-CB 3.42Å; G43-S47 PolarHBondContact O-N 3.28Å; G43-S47 VanDerWaalsContact O-N 3.16Å; G43-S47 PolarHBondContact O-OG 3.46Å; A44-S47 WeakPolarHBondContact O-CB 3.32Å; A44-S47 PolarHBondContact O-N 3.21Å; V45-S47 PolarHBondContact O-N 3.43Å; S47-F50 PolarHBondContact O-N 3.46Å; S47-I51 WeakPolarHBondContact O-CG1 3.2Å; S47-I51 PolarHBondContact O-N 3.19Å; S47-I51 VanDerWaalsContact O-N 3.14Å; S47-I96 WeakPolarHBondContact OG-CG2 3.4Å |
| 48 | V | 97.1 | Very high | 95.1 | Very high | 73 Ų | 73 | 43.3 Ų | 43.3 | 44% | 0.442 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -64.2 | -47.9 | 175.2 | 174.6 | 0 | 0 | 0 | 0 | 110.9 | A44 V45 F50 I51 L52 | A44-V48 PolarHBondContact O-N 2.95Å; V45-V48 PolarHBondContact O-N 2.82Å; V45-V48 VanDerWaalsContact O-N 3.12Å; V48-F50 VanDerWaalsContact C-N 3.27Å; V48-F50 PolarHBondContact O-N 3.03Å; V48-I51 PolarHBondContact O-N 2.92Å; V48-L52 HydrophobicContact CG1-CD1 3.7Å; V48-L52 HydrophobicContact CG1-CG 4.25Å; V48-L52 WeakPolarHBondContact O-CB 3.46Å; V48-L52 WeakPolarHBondContact O-CG 3.39Å; V48-L52 PolarHBondContact O-N 3.13Å |
| 49 | V | 96.9 | Very high | 95 | Very high | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -61.5 | -38 | 178.3 | 175.9 | 0 | 0 | 0 | 0 | 111 | V45 G53 V89 L92 T301 L302 C304 | V45-V49 HydrophobicContact CG1-CG2 4.05Å; V45-V49 WeakPolarHBondContact O-CG2 3.43Å; V45-V49 PolarHBondContact O-N 2.63Å; V49-G53 VanDerWaalsContact O-CA 3.25Å; V49-G53 WeakPolarHBondContact O-CA 3.4Å; V49-G53 PolarHBondContact O-N 2.74Å; V49-V89 HydrophobicContact CG1-CG2 4.35Å; V49-L92 HydrophobicContact CB-CD1 3.98Å; V49-L92 HydrophobicContact CG1-CD1 3.63Å; V49-T301 WeakPolarHBondContact CG1-O 3.33Å; V49-L302 HydrophobicContact CG2-CD2 3.82Å; V49-L302 HydrophobicContact CG2-CG 4.41Å; V49-C304 HydrophobicContact CG1-CB 4.34Å |
| 50 | F | 97.7 | Very high | 94.8 | Very high | 58 Ų | 58 | 43.7 Ų | 43.7 | 25% | 0.254 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -61.1 | -53.4 | 176.8 | 172.8 | -109.6 | 0 | 0 | 0 | 111.5 | Y46 S47 V48 L54 V89 L92 P93 I96 | Y46-F50 WeakPolarHBondContact O-CB 3.25Å; Y46-F50 PolarHBondContact O-N 3Å; S47-F50 PolarHBondContact O-N 3.46Å; V48-F50 VanDerWaalsContact C-N 3.27Å; V48-F50 PolarHBondContact O-N 3.03Å; F50-L54 HydrophobicContact CE2-CD2 4.03Å; F50-L54 HydrophobicContact CZ-CD2 3.92Å; F50-L54 WeakPolarHBondContact O-CB 3.33Å; F50-L54 PolarHBondContact O-N 3.13Å; F50-V89 HydrophobicContact CD2-CG1 3.77Å; F50-V89 WeakPolarHBondContact CD2-O 3.44Å; F50-V89 HydrophobicContact CE2-CG1 4.41Å; F50-L92 HydrophobicContact CB-CB 4.14Å; F50-L92 HydrophobicContact CB-CD1 4.14Å; F50-L92 HydrophobicContact CD2-CB 4.35Å; F50-P93 HydrophobicContact CD2-CG 3.85Å; F50-P93 HydrophobicContact CE1-CG 4.43Å; F50-P93 HydrophobicContact CE2-CG 3.49Å; F50-P93 VanDerWaalsContact CE2-CG 3.49Å; F50-P93 HydrophobicContact CG-CG 4.47Å; F50-P93 HydrophobicContact CZ-CG 3.81Å; F50-I96 HydrophobicContact CB-CD1 4.03Å; F50-I96 HydrophobicContact CG-CD1 4.47Å |
| 51 | I | 96.5 | Very high | 94.6 | Very high | 97 Ų | 97 | 41 Ų | 41 | 50% | 0.497 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -64 | -53.4 | -177.4 | -64.5 | 168.8 | 0 | 0 | 0 | 110.5 | S47 V48 I55 | S47-I51 WeakPolarHBondContact O-CG1 3.2Å; S47-I51 PolarHBondContact O-N 3.19Å; S47-I51 VanDerWaalsContact O-N 3.14Å; V48-I51 PolarHBondContact O-N 2.92Å; I51-I55 HydrophobicContact CG2-CD1 3.98Å; I51-I55 WeakPolarHBondContact O-CD1 3.36Å; I51-I55 VanDerWaalsContact O-CG1 3.24Å; I51-I55 WeakPolarHBondContact O-CG1 3.37Å; I51-I55 PolarHBondContact O-N 3.06Å |
| 52 | L | 95.6 | Very high | 94.2 | Very high | 82 Ų | 82 | 43.8 Ų | 43.8 | 43% | 0.429 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -66.5 | -52.6 | -176.5 | -65.3 | -178.1 | 0 | 0 | 0 | 110.8 | V48 L54 I55 T56 | V48-L52 HydrophobicContact CG1-CD1 3.7Å; V48-L52 HydrophobicContact CG1-CG 4.25Å; V48-L52 WeakPolarHBondContact O-CB 3.46Å; V48-L52 WeakPolarHBondContact O-CG 3.39Å; V48-L52 PolarHBondContact O-N 3.13Å; L52-L54 VanDerWaalsContact C-N 3.32Å; L52-L54 PolarHBondContact O-N 3.26Å; L52-I55 PolarHBondContact O-N 3.32Å; L52-T56 WeakPolarHBondContact O-CB 3.47Å; L52-T56 WeakPolarHBondContact O-CG2 3.24Å; L52-T56 PolarHBondContact O-N 3.5Å; L52-T56 PolarHBondContact O-OG1 3.12Å |
| 53 | G | 95.4 | Very high | 93.7 | Very high | 0 Ų | 0 | 43.5 Ų | 43.5 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -61.1 | -38.6 | -177.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | V49 N57 | V49-G53 VanDerWaalsContact O-CA 3.25Å; V49-G53 WeakPolarHBondContact O-CA 3.4Å; V49-G53 PolarHBondContact O-N 2.74Å; G53-N57 VanDerWaalsContact O-CB 3.22Å; G53-N57 WeakPolarHBondContact O-CB 3.26Å; G53-N57 PolarHBondContact O-N 2.67Å; G53-N57 PolarHBondContact O-ND2 3.01Å |
| 54 | L | 95.4 | Very high | 93.2 | Very high | 56 Ų | 56 | 43.6 Ų | 43.6 | 29% | 0.293 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -65.7 | -49.8 | 178.2 | -176.4 | 65.8 | 0 | 0 | 0 | 110.5 | F50 L52 S58 L86 V89 | F50-L54 HydrophobicContact CE2-CD2 4.03Å; F50-L54 HydrophobicContact CZ-CD2 3.92Å; F50-L54 WeakPolarHBondContact O-CB 3.33Å; F50-L54 PolarHBondContact O-N 3.13Å; L52-L54 VanDerWaalsContact C-N 3.32Å; L52-L54 PolarHBondContact O-N 3.26Å; L54-S58 WeakPolarHBondContact O-CB 3.22Å; L54-S58 PolarHBondContact O-N 3.36Å; L54-S58 PolarHBondContact O-OG 2.71Å; L54-L86 HydrophobicContact CD1-CD2 4.16Å; L54-V89 HydrophobicContact CB-CG1 3.82Å; L54-V89 HydrophobicContact CD1-CG1 4.49Å |
| 55 | I | 93.6 | Very high | 92.4 | Very high | 102 Ų | 102 | 44.3 Ų | 44.3 | 52% | 0.523 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -62 | -53.4 | -179.3 | -66.4 | 168.4 | 0 | 0 | 0 | 109.7 | I51 L52 V59 | I51-I55 HydrophobicContact CG2-CD1 3.98Å; I51-I55 WeakPolarHBondContact O-CD1 3.36Å; I51-I55 VanDerWaalsContact O-CG1 3.24Å; I51-I55 WeakPolarHBondContact O-CG1 3.37Å; I51-I55 PolarHBondContact O-N 3.06Å; L52-I55 PolarHBondContact O-N 3.32Å; I55-V59 WeakPolarHBondContact O-CB 3.31Å; I55-V59 VanDerWaalsContact O-CG2 3.26Å; I55-V59 WeakPolarHBondContact O-CG2 3.32Å; I55-V59 PolarHBondContact O-N 2.96Å |
| 56 | T | 90.8 | Very high | 91.6 | Very high | 39 Ų | 39 | 50.4 Ų | 50.4 | 24% | 0.239 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -71.1 | -41.3 | -169.9 | 60.3 | 0 | 0 | 0 | 0 | 112.6 | L52 S60 P308 | L52-T56 WeakPolarHBondContact O-CB 3.47Å; L52-T56 WeakPolarHBondContact O-CG2 3.24Å; L52-T56 PolarHBondContact O-N 3.5Å; L52-T56 PolarHBondContact O-OG1 3.12Å; T56-S60 VanDerWaalsContact O-CB 3.32Å; T56-S60 WeakPolarHBondContact O-CB 3.39Å; T56-S60 PolarHBondContact O-N 3.43Å; T56-S60 PolarHBondContact O-OG 2.84Å; T56-P308 HydrophobicContact CG2-CG 3.91Å; T56-P308 WeakPolarHBondContact OG1-CG 3.28Å |
| 57 | N | 93.1 | Very high | 90.3 | Very high | 0 Ų | 0 | 56.5 Ų | 56.5 | 0% | 0 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -76.1 | -31.5 | 179.7 | -65.6 | -65.4 | 0 | 0 | 0 | 112 | G53 S60 L61 D85 L86 C304 Y311 | G53-N57 VanDerWaalsContact O-CB 3.22Å; G53-N57 WeakPolarHBondContact O-CB 3.26Å; G53-N57 PolarHBondContact O-N 2.67Å; G53-N57 PolarHBondContact O-ND2 3.01Å; N57-S60 PolarHBondContact O-N 3.35Å; N57-L61 WeakPolarHBondContact O-CB 3.1Å; N57-L61 PolarHBondContact O-N 2.88Å; N57-D85 HydrophobicContact CB-CB 4.47Å; N57-L86 HydrophobicContact CB-CD1 4.28Å; N57-L86 HydrophobicContact CB-CD2 3.78Å; N57-L86 HydrophobicContact CB-CG 3.65Å; N57-C304 PolarHBondContact ND2-O 3.33Å; N57-Y311 PolarHBondContact OD1-OH 3.34Å |
| 58 | S | 92.4 | Very high | 89 | Confident | 52 Ų | 52 | 55.7 Ų | 55.7 | 36% | 0.364 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -65.7 | -46.1 | 174.2 | -61.6 | 0 | 0 | 0 | 0 | 111.4 | L54 S60 L61 F62 L86 | L54-S58 WeakPolarHBondContact O-CB 3.22Å; L54-S58 PolarHBondContact O-N 3.36Å; L54-S58 PolarHBondContact O-OG 2.71Å; S58-S60 VanDerWaalsContact C-N 3.29Å; S58-S60 PolarHBondContact O-N 2.87Å; S58-L61 PolarHBondContact O-N 3.43Å; S58-F62 WeakPolarHBondContact O-CB 3.37Å; S58-F62 PolarHBondContact O-N 3.41Å; S58-L86 WeakPolarHBondContact OG-CD2 3.46Å |
| 59 | V | 89.4 | Confident | 87.2 | Confident | 64 Ų | 64 | 59.9 Ų | 59.9 | 39% | 0.388 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -60.5 | -42.9 | 174.8 | 170.4 | 0 | 0 | 0 | 0 | 110.3 | I55 F62 V63 F322 | I55-V59 WeakPolarHBondContact O-CB 3.31Å; I55-V59 VanDerWaalsContact O-CG2 3.26Å; I55-V59 WeakPolarHBondContact O-CG2 3.32Å; I55-V59 PolarHBondContact O-N 2.96Å; V59-F62 PolarHBondContact O-N 2.91Å; V59-V63 VanDerWaalsContact O-CG2 3.32Å; V59-V63 WeakPolarHBondContact O-CG2 3.4Å; V59-V63 PolarHBondContact O-N 3.45Å; V59-F322 HydrophobicContact CG1-CZ 4.44Å |
| 60 | S | 88.4 | Confident | 85.5 | Confident | 2 Ų | 2 | 62.8 Ų | 62.8 | 1% | 0.014 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -63.4 | -49.2 | -179.8 | -58.9 | 0 | 0 | 0 | 0 | 111.9 | T56 N57 S58 F62 V63 F64 Y311 | T56-S60 VanDerWaalsContact O-CB 3.32Å; T56-S60 WeakPolarHBondContact O-CB 3.39Å; T56-S60 PolarHBondContact O-N 3.43Å; T56-S60 PolarHBondContact O-OG 2.84Å; N57-S60 PolarHBondContact O-N 3.35Å; S58-S60 VanDerWaalsContact C-N 3.29Å; S58-S60 PolarHBondContact O-N 2.87Å; S60-F62 VanDerWaalsContact C-N 3.33Å; S60-F62 PolarHBondContact O-N 2.86Å; S60-V63 PolarHBondContact O-N 2.99Å; S60-F64 WeakPolarHBondContact O-CD2 3.33Å; S60-F64 WeakPolarHBondContact O-CG 3.36Å; S60-F64 PolarHBondContact O-N 3.24Å; S60-Y311 VanDerWaalsContact OG-CD2 3.31Å; S60-Y311 WeakPolarHBondContact OG-CD2 3.17Å |
| 61 | L | 89.3 | Confident | 84 | Confident | 39 Ų | 39 | 68.2 Ų | 68.2 | 20% | 0.204 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -61.6 | -41.9 | 177.8 | -166 | 71.1 | 0 | 0 | 0 | 111.4 | N57 S58 V63 F64 C65 T79 A82 L86 | N57-L61 WeakPolarHBondContact O-CB 3.1Å; N57-L61 PolarHBondContact O-N 2.88Å; S58-L61 PolarHBondContact O-N 3.43Å; L61-V63 PolarHBondContact O-N 2.93Å; L61-F64 PolarHBondContact O-N 3.4Å; L61-C65 WeakPolarHBondContact O-CB 3.4Å; L61-C65 PolarHBondContact O-N 3.42Å; L61-C65 PolarHBondContact O-SG 3.28Å; L61-C65 VanDerWaalsContact O-SG 3.35Å; L61-T79 HydrophobicContact CD1-CG2 3.71Å; L61-A82 HydrophobicContact CD1-CB 4.43Å; L61-L86 HydrophobicContact CB-CD1 4.09Å; L61-L86 HydrophobicContact CD2-CD1 3.69Å; L61-L86 HydrophobicContact CG-CD1 4.48Å |
| 62 | F | 87.4 | Confident | 83.1 | Confident | 116 Ų | 116 | 65.4 Ų | 65.4 | 51% | 0.509 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -58.2 | -47.6 | 174.2 | 175.8 | -96.2 | 0 | 0 | 0 | 111.9 | S58 V59 S60 F64 F66 R67 | S58-F62 WeakPolarHBondContact O-CB 3.37Å; S58-F62 PolarHBondContact O-N 3.41Å; V59-F62 PolarHBondContact O-N 2.91Å; S60-F62 VanDerWaalsContact C-N 3.33Å; S60-F62 PolarHBondContact O-N 2.86Å; F62-F64 VanDerWaalsContact C-N 3.34Å; F62-F64 PolarHBondContact O-N 3.3Å; F62-F66 AromaticContact CD2-CD2 3.5Å; F62-F66 HydrophobicContact CD2-CD2 3.5Å; F62-F66 HydrophobicContact CD2-CE2 4.05Å; F62-F66 HydrophobicContact CD2-CG 4.28Å; F62-F66 HydrophobicContact CE2-CB 4.29Å; F62-F66 AromaticContact CE2-CD2 3.85Å; F62-F66 HydrophobicContact CE2-CD2 3.85Å; F62-F66 HydrophobicContact CE2-CG 4.21Å; F62-F66 HydrophobicContact CG-CD2 4.2Å; F62-F66 WeakPolarHBondContact O-CB 2.99Å; F62-F66 WeakPolarHBondContact O-CD2 3.33Å; F62-F66 PolarHBondContact O-N 3.37Å; F62-R67 HydrophobicContact CE1-CG 4.21Å |
| 63 | V | 84.1 | Confident | 82.5 | Confident | 6 Ų | 6 | 63.7 Ų | 63.7 | 4% | 0.036 | 31% | 0.308 | C | S | . | . | I | π-helix | trans | -62.8 | -42.2 | 177.5 | 172.5 | 0 | 0 | 0 | 0 | 110.8 | V59 S60 L61 R67 M68 F318 | V59-V63 VanDerWaalsContact O-CG2 3.32Å; V59-V63 WeakPolarHBondContact O-CG2 3.4Å; V59-V63 PolarHBondContact O-N 3.45Å; S60-V63 PolarHBondContact O-N 2.99Å; L61-V63 PolarHBondContact O-N 2.93Å; V63-R67 HydrophobicContact CG1-CB 4.26Å; V63-R67 CarbonylContact O-C 3.53Å; V63-R67 WeakPolarHBondContact O-CA 3.4Å; V63-R67 WeakPolarHBondContact O-CB 3.4Å; V63-R67 PolarHBondContact O-N 3.29Å; V63-M68 HydrophobicContact CG1-CG 4.12Å; V63-M68 HydrophobicContact CG1-SD 4.17Å; V63-M68 PolarHBondContact O-N 3.45Å; V63-F318 HydrophobicContact CB-CD2 4.19Å; V63-F318 HydrophobicContact CB-CE2 4.09Å; V63-F318 HydrophobicContact CG1-CD2 3.67Å; V63-F318 HydrophobicContact CG1-CE2 4.08Å; V63-F318 HydrophobicContact CG2-CE2 4.44Å |
| 64 | F | 84 | Confident | 82.1 | Confident | 1 Ų | 1 | 63.7 Ų | 63.7 | 0% | 0.004 | 31% | 0.308 | C | S | . | . | I | π-helix | trans | -68.7 | -39 | -179 | -59.3 | -27.6 | 0 | 0 | 0 | 113.7 | S60 L61 F62 M68 I78 Y311 L315 F318 | S60-F64 WeakPolarHBondContact O-CD2 3.33Å; S60-F64 WeakPolarHBondContact O-CG 3.36Å; S60-F64 PolarHBondContact O-N 3.24Å; L61-F64 PolarHBondContact O-N 3.4Å; F62-F64 VanDerWaalsContact C-N 3.34Å; F62-F64 PolarHBondContact O-N 3.3Å; F64-M68 HydrophobicContact CD1-CE 4.11Å; F64-M68 HydrophobicContact CD1-SD 3.73Å; F64-M68 HydrophobicContact CE1-SD 4.09Å; F64-I78 HydrophobicContact CD2-CG2 4.16Å; F64-I78 HydrophobicContact CE1-CG2 4.39Å; F64-I78 HydrophobicContact CE2-CG2 3.38Å; F64-I78 HydrophobicContact CZ-CG2 3.52Å; F64-Y311 AromaticContact CE2-CD2 3.91Å; F64-Y311 HydrophobicContact CE2-CD2 3.91Å; F64-Y311 HydrophobicContact CE2-CE2 4.04Å; F64-Y311 HydrophobicContact CE2-CG 4.17Å; F64-Y311 HydrophobicContact CZ-CD1 4.31Å; F64-Y311 AromaticContact CZ-CD2 3.7Å; F64-Y311 HydrophobicContact CZ-CD2 3.7Å; F64-Y311 HydrophobicContact CZ-CE2 4.31Å; F64-Y311 AromaticContact CZ-CG 3.7Å; F64-Y311 HydrophobicContact CZ-CG 3.7Å; F64-L315 HydrophobicContact CD1-CD1 4.06Å; F64-L315 HydrophobicContact CE1-CD1 3.33Å; F64-L315 HydrophobicContact CZ-CD1 3.72Å; F64-F318 HydrophobicContact CD1-CD2 4.2Å; F64-F318 HydrophobicContact CE1-CB 4.34Å; F64-F318 AromaticContact CE1-CD2 3.37Å; F64-F318 HydrophobicContact CE1-CD2 3.37Å; F64-F318 AromaticContact CE1-CE2 3.8Å; F64-F318 HydrophobicContact CE1-CE2 3.8Å; F64-F318 HydrophobicContact CE1-CG 4.03Å; F64-F318 AromaticContact CZ-CD2 3.96Å; F64-F318 HydrophobicContact CZ-CD2 3.96Å; F64-F318 HydrophobicContact CZ-CE2 4.01Å |
| 65 | C | 81.8 | Confident | 81.7 | Confident | 68 Ų | 68 | 61 Ų | 61 | 46% | 0.459 | 29% | 0.294 | S | S | . | . | I | π-helix | trans | -81.1 | -39.5 | -178.1 | -67 | 0 | 0 | 0 | 0 | 112.5 | L61 | L61-C65 WeakPolarHBondContact O-CB 3.4Å; L61-C65 PolarHBondContact O-N 3.42Å; L61-C65 PolarHBondContact O-SG 3.28Å; L61-C65 VanDerWaalsContact O-SG 3.35Å |
| 66 | F | 79.3 | Confident | 81.6 | Confident | 156 Ų | 156 | 57.2 Ų | 57.2 | 68% | 0.684 | 28% | 0.275 | S | S | * | . | I | π-helix | trans | -110.6 | -28.1 | -167.9 | -60.9 | -77.9 | 0 | 0 | 0 | 114.7 | F62 | F62-F66 AromaticContact CD2-CD2 3.5Å; F62-F66 HydrophobicContact CD2-CD2 3.5Å; F62-F66 HydrophobicContact CD2-CE2 4.05Å; F62-F66 HydrophobicContact CD2-CG 4.28Å; F62-F66 HydrophobicContact CE2-CB 4.29Å; F62-F66 AromaticContact CE2-CD2 3.85Å; F62-F66 HydrophobicContact CE2-CD2 3.85Å; F62-F66 HydrophobicContact CE2-CG 4.21Å; F62-F66 HydrophobicContact CG-CD2 4.2Å; F62-F66 WeakPolarHBondContact O-CB 2.99Å; F62-F66 WeakPolarHBondContact O-CD2 3.33Å; F62-F66 PolarHBondContact O-N 3.37Å |
| 67 | R | 70.9 | Confident | 81.7 | Confident | 141 Ų | 141 | 55.9 Ų | 55.9 | 53% | 0.532 | 27% | 0.265 | S | S | . | . | I | π-helix | trans | -104.7 | -31 | -175.7 | -57.6 | -69.3 | -83.7 | -178.1 | -10.1 | 112.2 | F62 V63 | F62-R67 HydrophobicContact CE1-CG 4.21Å; V63-R67 HydrophobicContact CG1-CB 4.26Å; V63-R67 CarbonylContact O-C 3.53Å; V63-R67 WeakPolarHBondContact O-CA 3.4Å; V63-R67 WeakPolarHBondContact O-CB 3.4Å; V63-R67 PolarHBondContact O-N 3.29Å |
| 68 | M | 70.1 | Confident | 81.6 | Confident | 17 Ų | 17 | 55.9 Ų | 55.9 | 8% | 0.084 | 27% | 0.265 | C | S | . | . | S | Bend | trans | -98.9 | 111.4 | 173.7 | -66 | -175.5 | 32 | 0 | 0 | 108.9 | V63 F64 M70 A75 L315 F318 | V63-M68 HydrophobicContact CG1-CG 4.12Å; V63-M68 HydrophobicContact CG1-SD 4.17Å; V63-M68 PolarHBondContact O-N 3.45Å; F64-M68 HydrophobicContact CD1-CE 4.11Å; F64-M68 HydrophobicContact CD1-SD 3.73Å; F64-M68 HydrophobicContact CE1-SD 4.09Å; M68-M70 PolarHBondContact O-N 3.37Å; M68-A75 HydrophobicContact CE-CB 4.49Å; M68-L315 HydrophobicContact CE-CD1 4.04Å; M68-L315 HydrophobicContact CE-CD2 4.28Å; M68-F318 HydrophobicContact SD-CB 4.24Å |
| 69 | K | 59.8 | Low | 81.6 | Confident | 161 Ų | 161 | 54.2 Ų | 54.2 | 70% | 0.7 | 25% | 0.253 | S | S | * | . | trans | -55.8 | 112.8 | 156.6 | -73.1 | -178.9 | 177.5 | -179.2 | 0 | 105.2 | R71 | K69-R71 HydrophobicContact CB-CG 4.05Å; K69-R71 WeakPolarHBondContact O-CA 3.41Å; K69-R71 VanDerWaalsContact O-CB 3.25Å; K69-R71 WeakPolarHBondContact O-CB 3.4Å; K69-R71 WeakPolarHBondContact O-CG 3.1Å; K69-R71 PolarHBondContact O-N 3.18Å | ||
| 70 | M | 61.6 | Low | 81.9 | Confident | 61 Ų | 61 | 52.5 Ų | 52.5 | 30% | 0.3 | 24% | 0.242 | S | C | . | . | trans | -56.6 | 78.3 | -175 | -65.9 | -146.4 | 77.9 | 0 | 0 | 111.5 | M68 A75 I76 T79 R152 | M68-M70 PolarHBondContact O-N 3.37Å; M70-A75 HydrophobicContact CE-CB 4.01Å; M70-A75 VanDerWaalsContact CE-O 3.29Å; M70-A75 WeakPolarHBondContact CE-O 3.43Å; M70-I76 HydrophobicContact CE-CG1 4.49Å; M70-T79 HydrophobicContact CE-CG2 4.1Å; M70-T79 WeakPolarHBondContact CE-OG1 3.17Å; M70-T79 HydrophobicContact SD-CG2 4.44Å; M70-R152 VanDerWaalsContact O-CZ 3.22Å; M70-R152 PolarHBondContact O-NE 2.96Å; M70-R152 PolarHBondContact O-NH1 3.41Å | ||
| 71 | R | 64.9 | Low | 82.1 | Confident | 172 Ų | 172 | 52.4 Ų | 52.4 | 65% | 0.649 | 24% | 0.241 | S | C | * | . | trans | -93 | -26.3 | -160.9 | -90.3 | 173.4 | 174.4 | 169.5 | -3.9 | 112.7 | K69 R152 | K69-R71 HydrophobicContact CB-CG 4.05Å; K69-R71 WeakPolarHBondContact O-CA 3.41Å; K69-R71 VanDerWaalsContact O-CB 3.25Å; K69-R71 WeakPolarHBondContact O-CB 3.4Å; K69-R71 WeakPolarHBondContact O-CG 3.1Å; K69-R71 PolarHBondContact O-N 3.18Å; R71-R152 VanDerWaalsContact CA-NH2 3.31Å; R71-R152 PolarHBondContact O-NE 2.7Å; R71-R152 PolarHBondContact O-NH2 3.25Å | ||
| 72 | S | 77 | Confident | 82.4 | Confident | 39 Ų | 39 | 50.6 Ų | 50.6 | 27% | 0.273 | 23% | 0.232 | S | C | . | . | S | Bend | trans | -106.1 | 150.6 | 178.9 | 63.1 | 0 | 0 | 0 | 0 | 112.6 | T74 A75 | S72-T74 VanDerWaalsContact C-N 3.34Å; S72-A75 WeakPolarHBondContact O-CB 3.44Å; S72-A75 PolarHBondContact O-N 2.95Å; S72-A75 WeakPolarHBondContact OG-CB 3.33Å; S72-A75 PolarHBondContact OG-N 2.93Å |
| 73 | E | 84.4 | Confident | 82.8 | Confident | 45 Ų | 45 | 48.3 Ų | 48.3 | 21% | 0.21 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -60.9 | -44.1 | 176 | -62.4 | 70.7 | -146.9 | 0 | 0 | 110.7 | A75 I76 R150 | E73-A75 PolarHBondContact O-N 2.92Å; E73-I76 WeakPolarHBondContact O-CB 3.44Å; E73-I76 PolarHBondContact O-N 2.87Å; E73-R150 HydrophobicContact CG-CB 4.39Å; E73-R150 VanDerWaalsContact CG-O 3.32Å; E73-R150 WeakPolarHBondContact CG-O 3.45Å |
| 74 | T | 85.9 | Confident | 83.4 | Confident | 1 Ų | 1 | 48 Ų | 48 | 1% | 0.006 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -59.8 | -31.6 | 177.1 | -32.7 | 0 | 0 | 0 | 0 | 112.8 | S72 I76 F77 I78 I132 D135 R136 T314 | S72-T74 VanDerWaalsContact C-N 3.34Å; T74-I76 PolarHBondContact O-N 3.26Å; T74-F77 PolarHBondContact O-N 3.06Å; T74-I78 HydrophobicContact CG2-CD1 4.21Å; T74-I78 PolarHBondContact O-N 3.35Å; T74-I78 VanDerWaalsContact O-N 3.12Å; T74-I132 HydrophobicContact CG2-CG1 4.27Å; T74-I132 HydrophobicContact CG2-CG2 3.96Å; T74-D135 PolarHBondContact OG1-OD2 3.4Å; T74-R136 PolarHBondContact OG1-NH2 3.42Å; T74-T314 HydrophobicContact CG2-CG2 3.7Å |
| 75 | A | 87.3 | Confident | 83.9 | Confident | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -65.7 | -27.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | M68 M70 S72 E73 T79 L315 | M68-A75 HydrophobicContact CE-CB 4.49Å; M70-A75 HydrophobicContact CE-CB 4.01Å; M70-A75 VanDerWaalsContact CE-O 3.29Å; M70-A75 WeakPolarHBondContact CE-O 3.43Å; S72-A75 WeakPolarHBondContact O-CB 3.44Å; S72-A75 PolarHBondContact O-N 2.95Å; S72-A75 WeakPolarHBondContact OG-CB 3.33Å; S72-A75 PolarHBondContact OG-N 2.93Å; E73-A75 PolarHBondContact O-N 2.92Å; A75-T79 VanDerWaalsContact O-CB 3.31Å; A75-T79 WeakPolarHBondContact O-CB 3.45Å; A75-T79 PolarHBondContact O-N 2.87Å; A75-T79 PolarHBondContact O-OG1 2.99Å; A75-L315 HydrophobicContact CB-CD2 4.04Å |
| 76 | I | 92 | Very high | 84.6 | Confident | 22 Ų | 22 | 45.7 Ų | 45.7 | 11% | 0.113 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -66.1 | -48.6 | 176.6 | -60.3 | 172.5 | 0 | 0 | 0 | 109.7 | M70 E73 T74 I78 T79 N80 R152 | M70-I76 HydrophobicContact CE-CG1 4.49Å; E73-I76 WeakPolarHBondContact O-CB 3.44Å; E73-I76 PolarHBondContact O-N 2.87Å; T74-I76 PolarHBondContact O-N 3.26Å; I76-I78 PolarHBondContact O-N 2.92Å; I76-T79 PolarHBondContact O-N 2.99Å; I76-N80 PolarHBondContact O-N 3.29Å; I76-N80 VanDerWaalsContact O-N 3.08Å; I76-N80 PolarHBondContact O-ND2 3.3Å; I76-R152 HydrophobicContact CD1-CB 3.78Å; I76-R152 HydrophobicContact CD1-CG 4.01Å |
| 77 | F | 93.3 | Very high | 85.4 | Confident | 10 Ų | 10 | 42.5 Ų | 42.5 | 4% | 0.044 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -61 | -44.2 | 176.7 | -59.9 | -56.4 | 0 | 0 | 0 | 111.9 | T74 T79 N80 L81 F128 C131 I132 D135 V158 C159 | T74-F77 PolarHBondContact O-N 3.06Å; F77-T79 VanDerWaalsContact C-N 3.33Å; F77-T79 PolarHBondContact O-N 3.19Å; F77-N80 PolarHBondContact O-N 3.36Å; F77-L81 WeakPolarHBondContact O-CB 3.01Å; F77-L81 PolarHBondContact O-N 3.41Å; F77-F128 HydrophobicContact CD1-CD1 4.42Å; F77-C131 HydrophobicContact CD1-CB 3.62Å; F77-C131 HydrophobicContact CD2-CB 4.22Å; F77-C131 HydrophobicContact CE1-CB 3.7Å; F77-C131 HydrophobicContact CE2-CB 4.28Å; F77-C131 HydrophobicContact CG-CB 3.92Å; F77-C131 HydrophobicContact CZ-CB 4.04Å; F77-I132 HydrophobicContact CB-CD1 4.27Å; F77-I132 HydrophobicContact CB-CG1 3.69Å; F77-I132 HydrophobicContact CG-CG1 4.46Å; F77-D135 HydrophobicContact CE2-CB 4.18Å; F77-V158 HydrophobicContact CE1-CB 4.13Å; F77-V158 HydrophobicContact CE1-CG1 3.87Å; F77-V158 HydrophobicContact CZ-CG1 4.4Å; F77-C159 WeakPolarHBondContact CD1-SG 3.36Å |
| 78 | I | 91.1 | Very high | 86.7 | Confident | 0 Ų | 0 | 36 Ų | 36 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -62.3 | -38.6 | 178 | -76.6 | 170.8 | 0 | 0 | 0 | 112.4 | F64 T74 I76 L81 A82 I132 Y311 T314 L315 | F64-I78 HydrophobicContact CD2-CG2 4.16Å; F64-I78 HydrophobicContact CE1-CG2 4.39Å; F64-I78 HydrophobicContact CE2-CG2 3.38Å; F64-I78 HydrophobicContact CZ-CG2 3.52Å; T74-I78 HydrophobicContact CG2-CD1 4.21Å; T74-I78 PolarHBondContact O-N 3.35Å; T74-I78 VanDerWaalsContact O-N 3.12Å; I76-I78 PolarHBondContact O-N 2.92Å; I78-L81 WeakPolarHBondContact O-CB 3.49Å; I78-L81 PolarHBondContact O-N 3.42Å; I78-A82 PolarHBondContact O-N 3.43Å; I78-I132 HydrophobicContact CG1-CD1 3.73Å; I78-I132 HydrophobicContact CG1-CG1 4.44Å; I78-Y311 HydrophobicContact CB-CD1 4.36Å; I78-Y311 HydrophobicContact CB-CE1 4.41Å; I78-Y311 HydrophobicContact CG1-CD1 4.32Å; I78-Y311 HydrophobicContact CG2-CD1 3.33Å; I78-Y311 HydrophobicContact CG2-CE1 3.53Å; I78-Y311 HydrophobicContact CG2-CG 4Å; I78-T314 HydrophobicContact CD1-CG2 3.45Å; I78-T314 VanDerWaalsContact CD1-CG2 3.45Å; I78-L315 HydrophobicContact CB-CD1 4.46Å; I78-L315 HydrophobicContact CD1-CD1 3.83Å; I78-L315 HydrophobicContact CD1-CD2 4.18Å; I78-L315 HydrophobicContact CD1-CG 3.81Å; I78-L315 HydrophobicContact CG2-CD1 3.85Å |
| 79 | T | 91.9 | Very high | 87.9 | Confident | 17 Ų | 17 | 35.2 Ų | 35.2 | 10% | 0.104 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -70.3 | -37.7 | 179.4 | -60.4 | 0 | 0 | 0 | 0 | 111.3 | L61 M70 A75 I76 F77 A82 L83 | L61-T79 HydrophobicContact CD1-CG2 3.71Å; M70-T79 HydrophobicContact CE-CG2 4.1Å; M70-T79 WeakPolarHBondContact CE-OG1 3.17Å; M70-T79 HydrophobicContact SD-CG2 4.44Å; A75-T79 VanDerWaalsContact O-CB 3.31Å; A75-T79 WeakPolarHBondContact O-CB 3.45Å; A75-T79 PolarHBondContact O-N 2.87Å; A75-T79 PolarHBondContact O-OG1 2.99Å; I76-T79 PolarHBondContact O-N 2.99Å; F77-T79 VanDerWaalsContact C-N 3.33Å; F77-T79 PolarHBondContact O-N 3.19Å; T79-A82 PolarHBondContact O-N 2.93Å; T79-L83 WeakPolarHBondContact O-CB 3.27Å; T79-L83 PolarHBondContact O-N 3.25Å |
| 80 | N | 94.9 | Very high | 89.7 | Confident | 29 Ų | 29 | 31.1 Ų | 31.1 | 16% | 0.155 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -69.2 | -34.6 | 174.5 | -76.8 | -88.7 | 0 | 0 | 0 | 112.3 | I76 F77 L83 S84 F128 W163 | I76-N80 PolarHBondContact O-N 3.29Å; I76-N80 VanDerWaalsContact O-N 3.08Å; I76-N80 PolarHBondContact O-ND2 3.3Å; F77-N80 PolarHBondContact O-N 3.36Å; N80-L83 PolarHBondContact O-N 2.97Å; N80-S84 WeakPolarHBondContact O-CB 3.2Å; N80-S84 PolarHBondContact O-N 2.89Å; N80-F128 HydrophobicContact CB-CD1 4.15Å; N80-F128 HydrophobicContact CB-CD2 4.47Å; N80-F128 HydrophobicContact CB-CE1 3.58Å; N80-F128 HydrophobicContact CB-CE2 3.95Å; N80-F128 HydrophobicContact CB-CZ 3.49Å; N80-F128 VanDerWaalsContact CB-CZ 3.49Å; N80-W163 PolarHBondContact OD1-NE1 2.93Å |
| 81 | L | 94.1 | Very high | 91.4 | Very high | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -58.2 | -56.2 | 170.1 | -178.7 | 59.9 | 0 | 0 | 0 | 110.4 | F77 I78 L83 S84 D85 S125 F128 L129 I132 Y311 | F77-L81 WeakPolarHBondContact O-CB 3.01Å; F77-L81 PolarHBondContact O-N 3.41Å; I78-L81 WeakPolarHBondContact O-CB 3.49Å; I78-L81 PolarHBondContact O-N 3.42Å; L81-L83 VanDerWaalsContact C-N 3.25Å; L81-L83 PolarHBondContact O-N 2.79Å; L81-S84 WeakPolarHBondContact O-CA 3.22Å; L81-S84 VanDerWaalsContact O-CB 3.31Å; L81-S84 WeakPolarHBondContact O-CB 3.08Å; L81-S84 PolarHBondContact O-N 3.42Å; L81-D85 PolarHBondContact O-N 2.65Å; L81-S125 VanDerWaalsContact CD1-OG 3.29Å; L81-S125 WeakPolarHBondContact CD1-OG 3.42Å; L81-F128 HydrophobicContact CB-CB 4.19Å; L81-F128 HydrophobicContact CB-CD2 4.44Å; L81-F128 HydrophobicContact CD1-CB 4.31Å; L81-L129 HydrophobicContact CD2-CD2 4.01Å; L81-L129 HydrophobicContact CD2-CG 4.43Å; L81-I132 HydrophobicContact CD2-CD1 4.49Å; L81-Y311 HydrophobicContact CD2-CE1 4.19Å |
| 82 | A | 94.4 | Very high | 92.9 | Very high | 0 Ų | 0 | 20.7 Ų | 20.7 | 0% | 0 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -55.8 | -38.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | L61 I78 T79 D85 L86 Y311 | L61-A82 HydrophobicContact CD1-CB 4.43Å; I78-A82 PolarHBondContact O-N 3.43Å; T79-A82 PolarHBondContact O-N 2.93Å; A82-D85 PolarHBondContact O-N 2.67Å; A82-L86 WeakPolarHBondContact O-CG 3.14Å; A82-L86 PolarHBondContact O-N 3.29Å; A82-Y311 WeakPolarHBondContact CA-OH 3.12Å; A82-Y311 HydrophobicContact CB-CE2 4.21Å; A82-Y311 VanDerWaalsContact CB-OH 3.27Å; A82-Y311 WeakPolarHBondContact CB-OH 3.42Å; A82-Y311 PolarHBondContact N-OH 2.76Å |
| 83 | L | 95.4 | Very high | 93.9 | Very high | 68 Ų | 68 | 21.2 Ų | 21.2 | 36% | 0.356 | 12% | 0.119 | S | C | . | . | H | α-helix | trans | -64.9 | -44.2 | 176 | 179.7 | 61.5 | 0 | 0 | 0 | 111.5 | T79 N80 L81 D85 L86 L87 W163 | T79-L83 WeakPolarHBondContact O-CB 3.27Å; T79-L83 PolarHBondContact O-N 3.25Å; N80-L83 PolarHBondContact O-N 2.97Å; L81-L83 VanDerWaalsContact C-N 3.25Å; L81-L83 PolarHBondContact O-N 2.79Å; L83-D85 VanDerWaalsContact C-N 3.34Å; L83-D85 PolarHBondContact O-N 3.06Å; L83-L86 PolarHBondContact O-N 3.05Å; L83-L87 HydrophobicContact CG-CD1 4.46Å; L83-L87 WeakPolarHBondContact O-CG 3.39Å; L83-L87 PolarHBondContact O-N 3.19Å; L83-W163 HydrophobicContact CB-CZ2 4.43Å; L83-W163 HydrophobicContact CD2-CZ2 4.05Å; L83-W163 HydrophobicContact CG-CZ2 4.19Å |
| 84 | S | 96.5 | Very high | 94.4 | Very high | 1 Ų | 1 | 22.3 Ų | 22.3 | 1% | 0.007 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -60.9 | -42 | 176 | -171.8 | 0 | 0 | 0 | 0 | 112.1 | N80 L81 L87 F88 N121 | N80-S84 WeakPolarHBondContact O-CB 3.2Å; N80-S84 PolarHBondContact O-N 2.89Å; L81-S84 WeakPolarHBondContact O-CA 3.22Å; L81-S84 VanDerWaalsContact O-CB 3.31Å; L81-S84 WeakPolarHBondContact O-CB 3.08Å; L81-S84 PolarHBondContact O-N 3.42Å; S84-L87 PolarHBondContact O-N 2.9Å; S84-F88 PolarHBondContact O-N 3.43Å; S84-F88 VanDerWaalsContact O-N 3.15Å; S84-N121 PolarHBondContact O-ND2 3.01Å; S84-N121 WeakPolarHBondContact OG-CA 3.25Å |
| 85 | D | 96.1 | Very high | 94.7 | Very high | 0 Ų | 0 | 23.7 Ų | 23.7 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -63.8 | -44.2 | 176.7 | -60.1 | -43.5 | 0 | 0 | 0 | 111.8 | N57 L81 A82 L83 F88 V89 N121 S125 N303 C304 | N57-D85 HydrophobicContact CB-CB 4.47Å; L81-D85 PolarHBondContact O-N 2.65Å; A82-D85 PolarHBondContact O-N 2.67Å; L83-D85 VanDerWaalsContact C-N 3.34Å; L83-D85 PolarHBondContact O-N 3.06Å; D85-F88 PolarHBondContact O-N 2.98Å; D85-V89 VanDerWaalsContact O-CB 3.32Å; D85-V89 WeakPolarHBondContact O-CB 2.94Å; D85-V89 VanDerWaalsContact O-CG2 3.24Å; D85-V89 WeakPolarHBondContact O-CG2 3.29Å; D85-V89 PolarHBondContact O-N 3.49Å; D85-N121 WeakPolarHBondContact CA-ND2 3.47Å; D85-N121 PolarHBondContact OD1-ND2 3.35Å; D85-S125 PolarHBondContact OD1-OG 3.23Å; D85-N303 PolarHBondContact OD1-OD1 3.46Å; D85-C304 HydrophobicContact CB-CB 4.08Å; D85-C304 PolarHBondContact OD1-SG 2.93Å |
| 86 | L | 95.8 | Very high | 95.2 | Very high | 19 Ų | 19 | 24.9 Ų | 24.9 | 10% | 0.099 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -62.9 | -44.3 | 176.6 | -76.8 | 170.4 | 0 | 0 | 0 | 112.7 | L54 N57 S58 L61 A82 L83 F88 V89 C90 | L54-L86 HydrophobicContact CD1-CD2 4.16Å; N57-L86 HydrophobicContact CB-CD1 4.28Å; N57-L86 HydrophobicContact CB-CD2 3.78Å; N57-L86 HydrophobicContact CB-CG 3.65Å; S58-L86 WeakPolarHBondContact OG-CD2 3.46Å; L61-L86 HydrophobicContact CB-CD1 4.09Å; L61-L86 HydrophobicContact CD2-CD1 3.69Å; L61-L86 HydrophobicContact CG-CD1 4.48Å; A82-L86 WeakPolarHBondContact O-CG 3.14Å; A82-L86 PolarHBondContact O-N 3.29Å; L83-L86 PolarHBondContact O-N 3.05Å; L86-F88 VanDerWaalsContact C-N 3.27Å; L86-F88 PolarHBondContact O-N 3.34Å; L86-V89 PolarHBondContact O-N 3.03Å; L86-C90 WeakPolarHBondContact O-CB 3.49Å; L86-C90 PolarHBondContact O-N 3.42Å; L86-C90 PolarHBondContact O-SG 3.45Å |
| 87 | L | 96.1 | Very high | 95.4 | Very high | 90 Ų | 90 | 27.8 Ų | 27.8 | 47% | 0.471 | 15% | 0.147 | S | C | . | . | H | α-helix | trans | -58.7 | -42.3 | 177.8 | -71.7 | 176.3 | 0 | 0 | 0 | 111.3 | L83 S84 W163 | L83-L87 HydrophobicContact CG-CD1 4.46Å; L83-L87 WeakPolarHBondContact O-CG 3.39Å; L83-L87 PolarHBondContact O-N 3.19Å; S84-L87 PolarHBondContact O-N 2.9Å; L87-W163 HydrophobicContact CD1-CH2 3.81Å; L87-W163 HydrophobicContact CD1-CZ3 4.11Å |
| 88 | F | 97.1 | Very high | 95.4 | Very high | 5 Ų | 5 | 27.4 Ų | 27.4 | 2% | 0.022 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -68.9 | -49.1 | 176.5 | 166.5 | -116.8 | 0 | 0 | 0 | 112.7 | S84 D85 L86 C90 T91 L92 F118 N121 T301 | S84-F88 PolarHBondContact O-N 3.43Å; S84-F88 VanDerWaalsContact O-N 3.15Å; D85-F88 PolarHBondContact O-N 2.98Å; L86-F88 VanDerWaalsContact C-N 3.27Å; L86-F88 PolarHBondContact O-N 3.34Å; F88-C90 VanDerWaalsContact C-N 3.25Å; F88-C90 PolarHBondContact O-N 3.29Å; F88-T91 WeakPolarHBondContact O-CA 3.31Å; F88-T91 PolarHBondContact O-N 2.92Å; F88-T91 PolarHBondContact O-OG1 2.99Å; F88-L92 HydrophobicContact CE1-CD1 4.27Å; F88-L92 HydrophobicContact CE1-CD2 4.11Å; F88-L92 HydrophobicContact CE1-CG 4.4Å; F88-L92 HydrophobicContact CE2-CD2 3.77Å; F88-L92 HydrophobicContact CE2-CG 4.47Å; F88-L92 HydrophobicContact CZ-CD1 4.48Å; F88-L92 HydrophobicContact CZ-CD2 3.5Å; F88-L92 VanDerWaalsContact CZ-CD2 3.5Å; F88-L92 HydrophobicContact CZ-CG 4.23Å; F88-L92 PolarHBondContact O-N 3.12Å; F88-F118 HydrophobicContact CD2-CB 4.2Å; F88-F118 HydrophobicContact CE2-CB 4.02Å; F88-F118 AromaticContact CE2-CD2 3.74Å; F88-F118 HydrophobicContact CE2-CD2 3.74Å; F88-F118 HydrophobicContact CE2-CG 4.39Å; F88-F118 HydrophobicContact CZ-CD2 4.09Å; F88-N121 HydrophobicContact CB-CB 3.52Å; F88-N121 HydrophobicContact CD1-CB 4.26Å; F88-N121 HydrophobicContact CD2-CB 4.47Å; F88-N121 HydrophobicContact CG-CB 3.85Å; F88-T301 HydrophobicContact CE1-CG2 3.99Å; F88-T301 HydrophobicContact CZ-CG2 3.63Å |
| 89 | V | 97.1 | Very high | 95.5 | Very high | 0 Ų | 0 | 27.6 Ų | 27.6 | 0% | 0 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -58.2 | -38.7 | -179.3 | 166.4 | 0 | 0 | 0 | 0 | 111.4 | V49 F50 L54 D85 L86 T91 L92 C304 | V49-V89 HydrophobicContact CG1-CG2 4.35Å; F50-V89 HydrophobicContact CD2-CG1 3.77Å; F50-V89 WeakPolarHBondContact CD2-O 3.44Å; F50-V89 HydrophobicContact CE2-CG1 4.41Å; L54-V89 HydrophobicContact CB-CG1 3.82Å; L54-V89 HydrophobicContact CD1-CG1 4.49Å; D85-V89 VanDerWaalsContact O-CB 3.32Å; D85-V89 WeakPolarHBondContact O-CB 2.94Å; D85-V89 VanDerWaalsContact O-CG2 3.24Å; D85-V89 WeakPolarHBondContact O-CG2 3.29Å; D85-V89 PolarHBondContact O-N 3.49Å; L86-V89 PolarHBondContact O-N 3.03Å; V89-T91 PolarHBondContact O-N 3.39Å; V89-T91 VanDerWaalsContact O-N 3.14Å; V89-L92 HydrophobicContact CB-CD1 4.45Å; V89-L92 HydrophobicContact CG2-CD1 4.18Å; V89-L92 WeakPolarHBondContact O-CB 3.43Å; V89-L92 PolarHBondContact O-N 2.73Å; V89-C304 HydrophobicContact CG2-CB 4.28Å |
| 90 | C | 96.9 | Very high | 95.6 | Very high | 74 Ų | 74 | 32 Ų | 32 | 50% | 0.5 | 16% | 0.164 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -60.8 | -21.6 | 174.6 | -73.7 | 0 | 0 | 0 | 0 | 113.9 | L86 F88 | L86-C90 WeakPolarHBondContact O-CB 3.49Å; L86-C90 PolarHBondContact O-N 3.42Å; L86-C90 PolarHBondContact O-SG 3.45Å; F88-C90 VanDerWaalsContact C-N 3.25Å; F88-C90 PolarHBondContact O-N 3.29Å |
| 91 | T | 96.3 | Very high | 95.5 | Very high | 13 Ų | 13 | 34.9 Ų | 34.9 | 8% | 0.08 | 18% | 0.18 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -89.8 | -13.4 | 175.1 | 73 | 0 | 0 | 0 | 0 | 113.9 | F88 V89 P93 F94 A117 | F88-T91 WeakPolarHBondContact O-CA 3.31Å; F88-T91 PolarHBondContact O-N 2.92Å; F88-T91 PolarHBondContact O-OG1 2.99Å; V89-T91 PolarHBondContact O-N 3.39Å; V89-T91 VanDerWaalsContact O-N 3.14Å; T91-P93 VanDerWaalsContact C-CD 3.43Å; T91-F94 PolarHBondContact O-N 3.45Å; T91-A117 HydrophobicContact CG2-CB 3.74Å |
| 92 | L | 96.6 | Very high | 95.3 | Very high | 1 Ų | 1 | 40.2 Ų | 40.2 | 1% | 0.005 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -60.7 | -35.8 | -177.7 | -70.4 | 179.6 | 0 | 0 | 0 | 114.6 | Y46 V49 F50 F88 V89 F94 K95 I96 | Y46-L92 HydrophobicContact CD1-CD2 4.19Å; Y46-L92 HydrophobicContact CD2-CD2 4.27Å; Y46-L92 HydrophobicContact CG-CD2 3.93Å; V49-L92 HydrophobicContact CB-CD1 3.98Å; V49-L92 HydrophobicContact CG1-CD1 3.63Å; F50-L92 HydrophobicContact CB-CB 4.14Å; F50-L92 HydrophobicContact CB-CD1 4.14Å; F50-L92 HydrophobicContact CD2-CB 4.35Å; F88-L92 HydrophobicContact CE1-CD1 4.27Å; F88-L92 HydrophobicContact CE1-CD2 4.11Å; F88-L92 HydrophobicContact CE1-CG 4.4Å; F88-L92 HydrophobicContact CE2-CD2 3.77Å; F88-L92 HydrophobicContact CE2-CG 4.47Å; F88-L92 HydrophobicContact CZ-CD1 4.48Å; F88-L92 HydrophobicContact CZ-CD2 3.5Å; F88-L92 VanDerWaalsContact CZ-CD2 3.5Å; F88-L92 HydrophobicContact CZ-CG 4.23Å; F88-L92 PolarHBondContact O-N 3.12Å; V89-L92 HydrophobicContact CB-CD1 4.45Å; V89-L92 HydrophobicContact CG2-CD1 4.18Å; V89-L92 WeakPolarHBondContact O-CB 3.43Å; V89-L92 PolarHBondContact O-N 2.73Å; L92-F94 PolarHBondContact O-N 3.23Å; L92-K95 CarbonylContact O-C 3.53Å; L92-K95 WeakPolarHBondContact O-CA 3.38Å; L92-K95 PolarHBondContact O-N 3.35Å; L92-I96 HydrophobicContact CB-CD1 4.32Å; L92-I96 VanDerWaalsContact O-CG1 3.26Å; L92-I96 WeakPolarHBondContact O-CG1 3.43Å; L92-I96 PolarHBondContact O-N 2.93Å |
| 93 | P | 97.4 | Very high | 95.1 | Very high | 51 Ų | 51 | 43.3 Ų | 43.3 | 33% | 0.331 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -52.9 | -40.4 | 177.5 | -30.3 | 37.7 | 0 | 0 | 0 | 113.6 | F50 T91 I96 F97 | F50-P93 HydrophobicContact CD2-CG 3.85Å; F50-P93 HydrophobicContact CE1-CG 4.43Å; F50-P93 HydrophobicContact CE2-CG 3.49Å; F50-P93 VanDerWaalsContact CE2-CG 3.49Å; F50-P93 HydrophobicContact CG-CG 4.47Å; F50-P93 HydrophobicContact CZ-CG 3.81Å; T91-P93 VanDerWaalsContact C-CD 3.43Å; P93-I96 PolarHBondContact O-N 2.95Å; P93-F97 PolarHBondContact O-N 2.92Å |
| 94 | F | 95.5 | Very high | 94.8 | Very high | 67 Ų | 67 | 40.2 Ų | 40.2 | 29% | 0.294 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -67.1 | -40 | 177.2 | -54 | -68.7 | 0 | 0 | 0 | 111.9 | T91 L92 Y98 W104 F106 L110 | T91-F94 PolarHBondContact O-N 3.45Å; L92-F94 PolarHBondContact O-N 3.23Å; F94-Y98 WeakPolarHBondContact O-CB 3.42Å; F94-Y98 PolarHBondContact O-N 3.22Å; F94-W104 HydrophobicContact CB-CH2 3.59Å; F94-W104 HydrophobicContact CB-CZ2 4.49Å; F94-W104 HydrophobicContact CB-CZ3 3.94Å; F94-F106 HydrophobicContact CB-CD2 4.07Å; F94-F106 HydrophobicContact CB-CE2 4.01Å; F94-F106 AromaticContact CD1-CD1 3.82Å; F94-F106 HydrophobicContact CD1-CD1 3.82Å; F94-F106 HydrophobicContact CD1-CD2 4.02Å; F94-F106 AromaticContact CD1-CE1 3.8Å; F94-F106 HydrophobicContact CD1-CE1 3.8Å; F94-F106 AromaticContact CD1-CE2 4Å; F94-F106 HydrophobicContact CD1-CE2 4Å; F94-F106 AromaticContact CD1-CG 3.94Å; F94-F106 HydrophobicContact CD1-CG 3.94Å; F94-F106 AromaticContact CD1-CZ 3.9Å; F94-F106 HydrophobicContact CD1-CZ 3.9Å; F94-F106 HydrophobicContact CE1-CD1 4.22Å; F94-F106 HydrophobicContact CE1-CE1 4.29Å; F94-F106 HydrophobicContact CG-CD2 4.49Å; F94-L110 HydrophobicContact CB-CD2 4.35Å; F94-L110 HydrophobicContact CD1-CD2 3.4Å; F94-L110 HydrophobicContact CD2-CD1 4.49Å; F94-L110 HydrophobicContact CD2-CD2 3.84Å; F94-L110 HydrophobicContact CD2-CG 4.35Å; F94-L110 HydrophobicContact CE1-CD2 3.49Å; F94-L110 VanDerWaalsContact CE1-CD2 3.49Å; F94-L110 HydrophobicContact CE2-CD1 4.25Å; F94-L110 HydrophobicContact CE2-CD2 3.92Å; F94-L110 HydrophobicContact CG-CD2 3.58Å; F94-L110 HydrophobicContact CG-CG 4.4Å; F94-L110 HydrophobicContact CZ-CD2 3.75Å |
| 95 | K | 93.6 | Very high | 94.7 | Very high | 31 Ų | 31 | 43.3 Ų | 43.3 | 14% | 0.135 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -68.5 | -37.9 | 175.1 | -73.4 | -71.7 | -174.9 | 179.8 | 0 | 111.8 | Y46 L92 Y98 N99 W104 S114 | Y46-K95 HydrophobicContact CD2-CB 3.94Å; Y46-K95 HydrophobicContact CE2-CB 4.16Å; L92-K95 CarbonylContact O-C 3.53Å; L92-K95 WeakPolarHBondContact O-CA 3.38Å; L92-K95 PolarHBondContact O-N 3.35Å; K95-Y98 PolarHBondContact O-N 3.35Å; K95-N99 WeakPolarHBondContact O-CB 3.47Å; K95-N99 PolarHBondContact O-N 2.94Å; K95-N99 PolarHBondContact O-ND2 2.61Å; K95-W104 HydrophobicContact CD-CZ3 4.23Å; K95-S114 WeakPolarHBondContact CE-OG 3.38Å; K95-S114 WeakPolarHBondContact CG-OG 3.32Å |
| 96 | I | 96.8 | Very high | 94.4 | Very high | 24 Ų | 24 | 46.7 Ų | 46.7 | 12% | 0.123 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -61.2 | -50.1 | 175.7 | -67.9 | 161.2 | 0 | 0 | 0 | 109.5 | S47 F50 L92 P93 Y98 N99 F100 | S47-I96 WeakPolarHBondContact OG-CG2 3.4Å; F50-I96 HydrophobicContact CB-CD1 4.03Å; F50-I96 HydrophobicContact CG-CD1 4.47Å; L92-I96 HydrophobicContact CB-CD1 4.32Å; L92-I96 VanDerWaalsContact O-CG1 3.26Å; L92-I96 WeakPolarHBondContact O-CG1 3.43Å; L92-I96 PolarHBondContact O-N 2.93Å; P93-I96 PolarHBondContact O-N 2.95Å; I96-Y98 VanDerWaalsContact C-N 3.32Å; I96-Y98 PolarHBondContact O-N 3.08Å; I96-N99 PolarHBondContact O-N 2.8Å; I96-F100 HydrophobicContact CG2-CD2 3.71Å; I96-F100 HydrophobicContact CG2-CE2 3.65Å; I96-F100 WeakPolarHBondContact O-CD2 3.11Å; I96-F100 PolarHBondContact O-N 3.06Å; I96-F100 VanDerWaalsContact O-N 3.08Å |
| 97 | F | 96.3 | Very high | 94.2 | Very high | 84 Ų | 84 | 47.6 Ų | 47.6 | 37% | 0.368 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -55.8 | -48.3 | 175.7 | -177.4 | -83.1 | 0 | 0 | 0 | 111.5 | P93 N99 F100 N101 P105 F106 | P93-F97 PolarHBondContact O-N 2.92Å; F97-N99 PolarHBondContact O-N 3.24Å; F97-F100 PolarHBondContact O-N 3.39Å; F97-N101 HydrophobicContact CD1-CB 4.4Å; F97-N101 WeakPolarHBondContact CD2-ND2 3.46Å; F97-N101 HydrophobicContact CE1-CB 4Å; F97-N101 WeakPolarHBondContact CE2-ND2 3.45Å; F97-N101 HydrophobicContact CZ-CB 4.29Å; F97-N101 WeakPolarHBondContact O-CB 3.44Å; F97-N101 PolarHBondContact O-N 3.34Å; F97-N101 PolarHBondContact O-ND2 3.32Å; F97-P105 HydrophobicContact CD1-CG 4.16Å; F97-P105 HydrophobicContact CE1-CG 3.61Å; F97-P105 HydrophobicContact CZ-CG 4.31Å; F97-F106 HydrophobicContact CB-CE2 4.09Å; F97-F106 HydrophobicContact CB-CZ 3.91Å; F97-F106 AromaticContact CD1-CE2 3.72Å; F97-F106 HydrophobicContact CD1-CE2 3.72Å; F97-F106 AromaticContact CD1-CZ 3.63Å; F97-F106 HydrophobicContact CD1-CZ 3.63Å; F97-F106 HydrophobicContact CD2-CZ 4.44Å; F97-F106 HydrophobicContact CE1-CZ 4.31Å; F97-F106 HydrophobicContact CG-CE2 4.1Å; F97-F106 AromaticContact CG-CZ 3.72Å; F97-F106 HydrophobicContact CG-CZ 3.72Å |
| 98 | Y | 93.6 | Very high | 93.8 | Very high | 2 Ų | 2 | 45.5 Ų | 45.5 | 1% | 0.008 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -59.8 | -43 | 178.5 | 167 | -106.5 | 0 | 0 | 0 | 113 | Y39 F94 K95 I96 R102 W104 E190 | Y39-Y98 HydrophobicContact CE1-CE1 4.38Å; F94-Y98 WeakPolarHBondContact O-CB 3.42Å; F94-Y98 PolarHBondContact O-N 3.22Å; K95-Y98 PolarHBondContact O-N 3.35Å; I96-Y98 VanDerWaalsContact C-N 3.32Å; I96-Y98 PolarHBondContact O-N 3.08Å; Y98-R102 WeakPolarHBondContact O-CA 3.27Å; Y98-R102 PolarHBondContact O-N 3.17Å; Y98-W104 HydrophobicContact CD2-CB 3.79Å; Y98-W104 HydrophobicContact CD2-CE3 4.23Å; Y98-W104 HydrophobicContact CE2-CB 4.26Å; Y98-W104 AromaticContact CG-CE3 3.98Å; Y98-W104 HydrophobicContact CG-CE3 3.98Å; Y98-E190 VanDerWaalsContact CE1-OE1 3.31Å; Y98-E190 WeakPolarHBondContact CE1-OE1 3.45Å; Y98-E190 PolarHBondContact OH-OE1 2.89Å |
| 99 | N | 92.9 | Very high | 93.5 | Very high | 4 Ų | 4 | 50.3 Ų | 50.3 | 2% | 0.021 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -68.9 | -38.5 | -177.7 | -82.4 | -76.6 | 0 | 0 | 0 | 111.9 | Y39 N42 K95 I96 F97 | Y39-N99 WeakPolarHBondContact CB-O 3.3Å; Y39-N99 WeakPolarHBondContact O-CB 3.21Å; N42-N99 HydrophobicContact CB-CB 4.49Å; N42-N99 VanDerWaalsContact CB-OD1 3.29Å; N42-N99 WeakPolarHBondContact CB-OD1 3.38Å; N42-N99 PolarHBondContact ND2-OD1 3.29Å; K95-N99 WeakPolarHBondContact O-CB 3.47Å; K95-N99 PolarHBondContact O-N 2.94Å; K95-N99 PolarHBondContact O-ND2 2.61Å; I96-N99 PolarHBondContact O-N 2.8Å; F97-N99 PolarHBondContact O-N 3.24Å |
| 100 | F | 94.8 | Very high | 93.2 | Very high | 108 Ų | 108 | 52.2 Ų | 52.2 | 47% | 0.474 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -77.2 | -36.6 | 177.4 | -72 | -56 | 0 | 0 | 0 | 113.7 | I96 F97 | I96-F100 HydrophobicContact CG2-CD2 3.71Å; I96-F100 HydrophobicContact CG2-CE2 3.65Å; I96-F100 WeakPolarHBondContact O-CD2 3.11Å; I96-F100 PolarHBondContact O-N 3.06Å; I96-F100 VanDerWaalsContact O-N 3.08Å; F97-F100 PolarHBondContact O-N 3.39Å |
| 101 | N | 92.1 | Very high | 92.9 | Very high | 91 Ų | 91 | 48.7 Ų | 48.7 | 49% | 0.487 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -93.1 | -8.5 | -177.1 | -63.9 | -77.5 | 0 | 0 | 0 | 113.7 | F97 H103 | F97-N101 HydrophobicContact CD1-CB 4.4Å; F97-N101 WeakPolarHBondContact CD2-ND2 3.46Å; F97-N101 HydrophobicContact CE1-CB 4Å; F97-N101 WeakPolarHBondContact CE2-ND2 3.45Å; F97-N101 HydrophobicContact CZ-CB 4.29Å; F97-N101 WeakPolarHBondContact O-CB 3.44Å; F97-N101 PolarHBondContact O-N 3.34Å; F97-N101 PolarHBondContact O-ND2 3.32Å; N101-H103 PolarHBondContact O-N 3.49Å; N101-H103 VanDerWaalsContact O-N 3.08Å |
| 102 | R | 89.8 | Confident | 92.7 | Very high | 111 Ų | 111 | 50.6 Ų | 50.6 | 42% | 0.419 | 26% | 0.259 | S | S | . | . | S | Bend | trans | 52.6 | 28.2 | -174.8 | -55.5 | -175.5 | 178.5 | -169.9 | -1.3 | 113.3 | Y39 Y98 | Y39-R102 HydrophobicContact CD1-CG 4.37Å; Y39-R102 HydrophobicContact CD2-CG 4.43Å; Y39-R102 HydrophobicContact CG-CG 4.23Å; Y98-R102 WeakPolarHBondContact O-CA 3.27Å; Y98-R102 PolarHBondContact O-N 3.17Å |
| 103 | H | 89.5 | Confident | 92.5 | Very high | 66 Ų | 66 | 54.7 Ų | 54.7 | 31% | 0.306 | 28% | 0.281 | S | S | . | . | trans | -146.1 | 132.6 | -174.9 | -179.5 | 78.6 | 0 | 0 | 0 | 110.5 | N101 P105 T186 | N101-H103 PolarHBondContact O-N 3.49Å; N101-H103 VanDerWaalsContact O-N 3.08Å; H103-P105 VanDerWaalsContact O-CD 3.24Å; H103-P105 WeakPolarHBondContact O-CD 3.43Å; H103-T186 PolarHBondContact ND1-N 2.76Å | ||
| 104 | W | 90.9 | Very high | 92.2 | Very high | 2 Ų | 2 | 52.4 Ų | 52.4 | 1% | 0.008 | 27% | 0.266 | C | S | . | . | trans | -105 | 96.4 | 177.1 | -176.3 | -87.3 | 0 | 0 | 0 | 111.1 | F94 K95 Y98 F106 G107 L110 C111 T186 C188 | F94-W104 HydrophobicContact CB-CH2 3.59Å; F94-W104 HydrophobicContact CB-CZ2 4.49Å; F94-W104 HydrophobicContact CB-CZ3 3.94Å; K95-W104 HydrophobicContact CD-CZ3 4.23Å; Y98-W104 HydrophobicContact CD2-CB 3.79Å; Y98-W104 HydrophobicContact CD2-CE3 4.23Å; Y98-W104 HydrophobicContact CE2-CB 4.26Å; Y98-W104 AromaticContact CG-CE3 3.98Å; Y98-W104 HydrophobicContact CG-CE3 3.98Å; W104-F106 AromaticContact CD2-CD2 3.94Å; W104-F106 HydrophobicContact CD2-CD2 3.94Å; W104-F106 AromaticContact CE2-CD2 3.86Å; W104-F106 HydrophobicContact CE3-CD2 4.1Å; W104-F106 HydrophobicContact CH2-CD2 4.08Å; W104-F106 HydrophobicContact CZ2-CB 3.95Å; W104-F106 AromaticContact CZ2-CD2 3.93Å; W104-F106 HydrophobicContact CZ2-CD2 3.93Å; W104-F106 HydrophobicContact CZ2-CG 4.4Å; W104-F106 HydrophobicContact CZ3-CD2 4.17Å; W104-G107 PolarHBondContact NE1-O 3.46Å; W104-L110 HydrophobicContact CZ2-CB 4Å; W104-L110 HydrophobicContact CZ2-CD2 4.28Å; W104-L110 HydrophobicContact CZ2-CG 4.08Å; W104-C111 HydrophobicContact CZ2-CB 4.15Å; W104-T186 HydrophobicContact CB-CG2 4.34Å; W104-T186 WeakPolarHBondContact CB-O 3.37Å; W104-T186 PolarHBondContact N-O 2.93Å; W104-T186 WeakPolarHBondContact O-CB 3.33Å; W104-T186 WeakPolarHBondContact O-CG2 3.2Å; W104-C188 HydrophobicContact CB-CB 3.93Å; W104-C188 HydrophobicContact CD2-CB 3.48Å; W104-C188 VanDerWaalsContact CD2-CB 3.48Å; W104-C188 HydrophobicContact CE3-CB 3.73Å; W104-C188 HydrophobicContact CG-CB 3.54Å | ||
| 105 | P | 92.5 | Very high | 92 | Very high | 67 Ų | 67 | 49.3 Ų | 49.3 | 44% | 0.435 | 25% | 0.253 | S | S | . | . | trans | -86.7 | -7.2 | -178.6 | 34.6 | -36.7 | 0 | 0 | 0 | 113.8 | F97 H103 G107 | F97-P105 HydrophobicContact CD1-CG 4.16Å; F97-P105 HydrophobicContact CE1-CG 3.61Å; F97-P105 HydrophobicContact CZ-CG 4.31Å; H103-P105 VanDerWaalsContact O-CD 3.24Å; H103-P105 WeakPolarHBondContact O-CD 3.43Å; P105-G107 VanDerWaalsContact C-N 3.28Å; P105-G107 PolarHBondContact O-N 3.28Å | ||
| 106 | F | 91.7 | Very high | 91.9 | Very high | 71 Ų | 71 | 48.7 Ų | 48.7 | 31% | 0.311 | 25% | 0.252 | S | S | . | . | S | Bend | trans | -85.2 | 8.6 | -165.6 | -47.5 | -73.4 | 0 | 0 | 0 | 115.3 | F94 F97 W104 L110 | F94-F106 HydrophobicContact CB-CD2 4.07Å; F94-F106 HydrophobicContact CB-CE2 4.01Å; F94-F106 AromaticContact CD1-CD1 3.82Å; F94-F106 HydrophobicContact CD1-CD1 3.82Å; F94-F106 HydrophobicContact CD1-CD2 4.02Å; F94-F106 AromaticContact CD1-CE1 3.8Å; F94-F106 HydrophobicContact CD1-CE1 3.8Å; F94-F106 AromaticContact CD1-CE2 4Å; F94-F106 HydrophobicContact CD1-CE2 4Å; F94-F106 AromaticContact CD1-CG 3.94Å; F94-F106 HydrophobicContact CD1-CG 3.94Å; F94-F106 AromaticContact CD1-CZ 3.9Å; F94-F106 HydrophobicContact CD1-CZ 3.9Å; F94-F106 HydrophobicContact CE1-CD1 4.22Å; F94-F106 HydrophobicContact CE1-CE1 4.29Å; F94-F106 HydrophobicContact CG-CD2 4.49Å; F97-F106 HydrophobicContact CB-CE2 4.09Å; F97-F106 HydrophobicContact CB-CZ 3.91Å; F97-F106 AromaticContact CD1-CE2 3.72Å; F97-F106 HydrophobicContact CD1-CE2 3.72Å; F97-F106 AromaticContact CD1-CZ 3.63Å; F97-F106 HydrophobicContact CD1-CZ 3.63Å; F97-F106 HydrophobicContact CD2-CZ 4.44Å; F97-F106 HydrophobicContact CE1-CZ 4.31Å; F97-F106 HydrophobicContact CG-CE2 4.1Å; F97-F106 AromaticContact CG-CZ 3.72Å; F97-F106 HydrophobicContact CG-CZ 3.72Å; W104-F106 AromaticContact CD2-CD2 3.94Å; W104-F106 HydrophobicContact CD2-CD2 3.94Å; W104-F106 AromaticContact CE2-CD2 3.86Å; W104-F106 HydrophobicContact CE3-CD2 4.1Å; W104-F106 HydrophobicContact CH2-CD2 4.08Å; W104-F106 HydrophobicContact CZ2-CB 3.95Å; W104-F106 AromaticContact CZ2-CD2 3.93Å; W104-F106 HydrophobicContact CZ2-CD2 3.93Å; W104-F106 HydrophobicContact CZ2-CG 4.4Å; W104-F106 HydrophobicContact CZ3-CD2 4.17Å; F106-L110 HydrophobicContact CB-CB 4.11Å; F106-L110 HydrophobicContact CB-CD2 3.44Å; F106-L110 VanDerWaalsContact CB-CD2 3.44Å; F106-L110 HydrophobicContact CB-CG 4.34Å; F106-L110 HydrophobicContact CD1-CD2 4.38Å; F106-L110 HydrophobicContact CG-CD2 3.91Å |
| 107 | G | 90.4 | Very high | 91.8 | Very high | 38 Ų | 38 | 48.4 Ų | 48.4 | 39% | 0.392 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | 76.3 | 170.5 | -180 | 0 | 0 | 0 | 0 | 0 | 115.2 | W104 P105 C111 | W104-G107 PolarHBondContact NE1-O 3.46Å; P105-G107 VanDerWaalsContact C-N 3.28Å; P105-G107 PolarHBondContact O-N 3.28Å; G107-C111 PolarHBondContact O-N 3.44Å |
| 108 | D | 87.8 | Confident | 91.6 | Very high | 46 Ų | 46 | 45.4 Ų | 45.4 | 25% | 0.246 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -67.7 | -39.7 | -174.1 | -175.9 | 71.3 | 0 | 0 | 0 | 112.9 | L110 C111 K112 T178 T179 | D108-L110 PolarHBondContact O-N 3.41Å; D108-C111 VanDerWaalsContact O-CB 3.3Å; D108-C111 WeakPolarHBondContact O-CB 3.14Å; D108-C111 PolarHBondContact O-N 2.91Å; D108-C111 VanDerWaalsContact O-N 3.13Å; D108-K112 PolarHBondContact O-N 3.39Å; D108-K112 WeakPolarHBondContact OD2-CE 3.46Å; D108-K112 IonicContact OD2-NZ 2.95Å; D108-K112 PolarHBondContact OD2-NZ 3.14Å; D108-T178 WeakPolarHBondContact OD1-CA 3.38Å; D108-T179 HydrophobicContact CB-CG2 4.32Å; D108-T179 PolarHBondContact OD1-N 2.98Å; D108-T179 VanDerWaalsContact OD1-N 3.07Å |
| 109 | T | 90.7 | Very high | 91.5 | Very high | 105 Ų | 105 | 46.4 Ų | 46.4 | 64% | 0.644 | 25% | 0.245 | S | C | * | . | H | α-helix | trans | -57.2 | -48.8 | 179.7 | -53.6 | 0 | 0 | 0 | 0 | 111.7 | C111 K112 I113 | T109-C111 VanDerWaalsContact C-N 3.29Å; T109-C111 PolarHBondContact O-N 3.26Å; T109-K112 PolarHBondContact O-N 3.18Å; T109-I113 HydrophobicContact CG2-CD1 4.02Å; T109-I113 WeakPolarHBondContact O-CG1 3.34Å; T109-I113 PolarHBondContact O-N 3.42Å |
| 110 | L | 91.9 | Very high | 91.5 | Very high | 41 Ų | 41 | 46.4 Ų | 46.4 | 22% | 0.215 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -71 | -29.2 | -179.3 | -162.2 | 67.9 | 0 | 0 | 0 | 111.9 | F94 W104 F106 D108 K112 I113 S114 | F94-L110 HydrophobicContact CB-CD2 4.35Å; F94-L110 HydrophobicContact CD1-CD2 3.4Å; F94-L110 HydrophobicContact CD2-CD1 4.49Å; F94-L110 HydrophobicContact CD2-CD2 3.84Å; F94-L110 HydrophobicContact CD2-CG 4.35Å; F94-L110 HydrophobicContact CE1-CD2 3.49Å; F94-L110 VanDerWaalsContact CE1-CD2 3.49Å; F94-L110 HydrophobicContact CE2-CD1 4.25Å; F94-L110 HydrophobicContact CE2-CD2 3.92Å; F94-L110 HydrophobicContact CG-CD2 3.58Å; F94-L110 HydrophobicContact CG-CG 4.4Å; F94-L110 HydrophobicContact CZ-CD2 3.75Å; W104-L110 HydrophobicContact CZ2-CB 4Å; W104-L110 HydrophobicContact CZ2-CD2 4.28Å; W104-L110 HydrophobicContact CZ2-CG 4.08Å; F106-L110 HydrophobicContact CB-CB 4.11Å; F106-L110 HydrophobicContact CB-CD2 3.44Å; F106-L110 VanDerWaalsContact CB-CD2 3.44Å; F106-L110 HydrophobicContact CB-CG 4.34Å; F106-L110 HydrophobicContact CD1-CD2 4.38Å; F106-L110 HydrophobicContact CG-CD2 3.91Å; D108-L110 PolarHBondContact O-N 3.41Å; L110-K112 VanDerWaalsContact C-N 3.35Å; L110-I113 HydrophobicContact CD1-CB 4.47Å; L110-I113 HydrophobicContact CD1-CD1 4.33Å; L110-I113 PolarHBondContact O-N 3.41Å; L110-S114 WeakPolarHBondContact O-CB 3.35Å; L110-S114 PolarHBondContact O-N 3.05Å |
| 111 | C | 90.7 | Very high | 91.5 | Very high | 0 Ų | 0 | 41.3 Ų | 41.3 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -60.8 | -46.3 | 172.3 | -179.6 | 0 | 0 | 0 | 0 | 111.1 | W104 G107 D108 T109 S114 G115 T179 C188 | W104-C111 HydrophobicContact CZ2-CB 4.15Å; G107-C111 PolarHBondContact O-N 3.44Å; D108-C111 VanDerWaalsContact O-CB 3.3Å; D108-C111 WeakPolarHBondContact O-CB 3.14Å; D108-C111 PolarHBondContact O-N 2.91Å; D108-C111 VanDerWaalsContact O-N 3.13Å; T109-C111 VanDerWaalsContact C-N 3.29Å; T109-C111 PolarHBondContact O-N 3.26Å; C111-S114 PolarHBondContact O-N 3.37Å; C111-G115 PolarHBondContact O-N 3.36Å; C111-T179 HydrophobicContact CB-CG2 3.84Å; C111-C188 WeakPolarHBondContact CA-SG 3.34Å; C111-C188 HydrophobicContact CB-CB 3.88Å; C111-C188 WeakPolarHBondContact CB-SG 3.36Å; C111-C188 WeakPolarHBondContact SG-CA 3.49Å; C111-C188 WeakPolarHBondContact SG-CB 3.3Å; C111-C188 CovalentContact SG-SG 2.03Å; C111-C188 PolarHBondContact SG-SG 3.44Å |
| 112 | K | 90.4 | Very high | 91.5 | Very high | 52 Ų | 52 | 37 Ų | 37 | 23% | 0.226 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -66.9 | -40.7 | 177.4 | -70.1 | 175 | 172.7 | 160.2 | 0 | 112.6 | D108 T109 L110 G115 T116 S174 S177 | D108-K112 PolarHBondContact O-N 3.39Å; D108-K112 WeakPolarHBondContact OD2-CE 3.46Å; D108-K112 IonicContact OD2-NZ 2.95Å; D108-K112 PolarHBondContact OD2-NZ 3.14Å; T109-K112 PolarHBondContact O-N 3.18Å; L110-K112 VanDerWaalsContact C-N 3.35Å; K112-G115 PolarHBondContact O-N 3.02Å; K112-T116 VanDerWaalsContact O-CB 3.28Å; K112-T116 WeakPolarHBondContact O-CB 3.5Å; K112-T116 PolarHBondContact O-N 2.85Å; K112-T116 PolarHBondContact O-OG1 2.97Å; K112-S174 PolarHBondContact O-OG 3.12Å; K112-S177 WeakPolarHBondContact CE-O 3.25Å |
| 113 | I | 92.9 | Very high | 91.7 | Very high | 88 Ų | 88 | 33.1 Ų | 33.1 | 45% | 0.451 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -60.2 | -48.6 | 174.5 | -69.6 | 167.6 | 0 | 0 | 0 | 110.1 | T109 L110 G115 T116 A117 | T109-I113 HydrophobicContact CG2-CD1 4.02Å; T109-I113 WeakPolarHBondContact O-CG1 3.34Å; T109-I113 PolarHBondContact O-N 3.42Å; L110-I113 HydrophobicContact CD1-CB 4.47Å; L110-I113 HydrophobicContact CD1-CD1 4.33Å; L110-I113 PolarHBondContact O-N 3.41Å; I113-G115 PolarHBondContact O-N 2.86Å; I113-T116 PolarHBondContact O-N 3.33Å; I113-A117 WeakPolarHBondContact O-CB 3.45Å; I113-A117 PolarHBondContact O-N 3.38Å |
| 114 | S | 92.3 | Very high | 92 | Very high | 2 Ų | 2 | 30 Ų | 30 | 1% | 0.014 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -64 | -41.6 | 179.5 | -178.4 | 0 | 0 | 0 | 0 | 112.3 | K95 L110 C111 F118 | K95-S114 WeakPolarHBondContact CE-OG 3.38Å; K95-S114 WeakPolarHBondContact CG-OG 3.32Å; L110-S114 WeakPolarHBondContact O-CB 3.35Å; L110-S114 PolarHBondContact O-N 3.05Å; C111-S114 PolarHBondContact O-N 3.37Å; S114-F118 WeakPolarHBondContact O-CB 3.39Å; S114-F118 PolarHBondContact O-N 2.95Å |
| 115 | G | 89.9 | Confident | 92.2 | Very high | 2 Ų | 2 | 29.9 Ų | 29.9 | 2% | 0.021 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -62.9 | -43.3 | 174 | 0 | 0 | 0 | 0 | 0 | 112.9 | C111 K112 I113 F118 L119 | C111-G115 PolarHBondContact O-N 3.36Å; K112-G115 PolarHBondContact O-N 3.02Å; I113-G115 PolarHBondContact O-N 2.86Å; G115-F118 PolarHBondContact O-N 3.19Å; G115-L119 WeakPolarHBondContact O-CG 3.32Å; G115-L119 PolarHBondContact O-N 3.48Å |
| 116 | T | 91.9 | Very high | 92.2 | Very high | 19 Ų | 19 | 26.7 Ų | 26.7 | 12% | 0.117 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -64.5 | -45.3 | 177.5 | -60.1 | 0 | 0 | 0 | 0 | 111.1 | K112 I113 F118 L119 T120 G170 I171 S174 | K112-T116 VanDerWaalsContact O-CB 3.28Å; K112-T116 WeakPolarHBondContact O-CB 3.5Å; K112-T116 PolarHBondContact O-N 2.85Å; K112-T116 PolarHBondContact O-OG1 2.97Å; I113-T116 PolarHBondContact O-N 3.33Å; T116-F118 VanDerWaalsContact C-N 3.33Å; T116-F118 PolarHBondContact O-N 2.94Å; T116-L119 PolarHBondContact O-N 2.8Å; T116-T120 WeakPolarHBondContact O-CB 3.24Å; T116-T120 PolarHBondContact O-N 2.99Å; T116-T120 PolarHBondContact O-OG1 3.35Å; T116-G170 PolarHBondContact OG1-O 2.88Å; T116-I171 HydrophobicContact CG2-CG1 3.79Å; T116-S174 PolarHBondContact N-OG 3.35Å; T116-S174 WeakPolarHBondContact OG1-CB 3.29Å; T116-S174 PolarHBondContact OG1-OG 3.14Å |
| 117 | A | 94.8 | Very high | 92.4 | Very high | 17 Ų | 17 | 25 Ų | 25 | 14% | 0.14 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -61.6 | -41.9 | 178 | 0 | 0 | 0 | 0 | 0 | 111.4 | T91 I113 N121 | T91-A117 HydrophobicContact CG2-CB 3.74Å; I113-A117 WeakPolarHBondContact O-CB 3.45Å; I113-A117 PolarHBondContact O-N 3.38Å; A117-N121 WeakPolarHBondContact O-CB 3.24Å; A117-N121 PolarHBondContact O-N 3.32Å |
| 118 | F | 92.4 | Very high | 92.6 | Very high | 22 Ų | 22 | 23.1 Ų | 23.1 | 10% | 0.096 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -60.7 | -50.5 | 174.9 | 170.2 | -100 | 0 | 0 | 0 | 112.6 | F88 S114 G115 T116 N121 I122 L297 T301 | F88-F118 HydrophobicContact CD2-CB 4.2Å; F88-F118 HydrophobicContact CE2-CB 4.02Å; F88-F118 AromaticContact CE2-CD2 3.74Å; F88-F118 HydrophobicContact CE2-CD2 3.74Å; F88-F118 HydrophobicContact CE2-CG 4.39Å; F88-F118 HydrophobicContact CZ-CD2 4.09Å; S114-F118 WeakPolarHBondContact O-CB 3.39Å; S114-F118 PolarHBondContact O-N 2.95Å; G115-F118 PolarHBondContact O-N 3.19Å; T116-F118 VanDerWaalsContact C-N 3.33Å; T116-F118 PolarHBondContact O-N 2.94Å; F118-N121 PolarHBondContact O-N 3.03Å; F118-I122 HydrophobicContact CD2-CD1 4.45Å; F118-I122 HydrophobicContact CE1-CD1 4.11Å; F118-I122 HydrophobicContact CE2-CD1 3.46Å; F118-I122 VanDerWaalsContact CE2-CD1 3.46Å; F118-I122 HydrophobicContact CE2-CG1 3.94Å; F118-I122 HydrophobicContact CZ-CD1 3.24Å; F118-I122 HydrophobicContact CZ-CG1 4.04Å; F118-I122 PolarHBondContact O-N 3.38Å; F118-L297 HydrophobicContact CE1-CD1 4.2Å; F118-L297 HydrophobicContact CE2-CD1 3.38Å; F118-L297 HydrophobicContact CZ-CD1 3.13Å; F118-T301 HydrophobicContact CE2-CG2 4.14Å |
| 119 | L | 90.5 | Very high | 92.8 | Very high | 22 Ų | 22 | 21 Ų | 21 | 12% | 0.115 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -64.8 | -41.9 | 179 | -69.9 | 171.8 | 0 | 0 | 0 | 111.7 | G115 T116 N121 Y123 A173 F189 | G115-L119 WeakPolarHBondContact O-CG 3.32Å; G115-L119 PolarHBondContact O-N 3.48Å; T116-L119 PolarHBondContact O-N 2.8Å; L119-N121 VanDerWaalsContact C-N 3.3Å; L119-N121 PolarHBondContact O-N 3.45Å; L119-Y123 HydrophobicContact CD2-CE2 3.95Å; L119-Y123 VanDerWaalsContact O-CD2 3.3Å; L119-Y123 WeakPolarHBondContact O-CD2 3.19Å; L119-Y123 PolarHBondContact O-N 3.3Å; L119-Y123 VanDerWaalsContact O-N 3.1Å; L119-A173 HydrophobicContact CD1-CB 3.55Å; L119-F189 HydrophobicContact CD1-CZ 4.25Å |
| 120 | T | 93.4 | Very high | 93 | Very high | 5 Ų | 5 | 16.4 Ų | 16.4 | 3% | 0.031 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -60.6 | -41.5 | 176.2 | -68.6 | 0 | 0 | 0 | 0 | 111 | T116 G124 W163 V166 L167 | T116-T120 WeakPolarHBondContact O-CB 3.24Å; T116-T120 PolarHBondContact O-N 2.99Å; T116-T120 PolarHBondContact O-OG1 3.35Å; T120-G124 WeakPolarHBondContact O-CA 3.49Å; T120-G124 PolarHBondContact O-N 3.43Å; T120-W163 HydrophobicContact CG2-CE3 4.17Å; T120-W163 HydrophobicContact CG2-CH2 4.48Å; T120-W163 HydrophobicContact CG2-CZ3 3.57Å; T120-V166 HydrophobicContact CG2-CG2 3.82Å; T120-L167 HydrophobicContact CG2-CD2 4.12Å |
| 121 | N | 95.2 | Very high | 93.1 | Very high | 0 Ų | 0 | 15.5 Ų | 15.5 | 0% | 0 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -66 | -55.8 | 176.1 | 178.3 | -98.3 | 0 | 0 | 0 | 112.5 | S84 D85 F88 A117 F118 L119 Y123 G124 S125 N303 | S84-N121 PolarHBondContact O-ND2 3.01Å; S84-N121 WeakPolarHBondContact OG-CA 3.25Å; D85-N121 WeakPolarHBondContact CA-ND2 3.47Å; D85-N121 PolarHBondContact OD1-ND2 3.35Å; F88-N121 HydrophobicContact CB-CB 3.52Å; F88-N121 HydrophobicContact CD1-CB 4.26Å; F88-N121 HydrophobicContact CD2-CB 4.47Å; F88-N121 HydrophobicContact CG-CB 3.85Å; A117-N121 WeakPolarHBondContact O-CB 3.24Å; A117-N121 PolarHBondContact O-N 3.32Å; F118-N121 PolarHBondContact O-N 3.03Å; L119-N121 VanDerWaalsContact C-N 3.3Å; L119-N121 PolarHBondContact O-N 3.45Å; N121-Y123 PolarHBondContact O-N 3.4Å; N121-G124 PolarHBondContact O-N 3.15Å; N121-S125 VanDerWaalsContact O-CB 3.25Å; N121-S125 WeakPolarHBondContact O-CB 3.32Å; N121-S125 PolarHBondContact O-N 2.93Å; N121-S125 PolarHBondContact O-OG 3.36Å; N121-N303 PolarHBondContact OD1-ND2 3.44Å |
| 122 | I | 92.7 | Very high | 93.2 | Very high | 1 Ų | 1 | 15.5 Ų | 15.5 | 1% | 0.005 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -56.7 | -52.5 | -176.5 | -79.8 | -159.6 | 0 | 0 | 0 | 111.8 | F118 M126 Y265 A300 | F118-I122 HydrophobicContact CD2-CD1 4.45Å; F118-I122 HydrophobicContact CE1-CD1 4.11Å; F118-I122 HydrophobicContact CE2-CD1 3.46Å; F118-I122 VanDerWaalsContact CE2-CD1 3.46Å; F118-I122 HydrophobicContact CE2-CG1 3.94Å; F118-I122 HydrophobicContact CZ-CD1 3.24Å; F118-I122 HydrophobicContact CZ-CG1 4.04Å; F118-I122 PolarHBondContact O-N 3.38Å; I122-M126 HydrophobicContact CG2-CE 3.23Å; I122-M126 WeakPolarHBondContact O-CE 3.31Å; I122-M126 WeakPolarHBondContact O-CG 3.39Å; I122-M126 PolarHBondContact O-N 2.9Å; I122-Y265 HydrophobicContact CD1-CD1 3.85Å; I122-Y265 HydrophobicContact CD1-CE1 3.54Å; I122-Y265 HydrophobicContact CG2-CD1 4.44Å; I122-Y265 HydrophobicContact CG2-CE1 4.19Å; I122-A300 HydrophobicContact CD1-CB 3.78Å |
| 123 | Y | 93.3 | Very high | 93.2 | Very high | 29 Ų | 29 | 13.4 Ų | 13.4 | 11% | 0.114 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -77.3 | -32.9 | -178.1 | -65.1 | -70.6 | 0 | 0 | 0 | 112.3 | L119 N121 M126 L127 I208 E209 | L119-Y123 HydrophobicContact CD2-CE2 3.95Å; L119-Y123 VanDerWaalsContact O-CD2 3.3Å; L119-Y123 WeakPolarHBondContact O-CD2 3.19Å; L119-Y123 PolarHBondContact O-N 3.3Å; L119-Y123 VanDerWaalsContact O-N 3.1Å; N121-Y123 PolarHBondContact O-N 3.4Å; Y123-M126 HydrophobicContact CD1-CE 4.01Å; Y123-M126 HydrophobicContact CE1-CE 4.27Å; Y123-M126 PolarHBondContact O-N 2.85Å; Y123-L127 WeakPolarHBondContact O-CB 3.46Å; Y123-L127 VanDerWaalsContact O-CG 3.31Å; Y123-L127 WeakPolarHBondContact O-CG 3.25Å; Y123-L127 PolarHBondContact O-N 3.37Å; Y123-I208 HydrophobicContact CE1-CG2 3.83Å; Y123-I208 HydrophobicContact CE2-CG2 3.97Å; Y123-I208 WeakPolarHBondContact OH-CG2 3.39Å; Y123-E209 PolarHBondContact OH-OE1 3.41Å |
| 124 | G | 95.5 | Very high | 93.2 | Very high | 0 Ų | 0 | 11.3 Ų | 11.3 | 0% | 0 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -61.2 | -48.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | T120 N121 M126 L127 F128 | T120-G124 WeakPolarHBondContact O-CA 3.49Å; T120-G124 PolarHBondContact O-N 3.43Å; N121-G124 PolarHBondContact O-N 3.15Å; G124-M126 PolarHBondContact O-N 3.14Å; G124-L127 PolarHBondContact O-N 2.89Å; G124-F128 WeakPolarHBondContact O-CB 3.29Å; G124-F128 WeakPolarHBondContact O-CD2 3.32Å; G124-F128 WeakPolarHBondContact O-CG 3.35Å; G124-F128 PolarHBondContact O-N 3.15Å |
| 125 | S | 94.8 | Very high | 93.2 | Very high | 0 Ų | 0 | 11.6 Ų | 11.6 | 0% | 0 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -62 | -43.5 | 178.8 | -61.7 | 0 | 0 | 0 | 0 | 111.6 | L81 D85 N121 L127 F128 L129 N303 | L81-S125 VanDerWaalsContact CD1-OG 3.29Å; L81-S125 WeakPolarHBondContact CD1-OG 3.42Å; D85-S125 PolarHBondContact OD1-OG 3.23Å; N121-S125 VanDerWaalsContact O-CB 3.25Å; N121-S125 WeakPolarHBondContact O-CB 3.32Å; N121-S125 PolarHBondContact O-N 2.93Å; N121-S125 PolarHBondContact O-OG 3.36Å; S125-L127 PolarHBondContact O-N 3.28Å; S125-F128 PolarHBondContact O-N 3.36Å; S125-L129 WeakPolarHBondContact O-CB 3.48Å; S125-L129 WeakPolarHBondContact O-CG 3.28Å; S125-L129 PolarHBondContact O-N 3.01Å; S125-N303 PolarHBondContact OG-OD1 2.88Å |
| 126 | M | 93.8 | Very high | 93.2 | Very high | 0 Ų | 0 | 13.8 Ų | 13.8 | 0% | 0 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -58.1 | -46.7 | 173.1 | -77.3 | -171.7 | -110.2 | 0 | 0 | 112.8 | I122 Y123 G124 T130 F213 F258 F262 N266 | I122-M126 HydrophobicContact CG2-CE 3.23Å; I122-M126 WeakPolarHBondContact O-CE 3.31Å; I122-M126 WeakPolarHBondContact O-CG 3.39Å; I122-M126 PolarHBondContact O-N 2.9Å; Y123-M126 HydrophobicContact CD1-CE 4.01Å; Y123-M126 HydrophobicContact CE1-CE 4.27Å; Y123-M126 PolarHBondContact O-N 2.85Å; G124-M126 PolarHBondContact O-N 3.14Å; M126-T130 WeakPolarHBondContact O-CB 3.36Å; M126-T130 PolarHBondContact O-N 2.97Å; M126-T130 PolarHBondContact O-OG1 3.19Å; M126-F213 HydrophobicContact SD-CD2 3.96Å; M126-F258 HydrophobicContact CB-CE2 4.04Å; M126-F258 HydrophobicContact CG-CE2 3.89Å; M126-F258 HydrophobicContact CG-CZ 4.43Å; M126-F262 HydrophobicContact CE-CB 4.17Å; M126-F262 HydrophobicContact CE-CD1 3.8Å; M126-F262 HydrophobicContact CE-CG 4.14Å; M126-F262 HydrophobicContact CG-CB 3.94Å; M126-F262 HydrophobicContact CG-CD1 3.66Å; M126-F262 HydrophobicContact CG-CD2 3.61Å; M126-F262 HydrophobicContact CG-CE1 4.04Å; M126-F262 HydrophobicContact CG-CE2 4.06Å; M126-F262 HydrophobicContact CG-CG 3.43Å; M126-F262 VanDerWaalsContact CG-CG 3.43Å; M126-F262 HydrophobicContact CG-CZ 4.24Å; M126-F262 HydrophobicContact SD-CB 3.8Å; M126-F262 HydrophobicContact SD-CD1 4.19Å; M126-F262 HydrophobicContact SD-CG 3.94Å; M126-N266 VanDerWaalsContact CE-ND2 3.26Å; M126-N266 WeakPolarHBondContact CE-ND2 3.3Å |
| 127 | L | 95.2 | Very high | 93.2 | Very high | 35 Ų | 35 | 14.8 Ų | 14.8 | 18% | 0.183 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -69.4 | -42.3 | -179.1 | -70.6 | 173.2 | 0 | 0 | 0 | 112 | Y123 G124 S125 L129 T130 C131 V162 L165 V166 P216 | Y123-L127 WeakPolarHBondContact O-CB 3.46Å; Y123-L127 VanDerWaalsContact O-CG 3.31Å; Y123-L127 WeakPolarHBondContact O-CG 3.25Å; Y123-L127 PolarHBondContact O-N 3.37Å; G124-L127 PolarHBondContact O-N 2.89Å; S125-L127 PolarHBondContact O-N 3.28Å; L127-L129 PolarHBondContact O-N 3.4Å; L127-T130 CarbonylContact O-C 3.59Å; L127-T130 WeakPolarHBondContact O-CA 3.24Å; L127-T130 VanDerWaalsContact O-CB 3.3Å; L127-T130 WeakPolarHBondContact O-CB 3.46Å; L127-T130 PolarHBondContact O-N 3.49Å; L127-T130 VanDerWaalsContact O-N 3.16Å; L127-C131 PolarHBondContact O-N 2.97Å; L127-C131 PolarHBondContact O-SG 3.33Å; L127-V162 HydrophobicContact CB-CG1 3.82Å; L127-V162 HydrophobicContact CB-CG2 4.17Å; L127-V162 HydrophobicContact CD1-CG1 4.02Å; L127-L165 HydrophobicContact CD1-CD2 3.98Å; L127-V166 HydrophobicContact CD1-CG1 3.78Å; L127-P216 HydrophobicContact CD2-CG 3.85Å |
| 128 | F | 95.1 | Very high | 93 | Very high | 0 Ų | 0 | 15.6 Ų | 15.6 | 0% | 0 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -64.3 | -40.6 | 176.3 | -71.4 | -52.5 | 0 | 0 | 0 | 112.2 | F77 N80 L81 G124 S125 T130 C131 I132 C159 V162 W163 | F77-F128 HydrophobicContact CD1-CD1 4.42Å; N80-F128 HydrophobicContact CB-CD1 4.15Å; N80-F128 HydrophobicContact CB-CD2 4.47Å; N80-F128 HydrophobicContact CB-CE1 3.58Å; N80-F128 HydrophobicContact CB-CE2 3.95Å; N80-F128 HydrophobicContact CB-CZ 3.49Å; N80-F128 VanDerWaalsContact CB-CZ 3.49Å; L81-F128 HydrophobicContact CB-CB 4.19Å; L81-F128 HydrophobicContact CB-CD2 4.44Å; L81-F128 HydrophobicContact CD1-CB 4.31Å; G124-F128 WeakPolarHBondContact O-CB 3.29Å; G124-F128 WeakPolarHBondContact O-CD2 3.32Å; G124-F128 WeakPolarHBondContact O-CG 3.35Å; G124-F128 PolarHBondContact O-N 3.15Å; S125-F128 PolarHBondContact O-N 3.36Å; F128-T130 VanDerWaalsContact C-N 3.29Å; F128-T130 PolarHBondContact O-N 3.47Å; F128-C131 WeakPolarHBondContact O-CB 3.11Å; F128-C131 PolarHBondContact O-N 2.93Å; F128-I132 VanDerWaalsContact O-CG1 3.28Å; F128-I132 WeakPolarHBondContact O-CG1 3.42Å; F128-I132 PolarHBondContact O-N 3.31Å; F128-C159 HydrophobicContact CE1-CB 4.1Å; F128-V162 HydrophobicContact CD1-CG1 4.32Å; F128-V162 HydrophobicContact CE1-CB 4.01Å; F128-V162 HydrophobicContact CE1-CG1 3.82Å; F128-V162 HydrophobicContact CE1-CG2 4.47Å; F128-V162 HydrophobicContact CE2-CG1 4.02Å; F128-V162 HydrophobicContact CZ-CB 4.13Å; F128-V162 HydrophobicContact CZ-CG1 3.63Å; F128-W163 HydrophobicContact CE2-CZ2 4.45Å; F128-W163 AromaticContact CZ-NE1 3.75Å |
| 129 | L | 92.2 | Very high | 92.8 | Very high | 1 Ų | 1 | 15.6 Ų | 15.6 | 1% | 0.005 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -61.8 | -39.3 | 172.4 | -70.3 | 172.6 | 0 | 0 | 0 | 111.8 | L81 S125 L127 I132 S133 F258 F262 I310 | L81-L129 HydrophobicContact CD2-CD2 4.01Å; L81-L129 HydrophobicContact CD2-CG 4.43Å; S125-L129 WeakPolarHBondContact O-CB 3.48Å; S125-L129 WeakPolarHBondContact O-CG 3.28Å; S125-L129 PolarHBondContact O-N 3.01Å; L127-L129 PolarHBondContact O-N 3.4Å; L129-I132 HydrophobicContact CD2-CD1 4.45Å; L129-I132 PolarHBondContact O-N 3.45Å; L129-S133 PolarHBondContact O-N 3.42Å; L129-S133 PolarHBondContact O-OG 2.77Å; L129-F258 HydrophobicContact CB-CD2 4.5Å; L129-F258 HydrophobicContact CD1-CD2 4.41Å; L129-F262 HydrophobicContact CD1-CE2 3.59Å; L129-F262 HydrophobicContact CD1-CZ 4.34Å; L129-I310 HydrophobicContact CD2-CD1 3.51Å; L129-I310 HydrophobicContact CD2-CG2 4.38Å |
| 130 | T | 93.9 | Very high | 92.6 | Very high | 8 Ų | 8 | 15.7 Ų | 15.7 | 5% | 0.049 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -61.7 | -46.4 | 173.2 | -51.8 | 0 | 0 | 0 | 0 | 111.5 | M126 L127 F128 I132 S133 V134 P216 L219 N220 | M126-T130 WeakPolarHBondContact O-CB 3.36Å; M126-T130 PolarHBondContact O-N 2.97Å; M126-T130 PolarHBondContact O-OG1 3.19Å; L127-T130 CarbonylContact O-C 3.59Å; L127-T130 WeakPolarHBondContact O-CA 3.24Å; L127-T130 VanDerWaalsContact O-CB 3.3Å; L127-T130 WeakPolarHBondContact O-CB 3.46Å; L127-T130 PolarHBondContact O-N 3.49Å; L127-T130 VanDerWaalsContact O-N 3.16Å; F128-T130 VanDerWaalsContact C-N 3.29Å; F128-T130 PolarHBondContact O-N 3.47Å; T130-I132 VanDerWaalsContact C-N 3.29Å; T130-I132 PolarHBondContact O-N 2.72Å; T130-S133 PolarHBondContact O-N 3.45Å; T130-S133 VanDerWaalsContact O-N 3.16Å; T130-V134 HydrophobicContact CG2-CG2 4.42Å; T130-V134 WeakPolarHBondContact O-CG2 3.47Å; T130-V134 PolarHBondContact O-N 2.91Å; T130-P216 WeakPolarHBondContact OG1-CB 3.23Å; T130-L219 HydrophobicContact CG2-CB 3.63Å; T130-L219 HydrophobicContact CG2-CD1 3.86Å; T130-L219 HydrophobicContact CG2-CG 4.42Å; T130-N220 PolarHBondContact OG1-ND2 3.38Å |
| 131 | C | 94.7 | Very high | 92.4 | Very high | 22 Ų | 22 | 17 Ų | 17 | 15% | 0.149 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -58.9 | -40.9 | 176 | -67 | 0 | 0 | 0 | 0 | 111.5 | F77 L127 F128 V134 D135 | F77-C131 HydrophobicContact CD1-CB 3.62Å; F77-C131 HydrophobicContact CD2-CB 4.22Å; F77-C131 HydrophobicContact CE1-CB 3.7Å; F77-C131 HydrophobicContact CE2-CB 4.28Å; F77-C131 HydrophobicContact CG-CB 3.92Å; F77-C131 HydrophobicContact CZ-CB 4.04Å; L127-C131 PolarHBondContact O-N 2.97Å; L127-C131 PolarHBondContact O-SG 3.33Å; F128-C131 WeakPolarHBondContact O-CB 3.11Å; F128-C131 PolarHBondContact O-N 2.93Å; C131-V134 PolarHBondContact O-N 3.46Å; C131-D135 VanDerWaalsContact O-CB 3.24Å; C131-D135 WeakPolarHBondContact O-CB 3.35Å; C131-D135 PolarHBondContact O-N 3.17Å |
| 132 | I | 91.8 | Very high | 92 | Very high | 0 Ų | 0 | 22.6 Ų | 22.6 | 0% | 0 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -63.1 | -46.5 | 174.9 | -66.2 | 162.3 | 0 | 0 | 0 | 110.4 | T74 F77 I78 L81 F128 L129 T130 V134 D135 R136 | T74-I132 HydrophobicContact CG2-CG1 4.27Å; T74-I132 HydrophobicContact CG2-CG2 3.96Å; F77-I132 HydrophobicContact CB-CD1 4.27Å; F77-I132 HydrophobicContact CB-CG1 3.69Å; F77-I132 HydrophobicContact CG-CG1 4.46Å; I78-I132 HydrophobicContact CG1-CD1 3.73Å; I78-I132 HydrophobicContact CG1-CG1 4.44Å; L81-I132 HydrophobicContact CD2-CD1 4.49Å; F128-I132 VanDerWaalsContact O-CG1 3.28Å; F128-I132 WeakPolarHBondContact O-CG1 3.42Å; F128-I132 PolarHBondContact O-N 3.31Å; L129-I132 HydrophobicContact CD2-CD1 4.45Å; L129-I132 PolarHBondContact O-N 3.45Å; T130-I132 VanDerWaalsContact C-N 3.29Å; T130-I132 PolarHBondContact O-N 2.72Å; I132-V134 PolarHBondContact O-N 3.22Å; I132-D135 PolarHBondContact O-N 2.95Å; I132-R136 VanDerWaalsContact O-CG 3.25Å; I132-R136 WeakPolarHBondContact O-CG 3.5Å; I132-R136 PolarHBondContact O-N 2.98Å |
| 133 | S | 91.5 | Very high | 91.5 | Very high | 9 Ų | 9 | 24.9 Ų | 24.9 | 6% | 0.063 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -60.3 | -43 | 177.4 | -68.2 | 0 | 0 | 0 | 0 | 112.5 | L129 T130 R136 F137 N220 | L129-S133 PolarHBondContact O-N 3.42Å; L129-S133 PolarHBondContact O-OG 2.77Å; T130-S133 PolarHBondContact O-N 3.45Å; T130-S133 VanDerWaalsContact O-N 3.16Å; S133-R136 PolarHBondContact O-N 2.79Å; S133-F137 WeakPolarHBondContact O-CB 3.33Å; S133-F137 PolarHBondContact O-N 2.73Å; S133-N220 VanDerWaalsContact CB-OD1 3.29Å; S133-N220 WeakPolarHBondContact CB-OD1 3.48Å; S133-N220 PolarHBondContact OG-OD1 3.09Å |
| 134 | V | 93.3 | Very high | 91.1 | Very high | 44 Ų | 44 | 30.9 Ų | 30.9 | 27% | 0.267 | 16% | 0.155 | S | C | . | . | H | α-helix | trans | -66.8 | -43.7 | 176.2 | 172.7 | 0 | 0 | 0 | 0 | 111.2 | T130 C131 I132 R136 F137 L138 | T130-V134 HydrophobicContact CG2-CG2 4.42Å; T130-V134 WeakPolarHBondContact O-CG2 3.47Å; T130-V134 PolarHBondContact O-N 2.91Å; C131-V134 PolarHBondContact O-N 3.46Å; I132-V134 PolarHBondContact O-N 3.22Å; V134-R136 VanDerWaalsContact C-N 3.28Å; V134-R136 PolarHBondContact O-N 3.15Å; V134-F137 WeakPolarHBondContact O-CB 3.4Å; V134-F137 PolarHBondContact O-N 3.4Å; V134-L138 HydrophobicContact CG1-CD1 4.06Å; V134-L138 HydrophobicContact CG1-CG 4.33Å; V134-L138 WeakPolarHBondContact O-CG 3.32Å; V134-L138 PolarHBondContact O-N 3.39Å |
| 135 | D | 91.7 | Very high | 90.7 | Very high | 7 Ų | 7 | 40.4 Ų | 40.4 | 4% | 0.037 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -56.7 | -43.7 | 176.1 | 177.4 | 66.7 | 0 | 0 | 0 | 111.1 | T74 F77 C131 I132 L138 A139 R150 | T74-D135 PolarHBondContact OG1-OD2 3.4Å; F77-D135 HydrophobicContact CE2-CB 4.18Å; C131-D135 VanDerWaalsContact O-CB 3.24Å; C131-D135 WeakPolarHBondContact O-CB 3.35Å; C131-D135 PolarHBondContact O-N 3.17Å; I132-D135 PolarHBondContact O-N 2.95Å; D135-L138 PolarHBondContact O-N 3.13Å; D135-A139 WeakPolarHBondContact O-CB 3.3Å; D135-A139 PolarHBondContact O-N 3.34Å; D135-R150 VanDerWaalsContact CG-NH2 3.27Å; D135-R150 PolarHBondContact O-NE 3.25Å; D135-R150 IonicContact OD1-CZ 3.87Å; D135-R150 VanDerWaalsContact OD1-CZ 3.26Å; D135-R150 IonicContact OD1-NE 2.66Å; D135-R150 PolarHBondContact OD1-NE 3Å; D135-R150 IonicContact OD1-NH2 2.93Å; D135-R150 PolarHBondContact OD1-NH2 3.45Å; D135-R150 IonicContact OD2-CZ 2.71Å; D135-R150 IonicContact OD2-NE 2.74Å; D135-R150 IonicContact OD2-NH2 3.26Å; D135-R150 PolarHBondContact OD2-NH2 3.25Å |
| 136 | R | 89.3 | Confident | 90.4 | Very high | 49 Ų | 49 | 40.6 Ų | 40.6 | 19% | 0.185 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -69.3 | -39.2 | 177.2 | -64.8 | -58.2 | -175.7 | -172.9 | -3.6 | 112.9 | T74 I132 S133 V134 A139 I140 M250 T314 | T74-R136 PolarHBondContact OG1-NH2 3.42Å; I132-R136 VanDerWaalsContact O-CG 3.25Å; I132-R136 WeakPolarHBondContact O-CG 3.5Å; I132-R136 PolarHBondContact O-N 2.98Å; S133-R136 PolarHBondContact O-N 2.79Å; V134-R136 VanDerWaalsContact C-N 3.28Å; V134-R136 PolarHBondContact O-N 3.15Å; R136-A139 WeakPolarHBondContact O-CB 3.3Å; R136-A139 PolarHBondContact O-N 2.85Å; R136-I140 WeakPolarHBondContact O-CD1 3.34Å; R136-I140 WeakPolarHBondContact O-CG1 3.29Å; R136-I140 PolarHBondContact O-N 2.78Å; R136-I140 VanDerWaalsContact O-N 3.15Å; R136-M250 HydrophobicContact CB-CE 4.23Å; R136-M250 HydrophobicContact CG-CE 3.47Å; R136-M250 VanDerWaalsContact CG-CE 3.47Å; R136-M250 HydrophobicContact CG-SD 4.29Å; R136-M250 PolarHBondContact NE-SD 3.43Å; R136-M250 VanDerWaalsContact NE-SD 3.38Å; R136-T314 PolarHBondContact NH2-O 3.22Å |
| 137 | F | 91.4 | Very high | 90 | Very high | 39 Ų | 39 | 49.4 Ų | 49.4 | 17% | 0.171 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -57 | -51.9 | 171.4 | 164.7 | -98.4 | 0 | 0 | 0 | 111.9 | S133 V134 A139 I140 V141 Y142 C223 V226 V227 | S133-F137 WeakPolarHBondContact O-CB 3.33Å; S133-F137 PolarHBondContact O-N 2.73Å; V134-F137 WeakPolarHBondContact O-CB 3.4Å; V134-F137 PolarHBondContact O-N 3.4Å; F137-A139 VanDerWaalsContact C-N 3.32Å; F137-A139 PolarHBondContact O-N 3.07Å; F137-I140 PolarHBondContact O-N 2.89Å; F137-V141 HydrophobicContact CD2-CB 4.22Å; F137-V141 HydrophobicContact CD2-CG2 3.61Å; F137-V141 HydrophobicContact CE2-CB 4.04Å; F137-V141 HydrophobicContact CE2-CG1 4.13Å; F137-V141 HydrophobicContact CE2-CG2 3.74Å; F137-V141 HydrophobicContact CG-CG2 4.45Å; F137-V141 HydrophobicContact CZ-CG1 4.46Å; F137-V141 VanDerWaalsContact O-CB 3.3Å; F137-V141 WeakPolarHBondContact O-CB 3.41Å; F137-V141 WeakPolarHBondContact O-CG2 3.24Å; F137-V141 PolarHBondContact O-N 3.29Å; F137-Y142 HydrophobicContact CE1-CD2 4.22Å; F137-Y142 AromaticContact CE1-CE2 3.9Å; F137-Y142 HydrophobicContact CE1-CE2 3.9Å; F137-Y142 HydrophobicContact CE2-CE2 4.46Å; F137-Y142 HydrophobicContact CZ-CD2 4.28Å; F137-Y142 AromaticContact CZ-CE2 3.61Å; F137-Y142 HydrophobicContact CZ-CE2 3.61Å; F137-C223 HydrophobicContact CB-CB 3.93Å; F137-C223 HydrophobicContact CG-CB 4.38Å; F137-V226 HydrophobicContact CD2-CB 4.13Å; F137-V226 HydrophobicContact CD2-CG1 4.19Å; F137-V226 HydrophobicContact CE2-CB 3.93Å; F137-V226 HydrophobicContact CE2-CG1 3.71Å; F137-V226 HydrophobicContact CE2-CG2 4.47Å; F137-V227 VanDerWaalsContact CA-CG2 3.44Å; F137-V227 HydrophobicContact CB-CG2 3.9Å; F137-V227 HydrophobicContact CD2-CG2 4.3Å |
| 138 | L | 91.4 | Very high | 89.6 | Confident | 34 Ų | 34 | 52.9 Ų | 52.9 | 18% | 0.178 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -61.7 | -41 | 179.2 | -69.8 | 175.9 | 0 | 0 | 0 | 111.9 | V134 D135 I140 Y142 S146 I149 R150 | V134-L138 HydrophobicContact CG1-CD1 4.06Å; V134-L138 HydrophobicContact CG1-CG 4.33Å; V134-L138 WeakPolarHBondContact O-CG 3.32Å; V134-L138 PolarHBondContact O-N 3.39Å; D135-L138 PolarHBondContact O-N 3.13Å; L138-I140 VanDerWaalsContact C-N 3.33Å; L138-I140 PolarHBondContact O-N 3.46Å; L138-Y142 HydrophobicContact CD2-CD2 4.37Å; L138-Y142 CarbonylContact O-C 3.23Å; L138-Y142 VanDerWaalsContact O-C 3.23Å; L138-Y142 WeakPolarHBondContact O-CA 3.09Å; L138-Y142 PolarHBondContact O-N 3.27Å; L138-Y142 VanDerWaalsContact O-N 3.13Å; L138-S146 WeakPolarHBondContact O-CB 3.45Å; L138-S146 PolarHBondContact O-OG 3.45Å; L138-S146 VanDerWaalsContact O-OG 3.09Å; L138-I149 HydrophobicContact CD1-CG2 4.36Å; L138-R150 HydrophobicContact CB-CG 4.24Å; L138-R150 HydrophobicContact CD1-CG 4.33Å |
| 139 | A | 88.3 | Confident | 89.4 | Confident | 22 Ų | 22 | 57.2 Ų | 57.2 | 18% | 0.182 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -58.2 | -42.2 | 178 | 0 | 0 | 0 | 0 | 0 | 113.6 | D135 R136 F137 | D135-A139 WeakPolarHBondContact O-CB 3.3Å; D135-A139 PolarHBondContact O-N 3.34Å; R136-A139 WeakPolarHBondContact O-CB 3.3Å; R136-A139 PolarHBondContact O-N 2.85Å; F137-A139 VanDerWaalsContact C-N 3.32Å; F137-A139 PolarHBondContact O-N 3.07Å |
| 140 | I | 86.6 | Confident | 89.4 | Confident | 25 Ų | 25 | 59.5 Ų | 59.5 | 13% | 0.128 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -95.8 | -40.1 | -168.1 | -65.6 | 163 | 0 | 0 | 0 | 111.3 | R136 F137 L138 V227 T230 L231 I240 V247 | R136-I140 WeakPolarHBondContact O-CD1 3.34Å; R136-I140 WeakPolarHBondContact O-CG1 3.29Å; R136-I140 PolarHBondContact O-N 2.78Å; R136-I140 VanDerWaalsContact O-N 3.15Å; F137-I140 PolarHBondContact O-N 2.89Å; L138-I140 VanDerWaalsContact C-N 3.33Å; L138-I140 PolarHBondContact O-N 3.46Å; I140-V227 HydrophobicContact CB-CG1 4.47Å; I140-V227 HydrophobicContact CD1-CG1 3.46Å; I140-V227 VanDerWaalsContact CD1-CG1 3.46Å; I140-V227 HydrophobicContact CG2-CG1 4.32Å; I140-T230 HydrophobicContact CG2-CG2 4.06Å; I140-L231 HydrophobicContact CG2-CD2 4.19Å; I140-L231 HydrophobicContact CG2-CG 4.49Å; I140-I240 HydrophobicContact CG2-CD1 4.37Å; I140-V247 HydrophobicContact CD1-CG1 3.53Å |
| 141 | V | 88.1 | Confident | 89.3 | Confident | 33 Ų | 33 | 61.2 Ų | 61.2 | 20% | 0.2 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -85 | -33 | -175.4 | -175.3 | 0 | 0 | 0 | 0 | 111.2 | F137 P143 V226 V227 | F137-V141 HydrophobicContact CD2-CB 4.22Å; F137-V141 HydrophobicContact CD2-CG2 3.61Å; F137-V141 HydrophobicContact CE2-CB 4.04Å; F137-V141 HydrophobicContact CE2-CG1 4.13Å; F137-V141 HydrophobicContact CE2-CG2 3.74Å; F137-V141 HydrophobicContact CG-CG2 4.45Å; F137-V141 HydrophobicContact CZ-CG1 4.46Å; F137-V141 VanDerWaalsContact O-CB 3.3Å; F137-V141 WeakPolarHBondContact O-CB 3.41Å; F137-V141 WeakPolarHBondContact O-CG2 3.24Å; F137-V141 PolarHBondContact O-N 3.29Å; V141-P143 VanDerWaalsContact C-CD 3.5Å; V141-V226 HydrophobicContact CG1-CG1 4.49Å; V141-V226 HydrophobicContact CG2-CG1 3.97Å; V141-V227 HydrophobicContact CG2-CG2 4.5Å |
| 142 | Y | 87.4 | Confident | 89.1 | Confident | 116 Ų | 116 | 66.1 Ų | 66.1 | 46% | 0.455 | 31% | 0.305 | S | S | . | . | trans | -130.7 | 59.4 | -177.4 | -57.8 | -70.9 | 0 | 0 | 0 | 112.4 | F137 L138 F144 R145 S146 | F137-Y142 HydrophobicContact CE1-CD2 4.22Å; F137-Y142 AromaticContact CE1-CE2 3.9Å; F137-Y142 HydrophobicContact CE1-CE2 3.9Å; F137-Y142 HydrophobicContact CE2-CE2 4.46Å; F137-Y142 HydrophobicContact CZ-CD2 4.28Å; F137-Y142 AromaticContact CZ-CE2 3.61Å; F137-Y142 HydrophobicContact CZ-CE2 3.61Å; L138-Y142 HydrophobicContact CD2-CD2 4.37Å; L138-Y142 CarbonylContact O-C 3.23Å; L138-Y142 VanDerWaalsContact O-C 3.23Å; L138-Y142 WeakPolarHBondContact O-CA 3.09Å; L138-Y142 PolarHBondContact O-N 3.27Å; L138-Y142 VanDerWaalsContact O-N 3.13Å; Y142-F144 VanDerWaalsContact C-N 3.29Å; Y142-F144 PolarHBondContact O-N 2.94Å; Y142-F144 VanDerWaalsContact O-N 3.17Å; Y142-R145 PolarHBondContact O-N 3.49Å; Y142-S146 WeakPolarHBondContact O-CB 3.45Å; Y142-S146 PolarHBondContact O-N 3.43Å; Y142-S146 PolarHBondContact O-OG 3.28Å | ||
| 143 | P | 82.8 | Confident | 89.2 | Confident | 50 Ų | 50 | 75.3 Ų | 75.3 | 33% | 0.325 | 34% | 0.34 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.7 | -31 | -169.9 | 23.4 | -34.6 | 0 | 0 | 0 | 114.7 | V141 | V141-P143 VanDerWaalsContact C-CD 3.5Š|
| 144 | F | 84.9 | Confident | 89.3 | Confident | 154 Ų | 154 | 77.8 Ų | 77.8 | 68% | 0.675 | 35% | 0.352 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87 | -49.8 | 179 | -58.2 | -69.9 | 0 | 0 | 0 | 112.3 | Y142 S146 R147 | Y142-F144 VanDerWaalsContact C-N 3.29Å; Y142-F144 PolarHBondContact O-N 2.94Å; Y142-F144 VanDerWaalsContact O-N 3.17Å; F144-S146 VanDerWaalsContact C-N 3.31Å; F144-S146 PolarHBondContact O-N 3.28Å; F144-R147 PolarHBondContact O-N 3.45Å |
| 145 | R | 86.3 | Confident | 89.4 | Confident | 201 Ų | 201 | 75.9 Ų | 75.9 | 76% | 0.758 | 34% | 0.341 | S | S | * | . | G | 310 helix | trans | -68.3 | -29.2 | -177.9 | -168.9 | 175.4 | -178.5 | 170.1 | 1 | 112.7 | Y142 R147 T148 | Y142-R145 PolarHBondContact O-N 3.49Å; R145-R147 VanDerWaalsContact C-N 3.3Å; R145-R147 PolarHBondContact O-N 2.87Å; R145-T148 PolarHBondContact O-OG1 2.89Å |
| 146 | S | 88 | Confident | 89.5 | Confident | 3 Ų | 3 | 77.8 Ų | 77.8 | 2% | 0.021 | 36% | 0.358 | C | S | . | . | G | 310 helix | trans | -75.3 | -14.1 | -178.7 | 66.8 | 0 | 0 | 0 | 0 | 114.2 | L138 Y142 F144 T148 I149 R150 | L138-S146 WeakPolarHBondContact O-CB 3.45Å; L138-S146 PolarHBondContact O-OG 3.45Å; L138-S146 VanDerWaalsContact O-OG 3.09Å; Y142-S146 WeakPolarHBondContact O-CB 3.45Å; Y142-S146 PolarHBondContact O-N 3.43Å; Y142-S146 PolarHBondContact O-OG 3.28Å; F144-S146 VanDerWaalsContact C-N 3.31Å; F144-S146 PolarHBondContact O-N 3.28Å; S146-T148 VanDerWaalsContact C-N 3.26Å; S146-T148 PolarHBondContact O-N 3.48Å; S146-I149 PolarHBondContact O-N 2.93Å; S146-I149 VanDerWaalsContact O-N 3.07Å; S146-R150 VanDerWaalsContact O-CB 3.32Å; S146-R150 WeakPolarHBondContact O-CB 3.39Å; S146-R150 WeakPolarHBondContact O-CG 3.5Å; S146-R150 PolarHBondContact O-N 2.9Å |
| 147 | R | 85.3 | Confident | 89.9 | Confident | 185 Ų | 185 | 80.1 Ų | 80.1 | 70% | 0.698 | 37% | 0.373 | S | S | * | . | G | 310 helix | trans | -58.5 | -34.9 | -178.5 | -75 | -177.1 | 176.2 | -169.8 | -2.5 | 113.6 | F144 R145 | F144-R147 PolarHBondContact O-N 3.45Å; R145-R147 VanDerWaalsContact C-N 3.3Å; R145-R147 PolarHBondContact O-N 2.87Å |
| 148 | T | 88.6 | Confident | 90.2 | Very high | 109 Ų | 109 | 81.4 Ų | 81.4 | 67% | 0.669 | 38% | 0.384 | S | S | * | . | G | 310 helix | trans | -78.6 | -24.7 | 178.9 | 53.1 | 0 | 0 | 0 | 0 | 112.9 | R145 S146 T151 N154 | R145-T148 PolarHBondContact O-OG1 2.89Å; S146-T148 VanDerWaalsContact C-N 3.26Å; S146-T148 PolarHBondContact O-N 3.48Å; T148-T151 WeakPolarHBondContact O-CG2 3.32Å; T148-N154 PolarHBondContact O-ND2 3.3Å |
| 149 | I | 90.3 | Very high | 90.5 | Very high | 91 Ų | 91 | 80 Ų | 80 | 47% | 0.467 | 38% | 0.376 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.4 | -45.5 | 180 | -59.2 | 175 | 0 | 0 | 0 | 110.3 | L138 S146 T151 N154 | L138-I149 HydrophobicContact CD1-CG2 4.36Å; S146-I149 PolarHBondContact O-N 2.93Å; S146-I149 VanDerWaalsContact O-N 3.07Å; I149-T151 PolarHBondContact O-N 3.21Å; I149-N154 VanDerWaalsContact O-CB 3.3Å; I149-N154 WeakPolarHBondContact O-CB 3.39Å; I149-N154 PolarHBondContact O-ND2 2.84Å |
| 150 | R | 91.8 | Very high | 90.9 | Very high | 48 Ų | 48 | 81.2 Ų | 81.2 | 18% | 0.181 | 39% | 0.387 | C | S | . | . | S | Bend | trans | -80.9 | 67 | -178.7 | -61.7 | 178.9 | 71.4 | -135.5 | -3.4 | 110.1 | E73 D135 L138 S146 | E73-R150 HydrophobicContact CG-CB 4.39Å; E73-R150 VanDerWaalsContact CG-O 3.32Å; E73-R150 WeakPolarHBondContact CG-O 3.45Å; D135-R150 VanDerWaalsContact CG-NH2 3.27Å; D135-R150 PolarHBondContact O-NE 3.25Å; D135-R150 IonicContact OD1-CZ 3.87Å; D135-R150 VanDerWaalsContact OD1-CZ 3.26Å; D135-R150 IonicContact OD1-NE 2.66Å; D135-R150 PolarHBondContact OD1-NE 3Å; D135-R150 IonicContact OD1-NH2 2.93Å; D135-R150 PolarHBondContact OD1-NH2 3.45Å; D135-R150 IonicContact OD2-CZ 2.71Å; D135-R150 IonicContact OD2-NE 2.74Å; D135-R150 IonicContact OD2-NH2 3.26Å; D135-R150 PolarHBondContact OD2-NH2 3.25Å; L138-R150 HydrophobicContact CB-CG 4.24Å; L138-R150 HydrophobicContact CD1-CG 4.33Å; S146-R150 VanDerWaalsContact O-CB 3.32Å; S146-R150 WeakPolarHBondContact O-CB 3.39Å; S146-R150 WeakPolarHBondContact O-CG 3.5Å; S146-R150 PolarHBondContact O-N 2.9Å |
| 151 | T | 91.8 | Very high | 91.5 | Very high | 44 Ų | 44 | 81.9 Ų | 81.9 | 27% | 0.27 | 40% | 0.4 | S | S | . | . | trans | -108.3 | 156.6 | 172 | 70.2 | 0 | 0 | 0 | 0 | 109.7 | T148 I149 R153 N154 S155 | T148-T151 WeakPolarHBondContact O-CG2 3.32Å; I149-T151 PolarHBondContact O-N 3.21Å; T151-R153 VanDerWaalsContact C-N 3.27Å; T151-R153 PolarHBondContact O-N 3.16Å; T151-N154 PolarHBondContact O-N 3.21Å; T151-N154 WeakPolarHBondContact OG1-CB 3.23Å; T151-N154 PolarHBondContact OG1-N 2.88Å; T151-N154 PolarHBondContact OG1-ND2 3.1Å; T151-N154 PolarHBondContact OG1-OD1 3.39Å; T151-S155 WeakPolarHBondContact O-CB 3.41Å; T151-S155 PolarHBondContact O-N 3.46Å; T151-S155 PolarHBondContact O-OG 2.96Å | ||
| 152 | R | 90.9 | Very high | 91.9 | Very high | 125 Ų | 125 | 80.9 Ų | 80.9 | 47% | 0.472 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -59.9 | -39.8 | 175.3 | -64.8 | -169.3 | -167.3 | 155.3 | 11.8 | 112.2 | M70 R71 I76 S155 A156 | M70-R152 VanDerWaalsContact O-CZ 3.22Å; M70-R152 PolarHBondContact O-NE 2.96Å; M70-R152 PolarHBondContact O-NH1 3.41Å; R71-R152 VanDerWaalsContact CA-NH2 3.31Å; R71-R152 PolarHBondContact O-NE 2.7Å; R71-R152 PolarHBondContact O-NH2 3.25Å; I76-R152 HydrophobicContact CD1-CB 3.78Å; I76-R152 HydrophobicContact CD1-CG 4.01Å; R152-S155 PolarHBondContact O-N 3.29Å; R152-A156 WeakPolarHBondContact O-CB 3.44Å; R152-A156 PolarHBondContact O-N 2.98Å |
| 153 | R | 92.9 | Very high | 92.4 | Very high | 194 Ų | 194 | 77.2 Ų | 77.2 | 73% | 0.732 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -58.6 | -50.8 | 176.6 | -177.7 | -179.9 | 177.6 | -176.2 | -0.4 | 110.8 | T151 S155 A156 I157 | T151-R153 VanDerWaalsContact C-N 3.27Å; T151-R153 PolarHBondContact O-N 3.16Å; R153-S155 VanDerWaalsContact C-N 3.33Å; R153-S155 PolarHBondContact O-N 3.45Å; R153-A156 PolarHBondContact O-N 3.44Å; R153-I157 HydrophobicContact CG-CD1 3.92Å; R153-I157 VanDerWaalsContact O-CG1 3.29Å; R153-I157 WeakPolarHBondContact O-CG1 3.48Å; R153-I157 PolarHBondContact O-N 3.04Å |
| 154 | N | 94.8 | Very high | 93.1 | Very high | 60 Ų | 60 | 80.5 Ų | 80.5 | 32% | 0.321 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -65 | -39.9 | -180 | -66.2 | -6.4 | 0 | 0 | 0 | 111.4 | T148 I149 T151 A156 I157 V158 | T148-N154 PolarHBondContact O-ND2 3.3Å; I149-N154 VanDerWaalsContact O-CB 3.3Å; I149-N154 WeakPolarHBondContact O-CB 3.39Å; I149-N154 PolarHBondContact O-ND2 2.84Å; T151-N154 PolarHBondContact O-N 3.21Å; T151-N154 WeakPolarHBondContact OG1-CB 3.23Å; T151-N154 PolarHBondContact OG1-N 2.88Å; T151-N154 PolarHBondContact OG1-ND2 3.1Å; T151-N154 PolarHBondContact OG1-OD1 3.39Å; N154-A156 VanDerWaalsContact C-N 3.34Å; N154-A156 PolarHBondContact O-N 3.33Å; N154-I157 PolarHBondContact O-N 3.1Å; N154-V158 VanDerWaalsContact O-CG2 3.3Å; N154-V158 WeakPolarHBondContact O-CG2 3.29Å; N154-V158 PolarHBondContact O-N 3.22Å |
| 155 | S | 94.7 | Very high | 93.6 | Very high | 5 Ų | 5 | 78.2 Ų | 78.2 | 4% | 0.035 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -62.2 | -41.2 | 176.5 | -53.2 | 0 | 0 | 0 | 0 | 111.9 | T151 R152 R153 V158 C159 | T151-S155 WeakPolarHBondContact O-CB 3.41Å; T151-S155 PolarHBondContact O-N 3.46Å; T151-S155 PolarHBondContact O-OG 2.96Å; R152-S155 PolarHBondContact O-N 3.29Å; R153-S155 VanDerWaalsContact C-N 3.33Å; R153-S155 PolarHBondContact O-N 3.45Å; S155-V158 PolarHBondContact O-N 3.24Å; S155-C159 PolarHBondContact O-N 3.32Å; S155-C159 PolarHBondContact O-SG 3.34Å |
| 156 | A | 94.8 | Very high | 94 | Very high | 47 Ų | 47 | 69 Ų | 69 | 39% | 0.388 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -66.7 | -41 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | R152 R153 N154 C159 A160 | R152-A156 WeakPolarHBondContact O-CB 3.44Å; R152-A156 PolarHBondContact O-N 2.98Å; R153-A156 PolarHBondContact O-N 3.44Å; N154-A156 VanDerWaalsContact C-N 3.34Å; N154-A156 PolarHBondContact O-N 3.33Å; A156-C159 PolarHBondContact O-N 3.22Å; A156-A160 PolarHBondContact O-N 2.94Å |
| 157 | I | 97.1 | Very high | 94.3 | Very high | 98 Ų | 98 | 72.1 Ų | 72.1 | 50% | 0.503 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -61 | -45.1 | 174.4 | -69.1 | 166.2 | 0 | 0 | 0 | 110.5 | R153 N154 C159 A160 G161 | R153-I157 HydrophobicContact CG-CD1 3.92Å; R153-I157 VanDerWaalsContact O-CG1 3.29Å; R153-I157 WeakPolarHBondContact O-CG1 3.48Å; R153-I157 PolarHBondContact O-N 3.04Å; N154-I157 PolarHBondContact O-N 3.1Å; I157-C159 VanDerWaalsContact C-N 3.35Å; I157-C159 PolarHBondContact O-N 3.29Å; I157-A160 PolarHBondContact O-N 2.9Å; I157-G161 PolarHBondContact O-N 3.43Å |
| 158 | V | 97.4 | Very high | 94.6 | Very high | 66 Ų | 66 | 66 Ų | 66 | 40% | 0.4 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -61 | -44.7 | 176 | 171.6 | 0 | 0 | 0 | 0 | 110.6 | F77 N154 S155 A160 G161 V162 | F77-V158 HydrophobicContact CE1-CB 4.13Å; F77-V158 HydrophobicContact CE1-CG1 3.87Å; F77-V158 HydrophobicContact CZ-CG1 4.4Å; N154-V158 VanDerWaalsContact O-CG2 3.3Å; N154-V158 WeakPolarHBondContact O-CG2 3.29Å; N154-V158 PolarHBondContact O-N 3.22Å; S155-V158 PolarHBondContact O-N 3.24Å; V158-A160 PolarHBondContact O-N 3.45Å; V158-G161 PolarHBondContact O-N 2.93Å; V158-V162 WeakPolarHBondContact O-CG2 3.26Å; V158-V162 PolarHBondContact O-N 3.38Å |
| 159 | C | 97.5 | Very high | 94.5 | Very high | 3 Ų | 3 | 62.3 Ų | 62.3 | 2% | 0.02 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -60.5 | -44.2 | 176.4 | -67.1 | 0 | 0 | 0 | 0 | 112.1 | F77 F128 S155 A156 I157 G161 V162 W163 | F77-C159 WeakPolarHBondContact CD1-SG 3.36Å; F128-C159 HydrophobicContact CE1-CB 4.1Å; S155-C159 PolarHBondContact O-N 3.32Å; S155-C159 PolarHBondContact O-SG 3.34Å; A156-C159 PolarHBondContact O-N 3.22Å; I157-C159 VanDerWaalsContact C-N 3.35Å; I157-C159 PolarHBondContact O-N 3.29Å; C159-G161 VanDerWaalsContact C-N 3.31Å; C159-G161 PolarHBondContact O-N 3.28Å; C159-V162 PolarHBondContact O-N 2.75Å; C159-W163 PolarHBondContact O-N 3.49Å |
| 160 | A | 98.1 | Very high | 94.4 | Very high | 49 Ų | 49 | 58 Ų | 58 | 41% | 0.405 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -60.3 | -42.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | A156 I157 V158 W163 I164 | A156-A160 PolarHBondContact O-N 2.94Å; I157-A160 PolarHBondContact O-N 2.9Å; V158-A160 PolarHBondContact O-N 3.45Å; A160-W163 PolarHBondContact O-N 3.31Å; A160-I164 VanDerWaalsContact O-CG1 3.27Å; A160-I164 WeakPolarHBondContact O-CG1 3.39Å; A160-I164 PolarHBondContact O-N 3.22Å |
| 161 | G | 98.1 | Very high | 94.3 | Very high | 39 Ų | 39 | 59.9 Ų | 59.9 | 40% | 0.402 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -60.8 | -43.9 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113 | I157 V158 C159 I164 L165 | I157-G161 PolarHBondContact O-N 3.43Å; V158-G161 PolarHBondContact O-N 2.93Å; C159-G161 VanDerWaalsContact C-N 3.31Å; C159-G161 PolarHBondContact O-N 3.28Å; G161-I164 PolarHBondContact O-N 2.88Å; G161-L165 WeakPolarHBondContact O-CB 3.43Å; G161-L165 PolarHBondContact O-N 2.95Å |
| 162 | V | 97.4 | Very high | 94 | Very high | 12 Ų | 12 | 60.6 Ų | 60.6 | 7% | 0.073 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -59.6 | -49.8 | 174.6 | 170.9 | 0 | 0 | 0 | 0 | 110.4 | L127 F128 V158 C159 I164 L165 V166 | L127-V162 HydrophobicContact CB-CG1 3.82Å; L127-V162 HydrophobicContact CB-CG2 4.17Å; L127-V162 HydrophobicContact CD1-CG1 4.02Å; F128-V162 HydrophobicContact CD1-CG1 4.32Å; F128-V162 HydrophobicContact CE1-CB 4.01Å; F128-V162 HydrophobicContact CE1-CG1 3.82Å; F128-V162 HydrophobicContact CE1-CG2 4.47Å; F128-V162 HydrophobicContact CE2-CG1 4.02Å; F128-V162 HydrophobicContact CZ-CB 4.13Å; F128-V162 HydrophobicContact CZ-CG1 3.63Å; V158-V162 WeakPolarHBondContact O-CG2 3.26Å; V158-V162 PolarHBondContact O-N 3.38Å; C159-V162 PolarHBondContact O-N 2.75Å; V162-I164 PolarHBondContact O-N 2.87Å; V162-L165 WeakPolarHBondContact O-CB 3.35Å; V162-L165 PolarHBondContact O-N 2.87Å; V162-V166 HydrophobicContact CG1-CG1 4.39Å; V162-V166 WeakPolarHBondContact O-CG2 3.29Å; V162-V166 PolarHBondContact O-N 3.44Å |
| 163 | W | 98.1 | Very high | 93.4 | Very high | 38 Ų | 38 | 56 Ų | 56 | 14% | 0.144 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -57.1 | -48.4 | 178 | -82.8 | 113.9 | 0 | 0 | 0 | 112.7 | N80 L83 L87 T120 F128 C159 A160 L165 V166 L167 | N80-W163 PolarHBondContact OD1-NE1 2.93Å; L83-W163 HydrophobicContact CB-CZ2 4.43Å; L83-W163 HydrophobicContact CD2-CZ2 4.05Å; L83-W163 HydrophobicContact CG-CZ2 4.19Å; L87-W163 HydrophobicContact CD1-CH2 3.81Å; L87-W163 HydrophobicContact CD1-CZ3 4.11Å; T120-W163 HydrophobicContact CG2-CE3 4.17Å; T120-W163 HydrophobicContact CG2-CH2 4.48Å; T120-W163 HydrophobicContact CG2-CZ3 3.57Å; F128-W163 HydrophobicContact CE2-CZ2 4.45Å; F128-W163 AromaticContact CZ-NE1 3.75Å; C159-W163 PolarHBondContact O-N 3.49Å; A160-W163 PolarHBondContact O-N 3.31Å; W163-L165 VanDerWaalsContact C-N 3.29Å; W163-L165 PolarHBondContact O-N 2.96Å; W163-V166 HydrophobicContact CE3-CG2 4.42Å; W163-V166 PolarHBondContact O-N 3.46Å; W163-L167 HydrophobicContact CB-CD1 4.44Å; W163-L167 HydrophobicContact CE3-CD1 3.94Å; W163-L167 HydrophobicContact CE3-CG 4.1Å; W163-L167 WeakPolarHBondContact O-CB 3.18Å; W163-L167 VanDerWaalsContact O-CG 3.27Å; W163-L167 WeakPolarHBondContact O-CG 3.28Å; W163-L167 PolarHBondContact O-N 3Å |
| 164 | I | 97.6 | Very high | 92.8 | Very high | 119 Ų | 119 | 46.8 Ų | 46.8 | 61% | 0.61 | 29% | 0.29 | S | S | * | . | H | α-helix | trans | -58.4 | -45.5 | 178.1 | -69.9 | 165.3 | 0 | 0 | 0 | 110.2 | A160 G161 V162 S168 | A160-I164 VanDerWaalsContact O-CG1 3.27Å; A160-I164 WeakPolarHBondContact O-CG1 3.39Å; A160-I164 PolarHBondContact O-N 3.22Å; G161-I164 PolarHBondContact O-N 2.88Å; V162-I164 PolarHBondContact O-N 2.87Å; I164-S168 WeakPolarHBondContact O-CB 3.43Å; I164-S168 PolarHBondContact O-N 3.08Å; I164-S168 PolarHBondContact O-OG 3.21Å |
| 165 | L | 94.4 | Very high | 92 | Very high | 106 Ų | 106 | 49.1 Ų | 49.1 | 56% | 0.555 | 30% | 0.302 | S | S | * | . | H | α-helix | trans | -62.3 | -50.7 | -179.8 | -179.9 | 63.6 | 0 | 0 | 0 | 112 | L127 G161 V162 W163 S168 G169 | L127-L165 HydrophobicContact CD1-CD2 3.98Å; G161-L165 WeakPolarHBondContact O-CB 3.43Å; G161-L165 PolarHBondContact O-N 2.95Å; V162-L165 WeakPolarHBondContact O-CB 3.35Å; V162-L165 PolarHBondContact O-N 2.87Å; W163-L165 VanDerWaalsContact C-N 3.29Å; W163-L165 PolarHBondContact O-N 2.96Å; L165-S168 PolarHBondContact O-OG 3.43Å; L165-G169 PolarHBondContact O-N 3.44Å |
| 166 | V | 94.5 | Very high | 90.8 | Very high | 9 Ų | 9 | 54.1 Ų | 54.1 | 6% | 0.055 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -75.1 | -34.5 | -174.6 | -57.8 | 0 | 0 | 0 | 0 | 112.6 | T120 L127 V162 W163 G170 | T120-V166 HydrophobicContact CG2-CG2 3.82Å; L127-V166 HydrophobicContact CD1-CG1 3.78Å; V162-V166 HydrophobicContact CG1-CG1 4.39Å; V162-V166 WeakPolarHBondContact O-CG2 3.29Å; V162-V166 PolarHBondContact O-N 3.44Å; W163-V166 HydrophobicContact CE3-CG2 4.42Å; W163-V166 PolarHBondContact O-N 3.46Å; V166-G170 PolarHBondContact O-N 3.38Å |
| 167 | L | 94.8 | Very high | 89.5 | Confident | 68 Ų | 68 | 51.9 Ų | 51.9 | 36% | 0.356 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -69.4 | -47 | 175.2 | -73.2 | 168.6 | 0 | 0 | 0 | 111.1 | T120 W163 G169 G170 I171 | T120-L167 HydrophobicContact CG2-CD2 4.12Å; W163-L167 HydrophobicContact CB-CD1 4.44Å; W163-L167 HydrophobicContact CE3-CD1 3.94Å; W163-L167 HydrophobicContact CE3-CG 4.1Å; W163-L167 WeakPolarHBondContact O-CB 3.18Å; W163-L167 VanDerWaalsContact O-CG 3.27Å; W163-L167 WeakPolarHBondContact O-CG 3.28Å; W163-L167 PolarHBondContact O-N 3Å; L167-G169 VanDerWaalsContact C-N 3.32Å; L167-G169 PolarHBondContact O-N 2.99Å; L167-G170 PolarHBondContact O-N 3.36Å; L167-I171 VanDerWaalsContact O-CB 3.31Å; L167-I171 WeakPolarHBondContact O-CB 3.35Å; L167-I171 WeakPolarHBondContact O-CD1 3.29Å; L167-I171 WeakPolarHBondContact O-CG1 3.43Å; L167-I171 PolarHBondContact O-N 2.77Å |
| 168 | S | 91.3 | Very high | 87.9 | Confident | 57 Ų | 57 | 51.2 Ų | 51.2 | 40% | 0.399 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -60.8 | -43.1 | 177.9 | 60.4 | 0 | 0 | 0 | 0 | 111.5 | I164 L165 S172 | I164-S168 WeakPolarHBondContact O-CB 3.43Å; I164-S168 PolarHBondContact O-N 3.08Å; I164-S168 PolarHBondContact O-OG 3.21Å; L165-S168 PolarHBondContact O-OG 3.43Å; S168-S172 VanDerWaalsContact O-CB 3.22Å; S168-S172 WeakPolarHBondContact O-CB 3.3Å; S168-S172 PolarHBondContact O-N 3.21Å; S168-S172 PolarHBondContact O-OG 3.41Å |
| 169 | G | 87.3 | Confident | 86.7 | Confident | 30 Ų | 30 | 49.6 Ų | 49.6 | 31% | 0.309 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -63.1 | -48.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | L165 L167 S172 A173 | L165-G169 PolarHBondContact O-N 3.44Å; L167-G169 VanDerWaalsContact C-N 3.32Å; L167-G169 PolarHBondContact O-N 2.99Å; G169-S172 PolarHBondContact O-N 3.34Å; G169-A173 WeakPolarHBondContact O-CB 3.46Å; G169-A173 PolarHBondContact O-N 2.77Å |
| 170 | G | 88 | Confident | 85.5 | Confident | 2 Ų | 2 | 52.3 Ų | 52.3 | 2% | 0.021 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -63.2 | -43.3 | -179.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | T116 V166 L167 S174 | T116-G170 PolarHBondContact OG1-O 2.88Å; V166-G170 PolarHBondContact O-N 3.38Å; L167-G170 PolarHBondContact O-N 3.36Å; G170-S174 VanDerWaalsContact O-CB 3.27Å; G170-S174 WeakPolarHBondContact O-CB 3.49Å; G170-S174 PolarHBondContact O-N 3.22Å; G170-S174 PolarHBondContact O-OG 3.21Å |
| 171 | I | 88.4 | Confident | 84.3 | Confident | 86 Ų | 86 | 55 Ų | 55 | 44% | 0.441 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -64.4 | -49.7 | 175.2 | -67.9 | 166.8 | 0 | 0 | 0 | 109.4 | T116 L167 A173 S174 L175 | T116-I171 HydrophobicContact CG2-CG1 3.79Å; L167-I171 VanDerWaalsContact O-CB 3.31Å; L167-I171 WeakPolarHBondContact O-CB 3.35Å; L167-I171 WeakPolarHBondContact O-CD1 3.29Å; L167-I171 WeakPolarHBondContact O-CG1 3.43Å; L167-I171 PolarHBondContact O-N 2.77Å; I171-A173 VanDerWaalsContact C-N 3.33Å; I171-A173 PolarHBondContact O-N 3.26Å; I171-S174 CarbonylContact O-C 3.56Å; I171-S174 PolarHBondContact O-N 2.91Å; I171-S174 VanDerWaalsContact O-N 3.09Å; I171-L175 HydrophobicContact CG2-CD1 4.27Å; I171-L175 HydrophobicContact CG2-CG 4.33Å; I171-L175 WeakPolarHBondContact O-CG 3.36Å; I171-L175 PolarHBondContact O-N 3.39Å |
| 172 | S | 85.4 | Confident | 83 | Confident | 60 Ų | 60 | 57.5 Ų | 57.5 | 42% | 0.42 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -57.8 | -46 | -179.6 | -60.4 | 0 | 0 | 0 | 0 | 111.7 | S168 G169 S174 L175 F176 | S168-S172 VanDerWaalsContact O-CB 3.22Å; S168-S172 WeakPolarHBondContact O-CB 3.3Å; S168-S172 PolarHBondContact O-N 3.21Å; S168-S172 PolarHBondContact O-OG 3.41Å; G169-S172 PolarHBondContact O-N 3.34Å; S172-S174 PolarHBondContact O-N 2.71Å; S172-L175 PolarHBondContact O-N 3.01Å; S172-F176 WeakPolarHBondContact O-CD2 3.42Å |
| 173 | A | 79.6 | Confident | 81.3 | Confident | 27 Ų | 27 | 65.8 Ų | 65.8 | 22% | 0.223 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -63.7 | -40.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | L119 G169 I171 L175 F176 | L119-A173 HydrophobicContact CD1-CB 3.55Å; G169-A173 WeakPolarHBondContact O-CB 3.46Å; G169-A173 PolarHBondContact O-N 2.77Å; I171-A173 VanDerWaalsContact C-N 3.33Å; I171-A173 PolarHBondContact O-N 3.26Å; A173-L175 VanDerWaalsContact C-N 3.35Å; A173-L175 PolarHBondContact O-N 3.19Å; A173-F176 PolarHBondContact O-N 3.29Å |
| 174 | S | 79.6 | Confident | 80 | Confident | 2 Ų | 2 | 68.4 Ų | 68.4 | 1% | 0.014 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -72 | -25.7 | 179.6 | -59.7 | 0 | 0 | 0 | 0 | 113.2 | K112 T116 G170 I171 S172 F176 S177 | K112-S174 PolarHBondContact O-OG 3.12Å; T116-S174 PolarHBondContact N-OG 3.35Å; T116-S174 WeakPolarHBondContact OG1-CB 3.29Å; T116-S174 PolarHBondContact OG1-OG 3.14Å; G170-S174 VanDerWaalsContact O-CB 3.27Å; G170-S174 WeakPolarHBondContact O-CB 3.49Å; G170-S174 PolarHBondContact O-N 3.22Å; G170-S174 PolarHBondContact O-OG 3.21Å; I171-S174 CarbonylContact O-C 3.56Å; I171-S174 PolarHBondContact O-N 2.91Å; I171-S174 VanDerWaalsContact O-N 3.09Å; S172-S174 PolarHBondContact O-N 2.71Å; S174-F176 VanDerWaalsContact C-N 3.25Å; S174-F176 PolarHBondContact O-N 2.94Å; S174-S177 CarbonylContact O-C 3.58Å; S174-S177 WeakPolarHBondContact O-CA 3.33Å; S174-S177 WeakPolarHBondContact O-CB 3.45Å; S174-S177 PolarHBondContact O-N 3.16Å |
| 175 | L | 77.4 | Confident | 79.1 | Confident | 109 Ų | 109 | 65.3 Ų | 65.3 | 57% | 0.571 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -62.8 | -33.9 | 172.7 | -74.1 | 173.4 | 0 | 0 | 0 | 112.1 | I171 S172 A173 S177 | I171-L175 HydrophobicContact CG2-CD1 4.27Å; I171-L175 HydrophobicContact CG2-CG 4.33Å; I171-L175 WeakPolarHBondContact O-CG 3.36Å; I171-L175 PolarHBondContact O-N 3.39Å; S172-L175 PolarHBondContact O-N 3.01Å; A173-L175 VanDerWaalsContact C-N 3.35Å; A173-L175 PolarHBondContact O-N 3.19Å; L175-S177 PolarHBondContact O-N 3.34Å |
| 176 | F | 70.3 | Confident | 78.4 | Confident | 110 Ų | 110 | 61.4 Ų | 61.4 | 48% | 0.482 | 37% | 0.366 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.4 | -9.8 | 173.9 | -63.4 | -70.4 | 0 | 0 | 0 | 113.3 | S172 A173 S174 F192 L201 | S172-F176 WeakPolarHBondContact O-CD2 3.42Å; A173-F176 PolarHBondContact O-N 3.29Å; S174-F176 VanDerWaalsContact C-N 3.25Å; S174-F176 PolarHBondContact O-N 2.94Å; F176-F192 WeakPolarHBondContact O-CE1 3.32Å; F176-L201 HydrophobicContact CB-CD2 3.87Å; F176-L201 HydrophobicContact CG-CD2 4.34Å |
| 177 | S | 67.8 | Low | 77.8 | Confident | 0 Ų | 0 | 62 Ų | 62 | 0% | 0 | 37% | 0.37 | C | S | . | . | trans | -95 | 117.7 | 174 | -174.9 | 0 | 0 | 0 | 0 | 110.6 | K112 S174 L175 F189 | K112-S177 WeakPolarHBondContact CE-O 3.25Å; S174-S177 CarbonylContact O-C 3.58Å; S174-S177 WeakPolarHBondContact O-CA 3.33Å; S174-S177 WeakPolarHBondContact O-CB 3.45Å; S174-S177 PolarHBondContact O-N 3.16Å; L175-S177 PolarHBondContact O-N 3.34Å; S177-F189 VanDerWaalsContact CB-CE2 3.48Å; S177-F189 WeakPolarHBondContact OG-CD2 3.47Å | ||
| 178 | T | 64.1 | Low | 77.1 | Confident | 83 Ų | 83 | 58.8 Ų | 58.8 | 51% | 0.509 | 35% | 0.353 | S | S | . | . | trans | -114.8 | 151.9 | 169.7 | 53.3 | 0 | 0 | 0 | 0 | 110.1 | D108 N180 | D108-T178 WeakPolarHBondContact OD1-CA 3.38Å; T178-N180 PolarHBondContact O-N 3.42Å | ||
| 179 | T | 70.9 | Confident | 76.1 | Confident | 32 Ų | 32 | 58.7 Ų | 58.7 | 20% | 0.196 | 35% | 0.346 | C | S | . | . | trans | -59.3 | 131.1 | 166.7 | 48.5 | 0 | 0 | 0 | 0 | 109.8 | D108 C111 T186 T187 | D108-T179 HydrophobicContact CB-CG2 4.32Å; D108-T179 PolarHBondContact OD1-N 2.98Å; D108-T179 VanDerWaalsContact OD1-N 3.07Å; C111-T179 HydrophobicContact CB-CG2 3.84Å; T179-T186 HydrophobicContact CG2-CG2 4.2Å; T179-T187 VanDerWaalsContact CA-O 3.32Å; T179-T187 WeakPolarHBondContact CA-O 3.43Å | ||
| 180 | N | 71.6 | Confident | 75.1 | Confident | 61 Ų | 61 | 59.6 Ų | 59.6 | 33% | 0.326 | 34% | 0.342 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.4 | 115.7 | 175.9 | -157.4 | -83.2 | 0 | 0 | 0 | 108.6 | T178 N182 T186 T187 | T178-N180 PolarHBondContact O-N 3.42Å; N180-N182 PolarHBondContact OD1-OD1 2.73Å; N180-T186 WeakPolarHBondContact O-CA 3.04Å; N180-T187 WeakPolarHBondContact CB-OG1 3.47Å; N180-T187 PolarHBondContact N-O 3.47Å; N180-T187 PolarHBondContact O-N 3.35Å |
| 181 | V | 73.3 | Confident | 73.7 | Confident | 105 Ų | 105 | 62 Ų | 62 | 64% | 0.636 | 37% | 0.367 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -96.1 | 110.8 | 179 | -176.4 | 0 | 0 | 0 | 0 | 107.9 | T186 | V181-T186 HydrophobicContact CG2-CG2 4.26Å |
| 182 | N | 70.6 | Confident | 72.6 | Confident | 91 Ų | 91 | 59.7 Ų | 59.7 | 49% | 0.487 | 35% | 0.354 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.9 | 159.2 | 164.7 | -72.3 | -24.2 | 0 | 0 | 0 | 109 | N180 A184 T185 | N180-N182 PolarHBondContact OD1-OD1 2.73Å; N182-A184 PolarHBondContact O-N 3.01Å; N182-T185 PolarHBondContact N-O 3.38Å; N182-T185 PolarHBondContact O-N 2.79Å; N182-T185 VanDerWaalsContact O-N 3.1Å |
| 183 | N | 62.4 | Low | 71.4 | Confident | 186 Ų | 186 | 60.2 Ų | 60.2 | 100% | 0.995 | 36% | 0.357 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52 | -11.8 | -173.6 | -67.8 | -9 | 0 | 0 | 0 | 116.4 | ||
| 184 | A | 71.2 | Confident | 70.8 | Confident | 93 Ų | 93 | 67.4 Ų | 67.4 | 77% | 0.769 | 38% | 0.384 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -128 | -18 | 177.6 | 0 | 0 | 0 | 0 | 0 | 115 | N182 | N182-A184 PolarHBondContact O-N 3.01Š|
| 185 | T | 78.1 | Confident | 70 | Confident | 54 Ų | 54 | 76.9 Ų | 76.9 | 33% | 0.331 | 42% | 0.419 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -152 | 139.8 | -170.8 | 56.9 | 0 | 0 | 0 | 0 | 112.4 | N182 | N182-T185 PolarHBondContact N-O 3.38Å; N182-T185 PolarHBondContact O-N 2.79Å; N182-T185 VanDerWaalsContact O-N 3.1Å |
| 186 | T | 80.8 | Confident | 69.6 | Low | 25 Ų | 25 | 74.5 Ų | 74.5 | 15% | 0.153 | 41% | 0.409 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -97 | 121 | 170.2 | -54.2 | 0 | 0 | 0 | 0 | 109.5 | H103 W104 T179 N180 V181 | H103-T186 PolarHBondContact ND1-N 2.76Å; W104-T186 HydrophobicContact CB-CG2 4.34Å; W104-T186 WeakPolarHBondContact CB-O 3.37Å; W104-T186 PolarHBondContact N-O 2.93Å; W104-T186 WeakPolarHBondContact O-CB 3.33Å; W104-T186 WeakPolarHBondContact O-CG2 3.2Å; T179-T186 HydrophobicContact CG2-CG2 4.2Å; N180-T186 WeakPolarHBondContact O-CA 3.04Å; V181-T186 HydrophobicContact CG2-CG2 4.26Å |
| 187 | T | 81.4 | Confident | 69.6 | Low | 21 Ų | 21 | 70.5 Ų | 70.5 | 13% | 0.129 | 39% | 0.391 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.4 | 146.7 | 172.8 | 63.5 | 0 | 0 | 0 | 0 | 111 | T179 N180 E190 | T179-T187 VanDerWaalsContact CA-O 3.32Å; T179-T187 WeakPolarHBondContact CA-O 3.43Å; N180-T187 WeakPolarHBondContact CB-OG1 3.47Å; N180-T187 PolarHBondContact N-O 3.47Å; N180-T187 PolarHBondContact O-N 3.35Å; T187-E190 PolarHBondContact OG1-O 2.94Å |
| 188 | C | 80.3 | Confident | 69.8 | Low | 1 Ų | 1 | 76.2 Ų | 76.2 | 1% | 0.007 | 42% | 0.415 | C | S | . | . | S | Bend | trans | -120.9 | 126.1 | 177.8 | 164.7 | 0 | 0 | 0 | 0 | 110.2 | W104 C111 E190 | W104-C188 HydrophobicContact CB-CB 3.93Å; W104-C188 HydrophobicContact CD2-CB 3.48Å; W104-C188 VanDerWaalsContact CD2-CB 3.48Å; W104-C188 HydrophobicContact CE3-CB 3.73Å; W104-C188 HydrophobicContact CG-CB 3.54Å; C111-C188 WeakPolarHBondContact CA-SG 3.34Å; C111-C188 HydrophobicContact CB-CB 3.88Å; C111-C188 WeakPolarHBondContact CB-SG 3.36Å; C111-C188 WeakPolarHBondContact SG-CA 3.49Å; C111-C188 WeakPolarHBondContact SG-CB 3.3Å; C111-C188 CovalentContact SG-SG 2.03Å; C111-C188 PolarHBondContact SG-SG 3.44Å; C188-E190 PolarHBondContact O-N 2.82Å |
| 189 | F | 70.7 | Confident | 69.9 | Low | 54 Ų | 54 | 75.2 Ų | 75.2 | 24% | 0.237 | 41% | 0.409 | C | S | . | . | S | Bend | trans | 61.4 | 22.3 | 179.2 | -130 | -92.4 | 0 | 0 | 0 | 113.5 | L119 S177 | L119-F189 HydrophobicContact CD1-CZ 4.25Å; S177-F189 VanDerWaalsContact CB-CE2 3.48Å; S177-F189 WeakPolarHBondContact OG-CD2 3.47Å |
| 190 | E | 65.9 | Low | 69.9 | Low | 50 Ų | 50 | 80.5 Ų | 80.5 | 23% | 0.234 | 43% | 0.427 | C | S | . | . | trans | -134.9 | 152 | 177.3 | -75.1 | -176.2 | -129.9 | 0 | 0 | 109.1 | K38 Y39 Y98 T187 C188 | K38-E190 IonicContact NZ-OE2 3.99Å; K38-E190 PolarHBondContact NZ-OE2 2.95Å; Y39-E190 PolarHBondContact OH-OE2 3.42Å; Y98-E190 VanDerWaalsContact CE1-OE1 3.31Å; Y98-E190 WeakPolarHBondContact CE1-OE1 3.45Å; Y98-E190 PolarHBondContact OH-OE1 2.89Å; T187-E190 PolarHBondContact OG1-O 2.94Å; C188-E190 PolarHBondContact O-N 2.82Å | ||
| 191 | G | 58.8 | Low | 70 | Confident | 53 Ų | 53 | 78.4 Ų | 78.4 | 55% | 0.546 | 42% | 0.415 | S | S | . | . | trans | 88.5 | 19.6 | 173.3 | 0 | 0 | 0 | 0 | 0 | 115.8 | S193 | G191-S193 PolarHBondContact O-N 3.21Š| ||
| 192 | F | 63.7 | Low | 70.1 | Confident | 37 Ų | 37 | 73.6 Ų | 73.6 | 16% | 0.162 | 39% | 0.386 | C | S | . | . | trans | -53.5 | 128.5 | 172.5 | -61.9 | -85 | 0 | 0 | 0 | 111.6 | F176 K194 W197 L201 R276 | F176-F192 WeakPolarHBondContact O-CE1 3.32Å; F192-K194 PolarHBondContact O-N 3.46Å; F192-W197 HydrophobicContact CB-CE3 3.97Å; F192-W197 HydrophobicContact CD2-CE3 4.05Å; F192-W197 AromaticContact CD2-CZ3 3.91Å; F192-W197 HydrophobicContact CD2-CZ3 3.91Å; F192-W197 HydrophobicContact CE2-CZ3 4.37Å; F192-W197 HydrophobicContact CG-CE3 4.12Å; F192-W197 HydrophobicContact CG-CZ3 4.4Å; F192-L201 HydrophobicContact CB-CD1 4.12Å; F192-L201 HydrophobicContact CD1-CD1 3.45Å; F192-L201 VanDerWaalsContact CD1-CD1 3.45Å; F192-L201 HydrophobicContact CE1-CD1 3.88Å; F192-L201 HydrophobicContact CG-CD1 3.79Å; F192-R276 PolarHBondContact O-NH2 3.5Å | ||
| 193 | S | 62 | Low | 70.5 | Confident | 71 Ų | 71 | 76.3 Ų | 76.3 | 50% | 0.497 | 39% | 0.394 | S | S | . | . | trans | -52.2 | 137.3 | 175.9 | 172.6 | 0 | 0 | 0 | 0 | 110.9 | G191 R195 V196 W197 | G191-S193 PolarHBondContact O-N 3.21Å; S193-R195 PolarHBondContact O-N 3.22Å; S193-R195 VanDerWaalsContact O-N 3.09Å; S193-R195 PolarHBondContact OG-N 2.83Å; S193-V196 PolarHBondContact O-N 2.91Å; S193-V196 VanDerWaalsContact O-N 3.09Å; S193-W197 PolarHBondContact O-N 3.38Å | ||
| 194 | K | 64.9 | Low | 71.3 | Confident | 178 Ų | 178 | 70.7 Ų | 70.7 | 77% | 0.774 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -52 | -35.1 | 178.1 | -68.3 | -177.1 | -179.6 | 179.4 | 0 | 111.9 | F192 K198 | F192-K194 PolarHBondContact O-N 3.46Å; K194-K198 WeakPolarHBondContact O-CB 3.15Å; K194-K198 PolarHBondContact O-N 3.25Å |
| 195 | R | 63.8 | Low | 71.7 | Confident | 200 Ų | 200 | 67.5 Ų | 67.5 | 76% | 0.755 | 33% | 0.334 | S | S | * | . | H | α-helix | trans | -68.2 | -50 | 178.3 | -172.1 | -176.2 | -67.1 | -170.1 | -0.5 | 111.9 | S193 W197 K198 T199 | S193-R195 PolarHBondContact O-N 3.22Å; S193-R195 VanDerWaalsContact O-N 3.09Å; S193-R195 PolarHBondContact OG-N 2.83Å; R195-W197 VanDerWaalsContact C-N 3.3Å; R195-W197 PolarHBondContact O-N 3Å; R195-K198 PolarHBondContact O-N 2.83Å; R195-T199 WeakPolarHBondContact O-CB 3.37Å; R195-T199 PolarHBondContact O-N 3.45Å; R195-T199 PolarHBondContact O-OG1 2.87Å; R195-T199 VanDerWaalsContact O-OG1 3.04Å |
| 196 | V | 68 | Low | 71.9 | Confident | 59 Ų | 59 | 67.1 Ų | 67.1 | 36% | 0.358 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -62.1 | -42 | 178.8 | 176.6 | 0 | 0 | 0 | 0 | 110.5 | S193 Y200 L201 | S193-V196 PolarHBondContact O-N 2.91Å; S193-V196 VanDerWaalsContact O-N 3.09Å; V196-Y200 PolarHBondContact O-N 3.44Å; V196-Y200 VanDerWaalsContact O-N 3.12Å; V196-L201 HydrophobicContact CG1-CD1 4.02Å; V196-L201 HydrophobicContact CG1-CG 4.22Å; V196-L201 PolarHBondContact O-N 3.16Å |
| 197 | W | 71.2 | Confident | 72.1 | Confident | 27 Ų | 27 | 72.5 Ų | 72.5 | 10% | 0.102 | 35% | 0.351 | C | S | . | . | I | π-helix | trans | -62.9 | -48 | 176.8 | -167.8 | -82.6 | 0 | 0 | 0 | 112.3 | F192 S193 R195 L201 S202 Y272 R276 | F192-W197 HydrophobicContact CB-CE3 3.97Å; F192-W197 HydrophobicContact CD2-CE3 4.05Å; F192-W197 AromaticContact CD2-CZ3 3.91Å; F192-W197 HydrophobicContact CD2-CZ3 3.91Å; F192-W197 HydrophobicContact CE2-CZ3 4.37Å; F192-W197 HydrophobicContact CG-CE3 4.12Å; F192-W197 HydrophobicContact CG-CZ3 4.4Å; S193-W197 PolarHBondContact O-N 3.38Å; R195-W197 VanDerWaalsContact C-N 3.3Å; R195-W197 PolarHBondContact O-N 3Å; W197-L201 HydrophobicContact CD2-CB 4.22Å; W197-L201 HydrophobicContact CD2-CD1 4.46Å; W197-L201 HydrophobicContact CE3-CB 4.03Å; W197-L201 HydrophobicContact CE3-CD1 3.64Å; W197-L201 HydrophobicContact CE3-CG 4.5Å; W197-L201 HydrophobicContact CZ3-CB 4.49Å; W197-L201 HydrophobicContact CZ3-CD1 4.17Å; W197-L201 PolarHBondContact O-N 3.5Å; W197-S202 VanDerWaalsContact O-CB 3.23Å; W197-S202 WeakPolarHBondContact O-CB 3.41Å; W197-S202 PolarHBondContact O-N 3.3Å; W197-Y272 HydrophobicContact CH2-CE1 4.35Å; W197-Y272 HydrophobicContact CZ2-CD1 4.18Å; W197-Y272 HydrophobicContact CZ2-CE1 4.03Å; W197-R276 VanDerWaalsContact CD1-CG 3.43Å; W197-R276 HydrophobicContact CD2-CG 4.4Å; W197-R276 HydrophobicContact CG-CG 3.98Å |
| 198 | K | 70.9 | Confident | 72.1 | Confident | 119 Ų | 119 | 73.9 Ų | 73.9 | 52% | 0.517 | 36% | 0.357 | S | S | . | . | I | π-helix | trans | -67.8 | -41.9 | -178.1 | -173.5 | 174.7 | -177.7 | 178.1 | 0 | 112.8 | K194 R195 S277 | K194-K198 WeakPolarHBondContact O-CB 3.15Å; K194-K198 PolarHBondContact O-N 3.25Å; R195-K198 PolarHBondContact O-N 2.83Å; K198-S277 WeakPolarHBondContact CE-O 3.06Å |
| 199 | T | 67.1 | Low | 72.3 | Confident | 62 Ų | 62 | 74 Ų | 74 | 38% | 0.38 | 36% | 0.357 | S | S | . | . | I | π-helix | trans | -79.9 | -39.8 | -172.3 | -54.9 | 0 | 0 | 0 | 0 | 112.8 | R195 | R195-T199 WeakPolarHBondContact O-CB 3.37Å; R195-T199 PolarHBondContact O-N 3.45Å; R195-T199 PolarHBondContact O-OG1 2.87Å; R195-T199 VanDerWaalsContact O-OG1 3.04Å |
| 200 | Y | 70.8 | Confident | 72.8 | Confident | 144 Ų | 144 | 74.7 Ų | 74.7 | 57% | 0.565 | 37% | 0.366 | S | S | * | . | I | π-helix | trans | -122 | -59 | -170.4 | -61.1 | -78.2 | 0 | 0 | 0 | 112.7 | V196 S202 K203 I204 | V196-Y200 PolarHBondContact O-N 3.44Å; V196-Y200 VanDerWaalsContact O-N 3.12Å; Y200-S202 PolarHBondContact O-N 3.49Å; Y200-K203 PolarHBondContact O-N 2.88Å; Y200-I204 WeakPolarHBondContact O-CG1 3.17Å; Y200-I204 PolarHBondContact O-N 2.83Å |
| 201 | L | 74.6 | Confident | 73.7 | Confident | 16 Ų | 16 | 75.2 Ų | 75.2 | 8% | 0.084 | 37% | 0.372 | C | S | . | . | I | π-helix | trans | -64.4 | -40.1 | -169.4 | -59.2 | 171.7 | 0 | 0 | 0 | 112.4 | F176 F192 V196 W197 K203 I204 T205 | F176-L201 HydrophobicContact CB-CD2 3.87Å; F176-L201 HydrophobicContact CG-CD2 4.34Å; F192-L201 HydrophobicContact CB-CD1 4.12Å; F192-L201 HydrophobicContact CD1-CD1 3.45Å; F192-L201 VanDerWaalsContact CD1-CD1 3.45Å; F192-L201 HydrophobicContact CE1-CD1 3.88Å; F192-L201 HydrophobicContact CG-CD1 3.79Å; V196-L201 HydrophobicContact CG1-CD1 4.02Å; V196-L201 HydrophobicContact CG1-CG 4.22Å; V196-L201 PolarHBondContact O-N 3.16Å; W197-L201 HydrophobicContact CD2-CB 4.22Å; W197-L201 HydrophobicContact CD2-CD1 4.46Å; W197-L201 HydrophobicContact CE3-CB 4.03Å; W197-L201 HydrophobicContact CE3-CD1 3.64Å; W197-L201 HydrophobicContact CE3-CG 4.5Å; W197-L201 HydrophobicContact CZ3-CB 4.49Å; W197-L201 HydrophobicContact CZ3-CD1 4.17Å; W197-L201 PolarHBondContact O-N 3.5Å; L201-K203 VanDerWaalsContact C-N 3.33Å; L201-K203 PolarHBondContact O-N 3.44Å; L201-I204 PolarHBondContact O-N 2.88Å; L201-T205 VanDerWaalsContact O-CB 3.28Å; L201-T205 WeakPolarHBondContact O-CB 3.27Å; L201-T205 PolarHBondContact O-N 2.84Å; L201-T205 PolarHBondContact O-OG1 3.44Å |
| 202 | S | 75.1 | Confident | 74.8 | Confident | 4 Ų | 4 | 73.6 Ų | 73.6 | 3% | 0.028 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -61.5 | -39.8 | 179.8 | -176.2 | 0 | 0 | 0 | 0 | 112.7 | W197 Y200 I206 A273 S277 | W197-S202 VanDerWaalsContact O-CB 3.23Å; W197-S202 WeakPolarHBondContact O-CB 3.41Å; W197-S202 PolarHBondContact O-N 3.3Å; Y200-S202 PolarHBondContact O-N 3.49Å; S202-I206 VanDerWaalsContact O-CB 3.31Å; S202-I206 WeakPolarHBondContact O-CB 3.19Å; S202-I206 WeakPolarHBondContact O-CD1 3.27Å; S202-I206 WeakPolarHBondContact O-CG1 3.5Å; S202-I206 PolarHBondContact O-N 2.94Å; S202-A273 PolarHBondContact OG-O 2.98Å; S202-S277 VanDerWaalsContact OG-CB 3.3Å; S202-S277 WeakPolarHBondContact OG-CB 3.4Å; S202-S277 PolarHBondContact OG-OG 2.96Å |
| 203 | K | 79.1 | Confident | 76 | Confident | 149 Ų | 149 | 72.3 Ų | 72.3 | 65% | 0.648 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -69.8 | -42.7 | 180 | -65.8 | -178.6 | -178.5 | 178.3 | 0 | 110.8 | Y200 L201 I206 F207 | Y200-K203 PolarHBondContact O-N 2.88Å; L201-K203 VanDerWaalsContact C-N 3.33Å; L201-K203 PolarHBondContact O-N 3.44Å; K203-I206 PolarHBondContact O-N 3.45Å; K203-F207 WeakPolarHBondContact O-CB 3.35Å; K203-F207 PolarHBondContact O-N 3.34Å |
| 204 | I | 78.9 | Confident | 77.3 | Confident | 67 Ų | 67 | 72.3 Ų | 72.3 | 34% | 0.344 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -64 | -49 | 176.8 | -66.3 | 170.2 | 0 | 0 | 0 | 110.2 | Y200 L201 I206 F207 I208 | Y200-I204 WeakPolarHBondContact O-CG1 3.17Å; Y200-I204 PolarHBondContact O-N 2.83Å; L201-I204 PolarHBondContact O-N 2.88Å; I204-I206 PolarHBondContact O-N 2.89Å; I204-F207 PolarHBondContact O-N 3.41Å; I204-I208 HydrophobicContact CG2-CD1 3.62Å; I204-I208 HydrophobicContact CG2-CG1 4.33Å; I204-I208 WeakPolarHBondContact O-CB 3.14Å; I204-I208 VanDerWaalsContact O-CG1 3.28Å; I204-I208 WeakPolarHBondContact O-CG1 3.24Å; I204-I208 PolarHBondContact O-N 2.91Å |
| 205 | T | 80.1 | Confident | 78.5 | Confident | 26 Ų | 26 | 68 Ų | 68 | 16% | 0.16 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -57.8 | -48.8 | 176.1 | -61.2 | 0 | 0 | 0 | 0 | 110.5 | L201 F207 I208 E209 L269 A273 | L201-T205 VanDerWaalsContact O-CB 3.28Å; L201-T205 WeakPolarHBondContact O-CB 3.27Å; L201-T205 PolarHBondContact O-N 2.84Å; L201-T205 PolarHBondContact O-OG1 3.44Å; T205-F207 VanDerWaalsContact C-N 3.33Å; T205-F207 PolarHBondContact O-N 3.4Å; T205-I208 PolarHBondContact O-N 3.2Å; T205-E209 HydrophobicContact CG2-CG 4.14Å; T205-E209 WeakPolarHBondContact O-CB 3.22Å; T205-E209 VanDerWaalsContact O-CG 3.23Å; T205-E209 WeakPolarHBondContact O-CG 3.28Å; T205-E209 PolarHBondContact O-N 2.94Å; T205-L269 HydrophobicContact CG2-CD1 4.17Å; T205-L269 HydrophobicContact CG2-CG 4.17Å; T205-A273 HydrophobicContact CG2-CB 4.16Å |
| 206 | I | 81.8 | Confident | 79.8 | Confident | 47 Ų | 47 | 58.5 Ų | 58.5 | 24% | 0.241 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -59 | -44.3 | 177.8 | -73.9 | 165.3 | 0 | 0 | 0 | 111.5 | S202 K203 I204 E209 V210 F270 A273 L274 | S202-I206 VanDerWaalsContact O-CB 3.31Å; S202-I206 WeakPolarHBondContact O-CB 3.19Å; S202-I206 WeakPolarHBondContact O-CD1 3.27Å; S202-I206 WeakPolarHBondContact O-CG1 3.5Å; S202-I206 PolarHBondContact O-N 2.94Å; K203-I206 PolarHBondContact O-N 3.45Å; I204-I206 PolarHBondContact O-N 2.89Å; I206-E209 PolarHBondContact O-N 3.23Å; I206-V210 HydrophobicContact CG2-CG2 4.38Å; I206-V210 WeakPolarHBondContact O-CB 3.49Å; I206-V210 VanDerWaalsContact O-CG2 3.24Å; I206-V210 WeakPolarHBondContact O-CG2 3.43Å; I206-V210 PolarHBondContact O-N 3.44Å; I206-F270 HydrophobicContact CG1-CD2 4.47Å; I206-F270 HydrophobicContact CG1-CE2 4.31Å; I206-F270 HydrophobicContact CG2-CE2 4.09Å; I206-A273 HydrophobicContact CG1-CB 4.21Å; I206-L274 HydrophobicContact CD1-CD2 3.95Å |
| 207 | F | 84.6 | Confident | 81 | Confident | 138 Ų | 138 | 57.6 Ų | 57.6 | 61% | 0.605 | 29% | 0.286 | S | S | * | . | H | α-helix | trans | -62.2 | -46.2 | 177.5 | 176.9 | -96.3 | 0 | 0 | 0 | 112.1 | K203 I204 T205 E209 V210 V211 | K203-F207 WeakPolarHBondContact O-CB 3.35Å; K203-F207 PolarHBondContact O-N 3.34Å; I204-F207 PolarHBondContact O-N 3.41Å; T205-F207 VanDerWaalsContact C-N 3.33Å; T205-F207 PolarHBondContact O-N 3.4Å; F207-E209 VanDerWaalsContact C-N 3.35Å; F207-V210 PolarHBondContact O-N 3.21Å; F207-V211 HydrophobicContact CD2-CG2 4.12Å; F207-V211 HydrophobicContact CE1-CG2 4.27Å; F207-V211 HydrophobicContact CE2-CG2 3.76Å; F207-V211 HydrophobicContact CZ-CG2 3.84Å; F207-V211 WeakPolarHBondContact O-CB 3.4Å; F207-V211 WeakPolarHBondContact O-CG2 3.47Å; F207-V211 PolarHBondContact O-N 2.93Å |
| 208 | I | 82.5 | Confident | 82 | Confident | 49 Ų | 49 | 61.2 Ų | 61.2 | 25% | 0.251 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -64.7 | -39.2 | 178.1 | -66.1 | 170.9 | 0 | 0 | 0 | 110.9 | Y123 I204 T205 G212 | Y123-I208 HydrophobicContact CE1-CG2 3.83Å; Y123-I208 HydrophobicContact CE2-CG2 3.97Å; Y123-I208 WeakPolarHBondContact OH-CG2 3.39Å; I204-I208 HydrophobicContact CG2-CD1 3.62Å; I204-I208 HydrophobicContact CG2-CG1 4.33Å; I204-I208 WeakPolarHBondContact O-CB 3.14Å; I204-I208 VanDerWaalsContact O-CG1 3.28Å; I204-I208 WeakPolarHBondContact O-CG1 3.24Å; I204-I208 PolarHBondContact O-N 2.91Å; T205-I208 PolarHBondContact O-N 3.2Å; I208-G212 WeakPolarHBondContact O-CA 3.17Å; I208-G212 PolarHBondContact O-N 2.84Å |
| 209 | E | 83.6 | Confident | 83.1 | Confident | 3 Ų | 3 | 58.9 Ų | 58.9 | 1% | 0.014 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -65.9 | -44.9 | 176 | -72.5 | -57.5 | 118.5 | 0 | 0 | 111.4 | Y123 T205 I206 F207 F213 I214 N266 L269 F270 | Y123-E209 PolarHBondContact OH-OE1 3.41Å; T205-E209 HydrophobicContact CG2-CG 4.14Å; T205-E209 WeakPolarHBondContact O-CB 3.22Å; T205-E209 VanDerWaalsContact O-CG 3.23Å; T205-E209 WeakPolarHBondContact O-CG 3.28Å; T205-E209 PolarHBondContact O-N 2.94Å; I206-E209 PolarHBondContact O-N 3.23Å; F207-E209 VanDerWaalsContact C-N 3.35Å; E209-F213 VanDerWaalsContact O-CB 3.26Å; E209-F213 WeakPolarHBondContact O-CB 3.41Å; E209-F213 PolarHBondContact O-N 3.42Å; E209-I214 PolarHBondContact O-N 2.9Å; E209-N266 PolarHBondContact OE1-OD1 3.05Å; E209-N266 VanDerWaalsContact OE2-CA 3.22Å; E209-N266 WeakPolarHBondContact OE2-CA 3.26Å; E209-N266 WeakPolarHBondContact OE2-CB 3.14Å; E209-N266 PolarHBondContact OE2-OD1 2.69Å; E209-N266 VanDerWaalsContact OE2-OD1 3.08Å; E209-L269 HydrophobicContact CG-CD2 4.5Å; E209-L269 HydrophobicContact CG-CG 4.41Å; E209-L269 WeakPolarHBondContact OE1-CD2 3.49Å; E209-F270 HydrophobicContact CB-CD2 4.26Å |
| 210 | V | 81.5 | Confident | 84.2 | Confident | 69 Ų | 69 | 56 Ų | 56 | 42% | 0.418 | 28% | 0.281 | S | S | . | . | I | π-helix | trans | -65.4 | -49.8 | 179.2 | 171.9 | 0 | 0 | 0 | 0 | 110.6 | I206 F207 I214 F270 | I206-V210 HydrophobicContact CG2-CG2 4.38Å; I206-V210 WeakPolarHBondContact O-CB 3.49Å; I206-V210 VanDerWaalsContact O-CG2 3.24Å; I206-V210 WeakPolarHBondContact O-CG2 3.43Å; I206-V210 PolarHBondContact O-N 3.44Å; F207-V210 PolarHBondContact O-N 3.21Å; V210-I214 WeakPolarHBondContact O-CB 3.34Å; V210-I214 PolarHBondContact O-N 3.3Å; V210-F270 HydrophobicContact CG2-CE2 4.3Å |
| 211 | V | 84.7 | Confident | 85.2 | Confident | 61 Ų | 61 | 51.8 Ų | 51.8 | 37% | 0.37 | 27% | 0.27 | S | S | . | . | I | π-helix | trans | -79.1 | -47.5 | -175.9 | 178.5 | 0 | 0 | 0 | 0 | 111.2 | F207 I215 | F207-V211 HydrophobicContact CD2-CG2 4.12Å; F207-V211 HydrophobicContact CE1-CG2 4.27Å; F207-V211 HydrophobicContact CE2-CG2 3.76Å; F207-V211 HydrophobicContact CZ-CG2 3.84Å; F207-V211 WeakPolarHBondContact O-CB 3.4Å; F207-V211 WeakPolarHBondContact O-CG2 3.47Å; F207-V211 PolarHBondContact O-N 2.93Å; V211-I215 HydrophobicContact CB-CD1 4.47Å; V211-I215 HydrophobicContact CG1-CD1 3.85Å; V211-I215 WeakPolarHBondContact O-CB 3.36Å; V211-I215 WeakPolarHBondContact O-CG1 3.21Å |
| 212 | G | 82.8 | Confident | 86.1 | Confident | 20 Ų | 20 | 53.4 Ų | 53.4 | 21% | 0.206 | 28% | 0.283 | C | S | . | . | I | π-helix | trans | -80.7 | -15.8 | -172.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | I208 P216 | I208-G212 WeakPolarHBondContact O-CA 3.17Å; I208-G212 PolarHBondContact O-N 2.84Å; G212-P216 WeakPolarHBondContact O-CD 3.29Å; G212-P216 VanDerWaalsContact O-CG 3.25Å; G212-P216 WeakPolarHBondContact O-CG 3.14Å |
| 213 | F | 88.1 | Confident | 87 | Confident | 10 Ų | 10 | 53.6 Ų | 53.6 | 4% | 0.044 | 28% | 0.284 | C | S | . | . | I | π-helix | trans | -115.4 | -45.8 | 174.6 | 164.4 | -106.4 | 0 | 0 | 0 | 113.6 | M126 E209 I215 P216 L217 F258 V263 N266 | M126-F213 HydrophobicContact SD-CD2 3.96Å; E209-F213 VanDerWaalsContact O-CB 3.26Å; E209-F213 WeakPolarHBondContact O-CB 3.41Å; E209-F213 PolarHBondContact O-N 3.42Å; F213-I215 PolarHBondContact O-N 3.46Å; F213-P216 WeakPolarHBondContact O-CD 3.41Å; F213-L217 HydrophobicContact CE1-CD2 4.24Å; F213-L217 HydrophobicContact CE2-CB 4.43Å; F213-L217 HydrophobicContact CZ-CD2 3.91Å; F213-L217 VanDerWaalsContact O-CB 3.28Å; F213-L217 WeakPolarHBondContact O-CB 3.4Å; F213-L217 PolarHBondContact O-N 3.42Å; F213-F258 HydrophobicContact CE2-CE1 4.34Å; F213-V263 HydrophobicContact CE2-CB 4.41Å; F213-V263 HydrophobicContact CE2-CG2 3.92Å; F213-V263 HydrophobicContact CZ-CB 4.17Å; F213-V263 HydrophobicContact CZ-CG1 4.21Å; F213-V263 HydrophobicContact CZ-CG2 3.9Å; F213-N266 HydrophobicContact CB-CB 4.03Å; F213-N266 HydrophobicContact CD1-CB 3.61Å; F213-N266 HydrophobicContact CD2-CB 3.64Å; F213-N266 HydrophobicContact CE1-CB 3.9Å; F213-N266 HydrophobicContact CE2-CB 3.93Å; F213-N266 HydrophobicContact CG-CB 3.47Å; F213-N266 VanDerWaalsContact CG-CB 3.47Å; F213-N266 HydrophobicContact CZ-CB 4.05Å |
| 214 | I | 89.4 | Confident | 87.5 | Confident | 70 Ų | 70 | 47 Ų | 47 | 36% | 0.359 | 26% | 0.257 | S | S | . | . | I | π-helix | trans | -66.5 | -40.4 | -176.9 | -54.8 | -65.1 | 0 | 0 | 0 | 111.6 | E209 V210 L217 I218 | E209-I214 PolarHBondContact O-N 2.9Å; V210-I214 WeakPolarHBondContact O-CB 3.34Å; V210-I214 PolarHBondContact O-N 3.3Å; I214-L217 PolarHBondContact O-N 3.22Å; I214-I218 HydrophobicContact CG2-CD1 3.64Å; I214-I218 HydrophobicContact CG2-CG1 4.18Å; I214-I218 VanDerWaalsContact O-CG1 3.3Å; I214-I218 WeakPolarHBondContact O-CG1 3.48Å; I214-I218 PolarHBondContact O-N 3.32Å |
| 215 | I | 90.4 | Very high | 88 | Confident | 87 Ų | 87 | 46.2 Ų | 46.2 | 45% | 0.446 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -64 | -52 | 178.2 | -59.7 | 174.8 | 0 | 0 | 0 | 110.7 | V211 F213 L217 I218 L219 | V211-I215 HydrophobicContact CB-CD1 4.47Å; V211-I215 HydrophobicContact CG1-CD1 3.85Å; V211-I215 WeakPolarHBondContact O-CB 3.36Å; V211-I215 WeakPolarHBondContact O-CG1 3.21Å; F213-I215 PolarHBondContact O-N 3.46Å; I215-L217 VanDerWaalsContact C-N 3.31Å; I215-L217 PolarHBondContact O-N 2.84Å; I215-I218 PolarHBondContact O-N 3.03Å; I215-L219 HydrophobicContact CG2-CD1 3.91Å; I215-L219 HydrophobicContact CG2-CG 4.39Å; I215-L219 WeakPolarHBondContact O-CB 3.37Å; I215-L219 WeakPolarHBondContact O-CG 3.16Å; I215-L219 PolarHBondContact O-N 3.43Å |
| 216 | P | 91.3 | Very high | 88.6 | Confident | 2 Ų | 2 | 47.5 Ų | 47.5 | 1% | 0.013 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -54.9 | -41.6 | 172.2 | -34.9 | 43.7 | 0 | 0 | 0 | 114.2 | L127 T130 G212 F213 L219 N220 F258 | L127-P216 HydrophobicContact CD2-CG 3.85Å; T130-P216 WeakPolarHBondContact OG1-CB 3.23Å; G212-P216 WeakPolarHBondContact O-CD 3.29Å; G212-P216 VanDerWaalsContact O-CG 3.25Å; G212-P216 WeakPolarHBondContact O-CG 3.14Å; F213-P216 WeakPolarHBondContact O-CD 3.41Å; P216-L219 PolarHBondContact O-N 2.94Å; P216-N220 WeakPolarHBondContact O-CB 3.39Å; P216-N220 PolarHBondContact O-N 3.46Å; P216-N220 PolarHBondContact O-ND2 3.18Å; P216-F258 HydrophobicContact CB-CE2 4.25Å; P216-F258 HydrophobicContact CB-CZ 4.07Å |
| 217 | L | 92.1 | Very high | 88.8 | Confident | 40 Ų | 40 | 45.3 Ų | 45.3 | 21% | 0.209 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -61.5 | -51.2 | 178.4 | 176.3 | 65.6 | 0 | 0 | 0 | 111.3 | F213 I214 I215 L219 N220 V221 F258 V263 | F213-L217 HydrophobicContact CE1-CD2 4.24Å; F213-L217 HydrophobicContact CE2-CB 4.43Å; F213-L217 HydrophobicContact CZ-CD2 3.91Å; F213-L217 VanDerWaalsContact O-CB 3.28Å; F213-L217 WeakPolarHBondContact O-CB 3.4Å; F213-L217 PolarHBondContact O-N 3.42Å; I214-L217 PolarHBondContact O-N 3.22Å; I215-L217 VanDerWaalsContact C-N 3.31Å; I215-L217 PolarHBondContact O-N 2.84Å; L217-L219 VanDerWaalsContact C-N 3.33Å; L217-L219 PolarHBondContact O-N 3.06Å; L217-N220 PolarHBondContact O-N 3.03Å; L217-V221 HydrophobicContact CD1-CG2 3.93Å; L217-V221 HydrophobicContact CG-CG2 4.34Å; L217-V221 WeakPolarHBondContact O-CB 3.41Å; L217-V221 WeakPolarHBondContact O-CG2 3.11Å; L217-V221 PolarHBondContact O-N 2.73Å; L217-F258 HydrophobicContact CB-CE1 4.02Å; L217-F258 HydrophobicContact CB-CZ 4.32Å; L217-F258 HydrophobicContact CD1-CD1 4.23Å; L217-F258 HydrophobicContact CD1-CE1 3.66Å; L217-F258 HydrophobicContact CG-CE1 4.46Å; L217-V263 HydrophobicContact CD1-CG2 4.03Å |
| 218 | I | 93.1 | Very high | 88.9 | Confident | 103 Ų | 103 | 41 Ų | 41 | 53% | 0.528 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -60.2 | -44.7 | 179.3 | -69.3 | 171 | 0 | 0 | 0 | 110.5 | I214 I215 S222 | I214-I218 HydrophobicContact CG2-CD1 3.64Å; I214-I218 HydrophobicContact CG2-CG1 4.18Å; I214-I218 VanDerWaalsContact O-CG1 3.3Å; I214-I218 WeakPolarHBondContact O-CG1 3.48Å; I214-I218 PolarHBondContact O-N 3.32Å; I215-I218 PolarHBondContact O-N 3.03Å; I218-S222 WeakPolarHBondContact O-CB 3.43Å; I218-S222 PolarHBondContact O-N 3.47Å; I218-S222 PolarHBondContact O-OG 3.3Å |
| 219 | L | 93.2 | Very high | 89.2 | Confident | 70 Ų | 70 | 47 Ų | 47 | 37% | 0.366 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -62.8 | -46 | 178.6 | -73.3 | 175.1 | 0 | 0 | 0 | 111.8 | T130 I215 P216 L217 S222 C223 | T130-L219 HydrophobicContact CG2-CB 3.63Å; T130-L219 HydrophobicContact CG2-CD1 3.86Å; T130-L219 HydrophobicContact CG2-CG 4.42Å; I215-L219 HydrophobicContact CG2-CD1 3.91Å; I215-L219 HydrophobicContact CG2-CG 4.39Å; I215-L219 WeakPolarHBondContact O-CB 3.37Å; I215-L219 WeakPolarHBondContact O-CG 3.16Å; I215-L219 PolarHBondContact O-N 3.43Å; P216-L219 PolarHBondContact O-N 2.94Å; L217-L219 VanDerWaalsContact C-N 3.33Å; L217-L219 PolarHBondContact O-N 3.06Å; L219-S222 PolarHBondContact O-OG 2.88Å; L219-S222 VanDerWaalsContact O-OG 3.14Å; L219-C223 WeakPolarHBondContact O-CB 3.42Å; L219-C223 PolarHBondContact O-N 3.16Å; L219-C223 PolarHBondContact O-SG 3.32Å |
| 220 | N | 91.2 | Very high | 89.2 | Confident | 0 Ų | 0 | 47.9 Ų | 47.9 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -62.7 | -47.5 | 177.8 | -83.4 | -75 | 0 | 0 | 0 | 112.1 | T130 S133 P216 L217 S224 | T130-N220 PolarHBondContact OG1-ND2 3.38Å; S133-N220 VanDerWaalsContact CB-OD1 3.29Å; S133-N220 WeakPolarHBondContact CB-OD1 3.48Å; S133-N220 PolarHBondContact OG-OD1 3.09Å; P216-N220 WeakPolarHBondContact O-CB 3.39Å; P216-N220 PolarHBondContact O-N 3.46Å; P216-N220 PolarHBondContact O-ND2 3.18Å; L217-N220 PolarHBondContact O-N 3.03Å; N220-S224 WeakPolarHBondContact O-CB 3.19Å; N220-S224 PolarHBondContact O-N 2.89Å; N220-S224 PolarHBondContact O-OG 2.7Å |
| 221 | V | 92.1 | Very high | 89.2 | Confident | 56 Ų | 56 | 44.9 Ų | 44.9 | 34% | 0.339 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -62.2 | -49.3 | 180 | 174.9 | 0 | 0 | 0 | 0 | 110.4 | L217 S225 M255 | L217-V221 HydrophobicContact CD1-CG2 3.93Å; L217-V221 HydrophobicContact CG-CG2 4.34Å; L217-V221 WeakPolarHBondContact O-CB 3.41Å; L217-V221 WeakPolarHBondContact O-CG2 3.11Å; L217-V221 PolarHBondContact O-N 2.73Å; V221-S225 WeakPolarHBondContact O-CB 3.29Å; V221-S225 PolarHBondContact O-N 3.04Å; V221-S225 PolarHBondContact O-OG 2.9Å; V221-M255 HydrophobicContact CB-CE 4.26Å; V221-M255 HydrophobicContact CG2-CE 3.57Å |
| 222 | S | 93.8 | Very high | 89.1 | Confident | 50 Ų | 50 | 50.9 Ų | 50.9 | 35% | 0.35 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -66.7 | -49.7 | -177.4 | 59.1 | 0 | 0 | 0 | 0 | 111.9 | I218 L219 S224 S225 V226 | I218-S222 WeakPolarHBondContact O-CB 3.43Å; I218-S222 PolarHBondContact O-N 3.47Å; I218-S222 PolarHBondContact O-OG 3.3Å; L219-S222 PolarHBondContact O-OG 2.88Å; L219-S222 VanDerWaalsContact O-OG 3.14Å; S222-S224 PolarHBondContact O-N 2.98Å; S222-S225 PolarHBondContact O-N 2.91Å; S222-V226 WeakPolarHBondContact O-CG2 3.2Å; S222-V226 PolarHBondContact O-N 3.34Å |
| 223 | C | 92.4 | Very high | 89 | Confident | 9 Ų | 9 | 56 Ų | 56 | 6% | 0.061 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -58.7 | -49.4 | 178.2 | -69.8 | 0 | 0 | 0 | 0 | 110.9 | F137 L219 S225 V226 V227 | F137-C223 HydrophobicContact CB-CB 3.93Å; F137-C223 HydrophobicContact CG-CB 4.38Å; L219-C223 WeakPolarHBondContact O-CB 3.42Å; L219-C223 PolarHBondContact O-N 3.16Å; L219-C223 PolarHBondContact O-SG 3.32Å; C223-S225 VanDerWaalsContact C-N 3.34Å; C223-S225 PolarHBondContact O-N 2.96Å; C223-V226 PolarHBondContact O-N 3.26Å; C223-V227 VanDerWaalsContact O-CG2 3.28Å; C223-V227 WeakPolarHBondContact O-CG2 3.48Å; C223-V227 PolarHBondContact O-N 3.43Å |
| 224 | S | 89.7 | Confident | 88.1 | Confident | 10 Ų | 10 | 60.8 Ų | 60.8 | 7% | 0.07 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -60.9 | -44.2 | 178.8 | -60.6 | 0 | 0 | 0 | 0 | 111.3 | N220 S222 V226 V227 L228 | N220-S224 WeakPolarHBondContact O-CB 3.19Å; N220-S224 PolarHBondContact O-N 2.89Å; N220-S224 PolarHBondContact O-OG 2.7Å; S222-S224 PolarHBondContact O-N 2.98Å; S224-V226 PolarHBondContact O-N 3.45Å; S224-V227 PolarHBondContact O-N 2.82Å; S224-L228 WeakPolarHBondContact O-CB 3.46Å; S224-L228 WeakPolarHBondContact O-CD1 3.49Å; S224-L228 PolarHBondContact O-N 3.08Å |
| 225 | S | 90.9 | Very high | 87.1 | Confident | 50 Ų | 50 | 61.2 Ų | 61.2 | 35% | 0.35 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -61.1 | -44.7 | 178.8 | -64.4 | 0 | 0 | 0 | 0 | 112.4 | V221 S222 C223 L228 R229 | V221-S225 WeakPolarHBondContact O-CB 3.29Å; V221-S225 PolarHBondContact O-N 3.04Å; V221-S225 PolarHBondContact O-OG 2.9Å; S222-S225 PolarHBondContact O-N 2.91Å; C223-S225 VanDerWaalsContact C-N 3.34Å; C223-S225 PolarHBondContact O-N 2.96Å; S225-L228 PolarHBondContact O-N 3.46Å; S225-R229 WeakPolarHBondContact O-CB 3.46Å; S225-R229 VanDerWaalsContact O-CG 3.28Å; S225-R229 WeakPolarHBondContact O-CG 3.41Å; S225-R229 PolarHBondContact O-N 3.35Å |
| 226 | V | 90.8 | Very high | 86 | Confident | 54 Ų | 54 | 58.4 Ų | 58.4 | 33% | 0.327 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -67.5 | -41.4 | 178.6 | -179.2 | 0 | 0 | 0 | 0 | 110.8 | F137 V141 S222 C223 S224 L228 R229 T230 | F137-V226 HydrophobicContact CD2-CB 4.13Å; F137-V226 HydrophobicContact CD2-CG1 4.19Å; F137-V226 HydrophobicContact CE2-CB 3.93Å; F137-V226 HydrophobicContact CE2-CG1 3.71Å; F137-V226 HydrophobicContact CE2-CG2 4.47Å; V141-V226 HydrophobicContact CG1-CG1 4.49Å; V141-V226 HydrophobicContact CG2-CG1 3.97Å; S222-V226 WeakPolarHBondContact O-CG2 3.2Å; S222-V226 PolarHBondContact O-N 3.34Å; C223-V226 PolarHBondContact O-N 3.26Å; S224-V226 PolarHBondContact O-N 3.45Å; V226-L228 PolarHBondContact O-N 2.9Å; V226-R229 PolarHBondContact O-N 2.74Å; V226-T230 WeakPolarHBondContact O-CB 3.14Å; V226-T230 PolarHBondContact O-N 2.79Å; V226-T230 PolarHBondContact O-OG1 2.89Å |
| 227 | V | 86.9 | Confident | 84.5 | Confident | 1 Ų | 1 | 62.1 Ų | 62.1 | 1% | 0.006 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -61.4 | -46.4 | 175.9 | 177.1 | 0 | 0 | 0 | 0 | 111.1 | F137 I140 V141 C223 S224 R229 T230 L231 I251 | F137-V227 VanDerWaalsContact CA-CG2 3.44Å; F137-V227 HydrophobicContact CB-CG2 3.9Å; F137-V227 HydrophobicContact CD2-CG2 4.3Å; I140-V227 HydrophobicContact CB-CG1 4.47Å; I140-V227 HydrophobicContact CD1-CG1 3.46Å; I140-V227 VanDerWaalsContact CD1-CG1 3.46Å; I140-V227 HydrophobicContact CG2-CG1 4.32Å; V141-V227 HydrophobicContact CG2-CG2 4.5Å; C223-V227 VanDerWaalsContact O-CG2 3.28Å; C223-V227 WeakPolarHBondContact O-CG2 3.48Å; C223-V227 PolarHBondContact O-N 3.43Å; S224-V227 PolarHBondContact O-N 2.82Å; V227-R229 VanDerWaalsContact C-N 3.32Å; V227-R229 PolarHBondContact O-N 3.05Å; V227-T230 PolarHBondContact O-N 2.79Å; V227-L231 HydrophobicContact CG1-CD1 3.81Å; V227-L231 HydrophobicContact CG1-CG 4.16Å; V227-L231 WeakPolarHBondContact O-CB 3.24Å; V227-L231 VanDerWaalsContact O-CG 3.29Å; V227-L231 WeakPolarHBondContact O-CG 3.09Å; V227-L231 PolarHBondContact O-N 2.89Å; V227-I251 HydrophobicContact CB-CD1 3.95Å; V227-I251 HydrophobicContact CG1-CD1 3.23Å |
| 228 | L | 86.6 | Confident | 82.8 | Confident | 46 Ų | 46 | 65.4 Ų | 65.4 | 24% | 0.241 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -59 | -43.2 | 176.9 | -94.5 | 74.1 | 0 | 0 | 0 | 111.7 | S224 S225 V226 L231 R232 L248 I251 | S224-L228 WeakPolarHBondContact O-CB 3.46Å; S224-L228 WeakPolarHBondContact O-CD1 3.49Å; S224-L228 PolarHBondContact O-N 3.08Å; S225-L228 PolarHBondContact O-N 3.46Å; V226-L228 PolarHBondContact O-N 2.9Å; L228-L231 PolarHBondContact O-N 2.93Å; L228-R232 WeakPolarHBondContact O-CG 3.44Å; L228-R232 PolarHBondContact O-N 3.32Å; L228-L248 HydrophobicContact CD1-CD1 4.24Å; L228-L248 HydrophobicContact CD2-CD1 4.28Å; L228-L248 HydrophobicContact CG-CD1 3.89Å; L228-I251 HydrophobicContact CD1-CB 4.22Å; L228-I251 HydrophobicContact CD1-CD1 4.22Å; L228-I251 HydrophobicContact CD1-CG2 3.5Å |
| 229 | R | 87.9 | Confident | 81.5 | Confident | 177 Ų | 177 | 67.2 Ų | 67.2 | 67% | 0.668 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -63.1 | -43.8 | 176.3 | -73.7 | 174.9 | -176.7 | -173.6 | 1.5 | 111.8 | S225 V226 V227 R232 | S225-R229 WeakPolarHBondContact O-CB 3.46Å; S225-R229 VanDerWaalsContact O-CG 3.28Å; S225-R229 WeakPolarHBondContact O-CG 3.41Å; S225-R229 PolarHBondContact O-N 3.35Å; V226-R229 PolarHBondContact O-N 2.74Å; V227-R229 VanDerWaalsContact C-N 3.32Å; V227-R229 PolarHBondContact O-N 3.05Å; R229-R232 PolarHBondContact O-N 3.14Å |
| 230 | T | 84.4 | Confident | 80.1 | Confident | 20 Ų | 20 | 65.8 Ų | 65.8 | 12% | 0.123 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -65.1 | -41 | 178.6 | -60.7 | 0 | 0 | 0 | 0 | 111.4 | I140 V226 V227 R232 K233 T236 | I140-T230 HydrophobicContact CG2-CG2 4.06Å; V226-T230 WeakPolarHBondContact O-CB 3.14Å; V226-T230 PolarHBondContact O-N 2.79Å; V226-T230 PolarHBondContact O-OG1 2.89Å; V227-T230 PolarHBondContact O-N 2.79Å; T230-R232 PolarHBondContact O-N 3.13Å; T230-K233 WeakPolarHBondContact O-CB 3.38Å; T230-K233 PolarHBondContact O-N 3.44Å; T230-K233 VanDerWaalsContact O-N 3.1Å; T230-T236 HydrophobicContact CG2-CG2 4.27Å |
| 231 | L | 81.6 | Confident | 78.9 | Confident | 6 Ų | 6 | 67.7 Ų | 67.7 | 3% | 0.031 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -67.1 | -18.9 | 176.2 | -69.7 | 175.3 | 0 | 0 | 0 | 113.8 | I140 V227 L228 I240 K244 V247 I251 | I140-L231 HydrophobicContact CG2-CD2 4.19Å; I140-L231 HydrophobicContact CG2-CG 4.49Å; V227-L231 HydrophobicContact CG1-CD1 3.81Å; V227-L231 HydrophobicContact CG1-CG 4.16Å; V227-L231 WeakPolarHBondContact O-CB 3.24Å; V227-L231 VanDerWaalsContact O-CG 3.29Å; V227-L231 WeakPolarHBondContact O-CG 3.09Å; V227-L231 PolarHBondContact O-N 2.89Å; L228-L231 PolarHBondContact O-N 2.93Å; L231-I240 HydrophobicContact CD2-CD1 3.58Å; L231-K244 WeakPolarHBondContact O-CE 3.45Å; L231-K244 PolarHBondContact O-NZ 3.45Å; L231-V247 HydrophobicContact CD1-CB 4.43Å; L231-V247 HydrophobicContact CD1-CG1 3.77Å; L231-I251 HydrophobicContact CD1-CD1 4.41Å |
| 232 | R | 82.2 | Confident | 77.4 | Confident | 188 Ų | 188 | 71.3 Ų | 71.3 | 71% | 0.709 | 40% | 0.395 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.1 | -16.3 | 173.8 | -72.7 | 174.1 | -173 | -178.2 | 2 | 113 | L228 R229 T230 | L228-R232 WeakPolarHBondContact O-CG 3.44Å; L228-R232 PolarHBondContact O-N 3.32Å; R229-R232 PolarHBondContact O-N 3.14Å; T230-R232 PolarHBondContact O-N 3.13Å |
| 233 | K | 81.8 | Confident | 76.3 | Confident | 128 Ų | 128 | 72.7 Ų | 72.7 | 56% | 0.557 | 40% | 0.398 | S | S | * | . | S | Bend | trans | -73.3 | 135.1 | -179.9 | -64.6 | -174.5 | 178.1 | -176 | 0 | 111.4 | T230 A235 T236 L237 | T230-K233 WeakPolarHBondContact O-CB 3.38Å; T230-K233 PolarHBondContact O-N 3.44Å; T230-K233 VanDerWaalsContact O-N 3.1Å; K233-A235 PolarHBondContact O-N 2.9Å; K233-T236 PolarHBondContact O-N 2.9Å; K233-L237 PolarHBondContact O-N 2.99Å |
| 234 | P | 69.3 | Low | 75.6 | Confident | 109 Ų | 109 | 74.9 Ų | 74.9 | 71% | 0.708 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -62.5 | -36.8 | -178 | -21.9 | 31.5 | 0 | 0 | 0 | 114 | T236 L237 | P234-T236 VanDerWaalsContact C-N 3.32Å; P234-T236 PolarHBondContact O-N 3.29Å; P234-L237 WeakPolarHBondContact O-CB 3.4Å; P234-L237 PolarHBondContact O-N 3.1Å |
| 235 | A | 68.6 | Low | 75 | Confident | 80 Ų | 80 | 83 Ų | 83 | 66% | 0.661 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -64.5 | -34.1 | -179.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | K233 L237 | K233-A235 PolarHBondContact O-N 2.9Å; A235-L237 VanDerWaalsContact C-N 3.28Å |
| 236 | T | 66.8 | Low | 74.4 | Confident | 27 Ų | 27 | 82.6 Ų | 82.6 | 17% | 0.166 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -78.9 | -16.4 | 176.3 | -38.7 | 0 | 0 | 0 | 0 | 111.8 | T230 K233 P234 I240 | T230-T236 HydrophobicContact CG2-CG2 4.27Å; K233-T236 PolarHBondContact O-N 2.9Å; P234-T236 VanDerWaalsContact C-N 3.32Å; P234-T236 PolarHBondContact O-N 3.29Å; T236-I240 HydrophobicContact CG2-CD1 3.76Å; T236-I240 HydrophobicContact CG2-CG1 4.4Å; T236-I240 PolarHBondContact O-N 3.23Å |
| 237 | L | 58.3 | Low | 73.9 | Confident | 81 Ų | 81 | 81.2 Ų | 81.2 | 42% | 0.424 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -69.7 | -38.7 | 179.5 | -167.1 | 63.5 | 0 | 0 | 0 | 112.1 | K233 P234 A235 Q239 G241 K244 | K233-L237 PolarHBondContact O-N 2.99Å; P234-L237 WeakPolarHBondContact O-CB 3.4Å; P234-L237 PolarHBondContact O-N 3.1Å; A235-L237 VanDerWaalsContact C-N 3.28Å; L237-Q239 VanDerWaalsContact C-N 3.34Å; L237-G241 PolarHBondContact O-N 2.99Å; L237-G241 VanDerWaalsContact O-N 3.12Å; L237-K244 HydrophobicContact CD1-CD 3.24Å |
| 238 | S | 57.2 | Low | 73.6 | Confident | 109 Ų | 109 | 84.5 Ų | 84.5 | 76% | 0.762 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -71.4 | -30.7 | 178.1 | 77.6 | 0 | 0 | 0 | 0 | 112.3 | ||
| 239 | Q | 65.1 | Low | 73.5 | Confident | 141 Ų | 141 | 87.6 Ų | 87.6 | 66% | 0.659 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -80.4 | -29.5 | -176.1 | -153.6 | 178 | 2.2 | 0 | 0 | 113.7 | L237 | L237-Q239 VanDerWaalsContact C-N 3.34Å |
| 240 | I | 64.9 | Low | 73.3 | Confident | 40 Ų | 40 | 79.3 Ų | 79.3 | 21% | 0.205 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -99.3 | -23.4 | -178.8 | -64.1 | 176.1 | 0 | 0 | 0 | 112.1 | I140 L231 T236 T242 N243 K244 | I140-I240 HydrophobicContact CG2-CD1 4.37Å; L231-I240 HydrophobicContact CD2-CD1 3.58Å; T236-I240 HydrophobicContact CG2-CD1 3.76Å; T236-I240 HydrophobicContact CG2-CG1 4.4Å; T236-I240 PolarHBondContact O-N 3.23Å; I240-T242 PolarHBondContact O-N 2.68Å; I240-N243 HydrophobicContact CG2-CB 4.06Å; I240-N243 WeakPolarHBondContact O-CB 3.41Å; I240-N243 PolarHBondContact O-N 2.84Å; I240-K244 HydrophobicContact CG2-CB 4.2Å |
| 241 | G | 66.8 | Low | 73.3 | Confident | 39 Ų | 39 | 78.9 Ų | 78.9 | 40% | 0.402 | 42% | 0.419 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 54.8 | -136.5 | 174.8 | 0 | 0 | 0 | 0 | 0 | 114 | L237 N243 K244 | L237-G241 PolarHBondContact O-N 2.99Å; L237-G241 VanDerWaalsContact O-N 3.12Å; G241-N243 PolarHBondContact O-N 2.03Å; G241-N243 VanDerWaalsContact O-N 3.13Å; G241-K244 PolarHBondContact O-N 2.93Å |
| 242 | T | 59.7 | Low | 73.5 | Confident | 133 Ų | 133 | 82.3 Ų | 82.3 | 82% | 0.816 | 44% | 0.44 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.5 | -18.5 | -178.4 | 47.4 | 0 | 0 | 0 | 0 | 114.1 | I240 K244 | I240-T242 PolarHBondContact O-N 2.68Å; T242-K244 VanDerWaalsContact C-N 3.26Å; T242-K244 PolarHBondContact O-N 3.48Å |
| 243 | N | 71.4 | Confident | 73.7 | Confident | 78 Ų | 78 | 74.8 Ų | 74.8 | 42% | 0.417 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -74.9 | -11 | 179.9 | -68.5 | -32.4 | 0 | 0 | 0 | 113.8 | I240 G241 K245 K246 V247 | I240-N243 HydrophobicContact CG2-CB 4.06Å; I240-N243 WeakPolarHBondContact O-CB 3.41Å; I240-N243 PolarHBondContact O-N 2.84Å; G241-N243 PolarHBondContact O-N 2.03Å; G241-N243 VanDerWaalsContact O-N 3.13Å; N243-K245 PolarHBondContact O-N 2.91Å; N243-K246 WeakPolarHBondContact O-CB 3.44Å; N243-K246 PolarHBondContact O-N 2.84Å; N243-V247 WeakPolarHBondContact O-CG2 3.49Å; N243-V247 PolarHBondContact O-N 2.87Å |
| 244 | K | 76.2 | Confident | 73.8 | Confident | 55 Ų | 55 | 68.9 Ų | 68.9 | 24% | 0.239 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -59 | -45.5 | 179.2 | 174.5 | 175.9 | 168.5 | 173.9 | 0 | 112.5 | L231 L237 I240 G241 T242 K246 V247 L248 | L231-K244 WeakPolarHBondContact O-CE 3.45Å; L231-K244 PolarHBondContact O-NZ 3.45Å; L237-K244 HydrophobicContact CD1-CD 3.24Å; I240-K244 HydrophobicContact CG2-CB 4.2Å; G241-K244 PolarHBondContact O-N 2.93Å; T242-K244 VanDerWaalsContact C-N 3.26Å; T242-K244 PolarHBondContact O-N 3.48Å; K244-K246 PolarHBondContact O-N 3.04Å; K244-V247 PolarHBondContact O-N 2.82Å; K244-L248 WeakPolarHBondContact O-CB 3.31Å; K244-L248 PolarHBondContact O-N 3.43Å |
| 245 | K | 77.1 | Confident | 74.8 | Confident | 181 Ų | 181 | 66 Ų | 66 | 79% | 0.787 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -60.9 | -38.6 | 179.2 | -73.3 | -175.8 | 179.3 | 179 | 0 | 111.1 | N243 K249 | N243-K245 PolarHBondContact O-N 2.91Å; K245-K249 WeakPolarHBondContact O-CB 3.46Å; K245-K249 PolarHBondContact O-N 3.19Å |
| 246 | K | 77.9 | Confident | 75.8 | Confident | 42 Ų | 42 | 64.5 Ų | 64.5 | 18% | 0.183 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -65.9 | -49.5 | 178.2 | -175.9 | 173 | -175.1 | 158.9 | 0 | 112 | N243 K244 L248 K249 M250 E316 | N243-K246 WeakPolarHBondContact O-CB 3.44Å; N243-K246 PolarHBondContact O-N 2.84Å; K244-K246 PolarHBondContact O-N 3.04Å; K246-L248 VanDerWaalsContact C-N 3.33Å; K246-L248 PolarHBondContact O-N 3.4Å; K246-K249 PolarHBondContact O-N 3.43Å; K246-M250 WeakPolarHBondContact O-CB 3.38Å; K246-M250 PolarHBondContact O-N 3.01Å; K246-E316 WeakPolarHBondContact CD-OE1 3.24Å; K246-E316 WeakPolarHBondContact CE-OE1 3.43Å; K246-E316 IonicContact NZ-OE1 3Å; K246-E316 PolarHBondContact NZ-OE1 3.2Å |
| 247 | V | 80.4 | Confident | 76.9 | Confident | 25 Ų | 25 | 63.8 Ų | 63.8 | 15% | 0.152 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -61.1 | -42.7 | 177.4 | 175 | 0 | 0 | 0 | 0 | 111.2 | I140 L231 N243 K244 M250 I251 | I140-V247 HydrophobicContact CD1-CG1 3.53Å; L231-V247 HydrophobicContact CD1-CB 4.43Å; L231-V247 HydrophobicContact CD1-CG1 3.77Å; N243-V247 WeakPolarHBondContact O-CG2 3.49Å; N243-V247 PolarHBondContact O-N 2.87Å; K244-V247 PolarHBondContact O-N 2.82Å; V247-M250 HydrophobicContact CG1-CE 4.21Å; V247-M250 WeakPolarHBondContact O-CB 3.43Å; V247-M250 PolarHBondContact O-N 2.95Å; V247-I251 HydrophobicContact CG1-CD1 3.87Å; V247-I251 WeakPolarHBondContact O-CG1 3.34Å; V247-I251 PolarHBondContact O-N 3.13Å |
| 248 | L | 82.2 | Confident | 78.5 | Confident | 69 Ų | 69 | 59.9 Ų | 59.9 | 36% | 0.361 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -62.2 | -47.6 | 177.1 | -174.7 | 66 | 0 | 0 | 0 | 111.2 | L228 K244 K246 M250 I251 T252 | L228-L248 HydrophobicContact CD1-CD1 4.24Å; L228-L248 HydrophobicContact CD2-CD1 4.28Å; L228-L248 HydrophobicContact CG-CD1 3.89Å; K244-L248 WeakPolarHBondContact O-CB 3.31Å; K244-L248 PolarHBondContact O-N 3.43Å; K246-L248 VanDerWaalsContact C-N 3.33Å; K246-L248 PolarHBondContact O-N 3.4Å; L248-M250 VanDerWaalsContact C-N 3.32Å; L248-M250 PolarHBondContact O-N 3.25Å; L248-I251 PolarHBondContact O-N 3.37Å; L248-T252 WeakPolarHBondContact O-CB 3.47Å; L248-T252 PolarHBondContact O-N 3.48Å; L248-T252 PolarHBondContact O-OG1 3.24Å; L248-T252 VanDerWaalsContact O-OG1 3.05Å |
| 249 | K | 83.1 | Confident | 80.1 | Confident | 111 Ų | 111 | 57.6 Ų | 57.6 | 48% | 0.483 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -59.8 | -43 | 178.4 | -169.7 | 170.4 | -172.4 | -175 | 0 | 111.8 | K245 K246 T252 V253 F313 | K245-K249 WeakPolarHBondContact O-CB 3.46Å; K245-K249 PolarHBondContact O-N 3.19Å; K246-K249 PolarHBondContact O-N 3.43Å; K249-T252 PolarHBondContact O-N 3.33Å; K249-V253 WeakPolarHBondContact O-CB 3.35Å; K249-V253 VanDerWaalsContact O-CG2 3.27Å; K249-V253 WeakPolarHBondContact O-CG2 3.3Å; K249-V253 PolarHBondContact O-N 2.78Å; K249-F313 HydrophobicContact CD-CD1 3.54Å; K249-F313 HydrophobicContact CD-CE1 3.35Å; K249-F313 HydrophobicContact CD-CG 4.31Å; K249-F313 HydrophobicContact CD-CZ 3.96Å; K249-F313 HydrophobicContact CG-CD1 3.83Å; K249-F313 HydrophobicContact CG-CE1 4.04Å; K249-F313 HydrophobicContact CG-CG 4.13Å; K249-F313 HydrophobicContact CG-CZ 4.48Å; K249-F313 VanDerWaalsContact NZ-CZ 3.27Å |
| 250 | M | 83.9 | Confident | 81.4 | Confident | 4 Ų | 4 | 54.2 Ų | 54.2 | 2% | 0.02 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -57.8 | -51.8 | 175 | 176 | -163.7 | 71.4 | 0 | 0 | 111.7 | R136 K246 V247 L248 T252 V253 H254 F313 T314 | R136-M250 HydrophobicContact CB-CE 4.23Å; R136-M250 HydrophobicContact CG-CE 3.47Å; R136-M250 VanDerWaalsContact CG-CE 3.47Å; R136-M250 HydrophobicContact CG-SD 4.29Å; R136-M250 PolarHBondContact NE-SD 3.43Å; R136-M250 VanDerWaalsContact NE-SD 3.38Å; K246-M250 WeakPolarHBondContact O-CB 3.38Å; K246-M250 PolarHBondContact O-N 3.01Å; V247-M250 HydrophobicContact CG1-CE 4.21Å; V247-M250 WeakPolarHBondContact O-CB 3.43Å; V247-M250 PolarHBondContact O-N 2.95Å; L248-M250 VanDerWaalsContact C-N 3.32Å; L248-M250 PolarHBondContact O-N 3.25Å; M250-T252 PolarHBondContact O-N 3.39Å; M250-V253 PolarHBondContact O-N 2.98Å; M250-H254 WeakPolarHBondContact CG-CE1 3.46Å; M250-H254 PolarHBondContact O-CD2 3.31Å; M250-H254 PolarHBondContact O-N 3Å; M250-F313 HydrophobicContact CB-CB 4.12Å; M250-T314 HydrophobicContact CG-CG2 4.37Å; M250-T314 VanDerWaalsContact CG-OG1 3.32Å; M250-T314 WeakPolarHBondContact CG-OG1 2.96Å; M250-T314 HydrophobicContact SD-CG2 3.66Å |
| 251 | I | 84.7 | Confident | 82.7 | Confident | 10 Ų | 10 | 52.3 Ų | 52.3 | 5% | 0.051 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -63.3 | -42.9 | -179.8 | -64 | 162.4 | 0 | 0 | 0 | 111.1 | V227 L228 L231 V247 L248 V253 H254 M255 | V227-I251 HydrophobicContact CB-CD1 3.95Å; V227-I251 HydrophobicContact CG1-CD1 3.23Å; L228-I251 HydrophobicContact CD1-CB 4.22Å; L228-I251 HydrophobicContact CD1-CD1 4.22Å; L228-I251 HydrophobicContact CD1-CG2 3.5Å; L231-I251 HydrophobicContact CD1-CD1 4.41Å; V247-I251 HydrophobicContact CG1-CD1 3.87Å; V247-I251 WeakPolarHBondContact O-CG1 3.34Å; V247-I251 PolarHBondContact O-N 3.13Å; L248-I251 PolarHBondContact O-N 3.37Å; I251-V253 VanDerWaalsContact C-N 3.34Å; I251-V253 PolarHBondContact O-N 3.44Å; I251-H254 PolarHBondContact O-N 2.84Å; I251-M255 VanDerWaalsContact O-CB 3.29Å; I251-M255 WeakPolarHBondContact O-CB 3.28Å; I251-M255 PolarHBondContact O-N 3.42Å |
| 252 | T | 85.8 | Confident | 84 | Confident | 79 Ų | 79 | 50.5 Ų | 50.5 | 49% | 0.485 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -60.1 | -44.5 | 177.1 | -61.7 | 0 | 0 | 0 | 0 | 111.4 | L248 K249 M250 A256 | L248-T252 WeakPolarHBondContact O-CB 3.47Å; L248-T252 PolarHBondContact O-N 3.48Å; L248-T252 PolarHBondContact O-OG1 3.24Å; L248-T252 VanDerWaalsContact O-OG1 3.05Å; K249-T252 PolarHBondContact O-N 3.33Å; M250-T252 PolarHBondContact O-N 3.39Å; T252-A256 VanDerWaalsContact O-CB 3.24Å; T252-A256 WeakPolarHBondContact O-CB 3.48Å; T252-A256 PolarHBondContact O-N 2.96Å |
| 253 | V | 87.4 | Confident | 85.6 | Confident | 29 Ų | 29 | 45.9 Ų | 45.9 | 18% | 0.176 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -65.8 | -45.2 | 178.4 | 170.2 | 0 | 0 | 0 | 0 | 111.1 | K249 M250 I251 M255 A256 V257 F309 I310 F313 | K249-V253 WeakPolarHBondContact O-CB 3.35Å; K249-V253 VanDerWaalsContact O-CG2 3.27Å; K249-V253 WeakPolarHBondContact O-CG2 3.3Å; K249-V253 PolarHBondContact O-N 2.78Å; M250-V253 PolarHBondContact O-N 2.98Å; I251-V253 VanDerWaalsContact C-N 3.34Å; I251-V253 PolarHBondContact O-N 3.44Å; V253-M255 VanDerWaalsContact C-N 3.34Å; V253-M255 PolarHBondContact O-N 3.45Å; V253-A256 PolarHBondContact O-N 3.05Å; V253-V257 HydrophobicContact CG1-CG2 4.45Å; V253-V257 WeakPolarHBondContact O-CG2 3.17Å; V253-V257 PolarHBondContact O-N 3.22Å; V253-F309 HydrophobicContact CG1-CB 4.17Å; V253-I310 HydrophobicContact CG1-CG1 4.21Å; V253-F313 HydrophobicContact CB-CD2 4.21Å; V253-F313 HydrophobicContact CG1-CD2 4.2Å; V253-F313 HydrophobicContact CG2-CD2 3.7Å; V253-F313 HydrophobicContact CG2-CE2 3.97Å |
| 254 | H | 84.4 | Confident | 86.8 | Confident | 4 Ų | 4 | 44 Ų | 44 | 2% | 0.019 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -62 | -44.3 | 179.3 | -64.2 | -178.8 | 0 | 0 | 0 | 111.7 | M250 I251 V257 F258 I310 T314 | M250-H254 WeakPolarHBondContact CG-CE1 3.46Å; M250-H254 PolarHBondContact O-CD2 3.31Å; M250-H254 PolarHBondContact O-N 3Å; I251-H254 PolarHBondContact O-N 2.84Å; H254-V257 PolarHBondContact O-N 3.31Å; H254-F258 WeakPolarHBondContact O-CB 3.43Å; H254-F258 PolarHBondContact O-N 3.13Å; H254-I310 VanDerWaalsContact CD2-CG2 3.46Å; H254-I310 WeakPolarHBondContact CD2-CG2 3.3Å; H254-I310 WeakPolarHBondContact NE2-CG2 3.36Å; H254-T314 PolarHBondContact CE1-OG1 3.37Å; H254-T314 PolarHBondContact NE2-OG1 2.84Å |
| 255 | M | 88.3 | Confident | 87.6 | Confident | 49 Ų | 49 | 41.7 Ų | 41.7 | 24% | 0.241 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -63.8 | -42.9 | 176.9 | -170.7 | 69.3 | 174.9 | 0 | 0 | 111.3 | V221 I251 V253 F258 V259 | V221-M255 HydrophobicContact CB-CE 4.26Å; V221-M255 HydrophobicContact CG2-CE 3.57Å; I251-M255 VanDerWaalsContact O-CB 3.29Å; I251-M255 WeakPolarHBondContact O-CB 3.28Å; I251-M255 PolarHBondContact O-N 3.42Å; V253-M255 VanDerWaalsContact C-N 3.34Å; V253-M255 PolarHBondContact O-N 3.45Å; M255-F258 PolarHBondContact O-N 3.21Å; M255-V259 HydrophobicContact CE-CG2 4.02Å; M255-V259 HydrophobicContact CG-CG2 4.35Å; M255-V259 WeakPolarHBondContact O-CB 3.39Å; M255-V259 VanDerWaalsContact O-CG2 3.29Å; M255-V259 WeakPolarHBondContact O-CG2 3.49Å; M255-V259 PolarHBondContact O-N 3.22Å; M255-V259 HydrophobicContact SD-CG2 4.39Å |
| 256 | A | 90 | Very high | 88.3 | Confident | 49 Ų | 49 | 33 Ų | 33 | 41% | 0.405 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -62.2 | -46.8 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | T252 V253 F258 V259 V260 | T252-A256 VanDerWaalsContact O-CB 3.24Å; T252-A256 WeakPolarHBondContact O-CB 3.48Å; T252-A256 PolarHBondContact O-N 2.96Å; V253-A256 PolarHBondContact O-N 3.05Å; A256-F258 VanDerWaalsContact C-N 3.34Å; A256-F258 PolarHBondContact O-N 3.01Å; A256-V259 PolarHBondContact O-N 3.01Å; A256-V260 VanDerWaalsContact O-CB 3.24Å; A256-V260 WeakPolarHBondContact O-CB 3.41Å; A256-V260 VanDerWaalsContact O-CG2 3.22Å; A256-V260 WeakPolarHBondContact O-CG2 3.3Å; A256-V260 PolarHBondContact O-N 2.69Å |
| 257 | V | 90.7 | Very high | 89 | Confident | 11 Ų | 11 | 33.7 Ų | 33.7 | 7% | 0.067 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -61 | -44.9 | 176.2 | 174.5 | 0 | 0 | 0 | 0 | 110.6 | V253 H254 V259 C261 F306 I310 | V253-V257 HydrophobicContact CG1-CG2 4.45Å; V253-V257 WeakPolarHBondContact O-CG2 3.17Å; V253-V257 PolarHBondContact O-N 3.22Å; H254-V257 PolarHBondContact O-N 3.31Å; V257-V259 PolarHBondContact O-N 3.03Å; V257-C261 VanDerWaalsContact O-CB 3.23Å; V257-C261 WeakPolarHBondContact O-CB 3.12Å; V257-C261 PolarHBondContact O-N 3.39Å; V257-C261 PolarHBondContact O-SG 3.12Å; V257-F306 HydrophobicContact CG1-CB 4.26Å; V257-F306 HydrophobicContact CG2-CB 3.75Å; V257-F306 HydrophobicContact CG2-CG 4.46Å; V257-I310 HydrophobicContact CB-CD1 4.15Å; V257-I310 HydrophobicContact CG1-CD1 4.1Å; V257-I310 HydrophobicContact CG2-CD1 4.14Å; V257-I310 HydrophobicContact CG2-CG1 4.32Å |
| 258 | F | 90.8 | Very high | 89.6 | Confident | 0 Ų | 0 | 33.1 Ų | 33.1 | 0% | 0 | 19% | 0.193 | C | C | . | . | I | π-helix | trans | -61 | -48.2 | -179.9 | -171.7 | -82.1 | 0 | 0 | 0 | 112.1 | M126 L129 F213 P216 L217 H254 M255 A256 F262 V263 | M126-F258 HydrophobicContact CB-CE2 4.04Å; M126-F258 HydrophobicContact CG-CE2 3.89Å; M126-F258 HydrophobicContact CG-CZ 4.43Å; L129-F258 HydrophobicContact CB-CD2 4.5Å; L129-F258 HydrophobicContact CD1-CD2 4.41Å; F213-F258 HydrophobicContact CE2-CE1 4.34Å; P216-F258 HydrophobicContact CB-CE2 4.25Å; P216-F258 HydrophobicContact CB-CZ 4.07Å; L217-F258 HydrophobicContact CB-CE1 4.02Å; L217-F258 HydrophobicContact CB-CZ 4.32Å; L217-F258 HydrophobicContact CD1-CD1 4.23Å; L217-F258 HydrophobicContact CD1-CE1 3.66Å; L217-F258 HydrophobicContact CG-CE1 4.46Å; H254-F258 WeakPolarHBondContact O-CB 3.43Å; H254-F258 PolarHBondContact O-N 3.13Å; M255-F258 PolarHBondContact O-N 3.21Å; A256-F258 VanDerWaalsContact C-N 3.34Å; A256-F258 PolarHBondContact O-N 3.01Å; F258-F262 HydrophobicContact CB-CD2 4.4Å; F258-F262 AromaticContact CD2-CD2 3.85Å; F258-F262 HydrophobicContact CD2-CD2 3.85Å; F258-F262 HydrophobicContact CD2-CE2 4.41Å; F258-F262 HydrophobicContact CE2-CD2 4.31Å; F258-F262 HydrophobicContact CG-CD2 4.13Å; F258-F262 WeakPolarHBondContact O-CB 3.31Å; F258-F262 PolarHBondContact O-N 2.9Å; F258-V263 HydrophobicContact CD1-CG2 4.46Å; F258-V263 HydrophobicContact CE1-CG2 4.42Å |
| 259 | V | 91.9 | Very high | 89.9 | Confident | 61 Ų | 61 | 30.4 Ų | 30.4 | 37% | 0.37 | 18% | 0.179 | S | C | . | . | I | π-helix | trans | -68.9 | -44.2 | -178.6 | 172.7 | 0 | 0 | 0 | 0 | 111.3 | M255 A256 V257 V263 P264 | M255-V259 HydrophobicContact CE-CG2 4.02Å; M255-V259 HydrophobicContact CG-CG2 4.35Å; M255-V259 WeakPolarHBondContact O-CB 3.39Å; M255-V259 VanDerWaalsContact O-CG2 3.29Å; M255-V259 WeakPolarHBondContact O-CG2 3.49Å; M255-V259 PolarHBondContact O-N 3.22Å; M255-V259 HydrophobicContact SD-CG2 4.39Å; A256-V259 PolarHBondContact O-N 3.01Å; V257-V259 PolarHBondContact O-N 3.03Å; V259-V263 HydrophobicContact CB-CG2 4.49Å; V259-V263 WeakPolarHBondContact O-CB 3.17Å; V259-P264 WeakPolarHBondContact O-CD 3.49Å |
| 260 | V | 92.3 | Very high | 90.3 | Very high | 70 Ų | 70 | 28.9 Ų | 28.9 | 42% | 0.424 | 17% | 0.173 | S | C | . | . | I | π-helix | trans | -72 | -43 | -176.8 | 172.1 | 0 | 0 | 0 | 0 | 111.2 | A256 P264 L299 | A256-V260 VanDerWaalsContact O-CB 3.24Å; A256-V260 WeakPolarHBondContact O-CB 3.41Å; A256-V260 VanDerWaalsContact O-CG2 3.22Å; A256-V260 WeakPolarHBondContact O-CG2 3.3Å; A256-V260 PolarHBondContact O-N 2.69Å; V260-P264 WeakPolarHBondContact O-CD 3.07Å; V260-P264 WeakPolarHBondContact O-CG 3.42Å; V260-L299 HydrophobicContact CG1-CD1 3.95Å; V260-L299 HydrophobicContact CG1-CD2 4.45Å; V260-L299 HydrophobicContact CG1-CG 4.43Å; V260-L299 WeakPolarHBondContact O-CD2 3.33Å; V260-L299 WeakPolarHBondContact O-CG 3.19Å |
| 261 | C | 93.3 | Very high | 90.5 | Very high | 0 Ų | 0 | 30.2 Ų | 30.2 | 0% | 0 | 18% | 0.18 | C | C | . | . | I | π-helix | trans | -85.4 | -42.2 | -172.3 | -55 | 0 | 0 | 0 | 0 | 112.4 | V257 A300 N303 F306 | V257-C261 VanDerWaalsContact O-CB 3.23Å; V257-C261 WeakPolarHBondContact O-CB 3.12Å; V257-C261 PolarHBondContact O-N 3.39Å; V257-C261 PolarHBondContact O-SG 3.12Å; C261-A300 WeakPolarHBondContact O-CA 3.21Å; C261-A300 WeakPolarHBondContact O-CB 3.14Å; C261-N303 HydrophobicContact CB-CB 3.98Å; C261-F306 VanDerWaalsContact SG-CD2 3.56Å |
| 262 | F | 93.2 | Very high | 90.6 | Very high | 0 Ų | 0 | 31.8 Ų | 31.8 | 0% | 0 | 19% | 0.185 | C | C | . | . | I | π-helix | trans | -99.7 | -38.6 | -169.4 | -53.9 | -62.3 | 0 | 0 | 0 | 113.6 | M126 L129 F258 Y265 N266 N303 | M126-F262 HydrophobicContact CE-CB 4.17Å; M126-F262 HydrophobicContact CE-CD1 3.8Å; M126-F262 HydrophobicContact CE-CG 4.14Å; M126-F262 HydrophobicContact CG-CB 3.94Å; M126-F262 HydrophobicContact CG-CD1 3.66Å; M126-F262 HydrophobicContact CG-CD2 3.61Å; M126-F262 HydrophobicContact CG-CE1 4.04Å; M126-F262 HydrophobicContact CG-CE2 4.06Å; M126-F262 HydrophobicContact CG-CG 3.43Å; M126-F262 VanDerWaalsContact CG-CG 3.43Å; M126-F262 HydrophobicContact CG-CZ 4.24Å; M126-F262 HydrophobicContact SD-CB 3.8Å; M126-F262 HydrophobicContact SD-CD1 4.19Å; M126-F262 HydrophobicContact SD-CG 3.94Å; L129-F262 HydrophobicContact CD1-CE2 3.59Å; L129-F262 HydrophobicContact CD1-CZ 4.34Å; F258-F262 HydrophobicContact CB-CD2 4.4Å; F258-F262 AromaticContact CD2-CD2 3.85Å; F258-F262 HydrophobicContact CD2-CD2 3.85Å; F258-F262 HydrophobicContact CD2-CE2 4.41Å; F258-F262 HydrophobicContact CE2-CD2 4.31Å; F258-F262 HydrophobicContact CG-CD2 4.13Å; F258-F262 WeakPolarHBondContact O-CB 3.31Å; F258-F262 PolarHBondContact O-N 2.9Å; F262-Y265 PolarHBondContact O-N 3.11Å; F262-N266 PolarHBondContact O-N 3.45Å; F262-N266 PolarHBondContact O-ND2 3.32Å; F262-N303 HydrophobicContact CE1-CB 4.05Å; F262-N303 HydrophobicContact CE2-CB 4.47Å; F262-N303 HydrophobicContact CZ-CB 3.64Å |
| 263 | V | 93.6 | Very high | 90.6 | Very high | 37 Ų | 37 | 28 Ų | 28 | 22% | 0.224 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -61.3 | -46 | -174.8 | 176.2 | 0 | 0 | 0 | 0 | 112.6 | F213 L217 F258 V259 Y265 S267 | F213-V263 HydrophobicContact CE2-CB 4.41Å; F213-V263 HydrophobicContact CE2-CG2 3.92Å; F213-V263 HydrophobicContact CZ-CB 4.17Å; F213-V263 HydrophobicContact CZ-CG1 4.21Å; F213-V263 HydrophobicContact CZ-CG2 3.9Å; L217-V263 HydrophobicContact CD1-CG2 4.03Å; F258-V263 HydrophobicContact CD1-CG2 4.46Å; F258-V263 HydrophobicContact CE1-CG2 4.42Å; V259-V263 HydrophobicContact CB-CG2 4.49Å; V259-V263 WeakPolarHBondContact O-CB 3.17Å; V263-Y265 PolarHBondContact O-N 2.84Å; V263-S267 WeakPolarHBondContact O-CB 3.44Å; V263-S267 PolarHBondContact O-N 3.31Å; V263-S267 PolarHBondContact O-OG 3.49Å |
| 264 | P | 95.3 | Very high | 90.6 | Very high | 39 Ų | 39 | 28.3 Ų | 28.3 | 25% | 0.253 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -61.7 | -42.9 | 178.2 | -25.9 | 35.7 | 0 | 0 | 0 | 112.6 | V259 V260 V268 T296 L299 | V259-P264 WeakPolarHBondContact O-CD 3.49Å; V260-P264 WeakPolarHBondContact O-CD 3.07Å; V260-P264 WeakPolarHBondContact O-CG 3.42Å; P264-V268 WeakPolarHBondContact O-CB 3.42Å; P264-V268 VanDerWaalsContact O-CG2 3.26Å; P264-V268 WeakPolarHBondContact O-CG2 3.31Å; P264-V268 PolarHBondContact O-N 2.75Å; P264-T296 HydrophobicContact CB-CG2 3.66Å; P264-L299 HydrophobicContact CB-CD2 4.25Å; P264-L299 HydrophobicContact CG-CD2 4Å |
| 265 | Y | 93.9 | Very high | 90.6 | Very high | 5 Ų | 5 | 28.3 Ų | 28.3 | 2% | 0.02 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -64.5 | -55 | -178.5 | 173.9 | -108.3 | 0 | 0 | 0 | 112.1 | I122 F262 V263 S267 V268 L269 Y293 L297 A300 | I122-Y265 HydrophobicContact CD1-CD1 3.85Å; I122-Y265 HydrophobicContact CD1-CE1 3.54Å; I122-Y265 HydrophobicContact CG2-CD1 4.44Å; I122-Y265 HydrophobicContact CG2-CE1 4.19Å; F262-Y265 PolarHBondContact O-N 3.11Å; V263-Y265 PolarHBondContact O-N 2.84Å; Y265-S267 VanDerWaalsContact C-N 3.32Å; Y265-S267 PolarHBondContact O-N 3.08Å; Y265-V268 PolarHBondContact O-N 3.04Å; Y265-L269 HydrophobicContact CE1-CD2 3.91Å; Y265-L269 VanDerWaalsContact O-CB 3.3Å; Y265-L269 WeakPolarHBondContact O-CB 3.49Å; Y265-L269 PolarHBondContact O-N 3.34Å; Y265-Y293 HydrophobicContact CE2-CD2 4.4Å; Y265-Y293 AromaticContact CE2-CE2 3.74Å; Y265-Y293 HydrophobicContact CE2-CE2 3.74Å; Y265-L297 HydrophobicContact CD2-CB 4.12Å; Y265-L297 HydrophobicContact CD2-CD1 4.31Å; Y265-L297 HydrophobicContact CE2-CB 4.03Å; Y265-L297 HydrophobicContact CE2-CD1 3.66Å; Y265-L297 HydrophobicContact CE2-CG 4.46Å; Y265-A300 HydrophobicContact CD1-CB 4.3Å; Y265-A300 HydrophobicContact CD2-CB 4.47Å; Y265-A300 HydrophobicContact CG-CB 3.93Å |
| 266 | N | 91.9 | Very high | 90.3 | Very high | 0 Ų | 0 | 29.8 Ų | 29.8 | 0% | 0 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -64.2 | -38.4 | -177.5 | -69.5 | -82.3 | 0 | 0 | 0 | 111.3 | M126 E209 F213 F262 V268 L269 F270 | M126-N266 VanDerWaalsContact CE-ND2 3.26Å; M126-N266 WeakPolarHBondContact CE-ND2 3.3Å; E209-N266 PolarHBondContact OE1-OD1 3.05Å; E209-N266 VanDerWaalsContact OE2-CA 3.22Å; E209-N266 WeakPolarHBondContact OE2-CA 3.26Å; E209-N266 WeakPolarHBondContact OE2-CB 3.14Å; E209-N266 PolarHBondContact OE2-OD1 2.69Å; E209-N266 VanDerWaalsContact OE2-OD1 3.08Å; F213-N266 HydrophobicContact CB-CB 4.03Å; F213-N266 HydrophobicContact CD1-CB 3.61Å; F213-N266 HydrophobicContact CD2-CB 3.64Å; F213-N266 HydrophobicContact CE1-CB 3.9Å; F213-N266 HydrophobicContact CE2-CB 3.93Å; F213-N266 HydrophobicContact CG-CB 3.47Å; F213-N266 VanDerWaalsContact CG-CB 3.47Å; F213-N266 HydrophobicContact CZ-CB 4.05Å; F262-N266 PolarHBondContact O-N 3.45Å; F262-N266 PolarHBondContact O-ND2 3.32Å; N266-V268 PolarHBondContact O-N 2.91Å; N266-L269 PolarHBondContact O-N 2.91Å; N266-F270 WeakPolarHBondContact O-CB 3.28Å; N266-F270 PolarHBondContact O-N 3.35Å |
| 267 | S | 92.3 | Very high | 89.8 | Confident | 56 Ų | 56 | 28.1 Ų | 28.1 | 39% | 0.392 | 15% | 0.151 | S | C | . | . | H | α-helix | trans | -63.1 | -44 | 176.2 | -57.5 | 0 | 0 | 0 | 0 | 112.2 | V263 Y265 L271 | V263-S267 WeakPolarHBondContact O-CB 3.44Å; V263-S267 PolarHBondContact O-N 3.31Å; V263-S267 PolarHBondContact O-OG 3.49Å; Y265-S267 VanDerWaalsContact C-N 3.32Å; Y265-S267 PolarHBondContact O-N 3.08Å; S267-L271 PolarHBondContact O-N 3.41Å; S267-L271 VanDerWaalsContact O-N 3.11Å |
| 268 | V | 92.7 | Very high | 89.3 | Confident | 12 Ų | 12 | 32.6 Ų | 32.6 | 7% | 0.073 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -71.8 | -36.5 | 177.5 | 172.6 | 0 | 0 | 0 | 0 | 111.5 | P264 Y265 N266 L271 Y272 M292 T296 | P264-V268 WeakPolarHBondContact O-CB 3.42Å; P264-V268 VanDerWaalsContact O-CG2 3.26Å; P264-V268 WeakPolarHBondContact O-CG2 3.31Å; P264-V268 PolarHBondContact O-N 2.75Å; Y265-V268 PolarHBondContact O-N 3.04Å; N266-V268 PolarHBondContact O-N 2.91Å; V268-L271 PolarHBondContact O-N 3.33Å; V268-Y272 WeakPolarHBondContact O-CB 3.22Å; V268-Y272 PolarHBondContact O-N 3.42Å; V268-M292 HydrophobicContact CG1-CB 4.01Å; V268-M292 HydrophobicContact CG2-CB 4.04Å; V268-T296 HydrophobicContact CB-CG2 4.5Å; V268-T296 HydrophobicContact CG2-CG2 3.95Å |
| 269 | L | 89.9 | Confident | 88.8 | Confident | 12 Ų | 12 | 35.9 Ų | 35.9 | 6% | 0.063 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -64.8 | -43.1 | 176.1 | 176.9 | 54.2 | 0 | 0 | 0 | 111.5 | T205 E209 Y265 N266 Y272 A273 Y293 | T205-L269 HydrophobicContact CG2-CD1 4.17Å; T205-L269 HydrophobicContact CG2-CG 4.17Å; E209-L269 HydrophobicContact CG-CD2 4.5Å; E209-L269 HydrophobicContact CG-CG 4.41Å; E209-L269 WeakPolarHBondContact OE1-CD2 3.49Å; Y265-L269 HydrophobicContact CE1-CD2 3.91Å; Y265-L269 VanDerWaalsContact O-CB 3.3Å; Y265-L269 WeakPolarHBondContact O-CB 3.49Å; Y265-L269 PolarHBondContact O-N 3.34Å; N266-L269 PolarHBondContact O-N 2.91Å; L269-Y272 PolarHBondContact O-N 3.1Å; L269-A273 WeakPolarHBondContact O-CB 3.26Å; L269-A273 PolarHBondContact O-N 2.61Å; L269-Y293 HydrophobicContact CD1-CE2 3.97Å |
| 270 | F | 89.6 | Confident | 88.3 | Confident | 79 Ų | 79 | 35.9 Ų | 35.9 | 35% | 0.346 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -59.3 | -48.6 | 173 | -178.8 | -99.7 | 0 | 0 | 0 | 111.6 | I206 E209 V210 N266 Y272 A273 L274 | I206-F270 HydrophobicContact CG1-CD2 4.47Å; I206-F270 HydrophobicContact CG1-CE2 4.31Å; I206-F270 HydrophobicContact CG2-CE2 4.09Å; E209-F270 HydrophobicContact CB-CD2 4.26Å; V210-F270 HydrophobicContact CG2-CE2 4.3Å; N266-F270 WeakPolarHBondContact O-CB 3.28Å; N266-F270 PolarHBondContact O-N 3.35Å; F270-Y272 VanDerWaalsContact C-N 3.34Å; F270-Y272 PolarHBondContact O-N 3.38Å; F270-A273 PolarHBondContact O-N 3.05Å; F270-L274 HydrophobicContact CD1-CD1 3.94Å; F270-L274 HydrophobicContact CE1-CD1 3.44Å; F270-L274 VanDerWaalsContact CE1-CD1 3.44Å; F270-L274 HydrophobicContact CE1-CG 4.24Å; F270-L274 HydrophobicContact CZ-CD1 3.92Å; F270-L274 HydrophobicContact CZ-CG 4.41Å; F270-L274 WeakPolarHBondContact O-CG 3.25Å; F270-L274 PolarHBondContact O-N 3.44Å; F270-L274 VanDerWaalsContact O-N 3.08Å |
| 271 | L | 90.1 | Very high | 87.8 | Confident | 33 Ų | 33 | 38.1 Ų | 38.1 | 17% | 0.173 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -59.9 | -44.2 | 175.4 | 178.9 | 62.4 | 0 | 0 | 0 | 111.8 | S267 V268 A273 L274 V275 L285 F288 A289 | S267-L271 PolarHBondContact O-N 3.41Å; S267-L271 VanDerWaalsContact O-N 3.11Å; V268-L271 PolarHBondContact O-N 3.33Å; L271-A273 VanDerWaalsContact C-N 3.32Å; L271-A273 PolarHBondContact O-N 2.92Å; L271-L274 PolarHBondContact O-N 2.98Å; L271-V275 HydrophobicContact CD1-CG2 4.16Å; L271-V275 WeakPolarHBondContact O-CG2 3.33Å; L271-V275 PolarHBondContact O-N 2.69Å; L271-L285 HydrophobicContact CD1-CD2 3.97Å; L271-L285 HydrophobicContact CD1-CG 4.38Å; L271-F288 HydrophobicContact CD2-CD1 3.83Å; L271-F288 HydrophobicContact CD2-CE1 4.14Å; L271-A289 HydrophobicContact CD2-CB 4.3Å; L271-A289 HydrophobicContact CG-CB 4.25Å |
| 272 | Y | 86.8 | Confident | 87.5 | Confident | 42 Ų | 42 | 41.5 Ų | 41.5 | 17% | 0.165 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -61.4 | -40.2 | 178.3 | -177.8 | -101.2 | 0 | 0 | 0 | 111.5 | W197 V268 L269 F270 R276 A289 K290 | W197-Y272 HydrophobicContact CH2-CE1 4.35Å; W197-Y272 HydrophobicContact CZ2-CD1 4.18Å; W197-Y272 HydrophobicContact CZ2-CE1 4.03Å; V268-Y272 WeakPolarHBondContact O-CB 3.22Å; V268-Y272 PolarHBondContact O-N 3.42Å; L269-Y272 PolarHBondContact O-N 3.1Å; F270-Y272 VanDerWaalsContact C-N 3.34Å; F270-Y272 PolarHBondContact O-N 3.38Å; Y272-R276 WeakPolarHBondContact O-CB 3.41Å; Y272-R276 PolarHBondContact O-N 2.69Å; Y272-R276 PolarHBondContact OH-NH1 3.21Å; Y272-A289 HydrophobicContact CD2-CB 4.16Å; Y272-K290 HydrophobicContact CE2-CG 4.24Å |
| 273 | A | 85.4 | Confident | 87.2 | Confident | 0 Ų | 0 | 43.7 Ų | 43.7 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -63 | -43.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | S202 T205 I206 L269 F270 L271 S277 | S202-A273 PolarHBondContact OG-O 2.98Å; T205-A273 HydrophobicContact CG2-CB 4.16Å; I206-A273 HydrophobicContact CG1-CB 4.21Å; L269-A273 WeakPolarHBondContact O-CB 3.26Å; L269-A273 PolarHBondContact O-N 2.61Å; F270-A273 PolarHBondContact O-N 3.05Å; L271-A273 VanDerWaalsContact C-N 3.32Å; L271-A273 PolarHBondContact O-N 2.92Å; A273-S277 VanDerWaalsContact O-CB 3.3Å; A273-S277 WeakPolarHBondContact O-CB 3.32Å; A273-S277 PolarHBondContact O-N 3.09Å; A273-S277 PolarHBondContact O-OG 3.31Å |
| 274 | L | 85.9 | Confident | 87 | Confident | 36 Ų | 36 | 49.2 Ų | 49.2 | 19% | 0.188 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -64.6 | -43.7 | 177.8 | -69.8 | 177.9 | 0 | 0 | 0 | 113 | I206 F270 L271 S277 Q278 A279 I280 | I206-L274 HydrophobicContact CD1-CD2 3.95Å; F270-L274 HydrophobicContact CD1-CD1 3.94Å; F270-L274 HydrophobicContact CE1-CD1 3.44Å; F270-L274 VanDerWaalsContact CE1-CD1 3.44Å; F270-L274 HydrophobicContact CE1-CG 4.24Å; F270-L274 HydrophobicContact CZ-CD1 3.92Å; F270-L274 HydrophobicContact CZ-CG 4.41Å; F270-L274 WeakPolarHBondContact O-CG 3.25Å; F270-L274 PolarHBondContact O-N 3.44Å; F270-L274 VanDerWaalsContact O-N 3.08Å; L271-L274 PolarHBondContact O-N 2.98Å; L274-S277 PolarHBondContact O-OG 2.68Å; L274-Q278 PolarHBondContact O-N 3.07Å; L274-A279 HydrophobicContact CD2-CB 4.24Å; L274-A279 WeakPolarHBondContact O-CB 3.01Å; L274-A279 PolarHBondContact O-N 3.5Å; L274-I280 HydrophobicContact CB-CD1 4.09Å; L274-I280 HydrophobicContact CB-CG1 4.37Å; L274-I280 HydrophobicContact CD1-CD1 3.9Å; L274-I280 PolarHBondContact O-N 3.38Å |
| 275 | V | 85.9 | Confident | 86.8 | Confident | 4 Ų | 4 | 49.6 Ų | 49.6 | 2% | 0.024 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -71.9 | -42 | 179.8 | 178.9 | 0 | 0 | 0 | 0 | 111 | L271 S277 Q278 L285 E286 | L271-V275 HydrophobicContact CD1-CG2 4.16Å; L271-V275 WeakPolarHBondContact O-CG2 3.33Å; L271-V275 PolarHBondContact O-N 2.69Å; V275-S277 VanDerWaalsContact C-N 3.31Å; V275-S277 PolarHBondContact O-N 2.84Å; V275-Q278 PolarHBondContact O-N 2.79Å; V275-Q278 PolarHBondContact O-NE2 3.01Å; V275-L285 HydrophobicContact CG2-CB 4.18Å; V275-E286 HydrophobicContact CG1-CB 3.5Å; V275-E286 HydrophobicContact CG1-CG 3.64Å |
| 276 | R | 80.6 | Confident | 86.5 | Confident | 80 Ų | 80 | 51.4 Ų | 51.4 | 30% | 0.302 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -69.7 | -27 | -179.8 | -168.9 | 171.1 | 174.4 | 104.4 | 4.7 | 113.2 | F192 W197 Y272 Q278 | F192-R276 PolarHBondContact O-NH2 3.5Å; W197-R276 VanDerWaalsContact CD1-CG 3.43Å; W197-R276 HydrophobicContact CD2-CG 4.4Å; W197-R276 HydrophobicContact CG-CG 3.98Å; Y272-R276 WeakPolarHBondContact O-CB 3.41Å; Y272-R276 PolarHBondContact O-N 2.69Å; Y272-R276 PolarHBondContact OH-NH1 3.21Å; R276-Q278 PolarHBondContact O-N 3.39Å |
| 277 | S | 80 | Confident | 86.4 | Confident | 13 Ų | 13 | 56.9 Ų | 56.9 | 9% | 0.091 | 29% | 0.293 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -78.3 | -4.7 | 171.6 | 56.8 | 0 | 0 | 0 | 0 | 114.1 | K198 S202 A273 L274 V275 A279 | K198-S277 WeakPolarHBondContact CE-O 3.06Å; S202-S277 VanDerWaalsContact OG-CB 3.3Å; S202-S277 WeakPolarHBondContact OG-CB 3.4Å; S202-S277 PolarHBondContact OG-OG 2.96Å; A273-S277 VanDerWaalsContact O-CB 3.3Å; A273-S277 WeakPolarHBondContact O-CB 3.32Å; A273-S277 PolarHBondContact O-N 3.09Å; A273-S277 PolarHBondContact O-OG 3.31Å; L274-S277 PolarHBondContact O-OG 2.68Å; V275-S277 VanDerWaalsContact C-N 3.31Å; V275-S277 PolarHBondContact O-N 2.84Å; S277-A279 PolarHBondContact O-N 3.37Å |
| 278 | Q | 80.3 | Confident | 86.4 | Confident | 106 Ų | 106 | 58.7 Ų | 58.7 | 50% | 0.495 | 29% | 0.294 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 61.6 | 24.1 | -172.5 | -55.1 | -75 | -71.3 | 0 | 0 | 112.7 | L274 V275 R276 I280 T281 | L274-Q278 PolarHBondContact O-N 3.07Å; V275-Q278 PolarHBondContact O-N 2.79Å; V275-Q278 PolarHBondContact O-NE2 3.01Å; R276-Q278 PolarHBondContact O-N 3.39Å; Q278-I280 VanDerWaalsContact C-N 3.31Å; Q278-T281 HydrophobicContact CB-CG2 4.48Å |
| 279 | A | 79.5 | Confident | 86.3 | Confident | 69 Ų | 69 | 58.2 Ų | 58.2 | 57% | 0.57 | 29% | 0.291 | S | S | * | . | S | Bend | trans | -71.9 | -30.9 | 169.4 | 0 | 0 | 0 | 0 | 0 | 111 | L274 S277 | L274-A279 HydrophobicContact CD2-CB 4.24Å; L274-A279 WeakPolarHBondContact O-CB 3.01Å; L274-A279 PolarHBondContact O-N 3.5Å; S277-A279 PolarHBondContact O-N 3.37Å |
| 280 | I | 81.6 | Confident | 86.3 | Confident | 61 Ų | 61 | 60.4 Ų | 60.4 | 31% | 0.313 | 30% | 0.3 | S | S | . | . | S | Bend | trans | -124.1 | 119.1 | 170.8 | -60.2 | 176.1 | 0 | 0 | 0 | 108.5 | L274 Q278 N282 L285 | L274-I280 HydrophobicContact CB-CD1 4.09Å; L274-I280 HydrophobicContact CB-CG1 4.37Å; L274-I280 HydrophobicContact CD1-CD1 3.9Å; L274-I280 PolarHBondContact O-N 3.38Å; Q278-I280 VanDerWaalsContact C-N 3.31Å; I280-N282 HydrophobicContact CG2-CB 4.19Å; I280-L285 HydrophobicContact CG2-CD2 3.94Å |
| 281 | T | 82.4 | Confident | 86.3 | Confident | 116 Ų | 116 | 59.9 Ų | 59.9 | 71% | 0.712 | 30% | 0.3 | S | S | * | . | trans | -103.8 | 80.6 | 177.6 | 45.5 | 0 | 0 | 0 | 0 | 110.1 | Q278 | Q278-T281 HydrophobicContact CB-CG2 4.48Š| ||
| 282 | N | 86.8 | Confident | 86.6 | Confident | 72 Ų | 72 | 61 Ų | 61 | 39% | 0.385 | 31% | 0.305 | S | S | . | . | trans | -137.2 | 118.1 | 176.3 | -176.5 | -49.4 | 0 | 0 | 0 | 110.5 | I280 F284 L285 E286 | I280-N282 HydrophobicContact CG2-CB 4.19Å; N282-F284 VanDerWaalsContact C-N 3.32Å; N282-F284 PolarHBondContact O-N 2.67Å; N282-F284 WeakPolarHBondContact OD1-CB 3.44Å; N282-F284 PolarHBondContact OD1-N 2.67Å; N282-L285 HydrophobicContact CB-CB 4.16Å; N282-L285 HydrophobicContact CB-CD1 4.32Å; N282-L285 PolarHBondContact O-N 2.99Å; N282-L285 PolarHBondContact OD1-N 3.26Å; N282-E286 PolarHBondContact O-N 2.98Å | ||
| 283 | C | 87.9 | Confident | 86.8 | Confident | 45 Ų | 45 | 62 Ų | 62 | 30% | 0.304 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -63.6 | -36.2 | -174.7 | -157.7 | 0 | 0 | 0 | 0 | 113 | C31 E286 R287 | C31-C283 WeakPolarHBondContact CA-SG 3.42Å; C31-C283 HydrophobicContact CB-CB 4.3Å; C31-C283 WeakPolarHBondContact CB-SG 3.13Å; C31-C283 WeakPolarHBondContact SG-CA 3.39Å; C31-C283 WeakPolarHBondContact SG-CB 3.08Å; C31-C283 CovalentContact SG-SG 2.04Å; C31-C283 PolarHBondContact SG-SG 2.97Å; C283-E286 PolarHBondContact O-N 2.91Å; C283-R287 WeakPolarHBondContact O-CB 3.48Å; C283-R287 VanDerWaalsContact O-CG 3.26Å; C283-R287 WeakPolarHBondContact O-CG 3.27Å; C283-R287 PolarHBondContact O-N 3.36Å |
| 284 | F | 89.3 | Confident | 87.1 | Confident | 153 Ų | 153 | 62.3 Ų | 62.3 | 67% | 0.671 | 31% | 0.311 | S | S | * | . | H | α-helix | trans | -65.4 | -46.9 | 177.4 | 174.5 | -101.3 | 0 | 0 | 0 | 110.8 | N282 E286 R287 F288 | N282-F284 VanDerWaalsContact C-N 3.32Å; N282-F284 PolarHBondContact O-N 2.67Å; N282-F284 WeakPolarHBondContact OD1-CB 3.44Å; N282-F284 PolarHBondContact OD1-N 2.67Å; F284-E286 VanDerWaalsContact C-N 3.33Å; F284-E286 PolarHBondContact O-N 3.15Å; F284-R287 PolarHBondContact O-N 2.79Å; F284-F288 WeakPolarHBondContact O-CB 3.38Å; F284-F288 PolarHBondContact O-N 3.24Å |
| 285 | L | 89.4 | Confident | 87.5 | Confident | 48 Ų | 48 | 63.9 Ų | 63.9 | 25% | 0.251 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -62.5 | -39.1 | 174.8 | -89.7 | 65.1 | 0 | 0 | 0 | 111.9 | L271 V275 I280 N282 F288 A289 | L271-L285 HydrophobicContact CD1-CD2 3.97Å; L271-L285 HydrophobicContact CD1-CG 4.38Å; V275-L285 HydrophobicContact CG2-CB 4.18Å; I280-L285 HydrophobicContact CG2-CD2 3.94Å; N282-L285 HydrophobicContact CB-CB 4.16Å; N282-L285 HydrophobicContact CB-CD1 4.32Å; N282-L285 PolarHBondContact O-N 2.99Å; N282-L285 PolarHBondContact OD1-N 3.26Å; L285-F288 PolarHBondContact O-N 3.11Å; L285-A289 WeakPolarHBondContact O-CB 3.08Å; L285-A289 PolarHBondContact O-N 3.02Å |
| 286 | E | 88.8 | Confident | 88 | Confident | 43 Ų | 43 | 64 Ų | 64 | 20% | 0.201 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -62.3 | -47 | 176.9 | -170.1 | 173.6 | 164 | 0 | 0 | 112.1 | C31 V275 N282 C283 F284 A289 K290 | C31-E286 HydrophobicContact CB-CG 4.45Å; V275-E286 HydrophobicContact CG1-CB 3.5Å; V275-E286 HydrophobicContact CG1-CG 3.64Å; N282-E286 PolarHBondContact O-N 2.98Å; C283-E286 PolarHBondContact O-N 2.91Å; F284-E286 VanDerWaalsContact C-N 3.33Å; F284-E286 PolarHBondContact O-N 3.15Å; E286-A289 PolarHBondContact O-N 3Å; E286-K290 HydrophobicContact CG-CD 4.31Å; E286-K290 WeakPolarHBondContact O-CB 3.35Å; E286-K290 WeakPolarHBondContact O-CG 3.1Å; E286-K290 PolarHBondContact O-N 2.74Å; E286-K290 WeakPolarHBondContact OE1-CE 3.22Å; E286-K290 IonicContact OE1-NZ 2.67Å; E286-K290 PolarHBondContact OE1-NZ 2.78Å |
| 287 | R | 89.5 | Confident | 88.7 | Confident | 114 Ų | 114 | 60.9 Ų | 60.9 | 43% | 0.43 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -62.5 | -47.1 | 177.2 | -69.8 | -176.9 | 173.6 | 178.2 | 1.6 | 110.9 | V33 C283 F284 A289 K290 I291 | V33-R287 HydrophobicContact CG2-CB 3.93Å; V33-R287 HydrophobicContact CG2-CG 3.54Å; C283-R287 WeakPolarHBondContact O-CB 3.48Å; C283-R287 VanDerWaalsContact O-CG 3.26Å; C283-R287 WeakPolarHBondContact O-CG 3.27Å; C283-R287 PolarHBondContact O-N 3.36Å; F284-R287 PolarHBondContact O-N 2.79Å; R287-A289 PolarHBondContact O-N 2.88Å; R287-K290 PolarHBondContact O-N 3.06Å; R287-I291 VanDerWaalsContact O-CG1 3.31Å; R287-I291 WeakPolarHBondContact O-CG1 3.3Å; R287-I291 PolarHBondContact O-N 3.47Å |
| 288 | F | 92.1 | Very high | 89.4 | Confident | 95 Ų | 95 | 60.5 Ų | 60.5 | 42% | 0.417 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -56.9 | -49.9 | 177.1 | 177.8 | -95.8 | 0 | 0 | 0 | 111.7 | L271 F284 L285 K290 I291 M292 | L271-F288 HydrophobicContact CD2-CD1 3.83Å; L271-F288 HydrophobicContact CD2-CE1 4.14Å; F284-F288 WeakPolarHBondContact O-CB 3.38Å; F284-F288 PolarHBondContact O-N 3.24Å; L285-F288 PolarHBondContact O-N 3.11Å; F288-K290 PolarHBondContact O-N 3.35Å; F288-I291 PolarHBondContact O-N 3.38Å; F288-M292 HydrophobicContact CD1-CG 4.31Å; F288-M292 HydrophobicContact CD2-CG 3.88Å; F288-M292 HydrophobicContact CE1-CB 4.5Å; F288-M292 HydrophobicContact CE1-CG 4.04Å; F288-M292 HydrophobicContact CE2-CG 3.58Å; F288-M292 HydrophobicContact CE2-SD 4.34Å; F288-M292 HydrophobicContact CG-CG 4.25Å; F288-M292 HydrophobicContact CZ-CG 3.67Å; F288-M292 VanDerWaalsContact O-CB 3.31Å; F288-M292 WeakPolarHBondContact O-CB 3.31Å; F288-M292 VanDerWaalsContact O-CG 3.3Å; F288-M292 WeakPolarHBondContact O-CG 3.09Å; F288-M292 PolarHBondContact O-N 2.87Å |
| 289 | A | 91.4 | Very high | 90.1 | Very high | 1 Ų | 1 | 57.9 Ų | 57.9 | 1% | 0.008 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -62.6 | -42 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | L271 Y272 L285 E286 R287 Y293 | L271-A289 HydrophobicContact CD2-CB 4.3Å; L271-A289 HydrophobicContact CG-CB 4.25Å; Y272-A289 HydrophobicContact CD2-CB 4.16Å; L285-A289 WeakPolarHBondContact O-CB 3.08Å; L285-A289 PolarHBondContact O-N 3.02Å; E286-A289 PolarHBondContact O-N 3Å; R287-A289 PolarHBondContact O-N 2.88Å; A289-Y293 WeakPolarHBondContact O-CB 3.31Å; A289-Y293 PolarHBondContact O-N 3.39Å |
| 290 | K | 88.4 | Confident | 90.9 | Very high | 58 Ų | 58 | 54.6 Ų | 54.6 | 25% | 0.252 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -63.8 | -39.5 | 177.6 | -74.9 | 176.9 | -174.9 | 171.1 | 0 | 113 | C31 V33 Y272 E286 R287 F288 P294 | C31-K290 PolarHBondContact O-NZ 2.79Å; V33-K290 HydrophobicContact CB-CD 4.35Å; V33-K290 HydrophobicContact CG2-CD 4.28Å; Y272-K290 HydrophobicContact CE2-CG 4.24Å; E286-K290 HydrophobicContact CG-CD 4.31Å; E286-K290 WeakPolarHBondContact O-CB 3.35Å; E286-K290 WeakPolarHBondContact O-CG 3.1Å; E286-K290 PolarHBondContact O-N 2.74Å; E286-K290 WeakPolarHBondContact OE1-CE 3.22Å; E286-K290 IonicContact OE1-NZ 2.67Å; E286-K290 PolarHBondContact OE1-NZ 2.78Å; R287-K290 PolarHBondContact O-N 3.06Å; F288-K290 PolarHBondContact O-N 3.35Å; K290-P294 WeakPolarHBondContact O-CD 3.15Å |
| 291 | I | 91.3 | Very high | 91.5 | Very high | 69 Ų | 69 | 51.7 Ų | 51.7 | 35% | 0.354 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -74.6 | -45.3 | 179.7 | -66.5 | 167.9 | 0 | 0 | 0 | 110.7 | V33 F37 R287 F288 P294 I295 | V33-I291 HydrophobicContact CG1-CD1 4.27Å; V33-I291 HydrophobicContact CG1-CG1 3.86Å; F37-I291 HydrophobicContact CZ-CG2 4.33Å; R287-I291 VanDerWaalsContact O-CG1 3.31Å; R287-I291 WeakPolarHBondContact O-CG1 3.3Å; R287-I291 PolarHBondContact O-N 3.47Å; F288-I291 PolarHBondContact O-N 3.38Å; I291-P294 WeakPolarHBondContact O-CD 3.41Å; I291-P294 WeakPolarHBondContact O-CG 3.34Å; I291-I295 HydrophobicContact CG2-CD1 4.28Å; I291-I295 WeakPolarHBondContact O-CD1 3.39Å |
| 292 | M | 94.4 | Very high | 92.1 | Very high | 56 Ų | 56 | 48.3 Ų | 48.3 | 28% | 0.276 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -76.3 | -29.7 | -173.8 | -67.5 | -57.9 | -65.2 | 0 | 0 | 113 | V268 F288 I295 T296 | V268-M292 HydrophobicContact CG1-CB 4.01Å; V268-M292 HydrophobicContact CG2-CB 4.04Å; F288-M292 HydrophobicContact CD1-CG 4.31Å; F288-M292 HydrophobicContact CD2-CG 3.88Å; F288-M292 HydrophobicContact CE1-CB 4.5Å; F288-M292 HydrophobicContact CE1-CG 4.04Å; F288-M292 HydrophobicContact CE2-CG 3.58Å; F288-M292 HydrophobicContact CE2-SD 4.34Å; F288-M292 HydrophobicContact CG-CG 4.25Å; F288-M292 HydrophobicContact CZ-CG 3.67Å; F288-M292 VanDerWaalsContact O-CB 3.31Å; F288-M292 WeakPolarHBondContact O-CB 3.31Å; F288-M292 VanDerWaalsContact O-CG 3.3Å; F288-M292 WeakPolarHBondContact O-CG 3.09Å; F288-M292 PolarHBondContact O-N 2.87Å; M292-I295 WeakPolarHBondContact O-CB 3.26Å; M292-I295 PolarHBondContact O-N 2.91Å; M292-I295 VanDerWaalsContact O-N 3.12Å; M292-I295 HydrophobicContact SD-CD1 4.2Å; M292-T296 HydrophobicContact CE-CG2 4.32Å; M292-T296 PolarHBondContact O-N 3.42Å; M292-T296 PolarHBondContact O-OG1 3.31Å; M292-T296 VanDerWaalsContact O-OG1 3.11Å |
| 293 | Y | 91.9 | Very high | 92.4 | Very high | 64 Ų | 64 | 44.9 Ų | 44.9 | 25% | 0.251 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -53.4 | -52.9 | -177.8 | 176.2 | -102.7 | 0 | 0 | 0 | 114.1 | Y265 L269 A289 I295 T296 L297 | Y265-Y293 HydrophobicContact CE2-CD2 4.4Å; Y265-Y293 AromaticContact CE2-CE2 3.74Å; Y265-Y293 HydrophobicContact CE2-CE2 3.74Å; L269-Y293 HydrophobicContact CD1-CE2 3.97Å; A289-Y293 WeakPolarHBondContact O-CB 3.31Å; A289-Y293 PolarHBondContact O-N 3.39Å; Y293-I295 VanDerWaalsContact C-N 3.29Å; Y293-I295 PolarHBondContact O-N 3.37Å; Y293-T296 PolarHBondContact O-OG1 2.81Å; Y293-L297 HydrophobicContact CE1-CD2 4.39Å; Y293-L297 WeakPolarHBondContact O-CB 3.21Å; Y293-L297 PolarHBondContact O-N 3.4Å |
| 294 | P | 91.9 | Very high | 92.6 | Very high | 5 Ų | 5 | 42.7 Ų | 42.7 | 3% | 0.032 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -65.7 | -31.2 | 177.6 | 26.1 | -35.5 | 0 | 0 | 0 | 113.1 | F37 K38 K290 I291 C298 | F37-P294 HydrophobicContact CE2-CG 3.93Å; F37-P294 HydrophobicContact CZ-CG 3.65Å; K38-P294 HydrophobicContact CB-CB 3.66Å; K38-P294 HydrophobicContact CB-CG 3.94Å; K290-P294 WeakPolarHBondContact O-CD 3.15Å; I291-P294 WeakPolarHBondContact O-CD 3.41Å; I291-P294 WeakPolarHBondContact O-CG 3.34Å; P294-C298 PolarHBondContact O-N 3.05Å; P294-C298 PolarHBondContact O-SG 2.93Å |
| 295 | I | 95.2 | Very high | 92.7 | Very high | 70 Ų | 70 | 36.1 Ų | 36.1 | 36% | 0.359 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -68.6 | -50.1 | 178.4 | -60.5 | 171.6 | 0 | 0 | 0 | 110.4 | F37 L41 I291 M292 Y293 L297 C298 L299 | F37-I295 HydrophobicContact CE2-CG1 4.29Å; L41-I295 HydrophobicContact CD2-CG1 3.86Å; I291-I295 HydrophobicContact CG2-CD1 4.28Å; I291-I295 WeakPolarHBondContact O-CD1 3.39Å; M292-I295 WeakPolarHBondContact O-CB 3.26Å; M292-I295 PolarHBondContact O-N 2.91Å; M292-I295 VanDerWaalsContact O-N 3.12Å; M292-I295 HydrophobicContact SD-CD1 4.2Å; Y293-I295 VanDerWaalsContact C-N 3.29Å; Y293-I295 PolarHBondContact O-N 3.37Å; I295-L297 VanDerWaalsContact C-N 3.31Å; I295-L297 PolarHBondContact O-N 2.76Å; I295-C298 WeakPolarHBondContact O-CB 3.43Å; I295-C298 PolarHBondContact O-N 3.28Å; I295-L299 PolarHBondContact O-N 3.24Å |
| 296 | T | 96.1 | Very high | 92.6 | Very high | 6 Ų | 6 | 37.1 Ų | 37.1 | 4% | 0.037 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -71.5 | -28.7 | 179.5 | 59.4 | 0 | 0 | 0 | 0 | 112 | P264 V268 M292 Y293 L299 A300 | P264-T296 HydrophobicContact CB-CG2 3.66Å; V268-T296 HydrophobicContact CB-CG2 4.5Å; V268-T296 HydrophobicContact CG2-CG2 3.95Å; M292-T296 HydrophobicContact CE-CG2 4.32Å; M292-T296 PolarHBondContact O-N 3.42Å; M292-T296 PolarHBondContact O-OG1 3.31Å; M292-T296 VanDerWaalsContact O-OG1 3.11Å; Y293-T296 PolarHBondContact O-OG1 2.81Å; T296-L299 WeakPolarHBondContact O-CB 3.3Å; T296-L299 PolarHBondContact O-N 2.88Å; T296-A300 PolarHBondContact O-N 3.23Å |
| 297 | L | 94.1 | Very high | 92.3 | Very high | 14 Ų | 14 | 35 Ų | 35 | 7% | 0.073 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -59.7 | -50.3 | 168.6 | 175.1 | 65.2 | 0 | 0 | 0 | 111.4 | Y46 F118 Y265 Y293 I295 L299 A300 T301 | Y46-L297 WeakPolarHBondContact OH-CD2 3.47Å; F118-L297 HydrophobicContact CE1-CD1 4.2Å; F118-L297 HydrophobicContact CE2-CD1 3.38Å; F118-L297 HydrophobicContact CZ-CD1 3.13Å; Y265-L297 HydrophobicContact CD2-CB 4.12Å; Y265-L297 HydrophobicContact CD2-CD1 4.31Å; Y265-L297 HydrophobicContact CE2-CB 4.03Å; Y265-L297 HydrophobicContact CE2-CD1 3.66Å; Y265-L297 HydrophobicContact CE2-CG 4.46Å; Y293-L297 HydrophobicContact CE1-CD2 4.39Å; Y293-L297 WeakPolarHBondContact O-CB 3.21Å; Y293-L297 PolarHBondContact O-N 3.4Å; I295-L297 VanDerWaalsContact C-N 3.31Å; I295-L297 PolarHBondContact O-N 2.76Å; L297-L299 VanDerWaalsContact C-N 3.28Å; L297-L299 PolarHBondContact O-N 3.37Å; L297-A300 WeakPolarHBondContact O-CB 3.22Å; L297-A300 PolarHBondContact O-N 3.46Å; L297-A300 VanDerWaalsContact O-N 3.16Å; L297-T301 WeakPolarHBondContact O-CG2 3.35Å; L297-T301 PolarHBondContact O-N 3.49Å |
| 298 | C | 95.4 | Very high | 91.7 | Very high | 6 Ų | 6 | 30.8 Ų | 30.8 | 4% | 0.041 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -56 | -44.7 | 174 | -77.9 | 0 | 0 | 0 | 0 | 111.4 | N42 V45 P294 I295 A300 T301 L302 | N42-C298 PolarHBondContact OD1-SG 3.42Å; V45-C298 HydrophobicContact CB-CB 4.16Å; V45-C298 HydrophobicContact CG1-CB 3.88Å; V45-C298 HydrophobicContact CG2-CB 4.06Å; P294-C298 PolarHBondContact O-N 3.05Å; P294-C298 PolarHBondContact O-SG 2.93Å; I295-C298 WeakPolarHBondContact O-CB 3.43Å; I295-C298 PolarHBondContact O-N 3.28Å; C298-A300 VanDerWaalsContact C-N 3.33Å; C298-A300 PolarHBondContact O-N 2.89Å; C298-T301 PolarHBondContact O-N 3.34Å; C298-T301 PolarHBondContact O-OG1 3.38Å; C298-L302 PolarHBondContact O-N 2.93Å |
| 299 | L | 95.7 | Very high | 91 | Very high | 50 Ų | 50 | 31.8 Ų | 31.8 | 26% | 0.262 | 16% | 0.155 | S | C | . | . | H | α-helix | trans | -61.4 | -39.6 | 177.2 | -172.7 | 58.9 | 0 | 0 | 0 | 112.7 | V260 P264 I295 T296 L297 L302 | V260-L299 HydrophobicContact CG1-CD1 3.95Å; V260-L299 HydrophobicContact CG1-CD2 4.45Å; V260-L299 HydrophobicContact CG1-CG 4.43Å; V260-L299 WeakPolarHBondContact O-CD2 3.33Å; V260-L299 WeakPolarHBondContact O-CG 3.19Å; P264-L299 HydrophobicContact CB-CD2 4.25Å; P264-L299 HydrophobicContact CG-CD2 4Å; I295-L299 PolarHBondContact O-N 3.24Å; T296-L299 WeakPolarHBondContact O-CB 3.3Å; T296-L299 PolarHBondContact O-N 2.88Å; L297-L299 VanDerWaalsContact C-N 3.28Å; L297-L299 PolarHBondContact O-N 3.37Å; L299-L302 HydrophobicContact CD1-CD1 4.22Å; L299-L302 WeakPolarHBondContact O-CB 3.23Å; L299-L302 PolarHBondContact O-N 3.46Å |
| 300 | A | 95.2 | Very high | 90.3 | Very high | 0 Ų | 0 | 31.7 Ų | 31.7 | 0% | 0 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -63.8 | -40.6 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | I122 C261 Y265 T296 L297 C298 L302 N303 | I122-A300 HydrophobicContact CD1-CB 3.78Å; C261-A300 WeakPolarHBondContact O-CA 3.21Å; C261-A300 WeakPolarHBondContact O-CB 3.14Å; Y265-A300 HydrophobicContact CD1-CB 4.3Å; Y265-A300 HydrophobicContact CD2-CB 4.47Å; Y265-A300 HydrophobicContact CG-CB 3.93Å; T296-A300 PolarHBondContact O-N 3.23Å; L297-A300 WeakPolarHBondContact O-CB 3.22Å; L297-A300 PolarHBondContact O-N 3.46Å; L297-A300 VanDerWaalsContact O-N 3.16Å; C298-A300 VanDerWaalsContact C-N 3.33Å; C298-A300 PolarHBondContact O-N 2.89Å; A300-L302 PolarHBondContact O-N 3.04Å; A300-N303 VanDerWaalsContact O-CB 3.29Å; A300-N303 WeakPolarHBondContact O-CB 3.44Å; A300-N303 PolarHBondContact O-N 3.47Å; A300-N303 VanDerWaalsContact O-N 3.1Å; A300-N303 PolarHBondContact O-ND2 3.03Å |
| 301 | T | 94.7 | Very high | 89.9 | Confident | 0 Ų | 0 | 29 Ų | 29 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -68.2 | -20 | 178.6 | 61.2 | 0 | 0 | 0 | 0 | 114.1 | Y46 V49 F88 F118 L297 C298 N303 | Y46-T301 HydrophobicContact CD1-CG2 4.45Å; Y46-T301 HydrophobicContact CE1-CG2 3.75Å; V49-T301 WeakPolarHBondContact CG1-O 3.33Å; F88-T301 HydrophobicContact CE1-CG2 3.99Å; F88-T301 HydrophobicContact CZ-CG2 3.63Å; F118-T301 HydrophobicContact CE2-CG2 4.14Å; L297-T301 WeakPolarHBondContact O-CG2 3.35Å; L297-T301 PolarHBondContact O-N 3.49Å; C298-T301 PolarHBondContact O-N 3.34Å; C298-T301 PolarHBondContact O-OG1 3.38Å; T301-N303 PolarHBondContact O-N 3.33Å |
| 302 | L | 94.3 | Very high | 89.2 | Confident | 45 Ų | 45 | 29.5 Ų | 29.5 | 24% | 0.236 | 14% | 0.14 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -67.8 | -10.8 | 172.5 | -70.7 | 168.6 | 0 | 0 | 0 | 112.9 | V45 V49 C298 L299 A300 C304 C305 F306 | V45-L302 HydrophobicContact CG1-CD2 4.47Å; V45-L302 HydrophobicContact CG1-CG 4.49Å; V49-L302 HydrophobicContact CG2-CD2 3.82Å; V49-L302 HydrophobicContact CG2-CG 4.41Å; C298-L302 PolarHBondContact O-N 2.93Å; L299-L302 HydrophobicContact CD1-CD1 4.22Å; L299-L302 WeakPolarHBondContact O-CB 3.23Å; L299-L302 PolarHBondContact O-N 3.46Å; A300-L302 PolarHBondContact O-N 3.04Å; L302-C304 PolarHBondContact O-N 3.34Å; L302-C305 WeakPolarHBondContact O-CB 3.42Å; L302-C305 PolarHBondContact O-N 3.43Å; L302-F306 HydrophobicContact CB-CD2 4.38Å; L302-F306 HydrophobicContact CB-CE2 3.74Å; L302-F306 HydrophobicContact CB-CZ 4.21Å; L302-F306 VanDerWaalsContact O-CD2 3.23Å; L302-F306 WeakPolarHBondContact O-CD2 3.38Å; L302-F306 PolarHBondContact O-N 3.26Å |
| 303 | N | 93.4 | Very high | 88.3 | Confident | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -51 | -45.1 | 174.8 | 86.1 | 84 | 0 | 0 | 0 | 111.5 | D85 N121 S125 C261 F262 A300 T301 C305 F306 D307 | D85-N303 PolarHBondContact OD1-OD1 3.46Å; N121-N303 PolarHBondContact OD1-ND2 3.44Å; S125-N303 PolarHBondContact OG-OD1 2.88Å; C261-N303 HydrophobicContact CB-CB 3.98Å; F262-N303 HydrophobicContact CE1-CB 4.05Å; F262-N303 HydrophobicContact CE2-CB 4.47Å; F262-N303 HydrophobicContact CZ-CB 3.64Å; A300-N303 VanDerWaalsContact O-CB 3.29Å; A300-N303 WeakPolarHBondContact O-CB 3.44Å; A300-N303 PolarHBondContact O-N 3.47Å; A300-N303 VanDerWaalsContact O-N 3.1Å; A300-N303 PolarHBondContact O-ND2 3.03Å; T301-N303 PolarHBondContact O-N 3.33Å; N303-C305 PolarHBondContact O-N 2.87Å; N303-F306 PolarHBondContact O-N 2.92Å; N303-D307 PolarHBondContact O-N 3.44Å |
| 304 | C | 92.6 | Very high | 87.3 | Confident | 0 Ų | 0 | 25.3 Ų | 25.3 | 0% | 0 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -59 | -23.2 | 179.4 | -54.1 | 0 | 0 | 0 | 0 | 113.9 | V49 N57 D85 V89 L302 D307 | V49-C304 HydrophobicContact CG1-CB 4.34Å; N57-C304 PolarHBondContact ND2-O 3.33Å; D85-C304 HydrophobicContact CB-CB 4.08Å; D85-C304 PolarHBondContact OD1-SG 2.93Å; V89-C304 HydrophobicContact CG2-CB 4.28Å; L302-C304 PolarHBondContact O-N 3.34Å; C304-D307 VanDerWaalsContact CA-OD2 3.24Å; C304-D307 WeakPolarHBondContact CA-OD2 3.17Å |
| 305 | C | 90.3 | Very high | 86.3 | Confident | 15 Ų | 15 | 25.3 Ų | 25.3 | 10% | 0.101 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -88.2 | -21.5 | 177.6 | -59.5 | 0 | 0 | 0 | 0 | 112.3 | L302 N303 P308 | L302-C305 WeakPolarHBondContact O-CB 3.42Å; L302-C305 PolarHBondContact O-N 3.43Å; N303-C305 PolarHBondContact O-N 2.87Å; C305-P308 WeakPolarHBondContact O-CD 3.5Å |
| 306 | F | 87.6 | Confident | 85 | Confident | 68 Ų | 68 | 26.1 Ų | 26.1 | 30% | 0.298 | 13% | 0.125 | S | C | . | . | H | α-helix | trans | -93.4 | -18.5 | -178.1 | -60.2 | -45.9 | 0 | 0 | 0 | 113.4 | V257 C261 L302 N303 P308 F309 I310 | V257-F306 HydrophobicContact CG1-CB 4.26Å; V257-F306 HydrophobicContact CG2-CB 3.75Å; V257-F306 HydrophobicContact CG2-CG 4.46Å; C261-F306 VanDerWaalsContact SG-CD2 3.56Å; L302-F306 HydrophobicContact CB-CD2 4.38Å; L302-F306 HydrophobicContact CB-CE2 3.74Å; L302-F306 HydrophobicContact CB-CZ 4.21Å; L302-F306 VanDerWaalsContact O-CD2 3.23Å; L302-F306 WeakPolarHBondContact O-CD2 3.38Å; L302-F306 PolarHBondContact O-N 3.26Å; N303-F306 PolarHBondContact O-N 2.92Å; F306-P308 VanDerWaalsContact C-N 3.33Å; F306-F309 WeakPolarHBondContact O-CB 3.46Å; F306-F309 PolarHBondContact O-N 2.98Å; F306-I310 PolarHBondContact O-N 3.29Å |
| 307 | D | 83 | Confident | 83.3 | Confident | 0 Ų | 0 | 29.1 Ų | 29.1 | 0% | 0 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -56.6 | -32.6 | 178.5 | -61.5 | -50.6 | 0 | 0 | 0 | 115.5 | N303 C304 F309 I310 Y311 | N303-D307 PolarHBondContact O-N 3.44Å; C304-D307 VanDerWaalsContact CA-OD2 3.24Å; C304-D307 WeakPolarHBondContact CA-OD2 3.17Å; D307-F309 PolarHBondContact O-N 3.22Å; D307-I310 CarbonylContact O-C 3.57Å; D307-I310 WeakPolarHBondContact O-CA 3.42Å; D307-I310 WeakPolarHBondContact O-CB 3.41Å; D307-I310 PolarHBondContact O-N 3Å; D307-I310 WeakPolarHBondContact OD1-CD1 3.28Å; D307-Y311 HydrophobicContact CB-CE1 3.85Å; D307-Y311 HydrophobicContact CB-CE2 4.13Å; D307-Y311 WeakPolarHBondContact CB-OH 3.46Å; D307-Y311 WeakPolarHBondContact O-CD1 3.35Å; D307-Y311 WeakPolarHBondContact O-CD2 3.5Å; D307-Y311 WeakPolarHBondContact O-CE1 3.32Å; D307-Y311 PolarHBondContact O-N 3.45Å |
| 308 | P | 76.7 | Confident | 81.8 | Confident | 25 Ų | 25 | 28.7 Ų | 28.7 | 16% | 0.162 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -59.3 | -31.4 | 172.8 | -25.8 | 36.1 | 0 | 0 | 0 | 113.6 | T56 C305 F306 Y311 Y312 | T56-P308 HydrophobicContact CG2-CG 3.91Å; T56-P308 WeakPolarHBondContact OG1-CG 3.28Å; C305-P308 WeakPolarHBondContact O-CD 3.5Å; F306-P308 VanDerWaalsContact C-N 3.33Å; P308-Y311 PolarHBondContact O-N 3.35Å; P308-Y312 WeakPolarHBondContact O-CB 3.47Å; P308-Y312 PolarHBondContact O-N 3.31Å |
| 309 | F | 77 | Confident | 80.4 | Confident | 115 Ų | 115 | 30.1 Ų | 30.1 | 50% | 0.504 | 15% | 0.15 | S | C | . | . | H | α-helix | trans | -68.4 | -42 | 172.6 | -65 | -83.5 | 0 | 0 | 0 | 110.9 | V253 F306 D307 Y311 Y312 F313 | V253-F309 HydrophobicContact CG1-CB 4.17Å; F306-F309 WeakPolarHBondContact O-CB 3.46Å; F306-F309 PolarHBondContact O-N 2.98Å; D307-F309 PolarHBondContact O-N 3.22Å; F309-Y311 VanDerWaalsContact C-N 3.28Å; F309-Y311 PolarHBondContact O-N 3.25Å; F309-Y312 PolarHBondContact O-N 2.96Å; F309-F313 HydrophobicContact CB-CD2 4.47Å; F309-F313 HydrophobicContact CB-CE2 4.27Å; F309-F313 HydrophobicContact CD1-CE2 4.35Å; F309-F313 WeakPolarHBondContact O-CD2 3.14Å; F309-F313 PolarHBondContact O-N 3.08Å |
| 310 | I | 76.4 | Confident | 79 | Confident | 0 Ų | 0 | 34.2 Ų | 34.2 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -56.2 | -47 | 173.5 | -59.2 | -171.4 | 0 | 0 | 0 | 109.4 | L129 V253 H254 V257 F306 D307 F313 T314 | L129-I310 HydrophobicContact CD2-CD1 3.51Å; L129-I310 HydrophobicContact CD2-CG2 4.38Å; V253-I310 HydrophobicContact CG1-CG1 4.21Å; H254-I310 VanDerWaalsContact CD2-CG2 3.46Å; H254-I310 WeakPolarHBondContact CD2-CG2 3.3Å; H254-I310 WeakPolarHBondContact NE2-CG2 3.36Å; V257-I310 HydrophobicContact CB-CD1 4.15Å; V257-I310 HydrophobicContact CG1-CD1 4.1Å; V257-I310 HydrophobicContact CG2-CD1 4.14Å; V257-I310 HydrophobicContact CG2-CG1 4.32Å; F306-I310 PolarHBondContact O-N 3.29Å; D307-I310 CarbonylContact O-C 3.57Å; D307-I310 WeakPolarHBondContact O-CA 3.42Å; D307-I310 WeakPolarHBondContact O-CB 3.41Å; D307-I310 PolarHBondContact O-N 3Å; D307-I310 WeakPolarHBondContact OD1-CD1 3.28Å; I310-F313 PolarHBondContact O-N 3.47Å; I310-T314 WeakPolarHBondContact O-CB 3.31Å; I310-T314 PolarHBondContact O-N 3.19Å; I310-T314 PolarHBondContact O-OG1 3.26Å |
| 311 | Y | 80.1 | Confident | 77.4 | Confident | 0 Ų | 0 | 34.9 Ų | 34.9 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -65.2 | -46 | -179.3 | -54.8 | -14.7 | 0 | 0 | 0 | 111.9 | N57 S60 F64 I78 L81 A82 D307 P308 F309 F313 T314 L315 F318 | N57-Y311 PolarHBondContact OD1-OH 3.34Å; S60-Y311 VanDerWaalsContact OG-CD2 3.31Å; S60-Y311 WeakPolarHBondContact OG-CD2 3.17Å; F64-Y311 AromaticContact CE2-CD2 3.91Å; F64-Y311 HydrophobicContact CE2-CD2 3.91Å; F64-Y311 HydrophobicContact CE2-CE2 4.04Å; F64-Y311 HydrophobicContact CE2-CG 4.17Å; F64-Y311 HydrophobicContact CZ-CD1 4.31Å; F64-Y311 AromaticContact CZ-CD2 3.7Å; F64-Y311 HydrophobicContact CZ-CD2 3.7Å; F64-Y311 HydrophobicContact CZ-CE2 4.31Å; F64-Y311 AromaticContact CZ-CG 3.7Å; F64-Y311 HydrophobicContact CZ-CG 3.7Å; I78-Y311 HydrophobicContact CB-CD1 4.36Å; I78-Y311 HydrophobicContact CB-CE1 4.41Å; I78-Y311 HydrophobicContact CG1-CD1 4.32Å; I78-Y311 HydrophobicContact CG2-CD1 3.33Å; I78-Y311 HydrophobicContact CG2-CE1 3.53Å; I78-Y311 HydrophobicContact CG2-CG 4Å; L81-Y311 HydrophobicContact CD2-CE1 4.19Å; A82-Y311 WeakPolarHBondContact CA-OH 3.12Å; A82-Y311 HydrophobicContact CB-CE2 4.21Å; A82-Y311 VanDerWaalsContact CB-OH 3.27Å; A82-Y311 WeakPolarHBondContact CB-OH 3.42Å; A82-Y311 PolarHBondContact N-OH 2.76Å; D307-Y311 HydrophobicContact CB-CE1 3.85Å; D307-Y311 HydrophobicContact CB-CE2 4.13Å; D307-Y311 WeakPolarHBondContact CB-OH 3.46Å; D307-Y311 WeakPolarHBondContact O-CD1 3.35Å; D307-Y311 WeakPolarHBondContact O-CD2 3.5Å; D307-Y311 WeakPolarHBondContact O-CE1 3.32Å; D307-Y311 PolarHBondContact O-N 3.45Å; P308-Y311 PolarHBondContact O-N 3.35Å; F309-Y311 VanDerWaalsContact C-N 3.28Å; F309-Y311 PolarHBondContact O-N 3.25Å; Y311-F313 VanDerWaalsContact C-N 3.34Å; Y311-F313 PolarHBondContact O-N 2.93Å; Y311-T314 PolarHBondContact O-N 3.12Å; Y311-L315 WeakPolarHBondContact O-CB 3.36Å; Y311-L315 PolarHBondContact O-N 2.8Å; Y311-F318 HydrophobicContact CD2-CZ 4.4Å |
| 312 | Y | 77.6 | Confident | 75.9 | Confident | 81 Ų | 81 | 39.4 Ų | 39.4 | 32% | 0.318 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -59.9 | -41.2 | 178 | -178 | -94.5 | 0 | 0 | 0 | 112.4 | P308 F309 Q319 | P308-Y312 WeakPolarHBondContact O-CB 3.47Å; P308-Y312 PolarHBondContact O-N 3.31Å; F309-Y312 PolarHBondContact O-N 2.96Å; Y312-Q319 HydrophobicContact CD2-CG 3.9Å; Y312-Q319 HydrophobicContact CE2-CB 4.3Å; Y312-Q319 HydrophobicContact CE2-CG 3.8Å; Y312-Q319 HydrophobicContact CG-CG 4.36Å; Y312-Q319 WeakPolarHBondContact O-CG 3.45Å; Y312-Q319 PolarHBondContact O-NE2 2.87Å |
| 313 | F | 74.9 | Confident | 74.2 | Confident | 23 Ų | 23 | 43.8 Ų | 43.8 | 10% | 0.101 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -82.2 | -22.6 | 179.3 | -63.9 | -56.9 | 0 | 0 | 0 | 113.8 | K249 M250 V253 F309 I310 Y311 | K249-F313 HydrophobicContact CD-CD1 3.54Å; K249-F313 HydrophobicContact CD-CE1 3.35Å; K249-F313 HydrophobicContact CD-CG 4.31Å; K249-F313 HydrophobicContact CD-CZ 3.96Å; K249-F313 HydrophobicContact CG-CD1 3.83Å; K249-F313 HydrophobicContact CG-CE1 4.04Å; K249-F313 HydrophobicContact CG-CG 4.13Å; K249-F313 HydrophobicContact CG-CZ 4.48Å; K249-F313 VanDerWaalsContact NZ-CZ 3.27Å; M250-F313 HydrophobicContact CB-CB 4.12Å; V253-F313 HydrophobicContact CB-CD2 4.21Å; V253-F313 HydrophobicContact CG1-CD2 4.2Å; V253-F313 HydrophobicContact CG2-CD2 3.7Å; V253-F313 HydrophobicContact CG2-CE2 3.97Å; F309-F313 HydrophobicContact CB-CD2 4.47Å; F309-F313 HydrophobicContact CB-CE2 4.27Å; F309-F313 HydrophobicContact CD1-CE2 4.35Å; F309-F313 WeakPolarHBondContact O-CD2 3.14Å; F309-F313 PolarHBondContact O-N 3.08Å; I310-F313 PolarHBondContact O-N 3.47Å; Y311-F313 VanDerWaalsContact C-N 3.34Å; Y311-F313 PolarHBondContact O-N 2.93Å |
| 314 | T | 71.4 | Confident | 72.5 | Confident | 8 Ų | 8 | 47.5 Ų | 47.5 | 5% | 0.049 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -90.8 | -33.8 | -177 | -54.1 | 0 | 0 | 0 | 0 | 114.3 | T74 I78 R136 M250 H254 I310 Y311 | T74-T314 HydrophobicContact CG2-CG2 3.7Å; I78-T314 HydrophobicContact CD1-CG2 3.45Å; I78-T314 VanDerWaalsContact CD1-CG2 3.45Å; R136-T314 PolarHBondContact NH2-O 3.22Å; M250-T314 HydrophobicContact CG-CG2 4.37Å; M250-T314 VanDerWaalsContact CG-OG1 3.32Å; M250-T314 WeakPolarHBondContact CG-OG1 2.96Å; M250-T314 HydrophobicContact SD-CG2 3.66Å; H254-T314 PolarHBondContact CE1-OG1 3.37Å; H254-T314 PolarHBondContact NE2-OG1 2.84Å; I310-T314 WeakPolarHBondContact O-CB 3.31Å; I310-T314 PolarHBondContact O-N 3.19Å; I310-T314 PolarHBondContact O-OG1 3.26Å; Y311-T314 PolarHBondContact O-N 3.12Å |
| 315 | L | 71.1 | Confident | 70.6 | Confident | 6 Ų | 6 | 51.3 Ų | 51.3 | 3% | 0.031 | 25% | 0.247 | C | C | . | . | trans | -115.7 | 108.4 | -170.3 | -64.3 | 172.2 | 0 | 0 | 0 | 111.2 | F64 M68 A75 I78 Y311 S317 F318 Q319 | F64-L315 HydrophobicContact CD1-CD1 4.06Å; F64-L315 HydrophobicContact CE1-CD1 3.33Å; F64-L315 HydrophobicContact CZ-CD1 3.72Å; M68-L315 HydrophobicContact CE-CD1 4.04Å; M68-L315 HydrophobicContact CE-CD2 4.28Å; A75-L315 HydrophobicContact CB-CD2 4.04Å; I78-L315 HydrophobicContact CB-CD1 4.46Å; I78-L315 HydrophobicContact CD1-CD1 3.83Å; I78-L315 HydrophobicContact CD1-CD2 4.18Å; I78-L315 HydrophobicContact CD1-CG 3.81Å; I78-L315 HydrophobicContact CG2-CD1 3.85Å; Y311-L315 WeakPolarHBondContact O-CB 3.36Å; Y311-L315 PolarHBondContact O-N 2.8Å; L315-S317 VanDerWaalsContact C-N 3.25Å; L315-S317 PolarHBondContact O-N 3.45Å; L315-F318 HydrophobicContact CB-CB 3.62Å; L315-F318 WeakPolarHBondContact O-CB 3.31Å; L315-F318 PolarHBondContact O-N 2.96Å; L315-F318 VanDerWaalsContact O-N 3.13Å; L315-Q319 PolarHBondContact O-N 3.02Å | ||
| 316 | E | 67.8 | Low | 68.7 | Low | 86 Ų | 86 | 54.7 Ų | 54.7 | 40% | 0.402 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -62.9 | -35.3 | 175.5 | -30.3 | -149.8 | 116.4 | 0 | 0 | 112.4 | K246 F318 Q319 K320 | K246-E316 WeakPolarHBondContact CD-OE1 3.24Å; K246-E316 WeakPolarHBondContact CE-OE1 3.43Å; K246-E316 IonicContact NZ-OE1 3Å; K246-E316 PolarHBondContact NZ-OE1 3.2Å; E316-F318 VanDerWaalsContact C-N 3.26Å; E316-F318 PolarHBondContact O-N 3.4Å; E316-Q319 WeakPolarHBondContact O-CB 3.43Å; E316-Q319 PolarHBondContact O-N 2.66Å; E316-K320 WeakPolarHBondContact O-CG 3.26Å; E316-K320 PolarHBondContact O-N 2.92Å |
| 317 | S | 59.6 | Low | 66.7 | Low | 69 Ų | 69 | 57.8 Ų | 57.8 | 48% | 0.483 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -64.4 | -33 | 176.3 | -53 | 0 | 0 | 0 | 0 | 112 | L315 S321 | L315-S317 VanDerWaalsContact C-N 3.25Å; L315-S317 PolarHBondContact O-N 3.45Å; S317-S321 PolarHBondContact O-N 3.05Å |
| 318 | F | 63.2 | Low | 65.2 | Low | 5 Ų | 5 | 61.7 Ų | 61.7 | 2% | 0.022 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -67.6 | -46 | 174.9 | -168.7 | -112 | 0 | 0 | 0 | 110.3 | V63 F64 M68 Y311 L315 E316 K320 S321 F322 | V63-F318 HydrophobicContact CB-CD2 4.19Å; V63-F318 HydrophobicContact CB-CE2 4.09Å; V63-F318 HydrophobicContact CG1-CD2 3.67Å; V63-F318 HydrophobicContact CG1-CE2 4.08Å; V63-F318 HydrophobicContact CG2-CE2 4.44Å; F64-F318 HydrophobicContact CD1-CD2 4.2Å; F64-F318 HydrophobicContact CE1-CB 4.34Å; F64-F318 AromaticContact CE1-CD2 3.37Å; F64-F318 HydrophobicContact CE1-CD2 3.37Å; F64-F318 AromaticContact CE1-CE2 3.8Å; F64-F318 HydrophobicContact CE1-CE2 3.8Å; F64-F318 HydrophobicContact CE1-CG 4.03Å; F64-F318 AromaticContact CZ-CD2 3.96Å; F64-F318 HydrophobicContact CZ-CD2 3.96Å; F64-F318 HydrophobicContact CZ-CE2 4.01Å; M68-F318 HydrophobicContact SD-CB 4.24Å; Y311-F318 HydrophobicContact CD2-CZ 4.4Å; L315-F318 HydrophobicContact CB-CB 3.62Å; L315-F318 WeakPolarHBondContact O-CB 3.31Å; L315-F318 PolarHBondContact O-N 2.96Å; L315-F318 VanDerWaalsContact O-N 3.13Å; E316-F318 VanDerWaalsContact C-N 3.26Å; E316-F318 PolarHBondContact O-N 3.4Å; F318-K320 PolarHBondContact O-N 3.27Å; F318-S321 PolarHBondContact O-N 3.39Å; F318-F322 HydrophobicContact CD1-CD2 4.39Å; F318-F322 AromaticContact CD1-CE2 3.81Å; F318-F322 HydrophobicContact CD1-CE2 3.81Å; F318-F322 HydrophobicContact CD2-CE2 4.24Å; F318-F322 HydrophobicContact CE1-CD2 4.37Å; F318-F322 AromaticContact CE1-CE2 3.42Å; F318-F322 HydrophobicContact CE1-CE2 3.42Å; F318-F322 VanDerWaalsContact CE1-CE2 3.42Å; F318-F322 HydrophobicContact CE1-CZ 4.15Å; F318-F322 AromaticContact CE2-CE2 3.86Å; F318-F322 HydrophobicContact CE2-CE2 3.86Å; F318-F322 HydrophobicContact CE2-CZ 4.39Å; F318-F322 HydrophobicContact CG-CE2 4.24Å; F318-F322 AromaticContact CZ-CE2 3.45Å; F318-F322 HydrophobicContact CZ-CE2 3.45Å; F318-F322 VanDerWaalsContact CZ-CE2 3.45Å; F318-F322 AromaticContact CZ-CZ 3.87Å; F318-F322 HydrophobicContact CZ-CZ 3.87Å; F318-F322 VanDerWaalsContact O-CD2 3.29Å; F318-F322 WeakPolarHBondContact O-CD2 3.5Å; F318-F322 PolarHBondContact O-N 3.06Å |
| 319 | Q | 66.1 | Low | 63.8 | Low | 37 Ų | 37 | 69.3 Ų | 69.3 | 17% | 0.173 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -53.6 | -52.5 | 173.2 | -60.7 | 178.1 | -24.5 | 0 | 0 | 111 | Y312 L315 E316 S321 F322 Y323 | Y312-Q319 HydrophobicContact CD2-CG 3.9Å; Y312-Q319 HydrophobicContact CE2-CB 4.3Å; Y312-Q319 HydrophobicContact CE2-CG 3.8Å; Y312-Q319 HydrophobicContact CG-CG 4.36Å; Y312-Q319 WeakPolarHBondContact O-CG 3.45Å; Y312-Q319 PolarHBondContact O-NE2 2.87Å; L315-Q319 PolarHBondContact O-N 3.02Å; E316-Q319 WeakPolarHBondContact O-CB 3.43Å; E316-Q319 PolarHBondContact O-N 2.66Å; Q319-S321 VanDerWaalsContact C-N 3.3Å; Q319-S321 PolarHBondContact O-N 3.34Å; Q319-F322 PolarHBondContact O-N 3.5Å; Q319-Y323 WeakPolarHBondContact O-CD2 3.35Å; Q319-Y323 PolarHBondContact O-N 2.98Å |
| 320 | K | 66.4 | Low | 62.2 | Low | 135 Ų | 135 | 69.4 Ų | 69.4 | 59% | 0.587 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -60.9 | -34.3 | -179 | -71.8 | 176.8 | 178.4 | 179.3 | 0 | 113.2 | E316 F318 F322 Y323 V324 | E316-K320 WeakPolarHBondContact O-CG 3.26Å; E316-K320 PolarHBondContact O-N 2.92Å; F318-K320 PolarHBondContact O-N 3.27Å; K320-F322 VanDerWaalsContact C-N 3.31Å; K320-F322 PolarHBondContact O-N 3.3Å; K320-Y323 PolarHBondContact O-N 3.48Å; K320-V324 WeakPolarHBondContact O-CG2 3.19Å; K320-V324 PolarHBondContact O-N 2.79Å |
| 321 | S | 61.3 | Low | 60.9 | Low | 15 Ų | 15 | 75.2 Ų | 75.2 | 11% | 0.105 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -64.6 | -32.5 | 177.9 | -167.8 | 0 | 0 | 0 | 0 | 113.1 | S317 F318 Q319 N325 | S317-S321 PolarHBondContact O-N 3.05Å; F318-S321 PolarHBondContact O-N 3.39Å; Q319-S321 VanDerWaalsContact C-N 3.3Å; Q319-S321 PolarHBondContact O-N 3.34Å; S321-N325 PolarHBondContact O-N 2.99Å |
| 322 | F | 63.3 | Low | 59.4 | Low | 95 Ų | 95 | 78.2 Ų | 78.2 | 42% | 0.417 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -71 | -39.2 | 174 | -77 | -81.5 | 0 | 0 | 0 | 112.2 | V59 F318 Q319 K320 T326 | V59-F322 HydrophobicContact CG1-CZ 4.44Å; F318-F322 HydrophobicContact CD1-CD2 4.39Å; F318-F322 AromaticContact CD1-CE2 3.81Å; F318-F322 HydrophobicContact CD1-CE2 3.81Å; F318-F322 HydrophobicContact CD2-CE2 4.24Å; F318-F322 HydrophobicContact CE1-CD2 4.37Å; F318-F322 AromaticContact CE1-CE2 3.42Å; F318-F322 HydrophobicContact CE1-CE2 3.42Å; F318-F322 VanDerWaalsContact CE1-CE2 3.42Å; F318-F322 HydrophobicContact CE1-CZ 4.15Å; F318-F322 AromaticContact CE2-CE2 3.86Å; F318-F322 HydrophobicContact CE2-CE2 3.86Å; F318-F322 HydrophobicContact CE2-CZ 4.39Å; F318-F322 HydrophobicContact CG-CE2 4.24Å; F318-F322 AromaticContact CZ-CE2 3.45Å; F318-F322 HydrophobicContact CZ-CE2 3.45Å; F318-F322 VanDerWaalsContact CZ-CE2 3.45Å; F318-F322 AromaticContact CZ-CZ 3.87Å; F318-F322 HydrophobicContact CZ-CZ 3.87Å; F318-F322 VanDerWaalsContact O-CD2 3.29Å; F318-F322 WeakPolarHBondContact O-CD2 3.5Å; F318-F322 PolarHBondContact O-N 3.06Å; Q319-F322 PolarHBondContact O-N 3.5Å; K320-F322 VanDerWaalsContact C-N 3.31Å; K320-F322 PolarHBondContact O-N 3.3Å; F322-T326 PolarHBondContact O-N 3.36Å; F322-T326 PolarHBondContact O-OG1 3.09Å |
| 323 | Y | 58.8 | Low | 58.1 | Low | 137 Ų | 137 | 80 Ų | 80 | 54% | 0.537 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -66.8 | -40.4 | 176.7 | -71.9 | -75.6 | 0 | 0 | 0 | 112.6 | Q319 K320 T326 H327 | Q319-Y323 WeakPolarHBondContact O-CD2 3.35Å; Q319-Y323 PolarHBondContact O-N 2.98Å; K320-Y323 PolarHBondContact O-N 3.48Å; Y323-T326 WeakPolarHBondContact CA-OG1 3.5Å; Y323-T326 PolarHBondContact O-N 3.44Å; Y323-T326 PolarHBondContact O-OG1 2.94Å; Y323-T326 VanDerWaalsContact O-OG1 3.05Å; Y323-H327 PolarHBondContact O-N 2.93Å |
| 324 | V | 56.8 | Low | 56.7 | Low | 77 Ų | 77 | 86 Ų | 86 | 47% | 0.467 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -68.1 | -40.4 | 177.7 | 174.4 | 0 | 0 | 0 | 0 | 111.3 | K320 T326 H327 V328 | K320-V324 WeakPolarHBondContact O-CG2 3.19Å; K320-V324 PolarHBondContact O-N 2.79Å; V324-T326 VanDerWaalsContact C-N 3.35Å; V324-T326 PolarHBondContact O-N 3.49Å; V324-H327 PolarHBondContact O-N 2.96Å; V324-V328 HydrophobicContact CG1-CG2 4.31Å; V324-V328 WeakPolarHBondContact O-CB 3.3Å; V324-V328 VanDerWaalsContact O-CG2 3.3Å; V324-V328 WeakPolarHBondContact O-CG2 3.3Å; V324-V328 PolarHBondContact O-N 3.43Å |
| 325 | N | 53.1 | Low | 55.6 | Low | 81 Ų | 81 | 93.8 Ų | 93.8 | 43% | 0.433 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -68.9 | -31.1 | 176.8 | -85.3 | -2.1 | 0 | 0 | 0 | 113 | S321 R329 | S321-N325 PolarHBondContact O-N 2.99Å; N325-R329 WeakPolarHBondContact O-CB 3.34Å; N325-R329 PolarHBondContact O-N 3.48Å; N325-R329 VanDerWaalsContact O-N 3.14Å |
| 326 | T | 50.8 | Low | 54.4 | Low | 86 Ų | 86 | 99.1 Ų | 99.1 | 53% | 0.528 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -72.8 | -41 | 173.6 | 31.2 | 0 | 0 | 0 | 0 | 111.6 | F322 Y323 V324 R329 M330 | F322-T326 PolarHBondContact O-N 3.36Å; F322-T326 PolarHBondContact O-OG1 3.09Å; Y323-T326 WeakPolarHBondContact CA-OG1 3.5Å; Y323-T326 PolarHBondContact O-N 3.44Å; Y323-T326 PolarHBondContact O-OG1 2.94Å; Y323-T326 VanDerWaalsContact O-OG1 3.05Å; V324-T326 VanDerWaalsContact C-N 3.35Å; V324-T326 PolarHBondContact O-N 3.49Å; T326-R329 PolarHBondContact O-N 3.09Å; T326-M330 VanDerWaalsContact O-CB 3.3Å; T326-M330 WeakPolarHBondContact O-CB 3.22Å; T326-M330 PolarHBondContact O-N 2.77Å |
| 327 | H | 46 | Very low | 53.4 | Low | 132 Ų | 132 | 103 Ų | 103 | 61% | 0.611 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -66.1 | -41.9 | 175.1 | -95.8 | -75 | 0 | 0 | 0 | 113.6 | Y323 V324 R329 M330 E331 | Y323-H327 PolarHBondContact O-N 2.93Å; V324-H327 PolarHBondContact O-N 2.96Å; H327-R329 VanDerWaalsContact C-N 3.32Å; H327-R329 PolarHBondContact O-N 3.33Å; H327-M330 PolarHBondContact O-N 2.04Å; H327-E331 PolarHBondContact O-N 3.37Å |
| 328 | V | 51.4 | Low | 52.4 | Low | 82 Ų | 82 | 105.6 Ų | 105.6 | 50% | 0.497 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -65.7 | -37.2 | 176.1 | 172.5 | 0 | 0 | 0 | 0 | 111.2 | V324 S332 | V324-V328 HydrophobicContact CG1-CG2 4.31Å; V324-V328 WeakPolarHBondContact O-CB 3.3Å; V324-V328 VanDerWaalsContact O-CG2 3.3Å; V324-V328 WeakPolarHBondContact O-CG2 3.3Å; V324-V328 PolarHBondContact O-N 3.43Å; V328-S332 WeakPolarHBondContact O-CB 3.23Å; V328-S332 PolarHBondContact O-N 2.94Å; V328-S332 PolarHBondContact O-OG 2.78Å |
| 329 | R | 46.1 | Very low | 51.5 | Low | 186 Ų | 186 | 111 Ų | 111 | 70% | 0.702 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -71.1 | -31 | 175.8 | -167.8 | 152.1 | 178.2 | 152.3 | -3.4 | 112.5 | N325 T326 H327 S332 L333 | N325-R329 WeakPolarHBondContact O-CB 3.34Å; N325-R329 PolarHBondContact O-N 3.48Å; N325-R329 VanDerWaalsContact O-N 3.14Å; T326-R329 PolarHBondContact O-N 3.09Å; H327-R329 VanDerWaalsContact C-N 3.32Å; H327-R329 PolarHBondContact O-N 3.33Å; R329-S332 WeakPolarHBondContact CA-OG 3.39Å; R329-S332 PolarHBondContact O-OG 3.04Å; R329-L333 HydrophobicContact CG-CD1 4.49Å; R329-L333 WeakPolarHBondContact O-CB 3.05Å; R329-L333 WeakPolarHBondContact O-CD1 2.94Å; R329-L333 VanDerWaalsContact O-CG 3.23Å; R329-L333 WeakPolarHBondContact O-CG 3.49Å; R329-L333 PolarHBondContact O-N 2.85Å |
| 330 | M | 43.2 | Very low | 50.4 | Low | 116 Ų | 116 | 117.6 Ų | 117.6 | 57% | 0.571 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -75 | -40.5 | 174.6 | -154.4 | 129.9 | 164.2 | 0 | 0 | 111.4 | T326 H327 S332 L333 F334 | T326-M330 VanDerWaalsContact O-CB 3.3Å; T326-M330 WeakPolarHBondContact O-CB 3.22Å; T326-M330 PolarHBondContact O-N 2.77Å; H327-M330 PolarHBondContact O-N 2.04Å; M330-S332 PolarHBondContact O-N 3.38Å; M330-L333 PolarHBondContact O-N 2.87Å; M330-F334 HydrophobicContact CE-CE2 4.43Å; M330-F334 HydrophobicContact CG-CD2 4.16Å; M330-F334 HydrophobicContact CG-CE2 4.24Å; M330-F334 WeakPolarHBondContact O-CD2 3.4Å; M330-F334 PolarHBondContact O-N 2.96Å |
| 331 | E | 49.6 | Very low | 48.9 | Very low | 123 Ų | 123 | 117.9 Ų | 117.9 | 58% | 0.575 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -64.4 | -37 | 172.1 | -82.5 | -170.2 | 158.1 | 0 | 0 | 112.7 | H327 L333 F334 K335 | H327-E331 PolarHBondContact O-N 3.37Å; E331-L333 VanDerWaalsContact C-N 3.32Å; E331-F334 PolarHBondContact O-N 3.1Å; E331-K335 WeakPolarHBondContact O-CB 3.33Å; E331-K335 PolarHBondContact O-N 2.74Å |
| 332 | S | 48.2 | Very low | 47.8 | Very low | 63 Ų | 63 | 123.6 Ų | 123.6 | 44% | 0.441 | 64% | 0.64 | S | S | . | * | H | α-helix | trans | -69.5 | -30.7 | 175 | 63.8 | 0 | 0 | 0 | 0 | 112.8 | V328 R329 M330 T336 | V328-S332 WeakPolarHBondContact O-CB 3.23Å; V328-S332 PolarHBondContact O-N 2.94Å; V328-S332 PolarHBondContact O-OG 2.78Å; R329-S332 WeakPolarHBondContact CA-OG 3.39Å; R329-S332 PolarHBondContact O-OG 3.04Å; M330-S332 PolarHBondContact O-N 3.38Å; S332-T336 PolarHBondContact O-OG1 2.96Å |
| 333 | L | 50.1 | Low | 46.3 | Very low | 118 Ų | 118 | 128.7 Ų | 128.7 | 62% | 0.618 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -74 | -39.7 | 174.1 | -75.1 | 165.7 | 0 | 0 | 0 | 111.2 | R329 M330 E331 T336 | R329-L333 HydrophobicContact CG-CD1 4.49Å; R329-L333 WeakPolarHBondContact O-CB 3.05Å; R329-L333 WeakPolarHBondContact O-CD1 2.94Å; R329-L333 VanDerWaalsContact O-CG 3.23Å; R329-L333 WeakPolarHBondContact O-CG 3.49Å; R329-L333 PolarHBondContact O-N 2.85Å; M330-L333 PolarHBondContact O-N 2.87Å; E331-L333 VanDerWaalsContact C-N 3.32Å; L333-T336 PolarHBondContact O-N 3.06Å |
| 334 | F | 47.1 | Very low | 45.2 | Very low | 149 Ų | 149 | 128.1 Ų | 128.1 | 65% | 0.654 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -73 | -23.6 | 175.4 | -91.1 | -81.6 | 0 | 0 | 0 | 114.2 | M330 E331 T336 | M330-F334 HydrophobicContact CE-CE2 4.43Å; M330-F334 HydrophobicContact CG-CD2 4.16Å; M330-F334 HydrophobicContact CG-CE2 4.24Å; M330-F334 WeakPolarHBondContact O-CD2 3.4Å; M330-F334 PolarHBondContact O-N 2.96Å; E331-F334 PolarHBondContact O-N 3.1Å; F334-T336 VanDerWaalsContact C-N 3.26Å; F334-T336 PolarHBondContact O-N 3.37Å |
| 335 | K | 48 | Very low | 44.1 | Very low | 171 Ų | 171 | 130 Ų | 130 | 74% | 0.743 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76 | -8.1 | 172.6 | -89.2 | -180 | 176.2 | 173.5 | 0 | 114.4 | E331 | E331-K335 WeakPolarHBondContact O-CB 3.33Å; E331-K335 PolarHBondContact O-N 2.74Å |
| 336 | T | 45.9 | Very low | 43.1 | Very low | 118 Ų | 118 | 134.2 Ų | 134.2 | 72% | 0.724 | 71% | 0.714 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.9 | -6.6 | 179.2 | -48.8 | 0 | 0 | 0 | 0 | 112.4 | S332 L333 F334 | S332-T336 PolarHBondContact O-OG1 2.96Å; L333-T336 PolarHBondContact O-N 3.06Å; F334-T336 VanDerWaalsContact C-N 3.26Å; F334-T336 PolarHBondContact O-N 3.37Å |
| 337 | E | 45.4 | Very low | 42.6 | Very low | 167 Ų | 167 | 135.7 Ų | 135.7 | 78% | 0.78 | 72% | 0.724 | S | S | * | * | trans | -122.5 | 82 | 175.6 | -72.3 | -178.2 | 168.7 | 0 | 0 | 111.3 | ||||
| 338 | T | 39.8 | Very low | 42.1 | Very low | 124 Ų | 124 | 134.1 Ų | 134.1 | 76% | 0.761 | 74% | 0.735 | S | S | * | * | trans | -131.4 | 122.2 | 154 | 23.9 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 339 | P | 43.2 | Very low | 41.2 | Very low | 119 Ų | 119 | 138.3 Ų | 138.3 | 77% | 0.773 | 75% | 0.752 | S | S | * | * | trans | -75.2 | 151.8 | 178.7 | -3.7 | 20 | 0 | 0 | 0 | 111.3 | T341 | P339-T341 PolarHBondContact O-N 3.45Š| ||
| 340 | L | 44.4 | Very low | 40.6 | Very low | 176 Ų | 176 | 138.1 Ų | 138.1 | 92% | 0.921 | 76% | 0.759 | S | S | * | * | trans | -46.5 | 124.3 | 170.1 | -96.2 | 81.1 | 0 | 0 | 0 | 111.5 | ||||
| 341 | T | 34.7 | Very low | 40.1 | Very low | 140 Ų | 140 | 141.2 Ų | 141.2 | 86% | 0.859 | 77% | 0.773 | S | S | * | * | trans | -126.6 | 124.9 | 156.2 | -0.9 | 0 | 0 | 0 | 0 | 110.5 | P339 | P339-T341 PolarHBondContact O-N 3.45Š| ||
| 342 | T | 37.2 | Very low | 39.1 | Very low | 136 Ų | 136 | 143.1 Ų | 143.1 | 83% | 0.834 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -61 | 135.9 | -172.7 | -27.4 | 0 | 0 | 0 | 0 | 112.4 | ||
| 343 | K | 32.9 | Very low | 38.3 | Very low | 202 Ų | 202 | 145.7 Ų | 145.7 | 88% | 0.878 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -69.8 | 142.3 | 166.6 | -87.6 | -179.9 | 172.2 | 179.5 | 0 | 110.7 | ||
| 344 | P | 35.7 | Very low | 37.2 | Very low | 124 Ų | 124 | 145 Ų | 145 | 81% | 0.805 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -92.1 | 129.3 | 154.4 | 16.2 | 1 | 0 | 0 | 0 | 110.5 | ||
| 345 | S | 33.8 | Very low | 36.4 | Very low | 118 Ų | 118 | 144.5 Ų | 144.5 | 83% | 0.825 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -83.4 | 134 | 171.2 | 46.6 | 0 | 0 | 0 | 0 | 111.2 | ||
| 346 | L | 32 | Very low | 35.6 | Very low | 169 Ų | 169 | 143.7 Ų | 143.7 | 89% | 0.885 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -94.6 | 151.1 | 163.1 | -114.5 | 94.6 | 0 | 0 | 0 | 110.5 | ||
| 347 | P | 40.5 | Very low | 34.9 | Very low | 116 Ų | 116 | 143.2 Ų | 143.2 | 75% | 0.753 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -91.8 | 155.5 | -169.6 | 35.9 | -32 | 0 | 0 | 0 | 113.7 | ||
| 348 | A | 33.8 | Very low | 34.2 | Very low | 100 Ų | 100 | 141.4 Ų | 141.4 | 83% | 0.826 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -90.5 | 140 | 169.3 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||
| 349 | I | 33 | Very low | 33.8 | Very low | 169 Ų | 169 | 141.6 Ų | 141.6 | 87% | 0.867 | 80% | 0.796 | S | S | * | * | trans | -133.7 | 135.3 | 160.6 | -64.7 | -179.1 | 0 | 0 | 0 | 108 | ||||
| 350 | Q | 33.8 | Very low | 33.3 | Very low | 183 Ų | 183 | 142.6 Ų | 142.6 | 86% | 0.855 | 80% | 0.795 | S | S | * | * | trans | -86.8 | 166.1 | -177.7 | -107.3 | 154.1 | -69.3 | 0 | 0 | 113.6 | ||||
| 351 | E | 31.9 | Very low | 32.5 | Very low | 181 Ų | 181 | 138 Ų | 138 | 85% | 0.846 | 79% | 0.79 | S | S | * | * | trans | 121 | 148.1 | 159.1 | -77 | 179.9 | 176.6 | 0 | 0 | 112.6 | ||||
| 352 | E | 29.3 | Very low | 32.4 | Very low | 163 Ų | 163 | 134.8 Ų | 134.8 | 76% | 0.762 | 79% | 0.785 | S | S | * | * | cis | -160.5 | 149.1 | -27.8 | -118.2 | -168.2 | 162.5 | 0 | 0 | 105.1 | ||||
| 353 | V | 30.8 | Very low | 32.2 | Very low | 117 Ų | 117 | 136.7 Ų | 136.7 | 71% | 0.709 | 78% | 0.784 | S | S | * | * | trans | 58.7 | 139.5 | 138.3 | -176.5 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 354 | S | 28.6 | Very low | 32.3 | Very low | 103 Ų | 103 | 133.3 Ų | 133.3 | 72% | 0.72 | 78% | 0.775 | S | S | * | * | trans | 83.3 | 103.9 | 150.5 | 54.9 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 355 | D | 30.2 | Very low | 32.3 | Very low | 138 Ų | 138 | 134.4 Ų | 134.4 | 74% | 0.738 | 77% | 0.771 | S | S | * | * | 87.2 | 140.9 | 108.4 | -138.8 | 17.4 | 0 | 0 | 0 | 121 | |||||
| 356 | Q | 30.8 | Very low | 32.3 | Very low | 154 Ų | 154 | 134.7 Ų | 134.7 | 72% | 0.72 | 76% | 0.763 | S | S | * | * | trans | 82.5 | 102.1 | 153.4 | -81 | 175.3 | 32.6 | 0 | 0 | 122.6 | ||||
| 357 | T | 30.4 | Very low | 32.3 | Very low | 109 Ų | 109 | 133.9 Ų | 133.9 | 67% | 0.669 | 76% | 0.755 | S | S | * | * | 68.1 | 141.9 | 119.3 | 13.2 | 0 | 0 | 0 | 0 | 122.9 | |||||
| 358 | T | 31.2 | Very low | 31.8 | Very low | 129 Ų | 129 | 132.5 Ų | 132.5 | 79% | 0.791 | 75% | 0.747 | S | S | * | * | trans | 73.5 | 147.6 | 150.7 | 55.1 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 359 | N | 31.6 | Very low | 32.1 | Very low | 127 Ų | 127 | 133.2 Ų | 133.2 | 68% | 0.679 | 74% | 0.742 | S | S | * | * | cis | -176.5 | 158.2 | -22.5 | -163.8 | 10.9 | 0 | 0 | 0 | 103.8 | ||||
| 360 | N | 32.4 | Very low | 32.6 | Very low | 141 Ų | 141 | 138.1 Ų | 138.1 | 75% | 0.754 | 76% | 0.757 | S | S | * | * | trans | 66.6 | 115.7 | 157.2 | -69.5 | -14.1 | 0 | 0 | 0 | 120 | ||||
| 361 | G | 28.7 | Very low | 32.5 | Very low | 79 Ų | 79 | 135.9 Ų | 135.9 | 81% | 0.814 | 75% | 0.752 | S | S | * | * | 114 | 138.1 | 83.3 | 0 | 0 | 0 | 0 | 0 | 117 | |||||
| 362 | G | 31.2 | Very low | 32.5 | Very low | 73 Ų | 73 | 133.5 Ų | 133.5 | 75% | 0.753 | 75% | 0.748 | S | S | * | * | trans | 92.5 | 94.9 | 161.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 363 | E | 33.3 | Very low | 32.7 | Very low | 176 Ų | 176 | 131.8 Ų | 131.8 | 82% | 0.822 | 75% | 0.747 | S | S | * | * | 73.2 | 134 | 52.9 | -146.3 | -171.1 | 159.6 | 0 | 0 | 114.3 | |||||
| 364 | L | 35.8 | Very low | 32.8 | Very low | 130 Ų | 130 | 132.7 Ų | 132.7 | 68% | 0.681 | 75% | 0.749 | S | S | * | * | trans | 77.9 | 142.2 | 165.9 | -69.2 | 124.6 | 0 | 0 | 0 | 118.2 | ||||
| 365 | M | 34.8 | Very low | 33.1 | Very low | 147 Ų | 147 | 134.6 Ų | 134.6 | 72% | 0.724 | 75% | 0.751 | S | S | * | * | cis | 157.7 | 160.5 | -16.6 | -104 | -98 | -84.1 | 0 | 0 | 105.4 | ||||
| 366 | L | 34.6 | Very low | 33.3 | Very low | 125 Ų | 125 | 134.3 Ų | 134.3 | 65% | 0.654 | 75% | 0.752 | S | S | * | * | trans | 71.4 | 147.3 | 163.2 | -59 | 125.2 | 0 | 0 | 0 | 115.2 | ||||
| 367 | E | 30.9 | Very low | 33.4 | Very low | 152 Ų | 152 | 132.9 Ų | 132.9 | 71% | 0.71 | 75% | 0.754 | S | S | * | * | cis | -166.3 | 135.1 | -1.7 | -122.5 | 176.6 | 126.8 | 0 | 0 | 105.1 | ||||
| 368 | S | 31.2 | Very low | 33.7 | Very low | 86 Ų | 86 | 134.8 Ų | 134.8 | 60% | 0.601 | 76% | 0.76 | S | S | * | * | 64 | 130.9 | 101.6 | 89.1 | 0 | 0 | 0 | 0 | 117.1 | |||||
| 369 | T | 38.8 | Very low | 33.9 | Very low | 116 Ų | 116 | 135.3 Ų | 135.3 | 71% | 0.712 | 76% | 0.758 | S | S | * | * | trans | 80.8 | 102.2 | 148.2 | -11.9 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 370 | F | 43.6 | Very low | 34.1 | Very low | 271 Ų | 271 | 136 Ų | 136 | 100% | 1.189 | 77% | 0.765 | S | S | * | * | -162.4 | 0 | 95.5 | -116.5 | -86.1 | 0 | 0 | 0 | 111.8 |
Retrieved 370 of 370 residues in 260.9 ms
(Link to these results)