| 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 | 46.6 | Very low | 43.5 | Very low | 202 Ų | 202 | 142.8 Ų | 142.8 | 100% | 0.995 | 66% | 0.663 | S | S | * | * | 0 | 110.2 | 0 | -108.7 | 167.5 | 67.2 | 0 | 0 | 106 | |||||
| 2 | D | 48.7 | Very low | 43.2 | Very low | 114 Ų | 114 | 142 Ų | 142 | 61% | 0.61 | 67% | 0.667 | S | S | * | * | trans | -84.8 | 121.1 | -167.7 | -151.6 | -14.6 | 0 | 0 | 0 | 109 | Q4 T5 E6 | D2-Q4 PolarHBondContact O-N 2.79Å; D2-T5 WeakPolarHBondContact O-CB 3.43Å; D2-T5 PolarHBondContact O-N 3.32Å; D2-E6 PolarHBondContact O-N 3.18Å | ||
| 3 | I | 47.7 | Very low | 42.6 | Very low | 139 Ų | 139 | 142.5 Ų | 142.5 | 71% | 0.713 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -58.8 | -24.4 | -172.1 | -66.9 | 172.1 | 0 | 0 | 0 | 111.3 | R7 | I3-R7 WeakPolarHBondContact O-CB 3.47Å; I3-R7 PolarHBondContact O-N 3.38Å; I3-R7 VanDerWaalsContact O-N 3.08Å |
| 4 | Q | 45.6 | Very low | 42.2 | Very low | 156 Ų | 156 | 143.9 Ų | 143.9 | 73% | 0.729 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -72.3 | -31.3 | 175 | -67.7 | -142.6 | -21.7 | 0 | 0 | 113.9 | D2 R8 | D2-Q4 PolarHBondContact O-N 2.79Å; Q4-R8 PolarHBondContact O-N 2.93Å |
| 5 | T | 48.5 | Very low | 41.4 | Very low | 85 Ų | 85 | 138.8 Ų | 138.8 | 52% | 0.521 | 68% | 0.676 | S | S | . | * | H | α-helix | trans | -76.8 | -33.4 | -180 | -42.6 | 0 | 0 | 0 | 0 | 110.8 | D2 R9 | D2-T5 WeakPolarHBondContact O-CB 3.43Å; D2-T5 PolarHBondContact O-N 3.32Å; T5-R9 PolarHBondContact O-N 3.14Å |
| 6 | E | 40.6 | Very low | 40.9 | Very low | 97 Ų | 97 | 134.8 Ų | 134.8 | 45% | 0.453 | 68% | 0.682 | S | S | . | * | H | α-helix | trans | -73.8 | -35.3 | 174.7 | -154 | 155 | -165.9 | 0 | 0 | 111.4 | D2 R9 L10 | D2-E6 PolarHBondContact O-N 3.18Å; E6-R9 PolarHBondContact O-N 3.23Å; E6-L10 WeakPolarHBondContact O-CG 3.35Å; E6-L10 PolarHBondContact O-N 2.78Å |
| 7 | R | 41.1 | Very low | 40.4 | Very low | 186 Ų | 186 | 136.2 Ų | 136.2 | 70% | 0.702 | 69% | 0.692 | S | S | * | * | H | α-helix | trans | -66.5 | -35.4 | 171.2 | -160.8 | -179.3 | -159.4 | -156.1 | 4.4 | 113.3 | I3 L11 | I3-R7 WeakPolarHBondContact O-CB 3.47Å; I3-R7 PolarHBondContact O-N 3.38Å; I3-R7 VanDerWaalsContact O-N 3.08Å; R7-L11 WeakPolarHBondContact O-CD1 3.42Å; R7-L11 VanDerWaalsContact O-CG 3.31Å; R7-L11 WeakPolarHBondContact O-CG 3.48Å; R7-L11 PolarHBondContact O-N 3.35Å |
| 8 | R | 39.8 | Very low | 40.2 | Very low | 192 Ų | 192 | 139.1 Ų | 139.1 | 73% | 0.725 | 70% | 0.702 | S | S | * | * | H | α-helix | trans | -68.7 | -42.2 | 173 | -99 | -175.7 | -175.8 | 178.9 | 1.6 | 112 | Q4 L10 L11 D12 | Q4-R8 PolarHBondContact O-N 2.93Å; R8-L10 PolarHBondContact O-N 2.89Å; R8-L11 PolarHBondContact O-N 3.42Å; R8-D12 PolarHBondContact O-N 3.04Å |
| 9 | R | 36.2 | Very low | 40.2 | Very low | 172 Ų | 172 | 136 Ų | 136 | 65% | 0.649 | 69% | 0.688 | S | S | * | * | H | α-helix | trans | -62.5 | -41.1 | 174.7 | -91.7 | -174.7 | 173.2 | 176.6 | -4.1 | 112.9 | T5 E6 L11 D12 E13 | T5-R9 PolarHBondContact O-N 3.14Å; E6-R9 PolarHBondContact O-N 3.23Å; R9-L11 VanDerWaalsContact C-N 3.31Å; R9-L11 PolarHBondContact O-N 3.22Å; R9-D12 PolarHBondContact O-N 3.35Å; R9-E13 VanDerWaalsContact O-CB 3.29Å; R9-E13 WeakPolarHBondContact O-CB 3.46Å; R9-E13 WeakPolarHBondContact O-CG 3.45Å; R9-E13 PolarHBondContact O-N 3.09Å |
| 10 | L | 41 | Very low | 40.2 | Very low | 110 Ų | 110 | 135.5 Ų | 135.5 | 58% | 0.576 | 69% | 0.694 | S | S | * | * | H | α-helix | trans | -67.9 | -29.2 | 177 | -71.7 | 166.8 | 0 | 0 | 0 | 113 | E6 R8 E14 | E6-L10 WeakPolarHBondContact O-CG 3.35Å; E6-L10 PolarHBondContact O-N 2.78Å; R8-L10 PolarHBondContact O-N 2.89Å; L10-E14 PolarHBondContact O-N 2.57Å |
| 11 | L | 43.1 | Very low | 40.5 | Very low | 118 Ų | 118 | 132.1 Ų | 132.1 | 62% | 0.618 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -77.2 | -26.6 | 172.8 | -73.6 | 167 | 0 | 0 | 0 | 113.1 | R7 R8 R9 | R7-L11 WeakPolarHBondContact O-CD1 3.42Å; R7-L11 VanDerWaalsContact O-CG 3.31Å; R7-L11 WeakPolarHBondContact O-CG 3.48Å; R7-L11 PolarHBondContact O-N 3.35Å; R8-L11 PolarHBondContact O-N 3.42Å; R9-L11 VanDerWaalsContact C-N 3.31Å; R9-L11 PolarHBondContact O-N 3.22Å |
| 12 | D | 39.6 | Very low | 40.7 | Very low | 133 Ų | 133 | 125 Ų | 125 | 71% | 0.711 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -88.6 | -22.8 | 177.1 | -69.7 | -24.2 | 0 | 0 | 0 | 112.4 | R8 R9 | R8-D12 PolarHBondContact O-N 3.04Å; R9-D12 PolarHBondContact O-N 3.35Å |
| 13 | E | 35.9 | Very low | 40.8 | Very low | 148 Ų | 148 | 124 Ų | 124 | 69% | 0.692 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -93.3 | -15.3 | 179.7 | -75.4 | -178.5 | 164.9 | 0 | 0 | 114.4 | R9 G15 | R9-E13 VanDerWaalsContact O-CB 3.29Å; R9-E13 WeakPolarHBondContact O-CB 3.46Å; R9-E13 WeakPolarHBondContact O-CG 3.45Å; R9-E13 PolarHBondContact O-N 3.09Å; E13-G15 PolarHBondContact O-N 3.16Å |
| 14 | E | 36.7 | Very low | 41.1 | Very low | 163 Ų | 163 | 121.9 Ų | 121.9 | 76% | 0.762 | 64% | 0.642 | S | S | * | * | S | Bend | trans | -83 | 62.7 | 153.4 | -71.2 | -177.4 | 167.7 | 0 | 0 | 108 | L10 G16 | L10-E14 PolarHBondContact O-N 2.57Å; E14-G16 PolarHBondContact O-N 3.18Å |
| 15 | G | 30.5 | Very low | 41.9 | Very low | 67 Ų | 67 | 118.5 Ų | 118.5 | 69% | 0.691 | 64% | 0.636 | S | S | * | * | 49.7 | 78 | 87.2 | 0 | 0 | 0 | 0 | 0 | 109.1 | E13 | E13-G15 PolarHBondContact O-N 3.16Š| |||
| 16 | G | 32.3 | Very low | 42.5 | Very low | 74 Ų | 74 | 119.3 Ų | 119.3 | 76% | 0.763 | 63% | 0.634 | S | S | * | * | 95.4 | 45.2 | 76.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | E14 | E14-G16 PolarHBondContact O-N 3.18Š| |||
| 17 | D | 32.5 | Very low | 43.7 | Very low | 160 Ų | 160 | 116.8 Ų | 116.8 | 86% | 0.856 | 62% | 0.622 | S | S | * | * | trans | -96.8 | 96.4 | 149.5 | -100.7 | -19.8 | 0 | 0 | 0 | 105.5 | D19 | D17-D19 PolarHBondContact O-N 2.96Š| ||
| 18 | E | 37.6 | Very low | 45 | Very low | 187 Ų | 187 | 114.3 Ų | 114.3 | 87% | 0.874 | 62% | 0.619 | S | S | * | * | trans | -57.5 | 97.1 | 152.9 | -76.9 | -176.3 | 152.8 | 0 | 0 | 106.1 | P20 | E18-P20 WeakPolarHBondContact O-CD 3.24Å; E18-P20 VanDerWaalsContact O-N 3.11Å | ||
| 19 | D | 39.8 | Very low | 46.1 | Very low | 81 Ų | 81 | 107.5 Ų | 107.5 | 43% | 0.433 | 60% | 0.603 | S | S | . | * | trans | -52.3 | 115.5 | 172.4 | -173.2 | 5.5 | 0 | 0 | 0 | 107.5 | D17 T21 L24 | D17-D19 PolarHBondContact O-N 2.96Å; D19-T21 PolarHBondContact O-N 3.16Å; D19-L24 WeakPolarHBondContact OD2-CD1 3.36Å | ||
| 20 | P | 39.7 | Very low | 47.6 | Very low | 126 Ų | 126 | 99.6 Ų | 99.6 | 82% | 0.818 | 57% | 0.574 | S | S | * | * | S | Bend | trans | -67.4 | 4.4 | -169.1 | 23.9 | -32 | 0 | 0 | 0 | 113.6 | E18 | E18-P20 WeakPolarHBondContact O-CD 3.24Å; E18-P20 VanDerWaalsContact O-N 3.11Å |
| 21 | T | 47 | Very low | 48.9 | Very low | 65 Ų | 65 | 95.8 Ų | 95.8 | 40% | 0.399 | 55% | 0.554 | S | S | . | * | trans | -135.1 | 109 | 170.9 | 50.8 | 0 | 0 | 0 | 0 | 109.7 | D19 L23 | D19-T21 PolarHBondContact O-N 3.16Å; T21-L23 HydrophobicContact CG2-CD1 3.75Å; T21-L23 HydrophobicContact CG2-CG 4.42Å; T21-L23 PolarHBondContact O-N 3.26Å | ||
| 22 | G | 50.4 | Low | 50.1 | Low | 53 Ų | 53 | 94.7 Ų | 94.7 | 55% | 0.546 | 56% | 0.556 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -58 | 9.3 | 168.6 | 0 | 0 | 0 | 0 | 0 | 115.6 | E26 | G22-E26 WeakPolarHBondContact O-CG 3.44Å; G22-E26 PolarHBondContact O-N 2.95Å; G22-E26 VanDerWaalsContact O-N 3.14Å |
| 23 | L | 50.6 | Low | 51.6 | Low | 93 Ų | 93 | 93.7 Ų | 93.7 | 49% | 0.487 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -64.7 | -37.7 | -178.6 | -69.1 | 171.3 | 0 | 0 | 0 | 113.4 | T21 Q27 | T21-L23 HydrophobicContact CG2-CD1 3.75Å; T21-L23 HydrophobicContact CG2-CG 4.42Å; T21-L23 PolarHBondContact O-N 3.26Å; L23-Q27 VanDerWaalsContact O-CB 3.31Å; L23-Q27 WeakPolarHBondContact O-CB 3.42Å; L23-Q27 PolarHBondContact O-N 3.43Å |
| 24 | L | 55.3 | Low | 53.6 | Low | 93 Ų | 93 | 87.6 Ų | 87.6 | 49% | 0.487 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -70.7 | -41.2 | 179.2 | -82.3 | 166.2 | 0 | 0 | 0 | 111.4 | D19 Q27 E28 | D19-L24 WeakPolarHBondContact OD2-CD1 3.36Å; L24-Q27 PolarHBondContact O-N 3.41Å; L24-E28 WeakPolarHBondContact O-CG 3.33Å; L24-E28 PolarHBondContact O-N 3.48Å |
| 25 | S | 61.4 | Low | 55.7 | Low | 86 Ų | 86 | 85.4 Ų | 85.4 | 60% | 0.601 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -60.2 | -44.1 | 173 | 171.3 | 0 | 0 | 0 | 0 | 112.1 | A29 | S25-A29 VanDerWaalsContact O-CB 3.29Å; S25-A29 WeakPolarHBondContact O-CB 3.44Å; S25-A29 PolarHBondContact O-N 3.04Å |
| 26 | E | 62.5 | Low | 58.3 | Low | 102 Ų | 102 | 83.9 Ų | 83.9 | 48% | 0.477 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -68.2 | -40.2 | 177.4 | -75.2 | -175.1 | 166.2 | 0 | 0 | 112.9 | G22 A29 Y30 W247 | G22-E26 WeakPolarHBondContact O-CG 3.44Å; G22-E26 PolarHBondContact O-N 2.95Å; G22-E26 VanDerWaalsContact O-N 3.14Å; E26-A29 PolarHBondContact O-N 3.1Å; E26-Y30 VanDerWaalsContact O-CB 3.25Å; E26-Y30 WeakPolarHBondContact O-CB 3.39Å; E26-Y30 PolarHBondContact O-N 3.11Å; E26-W247 VanDerWaalsContact OE2-CD1 3.32Å; E26-W247 PolarHBondContact OE2-NE1 3.02Å |
| 27 | Q | 65.5 | Low | 60.8 | Low | 44 Ų | 44 | 90.9 Ų | 90.9 | 21% | 0.206 | 49% | 0.485 | C | S | . | . | H | α-helix | trans | -65.3 | -40.7 | 177.8 | -173.4 | 174.6 | 8.2 | 0 | 0 | 111.6 | L23 L24 Y30 L31 E164 W247 | L23-Q27 VanDerWaalsContact O-CB 3.31Å; L23-Q27 WeakPolarHBondContact O-CB 3.42Å; L23-Q27 PolarHBondContact O-N 3.43Å; L24-Q27 PolarHBondContact O-N 3.41Å; Q27-Y30 PolarHBondContact O-N 3.25Å; Q27-L31 HydrophobicContact CG-CD1 4.08Å; Q27-L31 WeakPolarHBondContact O-CB 3.17Å; Q27-L31 WeakPolarHBondContact O-CG 3.42Å; Q27-L31 PolarHBondContact O-N 3.09Å; Q27-E164 PolarHBondContact NE2-OE2 3.44Å; Q27-W247 HydrophobicContact CB-CH2 4.28Å; Q27-W247 HydrophobicContact CB-CZ2 4.35Å; Q27-W247 HydrophobicContact CG-CH2 4.19Å |
| 28 | E | 67.1 | Low | 63.5 | Low | 134 Ų | 134 | 88 Ų | 88 | 63% | 0.626 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -68.5 | -42.6 | 175.7 | -72 | -171.4 | 157.6 | 0 | 0 | 112.3 | L24 Y30 L31 S32 | L24-E28 WeakPolarHBondContact O-CG 3.33Å; L24-E28 PolarHBondContact O-N 3.48Å; E28-Y30 VanDerWaalsContact C-N 3.33Å; E28-Y30 PolarHBondContact O-N 2.94Å; E28-L31 PolarHBondContact O-N 3.39Å; E28-S32 PolarHBondContact O-N 3.18Å |
| 29 | A | 63.8 | Low | 65.9 | Low | 48 Ų | 48 | 79.1 Ų | 79.1 | 40% | 0.397 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -61 | -41.6 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | S25 E26 S32 | S25-A29 VanDerWaalsContact O-CB 3.29Å; S25-A29 WeakPolarHBondContact O-CB 3.44Å; S25-A29 PolarHBondContact O-N 3.04Å; E26-A29 PolarHBondContact O-N 3.1Å; A29-S32 PolarHBondContact O-OG 3.05Å |
| 30 | Y | 68 | Low | 68.4 | Low | 7 Ų | 7 | 80 Ų | 80 | 3% | 0.027 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -59.2 | -54.5 | 172.2 | 164.9 | -91.6 | 0 | 0 | 0 | 110.9 | E26 Q27 E28 S32 K33 V34 R239 A243 P244 W247 E248 | E26-Y30 VanDerWaalsContact O-CB 3.25Å; E26-Y30 WeakPolarHBondContact O-CB 3.39Å; E26-Y30 PolarHBondContact O-N 3.11Å; Q27-Y30 PolarHBondContact O-N 3.25Å; E28-Y30 VanDerWaalsContact C-N 3.33Å; E28-Y30 PolarHBondContact O-N 2.94Å; Y30-S32 PolarHBondContact O-N 2.88Å; Y30-K33 PolarHBondContact O-N 3.18Å; Y30-V34 HydrophobicContact CD1-CG2 4.21Å; Y30-V34 HydrophobicContact CE1-CG2 3.75Å; Y30-V34 HydrophobicContact CE2-CG2 4.24Å; Y30-V34 WeakPolarHBondContact O-CG2 3.5Å; Y30-V34 PolarHBondContact O-N 3.44Å; Y30-R239 WeakPolarHBondContact OH-CD 3.24Å; Y30-R239 WeakPolarHBondContact OH-CG 3.11Å; Y30-R239 PolarHBondContact OH-NE 2.88Å; Y30-A243 HydrophobicContact CE2-CB 4.41Å; Y30-P244 HydrophobicContact CD2-CG 3.89Å; Y30-P244 HydrophobicContact CG-CG 4.43Å; Y30-W247 HydrophobicContact CD1-CZ3 4.33Å; Y30-W247 HydrophobicContact CD2-CE3 4.32Å; Y30-W247 HydrophobicContact CG-CE3 4.38Å; Y30-W247 HydrophobicContact CG-CZ3 4.35Å; Y30-E248 HydrophobicContact CE2-CB 4.36Å; Y30-E248 WeakPolarHBondContact CE2-OE2 3.46Å; Y30-E248 VanDerWaalsContact CZ-OE2 3.29Å; Y30-E248 PolarHBondContact OH-OE1 3.28Å; Y30-E248 PolarHBondContact OH-OE2 2.59Å |
| 31 | L | 68.9 | Low | 70.8 | Confident | 30 Ų | 30 | 78.4 Ų | 78.4 | 16% | 0.157 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -62.7 | -29.4 | -176.1 | -71.5 | 168.8 | 0 | 0 | 0 | 113.1 | Q27 E28 K33 V34 K165 | Q27-L31 HydrophobicContact CG-CD1 4.08Å; Q27-L31 WeakPolarHBondContact O-CB 3.17Å; Q27-L31 WeakPolarHBondContact O-CG 3.42Å; Q27-L31 PolarHBondContact O-N 3.09Å; E28-L31 PolarHBondContact O-N 3.39Å; L31-K33 VanDerWaalsContact C-N 3.25Å; L31-K33 PolarHBondContact O-N 3.29Å; L31-V34 PolarHBondContact O-N 3.46Å; L31-K165 HydrophobicContact CD1-CD 3.85Å; L31-K165 VanDerWaalsContact CD1-CE 3.47Å; L31-K165 HydrophobicContact CD1-CG 4.33Å; L31-K165 HydrophobicContact CD2-CD 4.3Å |
| 32 | S | 67 | Low | 72.9 | Confident | 95 Ų | 95 | 75.3 Ų | 75.3 | 66% | 0.664 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -65.2 | -26.4 | 176.7 | 77.4 | 0 | 0 | 0 | 0 | 113.7 | E28 A29 Y30 | E28-S32 PolarHBondContact O-N 3.18Å; A29-S32 PolarHBondContact O-OG 3.05Å; Y30-S32 PolarHBondContact O-N 2.88Å |
| 33 | K | 71.9 | Confident | 74.8 | Confident | 111 Ų | 111 | 73 Ų | 73 | 48% | 0.483 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -98.3 | -8.5 | -177 | -63 | -176.7 | -175.8 | 176.6 | 0 | 113.5 | Y30 L31 D242 | Y30-K33 PolarHBondContact O-N 3.18Å; L31-K33 VanDerWaalsContact C-N 3.25Å; L31-K33 PolarHBondContact O-N 3.29Å; K33-D242 VanDerWaalsContact CD-O 3.32Å; K33-D242 WeakPolarHBondContact CD-O 3.46Å |
| 34 | V | 78 | Confident | 76.8 | Confident | 20 Ų | 20 | 73.7 Ų | 73.7 | 12% | 0.121 | 36% | 0.362 | C | S | . | . | trans | -72.8 | 129.1 | -177.5 | 175 | 0 | 0 | 0 | 0 | 111.6 | Y30 L31 N36 R239 A243 | Y30-V34 HydrophobicContact CD1-CG2 4.21Å; Y30-V34 HydrophobicContact CE1-CG2 3.75Å; Y30-V34 HydrophobicContact CE2-CG2 4.24Å; Y30-V34 WeakPolarHBondContact O-CG2 3.5Å; Y30-V34 PolarHBondContact O-N 3.44Å; L31-V34 PolarHBondContact O-N 3.46Å; V34-N36 VanDerWaalsContact CG1-OD1 3.3Å; V34-N36 WeakPolarHBondContact CG1-OD1 3.4Å; V34-R239 CarbonylContact C-O 3.5Å; V34-R239 WeakPolarHBondContact CA-O 3.27Å; V34-R239 HydrophobicContact CG1-CB 4.41Å; V34-R239 HydrophobicContact CG2-CB 4.37Å; V34-A243 HydrophobicContact CG2-CB 4.33Å | ||
| 35 | K | 80.3 | Confident | 78.6 | Confident | 117 Ų | 117 | 69.3 Ų | 69.3 | 51% | 0.509 | 34% | 0.339 | S | S | . | . | trans | -108 | 109.1 | 174.1 | -68.8 | 171.7 | -179.1 | 153.6 | 0 | 110.5 | R37 R239 D242 | K35-R37 VanDerWaalsContact C-N 3.34Å; K35-R37 PolarHBondContact O-N 3.27Å; K35-R239 PolarHBondContact N-O 3.44Å; K35-D242 IonicContact NZ-OD2 3.97Å; K35-D242 PolarHBondContact NZ-OD2 3.06Å | ||
| 36 | N | 84.1 | Confident | 80.2 | Confident | 36 Ų | 36 | 65.2 Ų | 65.2 | 19% | 0.193 | 31% | 0.31 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -79.7 | -2 | -171.7 | -68.2 | -34.4 | 0 | 0 | 0 | 116.3 | V34 K38 L39 Y40 H163 | V34-N36 VanDerWaalsContact CG1-OD1 3.3Å; V34-N36 WeakPolarHBondContact CG1-OD1 3.4Å; N36-K38 PolarHBondContact O-N 3.01Å; N36-L39 WeakPolarHBondContact O-CB 3.26Å; N36-L39 PolarHBondContact O-N 3.22Å; N36-Y40 HydrophobicContact CB-CD2 4.21Å; N36-Y40 HydrophobicContact CB-CE1 4.17Å; N36-Y40 HydrophobicContact CB-CE2 3.75Å; N36-Y40 WeakPolarHBondContact O-CD2 3.26Å; N36-Y40 PolarHBondContact O-N 3.13Å; N36-H163 PolarHBondContact OD1-CE1 2.68Å |
| 37 | R | 86.4 | Confident | 81.7 | Confident | 220 Ų | 220 | 60.7 Ų | 60.7 | 83% | 0.83 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -57.3 | -47 | -173.8 | -177.3 | 179.8 | 174 | -168.2 | -1.1 | 112.9 | K35 Y40 L41 | K35-R37 VanDerWaalsContact C-N 3.34Å; K35-R37 PolarHBondContact O-N 3.27Å; R37-Y40 PolarHBondContact O-N 3.5Å; R37-L41 PolarHBondContact O-N 3.02Å; R37-L41 VanDerWaalsContact O-N 3.13Å |
| 38 | K | 88.8 | Confident | 83 | Confident | 100 Ų | 100 | 59 Ų | 59 | 44% | 0.435 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -73.8 | -31.8 | -180 | -74 | -178.8 | 172.9 | -174.8 | 0 | 112.3 | N36 L41 A42 F237 | N36-K38 PolarHBondContact O-N 3.01Å; K38-L41 PolarHBondContact O-N 2.92Å; K38-A42 WeakPolarHBondContact O-CB 3.49Å; K38-A42 PolarHBondContact O-N 3.03Å; K38-F237 HydrophobicContact CB-CD1 4.14Å; K38-F237 HydrophobicContact CB-CE1 3.87Å; K38-F237 HydrophobicContact CB-CZ 4.29Å; K38-F237 WeakPolarHBondContact CB-O 3.07Å; K38-F237 HydrophobicContact CD-CD1 4.2Å; K38-F237 HydrophobicContact CD-CD2 3.9Å; K38-F237 HydrophobicContact CD-CE1 4.19Å; K38-F237 HydrophobicContact CD-CE2 3.87Å; K38-F237 HydrophobicContact CD-CG 4.07Å; K38-F237 HydrophobicContact CD-CZ 4.03Å; K38-F237 WeakPolarHBondContact CD-O 3.23Å; K38-F237 HydrophobicContact CG-CE1 4.31Å; K38-F237 HydrophobicContact CG-CZ 4.24Å |
| 39 | L | 88.4 | Confident | 84.3 | Confident | 0 Ų | 0 | 52.7 Ų | 52.7 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -62.1 | -45.2 | 171.1 | 175.2 | 63 | 0 | 0 | 0 | 111.7 | N36 L41 A42 S43 T161 V166 L170 L238 | N36-L39 WeakPolarHBondContact O-CB 3.26Å; N36-L39 PolarHBondContact O-N 3.22Å; L39-L41 VanDerWaalsContact C-N 3.32Å; L39-L41 PolarHBondContact O-N 3.16Å; L39-A42 PolarHBondContact O-N 3.12Å; L39-S43 WeakPolarHBondContact O-CB 3.44Å; L39-S43 PolarHBondContact O-N 3.39Å; L39-S43 PolarHBondContact O-OG 3.26Å; L39-T161 WeakPolarHBondContact CD1-O 3.44Å; L39-V166 HydrophobicContact CD2-CG2 3.71Å; L39-L170 HydrophobicContact CD2-CD1 4.34Å; L39-L170 HydrophobicContact CG-CD1 4.25Å; L39-L238 HydrophobicContact CD1-CD2 4.26Å |
| 40 | Y | 90.5 | Very high | 85.8 | Confident | 99 Ų | 99 | 50.6 Ų | 50.6 | 39% | 0.388 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -64.9 | -36.5 | 176.1 | -64 | -29 | 0 | 0 | 0 | 112.1 | N36 R37 S43 F44 M169 L170 | N36-Y40 HydrophobicContact CB-CD2 4.21Å; N36-Y40 HydrophobicContact CB-CE1 4.17Å; N36-Y40 HydrophobicContact CB-CE2 3.75Å; N36-Y40 WeakPolarHBondContact O-CD2 3.26Å; N36-Y40 PolarHBondContact O-N 3.13Å; R37-Y40 PolarHBondContact O-N 3.5Å; Y40-S43 PolarHBondContact O-N 3.39Å; Y40-F44 VanDerWaalsContact O-CB 3.24Å; Y40-F44 WeakPolarHBondContact O-CB 3.29Å; Y40-F44 PolarHBondContact O-N 3.17Å; Y40-M169 HydrophobicContact CE1-CE 3.85Å; Y40-L170 HydrophobicContact CD1-CD2 4.04Å; Y40-L170 HydrophobicContact CE1-CD2 4.28Å |
| 41 | L | 91.5 | Very high | 87.1 | Confident | 94 Ų | 94 | 52.6 Ų | 52.6 | 49% | 0.492 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -64.5 | -44.9 | 173.2 | -176.4 | 62.7 | 0 | 0 | 0 | 112.2 | R37 K38 L39 S43 F44 A45 M215 | R37-L41 PolarHBondContact O-N 3.02Å; R37-L41 VanDerWaalsContact O-N 3.13Å; K38-L41 PolarHBondContact O-N 2.92Å; L39-L41 VanDerWaalsContact C-N 3.32Å; L39-L41 PolarHBondContact O-N 3.16Å; L41-S43 VanDerWaalsContact C-N 3.32Å; L41-S43 PolarHBondContact O-N 2.99Å; L41-F44 PolarHBondContact O-N 3.11Å; L41-A45 WeakPolarHBondContact O-CB 3.28Å; L41-A45 PolarHBondContact O-N 3.47Å; L41-M215 HydrophobicContact CD2-CE 3.72Å; L41-M215 HydrophobicContact CG-CE 3.74Å; L41-M215 HydrophobicContact CG-SD 4.28Å |
| 42 | A | 91.1 | Very high | 88.3 | Confident | 0 Ų | 0 | 51.2 Ų | 51.2 | 0% | 0 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -63.6 | -38.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | K38 L39 A46 Y157 M215 L238 | K38-A42 WeakPolarHBondContact O-CB 3.49Å; K38-A42 PolarHBondContact O-N 3.03Å; L39-A42 PolarHBondContact O-N 3.12Å; A42-A46 WeakPolarHBondContact O-CB 3.3Å; A42-A46 PolarHBondContact O-N 3.36Å; A42-A46 VanDerWaalsContact O-N 3.07Å; A42-Y157 HydrophobicContact CB-CE1 4.45Å; A42-M215 WeakPolarHBondContact CA-SD 3.3Å; A42-M215 HydrophobicContact CB-CG 4.28Å; A42-M215 HydrophobicContact CB-SD 3.67Å; A42-L238 HydrophobicContact CB-CD2 4.03Å |
| 43 | S | 90.7 | Very high | 89.6 | Confident | 4 Ų | 4 | 47.8 Ų | 47.8 | 3% | 0.028 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -68.7 | -44.1 | 175.9 | -54.7 | 0 | 0 | 0 | 0 | 110.9 | L39 Y40 L41 A45 A46 V47 L170 | L39-S43 WeakPolarHBondContact O-CB 3.44Å; L39-S43 PolarHBondContact O-N 3.39Å; L39-S43 PolarHBondContact O-OG 3.26Å; Y40-S43 PolarHBondContact O-N 3.39Å; L41-S43 VanDerWaalsContact C-N 3.32Å; L41-S43 PolarHBondContact O-N 2.99Å; S43-A45 VanDerWaalsContact C-N 3.35Å; S43-A45 PolarHBondContact O-N 2.93Å; S43-A46 PolarHBondContact O-N 2.86Å; S43-A46 VanDerWaalsContact O-N 3.16Å; S43-V47 WeakPolarHBondContact O-CG1 3.5Å; S43-V47 WeakPolarHBondContact O-CG2 3.47Å; S43-V47 PolarHBondContact O-N 3.27Å; S43-L170 WeakPolarHBondContact OG-CD1 3.15Å |
| 44 | F | 91.9 | Very high | 90.6 | Very high | 108 Ų | 108 | 42.5 Ų | 42.5 | 47% | 0.474 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -58 | -46.3 | 175.7 | -178 | -100.2 | 0 | 0 | 0 | 111.6 | Y40 L41 A46 V47 L48 | Y40-F44 VanDerWaalsContact O-CB 3.24Å; Y40-F44 WeakPolarHBondContact O-CB 3.29Å; Y40-F44 PolarHBondContact O-N 3.17Å; L41-F44 PolarHBondContact O-N 3.11Å; F44-A46 VanDerWaalsContact C-N 3.34Å; F44-A46 PolarHBondContact O-N 2.89Å; F44-V47 VanDerWaalsContact O-CG2 3.31Å; F44-V47 WeakPolarHBondContact O-CG2 3.34Å; F44-V47 PolarHBondContact O-N 3.49Å; F44-L48 PolarHBondContact O-N 3.34Å |
| 45 | A | 94 | Very high | 91.4 | Very high | 1 Ų | 1 | 42.4 Ų | 42.4 | 1% | 0.008 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -57 | -48.1 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | L41 S43 V47 L48 L208 A211 M212 M215 | L41-A45 WeakPolarHBondContact O-CB 3.28Å; L41-A45 PolarHBondContact O-N 3.47Å; S43-A45 VanDerWaalsContact C-N 3.35Å; S43-A45 PolarHBondContact O-N 2.93Å; A45-V47 PolarHBondContact O-N 3.13Å; A45-L48 WeakPolarHBondContact O-CB 3.47Å; A45-L48 PolarHBondContact O-N 3.34Å; A45-L208 WeakPolarHBondContact O-CD1 3.35Å; A45-A211 HydrophobicContact CB-CB 3.66Å; A45-M212 HydrophobicContact CB-CG 4.5Å; A45-M212 HydrophobicContact CB-SD 3.91Å; A45-M215 HydrophobicContact CB-CG 4Å |
| 46 | A | 93.3 | Very high | 92.1 | Very high | 0 Ų | 0 | 36.9 Ų | 36.9 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -65.1 | -37.9 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | A42 S43 F44 L48 G49 P50 V154 Y157 I158 M212 | A42-A46 WeakPolarHBondContact O-CB 3.3Å; A42-A46 PolarHBondContact O-N 3.36Å; A42-A46 VanDerWaalsContact O-N 3.07Å; S43-A46 PolarHBondContact O-N 2.86Å; S43-A46 VanDerWaalsContact O-N 3.16Å; F44-A46 VanDerWaalsContact C-N 3.34Å; F44-A46 PolarHBondContact O-N 2.89Å; A46-L48 PolarHBondContact O-N 3.44Å; A46-G49 PolarHBondContact O-N 2.93Å; A46-G49 VanDerWaalsContact O-N 3.1Å; A46-P50 WeakPolarHBondContact O-CD 3.36Å; A46-V154 HydrophobicContact CB-CG1 4.21Å; A46-V154 WeakPolarHBondContact O-CG1 3.39Å; A46-Y157 HydrophobicContact CB-CD1 3.63Å; A46-Y157 HydrophobicContact CB-CE1 3.97Å; A46-I158 HydrophobicContact CB-CG1 4.43Å; A46-M212 HydrophobicContact CB-CE 4.13Å |
| 47 | V | 93.7 | Very high | 92.5 | Very high | 6 Ų | 6 | 35.8 Ų | 35.8 | 4% | 0.036 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -76 | -3.1 | -178.3 | -58.3 | 0 | 0 | 0 | 0 | 114.4 | S43 F44 A45 G49 P50 M51 I158 C173 V174 M177 | S43-V47 WeakPolarHBondContact O-CG1 3.5Å; S43-V47 WeakPolarHBondContact O-CG2 3.47Å; S43-V47 PolarHBondContact O-N 3.27Å; F44-V47 VanDerWaalsContact O-CG2 3.31Å; F44-V47 WeakPolarHBondContact O-CG2 3.34Å; F44-V47 PolarHBondContact O-N 3.49Å; A45-V47 PolarHBondContact O-N 3.13Å; V47-G49 PolarHBondContact O-N 3.4Å; V47-P50 VanDerWaalsContact C-CD 3.49Å; V47-P50 VanDerWaalsContact O-CD 3.3Å; V47-P50 WeakPolarHBondContact O-CD 3.24Å; V47-M51 PolarHBondContact O-N 3.46Å; V47-I158 HydrophobicContact CG1-CD1 3.61Å; V47-C173 HydrophobicContact CG1-CB 4.38Å; V47-V174 HydrophobicContact CG1-CG2 4.38Å; V47-M177 HydrophobicContact CB-CB 4.33Å; V47-M177 HydrophobicContact CB-CG 3.76Å; V47-M177 HydrophobicContact CG2-CE 4.02Å; V47-M177 HydrophobicContact CG2-CG 3.76Å; V47-M177 WeakPolarHBondContact O-CB 3.45Å |
| 48 | L | 94.8 | Very high | 92.8 | Very high | 10 Ų | 10 | 25.3 Ų | 25.3 | 5% | 0.052 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -66.3 | -24.1 | 163.7 | -67 | 171.3 | 0 | 0 | 0 | 112.2 | F44 A45 A46 M51 S52 L207 L208 A211 | F44-L48 PolarHBondContact O-N 3.34Å; A45-L48 WeakPolarHBondContact O-CB 3.47Å; A45-L48 PolarHBondContact O-N 3.34Å; A46-L48 PolarHBondContact O-N 3.44Å; L48-M51 HydrophobicContact CD2-SD 4.33Å; L48-S52 PolarHBondContact O-N 3.45Å; L48-S52 PolarHBondContact O-OG 2.7Å; L48-L207 HydrophobicContact CD1-CB 4.03Å; L48-L207 HydrophobicContact CD1-CD2 3.73Å; L48-L207 HydrophobicContact CD1-CG 3.59Å; L48-L207 HydrophobicContact CD2-CD2 4.01Å; L48-L208 HydrophobicContact CB-CB 3.9Å; L48-L208 HydrophobicContact CB-CD1 4.36Å; L48-A211 HydrophobicContact CD1-CB 4.46Å |
| 49 | G | 94.4 | Very high | 93 | Very high | 0 Ų | 0 | 20.6 Ų | 20.6 | 0% | 0 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -64.5 | -57.6 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | A46 V47 M51 S52 F53 | A46-G49 PolarHBondContact O-N 2.93Å; A46-G49 VanDerWaalsContact O-N 3.1Å; V47-G49 PolarHBondContact O-N 3.4Å; G49-M51 PolarHBondContact O-N 3.27Å; G49-S52 WeakPolarHBondContact O-CA 3.47Å; G49-S52 VanDerWaalsContact O-CB 3.28Å; G49-S52 WeakPolarHBondContact O-CB 3.5Å; G49-S52 PolarHBondContact O-N 2.86Å; G49-F53 PolarHBondContact O-N 2.71Å |
| 50 | P | 93.8 | Very high | 93.2 | Very high | 4 Ų | 4 | 20.6 Ų | 20.6 | 3% | 0.026 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -57.2 | -34.9 | 173.4 | -24.1 | 35.2 | 0 | 0 | 0 | 112.5 | A46 V47 F53 G54 V154 V174 M177 V178 | A46-P50 WeakPolarHBondContact O-CD 3.36Å; V47-P50 VanDerWaalsContact C-CD 3.49Å; V47-P50 VanDerWaalsContact O-CD 3.3Å; V47-P50 WeakPolarHBondContact O-CD 3.24Å; P50-F53 WeakPolarHBondContact O-CB 3.28Å; P50-F53 PolarHBondContact O-N 3.49Å; P50-G54 PolarHBondContact O-N 3.13Å; P50-V154 HydrophobicContact CG-CB 3.99Å; P50-V154 HydrophobicContact CG-CG1 3.59Å; P50-V154 HydrophobicContact CG-CG2 4.25Å; P50-V174 HydrophobicContact CB-CG1 4Å; P50-V174 WeakPolarHBondContact CB-O 3.48Å; P50-V174 HydrophobicContact CG-CB 4.47Å; P50-V174 HydrophobicContact CG-CG1 3.7Å; P50-M177 HydrophobicContact CB-CB 4.33Å; P50-V178 HydrophobicContact CB-CG2 3.62Å; P50-V178 WeakPolarHBondContact O-CA 3.49Å |
| 51 | M | 95.4 | Very high | 93.3 | Very high | 50 Ų | 50 | 15.9 Ų | 15.9 | 25% | 0.246 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -59.3 | -51.2 | 169.9 | -171.4 | 177.8 | -176.1 | 0 | 0 | 111.3 | V47 L48 G49 F53 G54 F55 M177 P204 | V47-M51 PolarHBondContact O-N 3.46Å; L48-M51 HydrophobicContact CD2-SD 4.33Å; G49-M51 PolarHBondContact O-N 3.27Å; M51-F53 VanDerWaalsContact C-N 3.26Å; M51-F53 PolarHBondContact O-N 3.29Å; M51-G54 WeakPolarHBondContact O-CA 3.45Å; M51-G54 PolarHBondContact O-N 2.97Å; M51-F55 HydrophobicContact CE-CE2 3.61Å; M51-F55 HydrophobicContact CE-CZ 4.09Å; M51-F55 HydrophobicContact CG-CD2 4.08Å; M51-F55 HydrophobicContact CG-CE2 3.82Å; M51-F55 VanDerWaalsContact O-CD2 3.28Å; M51-F55 WeakPolarHBondContact O-CD2 3.47Å; M51-F55 PolarHBondContact O-N 3.46Å; M51-F55 HydrophobicContact SD-CE2 4.49Å; M51-M177 WeakPolarHBondContact CA-O 3.43Å; M51-M177 HydrophobicContact CB-CB 4.25Å; M51-P204 HydrophobicContact CG-CB 4.48Å |
| 52 | S | 95.4 | Very high | 93.2 | Very high | 0 Ų | 0 | 12 Ų | 12 | 0% | 0 | 6% | 0.057 | C | C | . | . | H | α-helix | trans | -56.2 | -40.6 | 176.1 | -51.5 | 0 | 0 | 0 | 0 | 112.3 | L48 G49 F55 V56 P204 P205 | L48-S52 PolarHBondContact O-N 3.45Å; L48-S52 PolarHBondContact O-OG 2.7Å; G49-S52 WeakPolarHBondContact O-CA 3.47Å; G49-S52 VanDerWaalsContact O-CB 3.28Å; G49-S52 WeakPolarHBondContact O-CB 3.5Å; G49-S52 PolarHBondContact O-N 2.86Å; S52-F55 WeakPolarHBondContact O-CB 3.16Å; S52-F55 PolarHBondContact O-N 3Å; S52-V56 WeakPolarHBondContact O-CG2 3.46Å; S52-V56 PolarHBondContact O-N 3.09Å; S52-P204 WeakPolarHBondContact OG-CB 3.3Å; S52-P205 VanDerWaalsContact OG-CD 3.3Å; S52-P205 WeakPolarHBondContact OG-CD 3.13Å; S52-P205 VanDerWaalsContact OG-N 3.17Å |
| 53 | F | 93.4 | Very high | 93.2 | Very high | 23 Ų | 23 | 12 Ų | 12 | 10% | 0.101 | 6% | 0.057 | C | C | . | . | H | α-helix | trans | -62.6 | -43.9 | 174.1 | 165.3 | -132.5 | 0 | 0 | 0 | 112.1 | G49 P50 M51 F55 V56 L57 S147 V178 W425 | G49-F53 PolarHBondContact O-N 2.71Å; P50-F53 WeakPolarHBondContact O-CB 3.28Å; P50-F53 PolarHBondContact O-N 3.49Å; M51-F53 VanDerWaalsContact C-N 3.26Å; M51-F53 PolarHBondContact O-N 3.29Å; F53-F55 VanDerWaalsContact C-N 3.32Å; F53-F55 PolarHBondContact O-N 2.62Å; F53-V56 WeakPolarHBondContact O-CB 3.46Å; F53-V56 PolarHBondContact O-N 3.33Å; F53-V56 VanDerWaalsContact O-N 3.17Å; F53-L57 HydrophobicContact CD2-CD1 4.13Å; F53-L57 HydrophobicContact CD2-CD2 4.43Å; F53-L57 HydrophobicContact CD2-CG 3.94Å; F53-L57 HydrophobicContact CE1-CD1 4.11Å; F53-L57 HydrophobicContact CE2-CD1 3.53Å; F53-L57 HydrophobicContact CE2-CD2 3.75Å; F53-L57 HydrophobicContact CE2-CG 3.58Å; F53-L57 HydrophobicContact CZ-CD1 3.51Å; F53-L57 HydrophobicContact CZ-CD2 4.39Å; F53-L57 HydrophobicContact CZ-CG 4.12Å; F53-L57 WeakPolarHBondContact O-CG 3.23Å; F53-L57 PolarHBondContact O-N 2.95Å; F53-S147 VanDerWaalsContact CD2-CB 3.46Å; F53-V178 HydrophobicContact CD1-CG1 4.01Å; F53-V178 HydrophobicContact CD1-CG2 3.73Å; F53-V178 HydrophobicContact CE1-CG1 4.04Å; F53-V178 HydrophobicContact CE1-CG2 4.12Å; F53-W425 AromaticContact CE2-CH2 3.39Å; F53-W425 HydrophobicContact CE2-CH2 3.39Å; F53-W425 AromaticContact CE2-CZ2 3.62Å; F53-W425 HydrophobicContact CE2-CZ2 3.62Å; F53-W425 AromaticContact CZ-CH2 3.32Å; F53-W425 HydrophobicContact CZ-CH2 3.32Å; F53-W425 AromaticContact CZ-CZ2 3.39Å; F53-W425 HydrophobicContact CZ-CZ2 3.39Å |
| 54 | G | 93.4 | Very high | 93.2 | Very high | 0 Ų | 0 | 12.3 Ų | 12.3 | 0% | 0 | 6% | 0.059 | C | C | . | . | H | α-helix | trans | -57.3 | -42.7 | 172 | 0 | 0 | 0 | 0 | 0 | 112.9 | P50 M51 V56 L57 G58 V178 I182 | P50-G54 PolarHBondContact O-N 3.13Å; M51-G54 WeakPolarHBondContact O-CA 3.45Å; M51-G54 PolarHBondContact O-N 2.97Å; G54-V56 PolarHBondContact O-N 3.01Å; G54-L57 PolarHBondContact O-N 3.42Å; G54-G58 PolarHBondContact O-N 3.42Å; G54-V178 VanDerWaalsContact CA-O 3.29Å; G54-V178 WeakPolarHBondContact CA-O 3.41Å; G54-I182 VanDerWaalsContact O-CG1 3.31Å; G54-I182 WeakPolarHBondContact O-CG1 3.41Å |
| 55 | F | 94.8 | Very high | 93 | Very high | 19 Ų | 19 | 7.5 Ų | 7.5 | 8% | 0.083 | 4% | 0.038 | C | C | . | . | H | α-helix | trans | -60 | -45 | 174.6 | -85.6 | -114.6 | 0 | 0 | 0 | 111.4 | M51 S52 F53 L57 G58 Y59 G181 V185 C201 P204 | M51-F55 HydrophobicContact CE-CE2 3.61Å; M51-F55 HydrophobicContact CE-CZ 4.09Å; M51-F55 HydrophobicContact CG-CD2 4.08Å; M51-F55 HydrophobicContact CG-CE2 3.82Å; M51-F55 VanDerWaalsContact O-CD2 3.28Å; M51-F55 WeakPolarHBondContact O-CD2 3.47Å; M51-F55 PolarHBondContact O-N 3.46Å; M51-F55 HydrophobicContact SD-CE2 4.49Å; S52-F55 WeakPolarHBondContact O-CB 3.16Å; S52-F55 PolarHBondContact O-N 3Å; F53-F55 VanDerWaalsContact C-N 3.32Å; F53-F55 PolarHBondContact O-N 2.62Å; F55-L57 VanDerWaalsContact C-N 3.34Å; F55-L57 PolarHBondContact O-N 3.32Å; F55-G58 PolarHBondContact O-N 3.37Å; F55-Y59 WeakPolarHBondContact O-CB 3.46Å; F55-Y59 PolarHBondContact O-N 3.07Å; F55-G181 WeakPolarHBondContact CD2-O 3.24Å; F55-V185 VanDerWaalsContact CA-CG2 3.46Å; F55-V185 HydrophobicContact CB-CG2 3.65Å; F55-V185 HydrophobicContact CD1-CG2 3.14Å; F55-V185 HydrophobicContact CD2-CG2 4.24Å; F55-V185 HydrophobicContact CE1-CG2 3.8Å; F55-V185 HydrophobicContact CG-CG2 3.41Å; F55-V185 VanDerWaalsContact CG-CG2 3.41Å; F55-C201 HydrophobicContact CB-CB 4.25Å; F55-C201 HydrophobicContact CD1-CB 4Å; F55-P204 HydrophobicContact CD2-CG 4.25Å; F55-P204 HydrophobicContact CE1-CG 4.41Å; F55-P204 HydrophobicContact CE2-CG 4.05Å; F55-P204 HydrophobicContact CZ-CG 4.14Å |
| 56 | V | 94.9 | Very high | 92.8 | Very high | 0 Ų | 0 | 10.3 Ų | 10.3 | 0% | 0 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -62.3 | -38.7 | 178.2 | 168.3 | 0 | 0 | 0 | 0 | 112.8 | S52 F53 G54 V89 F120 F124 R140 T143 | S52-V56 WeakPolarHBondContact O-CG2 3.46Å; S52-V56 PolarHBondContact O-N 3.09Å; F53-V56 WeakPolarHBondContact O-CB 3.46Å; F53-V56 PolarHBondContact O-N 3.33Å; F53-V56 VanDerWaalsContact O-N 3.17Å; G54-V56 PolarHBondContact O-N 3.01Å; V56-V89 HydrophobicContact CG1-CG2 3.39Å; V56-F120 HydrophobicContact CG2-CD1 4.13Å; V56-F120 HydrophobicContact CG2-CE1 3.8Å; V56-F124 HydrophobicContact CG2-CE2 3.87Å; V56-F124 HydrophobicContact CG2-CZ 3.47Å; V56-F124 VanDerWaalsContact CG2-CZ 3.47Å; V56-R140 PolarHBondContact O-NH1 3.45Å; V56-R140 PolarHBondContact O-NH2 2.87Å; V56-T143 HydrophobicContact CG2-CG2 4.32Å |
| 57 | L | 91.8 | Very high | 92.6 | Very high | 14 Ų | 14 | 10.3 Ų | 10.3 | 7% | 0.073 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -68.6 | -47.1 | 176.6 | -69.3 | -178.2 | 0 | 0 | 0 | 111.6 | F53 G54 F55 Y59 V178 I182 F297 W425 | F53-L57 HydrophobicContact CD2-CD1 4.13Å; F53-L57 HydrophobicContact CD2-CD2 4.43Å; F53-L57 HydrophobicContact CD2-CG 3.94Å; F53-L57 HydrophobicContact CE1-CD1 4.11Å; F53-L57 HydrophobicContact CE2-CD1 3.53Å; F53-L57 HydrophobicContact CE2-CD2 3.75Å; F53-L57 HydrophobicContact CE2-CG 3.58Å; F53-L57 HydrophobicContact CZ-CD1 3.51Å; F53-L57 HydrophobicContact CZ-CD2 4.39Å; F53-L57 HydrophobicContact CZ-CG 4.12Å; F53-L57 WeakPolarHBondContact O-CG 3.23Å; F53-L57 PolarHBondContact O-N 2.95Å; G54-L57 PolarHBondContact O-N 3.42Å; F55-L57 VanDerWaalsContact C-N 3.34Å; F55-L57 PolarHBondContact O-N 3.32Å; L57-Y59 VanDerWaalsContact C-N 3.32Å; L57-Y59 PolarHBondContact O-N 3.01Å; L57-V178 HydrophobicContact CD1-CG1 4.39Å; L57-I182 HydrophobicContact CB-CG1 4.4Å; L57-F297 HydrophobicContact CB-CE1 3.93Å; L57-F297 HydrophobicContact CD2-CE1 3.59Å; L57-F297 HydrophobicContact CD2-CZ 3.54Å; L57-F297 HydrophobicContact CG-CE1 4.34Å; L57-F297 VanDerWaalsContact O-CD1 3.24Å; L57-F297 WeakPolarHBondContact O-CD1 3.48Å; L57-F297 VanDerWaalsContact O-CE1 3.28Å; L57-F297 WeakPolarHBondContact O-CE1 3.32Å; L57-W425 HydrophobicContact CD2-CH2 4.15Å; L57-W425 HydrophobicContact CD2-CZ3 4.27Å |
| 58 | G | 92.4 | Very high | 92.3 | Very high | 0 Ų | 0 | 12 Ų | 12 | 0% | 0 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -69.2 | -26.8 | -179.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | G54 F55 S60 S61 P62 Y186 | G54-G58 PolarHBondContact O-N 3.42Å; F55-G58 PolarHBondContact O-N 3.37Å; G58-S60 PolarHBondContact O-N 3.3Å; G58-S60 VanDerWaalsContact O-N 3.11Å; G58-S61 PolarHBondContact O-N 2.88Å; G58-S61 VanDerWaalsContact O-N 3.11Å; G58-P62 VanDerWaalsContact O-CD 3.25Å; G58-P62 WeakPolarHBondContact O-CD 3.28Å; G58-Y186 WeakPolarHBondContact O-CE1 3.49Å |
| 59 | Y | 94.6 | Very high | 92 | Very high | 0 Ų | 0 | 19.7 Ų | 19.7 | 0% | 0 | 9% | 0.092 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -55.5 | -34.7 | -173.1 | -175.9 | -106.5 | 0 | 0 | 0 | 114.2 | F55 L57 S61 P62 A63 F85 I127 W194 L197 A198 | F55-Y59 WeakPolarHBondContact O-CB 3.46Å; F55-Y59 PolarHBondContact O-N 3.07Å; L57-Y59 VanDerWaalsContact C-N 3.32Å; L57-Y59 PolarHBondContact O-N 3.01Å; Y59-S61 VanDerWaalsContact C-N 3.29Å; Y59-S61 PolarHBondContact O-N 2.87Å; Y59-P62 WeakPolarHBondContact O-CD 3.41Å; Y59-A63 HydrophobicContact CD1-CB 4.23Å; Y59-A63 HydrophobicContact CE1-CB 3.95Å; Y59-A63 HydrophobicContact CE2-CB 4.48Å; Y59-A63 WeakPolarHBondContact O-CB 3.43Å; Y59-A63 PolarHBondContact O-N 2.77Å; Y59-F85 HydrophobicContact CD1-CZ 4.17Å; Y59-F85 AromaticContact CE1-CZ 3.82Å; Y59-F85 HydrophobicContact CE1-CZ 3.82Å; Y59-I127 HydrophobicContact CE1-CD1 4.38Å; Y59-I127 HydrophobicContact CE1-CG2 4.14Å; Y59-I127 VanDerWaalsContact OH-CG2 3.31Å; Y59-I127 WeakPolarHBondContact OH-CG2 3.48Å; Y59-W194 PolarHBondContact OH-O 2.98Å; Y59-L197 HydrophobicContact CD2-CB 4.5Å; Y59-L197 HydrophobicContact CD2-CD2 3.74Å; Y59-L197 HydrophobicContact CD2-CG 3.81Å; Y59-L197 HydrophobicContact CE2-CB 3.97Å; Y59-L197 HydrophobicContact CE2-CD2 3.82Å; Y59-L197 HydrophobicContact CE2-CG 3.79Å; Y59-A198 HydrophobicContact CE2-CB 4.04Å |
| 60 | S | 92.2 | Very high | 91.7 | Very high | 0 Ų | 0 | 21.6 Ų | 21.6 | 0% | 0 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -61.3 | -36.3 | -179.1 | -50.6 | 0 | 0 | 0 | 0 | 112.9 | G58 A63 I64 R140 F297 | G58-S60 PolarHBondContact O-N 3.3Å; G58-S60 VanDerWaalsContact O-N 3.11Å; S60-A63 PolarHBondContact O-N 3.48Å; S60-I64 WeakPolarHBondContact O-CB 3.41Å; S60-I64 VanDerWaalsContact O-CG1 3.24Å; S60-I64 WeakPolarHBondContact O-CG1 2.94Å; S60-I64 PolarHBondContact O-N 3.19Å; S60-R140 PolarHBondContact OG-NH2 3.26Å; S60-F297 CarbonylContact C-O 3.46Å |
| 61 | S | 90.9 | Very high | 91.3 | Very high | 1 Ų | 1 | 27.2 Ų | 27.2 | 1% | 0.007 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -63.3 | -52.2 | -170.6 | -178.8 | 0 | 0 | 0 | 0 | 113 | G58 Y59 P65 F297 E300 | G58-S61 PolarHBondContact O-N 2.88Å; G58-S61 VanDerWaalsContact O-N 3.11Å; Y59-S61 VanDerWaalsContact C-N 3.29Å; Y59-S61 PolarHBondContact O-N 2.87Å; S61-P65 WeakPolarHBondContact O-CD 3.38Å; S61-P65 WeakPolarHBondContact O-CG 3.18Å; S61-F297 VanDerWaalsContact CA-O 3.26Å; S61-F297 WeakPolarHBondContact CA-O 3.2Å; S61-F297 PolarHBondContact N-O 2.87Å; S61-E300 WeakPolarHBondContact OG-CB 3.47Å; S61-E300 PolarHBondContact OG-N 2.95Å; S61-E300 VanDerWaalsContact OG-N 3.08Å |
| 62 | P | 90.4 | Very high | 90.8 | Very high | 11 Ų | 11 | 27 Ų | 27 | 7% | 0.071 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -77.3 | -31.3 | 174 | 30.1 | -35.5 | 0 | 0 | 0 | 113.2 | G58 Y59 E66 V185 L197 E300 | G58-P62 VanDerWaalsContact O-CD 3.25Å; G58-P62 WeakPolarHBondContact O-CD 3.28Å; Y59-P62 WeakPolarHBondContact O-CD 3.41Å; P62-E66 WeakPolarHBondContact O-CB 3.42Å; P62-V185 HydrophobicContact CG-CG1 4.27Å; P62-L197 HydrophobicContact CB-CD2 4.22Å; P62-L197 HydrophobicContact CG-CD2 3.44Å; P62-L197 VanDerWaalsContact CG-CD2 3.44Å; P62-E300 VanDerWaalsContact CA-OE2 3.3Å; P62-E300 WeakPolarHBondContact CA-OE2 3.46Å |
| 63 | A | 91.6 | Very high | 90.2 | Very high | 0 Ų | 0 | 32.2 Ų | 32.2 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -72.5 | -37 | -174.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | Y59 S60 L67 F85 W194 | Y59-A63 HydrophobicContact CD1-CB 4.23Å; Y59-A63 HydrophobicContact CE1-CB 3.95Å; Y59-A63 HydrophobicContact CE2-CB 4.48Å; Y59-A63 WeakPolarHBondContact O-CB 3.43Å; Y59-A63 PolarHBondContact O-N 2.77Å; S60-A63 PolarHBondContact O-N 3.48Å; A63-L67 HydrophobicContact CB-CD1 4.41Å; A63-L67 WeakPolarHBondContact O-CB 3.19Å; A63-L67 WeakPolarHBondContact O-CD1 3.48Å; A63-L67 WeakPolarHBondContact O-CG 3.21Å; A63-L67 PolarHBondContact O-N 3.29Å; A63-F85 HydrophobicContact CB-CE1 4.15Å; A63-F85 HydrophobicContact CB-CZ 4.4Å; A63-W194 HydrophobicContact CB-CB 4.33Å |
| 64 | I | 90 | Very high | 89.9 | Confident | 11 Ų | 11 | 38.5 Ų | 38.5 | 6% | 0.056 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -64.8 | -51.9 | -177.3 | -71.7 | 169.3 | 0 | 0 | 0 | 111.9 | S60 E66 L67 S68 F85 Y298 | S60-I64 WeakPolarHBondContact O-CB 3.41Å; S60-I64 VanDerWaalsContact O-CG1 3.24Å; S60-I64 WeakPolarHBondContact O-CG1 2.94Å; S60-I64 PolarHBondContact O-N 3.19Å; I64-E66 VanDerWaalsContact C-N 3.32Å; I64-E66 PolarHBondContact O-N 3.43Å; I64-L67 PolarHBondContact O-N 3.41Å; I64-S68 WeakPolarHBondContact O-CB 3.29Å; I64-S68 PolarHBondContact O-N 2.64Å; I64-S68 PolarHBondContact O-OG 2.83Å; I64-F85 HydrophobicContact CD1-CD1 4.14Å; I64-F85 HydrophobicContact CG1-CD1 3.63Å; I64-F85 HydrophobicContact CG1-CE1 4.08Å; I64-Y298 HydrophobicContact CD1-CD1 4.17Å; I64-Y298 HydrophobicContact CD1-CE1 3.8Å |
| 65 | P | 87.9 | Confident | 89.6 | Confident | 7 Ų | 7 | 38.7 Ų | 38.7 | 5% | 0.045 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -60 | -41.2 | 178.2 | -25 | 35.9 | 0 | 0 | 0 | 112.6 | S61 S68 R69 E300 | S61-P65 WeakPolarHBondContact O-CD 3.38Å; S61-P65 WeakPolarHBondContact O-CG 3.18Å; P65-S68 PolarHBondContact O-N 3.35Å; P65-R69 WeakPolarHBondContact O-CG 3.31Å; P65-R69 PolarHBondContact O-N 3.1Å; P65-E300 HydrophobicContact CG-CB 4.23Å; P65-E300 HydrophobicContact CG-CG 4.2Å |
| 66 | E | 89.3 | Confident | 89.4 | Confident | 61 Ų | 61 | 44.8 Ų | 44.8 | 29% | 0.285 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -65.5 | -49.9 | 179 | -165.5 | -171.1 | 161.6 | 0 | 0 | 111.7 | P62 I64 S68 R69 I70 D193 W194 | P62-E66 WeakPolarHBondContact O-CB 3.42Å; I64-E66 VanDerWaalsContact C-N 3.32Å; I64-E66 PolarHBondContact O-N 3.43Å; E66-S68 PolarHBondContact O-N 2.89Å; E66-R69 PolarHBondContact O-N 3.41Å; E66-I70 PolarHBondContact O-N 3.09Å; E66-D193 WeakPolarHBondContact OE1-CA 3.21Å; E66-D193 WeakPolarHBondContact OE1-CB 3.17Å; E66-W194 PolarHBondContact OE1-N 2.95Å; E66-W194 WeakPolarHBondContact OE2-CB 3.41Å; E66-W194 PolarHBondContact OE2-N 3.21Å |
| 67 | L | 89.5 | Confident | 89.1 | Confident | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -65.5 | -23.8 | 177.7 | -73.1 | 169.7 | 0 | 0 | 0 | 112.8 | A63 I64 R69 I70 R76 L77 F85 L136 W194 | A63-L67 HydrophobicContact CB-CD1 4.41Å; A63-L67 WeakPolarHBondContact O-CB 3.19Å; A63-L67 WeakPolarHBondContact O-CD1 3.48Å; A63-L67 WeakPolarHBondContact O-CG 3.21Å; A63-L67 PolarHBondContact O-N 3.29Å; I64-L67 PolarHBondContact O-N 3.41Å; L67-R69 VanDerWaalsContact C-N 3.32Å; L67-I70 WeakPolarHBondContact O-CG2 3.46Å; L67-R76 VanDerWaalsContact O-CA 3.31Å; L67-R76 WeakPolarHBondContact O-CA 3.24Å; L67-L77 HydrophobicContact CB-CD1 3.7Å; L67-L77 HydrophobicContact CB-CG 3.95Å; L67-L77 HydrophobicContact CD1-CD1 3.78Å; L67-L77 HydrophobicContact CG-CD1 4.39Å; L67-L77 PolarHBondContact O-N 2.94Å; L67-F85 HydrophobicContact CD1-CZ 4.27Å; L67-L136 HydrophobicContact CD1-CD1 4.03Å; L67-L136 HydrophobicContact CD2-CD1 4.45Å; L67-W194 HydrophobicContact CD2-CD2 3.88Å; L67-W194 HydrophobicContact CD2-CE3 4.43Å; L67-W194 HydrophobicContact CD2-CG 4.11Å; L67-W194 HydrophobicContact CD2-CZ2 4.18Å; L67-W194 HydrophobicContact CG-CD2 4.48Å; L67-W194 HydrophobicContact CG-CG 4.35Å |
| 68 | S | 87.8 | Confident | 89 | Confident | 41 Ų | 41 | 47 Ų | 47 | 29% | 0.287 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -74.5 | -24.7 | 174.8 | -58 | 0 | 0 | 0 | 0 | 112.5 | I64 P65 E66 | I64-S68 WeakPolarHBondContact O-CB 3.29Å; I64-S68 PolarHBondContact O-N 2.64Å; I64-S68 PolarHBondContact O-OG 2.83Å; P65-S68 PolarHBondContact O-N 3.35Å; E66-S68 PolarHBondContact O-N 2.89Å |
| 69 | R | 87.3 | Confident | 88.6 | Confident | 171 Ų | 171 | 52.9 Ų | 52.9 | 65% | 0.645 | 27% | 0.265 | S | S | * | . | H | α-helix | trans | -99.6 | -7 | -177.7 | -66 | 175.5 | -171.7 | 161.6 | 6.2 | 113.8 | P65 E66 L67 | P65-R69 WeakPolarHBondContact O-CG 3.31Å; P65-R69 PolarHBondContact O-N 3.1Å; E66-R69 PolarHBondContact O-N 3.41Å; L67-R69 VanDerWaalsContact C-N 3.32Å |
| 70 | I | 89.8 | Confident | 88.3 | Confident | 40 Ų | 40 | 57.1 Ų | 57.1 | 21% | 0.205 | 29% | 0.291 | C | S | . | . | trans | -62.9 | 145.4 | -176.3 | -155.2 | 170.2 | 0 | 0 | 0 | 112.2 | E66 L67 L75 R76 | E66-I70 PolarHBondContact O-N 3.09Å; L67-I70 WeakPolarHBondContact O-CG2 3.46Å; I70-L75 HydrophobicContact CD1-CB 4.46Å; I70-L75 HydrophobicContact CG2-CB 4.31Å; I70-R76 HydrophobicContact CG2-CB 3.83Å | ||
| 71 | S | 83.6 | Confident | 88.2 | Confident | 122 Ų | 122 | 60.2 Ų | 60.2 | 85% | 0.853 | 31% | 0.305 | S | S | * | . | S | Bend | trans | -78.1 | -23.4 | -178.6 | -48 | 0 | 0 | 0 | 0 | 114 | P73 | S71-P73 VanDerWaalsContact O-CD 3.27Å; S71-P73 WeakPolarHBondContact O-CD 3Å |
| 72 | D | 86.4 | Confident | 88.1 | Confident | 46 Ų | 46 | 60.3 Ų | 60.3 | 25% | 0.246 | 31% | 0.306 | C | S | . | . | trans | -76.2 | 113.3 | 178.2 | -170.5 | -25.3 | 0 | 0 | 0 | 110.1 | R74 L75 R76 | D72-R74 PolarHBondContact O-N 3.45Å; D72-R74 VanDerWaalsContact O-N 3.13Å; D72-R74 WeakPolarHBondContact OD1-CB 3.17Å; D72-R74 PolarHBondContact OD1-N 3.19Å; D72-R74 IonicContact OD1-NE 2.91Å; D72-R74 PolarHBondContact OD1-NE 2.99Å; D72-R74 IonicContact OD1-NH2 3.3Å; D72-R74 IonicContact OD2-CZ 3.1Å; D72-R74 IonicContact OD2-NE 2.7Å; D72-R74 IonicContact OD2-NH2 3.66Å; D72-R74 PolarHBondContact OD2-NH2 3.33Å; D72-L75 PolarHBondContact O-N 3.25Å; D72-L75 VanDerWaalsContact O-N 3.16Å; D72-R76 PolarHBondContact O-N 2.88Å | ||
| 73 | P | 82.8 | Confident | 88.1 | Confident | 109 Ų | 109 | 59.9 Ų | 59.9 | 71% | 0.708 | 30% | 0.304 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.6 | -18 | -177.2 | 26.1 | -34.2 | 0 | 0 | 0 | 113.7 | S71 L75 | S71-P73 VanDerWaalsContact O-CD 3.27Å; S71-P73 WeakPolarHBondContact O-CD 3Å; P73-L75 VanDerWaalsContact C-N 3.34Å |
| 74 | R | 86.1 | Confident | 88.2 | Confident | 156 Ų | 156 | 64.6 Ų | 64.6 | 59% | 0.589 | 32% | 0.321 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.6 | -18.9 | 179.1 | -61.1 | 174 | -65.3 | 174.9 | 4.7 | 113.5 | D72 N132 V133 | D72-R74 PolarHBondContact O-N 3.45Å; D72-R74 VanDerWaalsContact O-N 3.13Å; D72-R74 WeakPolarHBondContact OD1-CB 3.17Å; D72-R74 PolarHBondContact OD1-N 3.19Å; D72-R74 IonicContact OD1-NE 2.91Å; D72-R74 PolarHBondContact OD1-NE 2.99Å; D72-R74 IonicContact OD1-NH2 3.3Å; D72-R74 IonicContact OD2-CZ 3.1Å; D72-R74 IonicContact OD2-NE 2.7Å; D72-R74 IonicContact OD2-NH2 3.66Å; D72-R74 PolarHBondContact OD2-NH2 3.33Å; R74-N132 WeakPolarHBondContact O-CA 3.49Å; R74-V133 WeakPolarHBondContact O-CG2 3.43Å; R74-V133 PolarHBondContact O-N 2.81Å |
| 75 | L | 87.4 | Confident | 88.3 | Confident | 4 Ų | 4 | 64.1 Ų | 64.1 | 2% | 0.021 | 32% | 0.319 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -112.3 | -14.5 | -178.9 | -69.1 | 172.8 | 0 | 0 | 0 | 112.5 | I70 D72 P73 L77 A130 W194 | I70-L75 HydrophobicContact CD1-CB 4.46Å; I70-L75 HydrophobicContact CG2-CB 4.31Å; D72-L75 PolarHBondContact O-N 3.25Å; D72-L75 VanDerWaalsContact O-N 3.16Å; P73-L75 VanDerWaalsContact C-N 3.34Å; L75-L77 PolarHBondContact O-N 3.38Å; L75-A130 HydrophobicContact CD2-CB 4.31Å; L75-W194 HydrophobicContact CD1-CZ2 4.22Å |
| 76 | R | 90.4 | Very high | 88.4 | Confident | 147 Ų | 147 | 63.8 Ų | 63.8 | 56% | 0.555 | 32% | 0.317 | S | S | * | . | P | Polyproline II helix | trans | -66 | 121.4 | 179.4 | -178.5 | 175.3 | 160.2 | 163.8 | -4 | 110.9 | L67 I70 D72 | L67-R76 VanDerWaalsContact O-CA 3.31Å; L67-R76 WeakPolarHBondContact O-CA 3.24Å; I70-R76 HydrophobicContact CG2-CB 3.83Å; D72-R76 PolarHBondContact O-N 2.88Å |
| 77 | L | 89 | Confident | 88.5 | Confident | 5 Ų | 5 | 60.9 Ų | 60.9 | 3% | 0.026 | 30% | 0.303 | C | S | . | . | P | Polyproline II helix | trans | -85.3 | 126.5 | 177.1 | -62.4 | 176.3 | 0 | 0 | 0 | 110.3 | L67 L75 E81 F85 V133 L136 | L67-L77 HydrophobicContact CB-CD1 3.7Å; L67-L77 HydrophobicContact CB-CG 3.95Å; L67-L77 HydrophobicContact CD1-CD1 3.78Å; L67-L77 HydrophobicContact CG-CD1 4.39Å; L67-L77 PolarHBondContact O-N 2.94Å; L75-L77 PolarHBondContact O-N 3.38Å; L77-E81 HydrophobicContact CB-CB 4.35Å; L77-E81 HydrophobicContact CD2-CB 3.89Å; L77-F85 HydrophobicContact CD1-CB 4.13Å; L77-F85 HydrophobicContact CD1-CD1 4.34Å; L77-F85 HydrophobicContact CD1-CG 4.12Å; L77-V133 HydrophobicContact CD2-CG1 3.77Å; L77-V133 HydrophobicContact CD2-CG2 4.19Å; L77-L136 HydrophobicContact CD2-CD1 4.36Å |
| 78 | S | 88.8 | Confident | 88.8 | Confident | 54 Ų | 54 | 62 Ų | 62 | 38% | 0.378 | 31% | 0.309 | S | S | . | . | P | Polyproline II helix | trans | -71 | 167.2 | 159.8 | 61.6 | 0 | 0 | 0 | 0 | 111.3 | V80 E81 G82 | S78-V80 PolarHBondContact O-N 3.11Å; S78-E81 WeakPolarHBondContact CB-OE2 3.27Å; S78-E81 PolarHBondContact N-OE2 3.08Å; S78-E81 PolarHBondContact O-N 3.13Å; S78-E81 VanDerWaalsContact O-N 3.08Å; S78-E81 WeakPolarHBondContact OG-CB 3.36Å; S78-E81 VanDerWaalsContact OG-CD 3.31Å; S78-E81 VanDerWaalsContact OG-CG 3.23Å; S78-E81 WeakPolarHBondContact OG-CG 3.34Å; S78-E81 PolarHBondContact OG-N 3.08Å; S78-E81 PolarHBondContact OG-OE2 2.9Å; S78-G82 PolarHBondContact O-N 3.4Å |
| 79 | E | 84.8 | Confident | 89.1 | Confident | 125 Ų | 125 | 60.2 Ų | 60.2 | 58% | 0.584 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -54.9 | -41.7 | 176.1 | -67 | -173.5 | -171.6 | 0 | 0 | 112.2 | S83 N440 | E79-S83 PolarHBondContact O-N 2.7Å; E79-N440 PolarHBondContact OE2-ND2 3.09Å |
| 80 | V | 88.8 | Confident | 89.3 | Confident | 89 Ų | 89 | 52.1 Ų | 52.1 | 54% | 0.539 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -65.1 | -45.8 | 177 | 179.5 | 0 | 0 | 0 | 0 | 110.1 | S78 S83 W84 | S78-V80 PolarHBondContact O-N 3.11Å; V80-S83 PolarHBondContact O-N 3.33Å; V80-S83 PolarHBondContact O-OG 3.17Å; V80-W84 VanDerWaalsContact O-CD1 3.28Å; V80-W84 PolarHBondContact O-N 3.12Å; V80-W84 VanDerWaalsContact O-N 3.11Å |
| 81 | E | 90.4 | Very high | 89.5 | Confident | 64 Ų | 64 | 53.3 Ų | 53.3 | 30% | 0.299 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -68.4 | -35.8 | -179.2 | -72 | 167 | 136.6 | 0 | 0 | 113 | L77 S78 W84 F85 V133 Y137 | L77-E81 HydrophobicContact CB-CB 4.35Å; L77-E81 HydrophobicContact CD2-CB 3.89Å; S78-E81 WeakPolarHBondContact CB-OE2 3.27Å; S78-E81 PolarHBondContact N-OE2 3.08Å; S78-E81 PolarHBondContact O-N 3.13Å; S78-E81 VanDerWaalsContact O-N 3.08Å; S78-E81 WeakPolarHBondContact OG-CB 3.36Å; S78-E81 VanDerWaalsContact OG-CD 3.31Å; S78-E81 VanDerWaalsContact OG-CG 3.23Å; S78-E81 WeakPolarHBondContact OG-CG 3.34Å; S78-E81 PolarHBondContact OG-N 3.08Å; S78-E81 PolarHBondContact OG-OE2 2.9Å; E81-W84 PolarHBondContact O-N 3.2Å; E81-F85 WeakPolarHBondContact O-CB 3.37Å; E81-F85 PolarHBondContact O-N 3.28Å; E81-V133 HydrophobicContact CG-CG1 4.49Å; E81-Y137 WeakPolarHBondContact CA-OH 3.22Å; E81-Y137 WeakPolarHBondContact CB-OH 3.22Å; E81-Y137 WeakPolarHBondContact CG-OH 3.48Å; E81-Y137 PolarHBondContact O-OH 3.17Å |
| 82 | G | 88.8 | Confident | 90 | Very high | 3 Ų | 3 | 47.6 Ų | 47.6 | 3% | 0.031 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -63.1 | -41.2 | 171.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | S78 W84 F85 G86 | S78-G82 PolarHBondContact O-N 3.4Å; G82-W84 VanDerWaalsContact C-N 3.32Å; G82-W84 PolarHBondContact O-N 3.18Å; G82-F85 WeakPolarHBondContact O-CB 3.43Å; G82-F85 PolarHBondContact O-N 2.76Å; G82-G86 PolarHBondContact O-N 2.91Å |
| 83 | S | 90.4 | Very high | 90.3 | Very high | 3 Ų | 3 | 45.5 Ų | 45.5 | 2% | 0.021 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -63.1 | -37.8 | 175.4 | 79.9 | 0 | 0 | 0 | 0 | 112.9 | E79 V80 S87 Y298 K433 | E79-S83 PolarHBondContact O-N 2.7Å; V80-S83 PolarHBondContact O-N 3.33Å; V80-S83 PolarHBondContact O-OG 3.17Å; S83-S87 VanDerWaalsContact O-CB 3.25Å; S83-S87 WeakPolarHBondContact O-CB 3.33Å; S83-S87 PolarHBondContact O-N 2.85Å; S83-S87 PolarHBondContact O-OG 2.88Å; S83-Y298 WeakPolarHBondContact CA-OH 3.24Å; S83-K433 WeakPolarHBondContact OG-CE 3.23Å; S83-K433 PolarHBondContact OG-NZ 2.97Å |
| 84 | W | 93.3 | Very high | 90.7 | Very high | 99 Ų | 99 | 40.6 Ų | 40.6 | 38% | 0.375 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -68.8 | -43.1 | 172.8 | -83.1 | 109.1 | 0 | 0 | 0 | 111.9 | V80 E81 G82 G86 S87 I88 Y137 F429 K433 | V80-W84 VanDerWaalsContact O-CD1 3.28Å; V80-W84 PolarHBondContact O-N 3.12Å; V80-W84 VanDerWaalsContact O-N 3.11Å; E81-W84 PolarHBondContact O-N 3.2Å; G82-W84 VanDerWaalsContact C-N 3.32Å; G82-W84 PolarHBondContact O-N 3.18Å; W84-G86 VanDerWaalsContact C-N 3.34Å; W84-G86 PolarHBondContact O-N 3.24Å; W84-S87 PolarHBondContact O-N 3.23Å; W84-S87 PolarHBondContact O-OG 2.91Å; W84-I88 WeakPolarHBondContact O-CB 3.48Å; W84-I88 WeakPolarHBondContact O-CG2 3.37Å; W84-I88 PolarHBondContact O-N 3.16Å; W84-Y137 HydrophobicContact CB-CE1 3.97Å; W84-Y137 HydrophobicContact CB-CE2 4.47Å; W84-F429 HydrophobicContact CE3-CE2 4.45Å; W84-F429 HydrophobicContact CH2-CZ 4.18Å; W84-F429 HydrophobicContact CZ3-CE2 4.03Å; W84-F429 AromaticContact CZ3-CZ 3.86Å; W84-F429 HydrophobicContact CZ3-CZ 3.86Å; W84-K433 HydrophobicContact CD2-CD 4.17Å; W84-K433 HydrophobicContact CG-CD 4.43Å |
| 85 | F | 92.4 | Very high | 91 | Very high | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -58.9 | -44.4 | 178.4 | 179 | -100.3 | 0 | 0 | 0 | 112.5 | Y59 A63 I64 L67 L77 E81 G82 L136 Y137 R140 | Y59-F85 HydrophobicContact CD1-CZ 4.17Å; Y59-F85 AromaticContact CE1-CZ 3.82Å; Y59-F85 HydrophobicContact CE1-CZ 3.82Å; A63-F85 HydrophobicContact CB-CE1 4.15Å; A63-F85 HydrophobicContact CB-CZ 4.4Å; I64-F85 HydrophobicContact CD1-CD1 4.14Å; I64-F85 HydrophobicContact CG1-CD1 3.63Å; I64-F85 HydrophobicContact CG1-CE1 4.08Å; L67-F85 HydrophobicContact CD1-CZ 4.27Å; L77-F85 HydrophobicContact CD1-CB 4.13Å; L77-F85 HydrophobicContact CD1-CD1 4.34Å; L77-F85 HydrophobicContact CD1-CG 4.12Å; E81-F85 WeakPolarHBondContact O-CB 3.37Å; E81-F85 PolarHBondContact O-N 3.28Å; G82-F85 WeakPolarHBondContact O-CB 3.43Å; G82-F85 PolarHBondContact O-N 2.76Å; F85-L136 HydrophobicContact CD2-CB 3.92Å; F85-L136 HydrophobicContact CE2-CB 3.84Å; F85-L136 HydrophobicContact CE2-CD2 4.38Å; F85-L136 HydrophobicContact CE2-CG 4.5Å; F85-Y137 HydrophobicContact CB-CD1 4.41Å; F85-Y137 HydrophobicContact CB-CE1 3.91Å; F85-Y137 HydrophobicContact CD2-CD1 4.47Å; F85-R140 HydrophobicContact CD2-CG 3.67Å; F85-R140 HydrophobicContact CE2-CG 3.47Å; F85-R140 VanDerWaalsContact CE2-CG 3.47Å; F85-R140 HydrophobicContact CG-CG 4.42Å; F85-R140 HydrophobicContact CZ-CG 4.11Å; F85-R140 PolarHBondContact O-NE 3.37Å |
| 86 | G | 89.1 | Confident | 91.2 | Very high | 0 Ų | 0 | 36.8 Ų | 36.8 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -67.1 | -47.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | G82 W84 V89 F297 | G82-G86 PolarHBondContact O-N 2.91Å; W84-G86 VanDerWaalsContact C-N 3.34Å; W84-G86 PolarHBondContact O-N 3.24Å; G86-V89 VanDerWaalsContact O-CG1 3.24Å; G86-V89 WeakPolarHBondContact O-CG1 3.35Å; G86-F297 VanDerWaalsContact O-CD2 3.27Å; G86-F297 WeakPolarHBondContact O-CD2 3.3Å; G86-F297 WeakPolarHBondContact O-CE2 3.47Å |
| 87 | S | 92.5 | Very high | 91 | Very high | 0 Ų | 0 | 29.8 Ų | 29.8 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -79.9 | -34.5 | -171.5 | 60.7 | 0 | 0 | 0 | 0 | 114.7 | S83 W84 V89 T90 | S83-S87 VanDerWaalsContact O-CB 3.25Å; S83-S87 WeakPolarHBondContact O-CB 3.33Å; S83-S87 PolarHBondContact O-N 2.85Å; S83-S87 PolarHBondContact O-OG 2.88Å; W84-S87 PolarHBondContact O-N 3.23Å; W84-S87 PolarHBondContact O-OG 2.91Å; S87-V89 PolarHBondContact O-N 3.28Å; S87-T90 WeakPolarHBondContact O-CB 3.08Å; S87-T90 PolarHBondContact O-N 3.12Å; S87-T90 PolarHBondContact O-OG1 3.38Å |
| 88 | I | 94.4 | Very high | 90.9 | Very high | 25 Ų | 25 | 33.3 Ų | 33.3 | 13% | 0.128 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -62.8 | -23.8 | -171.1 | -156.1 | 173.4 | 0 | 0 | 0 | 113.7 | W84 T90 I91 G92 R140 V141 | W84-I88 WeakPolarHBondContact O-CB 3.48Å; W84-I88 WeakPolarHBondContact O-CG2 3.37Å; W84-I88 PolarHBondContact O-N 3.16Å; I88-T90 PolarHBondContact O-N 3.43Å; I88-I91 PolarHBondContact O-N 3.29Å; I88-G92 PolarHBondContact O-N 3.45Å; I88-G92 VanDerWaalsContact O-N 3.08Å; I88-R140 HydrophobicContact CG2-CB 3.54Å; I88-R140 HydrophobicContact CG2-CG 4.44Å; I88-V141 HydrophobicContact CD1-CG2 3.52Å; I88-V141 HydrophobicContact CG1-CG2 3.58Å; I88-V141 HydrophobicContact CG2-CG2 4.43Å |
| 89 | V | 94.4 | Very high | 90.9 | Very high | 3 Ų | 3 | 33.9 Ų | 33.9 | 2% | 0.018 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -58.5 | -34.7 | 173.2 | 75 | 0 | 0 | 0 | 0 | 112.2 | V56 G86 S87 G92 A93 G144 F297 | V56-V89 HydrophobicContact CG1-CG2 3.39Å; G86-V89 VanDerWaalsContact O-CG1 3.24Å; G86-V89 WeakPolarHBondContact O-CG1 3.35Å; S87-V89 PolarHBondContact O-N 3.28Å; V89-G92 PolarHBondContact O-N 3.31Å; V89-A93 PolarHBondContact O-N 3.41Å; V89-G144 VanDerWaalsContact O-CA 3.25Å; V89-G144 WeakPolarHBondContact O-CA 3.33Å; V89-F297 HydrophobicContact CG1-CE2 3.64Å; V89-F297 HydrophobicContact CG1-CZ 3.86Å |
| 90 | T | 92.9 | Very high | 90.9 | Very high | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -74.7 | -33.5 | -178.7 | 63.8 | 0 | 0 | 0 | 0 | 111.2 | S87 I88 A93 A94 F297 W425 A428 F429 | S87-T90 WeakPolarHBondContact O-CB 3.08Å; S87-T90 PolarHBondContact O-N 3.12Å; S87-T90 PolarHBondContact O-OG1 3.38Å; I88-T90 PolarHBondContact O-N 3.43Å; T90-A93 PolarHBondContact O-N 3.39Å; T90-A94 PolarHBondContact O-N 3.41Å; T90-F297 HydrophobicContact CG2-CE2 4.08Å; T90-F297 HydrophobicContact CG2-CZ 4.31Å; T90-W425 HydrophobicContact CG2-CE3 4.03Å; T90-W425 HydrophobicContact CG2-CZ3 4.16Å; T90-A428 HydrophobicContact CG2-CB 3.91Å; T90-F429 WeakPolarHBondContact OG1-CA 3.32Å; T90-F429 WeakPolarHBondContact OG1-CB 3.22Å; T90-F429 PolarHBondContact OG1-N 3.43Å |
| 91 | I | 93.4 | Very high | 90.5 | Very high | 65 Ų | 65 | 24.5 Ų | 24.5 | 33% | 0.333 | 13% | 0.129 | S | C | . | . | H | α-helix | trans | -62.1 | -46.6 | 168.7 | -64.6 | 174.5 | 0 | 0 | 0 | 109.8 | I88 A93 A94 V95 F429 | I88-I91 PolarHBondContact O-N 3.29Å; I91-A93 VanDerWaalsContact C-N 3.28Å; I91-A93 PolarHBondContact O-N 3.43Å; I91-A94 WeakPolarHBondContact O-CB 3.35Å; I91-A94 PolarHBondContact O-N 3.45Å; I91-V95 WeakPolarHBondContact O-CG2 3.09Å; I91-V95 PolarHBondContact O-N 3.31Å; I91-F429 HydrophobicContact CD1-CD1 4.27Å; I91-F429 HydrophobicContact CD1-CD2 3.49Å; I91-F429 VanDerWaalsContact CD1-CD2 3.49Å; I91-F429 HydrophobicContact CD1-CE1 4.11Å; I91-F429 HydrophobicContact CD1-CE2 3.31Å; I91-F429 HydrophobicContact CD1-CG 3.99Å; I91-F429 HydrophobicContact CD1-CZ 3.64Å; I91-F429 HydrophobicContact CG1-CB 4.21Å; I91-F429 HydrophobicContact CG1-CD1 4.29Å; I91-F429 HydrophobicContact CG1-CD2 3.44Å; I91-F429 VanDerWaalsContact CG1-CD2 3.44Å; I91-F429 HydrophobicContact CG1-CE2 3.86Å; I91-F429 HydrophobicContact CG1-CG 3.69Å; I91-F429 HydrophobicContact CG1-CZ 4.43Å |
| 92 | G | 93.8 | Very high | 90.2 | Very high | 2 Ų | 2 | 28.5 Ų | 28.5 | 2% | 0.021 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -52.9 | -48.8 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111 | I88 V89 A94 V95 G96 G144 L145 | I88-G92 PolarHBondContact O-N 3.45Å; I88-G92 VanDerWaalsContact O-N 3.08Å; V89-G92 PolarHBondContact O-N 3.31Å; G92-A94 PolarHBondContact O-N 3.17Å; G92-V95 PolarHBondContact O-N 3.16Å; G92-G96 PolarHBondContact O-N 3.46Å; G92-G144 CarbonylContact C-O 3.6Å; G92-L145 VanDerWaalsContact C-N 3.33Å; G92-L145 VanDerWaalsContact O-CA 3.22Å; G92-L145 WeakPolarHBondContact O-CA 3.41Å; G92-L145 PolarHBondContact O-N 2.89Å |
| 93 | A | 92.6 | Very high | 90.1 | Very high | 2 Ų | 2 | 29.5 Ų | 29.5 | 2% | 0.017 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -63.7 | -37.2 | 179.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | V89 T90 I91 G96 G97 G144 G148 W425 | V89-A93 PolarHBondContact O-N 3.41Å; T90-A93 PolarHBondContact O-N 3.39Å; I91-A93 VanDerWaalsContact C-N 3.28Å; I91-A93 PolarHBondContact O-N 3.43Å; A93-G96 PolarHBondContact O-N 2.95Å; A93-G97 PolarHBondContact O-N 3.12Å; A93-G144 WeakPolarHBondContact CA-O 3.01Å; A93-G144 VanDerWaalsContact N-C 3.3Å; A93-G144 PolarHBondContact N-O 3.47Å; A93-G148 VanDerWaalsContact O-CA 3.26Å; A93-G148 WeakPolarHBondContact O-CA 3.37Å; A93-W425 HydrophobicContact CB-CD2 3.55Å; A93-W425 HydrophobicContact CB-CE3 3.88Å; A93-W425 HydrophobicContact CB-CG 3.83Å; A93-W425 HydrophobicContact CB-CZ2 4.25Å; A93-W425 HydrophobicContact CB-CZ3 4.38Å |
| 94 | A | 91.5 | Very high | 89.9 | Confident | 7 Ų | 7 | 29.6 Ų | 29.6 | 6% | 0.058 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -60.2 | -51.1 | 174 | 0 | 0 | 0 | 0 | 0 | 111.6 | T90 I91 G92 G96 G97 L98 L422 W425 | T90-A94 PolarHBondContact O-N 3.41Å; I91-A94 WeakPolarHBondContact O-CB 3.35Å; I91-A94 PolarHBondContact O-N 3.45Å; G92-A94 PolarHBondContact O-N 3.17Å; A94-G96 VanDerWaalsContact C-N 3.3Å; A94-G96 PolarHBondContact O-N 3.01Å; A94-G97 PolarHBondContact O-N 2.64Å; A94-L98 PolarHBondContact O-N 3.17Å; A94-L422 HydrophobicContact CB-CD1 3.88Å; A94-W425 HydrophobicContact CB-CB 3.68Å |
| 95 | V | 92.5 | Very high | 89.3 | Confident | 79 Ų | 79 | 30.7 Ų | 30.7 | 48% | 0.479 | 16% | 0.155 | S | C | . | . | H | α-helix | trans | -63.9 | -39.5 | 177.3 | 178.7 | 0 | 0 | 0 | 0 | 110.7 | I91 G92 G97 L98 L99 L145 | I91-V95 WeakPolarHBondContact O-CG2 3.09Å; I91-V95 PolarHBondContact O-N 3.31Å; G92-V95 PolarHBondContact O-N 3.16Å; V95-G97 VanDerWaalsContact C-N 3.34Å; V95-G97 PolarHBondContact O-N 2.88Å; V95-L98 PolarHBondContact O-N 3.32Å; V95-L99 WeakPolarHBondContact O-CB 3.34Å; V95-L99 PolarHBondContact O-N 3.28Å; V95-L145 HydrophobicContact CB-CD1 4.14Å; V95-L145 HydrophobicContact CG1-CD1 3.81Å |
| 96 | G | 90.9 | Very high | 88.8 | Confident | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -62.5 | -39.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | G92 A93 A94 L99 G100 L145 I149 | G92-G96 PolarHBondContact O-N 3.46Å; A93-G96 PolarHBondContact O-N 2.95Å; A94-G96 VanDerWaalsContact C-N 3.3Å; A94-G96 PolarHBondContact O-N 3.01Å; G96-L99 PolarHBondContact O-N 3.09Å; G96-G100 WeakPolarHBondContact O-CA 3.48Å; G96-G100 PolarHBondContact O-N 2.98Å; G96-L145 WeakPolarHBondContact CA-O 3.46Å; G96-I149 WeakPolarHBondContact O-CG1 3.36Å; G96-I149 PolarHBondContact O-N 3.36Å |
| 97 | G | 86.3 | Confident | 88.8 | Confident | 0 Ų | 0 | 41.8 Ų | 41.8 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -60.9 | -44.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | A93 A94 V95 G100 G101 | A93-G97 PolarHBondContact O-N 3.12Å; A94-G97 PolarHBondContact O-N 2.64Å; V95-G97 VanDerWaalsContact C-N 3.34Å; V95-G97 PolarHBondContact O-N 2.88Å; G97-G100 PolarHBondContact O-N 3.17Å; G97-G101 PolarHBondContact O-N 3.13Å; G97-G101 VanDerWaalsContact O-N 3.08Å |
| 98 | L | 86.8 | Confident | 88.6 | Confident | 79 Ų | 79 | 41.8 Ų | 41.8 | 41% | 0.414 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -63.6 | -47.9 | 176.8 | -61.5 | -179.9 | 0 | 0 | 0 | 111.5 | A94 V95 G101 W102 A418 L422 | A94-L98 PolarHBondContact O-N 3.17Å; V95-L98 PolarHBondContact O-N 3.32Å; L98-G101 PolarHBondContact O-N 2.93Å; L98-W102 PolarHBondContact O-N 3.32Å; L98-A418 HydrophobicContact CD2-CB 3.82Å; L98-L422 HydrophobicContact CD1-CD1 4.49Å; L98-L422 HydrophobicContact CD1-CD2 4.49Å; L98-L422 HydrophobicContact CD2-CB 4.44Å |
| 99 | L | 89.3 | Confident | 88.4 | Confident | 67 Ų | 67 | 42.2 Ų | 42.2 | 35% | 0.351 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -63.6 | -42.3 | 178.7 | -175.6 | 64.1 | 0 | 0 | 0 | 111.3 | V95 G96 G101 W102 M103 L145 I149 | V95-L99 WeakPolarHBondContact O-CB 3.34Å; V95-L99 PolarHBondContact O-N 3.28Å; G96-L99 PolarHBondContact O-N 3.09Å; L99-G101 VanDerWaalsContact C-N 3.34Å; L99-G101 PolarHBondContact O-N 3.4Å; L99-W102 HydrophobicContact CD1-CE3 4.25Å; L99-W102 PolarHBondContact O-N 3.01Å; L99-M103 HydrophobicContact CD1-CG 4.4Å; L99-M103 HydrophobicContact CD1-SD 4.46Å; L99-M103 HydrophobicContact CD2-SD 4.22Å; L99-M103 HydrophobicContact CG-CG 4.25Å; L99-M103 HydrophobicContact CG-SD 3.85Å; L99-M103 VanDerWaalsContact O-CG 3.28Å; L99-M103 WeakPolarHBondContact O-CG 3.1Å; L99-M103 PolarHBondContact O-N 3.25Å; L99-L145 HydrophobicContact CD2-CD1 4.36Å; L99-I149 HydrophobicContact CD2-CD1 4.28Å |
| 100 | G | 85.1 | Confident | 88.3 | Confident | 0 Ų | 0 | 44.1 Ų | 44.1 | 0% | 0 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -59.3 | -43.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | G96 G97 W102 M103 V104 | G96-G100 WeakPolarHBondContact O-CA 3.48Å; G96-G100 PolarHBondContact O-N 2.98Å; G97-G100 PolarHBondContact O-N 3.17Å; G100-W102 VanDerWaalsContact C-N 3.33Å; G100-W102 PolarHBondContact O-N 3Å; G100-M103 PolarHBondContact O-N 3.45Å; G100-V104 WeakPolarHBondContact O-CB 3.44Å; G100-V104 VanDerWaalsContact O-CG2 3.24Å; G100-V104 WeakPolarHBondContact O-CG2 3.41Å; G100-V104 PolarHBondContact O-N 3.32Å |
| 101 | G | 80.8 | Confident | 88.3 | Confident | 16 Ų | 16 | 48.2 Ų | 48.2 | 17% | 0.165 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -58.1 | -43.6 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | G97 L98 L99 | G97-G101 PolarHBondContact O-N 3.13Å; G97-G101 VanDerWaalsContact O-N 3.08Å; L98-G101 PolarHBondContact O-N 2.93Å; L99-G101 VanDerWaalsContact C-N 3.34Å; L99-G101 PolarHBondContact O-N 3.4Å |
| 102 | W | 83.8 | Confident | 88.3 | Confident | 149 Ų | 149 | 45.1 Ų | 45.1 | 56% | 0.564 | 22% | 0.215 | S | C | * | . | H | α-helix | trans | -67.4 | -43.6 | 176 | 177.9 | 87.9 | 0 | 0 | 0 | 112.6 | L98 L99 G100 Q105 R106 | L98-W102 PolarHBondContact O-N 3.32Å; L99-W102 HydrophobicContact CD1-CE3 4.25Å; L99-W102 PolarHBondContact O-N 3.01Å; G100-W102 VanDerWaalsContact C-N 3.33Å; G100-W102 PolarHBondContact O-N 3Å; W102-Q105 PolarHBondContact O-N 2.78Å; W102-R106 HydrophobicContact CD2-CG 4.33Å; W102-R106 HydrophobicContact CZ2-CG 4.11Å; W102-R106 PolarHBondContact O-N 2.81Å |
| 103 | M | 86.9 | Confident | 88.2 | Confident | 24 Ų | 24 | 45 Ų | 45 | 12% | 0.118 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -63.3 | -45.1 | -179.7 | -70.2 | 177.9 | 73.9 | 0 | 0 | 111.9 | L99 G100 Q105 R106 I107 T112 I149 | L99-M103 HydrophobicContact CD1-CG 4.4Å; L99-M103 HydrophobicContact CD1-SD 4.46Å; L99-M103 HydrophobicContact CD2-SD 4.22Å; L99-M103 HydrophobicContact CG-CG 4.25Å; L99-M103 HydrophobicContact CG-SD 3.85Å; L99-M103 VanDerWaalsContact O-CG 3.28Å; L99-M103 WeakPolarHBondContact O-CG 3.1Å; L99-M103 PolarHBondContact O-N 3.25Å; G100-M103 PolarHBondContact O-N 3.45Å; M103-Q105 PolarHBondContact O-N 3.35Å; M103-R106 PolarHBondContact O-N 3.42Å; M103-I107 HydrophobicContact CB-CD1 4.39Å; M103-I107 HydrophobicContact CB-CG1 4.32Å; M103-I107 HydrophobicContact CE-CD1 3.75Å; M103-I107 VanDerWaalsContact O-CG1 3.24Å; M103-I107 WeakPolarHBondContact O-CG1 3.41Å; M103-I107 PolarHBondContact O-N 3.44Å; M103-T112 VanDerWaalsContact C-OG1 3.31Å; M103-T112 HydrophobicContact CB-CG2 3.62Å; M103-T112 WeakPolarHBondContact CB-OG1 3.33Å; M103-T112 HydrophobicContact CE-CG2 4.22Å; M103-T112 PolarHBondContact O-OG1 2.72Å; M103-T112 HydrophobicContact SD-CG2 4.31Å; M103-I149 HydrophobicContact SD-CD1 4.32Å |
| 104 | V | 84.6 | Confident | 88.3 | Confident | 5 Ų | 5 | 46.5 Ų | 46.5 | 3% | 0.03 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -58.5 | -34.5 | -178.2 | 168.5 | 0 | 0 | 0 | 0 | 112.8 | G100 G108 R109 T112 L152 V153 L156 | G100-V104 WeakPolarHBondContact O-CB 3.44Å; G100-V104 VanDerWaalsContact O-CG2 3.24Å; G100-V104 WeakPolarHBondContact O-CG2 3.41Å; G100-V104 PolarHBondContact O-N 3.32Å; V104-G108 PolarHBondContact O-N 3.44Å; V104-R109 HydrophobicContact CG1-CG 3.93Å; V104-R109 PolarHBondContact O-NH1 3.13Å; V104-T112 HydrophobicContact CG2-CG2 4.04Å; V104-T112 PolarHBondContact N-OG1 2.99Å; V104-L152 HydrophobicContact CG2-CD2 4.17Å; V104-V153 HydrophobicContact CG2-CB 4.03Å; V104-V153 HydrophobicContact CG2-CG1 3.75Å; V104-V153 HydrophobicContact CG2-CG2 3.3Å; V104-L156 HydrophobicContact CG1-CD1 4.2Å |
| 105 | Q | 80.9 | Confident | 88.4 | Confident | 121 Ų | 121 | 48.2 Ų | 48.2 | 57% | 0.565 | 23% | 0.232 | S | C | * | . | H | α-helix | trans | -77.5 | -33.3 | 177.8 | -66.3 | 179.4 | -3.2 | 0 | 0 | 113 | W102 M103 K225 | W102-Q105 PolarHBondContact O-N 2.78Å; M103-Q105 PolarHBondContact O-N 3.35Å; Q105-K225 PolarHBondContact O-NZ 3.49Å |
| 106 | R | 83 | Confident | 88.4 | Confident | 170 Ų | 170 | 44.4 Ų | 44.4 | 64% | 0.642 | 21% | 0.21 | S | C | * | . | H | α-helix | trans | -85.6 | -54.3 | -174.9 | -74.6 | -72.7 | -173.4 | 158.9 | -0.3 | 112.7 | W102 M103 | W102-R106 HydrophobicContact CD2-CG 4.33Å; W102-R106 HydrophobicContact CZ2-CG 4.11Å; W102-R106 PolarHBondContact O-N 2.81Å; M103-R106 PolarHBondContact O-N 3.42Å |
| 107 | I | 89.3 | Confident | 88.4 | Confident | 64 Ų | 64 | 44.6 Ų | 44.6 | 33% | 0.328 | 21% | 0.21 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -107.4 | -8.2 | -170.1 | 63.6 | 167.8 | 0 | 0 | 0 | 113.7 | M103 L111 T112 | M103-I107 HydrophobicContact CB-CD1 4.39Å; M103-I107 HydrophobicContact CB-CG1 4.32Å; M103-I107 HydrophobicContact CE-CD1 3.75Å; M103-I107 VanDerWaalsContact O-CG1 3.24Å; M103-I107 WeakPolarHBondContact O-CG1 3.41Å; M103-I107 PolarHBondContact O-N 3.44Å; I107-L111 HydrophobicContact CB-CB 4.36Å; I107-L111 HydrophobicContact CD1-CB 4.11Å; I107-L111 HydrophobicContact CG1-CB 4.3Å; I107-L111 WeakPolarHBondContact O-CD1 3.48Å; I107-T112 WeakPolarHBondContact CG1-OG1 3.48Å |
| 108 | G | 87.7 | Confident | 88.8 | Confident | 0 Ų | 0 | 49.9 Ų | 49.9 | 0% | 0 | 24% | 0.238 | C | C | . | . | trans | 97.1 | 174.4 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | V104 T112 E217 F221 | V104-G108 PolarHBondContact O-N 3.44Å; G108-T112 VanDerWaalsContact O-CB 3.3Å; G108-T112 WeakPolarHBondContact O-CB 3.46Å; G108-T112 PolarHBondContact O-N 3.3Å; G108-T112 PolarHBondContact O-OG1 3.42Å; G108-E217 WeakPolarHBondContact CA-OE2 3.24Å; G108-F221 VanDerWaalsContact CA-CE1 3.42Å | ||
| 109 | R | 90.4 | Very high | 89.2 | Confident | 34 Ų | 34 | 47.1 Ų | 47.1 | 13% | 0.128 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -81.2 | -46.7 | -172 | -72 | 67.5 | 170.4 | 147.6 | -4 | 110.3 | V104 T112 L113 V153 Y157 E160 E217 T218 F221 | V104-R109 HydrophobicContact CG1-CG 3.93Å; V104-R109 PolarHBondContact O-NH1 3.13Å; R109-T112 PolarHBondContact O-N 2.85Å; R109-L113 WeakPolarHBondContact O-CG 3.31Å; R109-L113 PolarHBondContact O-N 3.27Å; R109-V153 HydrophobicContact CB-CG1 4.16Å; R109-V153 HydrophobicContact CG-CG1 4.44Å; R109-Y157 HydrophobicContact CB-CD2 3.84Å; R109-E160 WeakPolarHBondContact CD-OE2 3.12Å; R109-E160 IonicContact CZ-OE1 2.78Å; R109-E160 VanDerWaalsContact CZ-OE1 3.3Å; R109-E160 IonicContact CZ-OE2 2.84Å; R109-E160 VanDerWaalsContact NE-CD 3.34Å; R109-E160 IonicContact NE-OE1 3.62Å; R109-E160 PolarHBondContact NE-OE1 3.44Å; R109-E160 VanDerWaalsContact NE-OE1 3.1Å; R109-E160 IonicContact NE-OE2 3.43Å; R109-E160 PolarHBondContact NE-OE2 2.92Å; R109-E160 IonicContact NH2-OE1 3.4Å; R109-E160 PolarHBondContact NH2-OE1 3.47Å; R109-E160 IonicContact NH2-OE2 3.42Å; R109-E217 WeakPolarHBondContact CA-OE1 3.41Å; R109-E217 WeakPolarHBondContact CB-OE1 3.31Å; R109-E217 VanDerWaalsContact N-CD 3.33Å; R109-E217 PolarHBondContact N-OE1 3.37Å; R109-E217 PolarHBondContact N-OE2 3.46Å; R109-T218 HydrophobicContact CB-CG2 3.88Å; R109-T218 HydrophobicContact CG-CG2 4Å; R109-F221 VanDerWaalsContact NH1-CD2 3.29Å |
| 110 | K | 92.9 | Very high | 89.4 | Confident | 42 Ų | 42 | 43.9 Ų | 43.9 | 18% | 0.183 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -56.9 | -53.6 | 176.9 | 173.7 | -173.8 | 171.8 | 166.8 | 0 | 111 | T112 L113 M114 M212 C213 M215 E217 | K110-T112 VanDerWaalsContact C-N 3.28Å; K110-T112 PolarHBondContact O-N 3.41Å; K110-L113 PolarHBondContact O-N 3.17Å; K110-M114 HydrophobicContact CG-SD 4.18Å; K110-M114 WeakPolarHBondContact O-CG 3.46Å; K110-M114 PolarHBondContact O-N 2.81Å; K110-M212 WeakPolarHBondContact CE-O 3.25Å; K110-C213 PolarHBondContact NZ-O 3.42Å; K110-C213 VanDerWaalsContact NZ-O 3.16Å; K110-M215 VanDerWaalsContact CD-O 3.29Å; K110-M215 WeakPolarHBondContact CD-O 3.49Å; K110-M215 VanDerWaalsContact CE-O 3.26Å; K110-M215 WeakPolarHBondContact CE-O 3.29Å; K110-M215 PolarHBondContact NZ-O 3.03Å; K110-E217 HydrophobicContact CB-CB 4.35Å; K110-E217 WeakPolarHBondContact CB-OE2 3.27Å; K110-E217 VanDerWaalsContact N-CD 3.31Å; K110-E217 PolarHBondContact N-OE1 3.38Å; K110-E217 PolarHBondContact N-OE2 3.19Å |
| 111 | L | 92.6 | Very high | 89.8 | Confident | 86 Ų | 86 | 46.1 Ų | 46.1 | 45% | 0.45 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -66.5 | -31.9 | -177.2 | -69.5 | -178.2 | 0 | 0 | 0 | 112.3 | I107 M114 S115 | I107-L111 HydrophobicContact CB-CB 4.36Å; I107-L111 HydrophobicContact CD1-CB 4.11Å; I107-L111 HydrophobicContact CG1-CB 4.3Å; I107-L111 WeakPolarHBondContact O-CD1 3.48Å; L111-M114 HydrophobicContact CD2-SD 4.42Å; L111-M114 PolarHBondContact O-N 2.95Å; L111-S115 VanDerWaalsContact O-CB 3.28Å; L111-S115 WeakPolarHBondContact O-CB 3.22Å; L111-S115 PolarHBondContact O-N 3.36Å; L111-S115 PolarHBondContact O-OG 3.38Å |
| 112 | T | 93.1 | Very high | 90.5 | Very high | 0 Ų | 0 | 51.3 Ų | 51.3 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -66.5 | -41.6 | 173.3 | -57.7 | 0 | 0 | 0 | 0 | 111.5 | M103 V104 I107 G108 R109 K110 S115 C116 I149 V153 | M103-T112 VanDerWaalsContact C-OG1 3.31Å; M103-T112 HydrophobicContact CB-CG2 3.62Å; M103-T112 WeakPolarHBondContact CB-OG1 3.33Å; M103-T112 HydrophobicContact CE-CG2 4.22Å; M103-T112 PolarHBondContact O-OG1 2.72Å; M103-T112 HydrophobicContact SD-CG2 4.31Å; V104-T112 HydrophobicContact CG2-CG2 4.04Å; V104-T112 PolarHBondContact N-OG1 2.99Å; I107-T112 WeakPolarHBondContact CG1-OG1 3.48Å; G108-T112 VanDerWaalsContact O-CB 3.3Å; G108-T112 WeakPolarHBondContact O-CB 3.46Å; G108-T112 PolarHBondContact O-N 3.3Å; G108-T112 PolarHBondContact O-OG1 3.42Å; R109-T112 PolarHBondContact O-N 2.85Å; K110-T112 VanDerWaalsContact C-N 3.28Å; K110-T112 PolarHBondContact O-N 3.41Å; T112-S115 PolarHBondContact O-N 2.84Å; T112-C116 PolarHBondContact O-N 3.05Å; T112-I149 HydrophobicContact CG2-CG2 3.6Å; T112-V153 HydrophobicContact CG2-CG1 4.45Å; T112-V153 HydrophobicContact CG2-CG2 3.56Å |
| 113 | L | 92.4 | Very high | 91.1 | Very high | 0 Ų | 0 | 44.2 Ų | 44.2 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -64.9 | -38.8 | 175.3 | -71.8 | 169.7 | 0 | 0 | 0 | 112.4 | R109 K110 C116 T117 V153 V154 Y157 M212 | R109-L113 WeakPolarHBondContact O-CG 3.31Å; R109-L113 PolarHBondContact O-N 3.27Å; K110-L113 PolarHBondContact O-N 3.17Å; L113-C116 PolarHBondContact O-SG 3.4Å; L113-T117 WeakPolarHBondContact O-CG2 3.49Å; L113-V153 HydrophobicContact CD1-CG1 3.98Å; L113-V153 HydrophobicContact CD2-CB 3.8Å; L113-V153 HydrophobicContact CD2-CG1 3.81Å; L113-V153 HydrophobicContact CG-CB 4.13Å; L113-V153 HydrophobicContact CG-CG1 3.55Å; L113-V154 HydrophobicContact CD1-CG2 4.36Å; L113-V154 HydrophobicContact CD2-CG2 3.36Å; L113-Y157 HydrophobicContact CD1-CD2 4.32Å; L113-Y157 HydrophobicContact CD1-CG 4.06Å; L113-M212 HydrophobicContact CB-CE 3.9Å; L113-M212 HydrophobicContact CD1-CE 3.19Å; L113-M212 HydrophobicContact CG-CE 4.13Å |
| 114 | M | 94.3 | Very high | 91.5 | Very high | 34 Ų | 34 | 43.1 Ų | 43.1 | 17% | 0.167 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -66.2 | -44.6 | 173.5 | -68.1 | -179.7 | 70 | 0 | 0 | 111.1 | K110 L111 C116 T117 M209 M212 C213 | K110-M114 HydrophobicContact CG-SD 4.18Å; K110-M114 WeakPolarHBondContact O-CG 3.46Å; K110-M114 PolarHBondContact O-N 2.81Å; L111-M114 HydrophobicContact CD2-SD 4.42Å; L111-M114 PolarHBondContact O-N 2.95Å; M114-C116 VanDerWaalsContact C-N 3.29Å; M114-C116 PolarHBondContact O-N 3.39Å; M114-T117 PolarHBondContact O-N 2.78Å; M114-T117 VanDerWaalsContact O-N 3.17Å; M114-T117 PolarHBondContact O-OG1 2.73Å; M114-M209 HydrophobicContact CB-SD 3.8Å; M114-M209 HydrophobicContact CE-SD 3.81Å; M114-M209 HydrophobicContact CG-SD 4.13Å; M114-M209 WeakPolarHBondContact O-CE 3.38Å; M114-M212 HydrophobicContact CG-CB 3.85Å; M114-M212 HydrophobicContact SD-CB 4.46Å; M114-C213 WeakPolarHBondContact CE-SG 3.3Å |
| 115 | S | 92.6 | Very high | 92.1 | Very high | 42 Ų | 42 | 46.1 Ų | 46.1 | 29% | 0.294 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -64.5 | -31 | -179 | -57.9 | 0 | 0 | 0 | 0 | 113.1 | L111 T112 T117 L118 P119 | L111-S115 VanDerWaalsContact O-CB 3.28Å; L111-S115 WeakPolarHBondContact O-CB 3.22Å; L111-S115 PolarHBondContact O-N 3.36Å; L111-S115 PolarHBondContact O-OG 3.38Å; T112-S115 PolarHBondContact O-N 2.84Å; S115-T117 VanDerWaalsContact C-N 3.29Å; S115-T117 PolarHBondContact O-N 3.43Å; S115-L118 PolarHBondContact O-N 2.48Å; S115-P119 WeakPolarHBondContact O-CD 3.39Å |
| 116 | C | 92.7 | Very high | 92.8 | Very high | 0 Ų | 0 | 41.5 Ų | 41.5 | 0% | 0 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -73.7 | -17.9 | 177.9 | 78 | 0 | 0 | 0 | 0 | 113.6 | T112 L113 M114 L118 P119 F120 A146 I149 T150 | T112-C116 PolarHBondContact O-N 3.05Å; L113-C116 PolarHBondContact O-SG 3.4Å; M114-C116 VanDerWaalsContact C-N 3.29Å; M114-C116 PolarHBondContact O-N 3.39Å; C116-L118 VanDerWaalsContact C-N 3.26Å; C116-L118 PolarHBondContact O-N 3.46Å; C116-P119 WeakPolarHBondContact O-CD 3.3Å; C116-P119 VanDerWaalsContact O-CG 3.27Å; C116-P119 WeakPolarHBondContact O-CG 3.35Å; C116-F120 WeakPolarHBondContact O-CD2 3.44Å; C116-F120 PolarHBondContact O-N 3.46Å; C116-A146 WeakPolarHBondContact O-CB 3.4Å; C116-I149 HydrophobicContact CB-CB 4.02Å; C116-I149 HydrophobicContact CB-CD1 4.21Å; C116-I149 HydrophobicContact CB-CG2 3.71Å; C116-T150 PolarHBondContact SG-OG1 3.42Å |
| 117 | T | 92.2 | Very high | 93.4 | Very high | 3 Ų | 3 | 33.4 Ų | 33.4 | 2% | 0.018 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -67.6 | -28.6 | 174.4 | 66.2 | 0 | 0 | 0 | 0 | 112.6 | L113 M114 S115 F120 V121 P205 L208 M209 | L113-T117 WeakPolarHBondContact O-CG2 3.49Å; M114-T117 PolarHBondContact O-N 2.78Å; M114-T117 VanDerWaalsContact O-N 3.17Å; M114-T117 PolarHBondContact O-OG1 2.73Å; S115-T117 VanDerWaalsContact C-N 3.29Å; S115-T117 PolarHBondContact O-N 3.43Å; T117-F120 WeakPolarHBondContact O-CB 3.38Å; T117-F120 PolarHBondContact O-N 3.07Å; T117-V121 WeakPolarHBondContact O-CG2 3.31Å; T117-V121 PolarHBondContact O-N 3.38Å; T117-P205 WeakPolarHBondContact CG2-O 3.39Å; T117-L208 HydrophobicContact CG2-CB 4.23Å; T117-L208 HydrophobicContact CG2-CD2 3.75Å; T117-L208 HydrophobicContact CG2-CG 3.87Å; T117-M209 HydrophobicContact CG2-CB 4Å; T117-M209 WeakPolarHBondContact OG1-CE 3.44Å; T117-M209 PolarHBondContact OG1-SD 3.24Å |
| 118 | L | 93 | Very high | 93.7 | Very high | 111 Ų | 111 | 32.7 Ų | 32.7 | 58% | 0.581 | 17% | 0.171 | S | C | * | . | H | α-helix | trans | -59.8 | -54.7 | 177.5 | -60.3 | 177.6 | 0 | 0 | 0 | 112 | S115 C116 F120 V121 F122 M209 | S115-L118 PolarHBondContact O-N 2.48Å; C116-L118 VanDerWaalsContact C-N 3.26Å; C116-L118 PolarHBondContact O-N 3.46Å; L118-F120 VanDerWaalsContact C-N 3.3Å; L118-F120 PolarHBondContact O-N 3.5Å; L118-V121 PolarHBondContact O-N 2.83Å; L118-F122 WeakPolarHBondContact O-CB 3.46Å; L118-F122 PolarHBondContact O-N 3.3Å; L118-M209 HydrophobicContact CD2-CE 3.97Å; L118-M209 HydrophobicContact CG-CE 4.33Å |
| 119 | P | 95.1 | Very high | 94 | Very high | 21 Ų | 21 | 35.3 Ų | 35.3 | 14% | 0.136 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -65.6 | -27.9 | 175.4 | 22.2 | -30.7 | 0 | 0 | 0 | 113.6 | S115 C116 G123 L142 L145 A146 | S115-P119 WeakPolarHBondContact O-CD 3.39Å; C116-P119 WeakPolarHBondContact O-CD 3.3Å; C116-P119 VanDerWaalsContact O-CG 3.27Å; C116-P119 WeakPolarHBondContact O-CG 3.35Å; P119-G123 WeakPolarHBondContact O-CA 3.44Å; P119-G123 PolarHBondContact O-N 2.87Å; P119-L142 HydrophobicContact CB-CD2 4.44Å; P119-L145 HydrophobicContact CB-CD2 4.38Å; P119-A146 HydrophobicContact CB-CB 4.1Å; P119-A146 HydrophobicContact CG-CB 3.85Å |
| 120 | F | 93.9 | Very high | 94.1 | Very high | 0 Ų | 0 | 33.7 Ų | 33.7 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -62.4 | -57.5 | 171 | -86.8 | -56 | 0 | 0 | 0 | 111.7 | V56 C116 T117 L118 G123 F124 A146 S147 T150 P205 | V56-F120 HydrophobicContact CG2-CD1 4.13Å; V56-F120 HydrophobicContact CG2-CE1 3.8Å; C116-F120 WeakPolarHBondContact O-CD2 3.44Å; C116-F120 PolarHBondContact O-N 3.46Å; T117-F120 WeakPolarHBondContact O-CB 3.38Å; T117-F120 PolarHBondContact O-N 3.07Å; L118-F120 VanDerWaalsContact C-N 3.3Å; L118-F120 PolarHBondContact O-N 3.5Å; F120-G123 PolarHBondContact O-N 3.24Å; F120-F124 HydrophobicContact CD1-CE2 4.43Å; F120-F124 VanDerWaalsContact O-CD2 3.26Å; F120-F124 WeakPolarHBondContact O-CD2 3.22Å; F120-F124 PolarHBondContact O-N 2.95Å; F120-A146 HydrophobicContact CB-CB 4.09Å; F120-A146 HydrophobicContact CD1-CB 3.51Å; F120-A146 HydrophobicContact CD2-CB 3.41Å; F120-A146 VanDerWaalsContact CD2-CB 3.41Å; F120-A146 HydrophobicContact CE1-CB 3.7Å; F120-A146 HydrophobicContact CE2-CB 3.61Å; F120-A146 HydrophobicContact CG-CB 3.35Å; F120-A146 HydrophobicContact CZ-CB 3.74Å; F120-S147 WeakPolarHBondContact CE1-OG 3.29Å; F120-T150 WeakPolarHBondContact CE2-OG1 3.28Å; F120-P205 HydrophobicContact CB-CB 3.6Å; F120-P205 HydrophobicContact CB-CG 3.88Å; F120-P205 HydrophobicContact CD2-CB 3.88Å; F120-P205 HydrophobicContact CG-CB 3.88Å; F120-P205 HydrophobicContact CG-CG 4.31Å |
| 121 | V | 94.3 | Very high | 94.1 | Very high | 47 Ų | 47 | 38 Ų | 38 | 29% | 0.285 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -65.3 | -44.1 | -175.8 | 174.6 | 0 | 0 | 0 | 0 | 110.4 | T117 L118 F124 T125 | T117-V121 WeakPolarHBondContact O-CG2 3.31Å; T117-V121 PolarHBondContact O-N 3.38Å; L118-V121 PolarHBondContact O-N 2.83Å; V121-F124 PolarHBondContact O-N 3.34Å; V121-T125 WeakPolarHBondContact O-CB 3.47Å; V121-T125 PolarHBondContact O-N 3.43Å; V121-T125 PolarHBondContact O-OG1 3.04Å |
| 122 | F | 95.7 | Very high | 94 | Very high | 125 Ų | 125 | 37.1 Ų | 37.1 | 55% | 0.548 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -65 | -41.9 | 177.6 | -170.3 | -121.2 | 0 | 0 | 0 | 111.7 | L118 T125 I126 L142 | L118-F122 WeakPolarHBondContact O-CB 3.46Å; L118-F122 PolarHBondContact O-N 3.3Å; F122-T125 PolarHBondContact O-N 3.14Å; F122-I126 HydrophobicContact CD1-CD1 3.9Å; F122-I126 HydrophobicContact CE1-CD1 3.5Å; F122-I126 HydrophobicContact CE1-CG1 4.42Å; F122-I126 HydrophobicContact CE2-CD1 4.32Å; F122-I126 HydrophobicContact CE2-CG1 4.42Å; F122-I126 HydrophobicContact CG-CD1 4.45Å; F122-I126 HydrophobicContact CZ-CD1 3.74Å; F122-I126 HydrophobicContact CZ-CG1 4.28Å; F122-I126 WeakPolarHBondContact O-CG1 3.14Å; F122-I126 PolarHBondContact O-N 3.46Å; F122-L142 HydrophobicContact CD1-CD1 3.56Å; F122-L142 HydrophobicContact CE1-CD1 3.96Å |
| 123 | G | 96.1 | Very high | 93.9 | Very high | 0 Ų | 0 | 37.7 Ų | 37.7 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -60.2 | -47.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | P119 F120 I126 I127 G139 | P119-G123 WeakPolarHBondContact O-CA 3.44Å; P119-G123 PolarHBondContact O-N 2.87Å; F120-G123 PolarHBondContact O-N 3.24Å; G123-I126 PolarHBondContact O-N 2.93Å; G123-I127 WeakPolarHBondContact O-CG1 3.33Å; G123-I127 PolarHBondContact O-N 2.77Å; G123-I127 VanDerWaalsContact O-N 3.13Å; G123-G139 WeakPolarHBondContact O-CA 3.38Å |
| 124 | F | 95.9 | Very high | 93.9 | Very high | 0 Ų | 0 | 46.7 Ų | 46.7 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -66.7 | -36.7 | 174.5 | -76.2 | -59.4 | 0 | 0 | 0 | 112.8 | V56 F120 V121 I126 I127 I128 T143 A198 C201 | V56-F124 HydrophobicContact CG2-CE2 3.87Å; V56-F124 HydrophobicContact CG2-CZ 3.47Å; V56-F124 VanDerWaalsContact CG2-CZ 3.47Å; F120-F124 HydrophobicContact CD1-CE2 4.43Å; F120-F124 VanDerWaalsContact O-CD2 3.26Å; F120-F124 WeakPolarHBondContact O-CD2 3.22Å; F120-F124 PolarHBondContact O-N 2.95Å; V121-F124 PolarHBondContact O-N 3.34Å; F124-I126 VanDerWaalsContact C-N 3.32Å; F124-I126 PolarHBondContact O-N 3.47Å; F124-I127 HydrophobicContact CD1-CD1 4.16Å; F124-I127 WeakPolarHBondContact O-CB 3.47Å; F124-I127 PolarHBondContact O-N 3.4Å; F124-I127 VanDerWaalsContact O-N 3.14Å; F124-I128 WeakPolarHBondContact O-CD1 3.49Å; F124-I128 WeakPolarHBondContact O-CG1 3.36Å; F124-I128 PolarHBondContact O-N 3.32Å; F124-T143 HydrophobicContact CD1-CG2 4.16Å; F124-T143 HydrophobicContact CD2-CG2 3.91Å; F124-T143 HydrophobicContact CE1-CG2 4.11Å; F124-T143 HydrophobicContact CE2-CG2 3.87Å; F124-T143 HydrophobicContact CG-CG2 4.05Å; F124-T143 HydrophobicContact CZ-CG2 3.95Å; F124-A198 HydrophobicContact CD1-CB 4.14Å; F124-C201 HydrophobicContact CD1-CB 3.85Å; F124-C201 HydrophobicContact CD2-CB 4.18Å; F124-C201 HydrophobicContact CE1-CB 3.29Å; F124-C201 HydrophobicContact CE2-CB 3.66Å; F124-C201 WeakPolarHBondContact CE2-O 3.19Å; F124-C201 HydrophobicContact CG-CB 4.27Å; F124-C201 HydrophobicContact CZ-CB 3.19Å |
| 125 | T | 95.6 | Very high | 94 | Very high | 69 Ų | 69 | 47.5 Ų | 47.5 | 42% | 0.423 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -61 | -41.6 | 176.1 | -57.8 | 0 | 0 | 0 | 0 | 111.5 | V121 F122 I127 I128 A129 | V121-T125 WeakPolarHBondContact O-CB 3.47Å; V121-T125 PolarHBondContact O-N 3.43Å; V121-T125 PolarHBondContact O-OG1 3.04Å; F122-T125 PolarHBondContact O-N 3.14Å; T125-I127 VanDerWaalsContact C-N 3.35Å; T125-I128 PolarHBondContact O-N 2.98Å; T125-A129 WeakPolarHBondContact O-CB 3.5Å; T125-A129 PolarHBondContact O-N 3.31Å |
| 126 | I | 96.4 | Very high | 94.1 | Very high | 24 Ų | 24 | 45.5 Ų | 45.5 | 12% | 0.123 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -64.2 | -41.1 | 174.6 | -68.4 | 172.9 | 0 | 0 | 0 | 111 | F122 G123 F124 A129 A130 M135 V138 L142 | F122-I126 HydrophobicContact CD1-CD1 3.9Å; F122-I126 HydrophobicContact CE1-CD1 3.5Å; F122-I126 HydrophobicContact CE1-CG1 4.42Å; F122-I126 HydrophobicContact CE2-CD1 4.32Å; F122-I126 HydrophobicContact CE2-CG1 4.42Å; F122-I126 HydrophobicContact CG-CD1 4.45Å; F122-I126 HydrophobicContact CZ-CD1 3.74Å; F122-I126 HydrophobicContact CZ-CG1 4.28Å; F122-I126 WeakPolarHBondContact O-CG1 3.14Å; F122-I126 PolarHBondContact O-N 3.46Å; G123-I126 PolarHBondContact O-N 2.93Å; F124-I126 VanDerWaalsContact C-N 3.32Å; F124-I126 PolarHBondContact O-N 3.47Å; I126-A129 CarbonylContact O-C 3.29Å; I126-A129 PolarHBondContact O-N 3.22Å; I126-A130 PolarHBondContact O-N 2.94Å; I126-M135 HydrophobicContact CG2-CB 3.89Å; I126-M135 HydrophobicContact CG2-CE 4.34Å; I126-M135 HydrophobicContact CG2-CG 4.37Å; I126-M135 WeakPolarHBondContact CG2-O 3.2Å; I126-V138 HydrophobicContact CD1-CG1 3.91Å; I126-L142 HydrophobicContact CD1-CD1 3.67Å |
| 127 | I | 94.9 | Very high | 94.2 | Very high | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -61.3 | -48.8 | 175.7 | -66.3 | 169.4 | 0 | 0 | 0 | 109.8 | Y59 G123 F124 T125 A129 A130 L136 W194 A198 | Y59-I127 HydrophobicContact CE1-CD1 4.38Å; Y59-I127 HydrophobicContact CE1-CG2 4.14Å; Y59-I127 VanDerWaalsContact OH-CG2 3.31Å; Y59-I127 WeakPolarHBondContact OH-CG2 3.48Å; G123-I127 WeakPolarHBondContact O-CG1 3.33Å; G123-I127 PolarHBondContact O-N 2.77Å; G123-I127 VanDerWaalsContact O-N 3.13Å; F124-I127 HydrophobicContact CD1-CD1 4.16Å; F124-I127 WeakPolarHBondContact O-CB 3.47Å; F124-I127 PolarHBondContact O-N 3.4Å; F124-I127 VanDerWaalsContact O-N 3.14Å; T125-I127 VanDerWaalsContact C-N 3.35Å; I127-A129 VanDerWaalsContact C-N 3.28Å; I127-A129 PolarHBondContact O-N 3.37Å; I127-A130 WeakPolarHBondContact O-CB 3.47Å; I127-A130 PolarHBondContact O-N 3.07Å; I127-L136 HydrophobicContact CG2-CD2 4.14Å; I127-W194 HydrophobicContact CG2-CE3 4.18Å; I127-W194 HydrophobicContact CG2-CZ3 4Å; I127-W194 WeakPolarHBondContact O-CZ3 3.33Å; I127-A198 HydrophobicContact CB-CB 4.41Å; I127-A198 HydrophobicContact CG2-CB 3.85Å |
| 128 | I | 95.1 | Very high | 94.4 | Very high | 49 Ų | 49 | 49.9 Ų | 49.9 | 25% | 0.251 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -56.6 | -44.8 | 178.8 | -66.5 | 158.5 | 0 | 0 | 0 | 110.9 | F124 T125 A130 R195 A198 I199 | F124-I128 WeakPolarHBondContact O-CD1 3.49Å; F124-I128 WeakPolarHBondContact O-CG1 3.36Å; F124-I128 PolarHBondContact O-N 3.32Å; T125-I128 PolarHBondContact O-N 2.98Å; I128-A130 VanDerWaalsContact C-N 3.25Å; I128-A130 PolarHBondContact O-N 2.71Å; I128-R195 PolarHBondContact O-NE 2.89Å; I128-A198 HydrophobicContact CD1-CB 4.46Å; I128-A198 HydrophobicContact CG1-CB 3.72Å; I128-I199 HydrophobicContact CD1-CB 4.36Å; I128-I199 HydrophobicContact CD1-CG1 3.5Å; I128-I199 HydrophobicContact CG1-CG1 3.84Å; I128-I199 HydrophobicContact CG2-CD1 4.49Å; I128-I199 HydrophobicContact CG2-CG1 4.35Å |
| 129 | A | 94.8 | Very high | 94.5 | Very high | 55 Ų | 55 | 44.6 Ų | 44.6 | 46% | 0.455 | 23% | 0.227 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -81.9 | 5.8 | 180 | 0 | 0 | 0 | 0 | 0 | 113.9 | T125 I126 I127 Q131 M135 | T125-A129 WeakPolarHBondContact O-CB 3.5Å; T125-A129 PolarHBondContact O-N 3.31Å; I126-A129 CarbonylContact O-C 3.29Å; I126-A129 PolarHBondContact O-N 3.22Å; I127-A129 VanDerWaalsContact C-N 3.28Å; I127-A129 PolarHBondContact O-N 3.37Å; A129-Q131 PolarHBondContact O-N 2.74Å; A129-M135 HydrophobicContact CB-CE 4.17Å; A129-M135 WeakPolarHBondContact O-CE 3.37Å |
| 130 | A | 93.6 | Very high | 94.6 | Very high | 0 Ų | 0 | 43.6 Ų | 43.6 | 0% | 0 | 22% | 0.22 | C | C | . | . | trans | -63.4 | 127.9 | -171.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | L75 I126 I127 I128 M135 L136 W194 R195 | L75-A130 HydrophobicContact CD2-CB 4.31Å; I126-A130 PolarHBondContact O-N 2.94Å; I127-A130 WeakPolarHBondContact O-CB 3.47Å; I127-A130 PolarHBondContact O-N 3.07Å; I128-A130 VanDerWaalsContact C-N 3.25Å; I128-A130 PolarHBondContact O-N 2.71Å; A130-M135 HydrophobicContact CB-CB 3.9Å; A130-L136 HydrophobicContact CB-CD2 3.53Å; A130-L136 HydrophobicContact CB-CG 3.94Å; A130-W194 HydrophobicContact CB-CH2 4.11Å; A130-W194 HydrophobicContact CB-CZ3 4.34Å; A130-R195 PolarHBondContact O-NH2 3.04Å | ||
| 131 | Q | 91 | Very high | 94.7 | Very high | 133 Ų | 133 | 46.1 Ų | 46.1 | 62% | 0.621 | 24% | 0.236 | S | C | * | . | S | Bend | trans | -117.3 | -9.2 | 175.2 | -63.7 | -178.9 | -12.3 | 0 | 0 | 112.6 | A129 M135 | A129-Q131 PolarHBondContact O-N 2.74Å; Q131-M135 HydrophobicContact CB-SD 4.3Å; Q131-M135 PolarHBondContact N-SD 2.76Å |
| 132 | N | 91.1 | Very high | 94.8 | Very high | 66 Ų | 66 | 45.6 Ų | 45.6 | 35% | 0.353 | 23% | 0.231 | S | C | . | . | S | Bend | trans | -147 | 163.5 | 177 | 62.3 | 36.4 | 0 | 0 | 0 | 110.3 | R74 W134 M135 | R74-N132 WeakPolarHBondContact O-CA 3.49Å; N132-W134 VanDerWaalsContact C-N 3.27Å; N132-W134 PolarHBondContact O-N 3.4Å; N132-W134 PolarHBondContact OD1-N 2.94Å; N132-M135 PolarHBondContact O-N 3.34Å; N132-M135 WeakPolarHBondContact OD1-CB 3.39Å; N132-M135 WeakPolarHBondContact OD1-CG 3.47Å; N132-M135 PolarHBondContact OD1-N 3.19Å |
| 133 | V | 91.1 | Very high | 94.8 | Very high | 13 Ų | 13 | 39.6 Ų | 39.6 | 8% | 0.079 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -61.1 | -33.8 | 179.1 | -177.9 | 0 | 0 | 0 | 0 | 112.4 | R74 L77 E81 M135 L136 Y137 | R74-V133 WeakPolarHBondContact O-CG2 3.43Å; R74-V133 PolarHBondContact O-N 2.81Å; L77-V133 HydrophobicContact CD2-CG1 3.77Å; L77-V133 HydrophobicContact CD2-CG2 4.19Å; E81-V133 HydrophobicContact CG-CG1 4.49Å; V133-M135 VanDerWaalsContact C-N 3.34Å; V133-M135 PolarHBondContact O-N 3.06Å; V133-L136 VanDerWaalsContact O-CB 3.3Å; V133-L136 WeakPolarHBondContact O-CB 3.33Å; V133-L136 PolarHBondContact O-N 3.44Å; V133-L136 VanDerWaalsContact O-N 3.1Å; V133-Y137 HydrophobicContact CG1-CD1 4.41Å; V133-Y137 HydrophobicContact CG1-CD2 4.26Å; V133-Y137 HydrophobicContact CG1-CE1 3.82Å; V133-Y137 HydrophobicContact CG1-CE2 3.65Å; V133-Y137 PolarHBondContact O-N 2.88Å |
| 134 | W | 93 | Very high | 94.8 | Very high | 189 Ų | 189 | 39.6 Ų | 39.6 | 72% | 0.716 | 21% | 0.205 | S | C | * | . | H | α-helix | trans | -63.1 | -37.1 | 179.3 | -67.3 | 108.5 | 0 | 0 | 0 | 113.2 | N132 L136 Y137 V138 | N132-W134 VanDerWaalsContact C-N 3.27Å; N132-W134 PolarHBondContact O-N 3.4Å; N132-W134 PolarHBondContact OD1-N 2.94Å; W134-L136 VanDerWaalsContact C-N 3.32Å; W134-L136 PolarHBondContact O-N 3.4Å; W134-Y137 AromaticContact CE3-CD2 3.89Å; W134-Y137 HydrophobicContact CE3-CD2 3.89Å; W134-Y137 HydrophobicContact CZ3-CD2 4.13Å; W134-Y137 PolarHBondContact O-N 3.38Å; W134-V138 WeakPolarHBondContact O-CG2 3.17Å; W134-V138 PolarHBondContact O-N 3.49Å |
| 135 | M | 95.3 | Very high | 94.7 | Very high | 50 Ų | 50 | 41.3 Ų | 41.3 | 25% | 0.246 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -62.3 | -41.2 | 173.5 | -73.9 | 175.8 | 79.6 | 0 | 0 | 111 | I126 A129 A130 Q131 N132 V133 Y137 V138 G139 | I126-M135 HydrophobicContact CG2-CB 3.89Å; I126-M135 HydrophobicContact CG2-CE 4.34Å; I126-M135 HydrophobicContact CG2-CG 4.37Å; I126-M135 WeakPolarHBondContact CG2-O 3.2Å; A129-M135 HydrophobicContact CB-CE 4.17Å; A129-M135 WeakPolarHBondContact O-CE 3.37Å; A130-M135 HydrophobicContact CB-CB 3.9Å; Q131-M135 HydrophobicContact CB-SD 4.3Å; Q131-M135 PolarHBondContact N-SD 2.76Å; N132-M135 PolarHBondContact O-N 3.34Å; N132-M135 WeakPolarHBondContact OD1-CB 3.39Å; N132-M135 WeakPolarHBondContact OD1-CG 3.47Å; N132-M135 PolarHBondContact OD1-N 3.19Å; V133-M135 VanDerWaalsContact C-N 3.34Å; V133-M135 PolarHBondContact O-N 3.06Å; M135-Y137 VanDerWaalsContact C-N 3.33Å; M135-Y137 PolarHBondContact O-N 3.35Å; M135-V138 PolarHBondContact O-N 3.26Å; M135-G139 PolarHBondContact O-N 2.87Å |
| 136 | L | 94.4 | Very high | 94.7 | Very high | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -58.8 | -46.3 | 174.4 | -63.2 | 176.3 | 0 | 0 | 0 | 110.8 | L67 L77 F85 I127 A130 V133 W134 G139 R140 W194 | L67-L136 HydrophobicContact CD1-CD1 4.03Å; L67-L136 HydrophobicContact CD2-CD1 4.45Å; L77-L136 HydrophobicContact CD2-CD1 4.36Å; F85-L136 HydrophobicContact CD2-CB 3.92Å; F85-L136 HydrophobicContact CE2-CB 3.84Å; F85-L136 HydrophobicContact CE2-CD2 4.38Å; F85-L136 HydrophobicContact CE2-CG 4.5Å; I127-L136 HydrophobicContact CG2-CD2 4.14Å; A130-L136 HydrophobicContact CB-CD2 3.53Å; A130-L136 HydrophobicContact CB-CG 3.94Å; V133-L136 VanDerWaalsContact O-CB 3.3Å; V133-L136 WeakPolarHBondContact O-CB 3.33Å; V133-L136 PolarHBondContact O-N 3.44Å; V133-L136 VanDerWaalsContact O-N 3.1Å; W134-L136 VanDerWaalsContact C-N 3.32Å; W134-L136 PolarHBondContact O-N 3.4Å; L136-G139 PolarHBondContact O-N 2.9Å; L136-R140 VanDerWaalsContact O-CG 3.27Å; L136-R140 WeakPolarHBondContact O-CG 3.4Å; L136-R140 PolarHBondContact O-N 3.38Å; L136-W194 HydrophobicContact CD2-CE3 4.49Å; L136-W194 HydrophobicContact CD2-CH2 4.35Å; L136-W194 HydrophobicContact CD2-CZ3 3.81Å |
| 137 | Y | 95.4 | Very high | 94.5 | Very high | 23 Ų | 23 | 37 Ų | 37 | 9% | 0.09 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -63 | -46 | 177.6 | -64.9 | -18.8 | 0 | 0 | 0 | 113.5 | E81 W84 F85 V133 W134 M135 G139 R140 V141 | E81-Y137 WeakPolarHBondContact CA-OH 3.22Å; E81-Y137 WeakPolarHBondContact CB-OH 3.22Å; E81-Y137 WeakPolarHBondContact CG-OH 3.48Å; E81-Y137 PolarHBondContact O-OH 3.17Å; W84-Y137 HydrophobicContact CB-CE1 3.97Å; W84-Y137 HydrophobicContact CB-CE2 4.47Å; F85-Y137 HydrophobicContact CB-CD1 4.41Å; F85-Y137 HydrophobicContact CB-CE1 3.91Å; F85-Y137 HydrophobicContact CD2-CD1 4.47Å; V133-Y137 HydrophobicContact CG1-CD1 4.41Å; V133-Y137 HydrophobicContact CG1-CD2 4.26Å; V133-Y137 HydrophobicContact CG1-CE1 3.82Å; V133-Y137 HydrophobicContact CG1-CE2 3.65Å; V133-Y137 PolarHBondContact O-N 2.88Å; W134-Y137 AromaticContact CE3-CD2 3.89Å; W134-Y137 HydrophobicContact CE3-CD2 3.89Å; W134-Y137 HydrophobicContact CZ3-CD2 4.13Å; W134-Y137 PolarHBondContact O-N 3.38Å; M135-Y137 VanDerWaalsContact C-N 3.33Å; M135-Y137 PolarHBondContact O-N 3.35Å; Y137-G139 VanDerWaalsContact C-N 3.3Å; Y137-G139 PolarHBondContact O-N 3.38Å; Y137-R140 PolarHBondContact O-N 2.86Å; Y137-V141 WeakPolarHBondContact O-CG2 3.41Å; Y137-V141 PolarHBondContact O-N 3.49Å |
| 138 | V | 96.2 | Very high | 94.3 | Very high | 72 Ų | 72 | 37 Ų | 37 | 44% | 0.436 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -60.7 | -43 | 177.1 | 172.1 | 0 | 0 | 0 | 0 | 110.6 | I126 W134 M135 R140 V141 L142 | I126-V138 HydrophobicContact CD1-CG1 3.91Å; W134-V138 WeakPolarHBondContact O-CG2 3.17Å; W134-V138 PolarHBondContact O-N 3.49Å; M135-V138 PolarHBondContact O-N 3.26Å; V138-R140 PolarHBondContact O-N 3.15Å; V138-V141 PolarHBondContact O-N 3.02Å; V138-L142 HydrophobicContact CG1-CD1 3.95Å; V138-L142 WeakPolarHBondContact O-CG 3.46Å; V138-L142 PolarHBondContact O-N 3.42Å |
| 139 | G | 96 | Very high | 94.1 | Very high | 0 Ų | 0 | 34.9 Ų | 34.9 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -61.7 | -40.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | G123 M135 L136 Y137 L142 T143 | G123-G139 WeakPolarHBondContact O-CA 3.38Å; M135-G139 PolarHBondContact O-N 2.87Å; L136-G139 PolarHBondContact O-N 2.9Å; Y137-G139 VanDerWaalsContact C-N 3.3Å; Y137-G139 PolarHBondContact O-N 3.38Å; G139-L142 PolarHBondContact O-N 3.41Å; G139-T143 WeakPolarHBondContact O-CB 3.39Å; G139-T143 WeakPolarHBondContact O-CG2 3.37Å; G139-T143 PolarHBondContact O-N 2.89Å; G139-T143 PolarHBondContact O-OG1 3.41Å |
| 140 | R | 95.7 | Very high | 93.9 | Very high | 0 Ų | 0 | 32.3 Ų | 32.3 | 0% | 0 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -66.5 | -39.7 | 175 | -67.6 | -63.3 | -71 | 158.9 | -7.7 | 112.5 | V56 S60 F85 I88 L136 Y137 V138 T143 G144 | V56-R140 PolarHBondContact O-NH1 3.45Å; V56-R140 PolarHBondContact O-NH2 2.87Å; S60-R140 PolarHBondContact OG-NH2 3.26Å; F85-R140 HydrophobicContact CD2-CG 3.67Å; F85-R140 HydrophobicContact CE2-CG 3.47Å; F85-R140 VanDerWaalsContact CE2-CG 3.47Å; F85-R140 HydrophobicContact CG-CG 4.42Å; F85-R140 HydrophobicContact CZ-CG 4.11Å; F85-R140 PolarHBondContact O-NE 3.37Å; I88-R140 HydrophobicContact CG2-CB 3.54Å; I88-R140 HydrophobicContact CG2-CG 4.44Å; L136-R140 VanDerWaalsContact O-CG 3.27Å; L136-R140 WeakPolarHBondContact O-CG 3.4Å; L136-R140 PolarHBondContact O-N 3.38Å; Y137-R140 PolarHBondContact O-N 2.86Å; V138-R140 PolarHBondContact O-N 3.15Å; R140-T143 WeakPolarHBondContact CA-OG1 3.42Å; R140-T143 PolarHBondContact O-OG1 2.97Å; R140-T143 VanDerWaalsContact O-OG1 3.12Å; R140-G144 PolarHBondContact O-N 3.43Å |
| 141 | V | 96.6 | Very high | 93.5 | Very high | 54 Ų | 54 | 33.4 Ų | 33.4 | 33% | 0.327 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -61.6 | -45.6 | 175 | 170.7 | 0 | 0 | 0 | 0 | 111 | I88 Y137 V138 G144 L145 | I88-V141 HydrophobicContact CD1-CG2 3.52Å; I88-V141 HydrophobicContact CG1-CG2 3.58Å; I88-V141 HydrophobicContact CG2-CG2 4.43Å; Y137-V141 WeakPolarHBondContact O-CG2 3.41Å; Y137-V141 PolarHBondContact O-N 3.49Å; V138-V141 PolarHBondContact O-N 3.02Å; V141-G144 PolarHBondContact O-N 2.87Å; V141-L145 WeakPolarHBondContact O-CB 3.26Å; V141-L145 PolarHBondContact O-N 3.38Å |
| 142 | L | 96.6 | Very high | 93.1 | Very high | 35 Ų | 35 | 28.3 Ų | 28.3 | 18% | 0.183 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -68.3 | -44.8 | -178.9 | -70.6 | 167.6 | 0 | 0 | 0 | 112.7 | P119 F122 I126 V138 G139 G144 L145 A146 | P119-L142 HydrophobicContact CB-CD2 4.44Å; F122-L142 HydrophobicContact CD1-CD1 3.56Å; F122-L142 HydrophobicContact CE1-CD1 3.96Å; I126-L142 HydrophobicContact CD1-CD1 3.67Å; V138-L142 HydrophobicContact CG1-CD1 3.95Å; V138-L142 WeakPolarHBondContact O-CG 3.46Å; V138-L142 PolarHBondContact O-N 3.42Å; G139-L142 PolarHBondContact O-N 3.41Å; L142-G144 VanDerWaalsContact C-N 3.27Å; L142-G144 PolarHBondContact O-N 3.25Å; L142-L145 WeakPolarHBondContact O-CB 3.45Å; L142-L145 PolarHBondContact O-N 2.95Å; L142-A146 PolarHBondContact O-N 2.96Å |
| 143 | T | 96.3 | Very high | 92.9 | Very high | 0 Ų | 0 | 25.2 Ų | 25.2 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -64.7 | -34.6 | 174.6 | 51.1 | 0 | 0 | 0 | 0 | 111.8 | V56 F124 G139 R140 S147 | V56-T143 HydrophobicContact CG2-CG2 4.32Å; F124-T143 HydrophobicContact CD1-CG2 4.16Å; F124-T143 HydrophobicContact CD2-CG2 3.91Å; F124-T143 HydrophobicContact CE1-CG2 4.11Å; F124-T143 HydrophobicContact CE2-CG2 3.87Å; F124-T143 HydrophobicContact CG-CG2 4.05Å; F124-T143 HydrophobicContact CZ-CG2 3.95Å; G139-T143 WeakPolarHBondContact O-CB 3.39Å; G139-T143 WeakPolarHBondContact O-CG2 3.37Å; G139-T143 PolarHBondContact O-N 2.89Å; G139-T143 PolarHBondContact O-OG1 3.41Å; R140-T143 WeakPolarHBondContact CA-OG1 3.42Å; R140-T143 PolarHBondContact O-OG1 2.97Å; R140-T143 VanDerWaalsContact O-OG1 3.12Å; T143-S147 WeakPolarHBondContact O-CB 3.48Å; T143-S147 PolarHBondContact O-N 3.37Å; T143-S147 PolarHBondContact O-OG 2.68Å |
| 144 | G | 95 | Very high | 92.9 | Very high | 0 Ų | 0 | 24.6 Ų | 24.6 | 0% | 0 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -61.7 | -50.6 | 169.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | V89 G92 A93 R140 V141 L142 A146 S147 G148 | V89-G144 VanDerWaalsContact O-CA 3.25Å; V89-G144 WeakPolarHBondContact O-CA 3.33Å; G92-G144 CarbonylContact C-O 3.6Å; A93-G144 WeakPolarHBondContact CA-O 3.01Å; A93-G144 VanDerWaalsContact N-C 3.3Å; A93-G144 PolarHBondContact N-O 3.47Å; R140-G144 PolarHBondContact O-N 3.43Å; V141-G144 PolarHBondContact O-N 2.87Å; L142-G144 VanDerWaalsContact C-N 3.27Å; L142-G144 PolarHBondContact O-N 3.25Å; G144-A146 VanDerWaalsContact C-N 3.29Å; G144-A146 PolarHBondContact O-N 2.97Å; G144-S147 WeakPolarHBondContact O-CA 3.44Å; G144-S147 VanDerWaalsContact O-CB 3.3Å; G144-S147 WeakPolarHBondContact O-CB 3.46Å; G144-S147 PolarHBondContact O-N 2.73Å; G144-G148 PolarHBondContact O-N 3.33Å |
| 145 | L | 95.3 | Very high | 92.4 | Very high | 36 Ų | 36 | 18.2 Ų | 18.2 | 19% | 0.188 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -53.3 | -48.8 | 177 | -174.3 | 80.3 | 0 | 0 | 0 | 111.2 | G92 V95 G96 L99 P119 V141 L142 S147 G148 I149 | G92-L145 VanDerWaalsContact C-N 3.33Å; G92-L145 VanDerWaalsContact O-CA 3.22Å; G92-L145 WeakPolarHBondContact O-CA 3.41Å; G92-L145 PolarHBondContact O-N 2.89Å; V95-L145 HydrophobicContact CB-CD1 4.14Å; V95-L145 HydrophobicContact CG1-CD1 3.81Å; G96-L145 WeakPolarHBondContact CA-O 3.46Å; L99-L145 HydrophobicContact CD2-CD1 4.36Å; P119-L145 HydrophobicContact CB-CD2 4.38Å; V141-L145 WeakPolarHBondContact O-CB 3.26Å; V141-L145 PolarHBondContact O-N 3.38Å; L142-L145 WeakPolarHBondContact O-CB 3.45Å; L142-L145 PolarHBondContact O-N 2.95Å; L145-S147 VanDerWaalsContact C-N 3.34Å; L145-S147 PolarHBondContact O-N 3.09Å; L145-G148 PolarHBondContact O-N 3.45Å; L145-I149 HydrophobicContact CG-CD1 4.39Å; L145-I149 WeakPolarHBondContact O-CG1 3.45Å; L145-I149 PolarHBondContact O-N 3.49Å; L145-I149 VanDerWaalsContact O-N 3.13Å |
| 146 | A | 95.1 | Very high | 91.9 | Very high | 0 Ų | 0 | 18.3 Ų | 18.3 | 0% | 0 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -61.8 | -41.7 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | C116 P119 F120 L142 G144 I149 T150 | C116-A146 WeakPolarHBondContact O-CB 3.4Å; P119-A146 HydrophobicContact CB-CB 4.1Å; P119-A146 HydrophobicContact CG-CB 3.85Å; F120-A146 HydrophobicContact CB-CB 4.09Å; F120-A146 HydrophobicContact CD1-CB 3.51Å; F120-A146 HydrophobicContact CD2-CB 3.41Å; F120-A146 VanDerWaalsContact CD2-CB 3.41Å; F120-A146 HydrophobicContact CE1-CB 3.7Å; F120-A146 HydrophobicContact CE2-CB 3.61Å; F120-A146 HydrophobicContact CG-CB 3.35Å; F120-A146 HydrophobicContact CZ-CB 3.74Å; L142-A146 PolarHBondContact O-N 2.96Å; G144-A146 VanDerWaalsContact C-N 3.29Å; G144-A146 PolarHBondContact O-N 2.97Å; A146-I149 PolarHBondContact O-N 3.32Å; A146-T150 WeakPolarHBondContact O-CB 3.39Å; A146-T150 PolarHBondContact O-N 3.25Å; A146-T150 PolarHBondContact O-OG1 3.24Å |
| 147 | S | 92.5 | Very high | 91.7 | Very high | 2 Ų | 2 | 18.3 Ų | 18.3 | 1% | 0.014 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -61.8 | -44.6 | 176.7 | -65.9 | 0 | 0 | 0 | 0 | 112.6 | F53 F120 T143 G144 L145 T150 S151 | F53-S147 VanDerWaalsContact CD2-CB 3.46Å; F120-S147 WeakPolarHBondContact CE1-OG 3.29Å; T143-S147 WeakPolarHBondContact O-CB 3.48Å; T143-S147 PolarHBondContact O-N 3.37Å; T143-S147 PolarHBondContact O-OG 2.68Å; G144-S147 WeakPolarHBondContact O-CA 3.44Å; G144-S147 VanDerWaalsContact O-CB 3.3Å; G144-S147 WeakPolarHBondContact O-CB 3.46Å; G144-S147 PolarHBondContact O-N 2.73Å; L145-S147 VanDerWaalsContact C-N 3.34Å; L145-S147 PolarHBondContact O-N 3.09Å; S147-T150 PolarHBondContact O-N 3.47Å; S147-S151 WeakPolarHBondContact O-CB 3.49Å; S147-S151 PolarHBondContact O-N 3.3Å |
| 148 | G | 90.3 | Very high | 91.3 | Very high | 0 Ų | 0 | 17.3 Ų | 17.3 | 0% | 0 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -59.5 | -49 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | A93 G144 L145 T150 S151 | A93-G148 VanDerWaalsContact O-CA 3.26Å; A93-G148 WeakPolarHBondContact O-CA 3.37Å; G144-G148 PolarHBondContact O-N 3.33Å; L145-G148 PolarHBondContact O-N 3.45Å; G148-T150 VanDerWaalsContact C-N 3.32Å; G148-T150 PolarHBondContact O-N 2.86Å; G148-S151 PolarHBondContact O-N 3.44Å; G148-S151 PolarHBondContact O-OG 3.45Å |
| 149 | I | 90.8 | Very high | 90.6 | Very high | 4 Ų | 4 | 15.4 Ų | 15.4 | 2% | 0.021 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -57.2 | -50.2 | 176 | -64 | 165.7 | 0 | 0 | 0 | 109.7 | G96 L99 M103 T112 C116 L145 A146 S151 L152 V153 | G96-I149 WeakPolarHBondContact O-CG1 3.36Å; G96-I149 PolarHBondContact O-N 3.36Å; L99-I149 HydrophobicContact CD2-CD1 4.28Å; M103-I149 HydrophobicContact SD-CD1 4.32Å; T112-I149 HydrophobicContact CG2-CG2 3.6Å; C116-I149 HydrophobicContact CB-CB 4.02Å; C116-I149 HydrophobicContact CB-CD1 4.21Å; C116-I149 HydrophobicContact CB-CG2 3.71Å; L145-I149 HydrophobicContact CG-CD1 4.39Å; L145-I149 WeakPolarHBondContact O-CG1 3.45Å; L145-I149 PolarHBondContact O-N 3.49Å; L145-I149 VanDerWaalsContact O-N 3.13Å; A146-I149 PolarHBondContact O-N 3.32Å; I149-S151 VanDerWaalsContact C-N 3.34Å; I149-S151 PolarHBondContact O-N 3.32Å; I149-L152 PolarHBondContact O-N 2.84Å; I149-V153 HydrophobicContact CG2-CG2 3.82Å; I149-V153 WeakPolarHBondContact O-CG2 3.33Å; I149-V153 PolarHBondContact O-N 3.45Å |
| 150 | T | 91 | Very high | 90.1 | Very high | 1 Ų | 1 | 16.5 Ų | 16.5 | 1% | 0.006 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -64.1 | -37.5 | -175.2 | -55.1 | 0 | 0 | 0 | 0 | 112.7 | C116 F120 A146 S147 G148 L152 V153 V154 | C116-T150 PolarHBondContact SG-OG1 3.42Å; F120-T150 WeakPolarHBondContact CE2-OG1 3.28Å; A146-T150 WeakPolarHBondContact O-CB 3.39Å; A146-T150 PolarHBondContact O-N 3.25Å; A146-T150 PolarHBondContact O-OG1 3.24Å; S147-T150 PolarHBondContact O-N 3.47Å; G148-T150 VanDerWaalsContact C-N 3.32Å; G148-T150 PolarHBondContact O-N 2.86Å; T150-L152 PolarHBondContact O-N 3.39Å; T150-V153 PolarHBondContact O-N 3.31Å; T150-V154 HydrophobicContact CG2-CG2 3.6Å; T150-V154 WeakPolarHBondContact O-CG2 3.44Å; T150-V154 PolarHBondContact O-N 2.92Å; T150-V154 VanDerWaalsContact O-N 3.14Å |
| 151 | S | 84.8 | Confident | 89.7 | Confident | 23 Ų | 23 | 16.5 Ų | 16.5 | 16% | 0.161 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -59.1 | -30 | 177.9 | 73.5 | 0 | 0 | 0 | 0 | 113.2 | S147 G148 I149 P155 | S147-S151 WeakPolarHBondContact O-CB 3.49Å; S147-S151 PolarHBondContact O-N 3.3Å; G148-S151 PolarHBondContact O-N 3.44Å; G148-S151 PolarHBondContact O-OG 3.45Å; I149-S151 VanDerWaalsContact C-N 3.34Å; I149-S151 PolarHBondContact O-N 3.32Å; S151-P155 VanDerWaalsContact O-CD 3.32Å; S151-P155 WeakPolarHBondContact O-CD 3.47Å; S151-P155 WeakPolarHBondContact O-CG 3.34Å |
| 152 | L | 82.6 | Confident | 89.1 | Confident | 27 Ų | 27 | 14.4 Ų | 14.4 | 14% | 0.141 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -91.5 | -43.4 | 178.6 | -179.1 | 142.4 | 0 | 0 | 0 | 112 | V104 I149 T150 L156 | V104-L152 HydrophobicContact CG2-CD2 4.17Å; I149-L152 PolarHBondContact O-N 2.84Å; T150-L152 PolarHBondContact O-N 3.39Å; L152-L156 HydrophobicContact CD2-CD1 3.65Å; L152-L156 HydrophobicContact CG-CD1 4.21Å; L152-L156 WeakPolarHBondContact O-CD1 3.38Å; L152-L156 WeakPolarHBondContact O-CG 3.37Å |
| 153 | V | 87.5 | Confident | 88.3 | Confident | 0 Ų | 0 | 13.4 Ų | 13.4 | 0% | 0 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -76.4 | -35.7 | -169.6 | -171.7 | 0 | 0 | 0 | 0 | 112.6 | V104 R109 T112 L113 I149 T150 L156 Y157 | V104-V153 HydrophobicContact CG2-CB 4.03Å; V104-V153 HydrophobicContact CG2-CG1 3.75Å; V104-V153 HydrophobicContact CG2-CG2 3.3Å; R109-V153 HydrophobicContact CB-CG1 4.16Å; R109-V153 HydrophobicContact CG-CG1 4.44Å; T112-V153 HydrophobicContact CG2-CG1 4.45Å; T112-V153 HydrophobicContact CG2-CG2 3.56Å; L113-V153 HydrophobicContact CD1-CG1 3.98Å; L113-V153 HydrophobicContact CD2-CB 3.8Å; L113-V153 HydrophobicContact CD2-CG1 3.81Å; L113-V153 HydrophobicContact CG-CB 4.13Å; L113-V153 HydrophobicContact CG-CG1 3.55Å; I149-V153 HydrophobicContact CG2-CG2 3.82Å; I149-V153 WeakPolarHBondContact O-CG2 3.33Å; I149-V153 PolarHBondContact O-N 3.45Å; T150-V153 PolarHBondContact O-N 3.31Å; V153-L156 WeakPolarHBondContact O-CB 3.37Å; V153-L156 PolarHBondContact O-N 3.38Å; V153-Y157 WeakPolarHBondContact O-CB 3.44Å; V153-Y157 PolarHBondContact O-N 3.13Å |
| 154 | V | 90.2 | Very high | 87.2 | Confident | 0 Ų | 0 | 18.6 Ų | 18.6 | 0% | 0 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -67.7 | -48.5 | -174.7 | 176.3 | 0 | 0 | 0 | 0 | 112.5 | A46 P50 L113 T150 L156 Y157 I158 V174 | A46-V154 HydrophobicContact CB-CG1 4.21Å; A46-V154 WeakPolarHBondContact O-CG1 3.39Å; P50-V154 HydrophobicContact CG-CB 3.99Å; P50-V154 HydrophobicContact CG-CG1 3.59Å; P50-V154 HydrophobicContact CG-CG2 4.25Å; L113-V154 HydrophobicContact CD1-CG2 4.36Å; L113-V154 HydrophobicContact CD2-CG2 3.36Å; T150-V154 HydrophobicContact CG2-CG2 3.6Å; T150-V154 WeakPolarHBondContact O-CG2 3.44Å; T150-V154 PolarHBondContact O-N 2.92Å; T150-V154 VanDerWaalsContact O-N 3.14Å; V154-L156 PolarHBondContact O-N 2.99Å; V154-Y157 PolarHBondContact O-N 3.4Å; V154-I158 HydrophobicContact CG1-CD1 3.77Å; V154-I158 HydrophobicContact CG1-CG1 4.44Å; V154-I158 WeakPolarHBondContact O-CG1 3.46Å; V154-I158 PolarHBondContact O-N 3.39Å; V154-V174 HydrophobicContact CG1-CG2 4.2Å |
| 155 | P | 83.9 | Confident | 86.2 | Confident | 56 Ų | 56 | 25.7 Ų | 25.7 | 36% | 0.364 | 13% | 0.134 | S | C | . | . | H | α-helix | trans | -56.9 | -38.6 | 172.8 | -24.4 | 34.2 | 0 | 0 | 0 | 112.5 | S151 S159 V174 | S151-P155 VanDerWaalsContact O-CD 3.32Å; S151-P155 WeakPolarHBondContact O-CD 3.47Å; S151-P155 WeakPolarHBondContact O-CG 3.34Å; P155-S159 WeakPolarHBondContact O-CB 3.3Å; P155-S159 PolarHBondContact O-N 3.47Å; P155-S159 PolarHBondContact O-OG 2.92Å; P155-V174 HydrophobicContact CG-CG1 4.31Å |
| 156 | L | 83.9 | Confident | 85.3 | Confident | 51 Ų | 51 | 24.6 Ų | 24.6 | 27% | 0.267 | 13% | 0.129 | S | C | . | . | H | α-helix | trans | -64.2 | -50.6 | 177 | -72.5 | 173.8 | 0 | 0 | 0 | 111.6 | V104 L152 V153 V154 I158 S159 E160 | V104-L156 HydrophobicContact CG1-CD1 4.2Å; L152-L156 HydrophobicContact CD2-CD1 3.65Å; L152-L156 HydrophobicContact CG-CD1 4.21Å; L152-L156 WeakPolarHBondContact O-CD1 3.38Å; L152-L156 WeakPolarHBondContact O-CG 3.37Å; V153-L156 WeakPolarHBondContact O-CB 3.37Å; V153-L156 PolarHBondContact O-N 3.38Å; V154-L156 PolarHBondContact O-N 2.99Å; L156-I158 VanDerWaalsContact C-N 3.34Å; L156-I158 PolarHBondContact O-N 3.36Å; L156-S159 WeakPolarHBondContact CA-OG 3.22Å; L156-S159 PolarHBondContact O-N 2.89Å; L156-S159 VanDerWaalsContact O-N 3.17Å; L156-S159 PolarHBondContact O-OG 2.91Å; L156-E160 WeakPolarHBondContact O-CB 3.49Å; L156-E160 WeakPolarHBondContact O-CG 3.46Å; L156-E160 PolarHBondContact O-N 3.26Å |
| 157 | Y | 89.8 | Confident | 84.5 | Confident | 0 Ų | 0 | 30.5 Ų | 30.5 | 0% | 0 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -57.5 | -46.1 | 178.5 | -178.3 | -92.4 | 0 | 0 | 0 | 111.7 | A42 A46 R109 L113 V153 V154 E160 T161 M212 P216 T218 | A42-Y157 HydrophobicContact CB-CE1 4.45Å; A46-Y157 HydrophobicContact CB-CD1 3.63Å; A46-Y157 HydrophobicContact CB-CE1 3.97Å; R109-Y157 HydrophobicContact CB-CD2 3.84Å; L113-Y157 HydrophobicContact CD1-CD2 4.32Å; L113-Y157 HydrophobicContact CD1-CG 4.06Å; V153-Y157 WeakPolarHBondContact O-CB 3.44Å; V153-Y157 PolarHBondContact O-N 3.13Å; V154-Y157 PolarHBondContact O-N 3.4Å; Y157-E160 PolarHBondContact O-N 3.44Å; Y157-T161 HydrophobicContact CD1-CG2 4.35Å; Y157-T161 HydrophobicContact CD2-CG2 4.44Å; Y157-T161 HydrophobicContact CE1-CG2 4.01Å; Y157-T161 HydrophobicContact CE2-CG2 4.09Å; Y157-T161 WeakPolarHBondContact O-CB 3.42Å; Y157-T161 WeakPolarHBondContact O-CG2 3.48Å; Y157-T161 PolarHBondContact O-N 2.93Å; Y157-T161 PolarHBondContact O-OG1 2.9Å; Y157-M212 HydrophobicContact CD1-CE 4.39Å; Y157-M212 HydrophobicContact CD2-CE 4.49Å; Y157-M212 HydrophobicContact CE1-CE 4.15Å; Y157-M212 HydrophobicContact CE2-CE 4.27Å; Y157-P216 PolarHBondContact OH-O 3.3Å; Y157-P216 VanDerWaalsContact OH-O 3.13Å; Y157-T218 HydrophobicContact CD2-CG2 3.52Å; Y157-T218 HydrophobicContact CE2-CG2 3.97Å; Y157-T218 HydrophobicContact CG-CG2 4.26Å |
| 158 | I | 87.2 | Confident | 83.5 | Confident | 2 Ų | 2 | 32.6 Ų | 32.6 | 1% | 0.01 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -63.9 | -43.9 | 177.1 | -68.6 | 169.1 | 0 | 0 | 0 | 110.6 | A46 V47 V154 L156 E160 T161 A162 L170 V174 | A46-I158 HydrophobicContact CB-CG1 4.43Å; V47-I158 HydrophobicContact CG1-CD1 3.61Å; V154-I158 HydrophobicContact CG1-CD1 3.77Å; V154-I158 HydrophobicContact CG1-CG1 4.44Å; V154-I158 WeakPolarHBondContact O-CG1 3.46Å; V154-I158 PolarHBondContact O-N 3.39Å; L156-I158 VanDerWaalsContact C-N 3.34Å; L156-I158 PolarHBondContact O-N 3.36Å; I158-E160 VanDerWaalsContact C-N 3.29Å; I158-E160 PolarHBondContact O-N 3.34Å; I158-T161 PolarHBondContact O-N 3.31Å; I158-T161 PolarHBondContact O-OG1 3.19Å; I158-A162 WeakPolarHBondContact O-CB 3.25Å; I158-A162 PolarHBondContact O-N 3.33Å; I158-L170 HydrophobicContact CG2-CB 3.49Å; I158-L170 VanDerWaalsContact CG2-CB 3.49Å; I158-V174 HydrophobicContact CD1-CG2 3.43Å; I158-V174 VanDerWaalsContact CD1-CG2 3.43Å |
| 159 | S | 82.4 | Confident | 83 | Confident | 32 Ų | 32 | 37.5 Ų | 37.5 | 22% | 0.224 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -66.4 | -29.2 | -178.8 | 75.5 | 0 | 0 | 0 | 0 | 114.1 | P155 L156 | P155-S159 WeakPolarHBondContact O-CB 3.3Å; P155-S159 PolarHBondContact O-N 3.47Å; P155-S159 PolarHBondContact O-OG 2.92Å; L156-S159 WeakPolarHBondContact CA-OG 3.22Å; L156-S159 PolarHBondContact O-N 2.89Å; L156-S159 VanDerWaalsContact O-N 3.17Å; L156-S159 PolarHBondContact O-OG 2.91Å |
| 160 | E | 84.8 | Confident | 82.6 | Confident | 24 Ų | 24 | 37.8 Ų | 37.8 | 11% | 0.112 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -90.9 | -20.5 | 179.7 | -69.7 | 178.5 | -173.3 | 0 | 0 | 113.1 | R109 L156 Y157 I158 T218 R220 | R109-E160 WeakPolarHBondContact CD-OE2 3.12Å; R109-E160 IonicContact CZ-OE1 2.78Å; R109-E160 VanDerWaalsContact CZ-OE1 3.3Å; R109-E160 IonicContact CZ-OE2 2.84Å; R109-E160 VanDerWaalsContact NE-CD 3.34Å; R109-E160 IonicContact NE-OE1 3.62Å; R109-E160 PolarHBondContact NE-OE1 3.44Å; R109-E160 VanDerWaalsContact NE-OE1 3.1Å; R109-E160 IonicContact NE-OE2 3.43Å; R109-E160 PolarHBondContact NE-OE2 2.92Å; R109-E160 IonicContact NH2-OE1 3.4Å; R109-E160 PolarHBondContact NH2-OE1 3.47Å; R109-E160 IonicContact NH2-OE2 3.42Å; L156-E160 WeakPolarHBondContact O-CB 3.49Å; L156-E160 WeakPolarHBondContact O-CG 3.46Å; L156-E160 PolarHBondContact O-N 3.26Å; Y157-E160 PolarHBondContact O-N 3.44Å; I158-E160 VanDerWaalsContact C-N 3.29Å; I158-E160 PolarHBondContact O-N 3.34Å; E160-T218 HydrophobicContact CB-CG2 3.83Å; E160-T218 VanDerWaalsContact OE2-CB 3.23Å; E160-T218 WeakPolarHBondContact OE2-CB 3.39Å; E160-T218 WeakPolarHBondContact OE2-CG2 3.3Å; E160-T218 PolarHBondContact OE2-OG1 3.22Å; E160-R220 HydrophobicContact CB-CB 4.5Å; E160-R220 HydrophobicContact CG-CB 4.36Å |
| 161 | T | 86.6 | Confident | 81.9 | Confident | 0 Ų | 0 | 39.4 Ų | 39.4 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -94 | -31.5 | 175.5 | 53 | 0 | 0 | 0 | 0 | 112.6 | L39 Y157 I158 T218 L238 R239 | L39-T161 WeakPolarHBondContact CD1-O 3.44Å; Y157-T161 HydrophobicContact CD1-CG2 4.35Å; Y157-T161 HydrophobicContact CD2-CG2 4.44Å; Y157-T161 HydrophobicContact CE1-CG2 4.01Å; Y157-T161 HydrophobicContact CE2-CG2 4.09Å; Y157-T161 WeakPolarHBondContact O-CB 3.42Å; Y157-T161 WeakPolarHBondContact O-CG2 3.48Å; Y157-T161 PolarHBondContact O-N 2.93Å; Y157-T161 PolarHBondContact O-OG1 2.9Å; I158-T161 PolarHBondContact O-N 3.31Å; I158-T161 PolarHBondContact O-OG1 3.19Å; T161-T218 HydrophobicContact CG2-CG2 4.04Å; T161-L238 HydrophobicContact CG2-CD1 3.88Å; T161-R239 VanDerWaalsContact O-CZ 3.32Å; T161-R239 PolarHBondContact O-NH1 3.35Å; T161-R239 PolarHBondContact O-NH2 3.41Å |
| 162 | A | 83.9 | Confident | 81.7 | Confident | 10 Ų | 10 | 40.3 Ų | 40.3 | 8% | 0.083 | 22% | 0.221 | C | C | . | . | S | Bend | trans | -78.4 | 140.4 | -178.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | I158 V166 R167 L170 | I158-A162 WeakPolarHBondContact O-CB 3.25Å; I158-A162 PolarHBondContact O-N 3.33Å; A162-V166 HydrophobicContact CB-CG2 4.29Å; A162-R167 HydrophobicContact CB-CB 3.93Å; A162-R167 HydrophobicContact CB-CG 4.29Å; A162-L170 HydrophobicContact CB-CD1 3.77Å |
| 163 | H | 79.9 | Confident | 81.9 | Confident | 14 Ų | 14 | 41.2 Ų | 41.2 | 7% | 0.065 | 23% | 0.23 | C | C | . | . | trans | -82.5 | 162.6 | 168.2 | 66.7 | -79.2 | 0 | 0 | 0 | 110.5 | N36 K165 V166 R167 | N36-H163 PolarHBondContact OD1-CE1 2.68Å; H163-K165 VanDerWaalsContact C-N 3.31Å; H163-K165 PolarHBondContact O-N 2.84Å; H163-K165 VanDerWaalsContact O-N 3.14Å; H163-V166 WeakPolarHBondContact CE1-CG2 3.43Å; H163-V166 WeakPolarHBondContact ND1-CG2 3.26Å; H163-V166 PolarHBondContact O-N 2.92Å; H163-V166 VanDerWaalsContact O-N 3.15Å; H163-R167 WeakPolarHBondContact O-CB 3.38Å; H163-R167 PolarHBondContact O-N 3.25Å; H163-R167 VanDerWaalsContact O-N 3.09Å | ||
| 164 | E | 73.8 | Confident | 81.9 | Confident | 109 Ų | 109 | 42.2 Ų | 42.2 | 51% | 0.509 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -52.4 | -40.8 | -168.1 | -67.2 | 165.1 | -157.4 | 0 | 0 | 114.1 | Q27 V166 R251 | Q27-E164 PolarHBondContact NE2-OE2 3.44Å; E164-V166 PolarHBondContact O-N 3.02Å; E164-R251 IonicContact OE1-CZ 3.18Å; E164-R251 IonicContact OE1-NH1 2.83Å; E164-R251 PolarHBondContact OE1-NH1 3.26Å; E164-R251 IonicContact OE1-NH2 3.54Å; E164-R251 PolarHBondContact OE1-NH2 3.15Å |
| 165 | K | 73.3 | Confident | 81.7 | Confident | 149 Ų | 149 | 44.4 Ų | 44.4 | 65% | 0.648 | 25% | 0.246 | S | C | * | . | H | α-helix | trans | -65.4 | -32.6 | -177.8 | -72.1 | -176.9 | 169.9 | 164.6 | 0 | 114.7 | L31 H163 | L31-K165 HydrophobicContact CD1-CD 3.85Å; L31-K165 VanDerWaalsContact CD1-CE 3.47Å; L31-K165 HydrophobicContact CD1-CG 4.33Å; L31-K165 HydrophobicContact CD2-CD 4.3Å; H163-K165 VanDerWaalsContact C-N 3.31Å; H163-K165 PolarHBondContact O-N 2.84Å; H163-K165 VanDerWaalsContact O-N 3.14Å |
| 166 | V | 77.7 | Confident | 81.9 | Confident | 13 Ų | 13 | 44.2 Ų | 44.2 | 8% | 0.079 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -109.5 | -8.8 | -174.9 | -59.7 | 0 | 0 | 0 | 0 | 113.5 | L39 A162 H163 E164 G168 M169 L170 | L39-V166 HydrophobicContact CD2-CG2 3.71Å; A162-V166 HydrophobicContact CB-CG2 4.29Å; H163-V166 WeakPolarHBondContact CE1-CG2 3.43Å; H163-V166 WeakPolarHBondContact ND1-CG2 3.26Å; H163-V166 PolarHBondContact O-N 2.92Å; H163-V166 VanDerWaalsContact O-N 3.15Å; E164-V166 PolarHBondContact O-N 3.02Å; V166-G168 VanDerWaalsContact C-N 3.34Å; V166-G168 PolarHBondContact O-N 3.3Å; V166-M169 HydrophobicContact CB-CE 4.36Å; V166-M169 PolarHBondContact O-N 2.88Å; V166-L170 HydrophobicContact CB-CD1 4.37Å; V166-L170 HydrophobicContact CG2-CD1 3.88Å; V166-L170 WeakPolarHBondContact O-CG 3.44Å; V166-L170 PolarHBondContact O-N 2.94Å |
| 167 | R | 77.3 | Confident | 82.4 | Confident | 124 Ų | 124 | 43.6 Ų | 43.6 | 47% | 0.468 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -58.2 | -42.1 | -175.4 | -179.4 | 175.1 | 169.5 | -174.1 | -2 | 113 | A162 H163 G171 | A162-R167 HydrophobicContact CB-CB 3.93Å; A162-R167 HydrophobicContact CB-CG 4.29Å; H163-R167 WeakPolarHBondContact O-CB 3.38Å; H163-R167 PolarHBondContact O-N 3.25Å; H163-R167 VanDerWaalsContact O-N 3.09Å; R167-G171 PolarHBondContact O-N 3.42Å |
| 168 | G | 71.8 | Confident | 82.5 | Confident | 46 Ų | 46 | 44 Ų | 44 | 47% | 0.474 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -62 | -49.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | V166 L170 G171 S172 | V166-G168 VanDerWaalsContact C-N 3.34Å; V166-G168 PolarHBondContact O-N 3.3Å; G168-L170 PolarHBondContact O-N 2.86Å; G168-G171 PolarHBondContact O-N 3.35Å; G168-S172 PolarHBondContact O-N 3.12Å; G168-S172 PolarHBondContact O-OG 2.88Å |
| 169 | M | 79.9 | Confident | 82.7 | Confident | 103 Ų | 103 | 43.9 Ų | 43.9 | 51% | 0.507 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -57.6 | -48.3 | 177.4 | -178.9 | -176.4 | 68.7 | 0 | 0 | 112 | Y40 V166 G171 S172 C173 | Y40-M169 HydrophobicContact CE1-CE 3.85Å; V166-M169 HydrophobicContact CB-CE 4.36Å; V166-M169 PolarHBondContact O-N 2.88Å; M169-G171 VanDerWaalsContact C-N 3.31Å; M169-G171 PolarHBondContact O-N 3.46Å; M169-S172 PolarHBondContact O-N 3.2Å; M169-C173 PolarHBondContact O-N 3.43Å; M169-C173 VanDerWaalsContact O-N 3.14Å; M169-C173 PolarHBondContact O-SG 2.78Å; M169-C173 VanDerWaalsContact O-SG 3.35Å |
| 170 | L | 82.1 | Confident | 83.3 | Confident | 10 Ų | 10 | 44.7 Ų | 44.7 | 5% | 0.052 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -67.9 | -31.8 | 179.8 | -63.5 | 174.6 | 0 | 0 | 0 | 112.3 | L39 Y40 S43 I158 A162 V166 G168 C173 | L39-L170 HydrophobicContact CD2-CD1 4.34Å; L39-L170 HydrophobicContact CG-CD1 4.25Å; Y40-L170 HydrophobicContact CD1-CD2 4.04Å; Y40-L170 HydrophobicContact CE1-CD2 4.28Å; S43-L170 WeakPolarHBondContact OG-CD1 3.15Å; I158-L170 HydrophobicContact CG2-CB 3.49Å; I158-L170 VanDerWaalsContact CG2-CB 3.49Å; A162-L170 HydrophobicContact CB-CD1 3.77Å; V166-L170 HydrophobicContact CB-CD1 4.37Å; V166-L170 HydrophobicContact CG2-CD1 3.88Å; V166-L170 WeakPolarHBondContact O-CG 3.44Å; V166-L170 PolarHBondContact O-N 2.94Å; G168-L170 PolarHBondContact O-N 2.86Å; L170-C173 WeakPolarHBondContact O-CB 3.32Å; L170-C173 PolarHBondContact O-N 2.96Å |
| 171 | G | 76.8 | Confident | 83.8 | Confident | 35 Ų | 35 | 43.5 Ų | 43.5 | 36% | 0.361 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -62.3 | -46 | 170.7 | 0 | 0 | 0 | 0 | 0 | 112 | R167 G168 M169 C173 V174 | R167-G171 PolarHBondContact O-N 3.42Å; G168-G171 PolarHBondContact O-N 3.35Å; M169-G171 VanDerWaalsContact C-N 3.31Å; M169-G171 PolarHBondContact O-N 3.46Å; G171-C173 VanDerWaalsContact C-N 3.26Å; G171-C173 PolarHBondContact O-N 3.38Å; G171-V174 VanDerWaalsContact O-CB 3.27Å; G171-V174 WeakPolarHBondContact O-CB 3.09Å; G171-V174 WeakPolarHBondContact O-CG2 3.21Å; G171-V174 PolarHBondContact O-N 2.99Å; G171-V174 VanDerWaalsContact O-N 3.08Å |
| 172 | S | 80.5 | Confident | 84.1 | Confident | 41 Ų | 41 | 43.9 Ų | 43.9 | 29% | 0.287 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -62.4 | -31.1 | 176.7 | -63.2 | 0 | 0 | 0 | 0 | 113.2 | G168 M169 V174 Q175 L176 | G168-S172 PolarHBondContact O-N 3.12Å; G168-S172 PolarHBondContact O-OG 2.88Å; M169-S172 PolarHBondContact O-N 3.2Å; S172-V174 PolarHBondContact O-N 3.26Å; S172-Q175 PolarHBondContact O-N 3.01Å; S172-L176 PolarHBondContact O-N 2.82Å |
| 173 | C | 85.8 | Confident | 84.6 | Confident | 47 Ų | 47 | 45.4 Ų | 45.4 | 32% | 0.318 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -60.5 | -27.8 | 174.1 | -67.2 | 0 | 0 | 0 | 0 | 113.2 | V47 M169 L170 G171 L176 M177 | V47-C173 HydrophobicContact CG1-CB 4.38Å; M169-C173 PolarHBondContact O-N 3.43Å; M169-C173 VanDerWaalsContact O-N 3.14Å; M169-C173 PolarHBondContact O-SG 2.78Å; M169-C173 VanDerWaalsContact O-SG 3.35Å; L170-C173 WeakPolarHBondContact O-CB 3.32Å; L170-C173 PolarHBondContact O-N 2.96Å; G171-C173 VanDerWaalsContact C-N 3.26Å; G171-C173 PolarHBondContact O-N 3.38Å; C173-L176 PolarHBondContact O-N 3.45Å; C173-M177 WeakPolarHBondContact O-CB 3.47Å; C173-M177 WeakPolarHBondContact O-CG 3.43Å; C173-M177 PolarHBondContact O-N 2.69Å |
| 174 | V | 87.6 | Confident | 85.3 | Confident | 21 Ų | 21 | 45.7 Ų | 45.7 | 13% | 0.127 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -59.5 | -56.4 | 177.6 | 175.2 | 0 | 0 | 0 | 0 | 110.3 | V47 P50 V154 P155 I158 G171 S172 L176 M177 V178 | V47-V174 HydrophobicContact CG1-CG2 4.38Å; P50-V174 HydrophobicContact CB-CG1 4Å; P50-V174 WeakPolarHBondContact CB-O 3.48Å; P50-V174 HydrophobicContact CG-CB 4.47Å; P50-V174 HydrophobicContact CG-CG1 3.7Å; V154-V174 HydrophobicContact CG1-CG2 4.2Å; P155-V174 HydrophobicContact CG-CG1 4.31Å; I158-V174 HydrophobicContact CD1-CG2 3.43Å; I158-V174 VanDerWaalsContact CD1-CG2 3.43Å; G171-V174 VanDerWaalsContact O-CB 3.27Å; G171-V174 WeakPolarHBondContact O-CB 3.09Å; G171-V174 WeakPolarHBondContact O-CG2 3.21Å; G171-V174 PolarHBondContact O-N 2.99Å; G171-V174 VanDerWaalsContact O-N 3.08Å; S172-V174 PolarHBondContact O-N 3.26Å; V174-L176 VanDerWaalsContact C-N 3.3Å; V174-L176 PolarHBondContact O-N 3Å; V174-M177 PolarHBondContact O-N 3.33Å; V174-V178 WeakPolarHBondContact O-CG2 3.39Å; V174-V178 PolarHBondContact O-N 3.27Å |
| 175 | Q | 86.4 | Confident | 86.3 | Confident | 45 Ų | 45 | 40.5 Ų | 40.5 | 21% | 0.21 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -64.3 | -38.8 | -178.6 | -175.5 | 62 | 28.2 | 0 | 0 | 111.2 | S172 M177 V178 V179 T326 P398 | S172-Q175 PolarHBondContact O-N 3.01Å; Q175-M177 VanDerWaalsContact C-N 3.31Å; Q175-M177 PolarHBondContact O-N 3.1Å; Q175-V178 WeakPolarHBondContact O-CB 3.43Å; Q175-V178 PolarHBondContact O-N 3.07Å; Q175-V179 PolarHBondContact O-N 3.16Å; Q175-V179 VanDerWaalsContact O-N 3.17Å; Q175-T326 HydrophobicContact CB-CG2 4.36Å; Q175-T326 HydrophobicContact CG-CG2 3.77Å; Q175-P398 HydrophobicContact CG-CB 4.38Å |
| 176 | L | 89.4 | Confident | 87.3 | Confident | 53 Ų | 53 | 33.7 Ų | 33.7 | 28% | 0.277 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -61.4 | -39.4 | 177.9 | -163.4 | 146.2 | 0 | 0 | 0 | 111.6 | S172 C173 V174 V179 L180 | S172-L176 PolarHBondContact O-N 2.82Å; C173-L176 PolarHBondContact O-N 3.45Å; V174-L176 VanDerWaalsContact C-N 3.3Å; V174-L176 PolarHBondContact O-N 3Å; L176-V179 WeakPolarHBondContact O-CG2 3.21Å; L176-V179 PolarHBondContact O-N 2.79Å; L176-L180 HydrophobicContact CD2-CD1 3.46Å; L176-L180 VanDerWaalsContact CD2-CD1 3.46Å; L176-L180 HydrophobicContact CD2-CG 3.96Å; L176-L180 WeakPolarHBondContact O-CB 3.48Å; L176-L180 WeakPolarHBondContact O-CG 3.21Å; L176-L180 PolarHBondContact O-N 2.86Å |
| 177 | M | 93 | Very high | 88 | Confident | 37 Ų | 37 | 36.8 Ų | 36.8 | 18% | 0.182 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -69 | -33.1 | 175.6 | -73.5 | -60.3 | 177.2 | 0 | 0 | 113.2 | V47 P50 M51 C173 V174 Q175 L180 G181 | V47-M177 HydrophobicContact CB-CB 4.33Å; V47-M177 HydrophobicContact CB-CG 3.76Å; V47-M177 HydrophobicContact CG2-CE 4.02Å; V47-M177 HydrophobicContact CG2-CG 3.76Å; V47-M177 WeakPolarHBondContact O-CB 3.45Å; P50-M177 HydrophobicContact CB-CB 4.33Å; M51-M177 WeakPolarHBondContact CA-O 3.43Å; M51-M177 HydrophobicContact CB-CB 4.25Å; C173-M177 WeakPolarHBondContact O-CB 3.47Å; C173-M177 WeakPolarHBondContact O-CG 3.43Å; C173-M177 PolarHBondContact O-N 2.69Å; V174-M177 PolarHBondContact O-N 3.33Å; Q175-M177 VanDerWaalsContact C-N 3.31Å; Q175-M177 PolarHBondContact O-N 3.1Å; M177-L180 HydrophobicContact SD-CD1 3.85Å; M177-G181 PolarHBondContact O-N 2.8Å |
| 178 | V | 92.1 | Very high | 88.8 | Confident | 8 Ų | 8 | 31.9 Ų | 31.9 | 5% | 0.048 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -60.5 | -49.7 | 172.8 | -179.6 | 0 | 0 | 0 | 0 | 110.7 | P50 F53 G54 L57 V174 Q175 G181 I182 | P50-V178 HydrophobicContact CB-CG2 3.62Å; P50-V178 WeakPolarHBondContact O-CA 3.49Å; F53-V178 HydrophobicContact CD1-CG1 4.01Å; F53-V178 HydrophobicContact CD1-CG2 3.73Å; F53-V178 HydrophobicContact CE1-CG1 4.04Å; F53-V178 HydrophobicContact CE1-CG2 4.12Å; G54-V178 VanDerWaalsContact CA-O 3.29Å; G54-V178 WeakPolarHBondContact CA-O 3.41Å; L57-V178 HydrophobicContact CD1-CG1 4.39Å; V174-V178 WeakPolarHBondContact O-CG2 3.39Å; V174-V178 PolarHBondContact O-N 3.27Å; Q175-V178 WeakPolarHBondContact O-CB 3.43Å; Q175-V178 PolarHBondContact O-N 3.07Å; V178-G181 WeakPolarHBondContact O-CA 3.41Å; V178-G181 PolarHBondContact O-N 3.06Å; V178-G181 VanDerWaalsContact O-N 3.11Å; V178-I182 HydrophobicContact CG1-CD1 4.28Å; V178-I182 PolarHBondContact O-N 3.37Å |
| 179 | V | 92.3 | Very high | 89.7 | Confident | 0 Ų | 0 | 30.5 Ų | 30.5 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -71.1 | -33.6 | -177.8 | -61 | 0 | 0 | 0 | 0 | 112.4 | Q175 L176 G181 I182 M183 Q322 V323 T326 | Q175-V179 PolarHBondContact O-N 3.16Å; Q175-V179 VanDerWaalsContact O-N 3.17Å; L176-V179 WeakPolarHBondContact O-CG2 3.21Å; L176-V179 PolarHBondContact O-N 2.79Å; V179-G181 VanDerWaalsContact C-N 3.27Å; V179-G181 PolarHBondContact O-N 3.47Å; V179-I182 PolarHBondContact O-N 3.06Å; V179-M183 WeakPolarHBondContact O-CB 3.43Å; V179-M183 PolarHBondContact O-N 3.3Å; V179-Q322 HydrophobicContact CB-CG 4.25Å; V179-Q322 HydrophobicContact CG1-CG 3.83Å; V179-V323 HydrophobicContact CB-CG2 4.18Å; V179-V323 HydrophobicContact CG2-CB 4.45Å; V179-V323 HydrophobicContact CG2-CG2 3.96Å; V179-T326 HydrophobicContact CG2-CG2 4.05Å |
| 180 | L | 94.4 | Very high | 90.2 | Very high | 49 Ų | 49 | 27.5 Ų | 27.5 | 26% | 0.257 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -62.4 | -36.8 | 168.7 | -77.9 | 177.9 | 0 | 0 | 0 | 111.8 | L176 M177 M183 G184 V323 | L176-L180 HydrophobicContact CD2-CD1 3.46Å; L176-L180 VanDerWaalsContact CD2-CD1 3.46Å; L176-L180 HydrophobicContact CD2-CG 3.96Å; L176-L180 WeakPolarHBondContact O-CB 3.48Å; L176-L180 WeakPolarHBondContact O-CG 3.21Å; L176-L180 PolarHBondContact O-N 2.86Å; M177-L180 HydrophobicContact SD-CD1 3.85Å; L180-M183 HydrophobicContact CD2-CE 3.85Å; L180-M183 PolarHBondContact O-N 3.23Å; L180-G184 PolarHBondContact O-N 3.3Å; L180-V323 HydrophobicContact CD2-CG1 3.76Å; L180-V323 HydrophobicContact CD2-CG2 4.02Å; L180-V323 HydrophobicContact CG-CG1 4.39Å; L180-V323 HydrophobicContact CG-CG2 4.49Å |
| 181 | G | 95.1 | Very high | 90.6 | Very high | 0 Ų | 0 | 34.5 Ų | 34.5 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -64 | -46 | 176 | 0 | 0 | 0 | 0 | 0 | 112.9 | F55 M177 V178 V179 G184 V185 | F55-G181 WeakPolarHBondContact CD2-O 3.24Å; M177-G181 PolarHBondContact O-N 2.8Å; V178-G181 WeakPolarHBondContact O-CA 3.41Å; V178-G181 PolarHBondContact O-N 3.06Å; V178-G181 VanDerWaalsContact O-N 3.11Å; V179-G181 VanDerWaalsContact C-N 3.27Å; V179-G181 PolarHBondContact O-N 3.47Å; G181-G184 PolarHBondContact O-N 3.46Å; G181-V185 PolarHBondContact O-N 2.88Å; G181-V185 VanDerWaalsContact O-N 3.11Å |
| 182 | I | 93.7 | Very high | 91.3 | Very high | 8 Ų | 8 | 35 Ų | 35 | 4% | 0.041 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -59 | -51.1 | 174.5 | -66.7 | 163.1 | 0 | 0 | 0 | 110.4 | G54 L57 V178 V179 G184 V185 Y186 M296 | G54-I182 VanDerWaalsContact O-CG1 3.31Å; G54-I182 WeakPolarHBondContact O-CG1 3.41Å; L57-I182 HydrophobicContact CB-CG1 4.4Å; V178-I182 HydrophobicContact CG1-CD1 4.28Å; V178-I182 PolarHBondContact O-N 3.37Å; V179-I182 PolarHBondContact O-N 3.06Å; I182-G184 VanDerWaalsContact C-N 3.29Å; I182-G184 PolarHBondContact O-N 3.08Å; I182-V185 PolarHBondContact O-N 3.06Å; I182-V185 VanDerWaalsContact O-N 3.15Å; I182-Y186 HydrophobicContact CG2-CD2 4.35Å; I182-Y186 HydrophobicContact CG2-CE1 4.13Å; I182-Y186 HydrophobicContact CG2-CE2 3.91Å; I182-Y186 PolarHBondContact O-N 3.39Å; I182-M296 HydrophobicContact CB-CE 4.47Å; I182-M296 HydrophobicContact CD1-CE 3.92Å; I182-M296 HydrophobicContact CG1-CE 4.5Å; I182-M296 HydrophobicContact CG2-CE 3.39Å |
| 183 | M | 94.8 | Very high | 91.9 | Very high | 42 Ų | 42 | 37.5 Ų | 37.5 | 21% | 0.207 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -58.5 | -42.3 | 178.9 | -175.2 | -167.6 | 73.7 | 0 | 0 | 111.6 | V179 L180 V185 Y186 L187 A319 L320 V323 | V179-M183 WeakPolarHBondContact O-CB 3.43Å; V179-M183 PolarHBondContact O-N 3.3Å; L180-M183 HydrophobicContact CD2-CE 3.85Å; L180-M183 PolarHBondContact O-N 3.23Å; M183-V185 VanDerWaalsContact C-N 3.29Å; M183-V185 PolarHBondContact O-N 2.89Å; M183-Y186 PolarHBondContact O-N 3.43Å; M183-L187 WeakPolarHBondContact O-CB 3.4Å; M183-L187 PolarHBondContact O-N 2.88Å; M183-A319 HydrophobicContact CB-CB 3.92Å; M183-A319 HydrophobicContact CG-CB 4.15Å; M183-L320 HydrophobicContact SD-CB 4.45Å; M183-L320 HydrophobicContact SD-CD1 4.06Å; M183-V323 HydrophobicContact CB-CG2 4.1Å; M183-V323 HydrophobicContact SD-CG2 3.88Å |
| 184 | G | 94.6 | Very high | 92.1 | Very high | 20 Ų | 20 | 35.6 Ų | 35.6 | 21% | 0.206 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -60.1 | -38.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | L180 G181 I182 A188 | L180-G184 PolarHBondContact O-N 3.3Å; G181-G184 PolarHBondContact O-N 3.46Å; I182-G184 VanDerWaalsContact C-N 3.29Å; I182-G184 PolarHBondContact O-N 3.08Å; G184-A188 VanDerWaalsContact O-CB 3.24Å; G184-A188 WeakPolarHBondContact O-CB 3.41Å; G184-A188 PolarHBondContact O-N 3.22Å |
| 185 | V | 94.8 | Very high | 92.4 | Very high | 0 Ų | 0 | 39.2 Ų | 39.2 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -72.3 | -42.6 | 176.3 | 169.1 | 0 | 0 | 0 | 0 | 112.6 | F55 P62 G181 I182 M183 L187 A188 G189 L197 | F55-V185 VanDerWaalsContact CA-CG2 3.46Å; F55-V185 HydrophobicContact CB-CG2 3.65Å; F55-V185 HydrophobicContact CD1-CG2 3.14Å; F55-V185 HydrophobicContact CD2-CG2 4.24Å; F55-V185 HydrophobicContact CE1-CG2 3.8Å; F55-V185 HydrophobicContact CG-CG2 3.41Å; F55-V185 VanDerWaalsContact CG-CG2 3.41Å; P62-V185 HydrophobicContact CG-CG1 4.27Å; G181-V185 PolarHBondContact O-N 2.88Å; G181-V185 VanDerWaalsContact O-N 3.11Å; I182-V185 PolarHBondContact O-N 3.06Å; I182-V185 VanDerWaalsContact O-N 3.15Å; M183-V185 VanDerWaalsContact C-N 3.29Å; M183-V185 PolarHBondContact O-N 2.89Å; V185-L187 VanDerWaalsContact C-N 3.29Å; V185-L187 PolarHBondContact O-N 3.37Å; V185-A188 PolarHBondContact O-N 3.24Å; V185-G189 PolarHBondContact O-N 2.7Å; V185-L197 HydrophobicContact CG1-CD1 4.14Å; V185-L197 HydrophobicContact CG1-CD2 4.09Å; V185-L197 HydrophobicContact CG1-CG 4.39Å |
| 186 | Y | 92.8 | Very high | 92.8 | Very high | 5 Ų | 5 | 44.5 Ų | 44.5 | 2% | 0.02 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -62.7 | -41.1 | 176 | -67.5 | -2.8 | 0 | 0 | 0 | 111.1 | G58 I182 M183 G189 L190 M296 S315 V316 A319 | G58-Y186 WeakPolarHBondContact O-CE1 3.49Å; I182-Y186 HydrophobicContact CG2-CD2 4.35Å; I182-Y186 HydrophobicContact CG2-CE1 4.13Å; I182-Y186 HydrophobicContact CG2-CE2 3.91Å; I182-Y186 PolarHBondContact O-N 3.39Å; M183-Y186 PolarHBondContact O-N 3.43Å; Y186-G189 PolarHBondContact O-N 3.22Å; Y186-L190 PolarHBondContact O-N 2.9Å; Y186-M296 HydrophobicContact CE2-CE 4.39Å; Y186-M296 PolarHBondContact OH-O 2.95Å; Y186-S315 VanDerWaalsContact CD2-O 3.28Å; Y186-S315 WeakPolarHBondContact CD2-O 3.46Å; Y186-V316 VanDerWaalsContact C-CG2 3.5Å; Y186-V316 WeakPolarHBondContact O-CG2 3.5Å; Y186-A319 HydrophobicContact CD2-CB 3.57Å; Y186-A319 HydrophobicContact CE2-CB 4Å |
| 187 | L | 93.8 | Very high | 93 | Very high | 79 Ų | 79 | 42 Ų | 42 | 41% | 0.414 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -65.6 | -44.6 | 176.6 | -178.3 | 64.9 | 0 | 0 | 0 | 111.8 | M183 V185 G189 L190 F191 V316 | M183-L187 WeakPolarHBondContact O-CB 3.4Å; M183-L187 PolarHBondContact O-N 2.88Å; V185-L187 VanDerWaalsContact C-N 3.29Å; V185-L187 PolarHBondContact O-N 3.37Å; L187-G189 VanDerWaalsContact C-N 3.31Å; L187-G189 PolarHBondContact O-N 3.14Å; L187-L190 HydrophobicContact CD1-CD1 4.1Å; L187-L190 WeakPolarHBondContact O-CB 3.37Å; L187-L190 WeakPolarHBondContact O-CG 3.48Å; L187-L190 PolarHBondContact O-N 2.97Å; L187-F191 HydrophobicContact CD1-CE2 4.06Å; L187-F191 HydrophobicContact CG-CE2 4.42Å; L187-F191 WeakPolarHBondContact O-CD2 3.43Å; L187-F191 WeakPolarHBondContact O-CE2 3.28Å; L187-V316 HydrophobicContact CD1-CG1 4.38Å |
| 188 | A | 93.4 | Very high | 93.1 | Very high | 21 Ų | 21 | 40.2 Ų | 40.2 | 17% | 0.174 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -64.1 | -38.6 | 177 | 0 | 0 | 0 | 0 | 0 | 111.5 | G184 V185 L190 F191 V192 L197 | G184-A188 VanDerWaalsContact O-CB 3.24Å; G184-A188 WeakPolarHBondContact O-CB 3.41Å; G184-A188 PolarHBondContact O-N 3.22Å; V185-A188 PolarHBondContact O-N 3.24Å; A188-L190 PolarHBondContact O-N 3.3Å; A188-L190 VanDerWaalsContact O-N 3.13Å; A188-F191 PolarHBondContact O-N 3.3Å; A188-V192 WeakPolarHBondContact O-CG2 3.39Å; A188-V192 PolarHBondContact O-N 3.37Å; A188-V192 VanDerWaalsContact O-N 3.14Å; A188-L197 HydrophobicContact CB-CD1 3.58Å |
| 189 | G | 90.7 | Very high | 93.2 | Very high | 17 Ų | 17 | 42.6 Ų | 42.6 | 18% | 0.175 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -58.4 | -21.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | V185 Y186 L187 F191 | V185-G189 PolarHBondContact O-N 2.7Å; Y186-G189 PolarHBondContact O-N 3.22Å; L187-G189 VanDerWaalsContact C-N 3.31Å; L187-G189 PolarHBondContact O-N 3.14Å; G189-F191 PolarHBondContact O-N 2.87Å |
| 190 | L | 89.5 | Confident | 93.3 | Very high | 39 Ų | 39 | 44.6 Ų | 44.6 | 20% | 0.204 | 23% | 0.225 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -67.2 | -25.2 | 172.8 | -56.1 | -172.3 | 0 | 0 | 0 | 113.6 | Y186 L187 A188 E312 L313 V316 | Y186-L190 PolarHBondContact O-N 2.9Å; L187-L190 HydrophobicContact CD1-CD1 4.1Å; L187-L190 WeakPolarHBondContact O-CB 3.37Å; L187-L190 WeakPolarHBondContact O-CG 3.48Å; L187-L190 PolarHBondContact O-N 2.97Å; A188-L190 PolarHBondContact O-N 3.3Å; A188-L190 VanDerWaalsContact O-N 3.13Å; L190-E312 HydrophobicContact CD2-CB 3.4Å; L190-L313 HydrophobicContact CD1-CD2 3.66Å; L190-L313 HydrophobicContact CD2-CD2 4.42Å; L190-V316 HydrophobicContact CD1-CG2 4.08Å; L190-V316 HydrophobicContact CD2-CG2 4.06Å; L190-V316 HydrophobicContact CG-CG2 4.1Å |
| 191 | F | 90.9 | Very high | 93.3 | Very high | 158 Ų | 158 | 42.2 Ų | 42.2 | 69% | 0.693 | 21% | 0.213 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -118.7 | -16.6 | -166.9 | -56.5 | -69.7 | 0 | 0 | 0 | 113.4 | L187 A188 G189 | L187-F191 HydrophobicContact CD1-CE2 4.06Å; L187-F191 HydrophobicContact CG-CE2 4.42Å; L187-F191 WeakPolarHBondContact O-CD2 3.43Å; L187-F191 WeakPolarHBondContact O-CE2 3.28Å; A188-F191 PolarHBondContact O-N 3.3Å; G189-F191 PolarHBondContact O-N 2.87Å |
| 192 | V | 92.5 | Very high | 93.3 | Very high | 44 Ų | 44 | 43.2 Ų | 43.2 | 27% | 0.267 | 22% | 0.219 | S | C | . | . | S | Bend | trans | -138.1 | 143 | -171.1 | -48.5 | 0 | 0 | 0 | 0 | 112.4 | A188 W196 L197 | A188-V192 WeakPolarHBondContact O-CG2 3.39Å; A188-V192 PolarHBondContact O-N 3.37Å; A188-V192 VanDerWaalsContact O-N 3.14Å; V192-W196 HydrophobicContact CB-CB 3.75Å; V192-W196 HydrophobicContact CG1-CB 4.49Å; V192-W196 HydrophobicContact CG2-CB 4.05Å; V192-L197 HydrophobicContact CG2-CB 3.86Å; V192-L197 HydrophobicContact CG2-CD1 4.14Å |
| 193 | D | 91.3 | Very high | 93.3 | Very high | 95 Ų | 95 | 48 Ų | 48 | 51% | 0.508 | 24% | 0.244 | S | C | . | . | trans | -64.4 | 160.9 | 175.5 | -52 | -36.8 | 0 | 0 | 0 | 112.5 | E66 R195 W196 L197 | E66-D193 WeakPolarHBondContact OE1-CA 3.21Å; E66-D193 WeakPolarHBondContact OE1-CB 3.17Å; D193-R195 PolarHBondContact O-N 2.94Å; D193-W196 PolarHBondContact O-N 2.86Å; D193-L197 WeakPolarHBondContact O-CB 3.49Å; D193-L197 PolarHBondContact O-N 3.14Å | ||
| 194 | W | 92 | Very high | 93.3 | Very high | 6 Ų | 6 | 46.5 Ų | 46.5 | 2% | 0.023 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -48.9 | -33.2 | -179.5 | 70.1 | -87.7 | 0 | 0 | 0 | 115.2 | Y59 A63 E66 L67 L75 I127 A130 L136 A198 | Y59-W194 PolarHBondContact OH-O 2.98Å; A63-W194 HydrophobicContact CB-CB 4.33Å; E66-W194 PolarHBondContact OE1-N 2.95Å; E66-W194 WeakPolarHBondContact OE2-CB 3.41Å; E66-W194 PolarHBondContact OE2-N 3.21Å; L67-W194 HydrophobicContact CD2-CD2 3.88Å; L67-W194 HydrophobicContact CD2-CE3 4.43Å; L67-W194 HydrophobicContact CD2-CG 4.11Å; L67-W194 HydrophobicContact CD2-CZ2 4.18Å; L67-W194 HydrophobicContact CG-CD2 4.48Å; L67-W194 HydrophobicContact CG-CG 4.35Å; L75-W194 HydrophobicContact CD1-CZ2 4.22Å; I127-W194 HydrophobicContact CG2-CE3 4.18Å; I127-W194 HydrophobicContact CG2-CZ3 4Å; I127-W194 WeakPolarHBondContact O-CZ3 3.33Å; A130-W194 HydrophobicContact CB-CH2 4.11Å; A130-W194 HydrophobicContact CB-CZ3 4.34Å; L136-W194 HydrophobicContact CD2-CE3 4.49Å; L136-W194 HydrophobicContact CD2-CH2 4.35Å; L136-W194 HydrophobicContact CD2-CZ3 3.81Å; W194-A198 PolarHBondContact O-N 3.28Å |
| 195 | R | 93.7 | Very high | 93.3 | Very high | 98 Ų | 98 | 45.5 Ų | 45.5 | 37% | 0.37 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -71.8 | -48.1 | 176.5 | -73 | -169.7 | 171.9 | 116.4 | 0.8 | 112.3 | I128 A130 D193 L197 A198 I199 | I128-R195 PolarHBondContact O-NE 2.89Å; A130-R195 PolarHBondContact O-NH2 3.04Å; D193-R195 PolarHBondContact O-N 2.94Å; R195-L197 VanDerWaalsContact C-N 3.27Å; R195-A198 WeakPolarHBondContact O-CB 3.31Å; R195-A198 PolarHBondContact O-N 2.73Å; R195-I199 PolarHBondContact O-N 3.2Å; R195-I199 VanDerWaalsContact O-N 3.08Å |
| 196 | W | 94.3 | Very high | 93.2 | Very high | 155 Ų | 155 | 47.8 Ų | 47.8 | 59% | 0.587 | 24% | 0.244 | S | C | * | . | H | α-helix | trans | -67.1 | -34.8 | 176.6 | -75.4 | 109.5 | 0 | 0 | 0 | 111 | V192 D193 A198 I199 C200 | V192-W196 HydrophobicContact CB-CB 3.75Å; V192-W196 HydrophobicContact CG1-CB 4.49Å; V192-W196 HydrophobicContact CG2-CB 4.05Å; D193-W196 PolarHBondContact O-N 2.86Å; W196-A198 VanDerWaalsContact C-N 3.32Å; W196-A198 PolarHBondContact O-N 2.81Å; W196-I199 HydrophobicContact CD2-CD1 4.15Å; W196-I199 HydrophobicContact CE3-CD1 3.56Å; W196-I199 HydrophobicContact CZ3-CD1 3.81Å; W196-I199 WeakPolarHBondContact O-CB 3.4Å; W196-I199 PolarHBondContact O-N 3.35Å; W196-I199 VanDerWaalsContact O-N 3.14Å; W196-C200 PolarHBondContact O-N 3.09Å; W196-C200 PolarHBondContact O-SG 3.15Å; W196-C200 VanDerWaalsContact O-SG 3.39Å |
| 197 | L | 94.1 | Very high | 93.3 | Very high | 1 Ų | 1 | 52 Ų | 52 | 1% | 0.005 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -60.4 | -42.6 | 171.7 | -171.7 | 62.3 | 0 | 0 | 0 | 111.1 | Y59 P62 V185 A188 V192 D193 R195 I199 C200 C201 | Y59-L197 HydrophobicContact CD2-CB 4.5Å; Y59-L197 HydrophobicContact CD2-CD2 3.74Å; Y59-L197 HydrophobicContact CD2-CG 3.81Å; Y59-L197 HydrophobicContact CE2-CB 3.97Å; Y59-L197 HydrophobicContact CE2-CD2 3.82Å; Y59-L197 HydrophobicContact CE2-CG 3.79Å; P62-L197 HydrophobicContact CB-CD2 4.22Å; P62-L197 HydrophobicContact CG-CD2 3.44Å; P62-L197 VanDerWaalsContact CG-CD2 3.44Å; V185-L197 HydrophobicContact CG1-CD1 4.14Å; V185-L197 HydrophobicContact CG1-CD2 4.09Å; V185-L197 HydrophobicContact CG1-CG 4.39Å; A188-L197 HydrophobicContact CB-CD1 3.58Å; V192-L197 HydrophobicContact CG2-CB 3.86Å; V192-L197 HydrophobicContact CG2-CD1 4.14Å; D193-L197 WeakPolarHBondContact O-CB 3.49Å; D193-L197 PolarHBondContact O-N 3.14Å; R195-L197 VanDerWaalsContact C-N 3.27Å; L197-I199 VanDerWaalsContact C-N 3.33Å; L197-I199 PolarHBondContact O-N 2.9Å; L197-C200 WeakPolarHBondContact O-CB 3.36Å; L197-C200 PolarHBondContact O-N 3.25Å; L197-C201 PolarHBondContact O-N 3.02Å; L197-C201 PolarHBondContact O-SG 2.94Å |
| 198 | A | 94.4 | Very high | 93.4 | Very high | 0 Ų | 0 | 48.2 Ų | 48.2 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -63.9 | -35.7 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y59 F124 I127 I128 W194 R195 W196 C201 S202 | Y59-A198 HydrophobicContact CE2-CB 4.04Å; F124-A198 HydrophobicContact CD1-CB 4.14Å; I127-A198 HydrophobicContact CB-CB 4.41Å; I127-A198 HydrophobicContact CG2-CB 3.85Å; I128-A198 HydrophobicContact CD1-CB 4.46Å; I128-A198 HydrophobicContact CG1-CB 3.72Å; W194-A198 PolarHBondContact O-N 3.28Å; R195-A198 WeakPolarHBondContact O-CB 3.31Å; R195-A198 PolarHBondContact O-N 2.73Å; W196-A198 VanDerWaalsContact C-N 3.32Å; W196-A198 PolarHBondContact O-N 2.81Å; A198-C201 PolarHBondContact O-N 3.43Å; A198-S202 PolarHBondContact O-N 2.96Å; A198-S202 VanDerWaalsContact O-N 3.16Å |
| 199 | I | 95.1 | Very high | 93.4 | Very high | 58 Ų | 58 | 49.7 Ų | 49.7 | 30% | 0.297 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -61.7 | -48.8 | 171.9 | -65.1 | 167.6 | 0 | 0 | 0 | 110 | I128 R195 W196 L197 C201 S202 | I128-I199 HydrophobicContact CD1-CB 4.36Å; I128-I199 HydrophobicContact CD1-CG1 3.5Å; I128-I199 HydrophobicContact CG1-CG1 3.84Å; I128-I199 HydrophobicContact CG2-CD1 4.49Å; I128-I199 HydrophobicContact CG2-CG1 4.35Å; R195-I199 PolarHBondContact O-N 3.2Å; R195-I199 VanDerWaalsContact O-N 3.08Å; W196-I199 HydrophobicContact CD2-CD1 4.15Å; W196-I199 HydrophobicContact CE3-CD1 3.56Å; W196-I199 HydrophobicContact CZ3-CD1 3.81Å; W196-I199 WeakPolarHBondContact O-CB 3.4Å; W196-I199 PolarHBondContact O-N 3.35Å; W196-I199 VanDerWaalsContact O-N 3.14Å; L197-I199 VanDerWaalsContact C-N 3.33Å; L197-I199 PolarHBondContact O-N 2.9Å; I199-C201 VanDerWaalsContact C-N 3.26Å; I199-C201 PolarHBondContact O-N 3.47Å; I199-S202 WeakPolarHBondContact O-CB 3.39Å; I199-S202 PolarHBondContact O-N 3.49Å; I199-S202 PolarHBondContact O-OG 2.88Å |
| 200 | C | 94.6 | Very high | 93.6 | Very high | 41 Ų | 41 | 53 Ų | 53 | 28% | 0.277 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -56.7 | -40.8 | 175.9 | -68.2 | 0 | 0 | 0 | 0 | 111.9 | W196 L197 S202 L203 P204 | W196-C200 PolarHBondContact O-N 3.09Å; W196-C200 PolarHBondContact O-SG 3.15Å; W196-C200 VanDerWaalsContact O-SG 3.39Å; L197-C200 WeakPolarHBondContact O-CB 3.36Å; L197-C200 PolarHBondContact O-N 3.25Å; C200-S202 PolarHBondContact O-N 2.71Å; C200-L203 WeakPolarHBondContact O-CB 3.42Å; C200-L203 PolarHBondContact O-N 2.8Å; C200-P204 WeakPolarHBondContact O-CD 3.39Å |
| 201 | C | 93.7 | Very high | 93.8 | Very high | 0 Ų | 0 | 52.2 Ų | 52.2 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -67.2 | -21.3 | 177.4 | -60.1 | 0 | 0 | 0 | 0 | 114.1 | F55 F124 L197 A198 I199 L203 P205 | F55-C201 HydrophobicContact CB-CB 4.25Å; F55-C201 HydrophobicContact CD1-CB 4Å; F124-C201 HydrophobicContact CD1-CB 3.85Å; F124-C201 HydrophobicContact CD2-CB 4.18Å; F124-C201 HydrophobicContact CE1-CB 3.29Å; F124-C201 HydrophobicContact CE2-CB 3.66Å; F124-C201 WeakPolarHBondContact CE2-O 3.19Å; F124-C201 HydrophobicContact CG-CB 4.27Å; F124-C201 HydrophobicContact CZ-CB 3.19Å; L197-C201 PolarHBondContact O-N 3.02Å; L197-C201 PolarHBondContact O-SG 2.94Å; A198-C201 PolarHBondContact O-N 3.43Å; I199-C201 VanDerWaalsContact C-N 3.26Å; I199-C201 PolarHBondContact O-N 3.47Å; C201-L203 VanDerWaalsContact C-N 3.34Å; C201-P205 VanDerWaalsContact O-CD 3.28Å; C201-P205 WeakPolarHBondContact O-CD 3.18Å |
| 202 | S | 94.1 | Very high | 93.9 | Very high | 20 Ų | 20 | 44.7 Ų | 44.7 | 14% | 0.14 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -79.8 | -13.6 | 176 | 77.6 | 0 | 0 | 0 | 0 | 113.7 | A198 I199 C200 P205 S206 | A198-S202 PolarHBondContact O-N 2.96Å; A198-S202 VanDerWaalsContact O-N 3.16Å; I199-S202 WeakPolarHBondContact O-CB 3.39Å; I199-S202 PolarHBondContact O-N 3.49Å; I199-S202 PolarHBondContact O-OG 2.88Å; C200-S202 PolarHBondContact O-N 2.71Å; S202-P205 WeakPolarHBondContact O-CD 3.4Å; S202-P205 WeakPolarHBondContact O-CG 3.09Å; S202-S206 WeakPolarHBondContact O-CB 3.2Å; S202-S206 PolarHBondContact O-N 3.24Å; S202-S206 PolarHBondContact O-OG 2.86Å |
| 203 | L | 94.3 | Very high | 93.9 | Very high | 108 Ų | 108 | 45.7 Ų | 45.7 | 57% | 0.565 | 24% | 0.241 | S | C | * | . | H | α-helix | trans | -69.1 | -51.6 | -177.8 | -61.7 | 172.4 | 0 | 0 | 0 | 113 | C200 C201 S206 L207 | C200-L203 WeakPolarHBondContact O-CB 3.42Å; C200-L203 PolarHBondContact O-N 2.8Å; C201-L203 VanDerWaalsContact C-N 3.34Å; L203-S206 PolarHBondContact O-N 2.94Å; L203-L207 PolarHBondContact O-N 3.11Å |
| 204 | P | 94.4 | Very high | 94 | Very high | 11 Ų | 11 | 48.4 Ų | 48.4 | 7% | 0.071 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -57.1 | -44.4 | 179 | -23.5 | 35 | 0 | 0 | 0 | 115 | M51 S52 F55 C200 S206 L207 L208 | M51-P204 HydrophobicContact CG-CB 4.48Å; S52-P204 WeakPolarHBondContact OG-CB 3.3Å; F55-P204 HydrophobicContact CD2-CG 4.25Å; F55-P204 HydrophobicContact CE1-CG 4.41Å; F55-P204 HydrophobicContact CE2-CG 4.05Å; F55-P204 HydrophobicContact CZ-CG 4.14Å; C200-P204 WeakPolarHBondContact O-CD 3.39Å; P204-S206 VanDerWaalsContact C-N 3.34Å; P204-S206 PolarHBondContact O-N 3.05Å; P204-L207 PolarHBondContact O-N 3.01Å; P204-L208 WeakPolarHBondContact O-CB 3.48Å; P204-L208 PolarHBondContact O-N 3.43Å |
| 205 | P | 94.3 | Very high | 94.1 | Very high | 0 Ų | 0 | 48.6 Ų | 48.6 | 0% | 0 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -71.1 | -29.4 | 179 | 25.9 | -32.5 | 0 | 0 | 0 | 112.6 | S52 T117 F120 C201 S202 L208 M209 | S52-P205 VanDerWaalsContact OG-CD 3.3Å; S52-P205 WeakPolarHBondContact OG-CD 3.13Å; S52-P205 VanDerWaalsContact OG-N 3.17Å; T117-P205 WeakPolarHBondContact CG2-O 3.39Å; F120-P205 HydrophobicContact CB-CB 3.6Å; F120-P205 HydrophobicContact CB-CG 3.88Å; F120-P205 HydrophobicContact CD2-CB 3.88Å; F120-P205 HydrophobicContact CG-CB 3.88Å; F120-P205 HydrophobicContact CG-CG 4.31Å; C201-P205 VanDerWaalsContact O-CD 3.28Å; C201-P205 WeakPolarHBondContact O-CD 3.18Å; S202-P205 WeakPolarHBondContact O-CD 3.4Å; S202-P205 WeakPolarHBondContact O-CG 3.09Å; P205-L208 WeakPolarHBondContact O-CB 3.37Å; P205-L208 PolarHBondContact O-N 3.24Å; P205-M209 PolarHBondContact O-N 2.92Å; P205-M209 VanDerWaalsContact O-N 3.09Å |
| 206 | S | 94.2 | Very high | 94.1 | Very high | 48 Ų | 48 | 45 Ų | 45 | 34% | 0.336 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -67 | -42.3 | 173 | -58.4 | 0 | 0 | 0 | 0 | 111.2 | S202 L203 P204 M209 V210 | S202-S206 WeakPolarHBondContact O-CB 3.2Å; S202-S206 PolarHBondContact O-N 3.24Å; S202-S206 PolarHBondContact O-OG 2.86Å; L203-S206 PolarHBondContact O-N 2.94Å; P204-S206 VanDerWaalsContact C-N 3.34Å; P204-S206 PolarHBondContact O-N 3.05Å; S206-M209 PolarHBondContact O-N 3.37Å; S206-V210 PolarHBondContact O-N 3.34Å |
| 207 | L | 95.2 | Very high | 94.1 | Very high | 93 Ų | 93 | 38.7 Ų | 38.7 | 49% | 0.487 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -66 | -38.8 | 175 | -173.9 | 64.5 | 0 | 0 | 0 | 111.7 | L48 L203 P204 M209 V210 A211 | L48-L207 HydrophobicContact CD1-CB 4.03Å; L48-L207 HydrophobicContact CD1-CD2 3.73Å; L48-L207 HydrophobicContact CD1-CG 3.59Å; L48-L207 HydrophobicContact CD2-CD2 4.01Å; L203-L207 PolarHBondContact O-N 3.11Å; P204-L207 PolarHBondContact O-N 3.01Å; L207-M209 VanDerWaalsContact C-N 3.33Å; L207-M209 PolarHBondContact O-N 2.92Å; L207-V210 PolarHBondContact O-N 2.99Å; L207-A211 WeakPolarHBondContact O-CB 3.43Å; L207-A211 PolarHBondContact O-N 3.33Å |
| 208 | L | 94.5 | Very high | 93.9 | Very high | 0 Ų | 0 | 38.7 Ų | 38.7 | 0% | 0 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -55.7 | -47.3 | 173.1 | 170.7 | 64.7 | 0 | 0 | 0 | 111.2 | A45 L48 T117 P204 P205 V210 A211 M212 | A45-L208 WeakPolarHBondContact O-CD1 3.35Å; L48-L208 HydrophobicContact CB-CB 3.9Å; L48-L208 HydrophobicContact CB-CD1 4.36Å; T117-L208 HydrophobicContact CG2-CB 4.23Å; T117-L208 HydrophobicContact CG2-CD2 3.75Å; T117-L208 HydrophobicContact CG2-CG 3.87Å; P204-L208 WeakPolarHBondContact O-CB 3.48Å; P204-L208 PolarHBondContact O-N 3.43Å; P205-L208 WeakPolarHBondContact O-CB 3.37Å; P205-L208 PolarHBondContact O-N 3.24Å; L208-V210 PolarHBondContact O-N 3.48Å; L208-A211 PolarHBondContact O-N 2.88Å; L208-M212 HydrophobicContact CD1-CG 3.62Å; L208-M212 HydrophobicContact CG-CG 4.43Å; L208-M212 VanDerWaalsContact O-CB 3.31Å; L208-M212 WeakPolarHBondContact O-CB 3.5Å; L208-M212 VanDerWaalsContact O-CG 3.29Å; L208-M212 WeakPolarHBondContact O-CG 3.3Å; L208-M212 PolarHBondContact O-N 3.05Å |
| 209 | M | 94.4 | Very high | 93.7 | Very high | 51 Ų | 51 | 38.7 Ų | 38.7 | 25% | 0.251 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -57.4 | -52.2 | 179 | -178.1 | 64.9 | 109.4 | 0 | 0 | 111.2 | M114 T117 L118 P205 S206 L207 M212 C213 | M114-M209 HydrophobicContact CB-SD 3.8Å; M114-M209 HydrophobicContact CE-SD 3.81Å; M114-M209 HydrophobicContact CG-SD 4.13Å; M114-M209 WeakPolarHBondContact O-CE 3.38Å; T117-M209 HydrophobicContact CG2-CB 4Å; T117-M209 WeakPolarHBondContact OG1-CE 3.44Å; T117-M209 PolarHBondContact OG1-SD 3.24Å; L118-M209 HydrophobicContact CD2-CE 3.97Å; L118-M209 HydrophobicContact CG-CE 4.33Å; P205-M209 PolarHBondContact O-N 2.92Å; P205-M209 VanDerWaalsContact O-N 3.09Å; S206-M209 PolarHBondContact O-N 3.37Å; L207-M209 VanDerWaalsContact C-N 3.33Å; L207-M209 PolarHBondContact O-N 2.92Å; M209-M212 PolarHBondContact O-N 3.46Å; M209-C213 PolarHBondContact O-N 3.28Å; M209-C213 PolarHBondContact O-SG 3.18Å |
| 210 | V | 94.8 | Very high | 93.3 | Very high | 87 Ų | 87 | 39.7 Ų | 39.7 | 53% | 0.527 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -64.3 | -45.3 | -178.3 | 176.9 | 0 | 0 | 0 | 0 | 111.1 | S206 L207 L208 M212 C213 F214 | S206-V210 PolarHBondContact O-N 3.34Å; L207-V210 PolarHBondContact O-N 2.99Å; L208-V210 PolarHBondContact O-N 3.48Å; V210-M212 VanDerWaalsContact C-N 3.35Å; V210-M212 PolarHBondContact O-N 3Å; V210-C213 WeakPolarHBondContact O-CB 3.31Å; V210-C213 PolarHBondContact O-N 3.3Å; V210-F214 HydrophobicContact CG1-CE2 4.22Å; V210-F214 WeakPolarHBondContact O-CD2 3.39Å; V210-F214 WeakPolarHBondContact O-CE2 3.28Å |
| 211 | A | 94.4 | Very high | 92.9 | Very high | 23 Ų | 23 | 38.6 Ų | 38.6 | 19% | 0.19 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -63.7 | -40.7 | -178.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | A45 L48 L207 L208 C213 F214 | A45-A211 HydrophobicContact CB-CB 3.66Å; L48-A211 HydrophobicContact CD1-CB 4.46Å; L207-A211 WeakPolarHBondContact O-CB 3.43Å; L207-A211 PolarHBondContact O-N 3.33Å; L208-A211 PolarHBondContact O-N 2.88Å; A211-C213 VanDerWaalsContact C-N 3.33Å; A211-C213 PolarHBondContact O-N 3.19Å; A211-F214 PolarHBondContact O-N 3.07Å |
| 212 | M | 92.8 | Very high | 92.7 | Very high | 0 Ų | 0 | 39.1 Ų | 39.1 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -70.9 | -24.4 | -178.7 | -74 | -60.1 | -116.3 | 0 | 0 | 113.9 | A45 A46 K110 L113 M114 Y157 L208 M209 V210 F214 M215 | A45-M212 HydrophobicContact CB-CG 4.5Å; A45-M212 HydrophobicContact CB-SD 3.91Å; A46-M212 HydrophobicContact CB-CE 4.13Å; K110-M212 WeakPolarHBondContact CE-O 3.25Å; L113-M212 HydrophobicContact CB-CE 3.9Å; L113-M212 HydrophobicContact CD1-CE 3.19Å; L113-M212 HydrophobicContact CG-CE 4.13Å; M114-M212 HydrophobicContact CG-CB 3.85Å; M114-M212 HydrophobicContact SD-CB 4.46Å; Y157-M212 HydrophobicContact CD1-CE 4.39Å; Y157-M212 HydrophobicContact CD2-CE 4.49Å; Y157-M212 HydrophobicContact CE1-CE 4.15Å; Y157-M212 HydrophobicContact CE2-CE 4.27Å; L208-M212 HydrophobicContact CD1-CG 3.62Å; L208-M212 HydrophobicContact CG-CG 4.43Å; L208-M212 VanDerWaalsContact O-CB 3.31Å; L208-M212 WeakPolarHBondContact O-CB 3.5Å; L208-M212 VanDerWaalsContact O-CG 3.29Å; L208-M212 WeakPolarHBondContact O-CG 3.3Å; L208-M212 PolarHBondContact O-N 3.05Å; M209-M212 PolarHBondContact O-N 3.46Å; V210-M212 VanDerWaalsContact C-N 3.35Å; V210-M212 PolarHBondContact O-N 3Å; M212-F214 PolarHBondContact O-N 2.91Å; M212-M215 PolarHBondContact O-N 3.22Å; M212-M215 VanDerWaalsContact O-N 3.09Å; M212-M215 HydrophobicContact SD-CB 4.04Å; M212-M215 HydrophobicContact SD-CG 4.05Å |
| 213 | C | 92.7 | Very high | 92.4 | Very high | 64 Ų | 64 | 38.8 Ų | 38.8 | 43% | 0.432 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -52 | -39.2 | 172.1 | -71.2 | 0 | 0 | 0 | 0 | 112 | K110 M114 M209 V210 A211 | K110-C213 PolarHBondContact NZ-O 3.42Å; K110-C213 VanDerWaalsContact NZ-O 3.16Å; M114-C213 WeakPolarHBondContact CE-SG 3.3Å; M209-C213 PolarHBondContact O-N 3.28Å; M209-C213 PolarHBondContact O-SG 3.18Å; V210-C213 WeakPolarHBondContact O-CB 3.31Å; V210-C213 PolarHBondContact O-N 3.3Å; A211-C213 VanDerWaalsContact C-N 3.33Å; A211-C213 PolarHBondContact O-N 3.19Å |
| 214 | F | 92.8 | Very high | 91.9 | Very high | 152 Ų | 152 | 37 Ų | 37 | 67% | 0.667 | 20% | 0.203 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -87.5 | -6 | -176.8 | -57.5 | -75.5 | 0 | 0 | 0 | 114.6 | V210 A211 M212 | V210-F214 HydrophobicContact CG1-CE2 4.22Å; V210-F214 WeakPolarHBondContact O-CD2 3.39Å; V210-F214 WeakPolarHBondContact O-CE2 3.28Å; A211-F214 PolarHBondContact O-N 3.07Å; M212-F214 PolarHBondContact O-N 2.91Å |
| 215 | M | 94.1 | Very high | 91.4 | Very high | 11 Ų | 11 | 41.6 Ų | 41.6 | 5% | 0.054 | 22% | 0.222 | C | C | . | . | S | Bend | trans | -94.1 | 150.3 | -178 | -62.5 | -54.7 | 118.9 | 0 | 0 | 111.4 | L41 A42 A45 K110 M212 F237 | L41-M215 HydrophobicContact CD2-CE 3.72Å; L41-M215 HydrophobicContact CG-CE 3.74Å; L41-M215 HydrophobicContact CG-SD 4.28Å; A42-M215 WeakPolarHBondContact CA-SD 3.3Å; A42-M215 HydrophobicContact CB-CG 4.28Å; A42-M215 HydrophobicContact CB-SD 3.67Å; A45-M215 HydrophobicContact CB-CG 4Å; K110-M215 VanDerWaalsContact CD-O 3.29Å; K110-M215 WeakPolarHBondContact CD-O 3.49Å; K110-M215 VanDerWaalsContact CE-O 3.26Å; K110-M215 WeakPolarHBondContact CE-O 3.29Å; K110-M215 PolarHBondContact NZ-O 3.03Å; M212-M215 PolarHBondContact O-N 3.22Å; M212-M215 VanDerWaalsContact O-N 3.09Å; M212-M215 HydrophobicContact SD-CB 4.04Å; M212-M215 HydrophobicContact SD-CG 4.05Å; M215-F237 HydrophobicContact SD-CE1 4.23Å; M215-F237 HydrophobicContact SD-CZ 4.36Å |
| 216 | P | 92.9 | Very high | 91 | Very high | 21 Ų | 21 | 44.8 Ų | 44.8 | 14% | 0.136 | 26% | 0.255 | C | S | . | . | P | Polyproline II helix | trans | -76.1 | 165.5 | 176 | 32.7 | -35.9 | 0 | 0 | 0 | 112 | Y157 A234 F237 L238 | Y157-P216 PolarHBondContact OH-O 3.3Å; Y157-P216 VanDerWaalsContact OH-O 3.13Å; P216-A234 HydrophobicContact CB-CB 3.83Å; P216-A234 HydrophobicContact CG-CB 4.5Å; P216-F237 HydrophobicContact CG-CB 4.47Å; P216-F237 HydrophobicContact CG-CD1 3.63Å; P216-F237 HydrophobicContact CG-CE1 4.15Å; P216-F237 HydrophobicContact CG-CG 4.23Å; P216-L238 HydrophobicContact CG-CD1 4.49Å; P216-L238 HydrophobicContact CG-CD2 4.16Å; P216-L238 HydrophobicContact CG-CG 4.13Å |
| 217 | E | 94.1 | Very high | 90.8 | Very high | 24 Ų | 24 | 46.9 Ų | 46.9 | 11% | 0.112 | 26% | 0.258 | C | S | . | . | P | Polyproline II helix | trans | -76.7 | 161.6 | 166.2 | -175.1 | 57.3 | -84 | 0 | 0 | 110.5 | G108 R109 K110 F221 L222 | G108-E217 WeakPolarHBondContact CA-OE2 3.24Å; R109-E217 WeakPolarHBondContact CA-OE1 3.41Å; R109-E217 WeakPolarHBondContact CB-OE1 3.31Å; R109-E217 VanDerWaalsContact N-CD 3.33Å; R109-E217 PolarHBondContact N-OE1 3.37Å; R109-E217 PolarHBondContact N-OE2 3.46Å; K110-E217 HydrophobicContact CB-CB 4.35Å; K110-E217 WeakPolarHBondContact CB-OE2 3.27Å; K110-E217 VanDerWaalsContact N-CD 3.31Å; K110-E217 PolarHBondContact N-OE1 3.38Å; K110-E217 PolarHBondContact N-OE2 3.19Å; E217-F221 HydrophobicContact CG-CD1 3.59Å; E217-F221 HydrophobicContact CG-CE1 4.28Å; E217-F221 HydrophobicContact CG-CG 4.43Å; E217-L222 HydrophobicContact CB-CD1 4.19Å; E217-L222 HydrophobicContact CB-CD2 4.29Å; E217-L222 HydrophobicContact CB-CG 4.24Å; E217-L222 HydrophobicContact CG-CD2 4.26Å; E217-L222 HydrophobicContact CG-CG 4.22Å |
| 218 | T | 90.7 | Very high | 90.5 | Very high | 0 Ų | 0 | 46.4 Ų | 46.4 | 0% | 0 | 25% | 0.25 | C | C | . | . | P | Polyproline II helix | trans | -65.1 | 132.8 | -178.4 | 67.1 | 0 | 0 | 0 | 0 | 111.1 | R109 Y157 E160 T161 R220 F221 L222 | R109-T218 HydrophobicContact CB-CG2 3.88Å; R109-T218 HydrophobicContact CG-CG2 4Å; Y157-T218 HydrophobicContact CD2-CG2 3.52Å; Y157-T218 HydrophobicContact CE2-CG2 3.97Å; Y157-T218 HydrophobicContact CG-CG2 4.26Å; E160-T218 HydrophobicContact CB-CG2 3.83Å; E160-T218 VanDerWaalsContact OE2-CB 3.23Å; E160-T218 WeakPolarHBondContact OE2-CB 3.39Å; E160-T218 WeakPolarHBondContact OE2-CG2 3.3Å; E160-T218 PolarHBondContact OE2-OG1 3.22Å; T161-T218 HydrophobicContact CG2-CG2 4.04Å; T218-R220 PolarHBondContact O-N 3Å; T218-F221 PolarHBondContact O-N 3.31Å; T218-F221 VanDerWaalsContact O-N 3.09Å; T218-F221 WeakPolarHBondContact OG1-CB 3.43Å; T218-F221 PolarHBondContact OG1-N 3.37Å; T218-L222 PolarHBondContact O-N 3.32Å; T218-L222 VanDerWaalsContact O-N 3.13Å |
| 219 | P | 89.6 | Confident | 90.3 | Very high | 1 Ų | 1 | 55.1 Ų | 55.1 | 1% | 0.006 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -55.4 | -41.2 | 178.8 | -26.8 | 34 | 0 | 0 | 0 | 112.4 | F221 L222 L223 A234 L235 L238 | P219-F221 PolarHBondContact O-N 3.47Å; P219-L222 PolarHBondContact O-N 3.16Å; P219-L223 WeakPolarHBondContact O-CG 3.45Å; P219-L223 PolarHBondContact O-N 3.21Å; P219-A234 HydrophobicContact CG-CB 4.28Å; P219-L235 HydrophobicContact CB-CD1 4.28Å; P219-L235 HydrophobicContact CB-CD2 3.9Å; P219-L235 HydrophobicContact CB-CG 3.79Å; P219-L235 HydrophobicContact CG-CD2 3.55Å; P219-L235 HydrophobicContact CG-CG 3.74Å; P219-L238 HydrophobicContact CG-CD1 3.99Å |
| 220 | R | 87.4 | Confident | 90.1 | Very high | 79 Ų | 79 | 56.4 Ų | 56.4 | 30% | 0.298 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -59.5 | -41.9 | 177.4 | -171.7 | 176.7 | -177.3 | 166.4 | 0.2 | 113 | E160 T218 S224 I252 Q259 | E160-R220 HydrophobicContact CB-CB 4.5Å; E160-R220 HydrophobicContact CG-CB 4.36Å; T218-R220 PolarHBondContact O-N 3Å; R220-S224 WeakPolarHBondContact O-CB 3.5Å; R220-S224 PolarHBondContact O-N 2.65Å; R220-I252 HydrophobicContact CB-CG2 4.14Å; R220-I252 HydrophobicContact CG-CG2 4Å; R220-Q259 VanDerWaalsContact NH2-CD 3.29Å |
| 221 | F | 86.7 | Confident | 89.9 | Confident | 17 Ų | 17 | 52.3 Ų | 52.3 | 8% | 0.075 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -66.6 | -43.4 | 176.5 | 176.1 | -103.1 | 0 | 0 | 0 | 111.6 | G108 R109 E217 T218 P219 L223 S224 K225 | G108-F221 VanDerWaalsContact CA-CE1 3.42Å; R109-F221 VanDerWaalsContact NH1-CD2 3.29Å; E217-F221 HydrophobicContact CG-CD1 3.59Å; E217-F221 HydrophobicContact CG-CE1 4.28Å; E217-F221 HydrophobicContact CG-CG 4.43Å; T218-F221 PolarHBondContact O-N 3.31Å; T218-F221 VanDerWaalsContact O-N 3.09Å; T218-F221 WeakPolarHBondContact OG1-CB 3.43Å; T218-F221 PolarHBondContact OG1-N 3.37Å; P219-F221 PolarHBondContact O-N 3.47Å; F221-L223 PolarHBondContact O-N 2.84Å; F221-S224 PolarHBondContact O-N 3.14Å; F221-S224 PolarHBondContact O-OG 3.31Å; F221-K225 HydrophobicContact CE1-CG 4.28Å; F221-K225 HydrophobicContact CE2-CG 4.26Å; F221-K225 HydrophobicContact CZ-CG 4.06Å; F221-K225 WeakPolarHBondContact O-CG 3.28Å; F221-K225 PolarHBondContact O-N 3.01Å |
| 222 | L | 88.8 | Confident | 89.7 | Confident | 11 Ų | 11 | 53 Ų | 53 | 6% | 0.058 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -62.1 | -44.1 | 179.1 | -66.9 | 169.8 | 0 | 0 | 0 | 111.7 | E217 T218 P219 K225 G226 K227 E230 A231 A234 | E217-L222 HydrophobicContact CB-CD1 4.19Å; E217-L222 HydrophobicContact CB-CD2 4.29Å; E217-L222 HydrophobicContact CB-CG 4.24Å; E217-L222 HydrophobicContact CG-CD2 4.26Å; E217-L222 HydrophobicContact CG-CG 4.22Å; T218-L222 PolarHBondContact O-N 3.32Å; T218-L222 VanDerWaalsContact O-N 3.13Å; P219-L222 PolarHBondContact O-N 3.16Å; L222-K225 PolarHBondContact O-N 3.35Å; L222-K225 VanDerWaalsContact O-N 3.14Å; L222-G226 PolarHBondContact O-N 3.1Å; L222-K227 HydrophobicContact CB-CB 4.42Å; L222-K227 HydrophobicContact CD2-CB 4.47Å; L222-K227 HydrophobicContact CD2-CD 4.17Å; L222-K227 WeakPolarHBondContact O-CB 3.45Å; L222-K227 PolarHBondContact O-N 3.45Å; L222-E230 HydrophobicContact CD1-CB 4.04Å; L222-E230 HydrophobicContact CD2-CB 4.09Å; L222-A231 HydrophobicContact CB-CB 3.76Å; L222-A231 HydrophobicContact CD1-CB 4.47Å; L222-A234 HydrophobicContact CD1-CB 4.02Å |
| 223 | L | 88.3 | Confident | 89.6 | Confident | 13 Ų | 13 | 57.9 Ų | 57.9 | 7% | 0.068 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -62.9 | -42.6 | 174.8 | -67.5 | 169.6 | 0 | 0 | 0 | 111.8 | P219 F221 K225 G226 R228 A231 I252 E253 | P219-L223 WeakPolarHBondContact O-CG 3.45Å; P219-L223 PolarHBondContact O-N 3.21Å; F221-L223 PolarHBondContact O-N 2.84Å; L223-K225 PolarHBondContact O-N 3.34Å; L223-G226 PolarHBondContact O-N 2.73Å; L223-R228 HydrophobicContact CD2-CB 4.34Å; L223-R228 HydrophobicContact CD2-CG 4.09Å; L223-A231 HydrophobicContact CD1-CB 4.32Å; L223-A231 HydrophobicContact CD2-CB 3.63Å; L223-A231 HydrophobicContact CG-CB 3.57Å; L223-I252 HydrophobicContact CB-CG2 4.44Å; L223-I252 HydrophobicContact CD1-CB 3.67Å; L223-I252 HydrophobicContact CD1-CD1 4.18Å; L223-I252 HydrophobicContact CD1-CG2 3.52Å; L223-E253 HydrophobicContact CB-CG 4.36Å; L223-E253 HydrophobicContact CD1-CG 4.38Å; L223-E253 HydrophobicContact CD2-CG 4.03Å; L223-E253 WeakPolarHBondContact CD2-OE1 3.07Å; L223-E253 HydrophobicContact CG-CG 4.48Å |
| 224 | S | 82.9 | Confident | 89.5 | Confident | 70 Ų | 70 | 55.1 Ų | 55.1 | 49% | 0.49 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -62.1 | -16.3 | 175.6 | 77.9 | 0 | 0 | 0 | 0 | 114.5 | R220 F221 | R220-S224 WeakPolarHBondContact O-CB 3.5Å; R220-S224 PolarHBondContact O-N 2.65Å; F221-S224 PolarHBondContact O-N 3.14Å; F221-S224 PolarHBondContact O-OG 3.31Å |
| 225 | K | 84.2 | Confident | 89.3 | Confident | 108 Ų | 108 | 47.9 Ų | 47.9 | 47% | 0.47 | 24% | 0.235 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -101.1 | 7.6 | 175 | -63.9 | -62.7 | -176.7 | -172.6 | 0 | 112.8 | Q105 F221 L222 L223 K227 | Q105-K225 PolarHBondContact O-NZ 3.49Å; F221-K225 HydrophobicContact CE1-CG 4.28Å; F221-K225 HydrophobicContact CE2-CG 4.26Å; F221-K225 HydrophobicContact CZ-CG 4.06Å; F221-K225 WeakPolarHBondContact O-CG 3.28Å; F221-K225 PolarHBondContact O-N 3.01Å; L222-K225 PolarHBondContact O-N 3.35Å; L222-K225 VanDerWaalsContact O-N 3.14Å; L223-K225 PolarHBondContact O-N 3.34Å; K225-K227 HydrophobicContact CB-CD 4.25Å; K225-K227 HydrophobicContact CB-CG 4.31Å; K225-K227 PolarHBondContact O-N 3.44Å |
| 226 | G | 85.7 | Confident | 89.1 | Confident | 68 Ų | 68 | 53.3 Ų | 53.3 | 70% | 0.701 | 26% | 0.255 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 70.8 | 13.2 | -176.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | L222 L223 R228 | L222-G226 PolarHBondContact O-N 3.1Å; L223-G226 PolarHBondContact O-N 2.73Å; G226-R228 VanDerWaalsContact C-N 3.32Å; G226-R228 PolarHBondContact O-N 3.48Å |
| 227 | K | 89.4 | Confident | 88.9 | Confident | 92 Ų | 92 | 54.9 Ų | 54.9 | 40% | 0.4 | 26% | 0.26 | S | S | . | . | trans | -90.9 | 59.7 | -177.6 | -67.3 | 172.7 | 151.8 | -124.1 | 0 | 111.4 | L222 K225 R229 E230 A231 | L222-K227 HydrophobicContact CB-CB 4.42Å; L222-K227 HydrophobicContact CD2-CB 4.47Å; L222-K227 HydrophobicContact CD2-CD 4.17Å; L222-K227 WeakPolarHBondContact O-CB 3.45Å; L222-K227 PolarHBondContact O-N 3.45Å; K225-K227 HydrophobicContact CB-CD 4.25Å; K225-K227 HydrophobicContact CB-CG 4.31Å; K225-K227 PolarHBondContact O-N 3.44Å; K227-R229 PolarHBondContact O-N 3.44Å; K227-E230 HydrophobicContact CB-CB 4.32Å; K227-E230 VanDerWaalsContact NZ-CD 3.28Å; K227-E230 IonicContact NZ-OE1 2.76Å; K227-E230 PolarHBondContact NZ-OE1 3.05Å; K227-E230 IonicContact NZ-OE2 3.62Å; K227-E230 PolarHBondContact NZ-OE2 3.31Å; K227-E230 PolarHBondContact O-N 3.43Å; K227-A231 PolarHBondContact O-N 3.34Å; K227-A231 VanDerWaalsContact O-N 3.11Å | ||
| 228 | R | 90.1 | Very high | 88.6 | Confident | 82 Ų | 82 | 53.7 Ų | 53.7 | 31% | 0.309 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -55.7 | -45 | -174.2 | -169 | -176.3 | -176 | 112.3 | 0.1 | 113.6 | L223 G226 E230 A231 E232 E253 | L223-R228 HydrophobicContact CD2-CB 4.34Å; L223-R228 HydrophobicContact CD2-CG 4.09Å; G226-R228 VanDerWaalsContact C-N 3.32Å; G226-R228 PolarHBondContact O-N 3.48Å; R228-E230 PolarHBondContact O-N 3.29Å; R228-A231 WeakPolarHBondContact O-CB 3.43Å; R228-A231 PolarHBondContact O-N 2.86Å; R228-A231 VanDerWaalsContact O-N 3.09Å; R228-E232 IonicContact NE-OE1 3.56Å; R228-E232 PolarHBondContact NE-OE1 2.91Å; R228-E232 PolarHBondContact O-N 3.29Å; R228-E253 IonicContact CZ-OE1 3.86Å; R228-E253 IonicContact CZ-OE2 3.63Å; R228-E253 IonicContact NH1-OE1 3.88Å; R228-E253 PolarHBondContact NH1-OE1 2.94Å; R228-E253 IonicContact NH1-OE2 3.62Å; R228-E253 PolarHBondContact NH1-OE2 3.13Å |
| 229 | R | 90 | Very high | 88.4 | Confident | 184 Ų | 184 | 53.8 Ų | 53.8 | 69% | 0.694 | 26% | 0.255 | S | S | * | . | H | α-helix | trans | -60.5 | -43.5 | -179.2 | -162 | -174.9 | 79.3 | 176.5 | 0.1 | 112.8 | K227 A231 E232 E233 | K227-R229 PolarHBondContact O-N 3.44Å; R229-A231 VanDerWaalsContact C-N 3.3Å; R229-A231 PolarHBondContact O-N 2.8Å; R229-E232 PolarHBondContact O-N 3.48Å; R229-E233 IonicContact NE-OE1 2.79Å; R229-E233 WeakPolarHBondContact O-CG 3.3Å; R229-E233 PolarHBondContact O-N 3.02Å; R229-E233 VanDerWaalsContact O-N 3.1Å |
| 230 | E | 90.8 | Very high | 88.1 | Confident | 78 Ų | 78 | 54.1 Ų | 54.1 | 36% | 0.364 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -66.1 | -35.8 | 176.5 | -66.9 | 176.5 | -145.4 | 0 | 0 | 111 | L222 K227 R228 E233 A234 | L222-E230 HydrophobicContact CD1-CB 4.04Å; L222-E230 HydrophobicContact CD2-CB 4.09Å; K227-E230 HydrophobicContact CB-CB 4.32Å; K227-E230 VanDerWaalsContact NZ-CD 3.28Å; K227-E230 IonicContact NZ-OE1 2.76Å; K227-E230 PolarHBondContact NZ-OE1 3.05Å; K227-E230 IonicContact NZ-OE2 3.62Å; K227-E230 PolarHBondContact NZ-OE2 3.31Å; K227-E230 PolarHBondContact O-N 3.43Å; R228-E230 PolarHBondContact O-N 3.29Å; E230-E233 PolarHBondContact O-N 3.29Å; E230-A234 WeakPolarHBondContact O-CB 3.43Å; E230-A234 PolarHBondContact O-N 3.32Å |
| 231 | A | 89.7 | Confident | 87.6 | Confident | 0 Ų | 0 | 55.1 Ų | 55.1 | 0% | 0 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -65.8 | -41.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | L222 L223 K227 R228 R229 A234 L235 | L222-A231 HydrophobicContact CB-CB 3.76Å; L222-A231 HydrophobicContact CD1-CB 4.47Å; L223-A231 HydrophobicContact CD1-CB 4.32Å; L223-A231 HydrophobicContact CD2-CB 3.63Å; L223-A231 HydrophobicContact CG-CB 3.57Å; K227-A231 PolarHBondContact O-N 3.34Å; K227-A231 VanDerWaalsContact O-N 3.11Å; R228-A231 WeakPolarHBondContact O-CB 3.43Å; R228-A231 PolarHBondContact O-N 2.86Å; R228-A231 VanDerWaalsContact O-N 3.09Å; R229-A231 VanDerWaalsContact C-N 3.3Å; R229-A231 PolarHBondContact O-N 2.8Å; A231-A234 PolarHBondContact O-N 3.26Å; A231-L235 WeakPolarHBondContact O-CG 3.38Å; A231-L235 PolarHBondContact O-N 3.43Å |
| 232 | E | 90.5 | Very high | 86.9 | Confident | 37 Ų | 37 | 58.6 Ų | 58.6 | 17% | 0.173 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -62.7 | -43.1 | 174.5 | -73.9 | 173.2 | -167.2 | 0 | 0 | 111.5 | R228 R229 A234 L235 R236 I245 | R228-E232 IonicContact NE-OE1 3.56Å; R228-E232 PolarHBondContact NE-OE1 2.91Å; R228-E232 PolarHBondContact O-N 3.29Å; R229-E232 PolarHBondContact O-N 3.48Å; E232-A234 PolarHBondContact O-N 2.87Å; E232-L235 PolarHBondContact O-N 2.89Å; E232-R236 WeakPolarHBondContact O-CG 3.45Å; E232-R236 PolarHBondContact O-N 3.34Å; E232-I245 HydrophobicContact CB-CD1 3.86Å; E232-I245 HydrophobicContact CG-CD1 4.16Å |
| 233 | E | 90.3 | Very high | 86.3 | Confident | 104 Ų | 104 | 58.5 Ų | 58.5 | 49% | 0.486 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -61.2 | -42.8 | 174.2 | -72.1 | 172.5 | -158.7 | 0 | 0 | 111.8 | R229 E230 R236 F237 | R229-E233 IonicContact NE-OE1 2.79Å; R229-E233 WeakPolarHBondContact O-CG 3.3Å; R229-E233 PolarHBondContact O-N 3.02Å; R229-E233 VanDerWaalsContact O-N 3.1Å; E230-E233 PolarHBondContact O-N 3.29Å; E233-R236 PolarHBondContact O-N 3.02Å; E233-F237 PolarHBondContact O-N 2.94Å |
| 234 | A | 90.7 | Very high | 85.7 | Confident | 5 Ų | 5 | 60.5 Ų | 60.5 | 4% | 0.041 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -63 | -42.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112 | P216 P219 L222 E230 A231 E232 F237 L238 | P216-A234 HydrophobicContact CB-CB 3.83Å; P216-A234 HydrophobicContact CG-CB 4.5Å; P219-A234 HydrophobicContact CG-CB 4.28Å; L222-A234 HydrophobicContact CD1-CB 4.02Å; E230-A234 WeakPolarHBondContact O-CB 3.43Å; E230-A234 PolarHBondContact O-N 3.32Å; A231-A234 PolarHBondContact O-N 3.26Å; E232-A234 PolarHBondContact O-N 2.87Å; A234-F237 WeakPolarHBondContact O-CB 3.19Å; A234-F237 PolarHBondContact O-N 2.89Å; A234-L238 VanDerWaalsContact O-CG 3.3Å; A234-L238 WeakPolarHBondContact O-CG 3.33Å; A234-L238 PolarHBondContact O-N 3.21Å |
| 235 | L | 89.3 | Confident | 85.7 | Confident | 1 Ų | 1 | 57.5 Ų | 57.5 | 1% | 0.005 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -66.3 | -42.8 | 175.9 | -76.7 | 172.6 | 0 | 0 | 0 | 112.2 | P219 A231 E232 F237 L238 R239 I245 E248 C249 | P219-L235 HydrophobicContact CB-CD1 4.28Å; P219-L235 HydrophobicContact CB-CD2 3.9Å; P219-L235 HydrophobicContact CB-CG 3.79Å; P219-L235 HydrophobicContact CG-CD2 3.55Å; P219-L235 HydrophobicContact CG-CG 3.74Å; A231-L235 WeakPolarHBondContact O-CG 3.38Å; A231-L235 PolarHBondContact O-N 3.43Å; E232-L235 PolarHBondContact O-N 2.89Å; L235-F237 PolarHBondContact O-N 2.91Å; L235-L238 PolarHBondContact O-N 2.88Å; L235-L238 VanDerWaalsContact O-N 3.12Å; L235-R239 HydrophobicContact CD2-CG 4.49Å; L235-R239 WeakPolarHBondContact O-CB 3.5Å; L235-R239 WeakPolarHBondContact O-CG 3.45Å; L235-R239 PolarHBondContact O-N 3.42Å; L235-I245 HydrophobicContact CB-CB 4.09Å; L235-I245 HydrophobicContact CB-CG2 3.78Å; L235-I245 HydrophobicContact CD1-CB 4.39Å; L235-E248 HydrophobicContact CD1-CB 4.42Å; L235-E248 HydrophobicContact CD1-CG 4.43Å; L235-E248 HydrophobicContact CD2-CG 4.35Å; L235-E248 WeakPolarHBondContact CD2-OE2 3.47Å; L235-C249 WeakPolarHBondContact CD1-SG 3.43Å |
| 236 | R | 89.2 | Confident | 85.6 | Confident | 124 Ų | 124 | 57.9 Ų | 57.9 | 47% | 0.468 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -58.9 | -37.8 | 172.9 | -72.9 | 178.1 | -179.9 | 168 | 6.6 | 111.5 | E232 E233 G240 I245 | E232-R236 WeakPolarHBondContact O-CG 3.45Å; E232-R236 PolarHBondContact O-N 3.34Å; E233-R236 PolarHBondContact O-N 3.02Å; R236-G240 CarbonylContact O-C 3.34Å; R236-G240 VanDerWaalsContact O-C 3.29Å; R236-G240 VanDerWaalsContact O-CA 3.24Å; R236-G240 WeakPolarHBondContact O-CA 3.46Å; R236-G240 PolarHBondContact O-N 3.35Å; R236-I245 HydrophobicContact CG-CD1 3.48Å; R236-I245 VanDerWaalsContact CG-CD1 3.48Å; R236-I245 HydrophobicContact CG-CG2 4.13Å |
| 237 | F | 89.3 | Confident | 85.4 | Confident | 54 Ų | 54 | 57.2 Ų | 57.2 | 24% | 0.237 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -65.1 | -47.1 | 173.9 | -177 | -85.1 | 0 | 0 | 0 | 111.7 | K38 M215 P216 E233 A234 L235 | K38-F237 HydrophobicContact CB-CD1 4.14Å; K38-F237 HydrophobicContact CB-CE1 3.87Å; K38-F237 HydrophobicContact CB-CZ 4.29Å; K38-F237 WeakPolarHBondContact CB-O 3.07Å; K38-F237 HydrophobicContact CD-CD1 4.2Å; K38-F237 HydrophobicContact CD-CD2 3.9Å; K38-F237 HydrophobicContact CD-CE1 4.19Å; K38-F237 HydrophobicContact CD-CE2 3.87Å; K38-F237 HydrophobicContact CD-CG 4.07Å; K38-F237 HydrophobicContact CD-CZ 4.03Å; K38-F237 WeakPolarHBondContact CD-O 3.23Å; K38-F237 HydrophobicContact CG-CE1 4.31Å; K38-F237 HydrophobicContact CG-CZ 4.24Å; M215-F237 HydrophobicContact SD-CE1 4.23Å; M215-F237 HydrophobicContact SD-CZ 4.36Å; P216-F237 HydrophobicContact CG-CB 4.47Å; P216-F237 HydrophobicContact CG-CD1 3.63Å; P216-F237 HydrophobicContact CG-CE1 4.15Å; P216-F237 HydrophobicContact CG-CG 4.23Å; E233-F237 PolarHBondContact O-N 2.94Å; A234-F237 WeakPolarHBondContact O-CB 3.19Å; A234-F237 PolarHBondContact O-N 2.89Å; L235-F237 PolarHBondContact O-N 2.91Å |
| 238 | L | 87.8 | Confident | 85.1 | Confident | 0 Ų | 0 | 53.6 Ų | 53.6 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -76.7 | -36.2 | -173.8 | -68.7 | 170.1 | 0 | 0 | 0 | 113.9 | L39 A42 T161 P216 P219 A234 L235 | L39-L238 HydrophobicContact CD1-CD2 4.26Å; A42-L238 HydrophobicContact CB-CD2 4.03Å; T161-L238 HydrophobicContact CG2-CD1 3.88Å; P216-L238 HydrophobicContact CG-CD1 4.49Å; P216-L238 HydrophobicContact CG-CD2 4.16Å; P216-L238 HydrophobicContact CG-CG 4.13Å; P219-L238 HydrophobicContact CG-CD1 3.99Å; A234-L238 VanDerWaalsContact O-CG 3.3Å; A234-L238 WeakPolarHBondContact O-CG 3.33Å; A234-L238 PolarHBondContact O-N 3.21Å; L235-L238 PolarHBondContact O-N 2.88Å; L235-L238 VanDerWaalsContact O-N 3.12Å |
| 239 | R | 86.1 | Confident | 84.8 | Confident | 2 Ų | 2 | 49.7 Ų | 49.7 | 1% | 0.008 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -99.3 | -19.7 | -175 | -56.7 | -59.9 | -179 | -111.8 | -4.4 | 113.6 | Y30 V34 K35 T161 L235 A243 E248 | Y30-R239 WeakPolarHBondContact OH-CD 3.24Å; Y30-R239 WeakPolarHBondContact OH-CG 3.11Å; Y30-R239 PolarHBondContact OH-NE 2.88Å; V34-R239 CarbonylContact C-O 3.5Å; V34-R239 WeakPolarHBondContact CA-O 3.27Å; V34-R239 HydrophobicContact CG1-CB 4.41Å; V34-R239 HydrophobicContact CG2-CB 4.37Å; K35-R239 PolarHBondContact N-O 3.44Å; T161-R239 VanDerWaalsContact O-CZ 3.32Å; T161-R239 PolarHBondContact O-NH1 3.35Å; T161-R239 PolarHBondContact O-NH2 3.41Å; L235-R239 HydrophobicContact CD2-CG 4.49Å; L235-R239 WeakPolarHBondContact O-CB 3.5Å; L235-R239 WeakPolarHBondContact O-CG 3.45Å; L235-R239 PolarHBondContact O-N 3.42Å; R239-A243 HydrophobicContact CB-CB 3.68Å; R239-E248 IonicContact CZ-OE1 3.68Å; R239-E248 IonicContact NE-OE1 3.22Å; R239-E248 PolarHBondContact NE-OE1 3.35Å; R239-E248 IonicContact NE-OE2 2.95Å; R239-E248 PolarHBondContact NE-OE2 3.32Å; R239-E248 IonicContact NH2-OE1 3.55Å; R239-E248 PolarHBondContact NH2-OE1 2.65Å |
| 240 | G | 83.3 | Confident | 84.5 | Confident | 7 Ų | 7 | 43.2 Ų | 43.2 | 7% | 0.072 | 22% | 0.22 | C | C | . | . | trans | 97 | 168.5 | -172.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | R236 D242 | R236-G240 CarbonylContact O-C 3.34Å; R236-G240 VanDerWaalsContact O-C 3.29Å; R236-G240 VanDerWaalsContact O-CA 3.24Å; R236-G240 WeakPolarHBondContact O-CA 3.46Å; R236-G240 PolarHBondContact O-N 3.35Å; G240-D242 VanDerWaalsContact C-N 3.33Å; G240-D242 PolarHBondContact O-N 3.11Å | ||
| 241 | P | 75.8 | Confident | 84.1 | Confident | 100 Ų | 100 | 44.7 Ų | 44.7 | 65% | 0.649 | 22% | 0.222 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -72.2 | -23.3 | -170.7 | 28 | -34.2 | 0 | 0 | 0 | 114.2 | ||
| 242 | D | 73.4 | Confident | 83.6 | Confident | 91 Ų | 91 | 46.3 Ų | 46.3 | 49% | 0.487 | 23% | 0.23 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -95.8 | -4.2 | -170.5 | -48.7 | -52.3 | 0 | 0 | 0 | 113.3 | K33 K35 G240 | K33-D242 VanDerWaalsContact CD-O 3.32Å; K33-D242 WeakPolarHBondContact CD-O 3.46Å; K35-D242 IonicContact NZ-OD2 3.97Å; K35-D242 PolarHBondContact NZ-OD2 3.06Å; G240-D242 VanDerWaalsContact C-N 3.33Å; G240-D242 PolarHBondContact O-N 3.11Å |
| 243 | A | 74.9 | Confident | 83.3 | Confident | 9 Ų | 9 | 46.9 Ų | 46.9 | 7% | 0.074 | 23% | 0.233 | C | C | . | . | S | Bend | trans | -79.7 | 135.6 | -177.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | Y30 V34 R239 I245 | Y30-A243 HydrophobicContact CE2-CB 4.41Å; V34-A243 HydrophobicContact CG2-CB 4.33Å; R239-A243 HydrophobicContact CB-CB 3.68Å; A243-I245 VanDerWaalsContact C-N 3.32Å; A243-I245 WeakPolarHBondContact O-CG2 3.27Å; A243-I245 PolarHBondContact O-N 3.06Å |
| 244 | P | 75.8 | Confident | 82.7 | Confident | 55 Ų | 55 | 46.7 Ų | 46.7 | 36% | 0.357 | 24% | 0.235 | S | C | . | . | trans | -72.1 | 88 | 175.9 | 26.2 | -27.6 | 0 | 0 | 0 | 110 | Y30 E246 | Y30-P244 HydrophobicContact CD2-CG 3.89Å; Y30-P244 HydrophobicContact CG-CG 4.43Å; P244-E246 VanDerWaalsContact C-N 3.35Å | ||
| 245 | I | 82.9 | Confident | 81.7 | Confident | 6 Ų | 6 | 47.3 Ų | 47.3 | 3% | 0.031 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -72.1 | -26.1 | -176.9 | 64 | -173.5 | 0 | 0 | 0 | 113.4 | E232 L235 R236 A243 W247 E248 C249 | E232-I245 HydrophobicContact CB-CD1 3.86Å; E232-I245 HydrophobicContact CG-CD1 4.16Å; L235-I245 HydrophobicContact CB-CB 4.09Å; L235-I245 HydrophobicContact CB-CG2 3.78Å; L235-I245 HydrophobicContact CD1-CB 4.39Å; R236-I245 HydrophobicContact CG-CD1 3.48Å; R236-I245 VanDerWaalsContact CG-CD1 3.48Å; R236-I245 HydrophobicContact CG-CG2 4.13Å; A243-I245 VanDerWaalsContact C-N 3.32Å; A243-I245 WeakPolarHBondContact O-CG2 3.27Å; A243-I245 PolarHBondContact O-N 3.06Å; I245-W247 VanDerWaalsContact C-N 3.31Å; I245-W247 PolarHBondContact O-N 3Å; I245-E248 PolarHBondContact O-N 3.43Å; I245-C249 PolarHBondContact O-N 3.29Å |
| 246 | E | 82.1 | Confident | 80.7 | Confident | 116 Ų | 116 | 48.6 Ų | 48.6 | 54% | 0.542 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -64.2 | -40 | -175.5 | -75.7 | 145.9 | -167.6 | 0 | 0 | 111 | P244 C249 S250 | P244-E246 VanDerWaalsContact C-N 3.35Å; E246-C249 PolarHBondContact O-N 3.25Å; E246-S250 PolarHBondContact O-N 3.08Å; E246-S250 PolarHBondContact O-OG 3.4Å |
| 247 | W | 81.9 | Confident | 79.4 | Confident | 54 Ų | 54 | 49.1 Ų | 49.1 | 21% | 0.205 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -59.2 | -47.4 | 172.7 | 175.2 | 91.6 | 0 | 0 | 0 | 111.9 | E26 Q27 Y30 I245 S250 R251 | E26-W247 VanDerWaalsContact OE2-CD1 3.32Å; E26-W247 PolarHBondContact OE2-NE1 3.02Å; Q27-W247 HydrophobicContact CB-CH2 4.28Å; Q27-W247 HydrophobicContact CB-CZ2 4.35Å; Q27-W247 HydrophobicContact CG-CH2 4.19Å; Y30-W247 HydrophobicContact CD1-CZ3 4.33Å; Y30-W247 HydrophobicContact CD2-CE3 4.32Å; Y30-W247 HydrophobicContact CG-CE3 4.38Å; Y30-W247 HydrophobicContact CG-CZ3 4.35Å; I245-W247 VanDerWaalsContact C-N 3.31Å; I245-W247 PolarHBondContact O-N 3Å; W247-S250 PolarHBondContact O-N 2.92Å; W247-R251 WeakPolarHBondContact O-CB 3.39Å; W247-R251 PolarHBondContact O-N 3.39Å; W247-R251 VanDerWaalsContact O-N 3.11Å |
| 248 | E | 82.4 | Confident | 77.9 | Confident | 16 Ų | 16 | 54.6 Ų | 54.6 | 8% | 0.075 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -67.8 | -37.7 | 179.8 | -171.7 | 176.1 | -170.3 | 0 | 0 | 111.5 | Y30 L235 R239 I245 I252 | Y30-E248 HydrophobicContact CE2-CB 4.36Å; Y30-E248 WeakPolarHBondContact CE2-OE2 3.46Å; Y30-E248 VanDerWaalsContact CZ-OE2 3.29Å; Y30-E248 PolarHBondContact OH-OE1 3.28Å; Y30-E248 PolarHBondContact OH-OE2 2.59Å; L235-E248 HydrophobicContact CD1-CB 4.42Å; L235-E248 HydrophobicContact CD1-CG 4.43Å; L235-E248 HydrophobicContact CD2-CG 4.35Å; L235-E248 WeakPolarHBondContact CD2-OE2 3.47Å; R239-E248 IonicContact CZ-OE1 3.68Å; R239-E248 IonicContact NE-OE1 3.22Å; R239-E248 PolarHBondContact NE-OE1 3.35Å; R239-E248 IonicContact NE-OE2 2.95Å; R239-E248 PolarHBondContact NE-OE2 3.32Å; R239-E248 IonicContact NH2-OE1 3.55Å; R239-E248 PolarHBondContact NH2-OE1 2.65Å; I245-E248 PolarHBondContact O-N 3.43Å; E248-I252 HydrophobicContact CG-CD1 4.04Å; E248-I252 WeakPolarHBondContact O-CD1 3.17Å; E248-I252 VanDerWaalsContact O-CG1 3.24Å; E248-I252 WeakPolarHBondContact O-CG1 3.34Å; E248-I252 PolarHBondContact O-N 3.47Å; E248-I252 VanDerWaalsContact O-N 3.09Å |
| 249 | C | 83.9 | Confident | 76.3 | Confident | 0 Ų | 0 | 58.1 Ų | 58.1 | 0% | 0 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -59.2 | -53.5 | 174.2 | -83.4 | 0 | 0 | 0 | 0 | 111.9 | L235 I245 E246 R251 I252 E253 | L235-C249 WeakPolarHBondContact CD1-SG 3.43Å; I245-C249 PolarHBondContact O-N 3.29Å; E246-C249 PolarHBondContact O-N 3.25Å; C249-R251 VanDerWaalsContact C-N 3.3Å; C249-R251 PolarHBondContact O-N 2.93Å; C249-I252 PolarHBondContact O-N 3.19Å; C249-I252 VanDerWaalsContact O-N 3.12Å; C249-E253 PolarHBondContact O-N 3.32Å |
| 250 | S | 84.2 | Confident | 74.5 | Confident | 48 Ų | 48 | 61 Ų | 61 | 34% | 0.336 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -59.7 | -43.3 | -179 | -60.2 | 0 | 0 | 0 | 0 | 111 | E246 W247 I252 E253 D254 | E246-S250 PolarHBondContact O-N 3.08Å; E246-S250 PolarHBondContact O-OG 3.4Å; W247-S250 PolarHBondContact O-N 2.92Å; S250-I252 VanDerWaalsContact C-N 3.27Å; S250-I252 PolarHBondContact O-N 3.29Å; S250-E253 PolarHBondContact O-N 2.95Å; S250-E253 VanDerWaalsContact O-N 3.11Å; S250-D254 VanDerWaalsContact O-CG 3.23Å; S250-D254 PolarHBondContact O-N 2.97Å |
| 251 | R | 82 | Confident | 73 | Confident | 110 Ų | 110 | 64.3 Ų | 64.3 | 42% | 0.415 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -61.8 | -33.2 | 177.6 | -152.7 | -177.6 | 73.4 | 149.9 | 6.4 | 113.3 | E164 W247 C249 G255 | E164-R251 IonicContact OE1-CZ 3.18Å; E164-R251 IonicContact OE1-NH1 2.83Å; E164-R251 PolarHBondContact OE1-NH1 3.26Å; E164-R251 IonicContact OE1-NH2 3.54Å; E164-R251 PolarHBondContact OE1-NH2 3.15Å; W247-R251 WeakPolarHBondContact O-CB 3.39Å; W247-R251 PolarHBondContact O-N 3.39Å; W247-R251 VanDerWaalsContact O-N 3.11Å; C249-R251 VanDerWaalsContact C-N 3.3Å; C249-R251 PolarHBondContact O-N 2.93Å; R251-G255 PolarHBondContact O-N 3.47Å |
| 252 | I | 80.9 | Confident | 72 | Confident | 33 Ų | 33 | 64.4 Ų | 64.4 | 17% | 0.169 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -75 | -38.1 | 175.9 | -67.4 | 165.1 | 0 | 0 | 0 | 111.1 | R220 L223 E248 C249 S250 G255 C256 | R220-I252 HydrophobicContact CB-CG2 4.14Å; R220-I252 HydrophobicContact CG-CG2 4Å; L223-I252 HydrophobicContact CB-CG2 4.44Å; L223-I252 HydrophobicContact CD1-CB 3.67Å; L223-I252 HydrophobicContact CD1-CD1 4.18Å; L223-I252 HydrophobicContact CD1-CG2 3.52Å; E248-I252 HydrophobicContact CG-CD1 4.04Å; E248-I252 WeakPolarHBondContact O-CD1 3.17Å; E248-I252 VanDerWaalsContact O-CG1 3.24Å; E248-I252 WeakPolarHBondContact O-CG1 3.34Å; E248-I252 PolarHBondContact O-N 3.47Å; E248-I252 VanDerWaalsContact O-N 3.09Å; C249-I252 PolarHBondContact O-N 3.19Å; C249-I252 VanDerWaalsContact O-N 3.12Å; S250-I252 VanDerWaalsContact C-N 3.27Å; S250-I252 PolarHBondContact O-N 3.29Å; I252-G255 PolarHBondContact O-N 3.49Å; I252-C256 PolarHBondContact O-N 3.41Å; I252-C256 PolarHBondContact O-SG 3.36Å |
| 253 | E | 82.2 | Confident | 71.6 | Confident | 50 Ų | 50 | 63.4 Ų | 63.4 | 23% | 0.234 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -66.1 | -45.9 | 176.7 | -73.5 | 173 | 167.2 | 0 | 0 | 111.8 | L223 R228 C249 S250 G255 C256 D257 | L223-E253 HydrophobicContact CB-CG 4.36Å; L223-E253 HydrophobicContact CD1-CG 4.38Å; L223-E253 HydrophobicContact CD2-CG 4.03Å; L223-E253 WeakPolarHBondContact CD2-OE1 3.07Å; L223-E253 HydrophobicContact CG-CG 4.48Å; R228-E253 IonicContact CZ-OE1 3.86Å; R228-E253 IonicContact CZ-OE2 3.63Å; R228-E253 IonicContact NH1-OE1 3.88Å; R228-E253 PolarHBondContact NH1-OE1 2.94Å; R228-E253 IonicContact NH1-OE2 3.62Å; R228-E253 PolarHBondContact NH1-OE2 3.13Å; C249-E253 PolarHBondContact O-N 3.32Å; S250-E253 PolarHBondContact O-N 2.95Å; S250-E253 VanDerWaalsContact O-N 3.11Å; E253-G255 PolarHBondContact O-N 2.9Å; E253-C256 WeakPolarHBondContact O-CA 3.25Å; E253-C256 WeakPolarHBondContact O-CB 3.12Å; E253-C256 PolarHBondContact O-N 2.83Å; E253-D257 PolarHBondContact O-N 3.47Å |
| 254 | D | 78.6 | Confident | 71.3 | Confident | 99 Ų | 99 | 68 Ų | 68 | 53% | 0.529 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -53.7 | -45.9 | 174.7 | -65 | -25.2 | 0 | 0 | 0 | 110.5 | S250 C256 D257 E258 | S250-D254 VanDerWaalsContact O-CG 3.23Å; S250-D254 PolarHBondContact O-N 2.97Å; D254-C256 VanDerWaalsContact C-N 3.3Å; D254-C256 PolarHBondContact O-N 3.13Å; D254-D257 PolarHBondContact O-N 3.28Å; D254-E258 WeakPolarHBondContact O-CG 3.45Å; D254-E258 PolarHBondContact O-N 2.95Å; D254-E258 VanDerWaalsContact O-N 3.13Å |
| 255 | G | 69.6 | Low | 71 | Confident | 19 Ų | 19 | 71.6 Ų | 71.6 | 20% | 0.196 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -69.3 | -21.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | R251 I252 E253 Q259 | R251-G255 PolarHBondContact O-N 3.47Å; I252-G255 PolarHBondContact O-N 3.49Å; E253-G255 PolarHBondContact O-N 2.9Å; G255-Q259 WeakPolarHBondContact O-CG 3.47Å; G255-Q259 PolarHBondContact O-NE2 3.31Å; G255-Q259 PolarHBondContact O-OE1 3.01Å |
| 256 | C | 68.3 | Low | 70.5 | Confident | 28 Ų | 28 | 75 Ų | 75 | 19% | 0.189 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -80.2 | -36.7 | 173.7 | -71.2 | 0 | 0 | 0 | 0 | 111.7 | I252 E253 D254 Q259 G260 | I252-C256 PolarHBondContact O-N 3.41Å; I252-C256 PolarHBondContact O-SG 3.36Å; E253-C256 WeakPolarHBondContact O-CA 3.25Å; E253-C256 WeakPolarHBondContact O-CB 3.12Å; E253-C256 PolarHBondContact O-N 2.83Å; D254-C256 VanDerWaalsContact C-N 3.3Å; D254-C256 PolarHBondContact O-N 3.13Å; C256-Q259 CarbonylContact O-C 3.59Å; C256-Q259 WeakPolarHBondContact O-CA 3.41Å; C256-Q259 WeakPolarHBondContact O-CB 3.38Å; C256-Q259 PolarHBondContact O-N 3.2Å; C256-Q259 VanDerWaalsContact O-N 3.13Å; C256-G260 PolarHBondContact O-N 3.04Å |
| 257 | D | 61.6 | Low | 70.2 | Confident | 135 Ų | 135 | 71.3 Ų | 71.3 | 72% | 0.722 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -69.5 | -39.1 | 178.3 | -75.5 | -14.5 | 0 | 0 | 0 | 111.6 | E253 D254 Q259 G260 | E253-D257 PolarHBondContact O-N 3.47Å; D254-D257 PolarHBondContact O-N 3.28Å; D257-Q259 PolarHBondContact O-N 2.85Å; D257-G260 PolarHBondContact O-N 2.97Å; D257-G260 VanDerWaalsContact O-N 3.16Å |
| 258 | E | 58.2 | Low | 70 | Confident | 168 Ų | 168 | 70.2 Ų | 70.2 | 79% | 0.785 | 39% | 0.39 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.5 | -25.5 | 169.6 | -71.1 | -175.2 | 161.7 | 0 | 0 | 113 | D254 | D254-E258 WeakPolarHBondContact O-CG 3.45Å; D254-E258 PolarHBondContact O-N 2.95Å; D254-E258 VanDerWaalsContact O-N 3.13Å |
| 259 | Q | 54.3 | Low | 69.9 | Low | 75 Ų | 75 | 78 Ų | 78 | 35% | 0.35 | 42% | 0.424 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.2 | -2.1 | 178.4 | -77.2 | 159.4 | 28.1 | 0 | 0 | 113.7 | R220 G255 C256 D257 S261 I410 | R220-Q259 VanDerWaalsContact NH2-CD 3.29Å; G255-Q259 WeakPolarHBondContact O-CG 3.47Å; G255-Q259 PolarHBondContact O-NE2 3.31Å; G255-Q259 PolarHBondContact O-OE1 3.01Å; C256-Q259 CarbonylContact O-C 3.59Å; C256-Q259 WeakPolarHBondContact O-CA 3.41Å; C256-Q259 WeakPolarHBondContact O-CB 3.38Å; C256-Q259 PolarHBondContact O-N 3.2Å; C256-Q259 VanDerWaalsContact O-N 3.13Å; D257-Q259 PolarHBondContact O-N 2.85Å; Q259-S261 PolarHBondContact O-N 3.27Å; Q259-I410 HydrophobicContact CG-CG2 4.22Å |
| 260 | G | 48.5 | Very low | 69.8 | Low | 63 Ų | 63 | 79.8 Ų | 79.8 | 65% | 0.649 | 43% | 0.433 | S | S | * | . | trans | -63.7 | 0.3 | -178.1 | 0 | 0 | 0 | 0 | 0 | 116.4 | C256 D257 T262 | C256-G260 PolarHBondContact O-N 3.04Å; D257-G260 PolarHBondContact O-N 2.97Å; D257-G260 VanDerWaalsContact O-N 3.16Å; G260-T262 PolarHBondContact O-N 3.14Å; G260-T262 VanDerWaalsContact O-N 3.16Å | ||
| 261 | S | 51 | Low | 69.5 | Low | 76 Ų | 76 | 80.9 Ų | 80.9 | 53% | 0.531 | 44% | 0.439 | S | S | . | . | S | Bend | trans | -70.3 | 108.5 | 170.2 | 60.7 | 0 | 0 | 0 | 0 | 110.2 | Q259 F263 | Q259-S261 PolarHBondContact O-N 3.27Å; S261-F263 PolarHBondContact O-N 2.9Å |
| 262 | T | 56 | Low | 69.4 | Low | 102 Ų | 102 | 75.6 Ų | 75.6 | 63% | 0.626 | 42% | 0.419 | S | S | * | . | trans | -57.4 | 122.2 | 173.9 | 40.4 | 0 | 0 | 0 | 0 | 110.1 | G260 H264 | G260-T262 PolarHBondContact O-N 3.14Å; G260-T262 VanDerWaalsContact O-N 3.16Å; T262-H264 PolarHBondContact O-CD2 3.2Å; T262-H264 PolarHBondContact O-N 3.38Å; T262-H264 PolarHBondContact OG1-NE2 3.41Å | ||
| 263 | F | 63.5 | Low | 69.5 | Low | 69 Ų | 69 | 74.1 Ų | 74.1 | 30% | 0.303 | 41% | 0.412 | S | S | . | . | trans | -53.7 | 119.8 | 173 | 168.7 | -111.6 | 0 | 0 | 0 | 110.7 | S261 L268 V412 F415 | S261-F263 PolarHBondContact O-N 2.9Å; F263-L268 HydrophobicContact CE2-CD2 4.13Å; F263-L268 HydrophobicContact CE2-CG 4.12Å; F263-L268 HydrophobicContact CZ-CD1 4.14Å; F263-L268 HydrophobicContact CZ-CD2 4.18Å; F263-L268 HydrophobicContact CZ-CG 4.02Å; F263-V412 HydrophobicContact CD2-CB 4.37Å; F263-V412 HydrophobicContact CD2-CG1 3.71Å; F263-V412 HydrophobicContact CE2-CB 4.19Å; F263-V412 HydrophobicContact CE2-CG1 3.64Å; F263-F415 HydrophobicContact CE1-CB 3.97Å; F263-F415 HydrophobicContact CE1-CG 4.12Å; F263-F415 HydrophobicContact CZ-CB 3.98Å; F263-F415 HydrophobicContact CZ-CD1 4.07Å; F263-F415 HydrophobicContact CZ-CG 4.01Å | ||
| 264 | H | 68.6 | Low | 69.7 | Low | 106 Ų | 106 | 77.1 Ų | 77.1 | 49% | 0.491 | 42% | 0.424 | S | S | . | . | trans | -106.4 | 140.8 | 169.4 | -69.7 | -75 | 0 | 0 | 0 | 109.6 | T262 S266 D267 | T262-H264 PolarHBondContact O-CD2 3.2Å; T262-H264 PolarHBondContact O-N 3.38Å; T262-H264 PolarHBondContact OG1-NE2 3.41Å; H264-S266 WeakPolarHBondContact CB-OG 3.37Å; H264-S266 PolarHBondContact O-N 2.84Å; H264-D267 PolarHBondContact N-OD2 3.46Å; H264-D267 VanDerWaalsContact O-CB 3.26Å; H264-D267 WeakPolarHBondContact O-CB 3.43Å; H264-D267 VanDerWaalsContact O-CG 3.28Å; H264-D267 PolarHBondContact O-N 3.46Å | ||
| 265 | L | 70.8 | Confident | 70.2 | Confident | 130 Ų | 130 | 77 Ų | 77 | 68% | 0.681 | 42% | 0.419 | S | S | * | . | G | 310 helix | trans | -57.2 | -20.7 | 177.1 | -82.2 | 130.7 | 0 | 0 | 0 | 113.2 | D267 L268 | L265-D267 VanDerWaalsContact C-N 3.26Å; L265-D267 PolarHBondContact O-N 2.85Å; L265-L268 HydrophobicContact CD2-CD1 4.37Å; L265-L268 PolarHBondContact O-N 3.22Å |
| 266 | S | 72.2 | Confident | 71.1 | Confident | 77 Ų | 77 | 76.1 Ų | 76.1 | 54% | 0.538 | 41% | 0.41 | S | S | . | . | G | 310 helix | trans | -64.2 | -27.1 | 171.6 | 46.9 | 0 | 0 | 0 | 0 | 113.6 | H264 L268 K269 | H264-S266 WeakPolarHBondContact CB-OG 3.37Å; H264-S266 PolarHBondContact O-N 2.84Å; S266-L268 PolarHBondContact O-N 2.87Å; S266-K269 WeakPolarHBondContact O-CB 3.39Å; S266-K269 PolarHBondContact O-N 2.58Å; S266-K269 VanDerWaalsContact O-N 3.09Å |
| 267 | D | 75.5 | Confident | 72.1 | Confident | 40 Ų | 40 | 75.7 Ų | 75.7 | 21% | 0.214 | 41% | 0.406 | C | S | . | . | G | 310 helix | trans | -68.8 | -20.9 | -178.3 | -57.3 | -24.1 | 0 | 0 | 0 | 111.9 | H264 L265 K269 D270 | H264-D267 PolarHBondContact N-OD2 3.46Å; H264-D267 VanDerWaalsContact O-CB 3.26Å; H264-D267 WeakPolarHBondContact O-CB 3.43Å; H264-D267 VanDerWaalsContact O-CG 3.28Å; H264-D267 PolarHBondContact O-N 3.46Å; L265-D267 VanDerWaalsContact C-N 3.26Å; L265-D267 PolarHBondContact O-N 2.85Å; D267-K269 PolarHBondContact O-N 3.48Å; D267-D270 VanDerWaalsContact O-CB 3.28Å; D267-D270 WeakPolarHBondContact O-CB 3.39Å; D267-D270 PolarHBondContact O-N 3.39Å; D267-D270 VanDerWaalsContact O-N 3.16Å |
| 268 | L | 77.9 | Confident | 73.6 | Confident | 31 Ų | 31 | 72.9 Ų | 72.9 | 16% | 0.162 | 39% | 0.39 | C | S | . | . | G | 310 helix | trans | -67.5 | -16.9 | 173.8 | -64.8 | 174.5 | 0 | 0 | 0 | 113 | F263 L265 S266 D270 V273 F274 L277 F415 | F263-L268 HydrophobicContact CE2-CD2 4.13Å; F263-L268 HydrophobicContact CE2-CG 4.12Å; F263-L268 HydrophobicContact CZ-CD1 4.14Å; F263-L268 HydrophobicContact CZ-CD2 4.18Å; F263-L268 HydrophobicContact CZ-CG 4.02Å; L265-L268 HydrophobicContact CD2-CD1 4.37Å; L265-L268 PolarHBondContact O-N 3.22Å; S266-L268 PolarHBondContact O-N 2.87Å; L268-D270 VanDerWaalsContact C-N 3.34Å; L268-V273 HydrophobicContact CD2-CG1 4.04Å; L268-F274 WeakPolarHBondContact O-CB 3.41Å; L268-L277 HydrophobicContact CD2-CD2 4.21Å; L268-F415 HydrophobicContact CD1-CD1 4.03Å; L268-F415 HydrophobicContact CD1-CE1 3.56Å; L268-F415 HydrophobicContact CD1-CZ 4.26Å; L268-F415 HydrophobicContact CD2-CD1 4.06Å; L268-F415 HydrophobicContact CD2-CE1 4.22Å |
| 269 | K | 80.5 | Confident | 75.2 | Confident | 180 Ų | 180 | 65.6 Ų | 65.6 | 78% | 0.783 | 36% | 0.356 | S | S | * | . | G | 310 helix | trans | -83.9 | -11.7 | 175.5 | -63.4 | -176.5 | 179 | -179.5 | 0 | 112.8 | S266 D267 P271 | S266-K269 WeakPolarHBondContact O-CB 3.39Å; S266-K269 PolarHBondContact O-N 2.58Å; S266-K269 VanDerWaalsContact O-N 3.09Å; D267-K269 PolarHBondContact O-N 3.48Å; K269-P271 WeakPolarHBondContact O-CD 3.41Å |
| 270 | D | 81.4 | Confident | 76.9 | Confident | 37 Ų | 37 | 62 Ų | 62 | 20% | 0.198 | 34% | 0.34 | C | S | . | . | S | Bend | trans | -63.4 | 124.7 | 174.9 | -176.5 | -12.3 | 0 | 0 | 0 | 109.1 | D267 L268 G272 V273 F274 R411 R482 | D267-D270 VanDerWaalsContact O-CB 3.28Å; D267-D270 WeakPolarHBondContact O-CB 3.39Å; D267-D270 PolarHBondContact O-N 3.39Å; D267-D270 VanDerWaalsContact O-N 3.16Å; L268-D270 VanDerWaalsContact C-N 3.34Å; D270-G272 PolarHBondContact O-N 3.24Å; D270-G272 VanDerWaalsContact O-N 3.12Å; D270-G272 PolarHBondContact OD1-N 3.31Å; D270-V273 HydrophobicContact CB-CB 4.3Å; D270-V273 HydrophobicContact CB-CG2 4.14Å; D270-V273 WeakPolarHBondContact O-CA 3.44Å; D270-V273 PolarHBondContact O-N 3.19Å; D270-F274 PolarHBondContact O-N 3.08Å; D270-R411 IonicContact OD2-NH2 2.57Å; D270-R411 PolarHBondContact OD2-NH2 3.08Å; D270-R482 IonicContact OD1-NE 3.9Å; D270-R482 IonicContact OD1-NH2 2.91Å; D270-R482 IonicContact OD2-CZ 2.77Å; D270-R482 IonicContact OD2-NE 2.84Å; D270-R482 IonicContact OD2-NH2 3.07Å; D270-R482 PolarHBondContact OD2-NH2 3.35Å |
| 271 | P | 78.9 | Confident | 79.1 | Confident | 70 Ų | 70 | 60.9 Ų | 60.9 | 46% | 0.455 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -54.8 | -28.5 | 175.5 | -26.5 | 34.9 | 0 | 0 | 0 | 113.8 | K269 V273 K275 | K269-P271 WeakPolarHBondContact O-CD 3.41Å; P271-V273 PolarHBondContact O-N 2.99Å; P271-K275 WeakPolarHBondContact O-CB 3.3Å; P271-K275 WeakPolarHBondContact O-CG 3.33Å; P271-K275 PolarHBondContact O-N 2.94Å |
| 272 | G | 79.3 | Confident | 81.1 | Confident | 0 Ų | 0 | 60 Ų | 60 | 0% | 0 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -73 | -9.1 | 174.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | D270 P276 | D270-G272 PolarHBondContact O-N 3.24Å; D270-G272 VanDerWaalsContact O-N 3.12Å; D270-G272 PolarHBondContact OD1-N 3.31Å; G272-P276 WeakPolarHBondContact O-CG 3.44Å |
| 273 | V | 82.9 | Confident | 82.9 | Confident | 2 Ų | 2 | 55.1 Ų | 55.1 | 1% | 0.012 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -112 | -47.3 | 176.3 | 171.7 | 0 | 0 | 0 | 0 | 110.8 | L268 D270 P271 P276 L277 P409 V412 | L268-V273 HydrophobicContact CD2-CG1 4.04Å; D270-V273 HydrophobicContact CB-CB 4.3Å; D270-V273 HydrophobicContact CB-CG2 4.14Å; D270-V273 WeakPolarHBondContact O-CA 3.44Å; D270-V273 PolarHBondContact O-N 3.19Å; P271-V273 PolarHBondContact O-N 2.99Å; V273-P276 WeakPolarHBondContact O-CD 3.43Å; V273-L277 VanDerWaalsContact O-CB 3.31Å; V273-L277 WeakPolarHBondContact O-CB 3.12Å; V273-L277 PolarHBondContact O-N 2.97Å; V273-P409 HydrophobicContact CG2-CG 4.21Å; V273-V412 HydrophobicContact CG1-CB 4.37Å; V273-V412 HydrophobicContact CG1-CG1 4Å; V273-V412 HydrophobicContact CG1-CG2 3.94Å; V273-V412 HydrophobicContact CG2-CG1 4.3Å |
| 274 | F | 86.4 | Confident | 84.3 | Confident | 113 Ų | 113 | 51.9 Ų | 51.9 | 50% | 0.496 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -63.9 | -44.8 | -174.7 | -179.6 | -103.4 | 0 | 0 | 0 | 112.8 | L268 D270 L277 L278 | L268-F274 WeakPolarHBondContact O-CB 3.41Å; D270-F274 PolarHBondContact O-N 3.08Å; F274-L277 PolarHBondContact O-N 3.08Å; F274-L278 HydrophobicContact CE1-CD2 4.11Å; F274-L278 HydrophobicContact CZ-CD2 4.32Å; F274-L278 WeakPolarHBondContact O-CB 3.47Å; F274-L278 PolarHBondContact O-N 2.97Å |
| 275 | K | 88.7 | Confident | 85.5 | Confident | 97 Ų | 97 | 48 Ų | 48 | 42% | 0.422 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -64.4 | -50.1 | -179.6 | -65.9 | 176.6 | -174.8 | 174.2 | 0 | 111.8 | P271 L277 L278 I279 F481 | P271-K275 WeakPolarHBondContact O-CB 3.3Å; P271-K275 WeakPolarHBondContact O-CG 3.33Å; P271-K275 PolarHBondContact O-N 2.94Å; K275-L277 VanDerWaalsContact C-N 3.32Å; K275-L277 PolarHBondContact O-N 3.2Å; K275-L278 PolarHBondContact O-N 2.7Å; K275-I279 WeakPolarHBondContact O-CG1 3.17Å; K275-I279 PolarHBondContact O-N 3.04Å; K275-F481 HydrophobicContact CB-CD1 3.81Å; K275-F481 HydrophobicContact CB-CE1 4.43Å; K275-F481 HydrophobicContact CB-CG 4.42Å; K275-F481 HydrophobicContact CD-CD1 4.34Å; K275-F481 WeakPolarHBondContact CD-O 3.43Å; K275-F481 PolarHBondContact NZ-O 2.86Å |
| 276 | P | 88.4 | Confident | 86.6 | Confident | 0 Ų | 0 | 43.5 Ų | 43.5 | 0% | 0 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -48.8 | -48 | 168.6 | -38.6 | 42.6 | 0 | 0 | 0 | 115.3 | G272 V273 S280 V407 F481 | G272-P276 WeakPolarHBondContact O-CG 3.44Å; V273-P276 WeakPolarHBondContact O-CD 3.43Å; P276-S280 WeakPolarHBondContact O-CB 3.32Å; P276-S280 PolarHBondContact O-N 3.45Å; P276-S280 PolarHBondContact O-OG 2.93Å; P276-V407 HydrophobicContact CB-CG1 3.4Å; P276-V407 WeakPolarHBondContact CB-O 3.34Å; P276-V407 HydrophobicContact CG-CG1 3.84Å; P276-F481 HydrophobicContact CG-CB 4.34Å; P276-F481 HydrophobicContact CG-CD1 4.4Å; P276-F481 HydrophobicContact CG-CD2 3.51Å; P276-F481 HydrophobicContact CG-CE2 3.8Å; P276-F481 HydrophobicContact CG-CG 3.82Å; P276-F481 HydrophobicContact CG-CZ 4.34Å |
| 277 | L | 90 | Very high | 87.7 | Confident | 19 Ų | 19 | 40.1 Ų | 40.1 | 10% | 0.099 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -64.2 | -47.5 | -178.3 | 176.3 | 59.8 | 0 | 0 | 0 | 110.9 | L268 V273 F274 K275 I279 S280 I281 A416 V420 | L268-L277 HydrophobicContact CD2-CD2 4.21Å; V273-L277 VanDerWaalsContact O-CB 3.31Å; V273-L277 WeakPolarHBondContact O-CB 3.12Å; V273-L277 PolarHBondContact O-N 2.97Å; F274-L277 PolarHBondContact O-N 3.08Å; K275-L277 VanDerWaalsContact C-N 3.32Å; K275-L277 PolarHBondContact O-N 3.2Å; L277-I279 PolarHBondContact O-N 3.14Å; L277-S280 PolarHBondContact O-N 3.45Å; L277-I281 HydrophobicContact CD1-CD1 3.84Å; L277-I281 HydrophobicContact CD1-CG1 4.19Å; L277-I281 HydrophobicContact CG-CD1 3.93Å; L277-I281 WeakPolarHBondContact O-CG1 3.37Å; L277-I281 PolarHBondContact O-N 3.23Å; L277-A416 HydrophobicContact CD1-CB 3.8Å; L277-V420 HydrophobicContact CD1-CG2 4.15Å |
| 278 | L | 91.7 | Very high | 88.6 | Confident | 75 Ų | 75 | 38.5 Ų | 38.5 | 39% | 0.393 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -61.3 | -44.9 | 179.2 | -178.5 | 61.4 | 0 | 0 | 0 | 111.5 | F274 K275 S280 I281 L282 | F274-L278 HydrophobicContact CE1-CD2 4.11Å; F274-L278 HydrophobicContact CZ-CD2 4.32Å; F274-L278 WeakPolarHBondContact O-CB 3.47Å; F274-L278 PolarHBondContact O-N 2.97Å; K275-L278 PolarHBondContact O-N 2.7Å; L278-S280 VanDerWaalsContact C-N 3.33Å; L278-S280 PolarHBondContact O-N 2.81Å; L278-I281 PolarHBondContact O-N 3.3Å; L278-L282 HydrophobicContact CD1-CD1 4.01Å; L278-L282 HydrophobicContact CD1-CG 4.15Å; L278-L282 HydrophobicContact CG-CD1 3.95Å; L278-L282 HydrophobicContact CG-CG 4.46Å; L278-L282 WeakPolarHBondContact O-CB 3.46Å; L278-L282 VanDerWaalsContact O-CG 3.31Å; L278-L282 WeakPolarHBondContact O-CG 3.42Å; L278-L282 PolarHBondContact O-N 3.06Å |
| 279 | I | 92 | Very high | 89.3 | Confident | 16 Ų | 16 | 39.1 Ų | 39.1 | 8% | 0.082 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -61.5 | -43 | 176.8 | -69.9 | 163.9 | 0 | 0 | 0 | 110.8 | K275 L277 L282 L283 F461 F465 V466 F481 | K275-I279 WeakPolarHBondContact O-CG1 3.17Å; K275-I279 PolarHBondContact O-N 3.04Å; L277-I279 PolarHBondContact O-N 3.14Å; I279-L282 PolarHBondContact O-N 3.16Å; I279-L283 HydrophobicContact CG2-CD1 4.04Å; I279-L283 HydrophobicContact CG2-CG 4.37Å; I279-L283 WeakPolarHBondContact O-CB 3.44Å; I279-L283 WeakPolarHBondContact O-CG 3.41Å; I279-L283 PolarHBondContact O-N 3.32Å; I279-F461 HydrophobicContact CG2-CZ 4.46Å; I279-F465 WeakPolarHBondContact CD1-O 3.45Å; I279-V466 HydrophobicContact CG2-CG2 4.24Å; I279-F481 HydrophobicContact CD1-CD1 4.42Å; I279-F481 HydrophobicContact CD1-CE1 3.37Å; I279-F481 HydrophobicContact CD1-CZ 3.83Å |
| 280 | S | 91.3 | Very high | 90 | Very high | 0 Ų | 0 | 30.5 Ų | 30.5 | 0% | 0 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -65 | -41.5 | 179.3 | -57.3 | 0 | 0 | 0 | 0 | 112.2 | P276 L277 L278 M284 | P276-S280 WeakPolarHBondContact O-CB 3.32Å; P276-S280 PolarHBondContact O-N 3.45Å; P276-S280 PolarHBondContact O-OG 2.93Å; L277-S280 PolarHBondContact O-N 3.45Å; L278-S280 VanDerWaalsContact C-N 3.33Å; L278-S280 PolarHBondContact O-N 2.81Å; S280-M284 WeakPolarHBondContact O-CG 3.41Å; S280-M284 PolarHBondContact O-N 3.39Å |
| 281 | I | 93.2 | Very high | 90.5 | Very high | 39 Ų | 39 | 28.8 Ų | 28.8 | 20% | 0.2 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -63.8 | -49.1 | 175.5 | -72.3 | 171.4 | 0 | 0 | 0 | 110.6 | L277 L278 L283 M284 V285 A419 V420 | L277-I281 HydrophobicContact CD1-CD1 3.84Å; L277-I281 HydrophobicContact CD1-CG1 4.19Å; L277-I281 HydrophobicContact CG-CD1 3.93Å; L277-I281 WeakPolarHBondContact O-CG1 3.37Å; L277-I281 PolarHBondContact O-N 3.23Å; L278-I281 PolarHBondContact O-N 3.3Å; I281-L283 VanDerWaalsContact C-N 3.34Å; I281-L283 PolarHBondContact O-N 3.13Å; I281-M284 PolarHBondContact O-N 2.94Å; I281-V285 HydrophobicContact CG2-CG2 4.48Å; I281-V285 WeakPolarHBondContact O-CG2 3.42Å; I281-V285 PolarHBondContact O-N 3.44Å; I281-A419 HydrophobicContact CD1-CB 4.46Å; I281-V420 HydrophobicContact CG1-CG2 3.84Å |
| 282 | L | 94.4 | Very high | 91.1 | Very high | 57 Ų | 57 | 25.7 Ų | 25.7 | 30% | 0.298 | 12% | 0.124 | S | C | . | . | H | α-helix | trans | -64.1 | -38.8 | -179.6 | -71.4 | 174.4 | 0 | 0 | 0 | 111.9 | L278 I279 M284 V285 F286 F461 | L278-L282 HydrophobicContact CD1-CD1 4.01Å; L278-L282 HydrophobicContact CD1-CG 4.15Å; L278-L282 HydrophobicContact CG-CD1 3.95Å; L278-L282 HydrophobicContact CG-CG 4.46Å; L278-L282 WeakPolarHBondContact O-CB 3.46Å; L278-L282 VanDerWaalsContact O-CG 3.31Å; L278-L282 WeakPolarHBondContact O-CG 3.42Å; L278-L282 PolarHBondContact O-N 3.06Å; I279-L282 PolarHBondContact O-N 3.16Å; L282-M284 VanDerWaalsContact C-N 3.32Å; L282-M284 PolarHBondContact O-N 2.72Å; L282-V285 PolarHBondContact O-N 2.94Å; L282-F286 HydrophobicContact CB-CD2 4.39Å; L282-F286 HydrophobicContact CB-CE2 4.38Å; L282-F286 WeakPolarHBondContact O-CB 3.41Å; L282-F286 WeakPolarHBondContact O-CD2 3.27Å; L282-F286 PolarHBondContact O-N 3.17Å; L282-F461 HydrophobicContact CB-CE1 4.21Å; L282-F461 HydrophobicContact CB-CE2 3.87Å; L282-F461 HydrophobicContact CB-CZ 3.54Å; L282-F461 HydrophobicContact CD1-CE2 3.67Å; L282-F461 HydrophobicContact CD1-CZ 4.13Å; L282-F461 HydrophobicContact CG-CE2 4.43Å |
| 283 | L | 92.7 | Very high | 91.5 | Very high | 0 Ų | 0 | 26.4 Ų | 26.4 | 0% | 0 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -56.5 | -44.7 | 173.1 | -85 | 173.7 | 0 | 0 | 0 | 112 | I279 I281 Q287 L342 W396 P400 I403 F461 V466 | I279-L283 HydrophobicContact CG2-CD1 4.04Å; I279-L283 HydrophobicContact CG2-CG 4.37Å; I279-L283 WeakPolarHBondContact O-CB 3.44Å; I279-L283 WeakPolarHBondContact O-CG 3.41Å; I279-L283 PolarHBondContact O-N 3.32Å; I281-L283 VanDerWaalsContact C-N 3.34Å; I281-L283 PolarHBondContact O-N 3.13Å; L283-Q287 VanDerWaalsContact O-CB 3.3Å; L283-Q287 WeakPolarHBondContact O-CB 3.39Å; L283-Q287 PolarHBondContact O-N 3.09Å; L283-L342 HydrophobicContact CD2-CD1 4.32Å; L283-W396 HydrophobicContact CD2-CH2 3.59Å; L283-W396 HydrophobicContact CD2-CZ3 3.63Å; L283-P400 HydrophobicContact CB-CB 4.3Å; L283-I403 HydrophobicContact CD1-CB 4.14Å; L283-I403 HydrophobicContact CD1-CD1 4.04Å; L283-I403 HydrophobicContact CD1-CG2 3.75Å; L283-F461 HydrophobicContact CD2-CE1 3.91Å; L283-F461 HydrophobicContact CG-CE1 3.95Å; L283-V466 HydrophobicContact CD1-CG2 4.37Å; L283-V466 HydrophobicContact CD2-CG2 3.93Å; L283-V466 HydrophobicContact CG-CG2 4.28Å |
| 284 | M | 92.9 | Very high | 91.8 | Very high | 0 Ų | 0 | 26.3 Ų | 26.3 | 0% | 0 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -68.7 | -40.8 | 177.4 | -68.8 | -55.8 | 171.2 | 0 | 0 | 112.6 | S280 I281 L282 Q287 Q288 P400 W401 M404 V420 N424 | S280-M284 WeakPolarHBondContact O-CG 3.41Å; S280-M284 PolarHBondContact O-N 3.39Å; I281-M284 PolarHBondContact O-N 2.94Å; L282-M284 VanDerWaalsContact C-N 3.32Å; L282-M284 PolarHBondContact O-N 2.72Å; M284-Q287 WeakPolarHBondContact O-CB 3.46Å; M284-Q287 PolarHBondContact O-N 2.87Å; M284-Q288 WeakPolarHBondContact O-CG 3.22Å; M284-Q288 PolarHBondContact O-N 3.11Å; M284-Q288 VanDerWaalsContact O-N 3.14Å; M284-P400 HydrophobicContact CE-CB 4Å; M284-P400 HydrophobicContact SD-CB 4.03Å; M284-W401 HydrophobicContact CE-CB 4.43Å; M284-W401 HydrophobicContact CE-CD2 3.49Å; M284-W401 VanDerWaalsContact CE-CD2 3.49Å; M284-W401 HydrophobicContact CE-CE3 3.57Å; M284-W401 HydrophobicContact CE-CG 3.89Å; M284-W401 HydrophobicContact CE-CH2 4.35Å; M284-W401 HydrophobicContact CE-CZ2 4.28Å; M284-W401 HydrophobicContact CE-CZ3 4.01Å; M284-W401 HydrophobicContact SD-CD2 4.3Å; M284-W401 HydrophobicContact SD-CZ2 4.18Å; M284-M404 HydrophobicContact CE-CB 4.43Å; M284-M404 HydrophobicContact CE-SD 4.37Å; M284-V420 HydrophobicContact CB-CG1 4.45Å; M284-V420 HydrophobicContact CE-CG1 3.83Å; M284-V420 HydrophobicContact CG-CG1 3.36Å; M284-V420 HydrophobicContact SD-CG1 4.42Å; M284-N424 HydrophobicContact CB-CB 3.76Å; M284-N424 HydrophobicContact CG-CB 3.98Å; M284-N424 HydrophobicContact SD-CB 4.18Å |
| 285 | V | 94.9 | Very high | 92.1 | Very high | 26 Ų | 26 | 21 Ų | 21 | 16% | 0.158 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -60.1 | -50.2 | 175.9 | 167.4 | 0 | 0 | 0 | 0 | 110.3 | I281 L282 Q287 Q288 M289 M427 | I281-V285 HydrophobicContact CG2-CG2 4.48Å; I281-V285 WeakPolarHBondContact O-CG2 3.42Å; I281-V285 PolarHBondContact O-N 3.44Å; L282-V285 PolarHBondContact O-N 2.94Å; V285-Q287 PolarHBondContact O-N 3.26Å; V285-Q288 PolarHBondContact O-N 3.47Å; V285-Q288 VanDerWaalsContact O-N 3.16Å; V285-M289 HydrophobicContact CG1-CG 4.25Å; V285-M289 HydrophobicContact CG1-SD 3.72Å; V285-M289 VanDerWaalsContact O-CG 3.29Å; V285-M289 WeakPolarHBondContact O-CG 3.28Å; V285-M289 PolarHBondContact O-N 2.95Å; V285-M427 HydrophobicContact CG1-CE 3.65Å; V285-M427 HydrophobicContact CG1-CG 4.28Å; V285-M427 HydrophobicContact CG2-CE 4.49Å |
| 286 | F | 94.2 | Very high | 92 | Very high | 35 Ų | 35 | 16.7 Ų | 16.7 | 15% | 0.154 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -65 | -37 | 178.5 | -77.3 | -57.3 | 0 | 0 | 0 | 113 | L282 Q288 M289 T290 L457 N458 F461 | L282-F286 HydrophobicContact CB-CD2 4.39Å; L282-F286 HydrophobicContact CB-CE2 4.38Å; L282-F286 WeakPolarHBondContact O-CB 3.41Å; L282-F286 WeakPolarHBondContact O-CD2 3.27Å; L282-F286 PolarHBondContact O-N 3.17Å; F286-Q288 VanDerWaalsContact C-N 3.25Å; F286-Q288 PolarHBondContact O-N 3.42Å; F286-M289 HydrophobicContact CD1-SD 4.44Å; F286-M289 PolarHBondContact O-N 3.02Å; F286-T290 VanDerWaalsContact O-CG2 3.22Å; F286-T290 WeakPolarHBondContact O-CG2 3.31Å; F286-T290 PolarHBondContact O-N 3.42Å; F286-L457 HydrophobicContact CE1-CB 4.34Å; F286-N458 HydrophobicContact CB-CB 4.2Å; F286-N458 WeakPolarHBondContact CB-OD1 3.38Å; F286-N458 HydrophobicContact CD1-CB 4.4Å; F286-N458 HydrophobicContact CG-CB 4.39Å; F286-F461 HydrophobicContact CD2-CB 4.21Å; F286-F461 AromaticContact CD2-CD1 3.62Å; F286-F461 HydrophobicContact CD2-CD1 3.62Å; F286-F461 HydrophobicContact CD2-CD2 4.36Å; F286-F461 HydrophobicContact CD2-CE1 4.07Å; F286-F461 AromaticContact CD2-CG 3.79Å; F286-F461 HydrophobicContact CD2-CG 3.79Å; F286-F461 HydrophobicContact CE2-CB 3.78Å; F286-F461 AromaticContact CE2-CD1 3.81Å; F286-F461 HydrophobicContact CE2-CD1 3.81Å; F286-F461 AromaticContact CE2-CD2 3.72Å; F286-F461 HydrophobicContact CE2-CD2 3.72Å; F286-F461 HydrophobicContact CE2-CE1 4.36Å; F286-F461 HydrophobicContact CE2-CE2 4.28Å; F286-F461 AromaticContact CE2-CG 3.46Å; F286-F461 HydrophobicContact CE2-CG 3.46Å; F286-F461 VanDerWaalsContact CE2-CG 3.46Å; F286-F461 HydrophobicContact CZ-CB 4.3Å; F286-F461 HydrophobicContact CZ-CG 4.4Å |
| 287 | Q | 93.7 | Very high | 92 | Very high | 6 Ų | 6 | 16.7 Ų | 16.7 | 3% | 0.028 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -53.6 | -45.7 | 172.5 | -177 | -167.3 | 76.9 | 0 | 0 | 110.6 | L283 M284 V285 T290 F392 W396 G397 N424 | L283-Q287 VanDerWaalsContact O-CB 3.3Å; L283-Q287 WeakPolarHBondContact O-CB 3.39Å; L283-Q287 PolarHBondContact O-N 3.09Å; M284-Q287 WeakPolarHBondContact O-CB 3.46Å; M284-Q287 PolarHBondContact O-N 2.87Å; V285-Q287 PolarHBondContact O-N 3.26Å; Q287-T290 PolarHBondContact O-OG1 3.39Å; Q287-F392 HydrophobicContact CG-CE2 3.78Å; Q287-F392 HydrophobicContact CG-CZ 4.06Å; Q287-W396 HydrophobicContact CB-CE3 4.23Å; Q287-W396 WeakPolarHBondContact CG-O 3.47Å; Q287-W396 PolarHBondContact NE2-O 3.15Å; Q287-G397 PolarHBondContact NE2-O 3.14Å; Q287-N424 PolarHBondContact OE1-OD1 2.84Å; Q287-N424 VanDerWaalsContact OE1-OD1 3.13Å |
| 288 | Q | 94.8 | Very high | 91.8 | Very high | 5 Ų | 5 | 16.2 Ų | 16.2 | 2% | 0.023 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -76.2 | -36.7 | -178.5 | -64.3 | -57.7 | -31 | 0 | 0 | 113.7 | M284 V285 F286 T290 G291 N293 N424 M427 A428 | M284-Q288 WeakPolarHBondContact O-CG 3.22Å; M284-Q288 PolarHBondContact O-N 3.11Å; M284-Q288 VanDerWaalsContact O-N 3.14Å; V285-Q288 PolarHBondContact O-N 3.47Å; V285-Q288 VanDerWaalsContact O-N 3.16Å; F286-Q288 VanDerWaalsContact C-N 3.25Å; F286-Q288 PolarHBondContact O-N 3.42Å; Q288-T290 PolarHBondContact O-N 2.94Å; Q288-T290 VanDerWaalsContact O-N 3.1Å; Q288-G291 PolarHBondContact O-N 3.31Å; Q288-N293 PolarHBondContact NE2-ND2 3.11Å; Q288-N293 PolarHBondContact OE1-ND2 3.24Å; Q288-N424 WeakPolarHBondContact CG-O 3.15Å; Q288-N424 WeakPolarHBondContact CG-OD1 3.37Å; Q288-N424 PolarHBondContact NE2-OD1 3.5Å; Q288-M427 HydrophobicContact CB-CB 3.82Å; Q288-M427 HydrophobicContact CB-CG 3.59Å; Q288-M427 HydrophobicContact CG-CB 4.21Å; Q288-A428 HydrophobicContact CG-CB 4.18Å |
| 289 | M | 93.4 | Very high | 91.5 | Very high | 44 Ų | 44 | 12.9 Ų | 12.9 | 22% | 0.217 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -63.5 | -14.4 | 177.5 | -70.9 | -178.7 | 80.6 | 0 | 0 | 113.8 | V285 F286 G291 M427 F451 M454 | V285-M289 HydrophobicContact CG1-CG 4.25Å; V285-M289 HydrophobicContact CG1-SD 3.72Å; V285-M289 VanDerWaalsContact O-CG 3.29Å; V285-M289 WeakPolarHBondContact O-CG 3.28Å; V285-M289 PolarHBondContact O-N 2.95Å; F286-M289 HydrophobicContact CD1-SD 4.44Å; F286-M289 PolarHBondContact O-N 3.02Å; M289-G291 PolarHBondContact O-N 2.91Å; M289-M427 HydrophobicContact CG-CE 4.49Å; M289-M427 HydrophobicContact CG-CG 4.02Å; M289-M427 HydrophobicContact CG-SD 4.01Å; M289-F451 WeakPolarHBondContact O-CD1 3.4Å; M289-M454 HydrophobicContact CB-CB 4.31Å; M289-M454 HydrophobicContact CB-CG 4.35Å; M289-M454 HydrophobicContact CE-CE 3.45Å; M289-M454 VanDerWaalsContact CE-CE 3.45Å; M289-M454 HydrophobicContact CE-CG 4.19Å; M289-M454 HydrophobicContact CE-SD 3.35Å; M289-M454 WeakPolarHBondContact CE-SD 3.38Å |
| 290 | T | 93.9 | Very high | 91.1 | Very high | 0 Ų | 0 | 12.8 Ų | 12.8 | 0% | 0 | 7% | 0.065 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -66.4 | -13.5 | 171.3 | 68.7 | 0 | 0 | 0 | 0 | 113.2 | F286 Q287 Q288 M349 F388 | F286-T290 VanDerWaalsContact O-CG2 3.22Å; F286-T290 WeakPolarHBondContact O-CG2 3.31Å; F286-T290 PolarHBondContact O-N 3.42Å; Q287-T290 PolarHBondContact O-OG1 3.39Å; Q288-T290 PolarHBondContact O-N 2.94Å; Q288-T290 VanDerWaalsContact O-N 3.1Å; T290-M349 VanDerWaalsContact CB-CE 3.42Å; T290-M349 HydrophobicContact CG2-CE 3.34Å; T290-F388 WeakPolarHBondContact O-CZ 3.49Å |
| 291 | G | 92.1 | Very high | 90.7 | Very high | 0 Ų | 0 | 14.8 Ų | 14.8 | 0% | 0 | 8% | 0.076 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 87.3 | 5.7 | -180 | 0 | 0 | 0 | 0 | 0 | 114.3 | Q288 M289 N293 A294 I295 | Q288-G291 PolarHBondContact O-N 3.31Å; M289-G291 PolarHBondContact O-N 2.91Å; G291-N293 PolarHBondContact O-N 3.46Å; G291-A294 WeakPolarHBondContact O-CB 3.12Å; G291-A294 PolarHBondContact O-N 2.78Å; G291-A294 VanDerWaalsContact O-N 3.11Å; G291-I295 WeakPolarHBondContact O-CB 3.34Å; G291-I295 WeakPolarHBondContact O-CG1 3.34Å; G291-I295 PolarHBondContact O-N 3.26Å |
| 292 | I | 91.4 | Very high | 90.3 | Very high | 5 Ų | 5 | 12.9 Ų | 12.9 | 3% | 0.026 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -54 | -48.4 | -174.7 | -174.7 | 62.7 | 0 | 0 | 0 | 113.3 | A294 I295 M296 F388 I389 F392 | I292-A294 VanDerWaalsContact C-N 3.33Å; I292-A294 PolarHBondContact O-N 3.08Å; I292-I295 PolarHBondContact O-N 3.26Å; I292-M296 HydrophobicContact CD1-CG 4.03Å; I292-M296 HydrophobicContact CD1-SD 4.37Å; I292-M296 HydrophobicContact CG1-CG 4.24Å; I292-M296 WeakPolarHBondContact O-CB 3.31Å; I292-M296 WeakPolarHBondContact O-CG 3.48Å; I292-M296 PolarHBondContact O-N 2.99Å; I292-F388 HydrophobicContact CB-CE1 4.26Å; I292-F388 HydrophobicContact CB-CZ 4.45Å; I292-F388 HydrophobicContact CD1-CD1 4.26Å; I292-F388 HydrophobicContact CD1-CE1 3.61Å; I292-I389 HydrophobicContact CD1-CG1 4.28Å; I292-F392 HydrophobicContact CB-CD2 4.09Å; I292-F392 HydrophobicContact CB-CE2 3.89Å; I292-F392 HydrophobicContact CB-CZ 4.23Å; I292-F392 HydrophobicContact CD1-CB 4.29Å; I292-F392 HydrophobicContact CD1-CD1 3.94Å; I292-F392 HydrophobicContact CD1-CD2 4.24Å; I292-F392 HydrophobicContact CD1-CE1 4.34Å; I292-F392 HydrophobicContact CD1-CG 3.89Å; I292-F392 HydrophobicContact CG1-CD1 3.91Å; I292-F392 HydrophobicContact CG1-CD2 3.94Å; I292-F392 HydrophobicContact CG1-CE1 3.81Å; I292-F392 HydrophobicContact CG1-CE2 3.84Å; I292-F392 HydrophobicContact CG1-CG 3.97Å; I292-F392 HydrophobicContact CG1-CZ 3.78Å; I292-F392 HydrophobicContact CG2-CD2 4.37Å; I292-F392 HydrophobicContact CG2-CE2 3.68Å; I292-F392 HydrophobicContact CG2-CZ 3.88Å |
| 293 | N | 89.3 | Confident | 89.8 | Confident | 15 Ų | 15 | 10.2 Ų | 10.2 | 8% | 0.08 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -68.8 | -31.7 | -179 | -86.9 | -27.1 | 0 | 0 | 0 | 112.7 | Q288 G291 F297 A428 | Q288-N293 PolarHBondContact NE2-ND2 3.11Å; Q288-N293 PolarHBondContact OE1-ND2 3.24Å; G291-N293 PolarHBondContact O-N 3.46Å; N293-F297 VanDerWaalsContact O-CB 3.3Å; N293-F297 WeakPolarHBondContact O-CB 3.29Å; N293-F297 WeakPolarHBondContact O-CD1 3.37Å; N293-F297 VanDerWaalsContact O-CG 3.22Å; N293-F297 WeakPolarHBondContact O-CG 3.43Å; N293-F297 PolarHBondContact O-N 3.44Å; N293-A428 WeakPolarHBondContact ND2-CB 3.41Å |
| 294 | A | 89.3 | Confident | 89.2 | Confident | 0 Ų | 0 | 12.7 Ų | 12.7 | 0% | 0 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -66.9 | -48.9 | 172.1 | 0 | 0 | 0 | 0 | 0 | 110.7 | G291 I292 M296 F297 Y298 V431 F435 | G291-A294 WeakPolarHBondContact O-CB 3.12Å; G291-A294 PolarHBondContact O-N 2.78Å; G291-A294 VanDerWaalsContact O-N 3.11Å; I292-A294 VanDerWaalsContact C-N 3.33Å; I292-A294 PolarHBondContact O-N 3.08Å; A294-M296 VanDerWaalsContact C-N 3.27Å; A294-M296 PolarHBondContact O-N 2.69Å; A294-F297 PolarHBondContact O-N 3.17Å; A294-Y298 HydrophobicContact CB-CD2 4.43Å; A294-Y298 WeakPolarHBondContact O-CB 3.48Å; A294-Y298 WeakPolarHBondContact O-CD2 3.28Å; A294-Y298 PolarHBondContact O-N 3.18Å; A294-V431 HydrophobicContact CB-CG1 4.24Å; A294-F435 HydrophobicContact CB-CB 3.83Å; A294-F435 HydrophobicContact CB-CD1 4.26Å; A294-F435 HydrophobicContact CB-CD2 3.63Å; A294-F435 HydrophobicContact CB-CE2 4.24Å; A294-F435 HydrophobicContact CB-CG 3.63Å |
| 295 | I | 91 | Very high | 88.4 | Confident | 2 Ų | 2 | 14.4 Ų | 14.4 | 1% | 0.01 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -55.4 | -43.7 | 175.5 | -77.2 | 166.1 | 0 | 0 | 0 | 111.5 | G291 I292 A299 I302 M385 F388 I389 F448 | G291-I295 WeakPolarHBondContact O-CB 3.34Å; G291-I295 WeakPolarHBondContact O-CG1 3.34Å; G291-I295 PolarHBondContact O-N 3.26Å; I292-I295 PolarHBondContact O-N 3.26Å; I295-A299 WeakPolarHBondContact O-CA 3.37Å; I295-A299 VanDerWaalsContact O-CB 3.27Å; I295-A299 WeakPolarHBondContact O-CB 3.22Å; I295-A299 PolarHBondContact O-N 3.42Å; I295-I302 HydrophobicContact CG1-CD1 4.37Å; I295-M385 HydrophobicContact CB-SD 4.4Å; I295-M385 HydrophobicContact CD1-SD 4.46Å; I295-M385 HydrophobicContact CG1-CE 4.37Å; I295-M385 HydrophobicContact CG1-SD 4.38Å; I295-M385 HydrophobicContact CG2-CE 3.77Å; I295-M385 HydrophobicContact CG2-SD 3.23Å; I295-M385 WeakPolarHBondContact CG2-SD 3.14Å; I295-F388 HydrophobicContact CB-CE1 4.46Å; I295-F388 HydrophobicContact CD1-CD1 3.66Å; I295-F388 HydrophobicContact CD1-CE1 3.27Å; I295-F388 HydrophobicContact CD1-CE2 4.39Å; I295-F388 HydrophobicContact CD1-CG 4.39Å; I295-F388 HydrophobicContact CD1-CZ 3.68Å; I295-F388 HydrophobicContact CG1-CE1 4.44Å; I295-F388 HydrophobicContact CG2-CD1 4.36Å; I295-F388 HydrophobicContact CG2-CE1 4.39Å; I295-I389 HydrophobicContact CG2-CD1 4.1Å; I295-F448 HydrophobicContact CD1-CE1 4.09Å; I295-F448 HydrophobicContact CG1-CE1 4.06Å |
| 296 | M | 87.7 | Confident | 87.4 | Confident | 7 Ų | 7 | 13.2 Ų | 13.2 | 3% | 0.034 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -69.4 | -46.7 | 178.7 | -66.8 | -57.1 | -65.5 | 0 | 0 | 111.7 | I182 Y186 I292 A294 Y298 A299 I389 | I182-M296 HydrophobicContact CB-CE 4.47Å; I182-M296 HydrophobicContact CD1-CE 3.92Å; I182-M296 HydrophobicContact CG1-CE 4.5Å; I182-M296 HydrophobicContact CG2-CE 3.39Å; Y186-M296 HydrophobicContact CE2-CE 4.39Å; Y186-M296 PolarHBondContact OH-O 2.95Å; I292-M296 HydrophobicContact CD1-CG 4.03Å; I292-M296 HydrophobicContact CD1-SD 4.37Å; I292-M296 HydrophobicContact CG1-CG 4.24Å; I292-M296 WeakPolarHBondContact O-CB 3.31Å; I292-M296 WeakPolarHBondContact O-CG 3.48Å; I292-M296 PolarHBondContact O-N 2.99Å; A294-M296 VanDerWaalsContact C-N 3.27Å; A294-M296 PolarHBondContact O-N 2.69Å; M296-Y298 VanDerWaalsContact C-N 3.31Å; M296-Y298 PolarHBondContact O-N 3.2Å; M296-A299 PolarHBondContact O-N 2.82Å; M296-I389 HydrophobicContact SD-CD1 3.74Å; M296-I389 HydrophobicContact SD-CG1 4.39Å |
| 297 | F | 87.4 | Confident | 86.3 | Confident | 0 Ų | 0 | 16.5 Ų | 16.5 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -73.2 | -25.5 | -174.6 | -71.4 | 9.7 | 0 | 0 | 0 | 113.5 | L57 S60 S61 G86 V89 T90 N293 A294 T432 | L57-F297 HydrophobicContact CB-CE1 3.93Å; L57-F297 HydrophobicContact CD2-CE1 3.59Å; L57-F297 HydrophobicContact CD2-CZ 3.54Å; L57-F297 HydrophobicContact CG-CE1 4.34Å; L57-F297 VanDerWaalsContact O-CD1 3.24Å; L57-F297 WeakPolarHBondContact O-CD1 3.48Å; L57-F297 VanDerWaalsContact O-CE1 3.28Å; L57-F297 WeakPolarHBondContact O-CE1 3.32Å; S60-F297 CarbonylContact C-O 3.46Å; S61-F297 VanDerWaalsContact CA-O 3.26Å; S61-F297 WeakPolarHBondContact CA-O 3.2Å; S61-F297 PolarHBondContact N-O 2.87Å; G86-F297 VanDerWaalsContact O-CD2 3.27Å; G86-F297 WeakPolarHBondContact O-CD2 3.3Å; G86-F297 WeakPolarHBondContact O-CE2 3.47Å; V89-F297 HydrophobicContact CG1-CE2 3.64Å; V89-F297 HydrophobicContact CG1-CZ 3.86Å; T90-F297 HydrophobicContact CG2-CE2 4.08Å; T90-F297 HydrophobicContact CG2-CZ 4.31Å; N293-F297 VanDerWaalsContact O-CB 3.3Å; N293-F297 WeakPolarHBondContact O-CB 3.29Å; N293-F297 WeakPolarHBondContact O-CD1 3.37Å; N293-F297 VanDerWaalsContact O-CG 3.22Å; N293-F297 WeakPolarHBondContact O-CG 3.43Å; N293-F297 PolarHBondContact O-N 3.44Å; A294-F297 PolarHBondContact O-N 3.17Å; F297-T432 HydrophobicContact CD2-CG2 3.5Å; F297-T432 VanDerWaalsContact CD2-CG2 3.5Å; F297-T432 HydrophobicContact CE2-CG2 4.04Å; F297-T432 HydrophobicContact CG-CG2 4.43Å |
| 298 | Y | 85.9 | Confident | 85.3 | Confident | 9 Ų | 9 | 18.5 Ų | 18.5 | 4% | 0.035 | 9% | 0.092 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -113.2 | 21.8 | 179.4 | -56.5 | -75.8 | 0 | 0 | 0 | 111.9 | I64 S83 A294 M296 E300 D301 I302 T432 F435 | I64-Y298 HydrophobicContact CD1-CD1 4.17Å; I64-Y298 HydrophobicContact CD1-CE1 3.8Å; S83-Y298 WeakPolarHBondContact CA-OH 3.24Å; A294-Y298 HydrophobicContact CB-CD2 4.43Å; A294-Y298 WeakPolarHBondContact O-CB 3.48Å; A294-Y298 WeakPolarHBondContact O-CD2 3.28Å; A294-Y298 PolarHBondContact O-N 3.18Å; M296-Y298 VanDerWaalsContact C-N 3.31Å; M296-Y298 PolarHBondContact O-N 3.2Å; Y298-E300 VanDerWaalsContact C-N 3.34Å; Y298-E300 PolarHBondContact O-N 3.42Å; Y298-D301 PolarHBondContact O-N 3.47Å; Y298-D301 VanDerWaalsContact O-N 3.16Å; Y298-I302 WeakPolarHBondContact O-CB 3.42Å; Y298-I302 VanDerWaalsContact O-CG1 3.23Å; Y298-I302 WeakPolarHBondContact O-CG1 3.3Å; Y298-I302 PolarHBondContact O-N 3.14Å; Y298-T432 HydrophobicContact CE2-CG2 4.02Å; Y298-T432 PolarHBondContact OH-O 3.48Å; Y298-F435 HydrophobicContact CD2-CB 4.48Å; Y298-F435 AromaticContact CD2-CD1 3.34Å; Y298-F435 HydrophobicContact CD2-CD1 3.34Å; Y298-F435 AromaticContact CD2-CE1 3.84Å; Y298-F435 HydrophobicContact CD2-CE1 3.84Å; Y298-F435 HydrophobicContact CD2-CG 4.16Å; Y298-F435 HydrophobicContact CE2-CB 4.13Å; Y298-F435 AromaticContact CE2-CD1 3.73Å; Y298-F435 HydrophobicContact CE2-CD1 3.73Å; Y298-F435 HydrophobicContact CE2-CG 4.3Å; Y298-F435 AromaticContact CG-CD1 3.95Å; Y298-F435 HydrophobicContact CG-CD1 3.95Å; Y298-F435 HydrophobicContact CG-CE1 4.09Å |
| 299 | A | 86.9 | Confident | 84 | Confident | 4 Ų | 4 | 28.4 Ų | 28.4 | 3% | 0.033 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -55.7 | -47.5 | -173.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | I295 M296 I302 F303 | I295-A299 WeakPolarHBondContact O-CA 3.37Å; I295-A299 VanDerWaalsContact O-CB 3.27Å; I295-A299 WeakPolarHBondContact O-CB 3.22Å; I295-A299 PolarHBondContact O-N 3.42Å; M296-A299 PolarHBondContact O-N 2.82Å; A299-I302 PolarHBondContact O-N 3.24Å; A299-F303 WeakPolarHBondContact O-CD2 3.48Å; A299-F303 PolarHBondContact O-N 3.24Å; A299-F303 VanDerWaalsContact O-N 3.13Å |
| 300 | E | 83.5 | Confident | 83.4 | Confident | 15 Ų | 15 | 32.1 Ų | 32.1 | 7% | 0.07 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -64.2 | -45.8 | 177.3 | -171.3 | -178.5 | 137.4 | 0 | 0 | 112.1 | S61 P62 P65 Y298 I302 F303 V304 | S61-E300 WeakPolarHBondContact OG-CB 3.47Å; S61-E300 PolarHBondContact OG-N 2.95Å; S61-E300 VanDerWaalsContact OG-N 3.08Å; P62-E300 VanDerWaalsContact CA-OE2 3.3Å; P62-E300 WeakPolarHBondContact CA-OE2 3.46Å; P65-E300 HydrophobicContact CG-CB 4.23Å; P65-E300 HydrophobicContact CG-CG 4.2Å; Y298-E300 VanDerWaalsContact C-N 3.34Å; Y298-E300 PolarHBondContact O-N 3.42Å; E300-I302 VanDerWaalsContact C-N 3.31Å; E300-I302 PolarHBondContact O-N 3.45Å; E300-F303 PolarHBondContact O-N 2.89Å; E300-F303 VanDerWaalsContact O-N 3.09Å; E300-V304 WeakPolarHBondContact O-CG2 3.37Å; E300-V304 PolarHBondContact O-N 3.02Å |
| 301 | D | 82.9 | Confident | 82.8 | Confident | 41 Ų | 41 | 32.5 Ų | 32.5 | 22% | 0.219 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -60.8 | -40.5 | 178.3 | -173.1 | 76.2 | 0 | 0 | 0 | 112 | Y298 F303 V304 Q305 | Y298-D301 PolarHBondContact O-N 3.47Å; Y298-D301 VanDerWaalsContact O-N 3.16Å; D301-F303 VanDerWaalsContact C-N 3.32Å; D301-F303 PolarHBondContact O-N 3.23Å; D301-V304 WeakPolarHBondContact O-CB 3.35Å; D301-V304 PolarHBondContact O-N 3.4Å; D301-Q305 WeakPolarHBondContact O-CG 3.24Å; D301-Q305 PolarHBondContact O-N 3.35Å; D301-Q305 PolarHBondContact OD2-NE2 3.31Å |
| 302 | I | 83.8 | Confident | 82.3 | Confident | 0 Ų | 0 | 36.7 Ų | 36.7 | 0% | 0 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -60.6 | -41.7 | 174.4 | -69.5 | 164.5 | 0 | 0 | 0 | 110.9 | I295 Y298 A299 E300 Q305 A306 F356 F360 M385 F435 F448 | I295-I302 HydrophobicContact CG1-CD1 4.37Å; Y298-I302 WeakPolarHBondContact O-CB 3.42Å; Y298-I302 VanDerWaalsContact O-CG1 3.23Å; Y298-I302 WeakPolarHBondContact O-CG1 3.3Å; Y298-I302 PolarHBondContact O-N 3.14Å; A299-I302 PolarHBondContact O-N 3.24Å; E300-I302 VanDerWaalsContact C-N 3.31Å; E300-I302 PolarHBondContact O-N 3.45Å; I302-Q305 PolarHBondContact O-N 3.05Å; I302-A306 WeakPolarHBondContact O-CB 3.38Å; I302-A306 PolarHBondContact O-N 2.88Å; I302-F356 HydrophobicContact CG2-CE1 3.66Å; I302-F356 HydrophobicContact CG2-CZ 3.5Å; I302-F356 VanDerWaalsContact CG2-CZ 3.5Å; I302-F360 HydrophobicContact CG2-CZ 4.4Å; I302-M385 HydrophobicContact CB-CE 4.44Å; I302-M385 HydrophobicContact CD1-CE 4.08Å; I302-M385 HydrophobicContact CG2-CE 3.68Å; I302-F435 HydrophobicContact CD1-CE1 4.27Å; I302-F435 HydrophobicContact CD1-CZ 3.91Å; I302-F435 HydrophobicContact CG1-CE1 4.32Å; I302-F435 HydrophobicContact CG1-CZ 4.13Å; I302-F448 HydrophobicContact CD1-CZ 4.32Å; I302-F448 HydrophobicContact CG2-CZ 4.46Å |
| 303 | F | 83.4 | Confident | 82 | Confident | 0 Ų | 0 | 39.9 Ų | 39.9 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -69.8 | -34.3 | 176.6 | -78.1 | -57.4 | 0 | 0 | 0 | 112.9 | A299 E300 D301 Q305 A306 H307 F308 S311 A314 V318 L382 M385 | A299-F303 WeakPolarHBondContact O-CD2 3.48Å; A299-F303 PolarHBondContact O-N 3.24Å; A299-F303 VanDerWaalsContact O-N 3.13Å; E300-F303 PolarHBondContact O-N 2.89Å; E300-F303 VanDerWaalsContact O-N 3.09Å; D301-F303 VanDerWaalsContact C-N 3.32Å; D301-F303 PolarHBondContact O-N 3.23Å; F303-Q305 VanDerWaalsContact C-N 3.33Å; F303-A306 CarbonylContact O-C 3.52Å; F303-A306 PolarHBondContact O-N 3.34Å; F303-H307 PolarHBondContact O-N 2.87Å; F303-F308 HydrophobicContact CB-CB 4.12Å; F303-F308 HydrophobicContact CD1-CB 4.4Å; F303-F308 HydrophobicContact CD1-CD2 4.24Å; F303-F308 HydrophobicContact CD1-CG 4.46Å; F303-F308 WeakPolarHBondContact O-CB 3.45Å; F303-F308 PolarHBondContact O-N 3.17Å; F303-S311 PolarHBondContact O-OG 3.01Å; F303-A314 HydrophobicContact CD1-CB 3.93Å; F303-A314 HydrophobicContact CD2-CB 3.72Å; F303-A314 HydrophobicContact CE1-CB 4.02Å; F303-A314 HydrophobicContact CE2-CB 3.81Å; F303-A314 HydrophobicContact CG-CB 3.8Å; F303-A314 HydrophobicContact CZ-CB 3.97Å; F303-V318 HydrophobicContact CE2-CG2 4.17Å; F303-V318 HydrophobicContact CZ-CG2 3.88Å; F303-L382 HydrophobicContact CE1-CB 4.37Å; F303-L382 HydrophobicContact CE1-CD1 3.96Å; F303-L382 HydrophobicContact CZ-CD1 3.77Å; F303-M385 HydrophobicContact CZ-CB 4.1Å; F303-M385 HydrophobicContact CZ-CG 4.09Å |
| 304 | V | 80.9 | Confident | 81.9 | Confident | 53 Ų | 53 | 39.2 Ų | 39.2 | 32% | 0.321 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -62.4 | -44.4 | 172 | 171.7 | 0 | 0 | 0 | 0 | 109.9 | E300 D301 A306 H307 S311 | E300-V304 WeakPolarHBondContact O-CG2 3.37Å; E300-V304 PolarHBondContact O-N 3.02Å; D301-V304 WeakPolarHBondContact O-CB 3.35Å; D301-V304 PolarHBondContact O-N 3.4Å; V304-A306 VanDerWaalsContact C-N 3.28Å; V304-A306 PolarHBondContact O-N 2.72Å; V304-H307 PolarHBondContact O-N 3.47Å; V304-H307 VanDerWaalsContact O-N 3.08Å; V304-S311 WeakPolarHBondContact CA-OG 3.39Å; V304-S311 WeakPolarHBondContact CG2-OG 3.49Å; V304-S311 PolarHBondContact N-OG 3.1Å; V304-S311 VanDerWaalsContact N-OG 3.08Å |
| 305 | Q | 75.5 | Confident | 81.7 | Confident | 36 Ų | 36 | 39.4 Ų | 39.4 | 17% | 0.168 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -65 | -30.2 | 175.2 | -69.5 | -173.7 | 50.4 | 0 | 0 | 112.8 | D301 I302 F303 H307 F360 | D301-Q305 WeakPolarHBondContact O-CG 3.24Å; D301-Q305 PolarHBondContact O-N 3.35Å; D301-Q305 PolarHBondContact OD2-NE2 3.31Å; I302-Q305 PolarHBondContact O-N 3.05Å; F303-Q305 VanDerWaalsContact C-N 3.33Å; Q305-H307 PolarHBondContact O-N 2.82Å; Q305-F360 HydrophobicContact CB-CE1 4.3Å |
| 306 | A | 74.7 | Confident | 81.7 | Confident | 0 Ų | 0 | 40.3 Ų | 40.3 | 0% | 0 | 19% | 0.194 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -81 | 13.6 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | I302 F303 V304 F308 Y359 F360 A381 | I302-A306 WeakPolarHBondContact O-CB 3.38Å; I302-A306 PolarHBondContact O-N 2.88Å; F303-A306 CarbonylContact O-C 3.52Å; F303-A306 PolarHBondContact O-N 3.34Å; V304-A306 VanDerWaalsContact C-N 3.28Å; V304-A306 PolarHBondContact O-N 2.72Å; A306-F308 PolarHBondContact O-N 3.37Å; A306-F308 VanDerWaalsContact O-N 3.15Å; A306-Y359 HydrophobicContact CB-CE1 3.75Å; A306-Y359 PolarHBondContact O-OH 2.97Å; A306-F360 HydrophobicContact CB-CE1 4.45Å; A306-F360 HydrophobicContact CB-CZ 4.27Å; A306-A381 HydrophobicContact CB-CB 4.06Å |
| 307 | H | 71.8 | Confident | 81.8 | Confident | 104 Ų | 104 | 43.8 Ų | 43.8 | 48% | 0.481 | 21% | 0.212 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 57.9 | 27.8 | 179 | -56.3 | -67.6 | 0 | 0 | 0 | 114.3 | F303 V304 Q305 K309 | F303-H307 PolarHBondContact O-N 2.87Å; V304-H307 PolarHBondContact O-N 3.47Å; V304-H307 VanDerWaalsContact O-N 3.08Å; Q305-H307 PolarHBondContact O-N 2.82Å; H307-K309 PolarHBondContact O-N 3.11Å |
| 308 | F | 72.3 | Confident | 81.9 | Confident | 48 Ų | 48 | 43.9 Ų | 43.9 | 21% | 0.211 | 21% | 0.213 | C | C | . | . | trans | -77.4 | 112.6 | 175.8 | -140.5 | -77.5 | 0 | 0 | 0 | 109.7 | F303 A306 E310 S311 A314 T378 L382 | F303-F308 HydrophobicContact CB-CB 4.12Å; F303-F308 HydrophobicContact CD1-CB 4.4Å; F303-F308 HydrophobicContact CD1-CD2 4.24Å; F303-F308 HydrophobicContact CD1-CG 4.46Å; F303-F308 WeakPolarHBondContact O-CB 3.45Å; F303-F308 PolarHBondContact O-N 3.17Å; A306-F308 PolarHBondContact O-N 3.37Å; A306-F308 VanDerWaalsContact O-N 3.15Å; F308-E310 HydrophobicContact CD1-CB 4.36Å; F308-E310 HydrophobicContact CE1-CB 4.48Å; F308-E310 PolarHBondContact O-N 2.97Å; F308-S311 PolarHBondContact O-N 3.47Å; F308-S311 PolarHBondContact O-OG 3.26Å; F308-A314 HydrophobicContact CD1-CB 4.03Å; F308-A314 HydrophobicContact CE1-CB 4.12Å; F308-A314 HydrophobicContact CG-CB 4.33Å; F308-T378 HydrophobicContact CB-CG2 4.33Å; F308-T378 HydrophobicContact CD2-CG2 3.2Å; F308-T378 HydrophobicContact CE2-CG2 3.56Å; F308-T378 HydrophobicContact CG-CG2 3.96Å; F308-L382 HydrophobicContact CE2-CB 4.06Å; F308-L382 HydrophobicContact CE2-CD2 4.29Å; F308-L382 HydrophobicContact CZ-CD2 4.11Å | ||
| 309 | K | 67.3 | Low | 82.2 | Confident | 214 Ų | 214 | 43.5 Ų | 43.5 | 93% | 0.93 | 21% | 0.212 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -58.3 | -33.3 | -179.5 | -70.6 | -176.4 | 179.6 | 177.3 | 0 | 112.7 | H307 | H307-K309 PolarHBondContact O-N 3.11Š|
| 310 | E | 79.9 | Confident | 82.5 | Confident | 121 Ų | 121 | 47.4 Ų | 47.4 | 57% | 0.565 | 23% | 0.231 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -111.8 | 57.3 | 179.8 | -63.7 | 177.4 | -170.3 | 0 | 0 | 111.1 | F308 E312 L313 A314 | F308-E310 HydrophobicContact CD1-CB 4.36Å; F308-E310 HydrophobicContact CE1-CB 4.48Å; F308-E310 PolarHBondContact O-N 2.97Å; E310-E312 PolarHBondContact O-N 2.81Å; E310-L313 HydrophobicContact CB-CB 4.18Å; E310-L313 HydrophobicContact CB-CD1 4.09Å; E310-L313 HydrophobicContact CG-CD1 4.25Å; E310-L313 PolarHBondContact O-N 3Å; E310-L313 WeakPolarHBondContact OE2-CD1 3.39Å; E310-A314 PolarHBondContact O-N 3.49Å |
| 311 | S | 81.4 | Confident | 82.9 | Confident | 9 Ų | 9 | 48.6 Ų | 48.6 | 6% | 0.063 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -58 | -35.6 | -176.3 | -66.7 | 0 | 0 | 0 | 0 | 113.2 | F303 V304 F308 A314 S315 | F303-S311 PolarHBondContact O-OG 3.01Å; V304-S311 WeakPolarHBondContact CA-OG 3.39Å; V304-S311 WeakPolarHBondContact CG2-OG 3.49Å; V304-S311 PolarHBondContact N-OG 3.1Å; V304-S311 VanDerWaalsContact N-OG 3.08Å; F308-S311 PolarHBondContact O-N 3.47Å; F308-S311 PolarHBondContact O-OG 3.26Å; S311-A314 PolarHBondContact O-N 2.99Å; S311-S315 PolarHBondContact O-N 3.31Å; S311-S315 VanDerWaalsContact O-N 3.14Å |
| 312 | E | 81.8 | Confident | 83.4 | Confident | 87 Ų | 87 | 47 Ų | 47 | 41% | 0.407 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -64 | -48.6 | 177.6 | -56 | 172.2 | -164.2 | 0 | 0 | 111.2 | L190 E310 A314 S315 V316 | L190-E312 HydrophobicContact CD2-CB 3.4Å; E310-E312 PolarHBondContact O-N 2.81Å; E312-A314 VanDerWaalsContact C-N 3.34Å; E312-A314 PolarHBondContact O-N 3.07Å; E312-S315 PolarHBondContact O-N 3.1Å; E312-S315 PolarHBondContact O-OG 3.07Å; E312-V316 PolarHBondContact O-N 2.72Å |
| 313 | L | 86.3 | Confident | 83.8 | Confident | 73 Ų | 73 | 48 Ų | 48 | 38% | 0.382 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -64.7 | -37.3 | 177.2 | -71.4 | 171.9 | 0 | 0 | 0 | 112.2 | L190 E310 S315 V316 I317 | L190-L313 HydrophobicContact CD1-CD2 3.66Å; L190-L313 HydrophobicContact CD2-CD2 4.42Å; E310-L313 HydrophobicContact CB-CB 4.18Å; E310-L313 HydrophobicContact CB-CD1 4.09Å; E310-L313 HydrophobicContact CG-CD1 4.25Å; E310-L313 PolarHBondContact O-N 3Å; E310-L313 WeakPolarHBondContact OE2-CD1 3.39Å; L313-S315 VanDerWaalsContact C-N 3.32Å; L313-S315 PolarHBondContact O-N 3.26Å; L313-V316 PolarHBondContact O-N 3.39Å; L313-I317 WeakPolarHBondContact O-CG1 3.48Å; L313-I317 PolarHBondContact O-N 3.34Å |
| 314 | A | 85.9 | Confident | 84.3 | Confident | 1 Ų | 1 | 52.3 Ų | 52.3 | 1% | 0.008 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -59.8 | -42.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | F303 F308 E310 S311 E312 V316 I317 V318 L382 | F303-A314 HydrophobicContact CD1-CB 3.93Å; F303-A314 HydrophobicContact CD2-CB 3.72Å; F303-A314 HydrophobicContact CE1-CB 4.02Å; F303-A314 HydrophobicContact CE2-CB 3.81Å; F303-A314 HydrophobicContact CG-CB 3.8Å; F303-A314 HydrophobicContact CZ-CB 3.97Å; F308-A314 HydrophobicContact CD1-CB 4.03Å; F308-A314 HydrophobicContact CE1-CB 4.12Å; F308-A314 HydrophobicContact CG-CB 4.33Å; E310-A314 PolarHBondContact O-N 3.49Å; S311-A314 PolarHBondContact O-N 2.99Å; E312-A314 VanDerWaalsContact C-N 3.34Å; E312-A314 PolarHBondContact O-N 3.07Å; A314-V316 VanDerWaalsContact C-N 3.34Å; A314-V316 PolarHBondContact O-N 2.95Å; A314-I317 PolarHBondContact O-N 2.65Å; A314-V318 WeakPolarHBondContact O-CG2 3.28Å; A314-V318 PolarHBondContact O-N 3.34Å; A314-V318 VanDerWaalsContact O-N 3.09Å; A314-L382 HydrophobicContact CB-CD1 4.09Å |
| 315 | S | 86.3 | Confident | 84.9 | Confident | 3 Ų | 3 | 53 Ų | 53 | 2% | 0.021 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -61.9 | -40.6 | 176.1 | 79.6 | 0 | 0 | 0 | 0 | 112.1 | Y186 S311 E312 L313 V318 A319 | Y186-S315 VanDerWaalsContact CD2-O 3.28Å; Y186-S315 WeakPolarHBondContact CD2-O 3.46Å; S311-S315 PolarHBondContact O-N 3.31Å; S311-S315 VanDerWaalsContact O-N 3.14Å; E312-S315 PolarHBondContact O-N 3.1Å; E312-S315 PolarHBondContact O-OG 3.07Å; L313-S315 VanDerWaalsContact C-N 3.32Å; L313-S315 PolarHBondContact O-N 3.26Å; S315-V318 PolarHBondContact O-N 3.18Å; S315-A319 PolarHBondContact O-N 3.37Å |
| 316 | V | 90.6 | Very high | 85.5 | Confident | 22 Ų | 22 | 51.7 Ų | 51.7 | 13% | 0.133 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -65.2 | -44.2 | 177.3 | 175.2 | 0 | 0 | 0 | 0 | 111.7 | Y186 L187 L190 E312 L313 A314 V318 A319 L320 | Y186-V316 VanDerWaalsContact C-CG2 3.5Å; Y186-V316 WeakPolarHBondContact O-CG2 3.5Å; L187-V316 HydrophobicContact CD1-CG1 4.38Å; L190-V316 HydrophobicContact CD1-CG2 4.08Å; L190-V316 HydrophobicContact CD2-CG2 4.06Å; L190-V316 HydrophobicContact CG-CG2 4.1Å; E312-V316 PolarHBondContact O-N 2.72Å; L313-V316 PolarHBondContact O-N 3.39Å; A314-V316 VanDerWaalsContact C-N 3.34Å; A314-V316 PolarHBondContact O-N 2.95Å; V316-V318 VanDerWaalsContact C-N 3.29Å; V316-V318 PolarHBondContact O-N 3.36Å; V316-A319 PolarHBondContact O-N 3.16Å; V316-L320 PolarHBondContact O-N 3.45Å |
| 317 | I | 90.5 | Very high | 86.2 | Confident | 79 Ų | 79 | 52.8 Ų | 52.8 | 41% | 0.405 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -58.7 | -44.9 | 176.9 | -69.5 | 166.3 | 0 | 0 | 0 | 110.3 | L313 A314 L320 I321 | L313-I317 WeakPolarHBondContact O-CG1 3.48Å; L313-I317 PolarHBondContact O-N 3.34Å; A314-I317 PolarHBondContact O-N 2.65Å; I317-L320 WeakPolarHBondContact O-CB 3.36Å; I317-L320 PolarHBondContact O-N 3.44Å; I317-I321 HydrophobicContact CG2-CD1 4.16Å; I317-I321 WeakPolarHBondContact O-CG1 3.27Å; I317-I321 PolarHBondContact O-N 2.96Å |
| 318 | V | 89.5 | Confident | 87 | Confident | 3 Ų | 3 | 51.1 Ų | 51.1 | 2% | 0.018 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -63.6 | -41.7 | 178.2 | 165.2 | 0 | 0 | 0 | 0 | 111.9 | F303 A314 S315 V316 I321 Q322 L382 M385 I389 | F303-V318 HydrophobicContact CE2-CG2 4.17Å; F303-V318 HydrophobicContact CZ-CG2 3.88Å; A314-V318 WeakPolarHBondContact O-CG2 3.28Å; A314-V318 PolarHBondContact O-N 3.34Å; A314-V318 VanDerWaalsContact O-N 3.09Å; S315-V318 PolarHBondContact O-N 3.18Å; V316-V318 VanDerWaalsContact C-N 3.29Å; V316-V318 PolarHBondContact O-N 3.36Å; V318-I321 WeakPolarHBondContact O-CB 3.18Å; V318-I321 PolarHBondContact O-N 3.25Å; V318-Q322 PolarHBondContact O-N 2.9Å; V318-L382 HydrophobicContact CG2-CD1 3.85Å; V318-M385 HydrophobicContact CG1-CG 4.23Å; V318-M385 HydrophobicContact CG2-CB 4.43Å; V318-M385 HydrophobicContact CG2-CG 4.19Å; V318-I389 HydrophobicContact CG1-CB 4.25Å; V318-I389 HydrophobicContact CG1-CD1 3.06Å; V318-I389 HydrophobicContact CG1-CG1 4.16Å; V318-I389 HydrophobicContact CG1-CG2 4.31Å |
| 319 | A | 90.7 | Very high | 87.7 | Confident | 1 Ų | 1 | 48.9 Ų | 48.9 | 1% | 0.008 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -66.7 | -36.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | M183 Y186 S315 V316 I321 Q322 V323 | M183-A319 HydrophobicContact CB-CB 3.92Å; M183-A319 HydrophobicContact CG-CB 4.15Å; Y186-A319 HydrophobicContact CD2-CB 3.57Å; Y186-A319 HydrophobicContact CE2-CB 4Å; S315-A319 PolarHBondContact O-N 3.37Å; V316-A319 PolarHBondContact O-N 3.16Å; A319-I321 VanDerWaalsContact C-N 3.34Å; A319-Q322 VanDerWaalsContact O-CB 3.25Å; A319-Q322 WeakPolarHBondContact O-CB 3.49Å; A319-Q322 PolarHBondContact O-N 3.43Å; A319-V323 WeakPolarHBondContact O-CG2 3.31Å; A319-V323 PolarHBondContact O-N 3.28Å |
| 320 | L | 94.2 | Very high | 88.3 | Confident | 85 Ų | 85 | 40 Ų | 40 | 45% | 0.445 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -61.4 | -44 | 173.2 | 177 | 63.2 | 0 | 0 | 0 | 111.4 | M183 V316 I317 Q322 V323 I324 | M183-L320 HydrophobicContact SD-CB 4.45Å; M183-L320 HydrophobicContact SD-CD1 4.06Å; V316-L320 PolarHBondContact O-N 3.45Å; I317-L320 WeakPolarHBondContact O-CB 3.36Å; I317-L320 PolarHBondContact O-N 3.44Å; L320-Q322 VanDerWaalsContact C-N 3.27Å; L320-Q322 PolarHBondContact O-N 3.09Å; L320-V323 PolarHBondContact O-N 2.89Å; L320-I324 HydrophobicContact CD1-CD1 4.33Å; L320-I324 HydrophobicContact CG-CD1 4.12Å; L320-I324 WeakPolarHBondContact O-CG1 3.44Å; L320-I324 PolarHBondContact O-N 3.34Å |
| 321 | I | 92.4 | Very high | 88.5 | Confident | 41 Ų | 41 | 38.7 Ų | 38.7 | 21% | 0.21 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -59.1 | -42.9 | 174.3 | -69.1 | 171.9 | 0 | 0 | 0 | 110 | I317 V318 A319 V323 I324 F325 A386 A390 | I317-I321 HydrophobicContact CG2-CD1 4.16Å; I317-I321 WeakPolarHBondContact O-CG1 3.27Å; I317-I321 PolarHBondContact O-N 2.96Å; V318-I321 WeakPolarHBondContact O-CB 3.18Å; V318-I321 PolarHBondContact O-N 3.25Å; A319-I321 VanDerWaalsContact C-N 3.34Å; I321-V323 VanDerWaalsContact C-N 3.33Å; I321-V323 PolarHBondContact O-N 3.32Å; I321-I324 PolarHBondContact O-N 3.5Å; I321-F325 HydrophobicContact CG2-CD2 3.64Å; I321-F325 HydrophobicContact CG2-CE2 3.89Å; I321-F325 WeakPolarHBondContact O-CD2 3.34Å; I321-F325 PolarHBondContact O-N 2.82Å; I321-A386 HydrophobicContact CD1-CB 3.55Å; I321-A390 HydrophobicContact CG2-CB 3.98Å |
| 322 | Q | 92 | Very high | 88.7 | Confident | 6 Ų | 6 | 41.4 Ų | 41.4 | 3% | 0.028 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -57.3 | -44.5 | 175.9 | -160.5 | 175.2 | 18 | 0 | 0 | 112.5 | V179 V318 A319 L320 T326 I389 A393 | V179-Q322 HydrophobicContact CB-CG 4.25Å; V179-Q322 HydrophobicContact CG1-CG 3.83Å; V318-Q322 PolarHBondContact O-N 2.9Å; A319-Q322 VanDerWaalsContact O-CB 3.25Å; A319-Q322 WeakPolarHBondContact O-CB 3.49Å; A319-Q322 PolarHBondContact O-N 3.43Å; L320-Q322 VanDerWaalsContact C-N 3.27Å; L320-Q322 PolarHBondContact O-N 3.09Å; Q322-T326 VanDerWaalsContact O-CB 3.26Å; Q322-T326 WeakPolarHBondContact O-CB 3.22Å; Q322-T326 PolarHBondContact O-N 3.4Å; Q322-T326 PolarHBondContact O-OG1 3.39Å; Q322-I389 HydrophobicContact CB-CG2 3.43Å; Q322-I389 VanDerWaalsContact CB-CG2 3.43Å; Q322-I389 HydrophobicContact CG-CG2 3.52Å; Q322-A393 HydrophobicContact CG-CB 4.33Å |
| 323 | V | 93.4 | Very high | 88.5 | Confident | 23 Ų | 23 | 38 Ų | 38 | 14% | 0.139 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -61.8 | -48.5 | 178.2 | 172.8 | 0 | 0 | 0 | 0 | 110.9 | V179 L180 M183 A319 L320 I321 T326 G327 | V179-V323 HydrophobicContact CB-CG2 4.18Å; V179-V323 HydrophobicContact CG2-CB 4.45Å; V179-V323 HydrophobicContact CG2-CG2 3.96Å; L180-V323 HydrophobicContact CD2-CG1 3.76Å; L180-V323 HydrophobicContact CD2-CG2 4.02Å; L180-V323 HydrophobicContact CG-CG1 4.39Å; L180-V323 HydrophobicContact CG-CG2 4.49Å; M183-V323 HydrophobicContact CB-CG2 4.1Å; M183-V323 HydrophobicContact SD-CG2 3.88Å; A319-V323 WeakPolarHBondContact O-CG2 3.31Å; A319-V323 PolarHBondContact O-N 3.28Å; L320-V323 PolarHBondContact O-N 2.89Å; I321-V323 VanDerWaalsContact C-N 3.33Å; I321-V323 PolarHBondContact O-N 3.32Å; V323-T326 PolarHBondContact O-N 2.88Å; V323-G327 PolarHBondContact O-N 2.87Å |
| 324 | I | 93.7 | Very high | 87.8 | Confident | 89 Ų | 89 | 39.2 Ų | 39.2 | 46% | 0.456 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -60.2 | -51.2 | -179.5 | -66.3 | 167.2 | 0 | 0 | 0 | 110.4 | L320 I321 T326 G327 I328 | L320-I324 HydrophobicContact CD1-CD1 4.33Å; L320-I324 HydrophobicContact CG-CD1 4.12Å; L320-I324 WeakPolarHBondContact O-CG1 3.44Å; L320-I324 PolarHBondContact O-N 3.34Å; I321-I324 PolarHBondContact O-N 3.5Å; I324-T326 VanDerWaalsContact C-N 3.34Å; I324-T326 PolarHBondContact O-N 3.21Å; I324-G327 PolarHBondContact O-N 3.45Å; I324-I328 HydrophobicContact CG2-CD1 3.92Å; I324-I328 WeakPolarHBondContact O-CG1 3.47Å; I324-I328 PolarHBondContact O-N 3.32Å |
| 325 | F | 92.2 | Very high | 87.6 | Confident | 69 Ų | 69 | 48.6 Ų | 48.6 | 30% | 0.303 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -69.5 | -30.1 | -177.7 | -84.8 | -87.9 | 0 | 0 | 0 | 113.1 | I321 I328 A329 A390 A393 I394 | I321-F325 HydrophobicContact CG2-CD2 3.64Å; I321-F325 HydrophobicContact CG2-CE2 3.89Å; I321-F325 WeakPolarHBondContact O-CD2 3.34Å; I321-F325 PolarHBondContact O-N 2.82Å; F325-I328 HydrophobicContact CD1-CD1 4.49Å; F325-I328 PolarHBondContact O-N 2.95Å; F325-A329 VanDerWaalsContact O-CB 3.3Å; F325-A329 WeakPolarHBondContact O-CB 3.29Å; F325-A329 PolarHBondContact O-N 3.08Å; F325-A390 HydrophobicContact CB-CB 4.28Å; F325-A390 HydrophobicContact CD1-CB 3.89Å; F325-A390 HydrophobicContact CD2-CB 3.56Å; F325-A390 HydrophobicContact CE1-CB 4.03Å; F325-A390 HydrophobicContact CE2-CB 3.72Å; F325-A390 HydrophobicContact CG-CB 3.62Å; F325-A390 HydrophobicContact CZ-CB 3.95Å; F325-A393 HydrophobicContact CB-CB 3.94Å; F325-I394 HydrophobicContact CD1-CD1 3.53Å; F325-I394 HydrophobicContact CD1-CG1 3.78Å; F325-I394 HydrophobicContact CE1-CD1 3.86Å |
| 326 | T | 89.9 | Confident | 87.4 | Confident | 7 Ų | 7 | 50.4 Ų | 50.4 | 4% | 0.043 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -65.4 | -40.8 | 171.6 | -58.6 | 0 | 0 | 0 | 0 | 111.1 | Q175 V179 Q322 V323 I324 A329 A330 | Q175-T326 HydrophobicContact CB-CG2 4.36Å; Q175-T326 HydrophobicContact CG-CG2 3.77Å; V179-T326 HydrophobicContact CG2-CG2 4.05Å; Q322-T326 VanDerWaalsContact O-CB 3.26Å; Q322-T326 WeakPolarHBondContact O-CB 3.22Å; Q322-T326 PolarHBondContact O-N 3.4Å; Q322-T326 PolarHBondContact O-OG1 3.39Å; V323-T326 PolarHBondContact O-N 2.88Å; I324-T326 VanDerWaalsContact C-N 3.34Å; I324-T326 PolarHBondContact O-N 3.21Å; T326-A329 WeakPolarHBondContact O-CB 3.39Å; T326-A329 PolarHBondContact O-N 2.92Å; T326-A330 PolarHBondContact O-N 2.76Å; T326-A330 VanDerWaalsContact O-N 3.07Å |
| 327 | G | 88.1 | Confident | 87 | Confident | 23 Ų | 23 | 49.5 Ų | 49.5 | 24% | 0.237 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -62.8 | -42.7 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | V323 I324 A330 | V323-G327 PolarHBondContact O-N 2.87Å; I324-G327 PolarHBondContact O-N 3.45Å; G327-A330 PolarHBondContact O-N 3.39Å |
| 328 | I | 89.1 | Confident | 86.9 | Confident | 70 Ų | 70 | 46.8 Ų | 46.8 | 36% | 0.359 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -62.6 | -44.6 | 174.2 | -67 | 168.9 | 0 | 0 | 0 | 110.7 | I324 F325 A330 V331 I332 | I324-I328 HydrophobicContact CG2-CD1 3.92Å; I324-I328 WeakPolarHBondContact O-CG1 3.47Å; I324-I328 PolarHBondContact O-N 3.32Å; F325-I328 HydrophobicContact CD1-CD1 4.49Å; F325-I328 PolarHBondContact O-N 2.95Å; I328-A330 VanDerWaalsContact C-N 3.29Å; I328-A330 PolarHBondContact O-N 2.82Å; I328-V331 PolarHBondContact O-N 3.17Å; I328-V331 VanDerWaalsContact O-N 3.08Å; I328-I332 HydrophobicContact CG2-CD1 3.38Å; I328-I332 HydrophobicContact CG2-CG1 4.05Å; I328-I332 WeakPolarHBondContact O-CG1 3.19Å; I328-I332 PolarHBondContact O-N 3.06Å |
| 329 | A | 86.3 | Confident | 86.9 | Confident | 1 Ų | 1 | 49.3 Ų | 49.3 | 1% | 0.008 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -56.4 | -44.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | F325 T326 V331 I332 M333 A393 | F325-A329 VanDerWaalsContact O-CB 3.3Å; F325-A329 WeakPolarHBondContact O-CB 3.29Å; F325-A329 PolarHBondContact O-N 3.08Å; T326-A329 WeakPolarHBondContact O-CB 3.39Å; T326-A329 PolarHBondContact O-N 2.92Å; A329-V331 PolarHBondContact O-N 3.35Å; A329-I332 PolarHBondContact O-N 3.46Å; A329-M333 VanDerWaalsContact O-CB 3.24Å; A329-M333 WeakPolarHBondContact O-CB 3.45Å; A329-M333 PolarHBondContact O-N 3.17Å; A329-A393 VanDerWaalsContact CB-O 3.28Å; A329-A393 WeakPolarHBondContact CB-O 3.28Å |
| 330 | A | 80.8 | Confident | 87 | Confident | 27 Ų | 27 | 52.7 Ų | 52.7 | 22% | 0.223 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -57.6 | -35.8 | 178 | 0 | 0 | 0 | 0 | 0 | 112.8 | T326 G327 I328 | T326-A330 PolarHBondContact O-N 2.76Å; T326-A330 VanDerWaalsContact O-N 3.07Å; G327-A330 PolarHBondContact O-N 3.39Å; I328-A330 VanDerWaalsContact C-N 3.29Å; I328-A330 PolarHBondContact O-N 2.82Å |
| 331 | V | 82.9 | Confident | 86.9 | Confident | 94 Ų | 94 | 49 Ų | 49 | 57% | 0.57 | 26% | 0.258 | S | S | * | . | H | α-helix | trans | -80.1 | -37.7 | 178.5 | -180 | 0 | 0 | 0 | 0 | 111.9 | I328 A329 | I328-V331 PolarHBondContact O-N 3.17Å; I328-V331 VanDerWaalsContact O-N 3.08Å; A329-V331 PolarHBondContact O-N 3.35Å |
| 332 | I | 85.5 | Confident | 86.9 | Confident | 66 Ų | 66 | 47 Ų | 47 | 34% | 0.338 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -77.2 | -31.2 | -176.5 | -64.6 | -179.9 | 0 | 0 | 0 | 111.9 | I328 A329 D334 R335 A336 L341 | I328-I332 HydrophobicContact CG2-CD1 3.38Å; I328-I332 HydrophobicContact CG2-CG1 4.05Å; I328-I332 WeakPolarHBondContact O-CG1 3.19Å; I328-I332 PolarHBondContact O-N 3.06Å; A329-I332 PolarHBondContact O-N 3.46Å; I332-D334 VanDerWaalsContact C-N 3.26Å; I332-D334 PolarHBondContact O-N 2.93Å; I332-R335 WeakPolarHBondContact O-CA 3.24Å; I332-R335 PolarHBondContact O-N 3.26Å; I332-A336 HydrophobicContact CG2-CB 3.78Å; I332-A336 PolarHBondContact O-N 3.35Å; I332-L341 HydrophobicContact CG2-CD1 4.35Å; I332-L341 HydrophobicContact CG2-CD2 3.81Å |
| 333 | M | 77.4 | Confident | 87.1 | Confident | 14 Ų | 14 | 48.5 Ų | 48.5 | 7% | 0.069 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -55.9 | -38.8 | -173.7 | -172.3 | 172.6 | -61.6 | 0 | 0 | 113.6 | A329 R335 R338 L341 P398 I399 L402 | A329-M333 VanDerWaalsContact O-CB 3.24Å; A329-M333 WeakPolarHBondContact O-CB 3.45Å; A329-M333 PolarHBondContact O-N 3.17Å; M333-R335 PolarHBondContact O-N 3.46Å; M333-R338 PolarHBondContact O-NH1 3.39Å; M333-L341 HydrophobicContact CB-CD1 4.28Å; M333-L341 HydrophobicContact CG-CD1 4.45Å; M333-P398 HydrophobicContact CE-CB 3.77Å; M333-P398 HydrophobicContact CE-CG 3.52Å; M333-I399 HydrophobicContact CE-CD1 4.41Å; M333-I399 HydrophobicContact CE-CG1 3.59Å; M333-I399 HydrophobicContact SD-CG1 4.37Å; M333-L402 HydrophobicContact CG-CD2 4.43Å; M333-L402 HydrophobicContact SD-CD2 3.59Å; M333-L402 VanDerWaalsContact SD-CD2 3.59Å |
| 334 | D | 72.9 | Confident | 87.2 | Confident | 100 Ų | 100 | 52 Ų | 52 | 54% | 0.535 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -71.6 | -22.1 | 178.6 | -68.1 | -26.6 | 0 | 0 | 0 | 112.6 | I332 R338 K470 | I332-D334 VanDerWaalsContact C-N 3.26Å; I332-D334 PolarHBondContact O-N 2.93Å; D334-R338 IonicContact OD1-NH2 3.55Å; D334-K470 VanDerWaalsContact O-CE 3.24Å; D334-K470 WeakPolarHBondContact O-CE 3.45Å |
| 335 | R | 80.9 | Confident | 87.2 | Confident | 198 Ų | 198 | 47.8 Ų | 47.8 | 75% | 0.747 | 25% | 0.253 | S | S | * | . | H | α-helix | trans | -97.2 | -44.7 | -176.5 | -61.7 | -172.6 | -178.1 | -177.4 | 0.9 | 113.7 | I332 M333 K470 | I332-R335 WeakPolarHBondContact O-CA 3.24Å; I332-R335 PolarHBondContact O-N 3.26Å; M333-R335 PolarHBondContact O-N 3.46Å; R335-K470 PolarHBondContact O-NZ 2.83Å |
| 336 | A | 82.4 | Confident | 87.4 | Confident | 41 Ų | 41 | 44.6 Ų | 44.6 | 34% | 0.339 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -86.9 | -18.6 | -166.9 | 0 | 0 | 0 | 0 | 0 | 115.4 | I332 L341 | I332-A336 HydrophobicContact CG2-CB 3.78Å; I332-A336 PolarHBondContact O-N 3.35Å; A336-L341 HydrophobicContact CB-CD1 4.1Å; A336-L341 HydrophobicContact CB-CD2 4.03Å; A336-L341 HydrophobicContact CB-CG 3.88Å |
| 337 | G | 82.3 | Confident | 87.7 | Confident | 2 Ų | 2 | 46.9 Ų | 46.9 | 2% | 0.021 | 25% | 0.254 | C | S | . | . | trans | 88.1 | 150.1 | -172.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | L341 | G337-L341 WeakPolarHBondContact O-CD1 3.41Å; G337-L341 WeakPolarHBondContact O-CG 3.35Å; G337-L341 PolarHBondContact O-N 3.45Å | ||
| 338 | R | 87.8 | Confident | 88.1 | Confident | 22 Ų | 22 | 47.1 Ų | 47.1 | 8% | 0.083 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -75.8 | -41.1 | -169 | -76 | 75.3 | -179.5 | 142.2 | 11.8 | 110.8 | M333 D334 L342 I399 L402 I403 E406 E468 | M333-R338 PolarHBondContact O-NH1 3.39Å; D334-R338 IonicContact OD1-NH2 3.55Å; R338-L342 WeakPolarHBondContact O-CG 3Å; R338-L342 PolarHBondContact O-N 2.96Å; R338-L342 VanDerWaalsContact O-N 3.14Å; R338-I399 HydrophobicContact CB-CG2 3.84Å; R338-I399 HydrophobicContact CG-CG2 4.07Å; R338-L402 HydrophobicContact CG-CD2 4.07Å; R338-I403 HydrophobicContact CB-CD1 4.4Å; R338-I403 HydrophobicContact CB-CG1 4.48Å; R338-E406 IonicContact NE-OE1 3.99Å; R338-E406 IonicContact NE-OE2 3.64Å; R338-E406 IonicContact NH2-OE1 3.74Å; R338-E468 PolarHBondContact N-OE1 3.35Å; R338-E468 PolarHBondContact N-OE2 3.46Å |
| 339 | K | 91.1 | Very high | 88.4 | Confident | 56 Ų | 56 | 43.8 Ų | 43.8 | 24% | 0.243 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -66.9 | -43.9 | -178 | -175.3 | 176 | -175.9 | 153.2 | 0 | 111.7 | L341 L342 V343 T462 V463 V466 E468 | K339-L341 PolarHBondContact O-N 3.15Å; K339-L342 PolarHBondContact O-N 3.42Å; K339-V343 WeakPolarHBondContact O-CG2 2.69Å; K339-V343 PolarHBondContact O-N 2.94Å; K339-V343 VanDerWaalsContact O-N 3.15Å; K339-T462 VanDerWaalsContact CE-O 3.32Å; K339-T462 WeakPolarHBondContact CE-O 3.42Å; K339-T462 HydrophobicContact CG-CG2 4.32Å; K339-V463 WeakPolarHBondContact CE-O 3.33Å; K339-V463 PolarHBondContact NZ-O 3.11Å; K339-V466 WeakPolarHBondContact CD-O 3.26Å; K339-V466 WeakPolarHBondContact CE-O 3.48Å; K339-V466 PolarHBondContact NZ-O 2.95Å; K339-E468 WeakPolarHBondContact CB-OE2 3.26Å; K339-E468 PolarHBondContact N-OE2 3.32Å; K339-E468 VanDerWaalsContact N-OE2 3.09Å |
| 340 | V | 92.1 | Very high | 88.9 | Confident | 73 Ų | 73 | 46.8 Ų | 46.8 | 44% | 0.442 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -62.1 | -44.9 | 179.8 | 177.6 | 0 | 0 | 0 | 0 | 110.8 | V343 I344 | V340-V343 PolarHBondContact O-N 3.43Å; V340-I344 HydrophobicContact CG1-CD1 3.75Å; V340-I344 HydrophobicContact CG1-CG1 4.41Å; V340-I344 WeakPolarHBondContact O-CG1 3.29Å; V340-I344 PolarHBondContact O-N 2.91Å |
| 341 | L | 91.6 | Very high | 89.7 | Confident | 6 Ų | 6 | 50.5 Ų | 50.5 | 3% | 0.031 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -65.2 | -38.8 | 178.8 | -74.6 | 171.8 | 0 | 0 | 0 | 113 | I332 M333 A336 G337 K339 V343 S345 I394 I399 | I332-L341 HydrophobicContact CG2-CD1 4.35Å; I332-L341 HydrophobicContact CG2-CD2 3.81Å; M333-L341 HydrophobicContact CB-CD1 4.28Å; M333-L341 HydrophobicContact CG-CD1 4.45Å; A336-L341 HydrophobicContact CB-CD1 4.1Å; A336-L341 HydrophobicContact CB-CD2 4.03Å; A336-L341 HydrophobicContact CB-CG 3.88Å; G337-L341 WeakPolarHBondContact O-CD1 3.41Å; G337-L341 WeakPolarHBondContact O-CG 3.35Å; G337-L341 PolarHBondContact O-N 3.45Å; K339-L341 PolarHBondContact O-N 3.15Å; L341-V343 VanDerWaalsContact C-N 3.32Å; L341-V343 PolarHBondContact O-N 2.69Å; L341-S345 WeakPolarHBondContact O-CB 3.03Å; L341-S345 PolarHBondContact O-N 3.39Å; L341-I394 HydrophobicContact CD2-CG2 3.86Å; L341-I399 HydrophobicContact CB-CD1 3.38Å; L341-I399 HydrophobicContact CD1-CD1 4.13Å; L341-I399 HydrophobicContact CG-CD1 4.41Å |
| 342 | L | 93.4 | Very high | 90.2 | Very high | 0 Ų | 0 | 46.2 Ų | 46.2 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -61 | -40.6 | 173.7 | -75.8 | 173.4 | 0 | 0 | 0 | 112.2 | L283 R338 K339 G346 W396 I399 P400 I403 T462 V466 | L283-L342 HydrophobicContact CD2-CD1 4.32Å; R338-L342 WeakPolarHBondContact O-CG 3Å; R338-L342 PolarHBondContact O-N 2.96Å; R338-L342 VanDerWaalsContact O-N 3.14Å; K339-L342 PolarHBondContact O-N 3.42Å; L342-G346 PolarHBondContact O-N 3.11Å; L342-W396 HydrophobicContact CB-CZ2 4.11Å; L342-W396 HydrophobicContact CD2-CD2 3.78Å; L342-W396 HydrophobicContact CD2-CE3 3.97Å; L342-W396 HydrophobicContact CD2-CG 4.28Å; L342-W396 HydrophobicContact CD2-CH2 3.97Å; L342-W396 HydrophobicContact CD2-CZ2 3.87Å; L342-W396 HydrophobicContact CD2-CZ3 4.08Å; L342-W396 HydrophobicContact CG-CZ2 4.45Å; L342-W396 PolarHBondContact O-NE1 2.99Å; L342-I399 HydrophobicContact CD1-CG2 3.75Å; L342-I399 HydrophobicContact CD2-CB 3.81Å; L342-I399 HydrophobicContact CD2-CD1 4.37Å; L342-I399 HydrophobicContact CD2-CG2 3.91Å; L342-I399 HydrophobicContact CG-CB 4.07Å; L342-I399 HydrophobicContact CG-CD1 4.14Å; L342-I399 HydrophobicContact CG-CG2 3.67Å; L342-P400 HydrophobicContact CD2-CG 4.34Å; L342-I403 HydrophobicContact CD1-CD1 3.72Å; L342-T462 HydrophobicContact CB-CG2 3.61Å; L342-T462 HydrophobicContact CD1-CG2 4.01Å; L342-T462 HydrophobicContact CG-CG2 4.48Å; L342-V466 HydrophobicContact CD1-CG1 4.32Å |
| 343 | V | 95.3 | Very high | 90.6 | Very high | 37 Ų | 37 | 43.2 Ų | 43.2 | 22% | 0.224 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -67.8 | -49.4 | 178.2 | 173.2 | 0 | 0 | 0 | 0 | 111.1 | K339 V340 L341 S345 G346 V347 I459 T462 V463 | K339-V343 WeakPolarHBondContact O-CG2 2.69Å; K339-V343 PolarHBondContact O-N 2.94Å; K339-V343 VanDerWaalsContact O-N 3.15Å; V340-V343 PolarHBondContact O-N 3.43Å; L341-V343 VanDerWaalsContact C-N 3.32Å; L341-V343 PolarHBondContact O-N 2.69Å; V343-S345 VanDerWaalsContact C-N 3.33Å; V343-S345 PolarHBondContact O-N 3.35Å; V343-G346 PolarHBondContact O-N 3.03Å; V343-V347 WeakPolarHBondContact O-CG2 3.12Å; V343-V347 PolarHBondContact O-N 2.98Å; V343-I459 HydrophobicContact CG1-CG2 4.27Å; V343-T462 HydrophobicContact CG2-CG2 3.88Å; V343-V463 HydrophobicContact CG2-CG2 3.75Å |
| 344 | I | 94.8 | Very high | 91.4 | Very high | 97 Ų | 97 | 45.3 Ų | 45.3 | 50% | 0.497 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -59.6 | -46.4 | 178.5 | -66.7 | 170.2 | 0 | 0 | 0 | 110.6 | V340 G346 V347 A348 | V340-I344 HydrophobicContact CG1-CD1 3.75Å; V340-I344 HydrophobicContact CG1-CG1 4.41Å; V340-I344 WeakPolarHBondContact O-CG1 3.29Å; V340-I344 PolarHBondContact O-N 2.91Å; I344-G346 PolarHBondContact O-N 3.34Å; I344-V347 PolarHBondContact O-N 3.25Å; I344-A348 PolarHBondContact O-N 3.49Å |
| 345 | S | 94.9 | Very high | 92.4 | Very high | 1 Ų | 1 | 41.9 Ų | 41.9 | 1% | 0.007 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -58.2 | -46.4 | 175.9 | 174.5 | 0 | 0 | 0 | 0 | 111.6 | L341 V343 V347 A348 M349 G391 W396 | L341-S345 WeakPolarHBondContact O-CB 3.03Å; L341-S345 PolarHBondContact O-N 3.39Å; V343-S345 VanDerWaalsContact C-N 3.33Å; V343-S345 PolarHBondContact O-N 3.35Å; S345-V347 PolarHBondContact O-N 3.34Å; S345-A348 PolarHBondContact O-N 3.37Å; S345-M349 WeakPolarHBondContact O-CB 3.19Å; S345-M349 VanDerWaalsContact O-CG 3.28Å; S345-M349 WeakPolarHBondContact O-CG 3.34Å; S345-M349 PolarHBondContact O-N 3.41Å; S345-G391 VanDerWaalsContact CB-O 3.27Å; S345-G391 WeakPolarHBondContact CB-O 3.26Å; S345-G391 PolarHBondContact OG-O 3.16Å; S345-W396 PolarHBondContact OG-N 3.26Å; S345-W396 VanDerWaalsContact OG-N 3.08Å |
| 346 | G | 95.3 | Very high | 92.8 | Very high | 1 Ų | 1 | 32.6 Ų | 32.6 | 1% | 0.01 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -62.5 | -42.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | L342 V343 I344 M349 M350 | L342-G346 PolarHBondContact O-N 3.11Å; V343-G346 PolarHBondContact O-N 3.03Å; I344-G346 PolarHBondContact O-N 3.34Å; G346-M349 PolarHBondContact O-N 3.04Å; G346-M350 WeakPolarHBondContact O-CB 3.37Å; G346-M350 PolarHBondContact O-N 2.95Å |
| 347 | V | 96.9 | Very high | 93.1 | Very high | 56 Ų | 56 | 30.7 Ų | 30.7 | 34% | 0.339 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -63.5 | -45.9 | 176.9 | 171.5 | 0 | 0 | 0 | 0 | 110.8 | V343 I344 S345 M349 M350 I351 I459 | V343-V347 WeakPolarHBondContact O-CG2 3.12Å; V343-V347 PolarHBondContact O-N 2.98Å; I344-V347 PolarHBondContact O-N 3.25Å; S345-V347 PolarHBondContact O-N 3.34Å; V347-M349 VanDerWaalsContact C-N 3.34Å; V347-M349 PolarHBondContact O-N 3.33Å; V347-M350 PolarHBondContact O-N 3.4Å; V347-I351 HydrophobicContact CG1-CD1 3.71Å; V347-I351 HydrophobicContact CG1-CG1 4.38Å; V347-I351 WeakPolarHBondContact O-CG1 3.35Å; V347-I351 PolarHBondContact O-N 2.91Å; V347-I459 HydrophobicContact CB-CD1 4.47Å; V347-I459 HydrophobicContact CG2-CD1 3.8Å |
| 348 | A | 96.1 | Very high | 93.5 | Very high | 27 Ų | 27 | 33.2 Ų | 33.2 | 22% | 0.223 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -59.6 | -44.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | I344 S345 S352 | I344-A348 PolarHBondContact O-N 3.49Å; S345-A348 PolarHBondContact O-N 3.37Å; A348-S352 VanDerWaalsContact O-CB 3.26Å; A348-S352 WeakPolarHBondContact O-CB 3.2Å; A348-S352 PolarHBondContact O-N 3.26Å |
| 349 | M | 96.2 | Very high | 93.5 | Very high | 1 Ų | 1 | 32.4 Ų | 32.4 | 1% | 0.005 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -64.2 | -41.7 | 176.6 | -72.9 | 168.9 | 51.9 | 0 | 0 | 112.6 | T290 S345 G346 V347 S352 T353 F388 F392 W396 | T290-M349 VanDerWaalsContact CB-CE 3.42Å; T290-M349 HydrophobicContact CG2-CE 3.34Å; S345-M349 WeakPolarHBondContact O-CB 3.19Å; S345-M349 VanDerWaalsContact O-CG 3.28Å; S345-M349 WeakPolarHBondContact O-CG 3.34Å; S345-M349 PolarHBondContact O-N 3.41Å; G346-M349 PolarHBondContact O-N 3.04Å; V347-M349 VanDerWaalsContact C-N 3.34Å; V347-M349 PolarHBondContact O-N 3.33Å; M349-S352 PolarHBondContact O-N 2.86Å; M349-T353 WeakPolarHBondContact O-CB 3.34Å; M349-T353 WeakPolarHBondContact O-CG2 3.36Å; M349-T353 PolarHBondContact O-N 2.96Å; M349-T353 PolarHBondContact O-OG1 3.48Å; M349-F388 HydrophobicContact CB-CD2 3.81Å; M349-F388 HydrophobicContact CB-CE2 3.89Å; M349-F388 HydrophobicContact CE-CD2 4.5Å; M349-F388 HydrophobicContact CE-CE2 3.68Å; M349-F388 HydrophobicContact CE-CZ 3.97Å; M349-F388 HydrophobicContact CG-CD2 3.84Å; M349-F388 HydrophobicContact CG-CE2 3.96Å; M349-F392 HydrophobicContact CE-CD2 4.11Å; M349-F392 HydrophobicContact CG-CB 4.47Å; M349-F392 HydrophobicContact SD-CB 3.88Å; M349-F392 HydrophobicContact SD-CD2 4.04Å; M349-F392 HydrophobicContact SD-CG 4.48Å; M349-W396 HydrophobicContact CE-CG 4.48Å; M349-W396 HydrophobicContact SD-CB 3.92Å; M349-W396 VanDerWaalsContact SD-CD1 3.58Å; M349-W396 HydrophobicContact SD-CG 3.99Å |
| 350 | M | 96.9 | Very high | 93.2 | Very high | 63 Ų | 63 | 30.5 Ų | 30.5 | 31% | 0.31 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -64.6 | -47.5 | 178.5 | -176.6 | -177.6 | 71.7 | 0 | 0 | 111.7 | G346 V347 S352 T353 T354 C455 I459 | G346-M350 WeakPolarHBondContact O-CB 3.37Å; G346-M350 PolarHBondContact O-N 2.95Å; V347-M350 PolarHBondContact O-N 3.4Å; M350-S352 VanDerWaalsContact C-N 3.33Å; M350-S352 PolarHBondContact O-N 2.78Å; M350-T353 PolarHBondContact O-OG1 3.43Å; M350-T354 WeakPolarHBondContact O-CB 3.34Å; M350-T354 PolarHBondContact O-N 3.31Å; M350-T354 PolarHBondContact O-OG1 3.42Å; M350-C455 HydrophobicContact CB-CB 3.82Å; M350-C455 HydrophobicContact CG-CB 4.4Å; M350-I459 HydrophobicContact CB-CD1 4.42Å; M350-I459 HydrophobicContact CE-CD1 4.33Å; M350-I459 HydrophobicContact SD-CD1 4.08Å |
| 351 | I | 96.4 | Very high | 92.9 | Very high | 105 Ų | 105 | 34.4 Ų | 34.4 | 54% | 0.538 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -61 | -46.5 | 177.7 | -68.3 | 169.5 | 0 | 0 | 0 | 109.8 | V347 T354 A355 | V347-I351 HydrophobicContact CG1-CD1 3.71Å; V347-I351 HydrophobicContact CG1-CG1 4.38Å; V347-I351 WeakPolarHBondContact O-CG1 3.35Å; V347-I351 PolarHBondContact O-N 2.91Å; I351-T354 PolarHBondContact O-N 2.84Å; I351-A355 WeakPolarHBondContact O-CB 3.41Å; I351-A355 PolarHBondContact O-N 3.11Å |
| 352 | S | 94.9 | Very high | 92.5 | Very high | 5 Ų | 5 | 38.8 Ų | 38.8 | 4% | 0.035 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -63 | -50 | -179.7 | 160.4 | 0 | 0 | 0 | 0 | 112.9 | A348 M349 M350 T354 A355 F356 S384 F388 | A348-S352 VanDerWaalsContact O-CB 3.26Å; A348-S352 WeakPolarHBondContact O-CB 3.2Å; A348-S352 PolarHBondContact O-N 3.26Å; M349-S352 PolarHBondContact O-N 2.86Å; M350-S352 VanDerWaalsContact C-N 3.33Å; M350-S352 PolarHBondContact O-N 2.78Å; S352-T354 VanDerWaalsContact C-N 3.26Å; S352-T354 PolarHBondContact O-N 3.29Å; S352-A355 WeakPolarHBondContact O-CB 3.4Å; S352-A355 PolarHBondContact O-N 2.66Å; S352-A355 VanDerWaalsContact O-N 3.13Å; S352-F356 WeakPolarHBondContact O-CB 3.5Å; S352-F356 PolarHBondContact O-N 3.41Å; S352-S384 VanDerWaalsContact OG-C 3.25Å; S352-S384 PolarHBondContact OG-O 3.08Å; S352-F388 VanDerWaalsContact OG-CB 3.28Å; S352-F388 WeakPolarHBondContact OG-CB 3.46Å; S352-F388 PolarHBondContact OG-N 2.97Å |
| 353 | T | 93.3 | Very high | 91.6 | Very high | 2 Ų | 2 | 39.7 Ų | 39.7 | 1% | 0.012 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -64.4 | -33.6 | 179.7 | 43.3 | 0 | 0 | 0 | 0 | 112 | M349 M350 F356 G357 F388 F451 A452 | M349-T353 WeakPolarHBondContact O-CB 3.34Å; M349-T353 WeakPolarHBondContact O-CG2 3.36Å; M349-T353 PolarHBondContact O-N 2.96Å; M349-T353 PolarHBondContact O-OG1 3.48Å; M350-T353 PolarHBondContact O-OG1 3.43Å; T353-F356 PolarHBondContact O-N 3.07Å; T353-G357 PolarHBondContact O-N 3.2Å; T353-F388 HydrophobicContact CG2-CD2 3.44Å; T353-F388 VanDerWaalsContact CG2-CD2 3.44Å; T353-F388 HydrophobicContact CG2-CE2 3.5Å; T353-F388 VanDerWaalsContact CG2-CE2 3.5Å; T353-F388 HydrophobicContact CG2-CG 4.33Å; T353-F388 HydrophobicContact CG2-CZ 4.46Å; T353-F451 HydrophobicContact CG2-CB 4.43Å; T353-A452 WeakPolarHBondContact OG1-CA 3.34Å; T353-A452 WeakPolarHBondContact OG1-CB 3.32Å |
| 354 | T | 95.1 | Very high | 90.3 | Very high | 58 Ų | 58 | 41.9 Ų | 41.9 | 36% | 0.356 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -62.5 | -48.8 | 171.4 | -55.5 | 0 | 0 | 0 | 0 | 111 | M350 I351 S352 F356 G357 V358 A452 | M350-T354 WeakPolarHBondContact O-CB 3.34Å; M350-T354 PolarHBondContact O-N 3.31Å; M350-T354 PolarHBondContact O-OG1 3.42Å; I351-T354 PolarHBondContact O-N 2.84Å; S352-T354 VanDerWaalsContact C-N 3.26Å; S352-T354 PolarHBondContact O-N 3.29Å; T354-F356 VanDerWaalsContact C-N 3.28Å; T354-F356 PolarHBondContact O-N 3.34Å; T354-G357 PolarHBondContact O-N 3.08Å; T354-V358 WeakPolarHBondContact O-CG2 3.41Å; T354-V358 PolarHBondContact O-N 2.87Å; T354-A452 WeakPolarHBondContact OG1-CB 3.34Å |
| 355 | A | 92.6 | Very high | 88.7 | Confident | 29 Ų | 29 | 44.3 Ų | 44.3 | 24% | 0.24 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -60.6 | -38.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | I351 S352 V358 Y359 | I351-A355 WeakPolarHBondContact O-CB 3.41Å; I351-A355 PolarHBondContact O-N 3.11Å; S352-A355 WeakPolarHBondContact O-CB 3.4Å; S352-A355 PolarHBondContact O-N 2.66Å; S352-A355 VanDerWaalsContact O-N 3.13Å; A355-V358 PolarHBondContact O-N 3.43Å; A355-Y359 PolarHBondContact O-N 3.38Å |
| 356 | F | 89.6 | Confident | 86.8 | Confident | 3 Ų | 3 | 46.5 Ų | 46.5 | 1% | 0.013 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -68.4 | -40.2 | 177 | -154.3 | -135.4 | 0 | 0 | 0 | 112.6 | I302 S352 T353 T354 Y359 F360 A381 M385 F448 | I302-F356 HydrophobicContact CG2-CE1 3.66Å; I302-F356 HydrophobicContact CG2-CZ 3.5Å; I302-F356 VanDerWaalsContact CG2-CZ 3.5Å; S352-F356 WeakPolarHBondContact O-CB 3.5Å; S352-F356 PolarHBondContact O-N 3.41Å; T353-F356 PolarHBondContact O-N 3.07Å; T354-F356 VanDerWaalsContact C-N 3.28Å; T354-F356 PolarHBondContact O-N 3.34Å; F356-Y359 WeakPolarHBondContact O-CB 3.42Å; F356-Y359 PolarHBondContact O-N 3.34Å; F356-F360 HydrophobicContact CD1-CD2 4.48Å; F356-F360 HydrophobicContact CD1-CE2 4.05Å; F356-F360 HydrophobicContact CD2-CE2 4.49Å; F356-F360 HydrophobicContact CE1-CD2 4.48Å; F356-F360 AromaticContact CE1-CE2 3.64Å; F356-F360 HydrophobicContact CE1-CE2 3.64Å; F356-F360 HydrophobicContact CE2-CE2 4.1Å; F356-F360 HydrophobicContact CG-CE2 4.46Å; F356-F360 AromaticContact CZ-CE2 3.66Å; F356-F360 HydrophobicContact CZ-CE2 3.66Å; F356-F360 HydrophobicContact CZ-CZ 4.23Å; F356-F360 WeakPolarHBondContact O-CD2 3.21Å; F356-F360 PolarHBondContact O-N 2.82Å; F356-F360 VanDerWaalsContact O-N 3.14Å; F356-A381 HydrophobicContact CD2-CB 4.36Å; F356-A381 HydrophobicContact CE2-CB 3.7Å; F356-A381 VanDerWaalsContact CE2-O 3.3Å; F356-A381 WeakPolarHBondContact CE2-O 3.26Å; F356-M385 HydrophobicContact CD1-CE 4.44Å; F356-M385 HydrophobicContact CE1-CE 3.52Å; F356-M385 HydrophobicContact CZ-CE 3.72Å; F356-F448 AromaticContact CD1-CD1 3.57Å; F356-F448 HydrophobicContact CD1-CD1 3.57Å; F356-F448 AromaticContact CD1-CD2 3.72Å; F356-F448 HydrophobicContact CD1-CD2 3.72Å; F356-F448 AromaticContact CD1-CE1 3.45Å; F356-F448 HydrophobicContact CD1-CE1 3.45Å; F356-F448 VanDerWaalsContact CD1-CE1 3.45Å; F356-F448 AromaticContact CD1-CE2 3.63Å; F356-F448 HydrophobicContact CD1-CE2 3.63Å; F356-F448 AromaticContact CD1-CG 3.72Å; F356-F448 HydrophobicContact CD1-CG 3.72Å; F356-F448 AromaticContact CD1-CZ 3.51Å; F356-F448 HydrophobicContact CD1-CZ 3.51Å; F356-F448 HydrophobicContact CE1-CD1 4.23Å; F356-F448 HydrophobicContact CE1-CD2 4.15Å; F356-F448 AromaticContact CE1-CE1 3.64Å; F356-F448 HydrophobicContact CE1-CE1 3.64Å; F356-F448 AromaticContact CE1-CE2 3.57Å; F356-F448 HydrophobicContact CE1-CE2 3.57Å; F356-F448 HydrophobicContact CE1-CG 4.48Å; F356-F448 AromaticContact CE1-CZ 3.29Å; F356-F448 HydrophobicContact CE1-CZ 3.29Å |
| 357 | G | 89.7 | Confident | 84.6 | Confident | 0 Ų | 0 | 51.5 Ų | 51.5 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -63.2 | -40.1 | 171.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | T353 T354 Y359 F360 Y361 A445 | T353-G357 PolarHBondContact O-N 3.2Å; T354-G357 PolarHBondContact O-N 3.08Å; G357-Y359 VanDerWaalsContact C-N 3.34Å; G357-Y359 PolarHBondContact O-N 3.26Å; G357-F360 PolarHBondContact O-N 3.31Å; G357-Y361 WeakPolarHBondContact O-CB 3.42Å; G357-Y361 PolarHBondContact O-N 3.06Å; G357-A445 WeakPolarHBondContact O-CB 3.37Å |
| 358 | V | 89.9 | Confident | 81.9 | Confident | 56 Ų | 56 | 55.4 Ų | 55.4 | 34% | 0.339 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -62.5 | -41.3 | 173.6 | 171.8 | 0 | 0 | 0 | 0 | 111.2 | T354 A355 F360 Y361 L362 W449 | T354-V358 WeakPolarHBondContact O-CG2 3.41Å; T354-V358 PolarHBondContact O-N 2.87Å; A355-V358 PolarHBondContact O-N 3.43Å; V358-F360 PolarHBondContact O-N 3.49Å; V358-Y361 WeakPolarHBondContact O-CB 3.49Å; V358-Y361 PolarHBondContact O-N 2.91Å; V358-L362 HydrophobicContact CG1-CD1 3.83Å; V358-L362 HydrophobicContact CG1-CG 4.26Å; V358-L362 WeakPolarHBondContact O-CG 3.37Å; V358-L362 PolarHBondContact O-N 3.29Å; V358-W449 HydrophobicContact CG2-CZ2 4.45Å |
| 359 | Y | 87.7 | Confident | 79.4 | Confident | 4 Ų | 4 | 58.1 Ų | 58.1 | 2% | 0.016 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -56.4 | -51.8 | 175.3 | 168.3 | -95.4 | 0 | 0 | 0 | 111.6 | A306 A355 F356 G357 Y361 L362 T363 L377 L380 A381 | A306-Y359 HydrophobicContact CB-CE1 3.75Å; A306-Y359 PolarHBondContact O-OH 2.97Å; A355-Y359 PolarHBondContact O-N 3.38Å; F356-Y359 WeakPolarHBondContact O-CB 3.42Å; F356-Y359 PolarHBondContact O-N 3.34Å; G357-Y359 VanDerWaalsContact C-N 3.34Å; G357-Y359 PolarHBondContact O-N 3.26Å; Y359-Y361 VanDerWaalsContact C-N 3.27Å; Y359-Y361 PolarHBondContact O-N 2.89Å; Y359-L362 PolarHBondContact O-N 3.4Å; Y359-T363 HydrophobicContact CD2-CG2 4.33Å; Y359-T363 WeakPolarHBondContact CE1-OG1 3.39Å; Y359-T363 HydrophobicContact CE2-CG2 3.85Å; Y359-T363 PolarHBondContact O-N 3.2Å; Y359-T363 PolarHBondContact O-OG1 3.25Å; Y359-L377 HydrophobicContact CD2-CB 4.03Å; Y359-L377 WeakPolarHBondContact CD2-O 3.36Å; Y359-L377 HydrophobicContact CE2-CB 3.9Å; Y359-L377 WeakPolarHBondContact CE2-O 2.92Å; Y359-L380 HydrophobicContact CD2-CB 4.41Å; Y359-A381 HydrophobicContact CD1-CB 3.88Å; Y359-A381 HydrophobicContact CD2-CB 4.28Å; Y359-A381 HydrophobicContact CE1-CB 3.69Å; Y359-A381 HydrophobicContact CE2-CB 4.1Å; Y359-A381 HydrophobicContact CG-CB 4.18Å |
| 360 | F | 84.6 | Confident | 77 | Confident | 16 Ų | 16 | 60.6 Ų | 60.6 | 7% | 0.07 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -66 | -28.2 | 178.7 | -82.1 | -65.3 | 0 | 0 | 0 | 113.5 | I302 Q305 A306 F356 G357 V358 T363 A445 F448 | I302-F360 HydrophobicContact CG2-CZ 4.4Å; Q305-F360 HydrophobicContact CB-CE1 4.3Å; A306-F360 HydrophobicContact CB-CE1 4.45Å; A306-F360 HydrophobicContact CB-CZ 4.27Å; F356-F360 HydrophobicContact CD1-CD2 4.48Å; F356-F360 HydrophobicContact CD1-CE2 4.05Å; F356-F360 HydrophobicContact CD2-CE2 4.49Å; F356-F360 HydrophobicContact CE1-CD2 4.48Å; F356-F360 AromaticContact CE1-CE2 3.64Å; F356-F360 HydrophobicContact CE1-CE2 3.64Å; F356-F360 HydrophobicContact CE2-CE2 4.1Å; F356-F360 HydrophobicContact CG-CE2 4.46Å; F356-F360 AromaticContact CZ-CE2 3.66Å; F356-F360 HydrophobicContact CZ-CE2 3.66Å; F356-F360 HydrophobicContact CZ-CZ 4.23Å; F356-F360 WeakPolarHBondContact O-CD2 3.21Å; F356-F360 PolarHBondContact O-N 2.82Å; F356-F360 VanDerWaalsContact O-N 3.14Å; G357-F360 PolarHBondContact O-N 3.31Å; V358-F360 PolarHBondContact O-N 3.49Å; F360-T363 CarbonylContact O-C 3.5Å; F360-A445 HydrophobicContact CB-CB 4.18Å; F360-F448 AromaticContact CD2-CD2 3.76Å; F360-F448 HydrophobicContact CD2-CD2 3.76Å; F360-F448 AromaticContact CD2-CE2 3.86Å; F360-F448 HydrophobicContact CD2-CE2 3.86Å; F360-F448 AromaticContact CE2-CD2 3.9Å; F360-F448 HydrophobicContact CE2-CD2 3.9Å; F360-F448 AromaticContact CE2-CE2 3.5Å; F360-F448 HydrophobicContact CE2-CE2 3.5Å; F360-F448 HydrophobicContact CE2-CZ 4.44Å; F360-F448 HydrophobicContact CZ-CE2 4.46Å |
| 361 | Y | 86.4 | Confident | 74.5 | Confident | 156 Ų | 156 | 62.9 Ų | 62.9 | 61% | 0.612 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -69.2 | -39.6 | 173.6 | -178.9 | -98.7 | 0 | 0 | 0 | 111.9 | G357 V358 Y359 W449 | G357-Y361 WeakPolarHBondContact O-CB 3.42Å; G357-Y361 PolarHBondContact O-N 3.06Å; V358-Y361 WeakPolarHBondContact O-CB 3.49Å; V358-Y361 PolarHBondContact O-N 2.91Å; Y359-Y361 VanDerWaalsContact C-N 3.27Å; Y359-Y361 PolarHBondContact O-N 2.89Å; Y361-W449 AromaticContact CD2-CH2 3.93Å; Y361-W449 HydrophobicContact CD2-CH2 3.93Å; Y361-W449 HydrophobicContact CG-CH2 4.09Å; Y361-W449 HydrophobicContact CG-CZ2 4.43Å |
| 362 | L | 82.9 | Confident | 72.4 | Confident | 98 Ų | 98 | 61.5 Ų | 61.5 | 51% | 0.513 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -79.7 | -20.2 | 178.4 | -64.9 | 175.8 | 0 | 0 | 0 | 113.4 | V358 Y359 P364 | V358-L362 HydrophobicContact CG1-CD1 3.83Å; V358-L362 HydrophobicContact CG1-CG 4.26Å; V358-L362 WeakPolarHBondContact O-CG 3.37Å; V358-L362 PolarHBondContact O-N 3.29Å; Y359-L362 PolarHBondContact O-N 3.4Å; L362-P364 VanDerWaalsContact O-CD 3.26Å; L362-P364 WeakPolarHBondContact O-CD 3.24Å |
| 363 | T | 74.9 | Confident | 70.3 | Confident | 18 Ų | 18 | 64.7 Ų | 64.7 | 11% | 0.11 | 41% | 0.406 | C | S | . | . | S | Bend | trans | -117.7 | 63.9 | 178.8 | 55.8 | 0 | 0 | 0 | 0 | 111.5 | Y359 F360 | Y359-T363 HydrophobicContact CD2-CG2 4.33Å; Y359-T363 WeakPolarHBondContact CE1-OG1 3.39Å; Y359-T363 HydrophobicContact CE2-CG2 3.85Å; Y359-T363 PolarHBondContact O-N 3.2Å; Y359-T363 PolarHBondContact O-OG1 3.25Å; F360-T363 CarbonylContact O-C 3.5Å |
| 364 | P | 66.6 | Low | 68.1 | Low | 83 Ų | 83 | 73.9 Ų | 73.9 | 54% | 0.539 | 45% | 0.448 | S | S | . | . | trans | -62.3 | 150.1 | 178.5 | 26 | -32.6 | 0 | 0 | 0 | 111 | L362 V366 | L362-P364 VanDerWaalsContact O-CD 3.26Å; L362-P364 WeakPolarHBondContact O-CD 3.24Å; P364-V366 PolarHBondContact O-N 3.45Å | ||
| 365 | K | 61.3 | Low | 66.1 | Low | 149 Ų | 149 | 73.5 Ų | 73.5 | 65% | 0.648 | 45% | 0.451 | S | S | * | . | trans | -50.7 | 105 | 178.1 | -71.6 | -177.5 | 178.6 | 178.6 | 0 | 110 | ||||
| 366 | V | 56 | Low | 64.8 | Low | 47 Ų | 47 | 79.1 Ų | 79.1 | 29% | 0.285 | 48% | 0.477 | S | S | . | . | trans | -74.3 | 130.3 | 174.7 | -179.6 | 0 | 0 | 0 | 0 | 108.3 | P364 S368 A370 P373 | P364-V366 PolarHBondContact O-N 3.45Å; V366-S368 PolarHBondContact O-N 3.28Å; V366-A370 HydrophobicContact CG1-CB 3.48Å; V366-A370 VanDerWaalsContact CG1-CB 3.48Å; V366-P373 HydrophobicContact CG2-CG 3.96Å | ||
| 367 | P | 49.1 | Very low | 64 | Low | 105 Ų | 105 | 81.3 Ų | 81.3 | 68% | 0.682 | 49% | 0.488 | S | S | * | . | trans | -57.3 | 137.5 | 173.7 | -20.8 | 31.6 | 0 | 0 | 0 | 110.4 | G369 A370 | P367-G369 PolarHBondContact O-N 3.21Å; P367-A370 PolarHBondContact O-N 3.27Å | ||
| 368 | S | 38.9 | Very low | 63.2 | Low | 138 Ų | 138 | 83.2 Ų | 83.2 | 97% | 0.965 | 50% | 0.5 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -50.2 | 108.1 | 179.1 | -52.4 | 0 | 0 | 0 | 0 | 110.9 | V366 | V366-S368 PolarHBondContact O-N 3.28Š|
| 369 | G | 44.2 | Very low | 62.8 | Low | 84 Ų | 84 | 88.3 Ų | 88.3 | 87% | 0.866 | 51% | 0.513 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 125.1 | -9.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 116.6 | P367 | P367-G369 PolarHBondContact O-N 3.21Š|
| 370 | A | 46.3 | Very low | 62.7 | Low | 53 Ų | 53 | 90 Ų | 90 | 44% | 0.438 | 52% | 0.522 | S | S | . | . | S | Bend | trans | -88.9 | 148.7 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | V366 P367 A372 | V366-A370 HydrophobicContact CG1-CB 3.48Å; V366-A370 VanDerWaalsContact CG1-CB 3.48Å; P367-A370 PolarHBondContact O-N 3.27Å; A370-A372 PolarHBondContact O-N 3.29Å |
| 371 | P | 44.2 | Very low | 62.7 | Low | 112 Ų | 112 | 89.2 Ų | 89.2 | 73% | 0.727 | 52% | 0.519 | S | S | * | . | P | Polyproline II helix | trans | -57.5 | 130.9 | 177.5 | 0.3 | 3.8 | 0 | 0 | 0 | 109.8 | ||
| 372 | A | 52.3 | Low | 62.7 | Low | 76 Ų | 76 | 83.4 Ų | 83.4 | 63% | 0.628 | 50% | 0.499 | S | S | * | . | P | Polyproline II helix | trans | -51.7 | 138.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 109.5 | A370 H374 | A370-A372 PolarHBondContact O-N 3.29Å; A372-H374 PolarHBondContact O-N 3.29Å |
| 373 | P | 50 | Low | 63 | Low | 71 Ų | 71 | 80.6 Ų | 80.6 | 46% | 0.461 | 49% | 0.49 | S | S | . | . | P | Polyproline II helix | trans | -57.6 | 134 | 178.1 | -13.7 | 26.4 | 0 | 0 | 0 | 109.2 | V366 A375 | V366-P373 HydrophobicContact CG2-CG 3.96Å; P373-A375 PolarHBondContact O-N 3.08Å |
| 374 | H | 48.1 | Very low | 63.8 | Low | 196 Ų | 196 | 80 Ų | 80 | 91% | 0.907 | 49% | 0.486 | S | S | * | . | S | Bend | trans | -68.4 | 35.8 | -176.4 | -72.1 | -70.4 | 0 | 0 | 0 | 115.1 | A372 | A372-H374 PolarHBondContact O-N 3.29Š|
| 375 | A | 52.5 | Low | 65 | Low | 50 Ų | 50 | 76.2 Ų | 76.2 | 41% | 0.413 | 46% | 0.461 | S | S | . | . | trans | -123.4 | 109.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 109 | P373 L377 | P373-A375 PolarHBondContact O-N 3.08Å; A375-L377 HydrophobicContact CB-CD1 3.74Å; A375-L377 HydrophobicContact CB-CG 3.84Å; A375-L377 PolarHBondContact O-N 3.22Å | ||
| 376 | D | 65.1 | Low | 66.4 | Low | 147 Ų | 147 | 69.7 Ų | 69.7 | 79% | 0.786 | 44% | 0.435 | S | S | * | . | trans | -63.8 | 63 | 165.4 | -74.1 | -30.2 | 0 | 0 | 0 | 109.2 | T378 W379 | D376-T378 VanDerWaalsContact C-N 3.32Å; D376-W379 PolarHBondContact O-NE1 2.87Å | ||
| 377 | L | 72.4 | Confident | 68.3 | Low | 48 Ų | 48 | 70.9 Ų | 70.9 | 25% | 0.251 | 44% | 0.442 | S | S | . | . | trans | -93 | 1.7 | 174.9 | -71.2 | 168.9 | 0 | 0 | 0 | 111.1 | Y359 A375 W379 L380 A381 | Y359-L377 HydrophobicContact CD2-CB 4.03Å; Y359-L377 WeakPolarHBondContact CD2-O 3.36Å; Y359-L377 HydrophobicContact CE2-CB 3.9Å; Y359-L377 WeakPolarHBondContact CE2-O 2.92Å; A375-L377 HydrophobicContact CB-CD1 3.74Å; A375-L377 HydrophobicContact CB-CG 3.84Å; A375-L377 PolarHBondContact O-N 3.22Å; L377-W379 PolarHBondContact O-N 3.39Å; L377-L380 WeakPolarHBondContact O-CA 3.24Å; L377-L380 WeakPolarHBondContact O-CB 3.34Å; L377-L380 PolarHBondContact O-N 3.29Å; L377-A381 PolarHBondContact O-N 3.21Å | ||
| 378 | T | 74.4 | Confident | 70.5 | Confident | 40 Ų | 40 | 66 Ų | 66 | 25% | 0.245 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -59.1 | -30 | 179.2 | -43.2 | 0 | 0 | 0 | 0 | 112.2 | F308 D376 L380 A381 L382 | F308-T378 HydrophobicContact CB-CG2 4.33Å; F308-T378 HydrophobicContact CD2-CG2 3.2Å; F308-T378 HydrophobicContact CE2-CG2 3.56Å; F308-T378 HydrophobicContact CG-CG2 3.96Å; D376-T378 VanDerWaalsContact C-N 3.32Å; T378-L380 VanDerWaalsContact C-N 3.28Å; T378-L380 PolarHBondContact O-N 2.99Å; T378-A381 WeakPolarHBondContact O-CB 3.34Å; T378-A381 PolarHBondContact O-N 3.08Å; T378-L382 PolarHBondContact O-N 3.09Å |
| 379 | W | 81.2 | Confident | 73 | Confident | 163 Ų | 163 | 59.5 Ų | 59.5 | 62% | 0.617 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -65.5 | -29.6 | 172.1 | 69.6 | -93.9 | 0 | 0 | 0 | 112.6 | D376 L377 A381 L382 A383 | D376-W379 PolarHBondContact O-NE1 2.87Å; L377-W379 PolarHBondContact O-N 3.39Å; W379-A381 VanDerWaalsContact C-N 3.34Å; W379-L382 PolarHBondContact O-N 3.49Å; W379-A383 HydrophobicContact CE3-CB 4.26Å; W379-A383 WeakPolarHBondContact O-CB 3.3Å; W379-A383 PolarHBondContact O-N 2.9Å |
| 380 | L | 85.4 | Confident | 75.4 | Confident | 39 Ų | 39 | 55.8 Ų | 55.8 | 20% | 0.204 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -68.1 | -37.8 | 177.7 | -178.6 | 63.3 | 0 | 0 | 0 | 110.6 | Y359 L377 T378 S384 | Y359-L380 HydrophobicContact CD2-CB 4.41Å; L377-L380 WeakPolarHBondContact O-CA 3.24Å; L377-L380 WeakPolarHBondContact O-CB 3.34Å; L377-L380 PolarHBondContact O-N 3.29Å; T378-L380 VanDerWaalsContact C-N 3.28Å; T378-L380 PolarHBondContact O-N 2.99Å; L380-S384 WeakPolarHBondContact O-CB 3.25Å; L380-S384 PolarHBondContact O-N 2.79Å; L380-S384 PolarHBondContact O-OG 3.37Å |
| 381 | A | 84 | Confident | 77.7 | Confident | 0 Ų | 0 | 53.4 Ų | 53.4 | 0% | 0 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -60.1 | -51.3 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | A306 F356 Y359 L377 T378 W379 S384 M385 | A306-A381 HydrophobicContact CB-CB 4.06Å; F356-A381 HydrophobicContact CD2-CB 4.36Å; F356-A381 HydrophobicContact CE2-CB 3.7Å; F356-A381 VanDerWaalsContact CE2-O 3.3Å; F356-A381 WeakPolarHBondContact CE2-O 3.26Å; Y359-A381 HydrophobicContact CD1-CB 3.88Å; Y359-A381 HydrophobicContact CD2-CB 4.28Å; Y359-A381 HydrophobicContact CE1-CB 3.69Å; Y359-A381 HydrophobicContact CE2-CB 4.1Å; Y359-A381 HydrophobicContact CG-CB 4.18Å; L377-A381 PolarHBondContact O-N 3.21Å; T378-A381 WeakPolarHBondContact O-CB 3.34Å; T378-A381 PolarHBondContact O-N 3.08Å; W379-A381 VanDerWaalsContact C-N 3.34Å; A381-S384 PolarHBondContact O-N 3.08Å; A381-M385 WeakPolarHBondContact O-CB 3.34Å; A381-M385 PolarHBondContact O-N 3.34Å |
| 382 | L | 86.1 | Confident | 80 | Confident | 35 Ų | 35 | 48.9 Ų | 48.9 | 18% | 0.183 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -62.3 | -47.1 | 176.9 | -179 | 63.5 | 0 | 0 | 0 | 112.1 | F303 F308 A314 V318 T378 W379 S384 M385 A386 | F303-L382 HydrophobicContact CE1-CB 4.37Å; F303-L382 HydrophobicContact CE1-CD1 3.96Å; F303-L382 HydrophobicContact CZ-CD1 3.77Å; F308-L382 HydrophobicContact CE2-CB 4.06Å; F308-L382 HydrophobicContact CE2-CD2 4.29Å; F308-L382 HydrophobicContact CZ-CD2 4.11Å; A314-L382 HydrophobicContact CB-CD1 4.09Å; V318-L382 HydrophobicContact CG2-CD1 3.85Å; T378-L382 PolarHBondContact O-N 3.09Å; W379-L382 PolarHBondContact O-N 3.49Å; L382-S384 PolarHBondContact O-N 3.19Å; L382-M385 PolarHBondContact O-N 2.97Å; L382-A386 VanDerWaalsContact O-CB 3.24Å; L382-A386 WeakPolarHBondContact O-CB 3.21Å; L382-A386 PolarHBondContact O-N 3.47Å |
| 383 | A | 90.6 | Very high | 81.9 | Confident | 39 Ų | 39 | 45.3 Ų | 45.3 | 32% | 0.322 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -63.5 | -41.3 | -179.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | W379 A386 V387 | W379-A383 HydrophobicContact CE3-CB 4.26Å; W379-A383 WeakPolarHBondContact O-CB 3.3Å; W379-A383 PolarHBondContact O-N 2.9Å; A383-A386 PolarHBondContact O-N 3.4Å; A383-V387 WeakPolarHBondContact O-CB 3.46Å; A383-V387 VanDerWaalsContact O-CG2 3.26Å; A383-V387 WeakPolarHBondContact O-CG2 3.41Å; A383-V387 PolarHBondContact O-N 3.26Å |
| 384 | S | 91.8 | Very high | 83.8 | Confident | 6 Ų | 6 | 43.5 Ų | 43.5 | 4% | 0.042 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -61.6 | -54.3 | 175.9 | -57.8 | 0 | 0 | 0 | 0 | 109.6 | S352 L380 A381 L382 A386 V387 F388 | S352-S384 VanDerWaalsContact OG-C 3.25Å; S352-S384 PolarHBondContact OG-O 3.08Å; L380-S384 WeakPolarHBondContact O-CB 3.25Å; L380-S384 PolarHBondContact O-N 2.79Å; L380-S384 PolarHBondContact O-OG 3.37Å; A381-S384 PolarHBondContact O-N 3.08Å; L382-S384 PolarHBondContact O-N 3.19Å; S384-A386 VanDerWaalsContact C-N 3.29Å; S384-A386 PolarHBondContact O-N 2.94Å; S384-V387 PolarHBondContact O-N 3.45Å; S384-V387 VanDerWaalsContact O-N 3.09Å; S384-F388 PolarHBondContact O-N 3.49Å |
| 385 | M | 90.5 | Very high | 85.8 | Confident | 3 Ų | 3 | 34.2 Ų | 34.2 | 2% | 0.015 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -57.1 | -42.4 | 179.4 | -167.9 | 64 | 89.1 | 0 | 0 | 112.8 | I295 I302 F303 V318 F356 A381 L382 F388 I389 | I295-M385 HydrophobicContact CB-SD 4.4Å; I295-M385 HydrophobicContact CD1-SD 4.46Å; I295-M385 HydrophobicContact CG1-CE 4.37Å; I295-M385 HydrophobicContact CG1-SD 4.38Å; I295-M385 HydrophobicContact CG2-CE 3.77Å; I295-M385 HydrophobicContact CG2-SD 3.23Å; I295-M385 WeakPolarHBondContact CG2-SD 3.14Å; I302-M385 HydrophobicContact CB-CE 4.44Å; I302-M385 HydrophobicContact CD1-CE 4.08Å; I302-M385 HydrophobicContact CG2-CE 3.68Å; F303-M385 HydrophobicContact CZ-CB 4.1Å; F303-M385 HydrophobicContact CZ-CG 4.09Å; V318-M385 HydrophobicContact CG1-CG 4.23Å; V318-M385 HydrophobicContact CG2-CB 4.43Å; V318-M385 HydrophobicContact CG2-CG 4.19Å; F356-M385 HydrophobicContact CD1-CE 4.44Å; F356-M385 HydrophobicContact CE1-CE 3.52Å; F356-M385 HydrophobicContact CZ-CE 3.72Å; A381-M385 WeakPolarHBondContact O-CB 3.34Å; A381-M385 PolarHBondContact O-N 3.34Å; L382-M385 PolarHBondContact O-N 2.97Å; M385-F388 WeakPolarHBondContact O-CB 3.43Å; M385-F388 PolarHBondContact O-N 3.14Å; M385-I389 HydrophobicContact CG-CD1 4.18Å; M385-I389 PolarHBondContact O-N 2.9Å; M385-I389 HydrophobicContact SD-CD1 4.33Å |
| 386 | A | 92.1 | Very high | 87.6 | Confident | 12 Ų | 12 | 31.8 Ų | 31.8 | 10% | 0.099 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -60.3 | -46.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | I321 L382 A383 S384 F388 I389 A390 | I321-A386 HydrophobicContact CD1-CB 3.55Å; L382-A386 VanDerWaalsContact O-CB 3.24Å; L382-A386 WeakPolarHBondContact O-CB 3.21Å; L382-A386 PolarHBondContact O-N 3.47Å; A383-A386 PolarHBondContact O-N 3.4Å; S384-A386 VanDerWaalsContact C-N 3.29Å; S384-A386 PolarHBondContact O-N 2.94Å; A386-F388 VanDerWaalsContact C-N 3.34Å; A386-I389 PolarHBondContact O-N 2.71Å; A386-A390 WeakPolarHBondContact O-CB 3.48Å; A386-A390 PolarHBondContact O-N 2.88Å |
| 387 | V | 94.8 | Very high | 88.7 | Confident | 72 Ų | 72 | 24.9 Ų | 24.9 | 44% | 0.436 | 13% | 0.133 | S | C | . | . | H | α-helix | trans | -66.8 | -35.6 | 177.3 | 173.9 | 0 | 0 | 0 | 0 | 111.4 | A383 S384 G391 | A383-V387 WeakPolarHBondContact O-CB 3.46Å; A383-V387 VanDerWaalsContact O-CG2 3.26Å; A383-V387 WeakPolarHBondContact O-CG2 3.41Å; A383-V387 PolarHBondContact O-N 3.26Å; S384-V387 PolarHBondContact O-N 3.45Å; S384-V387 VanDerWaalsContact O-N 3.09Å; V387-G391 PolarHBondContact O-N 2.94Å |
| 388 | F | 95.2 | Very high | 89.2 | Confident | 2 Ų | 2 | 23.6 Ų | 23.6 | 1% | 0.009 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -60.6 | -50.2 | 174.8 | 179.9 | -105.3 | 0 | 0 | 0 | 110.7 | T290 I292 I295 M349 S352 T353 S384 M385 A386 G391 F392 | T290-F388 WeakPolarHBondContact O-CZ 3.49Å; I292-F388 HydrophobicContact CB-CE1 4.26Å; I292-F388 HydrophobicContact CB-CZ 4.45Å; I292-F388 HydrophobicContact CD1-CD1 4.26Å; I292-F388 HydrophobicContact CD1-CE1 3.61Å; I295-F388 HydrophobicContact CB-CE1 4.46Å; I295-F388 HydrophobicContact CD1-CD1 3.66Å; I295-F388 HydrophobicContact CD1-CE1 3.27Å; I295-F388 HydrophobicContact CD1-CE2 4.39Å; I295-F388 HydrophobicContact CD1-CG 4.39Å; I295-F388 HydrophobicContact CD1-CZ 3.68Å; I295-F388 HydrophobicContact CG1-CE1 4.44Å; I295-F388 HydrophobicContact CG2-CD1 4.36Å; I295-F388 HydrophobicContact CG2-CE1 4.39Å; M349-F388 HydrophobicContact CB-CD2 3.81Å; M349-F388 HydrophobicContact CB-CE2 3.89Å; M349-F388 HydrophobicContact CE-CD2 4.5Å; M349-F388 HydrophobicContact CE-CE2 3.68Å; M349-F388 HydrophobicContact CE-CZ 3.97Å; M349-F388 HydrophobicContact CG-CD2 3.84Å; M349-F388 HydrophobicContact CG-CE2 3.96Å; S352-F388 VanDerWaalsContact OG-CB 3.28Å; S352-F388 WeakPolarHBondContact OG-CB 3.46Å; S352-F388 PolarHBondContact OG-N 2.97Å; T353-F388 HydrophobicContact CG2-CD2 3.44Å; T353-F388 VanDerWaalsContact CG2-CD2 3.44Å; T353-F388 HydrophobicContact CG2-CE2 3.5Å; T353-F388 VanDerWaalsContact CG2-CE2 3.5Å; T353-F388 HydrophobicContact CG2-CG 4.33Å; T353-F388 HydrophobicContact CG2-CZ 4.46Å; S384-F388 PolarHBondContact O-N 3.49Å; M385-F388 WeakPolarHBondContact O-CB 3.43Å; M385-F388 PolarHBondContact O-N 3.14Å; A386-F388 VanDerWaalsContact C-N 3.34Å; F388-G391 PolarHBondContact O-N 2.87Å; F388-F392 WeakPolarHBondContact O-CB 3.43Å; F388-F392 PolarHBondContact O-N 3.2Å |
| 389 | I | 92.9 | Very high | 89.8 | Confident | 1 Ų | 1 | 21.7 Ų | 21.7 | 1% | 0.005 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -72 | -37.5 | -176.2 | -76.2 | 171.6 | 0 | 0 | 0 | 111.8 | I292 I295 M296 V318 Q322 M385 A386 F392 A393 | I292-I389 HydrophobicContact CD1-CG1 4.28Å; I295-I389 HydrophobicContact CG2-CD1 4.1Å; M296-I389 HydrophobicContact SD-CD1 3.74Å; M296-I389 HydrophobicContact SD-CG1 4.39Å; V318-I389 HydrophobicContact CG1-CB 4.25Å; V318-I389 HydrophobicContact CG1-CD1 3.06Å; V318-I389 HydrophobicContact CG1-CG1 4.16Å; V318-I389 HydrophobicContact CG1-CG2 4.31Å; Q322-I389 HydrophobicContact CB-CG2 3.43Å; Q322-I389 VanDerWaalsContact CB-CG2 3.43Å; Q322-I389 HydrophobicContact CG-CG2 3.52Å; M385-I389 HydrophobicContact CG-CD1 4.18Å; M385-I389 PolarHBondContact O-N 2.9Å; M385-I389 HydrophobicContact SD-CD1 4.33Å; A386-I389 PolarHBondContact O-N 2.71Å; I389-F392 PolarHBondContact O-N 3.27Å; I389-A393 VanDerWaalsContact O-CB 3.28Å; I389-A393 WeakPolarHBondContact O-CB 3.44Å; I389-A393 PolarHBondContact O-N 3.45Å |
| 390 | A | 93.6 | Very high | 90.2 | Very high | 7 Ų | 7 | 14 Ų | 14 | 6% | 0.058 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -61.1 | -47.8 | 170.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | I321 F325 A386 F392 A393 I394 | I321-A390 HydrophobicContact CG2-CB 3.98Å; F325-A390 HydrophobicContact CB-CB 4.28Å; F325-A390 HydrophobicContact CD1-CB 3.89Å; F325-A390 HydrophobicContact CD2-CB 3.56Å; F325-A390 HydrophobicContact CE1-CB 4.03Å; F325-A390 HydrophobicContact CE2-CB 3.72Å; F325-A390 HydrophobicContact CG-CB 3.62Å; F325-A390 HydrophobicContact CZ-CB 3.95Å; A386-A390 WeakPolarHBondContact O-CB 3.48Å; A386-A390 PolarHBondContact O-N 2.88Å; A390-F392 PolarHBondContact O-N 3.02Å; A390-A393 PolarHBondContact O-N 3.33Å; A390-I394 WeakPolarHBondContact O-CD1 3.28Å; A390-I394 WeakPolarHBondContact O-CG1 3.2Å; A390-I394 PolarHBondContact O-N 2.95Å; A390-I394 VanDerWaalsContact O-N 3.08Å |
| 391 | G | 94 | Very high | 90.2 | Very high | 3 Ų | 3 | 15.4 Ų | 15.4 | 3% | 0.031 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -56.1 | -51 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | S345 V387 F388 A393 I394 | S345-G391 VanDerWaalsContact CB-O 3.27Å; S345-G391 WeakPolarHBondContact CB-O 3.26Å; S345-G391 PolarHBondContact OG-O 3.16Å; V387-G391 PolarHBondContact O-N 2.94Å; F388-G391 PolarHBondContact O-N 2.87Å; G391-A393 PolarHBondContact O-N 3.49Å; G391-I394 PolarHBondContact O-N 3.39Å |
| 392 | F | 93.6 | Very high | 90 | Very high | 16 Ų | 16 | 17.6 Ų | 17.6 | 7% | 0.07 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -58 | -47.3 | 176.8 | -177.2 | -93.3 | 0 | 0 | 0 | 112.2 | Q287 I292 M349 F388 I389 A390 I394 G395 W396 G397 | Q287-F392 HydrophobicContact CG-CE2 3.78Å; Q287-F392 HydrophobicContact CG-CZ 4.06Å; I292-F392 HydrophobicContact CB-CD2 4.09Å; I292-F392 HydrophobicContact CB-CE2 3.89Å; I292-F392 HydrophobicContact CB-CZ 4.23Å; I292-F392 HydrophobicContact CD1-CB 4.29Å; I292-F392 HydrophobicContact CD1-CD1 3.94Å; I292-F392 HydrophobicContact CD1-CD2 4.24Å; I292-F392 HydrophobicContact CD1-CE1 4.34Å; I292-F392 HydrophobicContact CD1-CG 3.89Å; I292-F392 HydrophobicContact CG1-CD1 3.91Å; I292-F392 HydrophobicContact CG1-CD2 3.94Å; I292-F392 HydrophobicContact CG1-CE1 3.81Å; I292-F392 HydrophobicContact CG1-CE2 3.84Å; I292-F392 HydrophobicContact CG1-CG 3.97Å; I292-F392 HydrophobicContact CG1-CZ 3.78Å; I292-F392 HydrophobicContact CG2-CD2 4.37Å; I292-F392 HydrophobicContact CG2-CE2 3.68Å; I292-F392 HydrophobicContact CG2-CZ 3.88Å; M349-F392 HydrophobicContact CE-CD2 4.11Å; M349-F392 HydrophobicContact CG-CB 4.47Å; M349-F392 HydrophobicContact SD-CB 3.88Å; M349-F392 HydrophobicContact SD-CD2 4.04Å; M349-F392 HydrophobicContact SD-CG 4.48Å; F388-F392 WeakPolarHBondContact O-CB 3.43Å; F388-F392 PolarHBondContact O-N 3.2Å; I389-F392 PolarHBondContact O-N 3.27Å; A390-F392 PolarHBondContact O-N 3.02Å; F392-I394 VanDerWaalsContact C-N 3.27Å; F392-I394 PolarHBondContact O-N 3.21Å; F392-G395 PolarHBondContact O-N 3.24Å; F392-W396 HydrophobicContact CD2-CB 3.68Å; F392-W396 HydrophobicContact CE2-CB 3.91Å; F392-W396 HydrophobicContact CG-CB 4.48Å; F392-W396 PolarHBondContact O-N 2.93Å; F392-G397 VanDerWaalsContact CZ-CA 3.48Å; F392-G397 PolarHBondContact O-N 3.49Å |
| 393 | A | 90.9 | Very high | 89.9 | Confident | 2 Ų | 2 | 16 Ų | 16 | 2% | 0.017 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -60.9 | -33.3 | -179.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | Q322 F325 A329 I389 A390 G391 P398 | Q322-A393 HydrophobicContact CG-CB 4.33Å; F325-A393 HydrophobicContact CB-CB 3.94Å; A329-A393 VanDerWaalsContact CB-O 3.28Å; A329-A393 WeakPolarHBondContact CB-O 3.28Å; I389-A393 VanDerWaalsContact O-CB 3.28Å; I389-A393 WeakPolarHBondContact O-CB 3.44Å; I389-A393 PolarHBondContact O-N 3.45Å; A390-A393 PolarHBondContact O-N 3.33Å; G391-A393 PolarHBondContact O-N 3.49Å; A393-P398 WeakPolarHBondContact O-CD 3.43Å |
| 394 | I | 90.8 | Very high | 89.5 | Confident | 33 Ų | 33 | 15.3 Ų | 15.3 | 17% | 0.169 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -67.5 | -36.6 | 179.1 | -70.6 | 161.2 | 0 | 0 | 0 | 112.9 | F325 L341 A390 G391 F392 | F325-I394 HydrophobicContact CD1-CD1 3.53Å; F325-I394 HydrophobicContact CD1-CG1 3.78Å; F325-I394 HydrophobicContact CE1-CD1 3.86Å; L341-I394 HydrophobicContact CD2-CG2 3.86Å; A390-I394 WeakPolarHBondContact O-CD1 3.28Å; A390-I394 WeakPolarHBondContact O-CG1 3.2Å; A390-I394 PolarHBondContact O-N 2.95Å; A390-I394 VanDerWaalsContact O-N 3.08Å; G391-I394 PolarHBondContact O-N 3.39Å; F392-I394 VanDerWaalsContact C-N 3.27Å; F392-I394 PolarHBondContact O-N 3.21Å |
| 395 | G | 89.6 | Confident | 88.8 | Confident | 0 Ų | 0 | 17.6 Ų | 17.6 | 0% | 0 | 10% | 0.099 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -138.4 | -71 | -169.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | F392 G397 P398 I399 | F392-G395 PolarHBondContact O-N 3.24Å; G395-G397 PolarHBondContact O-N 3.11Å; G395-G397 VanDerWaalsContact O-N 3.1Å; G395-P398 WeakPolarHBondContact O-CD 3.28Å; G395-I399 VanDerWaalsContact O-CB 3.27Å; G395-I399 WeakPolarHBondContact O-CB 3.31Å; G395-I399 WeakPolarHBondContact O-CG1 3.26Å; G395-I399 PolarHBondContact O-N 2.95Å |
| 396 | W | 91.2 | Very high | 88.3 | Confident | 0 Ų | 0 | 19.6 Ų | 19.6 | 0% | 0 | 11% | 0.108 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -59.7 | -23.3 | -172.3 | -80.9 | 103.5 | 0 | 0 | 0 | 114.9 | L283 Q287 L342 S345 M349 F392 P400 N458 T462 | L283-W396 HydrophobicContact CD2-CH2 3.59Å; L283-W396 HydrophobicContact CD2-CZ3 3.63Å; Q287-W396 HydrophobicContact CB-CE3 4.23Å; Q287-W396 WeakPolarHBondContact CG-O 3.47Å; Q287-W396 PolarHBondContact NE2-O 3.15Å; L342-W396 HydrophobicContact CB-CZ2 4.11Å; L342-W396 HydrophobicContact CD2-CD2 3.78Å; L342-W396 HydrophobicContact CD2-CE3 3.97Å; L342-W396 HydrophobicContact CD2-CG 4.28Å; L342-W396 HydrophobicContact CD2-CH2 3.97Å; L342-W396 HydrophobicContact CD2-CZ2 3.87Å; L342-W396 HydrophobicContact CD2-CZ3 4.08Å; L342-W396 HydrophobicContact CG-CZ2 4.45Å; L342-W396 PolarHBondContact O-NE1 2.99Å; S345-W396 PolarHBondContact OG-N 3.26Å; S345-W396 VanDerWaalsContact OG-N 3.08Å; M349-W396 HydrophobicContact CE-CG 4.48Å; M349-W396 HydrophobicContact SD-CB 3.92Å; M349-W396 VanDerWaalsContact SD-CD1 3.58Å; M349-W396 HydrophobicContact SD-CG 3.99Å; F392-W396 HydrophobicContact CD2-CB 3.68Å; F392-W396 HydrophobicContact CE2-CB 3.91Å; F392-W396 HydrophobicContact CG-CB 4.48Å; F392-W396 PolarHBondContact O-N 2.93Å; W396-P400 HydrophobicContact CE3-CG 3.87Å; W396-P400 HydrophobicContact CZ3-CG 4.08Å; W396-P400 WeakPolarHBondContact O-CD 3.48Å; W396-P400 VanDerWaalsContact O-CG 3.28Å; W396-P400 WeakPolarHBondContact O-CG 3.49Å; W396-N458 VanDerWaalsContact CD2-ND2 3.27Å; W396-N458 VanDerWaalsContact CE3-ND2 3.28Å; W396-N458 WeakPolarHBondContact CH2-ND2 3.4Å; W396-N458 WeakPolarHBondContact CH2-OD1 3.34Å; W396-N458 HydrophobicContact CZ2-CB 4.33Å; W396-N458 WeakPolarHBondContact CZ2-ND2 3.34Å; W396-N458 WeakPolarHBondContact CZ2-OD1 3.44Å; W396-N458 WeakPolarHBondContact CZ3-ND2 3.49Å; W396-N458 WeakPolarHBondContact CZ3-OD1 3.46Å; W396-T462 WeakPolarHBondContact CH2-OG1 3.41Å; W396-T462 WeakPolarHBondContact CZ2-OG1 3.21Å |
| 397 | G | 87.3 | Confident | 87.8 | Confident | 2 Ų | 2 | 19 Ų | 19 | 2% | 0.021 | 10% | 0.104 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -68.8 | -70.6 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q287 F392 G395 | Q287-G397 PolarHBondContact NE2-O 3.14Å; F392-G397 VanDerWaalsContact CZ-CA 3.48Å; F392-G397 PolarHBondContact O-N 3.49Å; G395-G397 PolarHBondContact O-N 3.11Å; G395-G397 VanDerWaalsContact O-N 3.1Å |
| 398 | P | 83.3 | Confident | 87.2 | Confident | 21 Ų | 21 | 15.7 Ų | 15.7 | 14% | 0.136 | 8% | 0.083 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -81.4 | -31.3 | -171.5 | 29.5 | -35.7 | 0 | 0 | 0 | 114.9 | Q175 M333 A393 G395 W401 L402 | Q175-P398 HydrophobicContact CG-CB 4.38Å; M333-P398 HydrophobicContact CE-CB 3.77Å; M333-P398 HydrophobicContact CE-CG 3.52Å; A393-P398 WeakPolarHBondContact O-CD 3.43Å; G395-P398 WeakPolarHBondContact O-CD 3.28Å; P398-W401 PolarHBondContact O-N 3.4Å; P398-L402 PolarHBondContact O-N 3.32Å |
| 399 | I | 87.3 | Confident | 86.1 | Confident | 0 Ų | 0 | 15.7 Ų | 15.7 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -69.8 | -41.5 | -168.5 | -62.1 | 175.6 | 0 | 0 | 0 | 113.5 | M333 R338 L341 L342 G395 W401 L402 I403 | M333-I399 HydrophobicContact CE-CD1 4.41Å; M333-I399 HydrophobicContact CE-CG1 3.59Å; M333-I399 HydrophobicContact SD-CG1 4.37Å; R338-I399 HydrophobicContact CB-CG2 3.84Å; R338-I399 HydrophobicContact CG-CG2 4.07Å; L341-I399 HydrophobicContact CB-CD1 3.38Å; L341-I399 HydrophobicContact CD1-CD1 4.13Å; L341-I399 HydrophobicContact CG-CD1 4.41Å; L342-I399 HydrophobicContact CD1-CG2 3.75Å; L342-I399 HydrophobicContact CD2-CB 3.81Å; L342-I399 HydrophobicContact CD2-CD1 4.37Å; L342-I399 HydrophobicContact CD2-CG2 3.91Å; L342-I399 HydrophobicContact CG-CB 4.07Å; L342-I399 HydrophobicContact CG-CD1 4.14Å; L342-I399 HydrophobicContact CG-CG2 3.67Å; G395-I399 VanDerWaalsContact O-CB 3.27Å; G395-I399 WeakPolarHBondContact O-CB 3.31Å; G395-I399 WeakPolarHBondContact O-CG1 3.26Å; G395-I399 PolarHBondContact O-N 2.95Å; I399-W401 VanDerWaalsContact C-N 3.27Å; I399-W401 PolarHBondContact O-N 3.13Å; I399-L402 WeakPolarHBondContact O-CB 3.24Å; I399-L402 PolarHBondContact O-N 3.4Å; I399-I403 HydrophobicContact CG2-CD1 3.54Å; I399-I403 HydrophobicContact CG2-CG1 3.8Å; I399-I403 WeakPolarHBondContact O-CG1 3.01Å; I399-I403 PolarHBondContact O-N 3.49Å |
| 400 | P | 89.3 | Confident | 85 | Confident | 0 Ų | 0 | 18.9 Ų | 18.9 | 0% | 0 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -56.8 | -39.6 | 177.9 | -30.9 | 40.1 | 0 | 0 | 0 | 113.6 | L283 M284 L342 W396 M404 | L283-P400 HydrophobicContact CB-CB 4.3Å; M284-P400 HydrophobicContact CE-CB 4Å; M284-P400 HydrophobicContact SD-CB 4.03Å; L342-P400 HydrophobicContact CD2-CG 4.34Å; W396-P400 HydrophobicContact CE3-CG 3.87Å; W396-P400 HydrophobicContact CZ3-CG 4.08Å; W396-P400 WeakPolarHBondContact O-CD 3.48Å; W396-P400 VanDerWaalsContact O-CG 3.28Å; W396-P400 WeakPolarHBondContact O-CG 3.49Å; P400-M404 WeakPolarHBondContact O-CB 3.49Å; P400-M404 PolarHBondContact O-N 2.73Å |
| 401 | W | 84.4 | Confident | 83.9 | Confident | 70 Ų | 70 | 22.6 Ų | 22.6 | 27% | 0.265 | 11% | 0.112 | S | C | . | . | H | α-helix | trans | -67.2 | -37.8 | 175.2 | -67.8 | 104.9 | 0 | 0 | 0 | 112.3 | M284 P398 I399 M404 S405 V421 N424 | M284-W401 HydrophobicContact CE-CB 4.43Å; M284-W401 HydrophobicContact CE-CD2 3.49Å; M284-W401 VanDerWaalsContact CE-CD2 3.49Å; M284-W401 HydrophobicContact CE-CE3 3.57Å; M284-W401 HydrophobicContact CE-CG 3.89Å; M284-W401 HydrophobicContact CE-CH2 4.35Å; M284-W401 HydrophobicContact CE-CZ2 4.28Å; M284-W401 HydrophobicContact CE-CZ3 4.01Å; M284-W401 HydrophobicContact SD-CD2 4.3Å; M284-W401 HydrophobicContact SD-CZ2 4.18Å; P398-W401 PolarHBondContact O-N 3.4Å; I399-W401 VanDerWaalsContact C-N 3.27Å; I399-W401 PolarHBondContact O-N 3.13Å; W401-M404 HydrophobicContact CE3-SD 4.14Å; W401-M404 HydrophobicContact CZ3-SD 4.26Å; W401-S405 PolarHBondContact O-N 3.48Å; W401-V421 HydrophobicContact CH2-CG2 4.08Å; W401-V421 HydrophobicContact CZ3-CG2 3.81Å; W401-N424 HydrophobicContact CH2-CB 4.49Å |
| 402 | L | 81 | Confident | 83 | Confident | 46 Ų | 46 | 22.6 Ų | 22.6 | 24% | 0.241 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -66.3 | -50.5 | 176.1 | -171.3 | 73.2 | 0 | 0 | 0 | 111.4 | M333 R338 P398 I399 M404 S405 E406 | M333-L402 HydrophobicContact CG-CD2 4.43Å; M333-L402 HydrophobicContact SD-CD2 3.59Å; M333-L402 VanDerWaalsContact SD-CD2 3.59Å; R338-L402 HydrophobicContact CG-CD2 4.07Å; P398-L402 PolarHBondContact O-N 3.32Å; I399-L402 WeakPolarHBondContact O-CB 3.24Å; I399-L402 PolarHBondContact O-N 3.4Å; L402-M404 VanDerWaalsContact C-N 3.29Å; L402-M404 PolarHBondContact O-N 2.89Å; L402-S405 WeakPolarHBondContact O-CA 3.49Å; L402-S405 WeakPolarHBondContact O-CB 3.37Å; L402-S405 PolarHBondContact O-N 3.21Å; L402-S405 PolarHBondContact O-OG 3.47Å; L402-E406 WeakPolarHBondContact CD2-OE1 3.47Å; L402-E406 HydrophobicContact CG-CG 4.35Å; L402-E406 WeakPolarHBondContact CG-OE1 3.4Å; L402-E406 WeakPolarHBondContact O-CG 3.37Å; L402-E406 PolarHBondContact O-N 2.85Å |
| 403 | I | 84.2 | Confident | 82 | Confident | 0 Ų | 0 | 25 Ų | 25 | 0% | 0 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -58.5 | -42.4 | 179.4 | -68.8 | 178.2 | 0 | 0 | 0 | 110.6 | L283 R338 L342 I399 S405 E406 V407 V466 | L283-I403 HydrophobicContact CD1-CB 4.14Å; L283-I403 HydrophobicContact CD1-CD1 4.04Å; L283-I403 HydrophobicContact CD1-CG2 3.75Å; R338-I403 HydrophobicContact CB-CD1 4.4Å; R338-I403 HydrophobicContact CB-CG1 4.48Å; L342-I403 HydrophobicContact CD1-CD1 3.72Å; I399-I403 HydrophobicContact CG2-CD1 3.54Å; I399-I403 HydrophobicContact CG2-CG1 3.8Å; I399-I403 WeakPolarHBondContact O-CG1 3.01Å; I399-I403 PolarHBondContact O-N 3.49Å; I403-S405 PolarHBondContact O-N 3.42Å; I403-E406 PolarHBondContact O-N 2.91Å; I403-E406 VanDerWaalsContact O-N 3.11Å; I403-V407 HydrophobicContact CG2-CB 4.36Å; I403-V407 HydrophobicContact CG2-CG2 3.69Å; I403-V407 VanDerWaalsContact O-CB 3.28Å; I403-V407 WeakPolarHBondContact O-CB 3.36Å; I403-V407 WeakPolarHBondContact O-CG2 3.45Å; I403-V407 PolarHBondContact O-N 2.67Å; I403-V466 HydrophobicContact CD1-CG1 3.79Å |
| 404 | M | 82.5 | Confident | 81 | Confident | 25 Ų | 25 | 26.8 Ų | 26.8 | 12% | 0.123 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -52.5 | -42.9 | 173.5 | 174.3 | -163.6 | 148.9 | 0 | 0 | 111.6 | M284 P400 W401 L402 I408 V420 | M284-M404 HydrophobicContact CE-CB 4.43Å; M284-M404 HydrophobicContact CE-SD 4.37Å; P400-M404 WeakPolarHBondContact O-CB 3.49Å; P400-M404 PolarHBondContact O-N 2.73Å; W401-M404 HydrophobicContact CE3-SD 4.14Å; W401-M404 HydrophobicContact CZ3-SD 4.26Å; L402-M404 VanDerWaalsContact C-N 3.29Å; L402-M404 PolarHBondContact O-N 2.89Å; M404-I408 HydrophobicContact CB-CD1 4.5Å; M404-I408 HydrophobicContact CG-CD1 3.6Å; M404-I408 VanDerWaalsContact O-CB 3.29Å; M404-I408 WeakPolarHBondContact O-CB 3.43Å; M404-I408 WeakPolarHBondContact O-CD1 3.38Å; M404-I408 VanDerWaalsContact O-CG1 3.22Å; M404-I408 WeakPolarHBondContact O-CG1 3.44Å; M404-I408 PolarHBondContact O-N 3.16Å; M404-V420 HydrophobicContact CG-CB 4.36Å; M404-V420 HydrophobicContact CG-CG1 3.98Å; M404-V420 HydrophobicContact CG-CG2 4.36Å; M404-V420 HydrophobicContact SD-CB 3.9Å; M404-V420 HydrophobicContact SD-CG1 3.5Å; M404-V420 WeakPolarHBondContact SD-CG1 3.36Å |
| 405 | S | 75.8 | Confident | 80.4 | Confident | 55 Ų | 55 | 30 Ų | 30 | 39% | 0.385 | 15% | 0.151 | S | C | . | . | H | α-helix | trans | -76.5 | -25.8 | -179.5 | 76.8 | 0 | 0 | 0 | 0 | 114.3 | W401 L402 I403 R413 | W401-S405 PolarHBondContact O-N 3.48Å; L402-S405 WeakPolarHBondContact O-CA 3.49Å; L402-S405 WeakPolarHBondContact O-CB 3.37Å; L402-S405 PolarHBondContact O-N 3.21Å; L402-S405 PolarHBondContact O-OG 3.47Å; I403-S405 PolarHBondContact O-N 3.42Å; S405-R413 PolarHBondContact O-NH2 3.38Å |
| 406 | E | 80.1 | Confident | 80 | Confident | 44 Ų | 44 | 30 Ų | 30 | 21% | 0.206 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -89.4 | -27 | -177.9 | -71 | 177.5 | 172.8 | 0 | 0 | 113.2 | R338 L402 I403 T469 L474 I477 | R338-E406 IonicContact NE-OE1 3.99Å; R338-E406 IonicContact NE-OE2 3.64Å; R338-E406 IonicContact NH2-OE1 3.74Å; L402-E406 WeakPolarHBondContact CD2-OE1 3.47Å; L402-E406 HydrophobicContact CG-CG 4.35Å; L402-E406 WeakPolarHBondContact CG-OE1 3.4Å; L402-E406 WeakPolarHBondContact O-CG 3.37Å; L402-E406 PolarHBondContact O-N 2.85Å; I403-E406 PolarHBondContact O-N 2.91Å; I403-E406 VanDerWaalsContact O-N 3.11Å; E406-T469 WeakPolarHBondContact OE2-CB 3.31Å; E406-T469 PolarHBondContact OE2-OG1 3.38Å; E406-L474 VanDerWaalsContact O-CD1 3.28Å; E406-L474 WeakPolarHBondContact O-CD1 3.33Å; E406-I477 WeakPolarHBondContact O-CD1 3.47Å |
| 407 | V | 82.4 | Confident | 79.4 | Confident | 1 Ų | 1 | 30.1 Ų | 30.1 | 1% | 0.006 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -102.1 | -25.7 | -172.3 | 171.8 | 0 | 0 | 0 | 0 | 112.1 | P276 I403 P409 T469 I477 F481 | P276-V407 HydrophobicContact CB-CG1 3.4Å; P276-V407 WeakPolarHBondContact CB-O 3.34Å; P276-V407 HydrophobicContact CG-CG1 3.84Å; I403-V407 HydrophobicContact CG2-CB 4.36Å; I403-V407 HydrophobicContact CG2-CG2 3.69Å; I403-V407 VanDerWaalsContact O-CB 3.28Å; I403-V407 WeakPolarHBondContact O-CB 3.36Å; I403-V407 WeakPolarHBondContact O-CG2 3.45Å; I403-V407 PolarHBondContact O-N 2.67Å; V407-P409 WeakPolarHBondContact O-CD 3.36Å; V407-T469 HydrophobicContact CG2-CG2 3.65Å; V407-I477 HydrophobicContact CB-CG2 4.42Å; V407-I477 HydrophobicContact CG1-CG2 4.39Å; V407-I477 HydrophobicContact CG2-CG2 4.11Å; V407-F481 HydrophobicContact CB-CE2 4.49Å; V407-F481 HydrophobicContact CG1-CD2 4.35Å; V407-F481 HydrophobicContact CG1-CE2 3.36Å; V407-F481 HydrophobicContact CG1-CZ 3.67Å |
| 408 | I | 81 | Confident | 79 | Confident | 2 Ų | 2 | 30.8 Ų | 30.8 | 1% | 0.01 | 16% | 0.158 | C | C | . | . | S | Bend | trans | -84.5 | 123.7 | -178.4 | -63.3 | 174.8 | 0 | 0 | 0 | 110.8 | M404 V412 R413 A416 V420 | M404-I408 HydrophobicContact CB-CD1 4.5Å; M404-I408 HydrophobicContact CG-CD1 3.6Å; M404-I408 VanDerWaalsContact O-CB 3.29Å; M404-I408 WeakPolarHBondContact O-CB 3.43Å; M404-I408 WeakPolarHBondContact O-CD1 3.38Å; M404-I408 VanDerWaalsContact O-CG1 3.22Å; M404-I408 WeakPolarHBondContact O-CG1 3.44Å; M404-I408 PolarHBondContact O-N 3.16Å; I408-V412 HydrophobicContact CG2-CG2 3.8Å; I408-R413 HydrophobicContact CG2-CB 4.25Å; I408-R413 HydrophobicContact CG2-CG 4.47Å; I408-R413 PolarHBondContact O-NE 3.02Å; I408-R413 PolarHBondContact O-NH2 3.41Å; I408-A416 HydrophobicContact CD1-CB 4.08Å; I408-A416 HydrophobicContact CG2-CB 3.6Å; I408-V420 HydrophobicContact CD1-CG2 4.21Å |
| 409 | P | 73.3 | Confident | 79.2 | Confident | 1 Ų | 1 | 31 Ų | 31 | 1% | 0.006 | 16% | 0.161 | C | C | . | . | trans | -57.4 | 142.7 | 177 | -25.8 | 35.1 | 0 | 0 | 0 | 112.4 | V273 V407 R411 V412 R413 E478 | V273-P409 HydrophobicContact CG2-CG 4.21Å; V407-P409 WeakPolarHBondContact O-CD 3.36Å; P409-R411 VanDerWaalsContact C-N 3.26Å; P409-R411 HydrophobicContact CB-CG 4Å; P409-R411 PolarHBondContact O-N 3.31Å; P409-V412 HydrophobicContact CB-CG2 4.11Å; P409-V412 HydrophobicContact CG-CG2 4.3Å; P409-V412 WeakPolarHBondContact O-CG2 3.21Å; P409-V412 PolarHBondContact O-N 3.13Å; P409-R413 PolarHBondContact O-N 2.97Å; P409-R413 VanDerWaalsContact O-N 3.12Å; P409-E478 WeakPolarHBondContact CB-OE1 3.45Å; P409-E478 HydrophobicContact CG-CG 4.23Å; P409-E478 WeakPolarHBondContact CG-OE1 3.33Å | ||
| 410 | I | 69.6 | Low | 79.1 | Confident | 68 Ų | 68 | 31 Ų | 31 | 35% | 0.349 | 16% | 0.161 | S | C | . | . | G | 310 helix | trans | -56.6 | -41.6 | -176 | -63.1 | 170.1 | 0 | 0 | 0 | 111.2 | Q259 V412 R413 L474 | Q259-I410 HydrophobicContact CG-CG2 4.22Å; I410-V412 VanDerWaalsContact C-N 3.29Å; I410-V412 PolarHBondContact O-N 3.03Å; I410-R413 WeakPolarHBondContact O-CB 3.41Å; I410-R413 PolarHBondContact O-N 3.36Å; I410-L474 HydrophobicContact CD1-CD2 4.26Å; I410-L474 HydrophobicContact CG1-CD2 4.03Å |
| 411 | R | 70.7 | Confident | 78.9 | Confident | 86 Ų | 86 | 31.1 Ų | 31.1 | 33% | 0.325 | 16% | 0.162 | S | C | . | . | G | 310 helix | trans | -55.4 | -35 | 179.9 | 54.7 | 171.8 | -179.8 | 165 | 4.3 | 114.8 | D270 P409 | D270-R411 IonicContact OD2-NH2 2.57Å; D270-R411 PolarHBondContact OD2-NH2 3.08Å; P409-R411 VanDerWaalsContact C-N 3.26Å; P409-R411 HydrophobicContact CB-CG 4Å; P409-R411 PolarHBondContact O-N 3.31Å |
| 412 | V | 74.1 | Confident | 79.2 | Confident | 2 Ų | 2 | 31.4 Ų | 31.4 | 1% | 0.012 | 17% | 0.168 | C | C | . | . | G | 310 helix | trans | -104.8 | -4.4 | -178.3 | -60.9 | 0 | 0 | 0 | 0 | 113.2 | F263 V273 I408 P409 I410 G414 F415 A416 | F263-V412 HydrophobicContact CD2-CB 4.37Å; F263-V412 HydrophobicContact CD2-CG1 3.71Å; F263-V412 HydrophobicContact CE2-CB 4.19Å; F263-V412 HydrophobicContact CE2-CG1 3.64Å; V273-V412 HydrophobicContact CG1-CB 4.37Å; V273-V412 HydrophobicContact CG1-CG1 4Å; V273-V412 HydrophobicContact CG1-CG2 3.94Å; V273-V412 HydrophobicContact CG2-CG1 4.3Å; I408-V412 HydrophobicContact CG2-CG2 3.8Å; P409-V412 HydrophobicContact CB-CG2 4.11Å; P409-V412 HydrophobicContact CG-CG2 4.3Å; P409-V412 WeakPolarHBondContact O-CG2 3.21Å; P409-V412 PolarHBondContact O-N 3.13Å; I410-V412 VanDerWaalsContact C-N 3.29Å; I410-V412 PolarHBondContact O-N 3.03Å; V412-G414 PolarHBondContact O-N 3.18Å; V412-G414 VanDerWaalsContact O-N 3.08Å; V412-F415 PolarHBondContact O-N 3.06Å; V412-A416 HydrophobicContact CB-CB 4.46Å; V412-A416 HydrophobicContact CG2-CB 4.21Å; V412-A416 WeakPolarHBondContact O-CB 3.44Å; V412-A416 PolarHBondContact O-N 3.32Å |
| 413 | R | 72.4 | Confident | 79.6 | Confident | 68 Ų | 68 | 30.8 Ų | 30.8 | 26% | 0.257 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -56.7 | -33 | -167.1 | -170.6 | 172 | -68.2 | 175.5 | -2.9 | 114 | S405 I408 P409 I410 G417 | S405-R413 PolarHBondContact O-NH2 3.38Å; I408-R413 HydrophobicContact CG2-CB 4.25Å; I408-R413 HydrophobicContact CG2-CG 4.47Å; I408-R413 PolarHBondContact O-NE 3.02Å; I408-R413 PolarHBondContact O-NH2 3.41Å; P409-R413 PolarHBondContact O-N 2.97Å; P409-R413 VanDerWaalsContact O-N 3.12Å; I410-R413 WeakPolarHBondContact O-CB 3.41Å; I410-R413 PolarHBondContact O-N 3.36Å; R413-G417 WeakPolarHBondContact O-CA 3.47Å; R413-G417 PolarHBondContact O-N 3.19Å |
| 414 | G | 71.3 | Confident | 80 | Confident | 38 Ų | 38 | 30.9 Ų | 30.9 | 39% | 0.392 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -62.1 | -58.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | V412 A418 | V412-G414 PolarHBondContact O-N 3.18Å; V412-G414 VanDerWaalsContact O-N 3.08Å; G414-A418 WeakPolarHBondContact O-CB 3.49Å; G414-A418 PolarHBondContact O-N 3Å; G414-A418 VanDerWaalsContact O-N 3.13Å |
| 415 | F | 77.3 | Confident | 80.4 | Confident | 101 Ų | 101 | 30 Ų | 30 | 44% | 0.443 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -67.8 | -47.6 | -179.7 | 177.6 | -92.5 | 0 | 0 | 0 | 111.9 | F263 L268 V412 G417 A418 A419 | F263-F415 HydrophobicContact CE1-CB 3.97Å; F263-F415 HydrophobicContact CE1-CG 4.12Å; F263-F415 HydrophobicContact CZ-CB 3.98Å; F263-F415 HydrophobicContact CZ-CD1 4.07Å; F263-F415 HydrophobicContact CZ-CG 4.01Å; L268-F415 HydrophobicContact CD1-CD1 4.03Å; L268-F415 HydrophobicContact CD1-CE1 3.56Å; L268-F415 HydrophobicContact CD1-CZ 4.26Å; L268-F415 HydrophobicContact CD2-CD1 4.06Å; L268-F415 HydrophobicContact CD2-CE1 4.22Å; V412-F415 PolarHBondContact O-N 3.06Å; F415-G417 VanDerWaalsContact C-N 3.31Å; F415-G417 PolarHBondContact O-N 3.29Å; F415-A418 WeakPolarHBondContact O-CB 3.28Å; F415-A418 PolarHBondContact O-N 3.05Å; F415-A419 PolarHBondContact O-N 2.93Å |
| 416 | A | 80.8 | Confident | 81.2 | Confident | 0 Ų | 0 | 28.9 Ų | 28.9 | 0% | 0 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -59.3 | -43.1 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | L277 I408 V412 A419 V420 | L277-A416 HydrophobicContact CD1-CB 3.8Å; I408-A416 HydrophobicContact CD1-CB 4.08Å; I408-A416 HydrophobicContact CG2-CB 3.6Å; V412-A416 HydrophobicContact CB-CB 4.46Å; V412-A416 HydrophobicContact CG2-CB 4.21Å; V412-A416 WeakPolarHBondContact O-CB 3.44Å; V412-A416 PolarHBondContact O-N 3.32Å; A416-A419 PolarHBondContact O-N 3.44Å; A416-V420 VanDerWaalsContact O-CG2 3.3Å; A416-V420 WeakPolarHBondContact O-CG2 3.46Å; A416-V420 PolarHBondContact O-N 2.99Å |
| 417 | G | 78.7 | Confident | 81.9 | Confident | 3 Ų | 3 | 29 Ų | 29 | 3% | 0.031 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -66.6 | -38.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | R413 F415 A419 V420 V421 | R413-G417 WeakPolarHBondContact O-CA 3.47Å; R413-G417 PolarHBondContact O-N 3.19Å; F415-G417 VanDerWaalsContact C-N 3.31Å; F415-G417 PolarHBondContact O-N 3.29Å; G417-A419 VanDerWaalsContact C-N 3.33Å; G417-A419 PolarHBondContact O-N 2.91Å; G417-V420 PolarHBondContact O-N 3.29Å; G417-V421 WeakPolarHBondContact O-CB 3.4Å; G417-V421 WeakPolarHBondContact O-CG2 3.32Å; G417-V421 PolarHBondContact O-N 3.38Å |
| 418 | A | 80.3 | Confident | 82.4 | Confident | 15 Ų | 15 | 29 Ų | 29 | 12% | 0.124 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -60.5 | -42.2 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112 | L98 G414 F415 V421 L422 | L98-A418 HydrophobicContact CD2-CB 3.82Å; G414-A418 WeakPolarHBondContact O-CB 3.49Å; G414-A418 PolarHBondContact O-N 3Å; G414-A418 VanDerWaalsContact O-N 3.13Å; F415-A418 WeakPolarHBondContact O-CB 3.28Å; F415-A418 PolarHBondContact O-N 3.05Å; A418-V421 PolarHBondContact O-N 3.47Å; A418-L422 VanDerWaalsContact O-CB 3.3Å; A418-L422 WeakPolarHBondContact O-CB 3.47Å; A418-L422 PolarHBondContact O-N 2.9Å |
| 419 | A | 85.8 | Confident | 83.1 | Confident | 25 Ų | 25 | 31 Ų | 31 | 21% | 0.207 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -65.1 | -40.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | I281 F415 A416 G417 L422 S423 | I281-A419 HydrophobicContact CD1-CB 4.46Å; F415-A419 PolarHBondContact O-N 2.93Å; A416-A419 PolarHBondContact O-N 3.44Å; G417-A419 VanDerWaalsContact C-N 3.33Å; G417-A419 PolarHBondContact O-N 2.91Å; A419-L422 PolarHBondContact O-N 3.27Å; A419-S423 WeakPolarHBondContact O-CB 3.44Å; A419-S423 PolarHBondContact O-N 3.37Å; A419-S423 PolarHBondContact O-OG 3.38Å |
| 420 | V | 87.2 | Confident | 84.1 | Confident | 0 Ų | 0 | 34.4 Ų | 34.4 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -64.8 | -45.3 | 176.4 | 174.4 | 0 | 0 | 0 | 0 | 111 | L277 I281 M284 M404 I408 A416 G417 S423 N424 | L277-V420 HydrophobicContact CD1-CG2 4.15Å; I281-V420 HydrophobicContact CG1-CG2 3.84Å; M284-V420 HydrophobicContact CB-CG1 4.45Å; M284-V420 HydrophobicContact CE-CG1 3.83Å; M284-V420 HydrophobicContact CG-CG1 3.36Å; M284-V420 HydrophobicContact SD-CG1 4.42Å; M404-V420 HydrophobicContact CG-CB 4.36Å; M404-V420 HydrophobicContact CG-CG1 3.98Å; M404-V420 HydrophobicContact CG-CG2 4.36Å; M404-V420 HydrophobicContact SD-CB 3.9Å; M404-V420 HydrophobicContact SD-CG1 3.5Å; M404-V420 WeakPolarHBondContact SD-CG1 3.36Å; I408-V420 HydrophobicContact CD1-CG2 4.21Å; A416-V420 VanDerWaalsContact O-CG2 3.3Å; A416-V420 WeakPolarHBondContact O-CG2 3.46Å; A416-V420 PolarHBondContact O-N 2.99Å; G417-V420 PolarHBondContact O-N 3.29Å; V420-S423 PolarHBondContact O-N 2.85Å; V420-N424 PolarHBondContact O-N 3.48Å |
| 421 | V | 84.9 | Confident | 85.3 | Confident | 3 Ų | 3 | 31.7 Ų | 31.7 | 2% | 0.018 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -62.1 | -44.5 | 176.8 | 171.8 | 0 | 0 | 0 | 0 | 111.2 | W401 G417 A418 S423 N424 W425 | W401-V421 HydrophobicContact CH2-CG2 4.08Å; W401-V421 HydrophobicContact CZ3-CG2 3.81Å; G417-V421 WeakPolarHBondContact O-CB 3.4Å; G417-V421 WeakPolarHBondContact O-CG2 3.32Å; G417-V421 PolarHBondContact O-N 3.38Å; A418-V421 PolarHBondContact O-N 3.47Å; V421-S423 VanDerWaalsContact C-N 3.32Å; V421-S423 PolarHBondContact O-N 3.34Å; V421-N424 PolarHBondContact O-N 2.54Å; V421-W425 PolarHBondContact O-N 2.92Å |
| 422 | L | 88.9 | Confident | 86.2 | Confident | 77 Ų | 77 | 27.6 Ų | 27.6 | 40% | 0.403 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -60.9 | -42 | 175.5 | 178.9 | 61.1 | 0 | 0 | 0 | 111.6 | A94 L98 A418 A419 G426 | A94-L422 HydrophobicContact CB-CD1 3.88Å; L98-L422 HydrophobicContact CD1-CD1 4.49Å; L98-L422 HydrophobicContact CD1-CD2 4.49Å; L98-L422 HydrophobicContact CD2-CB 4.44Å; A418-L422 VanDerWaalsContact O-CB 3.3Å; A418-L422 WeakPolarHBondContact O-CB 3.47Å; A418-L422 PolarHBondContact O-N 2.9Å; A419-L422 PolarHBondContact O-N 3.27Å; L422-G426 WeakPolarHBondContact O-CA 3.23Å; L422-G426 PolarHBondContact O-N 3.43Å |
| 423 | S | 91.1 | Very high | 87.1 | Confident | 32 Ų | 32 | 28.9 Ų | 28.9 | 22% | 0.224 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -66 | -42 | 178.4 | -57 | 0 | 0 | 0 | 0 | 111.7 | A419 V420 V421 M427 | A419-S423 WeakPolarHBondContact O-CB 3.44Å; A419-S423 PolarHBondContact O-N 3.37Å; A419-S423 PolarHBondContact O-OG 3.38Å; V420-S423 PolarHBondContact O-N 2.85Å; V421-S423 VanDerWaalsContact C-N 3.32Å; V421-S423 PolarHBondContact O-N 3.34Å; S423-M427 WeakPolarHBondContact O-CB 3.36Å; S423-M427 PolarHBondContact O-N 3.4Å |
| 424 | N | 91.6 | Very high | 88 | Confident | 2 Ų | 2 | 28 Ų | 28 | 1% | 0.011 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -59.2 | -57.9 | 174.6 | -175.4 | 62.5 | 0 | 0 | 0 | 111.2 | M284 Q287 Q288 W401 V420 V421 G426 M427 A428 | M284-N424 HydrophobicContact CB-CB 3.76Å; M284-N424 HydrophobicContact CG-CB 3.98Å; M284-N424 HydrophobicContact SD-CB 4.18Å; Q287-N424 PolarHBondContact OE1-OD1 2.84Å; Q287-N424 VanDerWaalsContact OE1-OD1 3.13Å; Q288-N424 WeakPolarHBondContact CG-O 3.15Å; Q288-N424 WeakPolarHBondContact CG-OD1 3.37Å; Q288-N424 PolarHBondContact NE2-OD1 3.5Å; W401-N424 HydrophobicContact CH2-CB 4.49Å; V420-N424 PolarHBondContact O-N 3.48Å; V421-N424 PolarHBondContact O-N 2.54Å; N424-G426 VanDerWaalsContact C-N 3.34Å; N424-G426 PolarHBondContact O-N 3.02Å; N424-M427 PolarHBondContact O-N 2.93Å; N424-A428 WeakPolarHBondContact O-CB 3.15Å; N424-A428 PolarHBondContact O-N 3.26Å |
| 425 | W | 91.4 | Very high | 88.9 | Confident | 7 Ų | 7 | 26.1 Ų | 26.1 | 3% | 0.027 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -71.5 | -30 | -174.9 | -70.4 | 119.6 | 0 | 0 | 0 | 113.3 | F53 L57 T90 A93 A94 V421 A428 F429 | F53-W425 AromaticContact CE2-CH2 3.39Å; F53-W425 HydrophobicContact CE2-CH2 3.39Å; F53-W425 AromaticContact CE2-CZ2 3.62Å; F53-W425 HydrophobicContact CE2-CZ2 3.62Å; F53-W425 AromaticContact CZ-CH2 3.32Å; F53-W425 HydrophobicContact CZ-CH2 3.32Å; F53-W425 AromaticContact CZ-CZ2 3.39Å; F53-W425 HydrophobicContact CZ-CZ2 3.39Å; L57-W425 HydrophobicContact CD2-CH2 4.15Å; L57-W425 HydrophobicContact CD2-CZ3 4.27Å; T90-W425 HydrophobicContact CG2-CE3 4.03Å; T90-W425 HydrophobicContact CG2-CZ3 4.16Å; A93-W425 HydrophobicContact CB-CD2 3.55Å; A93-W425 HydrophobicContact CB-CE3 3.88Å; A93-W425 HydrophobicContact CB-CG 3.83Å; A93-W425 HydrophobicContact CB-CZ2 4.25Å; A93-W425 HydrophobicContact CB-CZ3 4.38Å; A94-W425 HydrophobicContact CB-CB 3.68Å; V421-W425 PolarHBondContact O-N 2.92Å; W425-A428 HydrophobicContact CE3-CB 4.07Å; W425-A428 PolarHBondContact O-N 3.35Å; W425-F429 PolarHBondContact O-N 3.01Å |
| 426 | G | 92.8 | Very high | 89.3 | Confident | 31 Ų | 31 | 22.6 Ų | 22.6 | 32% | 0.32 | 14% | 0.135 | S | C | . | . | H | α-helix | trans | -64.7 | -44.8 | 171.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | L422 N424 F429 V430 | L422-G426 WeakPolarHBondContact O-CA 3.23Å; L422-G426 PolarHBondContact O-N 3.43Å; N424-G426 VanDerWaalsContact C-N 3.34Å; N424-G426 PolarHBondContact O-N 3.02Å; G426-F429 WeakPolarHBondContact O-CB 3.45Å; G426-F429 PolarHBondContact O-N 2.91Å; G426-V430 WeakPolarHBondContact O-CG2 3.46Å; G426-V430 PolarHBondContact O-N 2.71Å; G426-V430 VanDerWaalsContact O-N 3.15Å |
| 427 | M | 94.8 | Very high | 89.7 | Confident | 47 Ų | 47 | 25.9 Ų | 25.9 | 23% | 0.232 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -69.8 | -36.2 | 175.8 | -170.2 | 55.2 | 72.6 | 0 | 0 | 111.8 | V285 Q288 M289 S423 N424 F429 V430 V431 | V285-M427 HydrophobicContact CG1-CE 3.65Å; V285-M427 HydrophobicContact CG1-CG 4.28Å; V285-M427 HydrophobicContact CG2-CE 4.49Å; Q288-M427 HydrophobicContact CB-CB 3.82Å; Q288-M427 HydrophobicContact CB-CG 3.59Å; Q288-M427 HydrophobicContact CG-CB 4.21Å; M289-M427 HydrophobicContact CG-CE 4.49Å; M289-M427 HydrophobicContact CG-CG 4.02Å; M289-M427 HydrophobicContact CG-SD 4.01Å; S423-M427 WeakPolarHBondContact O-CB 3.36Å; S423-M427 PolarHBondContact O-N 3.4Å; N424-M427 PolarHBondContact O-N 2.93Å; M427-F429 VanDerWaalsContact C-N 3.3Å; M427-F429 PolarHBondContact O-N 3.37Å; M427-V430 PolarHBondContact O-N 2.88Å; M427-V430 HydrophobicContact SD-CB 4.3Å; M427-V430 HydrophobicContact SD-CG1 4.5Å; M427-V431 HydrophobicContact CG-CG2 4.28Å; M427-V431 WeakPolarHBondContact O-CG2 3.27Å; M427-V431 PolarHBondContact O-N 3.46Å; M427-V431 HydrophobicContact SD-CG2 4.16Å |
| 428 | A | 93.3 | Very high | 90.2 | Very high | 0 Ų | 0 | 27.2 Ų | 27.2 | 0% | 0 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -57.3 | -43.7 | 171.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | T90 Q288 N293 N424 W425 T432 | T90-A428 HydrophobicContact CG2-CB 3.91Å; Q288-A428 HydrophobicContact CG-CB 4.18Å; N293-A428 WeakPolarHBondContact ND2-CB 3.41Å; N424-A428 WeakPolarHBondContact O-CB 3.15Å; N424-A428 PolarHBondContact O-N 3.26Å; W425-A428 HydrophobicContact CE3-CB 4.07Å; W425-A428 PolarHBondContact O-N 3.35Å; A428-T432 VanDerWaalsContact O-CB 3.24Å; A428-T432 WeakPolarHBondContact O-CB 3.4Å; A428-T432 PolarHBondContact O-N 3.42Å; A428-T432 PolarHBondContact O-OG1 2.91Å |
| 429 | F | 94.3 | Very high | 90.5 | Very high | 45 Ų | 45 | 26.8 Ų | 26.8 | 20% | 0.197 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -57.6 | -52.1 | 174.9 | 173.7 | -108.4 | 0 | 0 | 0 | 111.7 | W84 T90 I91 W425 G426 M427 V431 T432 K433 | W84-F429 HydrophobicContact CE3-CE2 4.45Å; W84-F429 HydrophobicContact CH2-CZ 4.18Å; W84-F429 HydrophobicContact CZ3-CE2 4.03Å; W84-F429 AromaticContact CZ3-CZ 3.86Å; W84-F429 HydrophobicContact CZ3-CZ 3.86Å; T90-F429 WeakPolarHBondContact OG1-CA 3.32Å; T90-F429 WeakPolarHBondContact OG1-CB 3.22Å; T90-F429 PolarHBondContact OG1-N 3.43Å; I91-F429 HydrophobicContact CD1-CD1 4.27Å; I91-F429 HydrophobicContact CD1-CD2 3.49Å; I91-F429 VanDerWaalsContact CD1-CD2 3.49Å; I91-F429 HydrophobicContact CD1-CE1 4.11Å; I91-F429 HydrophobicContact CD1-CE2 3.31Å; I91-F429 HydrophobicContact CD1-CG 3.99Å; I91-F429 HydrophobicContact CD1-CZ 3.64Å; I91-F429 HydrophobicContact CG1-CB 4.21Å; I91-F429 HydrophobicContact CG1-CD1 4.29Å; I91-F429 HydrophobicContact CG1-CD2 3.44Å; I91-F429 VanDerWaalsContact CG1-CD2 3.44Å; I91-F429 HydrophobicContact CG1-CE2 3.86Å; I91-F429 HydrophobicContact CG1-CG 3.69Å; I91-F429 HydrophobicContact CG1-CZ 4.43Å; W425-F429 PolarHBondContact O-N 3.01Å; G426-F429 WeakPolarHBondContact O-CB 3.45Å; G426-F429 PolarHBondContact O-N 2.91Å; M427-F429 VanDerWaalsContact C-N 3.3Å; M427-F429 PolarHBondContact O-N 3.37Å; F429-V431 PolarHBondContact O-N 3.28Å; F429-T432 PolarHBondContact O-N 3.19Å; F429-K433 HydrophobicContact CE2-CB 4.14Å; F429-K433 HydrophobicContact CE2-CG 4.4Å; F429-K433 HydrophobicContact CZ-CB 4.21Å; F429-K433 HydrophobicContact CZ-CG 4.16Å; F429-K433 WeakPolarHBondContact O-CB 3.49Å; F429-K433 PolarHBondContact O-N 3.39Å |
| 430 | V | 94.8 | Very high | 90.5 | Very high | 72 Ų | 72 | 29.6 Ų | 29.6 | 44% | 0.436 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -57.2 | -54.2 | -178.6 | 173.3 | 0 | 0 | 0 | 0 | 110.1 | G426 M427 T432 K433 T434 | G426-V430 WeakPolarHBondContact O-CG2 3.46Å; G426-V430 PolarHBondContact O-N 2.71Å; G426-V430 VanDerWaalsContact O-N 3.15Å; M427-V430 PolarHBondContact O-N 2.88Å; M427-V430 HydrophobicContact SD-CB 4.3Å; M427-V430 HydrophobicContact SD-CG1 4.5Å; V430-T432 PolarHBondContact O-N 3.28Å; V430-K433 PolarHBondContact O-N 3.44Å; V430-T434 WeakPolarHBondContact O-CB 3.37Å; V430-T434 WeakPolarHBondContact O-CG2 3.39Å; V430-T434 PolarHBondContact O-N 3.36Å; V430-T434 PolarHBondContact O-OG1 2.88Å |
| 431 | V | 94.1 | Very high | 90.6 | Very high | 11 Ų | 11 | 36.6 Ų | 36.6 | 7% | 0.067 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -62.7 | -44.9 | -176.7 | 173.6 | 0 | 0 | 0 | 0 | 111.9 | A294 M427 F429 F435 F451 | A294-V431 HydrophobicContact CB-CG1 4.24Å; M427-V431 HydrophobicContact CG-CG2 4.28Å; M427-V431 WeakPolarHBondContact O-CG2 3.27Å; M427-V431 PolarHBondContact O-N 3.46Å; M427-V431 HydrophobicContact SD-CG2 4.16Å; F429-V431 PolarHBondContact O-N 3.28Å; V431-F435 WeakPolarHBondContact O-CB 3.25Å; V431-F435 PolarHBondContact O-N 3.49Å; V431-F451 HydrophobicContact CG1-CE1 4.26Å; V431-F451 HydrophobicContact CG1-CZ 4.25Å |
| 432 | T | 91.4 | Very high | 90.6 | Very high | 0 Ų | 0 | 40.6 Ų | 40.6 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -69.2 | -36.1 | -179.9 | -63.3 | 0 | 0 | 0 | 0 | 112.3 | F297 Y298 A428 F429 V430 | F297-T432 HydrophobicContact CD2-CG2 3.5Å; F297-T432 VanDerWaalsContact CD2-CG2 3.5Å; F297-T432 HydrophobicContact CE2-CG2 4.04Å; F297-T432 HydrophobicContact CG-CG2 4.43Å; Y298-T432 HydrophobicContact CE2-CG2 4.02Å; Y298-T432 PolarHBondContact OH-O 3.48Å; A428-T432 VanDerWaalsContact O-CB 3.24Å; A428-T432 WeakPolarHBondContact O-CB 3.4Å; A428-T432 PolarHBondContact O-N 3.42Å; A428-T432 PolarHBondContact O-OG1 2.91Å; F429-T432 PolarHBondContact O-N 3.19Å; V430-T432 PolarHBondContact O-N 3.28Å |
| 433 | K | 92.4 | Very high | 90.6 | Very high | 30 Ų | 30 | 40.9 Ų | 40.9 | 13% | 0.13 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -74 | -38.4 | -179.3 | 177.3 | 62.9 | -158.9 | 77.2 | 0 | 112.1 | S83 W84 F429 V430 D437 | S83-K433 WeakPolarHBondContact OG-CE 3.23Å; S83-K433 PolarHBondContact OG-NZ 2.97Å; W84-K433 HydrophobicContact CD2-CD 4.17Å; W84-K433 HydrophobicContact CG-CD 4.43Å; F429-K433 HydrophobicContact CE2-CB 4.14Å; F429-K433 HydrophobicContact CE2-CG 4.4Å; F429-K433 HydrophobicContact CZ-CB 4.21Å; F429-K433 HydrophobicContact CZ-CG 4.16Å; F429-K433 WeakPolarHBondContact O-CB 3.49Å; F429-K433 PolarHBondContact O-N 3.39Å; V430-K433 PolarHBondContact O-N 3.44Å; K433-D437 IonicContact NZ-OD2 3.72Å |
| 434 | T | 91.8 | Very high | 90.4 | Very high | 48 Ų | 48 | 40 Ų | 40 | 29% | 0.294 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -87.9 | -7.4 | -179.5 | 62.4 | 0 | 0 | 0 | 0 | 113 | V430 Q436 D437 M438 | V430-T434 WeakPolarHBondContact O-CB 3.37Å; V430-T434 WeakPolarHBondContact O-CG2 3.39Å; V430-T434 PolarHBondContact O-N 3.36Å; V430-T434 PolarHBondContact O-OG1 2.88Å; T434-Q436 PolarHBondContact O-N 3Å; T434-D437 WeakPolarHBondContact O-CB 3.46Å; T434-D437 PolarHBondContact O-N 3.49Å; T434-D437 VanDerWaalsContact O-N 3.11Å; T434-M438 WeakPolarHBondContact O-CG 3.3Å; T434-M438 PolarHBondContact O-N 3.21Å |
| 435 | F | 90.2 | Very high | 90.3 | Very high | 0 Ų | 0 | 40.1 Ų | 40.1 | 0% | 0 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -53 | -52.1 | -177.6 | 179.3 | -112 | 0 | 0 | 0 | 113.1 | A294 Y298 I302 V431 D437 M438 M439 T447 F448 F451 | A294-F435 HydrophobicContact CB-CB 3.83Å; A294-F435 HydrophobicContact CB-CD1 4.26Å; A294-F435 HydrophobicContact CB-CD2 3.63Å; A294-F435 HydrophobicContact CB-CE2 4.24Å; A294-F435 HydrophobicContact CB-CG 3.63Å; Y298-F435 HydrophobicContact CD2-CB 4.48Å; Y298-F435 AromaticContact CD2-CD1 3.34Å; Y298-F435 HydrophobicContact CD2-CD1 3.34Å; Y298-F435 AromaticContact CD2-CE1 3.84Å; Y298-F435 HydrophobicContact CD2-CE1 3.84Å; Y298-F435 HydrophobicContact CD2-CG 4.16Å; Y298-F435 HydrophobicContact CE2-CB 4.13Å; Y298-F435 AromaticContact CE2-CD1 3.73Å; Y298-F435 HydrophobicContact CE2-CD1 3.73Å; Y298-F435 HydrophobicContact CE2-CG 4.3Å; Y298-F435 AromaticContact CG-CD1 3.95Å; Y298-F435 HydrophobicContact CG-CD1 3.95Å; Y298-F435 HydrophobicContact CG-CE1 4.09Å; I302-F435 HydrophobicContact CD1-CE1 4.27Å; I302-F435 HydrophobicContact CD1-CZ 3.91Å; I302-F435 HydrophobicContact CG1-CE1 4.32Å; I302-F435 HydrophobicContact CG1-CZ 4.13Å; V431-F435 WeakPolarHBondContact O-CB 3.25Å; V431-F435 PolarHBondContact O-N 3.49Å; F435-D437 VanDerWaalsContact C-N 3.3Å; F435-D437 PolarHBondContact O-N 2.91Å; F435-M438 HydrophobicContact CB-CE 4.48Å; F435-M438 HydrophobicContact CD2-CE 4.47Å; F435-M438 WeakPolarHBondContact O-CB 3.15Å; F435-M438 PolarHBondContact O-N 3.39Å; F435-M439 HydrophobicContact CD1-CG 4.33Å; F435-M439 HydrophobicContact CD2-CG 4.31Å; F435-M439 HydrophobicContact CE1-CG 3.99Å; F435-M439 HydrophobicContact CE2-CG 3.95Å; F435-M439 HydrophobicContact CE2-SD 3.97Å; F435-M439 HydrophobicContact CG-CG 4.49Å; F435-M439 HydrophobicContact CZ-CE 4.46Å; F435-M439 HydrophobicContact CZ-CG 3.79Å; F435-M439 HydrophobicContact CZ-SD 3.83Å; F435-M439 VanDerWaalsContact O-CG 3.26Å; F435-M439 WeakPolarHBondContact O-CG 3.19Å; F435-M439 PolarHBondContact O-N 3.05Å; F435-T447 HydrophobicContact CD2-CG2 4.17Å; F435-T447 HydrophobicContact CE2-CG2 4Å; F435-F448 HydrophobicContact CZ-CZ 4.42Å; F435-F451 HydrophobicContact CD2-CE2 4.04Å; F435-F451 HydrophobicContact CD2-CZ 4Å; F435-F451 AromaticContact CE2-CE2 3.9Å; F435-F451 HydrophobicContact CE2-CE2 3.9Å; F435-F451 HydrophobicContact CE2-CZ 4.34Å |
| 436 | Q | 85.2 | Confident | 90.4 | Very high | 26 Ų | 26 | 40.7 Ų | 40.7 | 12% | 0.121 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -64.8 | -37 | 179.5 | -163 | 66.7 | 10.2 | 0 | 0 | 112 | T434 M438 M439 N440 | T434-Q436 PolarHBondContact O-N 3Å; Q436-M438 VanDerWaalsContact C-N 3.34Å; Q436-M438 PolarHBondContact O-N 3.34Å; Q436-M439 PolarHBondContact O-N 3.43Å; Q436-N440 WeakPolarHBondContact O-CB 3.49Å; Q436-N440 PolarHBondContact O-N 3.35Å; Q436-N440 PolarHBondContact O-ND2 3.28Å |
| 437 | D | 88.3 | Confident | 90.4 | Very high | 70 Ų | 70 | 39.2 Ų | 39.2 | 37% | 0.374 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -64 | -40.6 | 176.1 | -58.1 | -39.4 | 0 | 0 | 0 | 110.9 | K433 T434 F435 N440 L441 | K433-D437 IonicContact NZ-OD2 3.72Å; T434-D437 WeakPolarHBondContact O-CB 3.46Å; T434-D437 PolarHBondContact O-N 3.49Å; T434-D437 VanDerWaalsContact O-N 3.11Å; F435-D437 VanDerWaalsContact C-N 3.3Å; F435-D437 PolarHBondContact O-N 2.91Å; D437-N440 PolarHBondContact O-N 3.2Å; D437-L441 VanDerWaalsContact O-CB 3.31Å; D437-L441 WeakPolarHBondContact O-CB 3.18Å; D437-L441 VanDerWaalsContact O-CG 3.28Å; D437-L441 WeakPolarHBondContact O-CG 3.28Å; D437-L441 PolarHBondContact O-N 2.92Å |
| 438 | M | 89.3 | Confident | 90.3 | Very high | 30 Ų | 30 | 37 Ų | 37 | 15% | 0.148 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -64.6 | -45.5 | 173.9 | -68.7 | -174.3 | -65.5 | 0 | 0 | 111.3 | T434 F435 Q436 N440 L441 L442 T447 L450 F451 | T434-M438 WeakPolarHBondContact O-CG 3.3Å; T434-M438 PolarHBondContact O-N 3.21Å; F435-M438 HydrophobicContact CB-CE 4.48Å; F435-M438 HydrophobicContact CD2-CE 4.47Å; F435-M438 WeakPolarHBondContact O-CB 3.15Å; F435-M438 PolarHBondContact O-N 3.39Å; Q436-M438 VanDerWaalsContact C-N 3.34Å; Q436-M438 PolarHBondContact O-N 3.34Å; M438-N440 PolarHBondContact O-N 3.26Å; M438-L441 PolarHBondContact O-N 3.14Å; M438-L442 HydrophobicContact CB-CD1 4.45Å; M438-L442 WeakPolarHBondContact O-CA 3.27Å; M438-L442 WeakPolarHBondContact O-CB 3.49Å; M438-L442 PolarHBondContact O-N 3.44Å; M438-T447 HydrophobicContact CB-CG2 3.86Å; M438-T447 HydrophobicContact CE-CG2 4.37Å; M438-T447 PolarHBondContact O-OG1 3.44Å; M438-T447 VanDerWaalsContact O-OG1 3.08Å; M438-L450 HydrophobicContact SD-CD2 3.86Å; M438-F451 HydrophobicContact CE-CE1 4.02Å; M438-F451 HydrophobicContact CE-CZ 3.87Å |
| 439 | M | 86.2 | Confident | 90.4 | Very high | 6 Ų | 6 | 41.7 Ų | 41.7 | 3% | 0.03 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -59 | -35.3 | 177.2 | -68.7 | -69.8 | -71.3 | 0 | 0 | 111.9 | F435 Q436 T443 S444 T447 F448 | F435-M439 HydrophobicContact CD1-CG 4.33Å; F435-M439 HydrophobicContact CD2-CG 4.31Å; F435-M439 HydrophobicContact CE1-CG 3.99Å; F435-M439 HydrophobicContact CE2-CG 3.95Å; F435-M439 HydrophobicContact CE2-SD 3.97Å; F435-M439 HydrophobicContact CG-CG 4.49Å; F435-M439 HydrophobicContact CZ-CE 4.46Å; F435-M439 HydrophobicContact CZ-CG 3.79Å; F435-M439 HydrophobicContact CZ-SD 3.83Å; F435-M439 VanDerWaalsContact O-CG 3.26Å; F435-M439 WeakPolarHBondContact O-CG 3.19Å; F435-M439 PolarHBondContact O-N 3.05Å; Q436-M439 PolarHBondContact O-N 3.43Å; M439-T443 CarbonylContact O-C 3.5Å; M439-T443 WeakPolarHBondContact O-CA 3.39Å; M439-T443 PolarHBondContact O-N 3.24Å; M439-S444 VanDerWaalsContact CE-CB 3.49Å; M439-S444 WeakPolarHBondContact CE-OG 3.35Å; M439-T447 WeakPolarHBondContact CA-OG1 3.32Å; M439-T447 HydrophobicContact CG-CG2 4.34Å; M439-T447 PolarHBondContact N-OG1 3.24Å; M439-T447 HydrophobicContact SD-CG2 3.92Å; M439-F448 HydrophobicContact CE-CE2 4.44Å; M439-F448 HydrophobicContact SD-CE2 4.28Å |
| 440 | N | 85.8 | Confident | 90.4 | Very high | 84 Ų | 84 | 42.4 Ų | 42.4 | 45% | 0.449 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -79.3 | -39.9 | 178 | -72.9 | -20.3 | 0 | 0 | 0 | 113.1 | E79 Q436 D437 M438 | E79-N440 PolarHBondContact OE2-ND2 3.09Å; Q436-N440 WeakPolarHBondContact O-CB 3.49Å; Q436-N440 PolarHBondContact O-N 3.35Å; Q436-N440 PolarHBondContact O-ND2 3.28Å; D437-N440 PolarHBondContact O-N 3.2Å; M438-N440 PolarHBondContact O-N 3.26Å |
| 441 | L | 89.1 | Confident | 90.4 | Very high | 148 Ų | 148 | 39.2 Ų | 39.2 | 78% | 0.775 | 21% | 0.209 | S | C | * | . | H | α-helix | trans | -85.1 | -44.2 | -176.1 | -70 | 170.6 | 0 | 0 | 0 | 113.8 | D437 M438 | D437-L441 VanDerWaalsContact O-CB 3.31Å; D437-L441 WeakPolarHBondContact O-CB 3.18Å; D437-L441 VanDerWaalsContact O-CG 3.28Å; D437-L441 WeakPolarHBondContact O-CG 3.28Å; D437-L441 PolarHBondContact O-N 2.92Å; M438-L441 PolarHBondContact O-N 3.14Å |
| 442 | L | 86.6 | Confident | 90.5 | Very high | 86 Ų | 86 | 39 Ų | 39 | 45% | 0.45 | 21% | 0.208 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -95.8 | -5.5 | -176.8 | -64.6 | 172.2 | 0 | 0 | 0 | 112.8 | M438 G446 L450 | M438-L442 HydrophobicContact CB-CD1 4.45Å; M438-L442 WeakPolarHBondContact O-CA 3.27Å; M438-L442 WeakPolarHBondContact O-CB 3.49Å; M438-L442 PolarHBondContact O-N 3.44Å; L442-G446 WeakPolarHBondContact O-CA 3.41Å; L442-G446 PolarHBondContact O-N 2.99Å; L442-L450 HydrophobicContact CD1-CD2 4.02Å |
| 443 | T | 88.5 | Confident | 90.8 | Very high | 84 Ų | 84 | 42.9 Ų | 42.9 | 52% | 0.515 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | 68.4 | 165.5 | -165.4 | 77.2 | 0 | 0 | 0 | 0 | 113.3 | M439 A445 G446 T447 | M439-T443 CarbonylContact O-C 3.5Å; M439-T443 WeakPolarHBondContact O-CA 3.39Å; M439-T443 PolarHBondContact O-N 3.24Å; T443-A445 VanDerWaalsContact C-N 3.33Å; T443-A445 PolarHBondContact O-N 3.37Å; T443-G446 PolarHBondContact O-N 3.4Å; T443-G446 PolarHBondContact OG1-N 3.23Å; T443-T447 PolarHBondContact O-N 3.44Å; T443-T447 PolarHBondContact O-OG1 3.08Å |
| 444 | S | 87 | Confident | 90.9 | Very high | 13 Ų | 13 | 43.4 Ų | 43.4 | 9% | 0.091 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -56.9 | -45.8 | 176 | -48.4 | 0 | 0 | 0 | 0 | 111.8 | M439 T447 F448 | M439-S444 VanDerWaalsContact CE-CB 3.49Å; M439-S444 WeakPolarHBondContact CE-OG 3.35Å; S444-T447 PolarHBondContact O-N 3.36Å; S444-F448 WeakPolarHBondContact O-CD2 3.46Å; S444-F448 PolarHBondContact O-N 2.88Å |
| 445 | A | 89.8 | Confident | 91 | Very high | 5 Ų | 5 | 41.1 Ų | 41.1 | 4% | 0.041 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -61.8 | -48 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | G357 F360 T443 T447 F448 W449 | G357-A445 WeakPolarHBondContact O-CB 3.37Å; F360-A445 HydrophobicContact CB-CB 4.18Å; T443-A445 VanDerWaalsContact C-N 3.33Å; T443-A445 PolarHBondContact O-N 3.37Å; A445-T447 VanDerWaalsContact C-N 3.33Å; A445-T447 PolarHBondContact O-N 3.08Å; A445-F448 PolarHBondContact O-N 3.44Å; A445-W449 PolarHBondContact O-N 2.9Å |
| 446 | G | 92.2 | Very high | 91.3 | Very high | 18 Ų | 18 | 41.9 Ų | 41.9 | 19% | 0.186 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -64.3 | -35.2 | -179.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | L442 T443 W449 L450 | L442-G446 WeakPolarHBondContact O-CA 3.41Å; L442-G446 PolarHBondContact O-N 2.99Å; T443-G446 PolarHBondContact O-N 3.4Å; T443-G446 PolarHBondContact OG1-N 3.23Å; G446-W449 PolarHBondContact O-N 3.23Å; G446-L450 WeakPolarHBondContact O-CB 3.34Å; G446-L450 PolarHBondContact O-N 3.46Å |
| 447 | T | 92.9 | Very high | 91.8 | Very high | 0 Ų | 0 | 44.9 Ų | 44.9 | 0% | 0 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -65.8 | -45.3 | 177 | -56.6 | 0 | 0 | 0 | 0 | 111.8 | F435 M438 M439 T443 S444 A445 L450 F451 | F435-T447 HydrophobicContact CD2-CG2 4.17Å; F435-T447 HydrophobicContact CE2-CG2 4Å; M438-T447 HydrophobicContact CB-CG2 3.86Å; M438-T447 HydrophobicContact CE-CG2 4.37Å; M438-T447 PolarHBondContact O-OG1 3.44Å; M438-T447 VanDerWaalsContact O-OG1 3.08Å; M439-T447 WeakPolarHBondContact CA-OG1 3.32Å; M439-T447 HydrophobicContact CG-CG2 4.34Å; M439-T447 PolarHBondContact N-OG1 3.24Å; M439-T447 HydrophobicContact SD-CG2 3.92Å; T443-T447 PolarHBondContact O-N 3.44Å; T443-T447 PolarHBondContact O-OG1 3.08Å; S444-T447 PolarHBondContact O-N 3.36Å; A445-T447 VanDerWaalsContact C-N 3.33Å; A445-T447 PolarHBondContact O-N 3.08Å; T447-L450 WeakPolarHBondContact O-CB 3.49Å; T447-L450 PolarHBondContact O-N 3.41Å; T447-F451 HydrophobicContact CG2-CE2 4.03Å; T447-F451 HydrophobicContact CG2-CZ 4.18Å; T447-F451 PolarHBondContact O-N 2.93Å; T447-F451 VanDerWaalsContact O-N 3.09Å |
| 448 | F | 92.7 | Very high | 92 | Very high | 1 Ų | 1 | 41.6 Ų | 41.6 | 0% | 0.004 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -70.6 | -31.9 | 177.5 | -73.8 | -67.4 | 0 | 0 | 0 | 113 | I295 I302 F356 F360 F435 M439 S444 A445 F451 A452 | I295-F448 HydrophobicContact CD1-CE1 4.09Å; I295-F448 HydrophobicContact CG1-CE1 4.06Å; I302-F448 HydrophobicContact CD1-CZ 4.32Å; I302-F448 HydrophobicContact CG2-CZ 4.46Å; F356-F448 AromaticContact CD1-CD1 3.57Å; F356-F448 HydrophobicContact CD1-CD1 3.57Å; F356-F448 AromaticContact CD1-CD2 3.72Å; F356-F448 HydrophobicContact CD1-CD2 3.72Å; F356-F448 AromaticContact CD1-CE1 3.45Å; F356-F448 HydrophobicContact CD1-CE1 3.45Å; F356-F448 VanDerWaalsContact CD1-CE1 3.45Å; F356-F448 AromaticContact CD1-CE2 3.63Å; F356-F448 HydrophobicContact CD1-CE2 3.63Å; F356-F448 AromaticContact CD1-CG 3.72Å; F356-F448 HydrophobicContact CD1-CG 3.72Å; F356-F448 AromaticContact CD1-CZ 3.51Å; F356-F448 HydrophobicContact CD1-CZ 3.51Å; F356-F448 HydrophobicContact CE1-CD1 4.23Å; F356-F448 HydrophobicContact CE1-CD2 4.15Å; F356-F448 AromaticContact CE1-CE1 3.64Å; F356-F448 HydrophobicContact CE1-CE1 3.64Å; F356-F448 AromaticContact CE1-CE2 3.57Å; F356-F448 HydrophobicContact CE1-CE2 3.57Å; F356-F448 HydrophobicContact CE1-CG 4.48Å; F356-F448 AromaticContact CE1-CZ 3.29Å; F356-F448 HydrophobicContact CE1-CZ 3.29Å; F360-F448 AromaticContact CD2-CD2 3.76Å; F360-F448 HydrophobicContact CD2-CD2 3.76Å; F360-F448 AromaticContact CD2-CE2 3.86Å; F360-F448 HydrophobicContact CD2-CE2 3.86Å; F360-F448 AromaticContact CE2-CD2 3.9Å; F360-F448 HydrophobicContact CE2-CD2 3.9Å; F360-F448 AromaticContact CE2-CE2 3.5Å; F360-F448 HydrophobicContact CE2-CE2 3.5Å; F360-F448 HydrophobicContact CE2-CZ 4.44Å; F360-F448 HydrophobicContact CZ-CE2 4.46Å; F435-F448 HydrophobicContact CZ-CZ 4.42Å; M439-F448 HydrophobicContact CE-CE2 4.44Å; M439-F448 HydrophobicContact SD-CE2 4.28Å; S444-F448 WeakPolarHBondContact O-CD2 3.46Å; S444-F448 PolarHBondContact O-N 2.88Å; A445-F448 PolarHBondContact O-N 3.44Å; F448-F451 HydrophobicContact CD1-CD2 4.08Å; F448-F451 HydrophobicContact CE1-CD2 4.38Å; F448-F451 PolarHBondContact O-N 3.47Å; F448-A452 PolarHBondContact O-N 2.76Å |
| 449 | W | 95.4 | Very high | 92.3 | Very high | 98 Ų | 98 | 41.3 Ų | 41.3 | 37% | 0.371 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -67 | -36.5 | 170.4 | -69.1 | -20.3 | 0 | 0 | 0 | 112.7 | V358 Y361 A445 G446 F451 A452 C453 | V358-W449 HydrophobicContact CG2-CZ2 4.45Å; Y361-W449 AromaticContact CD2-CH2 3.93Å; Y361-W449 HydrophobicContact CD2-CH2 3.93Å; Y361-W449 HydrophobicContact CG-CH2 4.09Å; Y361-W449 HydrophobicContact CG-CZ2 4.43Å; A445-W449 PolarHBondContact O-N 2.9Å; G446-W449 PolarHBondContact O-N 3.23Å; W449-F451 VanDerWaalsContact C-N 3.34Å; W449-F451 PolarHBondContact O-N 3.03Å; W449-A452 WeakPolarHBondContact O-CB 3.28Å; W449-A452 PolarHBondContact O-N 3Å; W449-C453 PolarHBondContact O-N 3.34Å; W449-C453 PolarHBondContact O-SG 3.19Å; W449-C453 VanDerWaalsContact O-SG 3.35Å |
| 450 | L | 95.3 | Very high | 92.8 | Very high | 61 Ų | 61 | 45.7 Ų | 45.7 | 32% | 0.319 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -59.8 | -45.6 | 171.4 | 179.3 | 65 | 0 | 0 | 0 | 111 | M438 L442 G446 T447 A452 C453 M454 | M438-L450 HydrophobicContact SD-CD2 3.86Å; L442-L450 HydrophobicContact CD1-CD2 4.02Å; G446-L450 WeakPolarHBondContact O-CB 3.34Å; G446-L450 PolarHBondContact O-N 3.46Å; T447-L450 WeakPolarHBondContact O-CB 3.49Å; T447-L450 PolarHBondContact O-N 3.41Å; L450-A452 VanDerWaalsContact C-N 3.33Å; L450-A452 PolarHBondContact O-N 3.09Å; L450-C453 WeakPolarHBondContact O-CB 3.47Å; L450-C453 PolarHBondContact O-N 3.09Å; L450-M454 HydrophobicContact CD1-CE 4.04Å; L450-M454 WeakPolarHBondContact O-CG 3.44Å; L450-M454 PolarHBondContact O-N 3.01Å |
| 451 | F | 94.8 | Very high | 93.2 | Very high | 5 Ų | 5 | 42.4 Ų | 42.4 | 2% | 0.022 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -62.9 | -36.8 | 174.4 | -66.7 | -26.3 | 0 | 0 | 0 | 112.9 | M289 T353 V431 F435 M438 T447 F448 W449 M454 C455 | M289-F451 WeakPolarHBondContact O-CD1 3.4Å; T353-F451 HydrophobicContact CG2-CB 4.43Å; V431-F451 HydrophobicContact CG1-CE1 4.26Å; V431-F451 HydrophobicContact CG1-CZ 4.25Å; F435-F451 HydrophobicContact CD2-CE2 4.04Å; F435-F451 HydrophobicContact CD2-CZ 4Å; F435-F451 AromaticContact CE2-CE2 3.9Å; F435-F451 HydrophobicContact CE2-CE2 3.9Å; F435-F451 HydrophobicContact CE2-CZ 4.34Å; M438-F451 HydrophobicContact CE-CE1 4.02Å; M438-F451 HydrophobicContact CE-CZ 3.87Å; T447-F451 HydrophobicContact CG2-CE2 4.03Å; T447-F451 HydrophobicContact CG2-CZ 4.18Å; T447-F451 PolarHBondContact O-N 2.93Å; T447-F451 VanDerWaalsContact O-N 3.09Å; F448-F451 HydrophobicContact CD1-CD2 4.08Å; F448-F451 HydrophobicContact CE1-CD2 4.38Å; F448-F451 PolarHBondContact O-N 3.47Å; W449-F451 VanDerWaalsContact C-N 3.34Å; W449-F451 PolarHBondContact O-N 3.03Å; F451-M454 PolarHBondContact O-N 3.46Å; F451-C455 PolarHBondContact O-N 3.48Å; F451-C455 PolarHBondContact O-SG 3.39Å |
| 452 | A | 96 | Very high | 93.4 | Very high | 6 Ų | 6 | 35.4 Ų | 35.4 | 5% | 0.05 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -62.8 | -43.9 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | T353 T354 F448 W449 L450 M454 C455 G456 | T353-A452 WeakPolarHBondContact OG1-CA 3.34Å; T353-A452 WeakPolarHBondContact OG1-CB 3.32Å; T354-A452 WeakPolarHBondContact OG1-CB 3.34Å; F448-A452 PolarHBondContact O-N 2.76Å; W449-A452 WeakPolarHBondContact O-CB 3.28Å; W449-A452 PolarHBondContact O-N 3Å; L450-A452 VanDerWaalsContact C-N 3.33Å; L450-A452 PolarHBondContact O-N 3.09Å; A452-M454 VanDerWaalsContact C-N 3.32Å; A452-M454 PolarHBondContact O-N 3.3Å; A452-C455 WeakPolarHBondContact O-CB 3.35Å; A452-C455 PolarHBondContact O-N 3.39Å; A452-G456 PolarHBondContact O-N 3.14Å |
| 453 | C | 96.3 | Very high | 93.7 | Very high | 82 Ų | 82 | 34.8 Ų | 34.8 | 55% | 0.554 | 20% | 0.197 | S | C | * | . | H | α-helix | trans | -59.8 | -42.7 | 173.5 | -68.6 | 0 | 0 | 0 | 0 | 111.6 | W449 L450 C455 G456 L457 | W449-C453 PolarHBondContact O-N 3.34Å; W449-C453 PolarHBondContact O-SG 3.19Å; W449-C453 VanDerWaalsContact O-SG 3.35Å; L450-C453 WeakPolarHBondContact O-CB 3.47Å; L450-C453 PolarHBondContact O-N 3.09Å; C453-C455 VanDerWaalsContact C-N 3.35Å; C453-C455 PolarHBondContact O-N 2.85Å; C453-G456 PolarHBondContact O-N 2.88Å; C453-G456 VanDerWaalsContact O-N 3.16Å; C453-L457 PolarHBondContact O-N 3.27Å |
| 454 | M | 95.3 | Very high | 93.9 | Very high | 40 Ų | 40 | 35.9 Ų | 35.9 | 20% | 0.197 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -64.5 | -37.7 | 175.8 | -66.2 | -56.6 | 175.6 | 0 | 0 | 112.2 | M289 L450 F451 A452 G456 L457 N458 | M289-M454 HydrophobicContact CB-CB 4.31Å; M289-M454 HydrophobicContact CB-CG 4.35Å; M289-M454 HydrophobicContact CE-CE 3.45Å; M289-M454 VanDerWaalsContact CE-CE 3.45Å; M289-M454 HydrophobicContact CE-CG 4.19Å; M289-M454 HydrophobicContact CE-SD 3.35Å; M289-M454 WeakPolarHBondContact CE-SD 3.38Å; L450-M454 HydrophobicContact CD1-CE 4.04Å; L450-M454 WeakPolarHBondContact O-CG 3.44Å; L450-M454 PolarHBondContact O-N 3.01Å; F451-M454 PolarHBondContact O-N 3.46Å; A452-M454 VanDerWaalsContact C-N 3.32Å; A452-M454 PolarHBondContact O-N 3.3Å; M454-G456 VanDerWaalsContact C-N 3.33Å; M454-G456 PolarHBondContact O-N 3.28Å; M454-L457 PolarHBondContact O-N 3.01Å; M454-L457 HydrophobicContact SD-CD1 3.88Å; M454-N458 VanDerWaalsContact O-CB 3.31Å; M454-N458 WeakPolarHBondContact O-CB 3.4Å; M454-N458 PolarHBondContact O-N 2.93Å |
| 455 | C | 95 | Very high | 94 | Very high | 1 Ų | 1 | 40.9 Ų | 40.9 | 1% | 0.007 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -61.8 | -40.5 | 171.6 | -65.9 | 0 | 0 | 0 | 0 | 111.6 | M350 F451 A452 C453 N458 I459 | M350-C455 HydrophobicContact CB-CB 3.82Å; M350-C455 HydrophobicContact CG-CB 4.4Å; F451-C455 PolarHBondContact O-N 3.48Å; F451-C455 PolarHBondContact O-SG 3.39Å; A452-C455 WeakPolarHBondContact O-CB 3.35Å; A452-C455 PolarHBondContact O-N 3.39Å; C453-C455 VanDerWaalsContact C-N 3.35Å; C453-C455 PolarHBondContact O-N 2.85Å; C455-N458 WeakPolarHBondContact O-CB 3.39Å; C455-N458 PolarHBondContact O-N 2.53Å; C455-I459 WeakPolarHBondContact O-CG1 3.47Å; C455-I459 PolarHBondContact O-N 3.26Å |
| 456 | G | 95.9 | Very high | 94 | Very high | 16 Ų | 16 | 40.7 Ų | 40.7 | 17% | 0.165 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -60.6 | -48.4 | 174 | 0 | 0 | 0 | 0 | 0 | 113 | A452 C453 M454 N458 I459 I460 | A452-G456 PolarHBondContact O-N 3.14Å; C453-G456 PolarHBondContact O-N 2.88Å; C453-G456 VanDerWaalsContact O-N 3.16Å; M454-G456 VanDerWaalsContact C-N 3.33Å; M454-G456 PolarHBondContact O-N 3.28Å; G456-N458 PolarHBondContact O-N 3.42Å; G456-I459 PolarHBondContact O-N 2.94Å; G456-I460 WeakPolarHBondContact O-CG1 3.24Å; G456-I460 PolarHBondContact O-N 2.87Å; G456-I460 VanDerWaalsContact O-N 3.11Å |
| 457 | L | 95.5 | Very high | 93.7 | Very high | 89 Ų | 89 | 40.8 Ų | 40.8 | 47% | 0.466 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -59.1 | -37.6 | 174.4 | -70.3 | 176 | 0 | 0 | 0 | 111.8 | F286 C453 M454 I460 F461 | F286-L457 HydrophobicContact CE1-CB 4.34Å; C453-L457 PolarHBondContact O-N 3.27Å; M454-L457 PolarHBondContact O-N 3.01Å; M454-L457 HydrophobicContact SD-CD1 3.88Å; L457-I460 PolarHBondContact O-N 3.27Å; L457-F461 WeakPolarHBondContact O-CB 3.46Å; L457-F461 PolarHBondContact O-N 3.09Å |
| 458 | N | 93.4 | Very high | 93.5 | Very high | 1 Ų | 1 | 43.1 Ų | 43.1 | 1% | 0.005 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -66.2 | -39.3 | 178.4 | -164.9 | 8.7 | 0 | 0 | 0 | 112.9 | F286 W396 M454 C455 G456 F461 T462 | F286-N458 HydrophobicContact CB-CB 4.2Å; F286-N458 WeakPolarHBondContact CB-OD1 3.38Å; F286-N458 HydrophobicContact CD1-CB 4.4Å; F286-N458 HydrophobicContact CG-CB 4.39Å; W396-N458 VanDerWaalsContact CD2-ND2 3.27Å; W396-N458 VanDerWaalsContact CE3-ND2 3.28Å; W396-N458 WeakPolarHBondContact CH2-ND2 3.4Å; W396-N458 WeakPolarHBondContact CH2-OD1 3.34Å; W396-N458 HydrophobicContact CZ2-CB 4.33Å; W396-N458 WeakPolarHBondContact CZ2-ND2 3.34Å; W396-N458 WeakPolarHBondContact CZ2-OD1 3.44Å; W396-N458 WeakPolarHBondContact CZ3-ND2 3.49Å; W396-N458 WeakPolarHBondContact CZ3-OD1 3.46Å; M454-N458 VanDerWaalsContact O-CB 3.31Å; M454-N458 WeakPolarHBondContact O-CB 3.4Å; M454-N458 PolarHBondContact O-N 2.93Å; C455-N458 WeakPolarHBondContact O-CB 3.39Å; C455-N458 PolarHBondContact O-N 2.53Å; G456-N458 PolarHBondContact O-N 3.42Å; N458-F461 PolarHBondContact O-N 3.5Å; N458-T462 WeakPolarHBondContact O-CB 3.21Å; N458-T462 PolarHBondContact O-N 2.99Å; N458-T462 PolarHBondContact O-OG1 3.35Å |
| 459 | I | 95.3 | Very high | 92.9 | Very high | 24 Ų | 24 | 43.3 Ų | 43.3 | 12% | 0.123 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -60.8 | -48.2 | 172.9 | -64.3 | 159.8 | 0 | 0 | 0 | 110.1 | V343 V347 M350 C455 G456 F461 T462 V463 | V343-I459 HydrophobicContact CG1-CG2 4.27Å; V347-I459 HydrophobicContact CB-CD1 4.47Å; V347-I459 HydrophobicContact CG2-CD1 3.8Å; M350-I459 HydrophobicContact CB-CD1 4.42Å; M350-I459 HydrophobicContact CE-CD1 4.33Å; M350-I459 HydrophobicContact SD-CD1 4.08Å; C455-I459 WeakPolarHBondContact O-CG1 3.47Å; C455-I459 PolarHBondContact O-N 3.26Å; G456-I459 PolarHBondContact O-N 2.94Å; I459-F461 VanDerWaalsContact C-N 3.34Å; I459-F461 PolarHBondContact O-N 3.4Å; I459-T462 PolarHBondContact O-N 3.13Å; I459-V463 HydrophobicContact CG2-CG2 4.42Å; I459-V463 WeakPolarHBondContact O-CG2 3.49Å; I459-V463 PolarHBondContact O-N 3.02Å |
| 460 | I | 95.9 | Very high | 92.1 | Very high | 98 Ų | 98 | 42.8 Ų | 42.8 | 50% | 0.503 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -58.7 | -48.5 | 178.8 | -65.7 | 168.1 | 0 | 0 | 0 | 110.2 | G456 L457 T462 V463 I464 | G456-I460 WeakPolarHBondContact O-CG1 3.24Å; G456-I460 PolarHBondContact O-N 2.87Å; G456-I460 VanDerWaalsContact O-N 3.11Å; L457-I460 PolarHBondContact O-N 3.27Å; I460-T462 VanDerWaalsContact C-N 3.32Å; I460-T462 PolarHBondContact O-N 2.95Å; I460-V463 PolarHBondContact O-N 3.42Å; I460-I464 HydrophobicContact CG2-CD1 3.65Å; I460-I464 WeakPolarHBondContact O-CG1 3.3Å; I460-I464 PolarHBondContact O-N 3.39Å; I460-I464 VanDerWaalsContact O-N 3.08Å |
| 461 | F | 94.6 | Very high | 90.9 | Very high | 15 Ų | 15 | 43.9 Ų | 43.9 | 7% | 0.066 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -57.5 | -45.4 | 177.2 | 170.8 | -101.1 | 0 | 0 | 0 | 111.9 | I279 L282 L283 F286 L457 N458 I459 V463 I464 F465 V466 | I279-F461 HydrophobicContact CG2-CZ 4.46Å; L282-F461 HydrophobicContact CB-CE1 4.21Å; L282-F461 HydrophobicContact CB-CE2 3.87Å; L282-F461 HydrophobicContact CB-CZ 3.54Å; L282-F461 HydrophobicContact CD1-CE2 3.67Å; L282-F461 HydrophobicContact CD1-CZ 4.13Å; L282-F461 HydrophobicContact CG-CE2 4.43Å; L283-F461 HydrophobicContact CD2-CE1 3.91Å; L283-F461 HydrophobicContact CG-CE1 3.95Å; F286-F461 HydrophobicContact CD2-CB 4.21Å; F286-F461 AromaticContact CD2-CD1 3.62Å; F286-F461 HydrophobicContact CD2-CD1 3.62Å; F286-F461 HydrophobicContact CD2-CD2 4.36Å; F286-F461 HydrophobicContact CD2-CE1 4.07Å; F286-F461 AromaticContact CD2-CG 3.79Å; F286-F461 HydrophobicContact CD2-CG 3.79Å; F286-F461 HydrophobicContact CE2-CB 3.78Å; F286-F461 AromaticContact CE2-CD1 3.81Å; F286-F461 HydrophobicContact CE2-CD1 3.81Å; F286-F461 AromaticContact CE2-CD2 3.72Å; F286-F461 HydrophobicContact CE2-CD2 3.72Å; F286-F461 HydrophobicContact CE2-CE1 4.36Å; F286-F461 HydrophobicContact CE2-CE2 4.28Å; F286-F461 AromaticContact CE2-CG 3.46Å; F286-F461 HydrophobicContact CE2-CG 3.46Å; F286-F461 VanDerWaalsContact CE2-CG 3.46Å; F286-F461 HydrophobicContact CZ-CB 4.3Å; F286-F461 HydrophobicContact CZ-CG 4.4Å; L457-F461 WeakPolarHBondContact O-CB 3.46Å; L457-F461 PolarHBondContact O-N 3.09Å; N458-F461 PolarHBondContact O-N 3.5Å; I459-F461 VanDerWaalsContact C-N 3.34Å; I459-F461 PolarHBondContact O-N 3.4Å; F461-V463 PolarHBondContact O-N 3.02Å; F461-I464 PolarHBondContact O-N 2.85Å; F461-F465 HydrophobicContact CD2-CB 4.08Å; F461-F465 AromaticContact CD2-CD2 3.51Å; F461-F465 HydrophobicContact CD2-CD2 3.51Å; F461-F465 HydrophobicContact CD2-CE2 4.32Å; F461-F465 HydrophobicContact CD2-CG 4.11Å; F461-F465 HydrophobicContact CE2-CB 3.78Å; F461-F465 AromaticContact CE2-CD2 3.93Å; F461-F465 HydrophobicContact CE2-CD2 3.93Å; F461-F465 HydrophobicContact CE2-CG 4.06Å; F461-F465 HydrophobicContact CG-CD2 4.38Å; F461-F465 HydrophobicContact CZ-CB 4.3Å; F461-F465 PolarHBondContact O-N 3.48Å; F461-V466 HydrophobicContact CD1-CG2 4.31Å; F461-V466 HydrophobicContact CE1-CG2 3.86Å; F461-V466 HydrophobicContact CZ-CG2 4.44Å |
| 462 | T | 93.3 | Very high | 90 | Very high | 0 Ų | 0 | 47.6 Ų | 47.6 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -63 | -44.4 | 179.7 | -61.3 | 0 | 0 | 0 | 0 | 112.1 | K339 L342 V343 W396 N458 I459 I460 I464 V466 | K339-T462 VanDerWaalsContact CE-O 3.32Å; K339-T462 WeakPolarHBondContact CE-O 3.42Å; K339-T462 HydrophobicContact CG-CG2 4.32Å; L342-T462 HydrophobicContact CB-CG2 3.61Å; L342-T462 HydrophobicContact CD1-CG2 4.01Å; L342-T462 HydrophobicContact CG-CG2 4.48Å; V343-T462 HydrophobicContact CG2-CG2 3.88Å; W396-T462 WeakPolarHBondContact CH2-OG1 3.41Å; W396-T462 WeakPolarHBondContact CZ2-OG1 3.21Å; N458-T462 WeakPolarHBondContact O-CB 3.21Å; N458-T462 PolarHBondContact O-N 2.99Å; N458-T462 PolarHBondContact O-OG1 3.35Å; I459-T462 PolarHBondContact O-N 3.13Å; I460-T462 VanDerWaalsContact C-N 3.32Å; I460-T462 PolarHBondContact O-N 2.95Å; T462-I464 VanDerWaalsContact C-N 3.33Å; T462-I464 PolarHBondContact O-N 2.95Å; T462-V466 HydrophobicContact CG2-CB 4.3Å; T462-V466 HydrophobicContact CG2-CG2 4.41Å; T462-V466 WeakPolarHBondContact O-CB 3.48Å; T462-V466 PolarHBondContact O-N 2.69Å |
| 463 | V | 93.6 | Very high | 88.9 | Confident | 74 Ų | 74 | 50.4 Ų | 50.4 | 45% | 0.448 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -64.8 | -40 | -179.6 | 172.4 | 0 | 0 | 0 | 0 | 111.1 | K339 V343 I459 I460 F461 | K339-V463 WeakPolarHBondContact CE-O 3.33Å; K339-V463 PolarHBondContact NZ-O 3.11Å; V343-V463 HydrophobicContact CG2-CG2 3.75Å; I459-V463 HydrophobicContact CG2-CG2 4.42Å; I459-V463 WeakPolarHBondContact O-CG2 3.49Å; I459-V463 PolarHBondContact O-N 3.02Å; I460-V463 PolarHBondContact O-N 3.42Å; F461-V463 PolarHBondContact O-N 3.02Å |
| 464 | I | 91.9 | Very high | 87.4 | Confident | 107 Ų | 107 | 48.2 Ų | 48.2 | 55% | 0.549 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -84.4 | -47.9 | -173.6 | -62.2 | 173.1 | 0 | 0 | 0 | 112.3 | I460 F461 T462 | I460-I464 HydrophobicContact CG2-CD1 3.65Å; I460-I464 WeakPolarHBondContact O-CG1 3.3Å; I460-I464 PolarHBondContact O-N 3.39Å; I460-I464 VanDerWaalsContact O-N 3.08Å; F461-I464 PolarHBondContact O-N 2.85Å; T462-I464 VanDerWaalsContact C-N 3.33Å; T462-I464 PolarHBondContact O-N 2.95Å |
| 465 | F | 89.6 | Confident | 86.2 | Confident | 118 Ų | 118 | 52.3 Ų | 52.3 | 52% | 0.518 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -106.4 | -24.3 | -164.5 | -62.5 | -77.3 | 0 | 0 | 0 | 114.5 | I279 F461 P467 | I279-F465 WeakPolarHBondContact CD1-O 3.45Å; F461-F465 HydrophobicContact CD2-CB 4.08Å; F461-F465 AromaticContact CD2-CD2 3.51Å; F461-F465 HydrophobicContact CD2-CD2 3.51Å; F461-F465 HydrophobicContact CD2-CE2 4.32Å; F461-F465 HydrophobicContact CD2-CG 4.11Å; F461-F465 HydrophobicContact CE2-CB 3.78Å; F461-F465 AromaticContact CE2-CD2 3.93Å; F461-F465 HydrophobicContact CE2-CD2 3.93Å; F461-F465 HydrophobicContact CE2-CG 4.06Å; F461-F465 HydrophobicContact CG-CD2 4.38Å; F461-F465 HydrophobicContact CZ-CB 4.3Å; F461-F465 PolarHBondContact O-N 3.48Å; F465-P467 WeakPolarHBondContact O-CD 3.33Å |
| 466 | V | 89.3 | Confident | 85.2 | Confident | 1 Ų | 1 | 56.9 Ų | 56.9 | 1% | 0.006 | 31% | 0.308 | C | S | . | . | P | Polyproline II helix | trans | -85.6 | 120.8 | -176.5 | -178.2 | 0 | 0 | 0 | 0 | 109.6 | I279 L283 K339 L342 I403 F461 T462 | I279-V466 HydrophobicContact CG2-CG2 4.24Å; L283-V466 HydrophobicContact CD1-CG2 4.37Å; L283-V466 HydrophobicContact CD2-CG2 3.93Å; L283-V466 HydrophobicContact CG-CG2 4.28Å; K339-V466 WeakPolarHBondContact CD-O 3.26Å; K339-V466 WeakPolarHBondContact CE-O 3.48Å; K339-V466 PolarHBondContact NZ-O 2.95Å; L342-V466 HydrophobicContact CD1-CG1 4.32Å; I403-V466 HydrophobicContact CD1-CG1 3.79Å; F461-V466 HydrophobicContact CD1-CG2 4.31Å; F461-V466 HydrophobicContact CE1-CG2 3.86Å; F461-V466 HydrophobicContact CZ-CG2 4.44Å; T462-V466 HydrophobicContact CG2-CB 4.3Å; T462-V466 HydrophobicContact CG2-CG2 4.41Å; T462-V466 WeakPolarHBondContact O-CB 3.48Å; T462-V466 PolarHBondContact O-N 2.69Å |
| 467 | P | 86.6 | Confident | 84.2 | Confident | 20 Ų | 20 | 56.4 Ų | 56.4 | 13% | 0.13 | 30% | 0.302 | C | S | . | . | P | Polyproline II helix | trans | -78.5 | 156.5 | 174.6 | 33.4 | -35.6 | 0 | 0 | 0 | 111.3 | F465 T469 F481 | F465-P467 WeakPolarHBondContact O-CD 3.33Å; P467-T469 PolarHBondContact O-N 3.15Å; P467-F481 HydrophobicContact CG-CE1 4.3Å; P467-F481 HydrophobicContact CG-CE2 4.25Å; P467-F481 HydrophobicContact CG-CZ 3.6Å |
| 468 | E | 87.1 | Confident | 83 | Confident | 49 Ų | 49 | 53.8 Ų | 53.8 | 23% | 0.229 | 29% | 0.287 | C | S | . | . | P | Polyproline II helix | trans | -76.5 | 122.8 | 166.6 | -175.7 | 57.7 | -109.7 | 0 | 0 | 109.4 | R338 K339 K470 K472 | R338-E468 PolarHBondContact N-OE1 3.35Å; R338-E468 PolarHBondContact N-OE2 3.46Å; K339-E468 WeakPolarHBondContact CB-OE2 3.26Å; K339-E468 PolarHBondContact N-OE2 3.32Å; K339-E468 VanDerWaalsContact N-OE2 3.09Å; E468-K470 HydrophobicContact CG-CB 4.25Å; E468-K470 WeakPolarHBondContact OE1-CB 3.45Å; E468-K470 PolarHBondContact OE1-N 2.89Å; E468-K470 VanDerWaalsContact OE1-N 3.08Å; E468-K472 WeakPolarHBondContact O-CD 3.46Å; E468-K472 WeakPolarHBondContact O-CE 3.37Å; E468-K472 PolarHBondContact O-NZ 3.21Å |
| 469 | T | 81.3 | Confident | 82 | Confident | 4 Ų | 4 | 55 Ų | 55 | 3% | 0.025 | 30% | 0.297 | C | S | . | . | trans | -100.1 | -14.7 | -178.3 | 57.6 | 0 | 0 | 0 | 0 | 112.9 | E406 V407 P467 G471 K472 I477 | E406-T469 WeakPolarHBondContact OE2-CB 3.31Å; E406-T469 PolarHBondContact OE2-OG1 3.38Å; V407-T469 HydrophobicContact CG2-CG2 3.65Å; P467-T469 PolarHBondContact O-N 3.15Å; T469-G471 PolarHBondContact O-N 2.85Å; T469-K472 PolarHBondContact O-N 3.46Å; T469-I477 HydrophobicContact CG2-CD1 4.12Å | ||
| 470 | K | 78.8 | Confident | 81.2 | Confident | 88 Ų | 88 | 56.7 Ų | 56.7 | 38% | 0.383 | 31% | 0.306 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.7 | 123.7 | -178.6 | 179.8 | -177.3 | 173.4 | -165.1 | 0 | 111.6 | D334 R335 E468 K472 | D334-K470 VanDerWaalsContact O-CE 3.24Å; D334-K470 WeakPolarHBondContact O-CE 3.45Å; R335-K470 PolarHBondContact O-NZ 2.83Å; E468-K470 HydrophobicContact CG-CB 4.25Å; E468-K470 WeakPolarHBondContact OE1-CB 3.45Å; E468-K470 PolarHBondContact OE1-N 2.89Å; E468-K470 VanDerWaalsContact OE1-N 3.08Å; K470-K472 VanDerWaalsContact C-N 3.27Å; K470-K472 PolarHBondContact O-N 3.34Å |
| 471 | G | 68.4 | Low | 80.3 | Confident | 83 Ų | 83 | 52.7 Ų | 52.7 | 86% | 0.856 | 29% | 0.285 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 72.8 | 13.9 | 172.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | T469 | T469-G471 PolarHBondContact O-N 2.85Š|
| 472 | K | 76.5 | Confident | 79.4 | Confident | 83 Ų | 83 | 57.4 Ų | 57.4 | 36% | 0.361 | 30% | 0.302 | S | S | . | . | trans | -105 | 144.8 | 178 | -62.5 | -174.9 | -178.1 | 169.5 | 0 | 111.3 | E468 T469 K470 Q476 I477 I480 | E468-K472 WeakPolarHBondContact O-CD 3.46Å; E468-K472 WeakPolarHBondContact O-CE 3.37Å; E468-K472 PolarHBondContact O-NZ 3.21Å; T469-K472 PolarHBondContact O-N 3.46Å; K470-K472 VanDerWaalsContact C-N 3.27Å; K470-K472 PolarHBondContact O-N 3.34Å; K472-Q476 VanDerWaalsContact CA-OE1 3.31Å; K472-Q476 HydrophobicContact CB-CB 4.39Å; K472-I477 HydrophobicContact CB-CD1 4.24Å; K472-I477 HydrophobicContact CB-CG1 3.91Å; K472-I480 HydrophobicContact CD-CD1 3.82Å | ||
| 473 | T | 73.7 | Confident | 78.1 | Confident | 66 Ų | 66 | 60.2 Ų | 60.2 | 41% | 0.405 | 33% | 0.331 | S | S | . | . | trans | -76.5 | 163.6 | 171.9 | 79.6 | 0 | 0 | 0 | 0 | 111.1 | E475 Q476 I477 | T473-E475 WeakPolarHBondContact CB-OE2 3.17Å; T473-E475 PolarHBondContact O-N 3.49Å; T473-E475 PolarHBondContact OG1-OE2 3.38Å; T473-Q476 PolarHBondContact O-N 2.82Å; T473-Q476 WeakPolarHBondContact OG1-CG 3.34Å; T473-Q476 PolarHBondContact OG1-N 3.34Å; T473-I477 WeakPolarHBondContact O-CG1 3.43Å; T473-I477 PolarHBondContact O-N 3.41Å | ||
| 474 | L | 65.3 | Low | 76.3 | Confident | 35 Ų | 35 | 61.7 Ų | 61.7 | 18% | 0.183 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -59.8 | -39.4 | 179 | -165.8 | 80.8 | 0 | 0 | 0 | 110.8 | E406 I410 I477 E478 | E406-L474 VanDerWaalsContact O-CD1 3.28Å; E406-L474 WeakPolarHBondContact O-CD1 3.33Å; I410-L474 HydrophobicContact CD1-CD2 4.26Å; I410-L474 HydrophobicContact CG1-CD2 4.03Å; L474-I477 PolarHBondContact O-N 2.67Å; L474-E478 WeakPolarHBondContact O-CG 3.48Å; L474-E478 PolarHBondContact O-N 2.91Å |
| 475 | E | 69.3 | Low | 74 | Confident | 126 Ų | 126 | 59.8 Ų | 59.8 | 59% | 0.589 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -68.3 | -39.6 | -179 | -54.2 | 70.9 | -148.8 | 0 | 0 | 111.2 | T473 I477 E478 A479 | T473-E475 WeakPolarHBondContact CB-OE2 3.17Å; T473-E475 PolarHBondContact O-N 3.49Å; T473-E475 PolarHBondContact OG1-OE2 3.38Å; E475-I477 VanDerWaalsContact C-N 3.32Å; E475-E478 PolarHBondContact O-N 3.17Å; E475-A479 WeakPolarHBondContact O-CB 3.17Å; E475-A479 PolarHBondContact O-N 2.97Å |
| 476 | Q | 73.4 | Confident | 71.5 | Confident | 98 Ų | 98 | 57 Ų | 57 | 46% | 0.458 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -64.1 | -39.5 | 173.9 | -71.5 | 173.5 | -19.7 | 0 | 0 | 111.3 | K472 T473 A479 I480 | K472-Q476 VanDerWaalsContact CA-OE1 3.31Å; K472-Q476 HydrophobicContact CB-CB 4.39Å; T473-Q476 PolarHBondContact O-N 2.82Å; T473-Q476 WeakPolarHBondContact OG1-CG 3.34Å; T473-Q476 PolarHBondContact OG1-N 3.34Å; Q476-A479 PolarHBondContact O-N 3.22Å; Q476-I480 VanDerWaalsContact O-CG1 3.3Å; Q476-I480 WeakPolarHBondContact O-CG1 3.19Å; Q476-I480 PolarHBondContact O-N 3.26Å |
| 477 | I | 75.3 | Confident | 68.8 | Low | 6 Ų | 6 | 67.1 Ų | 67.1 | 3% | 0.031 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -66.6 | -45.1 | 175.8 | -66.7 | 169.3 | 0 | 0 | 0 | 110.5 | E406 V407 T469 K472 T473 L474 E475 A479 I480 F481 | E406-I477 WeakPolarHBondContact O-CD1 3.47Å; V407-I477 HydrophobicContact CB-CG2 4.42Å; V407-I477 HydrophobicContact CG1-CG2 4.39Å; V407-I477 HydrophobicContact CG2-CG2 4.11Å; T469-I477 HydrophobicContact CG2-CD1 4.12Å; K472-I477 HydrophobicContact CB-CD1 4.24Å; K472-I477 HydrophobicContact CB-CG1 3.91Å; T473-I477 WeakPolarHBondContact O-CG1 3.43Å; T473-I477 PolarHBondContact O-N 3.41Å; L474-I477 PolarHBondContact O-N 2.67Å; E475-I477 VanDerWaalsContact C-N 3.32Å; I477-A479 VanDerWaalsContact C-N 3.29Å; I477-A479 PolarHBondContact O-N 2.92Å; I477-I480 WeakPolarHBondContact O-CB 3.45Å; I477-I480 PolarHBondContact O-N 2.94Å; I477-F481 HydrophobicContact CG2-CD2 3.87Å; I477-F481 HydrophobicContact CG2-CE2 3.49Å; I477-F481 VanDerWaalsContact CG2-CE2 3.49Å; I477-F481 WeakPolarHBondContact O-CD2 3.26Å; I477-F481 PolarHBondContact O-N 3.31Å |
| 478 | E | 71.1 | Confident | 67.9 | Low | 34 Ų | 34 | 69.5 Ų | 69.5 | 16% | 0.159 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -58.8 | -40.4 | 174.4 | -75.9 | -173 | -168.7 | 0 | 0 | 112 | P409 L474 E475 I480 F481 R482 | P409-E478 WeakPolarHBondContact CB-OE1 3.45Å; P409-E478 HydrophobicContact CG-CG 4.23Å; P409-E478 WeakPolarHBondContact CG-OE1 3.33Å; L474-E478 WeakPolarHBondContact O-CG 3.48Å; L474-E478 PolarHBondContact O-N 2.91Å; E475-E478 PolarHBondContact O-N 3.17Å; E478-I480 PolarHBondContact O-N 3.34Å; E478-F481 PolarHBondContact O-N 2.67Å; E478-F481 VanDerWaalsContact O-N 3.17Å; E478-R482 WeakPolarHBondContact O-CB 3.16Å; E478-R482 WeakPolarHBondContact O-CG 3.44Å; E478-R482 PolarHBondContact O-N 2.84Å |
| 479 | A | 71.4 | Confident | 66.9 | Low | 27 Ų | 27 | 70.5 Ų | 70.5 | 22% | 0.223 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -63.5 | -38.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | E475 Q476 I477 F481 R482 G483 T484 | E475-A479 WeakPolarHBondContact O-CB 3.17Å; E475-A479 PolarHBondContact O-N 2.97Å; Q476-A479 PolarHBondContact O-N 3.22Å; I477-A479 VanDerWaalsContact C-N 3.29Å; I477-A479 PolarHBondContact O-N 2.92Å; A479-F481 VanDerWaalsContact C-N 3.28Å; A479-F481 PolarHBondContact O-N 2.71Å; A479-R482 PolarHBondContact O-N 3.2Å; A479-G483 PolarHBondContact O-N 3.49Å; A479-T484 PolarHBondContact O-N 3.3Å; A479-T484 VanDerWaalsContact O-N 3.15Å; A479-T484 PolarHBondContact O-OG1 3.34Å |
| 480 | I | 78.9 | Confident | 66.1 | Low | 59 Ų | 59 | 74.2 Ų | 74.2 | 30% | 0.303 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -58.7 | -42.7 | 172.9 | -69.4 | 164.4 | 0 | 0 | 0 | 110.3 | K472 Q476 I477 E478 G483 | K472-I480 HydrophobicContact CD-CD1 3.82Å; Q476-I480 VanDerWaalsContact O-CG1 3.3Å; Q476-I480 WeakPolarHBondContact O-CG1 3.19Å; Q476-I480 PolarHBondContact O-N 3.26Å; I477-I480 WeakPolarHBondContact O-CB 3.45Å; I477-I480 PolarHBondContact O-N 2.94Å; E478-I480 PolarHBondContact O-N 3.34Å; I480-G483 PolarHBondContact O-N 2.8Å |
| 481 | F | 77.9 | Confident | 65.4 | Low | 14 Ų | 14 | 73.4 Ų | 73.4 | 6% | 0.061 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -75.6 | -33 | -179.3 | -71.7 | -63.1 | 0 | 0 | 0 | 114 | K275 P276 I279 V407 P467 I477 E478 A479 G483 | K275-F481 HydrophobicContact CB-CD1 3.81Å; K275-F481 HydrophobicContact CB-CE1 4.43Å; K275-F481 HydrophobicContact CB-CG 4.42Å; K275-F481 HydrophobicContact CD-CD1 4.34Å; K275-F481 WeakPolarHBondContact CD-O 3.43Å; K275-F481 PolarHBondContact NZ-O 2.86Å; P276-F481 HydrophobicContact CG-CB 4.34Å; P276-F481 HydrophobicContact CG-CD1 4.4Å; P276-F481 HydrophobicContact CG-CD2 3.51Å; P276-F481 HydrophobicContact CG-CE2 3.8Å; P276-F481 HydrophobicContact CG-CG 3.82Å; P276-F481 HydrophobicContact CG-CZ 4.34Å; I279-F481 HydrophobicContact CD1-CD1 4.42Å; I279-F481 HydrophobicContact CD1-CE1 3.37Å; I279-F481 HydrophobicContact CD1-CZ 3.83Å; V407-F481 HydrophobicContact CB-CE2 4.49Å; V407-F481 HydrophobicContact CG1-CD2 4.35Å; V407-F481 HydrophobicContact CG1-CE2 3.36Å; V407-F481 HydrophobicContact CG1-CZ 3.67Å; P467-F481 HydrophobicContact CG-CE1 4.3Å; P467-F481 HydrophobicContact CG-CE2 4.25Å; P467-F481 HydrophobicContact CG-CZ 3.6Å; I477-F481 HydrophobicContact CG2-CD2 3.87Å; I477-F481 HydrophobicContact CG2-CE2 3.49Å; I477-F481 VanDerWaalsContact CG2-CE2 3.49Å; I477-F481 WeakPolarHBondContact O-CD2 3.26Å; I477-F481 PolarHBondContact O-N 3.31Å; E478-F481 PolarHBondContact O-N 2.67Å; E478-F481 VanDerWaalsContact O-N 3.17Å; A479-F481 VanDerWaalsContact C-N 3.28Å; A479-F481 PolarHBondContact O-N 2.71Å; F481-G483 VanDerWaalsContact C-N 3.26Å |
| 482 | R | 74.7 | Confident | 65.2 | Low | 114 Ų | 114 | 72.8 Ų | 72.8 | 43% | 0.43 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -74.6 | -15.5 | 173.7 | -73.9 | -178.8 | 169.7 | 165.6 | 1.3 | 113.1 | D270 E478 A479 T484 | D270-R482 IonicContact OD1-NE 3.9Å; D270-R482 IonicContact OD1-NH2 2.91Å; D270-R482 IonicContact OD2-CZ 2.77Å; D270-R482 IonicContact OD2-NE 2.84Å; D270-R482 IonicContact OD2-NH2 3.07Å; D270-R482 PolarHBondContact OD2-NH2 3.35Å; E478-R482 WeakPolarHBondContact O-CB 3.16Å; E478-R482 WeakPolarHBondContact O-CG 3.44Å; E478-R482 PolarHBondContact O-N 2.84Å; A479-R482 PolarHBondContact O-N 3.2Å; R482-T484 VanDerWaalsContact C-N 3.29Å |
| 483 | G | 66.1 | Low | 64.4 | Low | 58 Ų | 58 | 72.1 Ų | 72.1 | 60% | 0.598 | 44% | 0.437 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 75.1 | 19.5 | -179.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | A479 I480 F481 | A479-G483 PolarHBondContact O-N 3.49Å; I480-G483 PolarHBondContact O-N 2.8Å; F481-G483 VanDerWaalsContact C-N 3.26Å |
| 484 | T | 56.1 | Low | 63.8 | Low | 106 Ų | 106 | 72.6 Ų | 72.6 | 65% | 0.65 | 44% | 0.439 | S | S | * | . | trans | -93.8 | -5.5 | -179.9 | 39.8 | 0 | 0 | 0 | 0 | 113.4 | A479 R482 G486 | A479-T484 PolarHBondContact O-N 3.3Å; A479-T484 VanDerWaalsContact O-N 3.15Å; A479-T484 PolarHBondContact O-OG1 3.34Å; R482-T484 VanDerWaalsContact C-N 3.29Å; T484-G486 PolarHBondContact O-N 2.97Å | ||
| 485 | S | 44.1 | Very low | 63.7 | Low | 66 Ų | 66 | 75.5 Ų | 75.5 | 46% | 0.462 | 46% | 0.459 | S | S | . | . | trans | -75 | 105.6 | 166.7 | 42.7 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 486 | G | 35.4 | Very low | 63.2 | Low | 61 Ų | 61 | 71.3 Ų | 71.3 | 63% | 0.629 | 45% | 0.448 | S | S | * | . | trans | -60 | 165.3 | 163 | 0 | 0 | 0 | 0 | 0 | 111.7 | T484 | T484-G486 PolarHBondContact O-N 2.97Š| ||
| 487 | P | 34 | Very low | 62.3 | Low | 212 Ų | 212 | 68.8 Ų | 68.8 | 100% | 1.377 | 45% | 0.447 | S | S | * | . | trans | -54.5 | 0 | -172.3 | 23.1 | -33.9 | 0 | 0 | 0 | 114.7 |
Retrieved 487 of 487 residues in 707 ms
(Link to these results)